NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
521184 | 2ld6 | 17651 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 1HT MET 1 10.276 -31.364 2.237 2 H2 MET 1 2HT MET 1 11.175 -30.045 1.652 3 H3 MET 1 3HT MET 1 10.986 -31.440 0.699 4 HA MET 1 HA MET 1 8.854 -30.926 0.084 5 HB2 MET 1 2HB MET 1 8.901 -30.046 2.893 6 HB3 MET 1 1HB MET 1 7.836 -29.081 1.868 7 HG2 MET 1 2HG MET 1 6.471 -30.891 1.348 8 HG3 MET 1 1HG MET 1 7.749 -32.071 1.640 9 HE1 MET 1 2HE MET 1 5.700 -33.122 2.361 10 HE2 MET 1 3HE MET 1 4.917 -32.974 3.933 11 HE3 MET 1 1HE MET 1 6.489 -33.773 3.796 12 H MET 2 H MET 2 8.312 -29.255 -1.354 13 HA MET 2 HA MET 2 10.181 -26.928 -1.396 14 HB2 MET 2 2HB MET 2 9.742 -28.653 -3.307 15 HB3 MET 2 1HB MET 2 8.245 -27.752 -3.556 16 HG2 MET 2 2HG MET 2 10.315 -25.832 -3.276 17 HG3 MET 2 1HG MET 2 10.910 -27.063 -4.392 18 HE1 MET 2 3HE MET 2 8.250 -27.950 -6.358 19 HE2 MET 2 1HE MET 2 10.007 -27.912 -6.161 20 HE3 MET 2 2HE MET 2 9.237 -26.949 -7.419 21 H GLU 3 H GLU 3 8.251 -26.619 0.554 22 HA GLU 3 HA GLU 3 6.095 -24.950 -0.672 23 HB2 GLU 3 2HB GLU 3 5.130 -25.170 1.639 24 HB3 GLU 3 1HB GLU 3 5.365 -26.724 0.830 25 HG2 GLU 3 2HG GLU 3 7.338 -27.185 2.085 26 HG3 GLU 3 1HG GLU 3 7.462 -25.512 2.641 27 H GLU 4 H GLU 4 9.105 -24.645 0.744 28 HA GLU 4 HA GLU 4 8.648 -22.419 2.479 29 HB2 GLU 4 2HB GLU 4 10.630 -23.834 2.613 30 HB3 GLU 4 1HB GLU 4 11.092 -23.387 0.969 31 HG2 GLU 4 2HG GLU 4 11.438 -21.077 1.639 32 HG3 GLU 4 1HG GLU 4 10.823 -21.415 3.257 33 H TYR 5 H TYR 5 8.397 -22.650 -0.842 34 HA TYR 5 HA TYR 5 9.495 -20.117 -1.675 35 HB2 TYR 5 2HB TYR 5 8.605 -22.354 -2.901 36 HB3 TYR 5 1HB TYR 5 7.184 -21.330 -3.093 37 HD1 TYR 5 2HD TYR 5 7.294 -19.236 -4.377 38 HD2 TYR 5 1HD TYR 5 10.710 -21.810 -3.988 39 HE1 TYR 5 2HE TYR 5 8.411 -18.033 -6.235 40 HE2 TYR 5 1HE TYR 5 11.828 -20.608 -5.848 41 HH TYR 5 HH TYR 5 10.300 -18.719 -7.994 42 H LEU 6 H LEU 6 6.412 -21.194 -0.505 43 HA LEU 6 HA LEU 6 5.155 -18.540 -0.858 44 HB2 LEU 6 2HB LEU 6 3.153 -19.720 -0.173 45 HB3 LEU 6 1HB LEU 6 4.033 -20.774 -1.280 46 HG LEU 6 HG LEU 6 5.119 -21.398 1.202 47 HD11 LEU 6 1HD1 LEU 6 2.985 -21.943 2.504 48 HD12 LEU 6 2HD1 LEU 6 2.156 -20.830 1.418 49 HD13 LEU 6 3HD1 LEU 6 3.449 -20.243 2.461 50 HD21 LEU 6 3HD2 LEU 6 3.330 -23.375 0.889 51 HD22 LEU 6 1HD2 LEU 6 4.734 -23.216 -0.167 52 HD23 LEU 6 2HD2 LEU 6 3.162 -22.617 -0.695 53 H GLY 7 H GLY 7 6.690 -20.482 1.607 54 HA2 GLY 7 2HA GLY 7 5.608 -19.106 3.900 55 HA3 GLY 7 1HA GLY 7 7.084 -20.073 3.889 56 H VAL 8 H VAL 8 8.369 -18.550 1.764 57 HA VAL 8 HA VAL 8 9.361 -16.316 3.395 58 HB VAL 8 HB VAL 8 10.114 -17.540 0.734 59 HG11 VAL 8 1HG1 VAL 8 12.234 -16.127 1.081 60 HG12 VAL 8 2HG1 VAL 8 11.282 -15.189 2.232 61 HG13 VAL 8 3HG1 VAL 8 10.790 -15.270 0.540 62 HG21 VAL 8 3HG2 VAL 8 11.588 -17.498 3.385 63 HG22 VAL 8 1HG2 VAL 8 12.006 -18.434 1.950 64 HG23 VAL 8 2HG2 VAL 8 10.550 -18.825 2.865 65 H PHE 9 H PHE 9 7.482 -16.845 0.532 66 HA PHE 9 HA PHE 9 7.488 -14.269 -0.647 67 HB2 PHE 9 2HB PHE 9 5.955 -16.733 -0.699 68 HB3 PHE 9 1HB PHE 9 4.885 -15.341 -0.857 69 HD1 PHE 9 1HD PHE 9 6.495 -13.375 -2.273 70 HD2 PHE 9 2HD PHE 9 6.262 -17.625 -2.844 71 HE1 PHE 9 1HE PHE 9 7.202 -13.097 -4.634 72 HE2 PHE 9 2HE PHE 9 6.969 -17.348 -5.205 73 HZ PHE 9 HZ PHE 9 7.438 -15.083 -6.100 74 H VAL 10 H VAL 10 5.592 -15.564 2.065 75 HA VAL 10 HA VAL 10 4.024 -13.105 2.380 76 HB VAL 10 HB VAL 10 4.384 -15.515 4.189 77 HG11 VAL 10 1HG1 VAL 10 2.820 -13.077 4.344 78 HG12 VAL 10 2HG1 VAL 10 3.014 -14.351 5.548 79 HG13 VAL 10 3HG1 VAL 10 1.769 -14.492 4.307 80 HG21 VAL 10 3HG2 VAL 10 1.953 -15.717 2.832 81 HG22 VAL 10 1HG2 VAL 10 3.405 -16.665 2.505 82 HG23 VAL 10 2HG2 VAL 10 3.090 -15.190 1.591 83 H ASP 11 H ASP 11 6.679 -14.728 4.171 84 HA ASP 11 HA ASP 11 6.912 -12.945 6.327 85 HB2 ASP 11 2HB ASP 11 8.145 -15.098 5.940 86 HB3 ASP 11 1HB ASP 11 9.149 -14.256 4.760 87 H GLU 12 H GLU 12 7.636 -12.486 3.015 88 HA GLU 12 HA GLU 12 9.296 -10.082 3.444 89 HB2 GLU 12 2HB GLU 12 8.274 -11.693 1.108 90 HB3 GLU 12 1HB GLU 12 9.001 -10.107 0.844 91 HG2 GLU 12 2HG GLU 12 10.915 -11.041 2.386 92 HG3 GLU 12 1HG GLU 12 10.266 -12.612 1.910 93 H THR 13 H THR 13 6.020 -10.939 2.373 94 HA THR 13 HA THR 13 5.217 -8.280 1.615 95 HB THR 13 HB THR 13 4.238 -10.733 1.247 96 HG1 THR 13 1HG THR 13 2.639 -9.696 0.319 97 HG21 THR 13 3HG2 THR 13 2.301 -9.784 3.334 98 HG22 THR 13 1HG2 THR 13 3.710 -10.721 3.827 99 HG23 THR 13 2HG2 THR 13 2.547 -11.411 2.697 100 H LYS 14 H LYS 14 5.216 -10.026 4.697 101 HA LYS 14 HA LYS 14 3.593 -8.064 6.113 102 HB2 LYS 14 2HB LYS 14 5.258 -10.482 6.714 103 HB3 LYS 14 1HB LYS 14 4.825 -9.420 8.055 104 HG2 LYS 14 2HG LYS 14 2.737 -10.252 8.092 105 HG3 LYS 14 1HG LYS 14 2.516 -9.856 6.385 106 HD2 LYS 14 2HD LYS 14 2.508 -12.076 5.983 107 HD3 LYS 14 1HD LYS 14 4.232 -12.058 6.362 108 HE2 LYS 14 2HE LYS 14 2.333 -12.159 8.673 109 HE3 LYS 14 1HE LYS 14 2.545 -13.638 7.715 110 HZ1 LYS 14 3HZ LYS 14 4.744 -13.773 8.216 111 HZ2 LYS 14 1HZ LYS 14 4.226 -12.991 9.630 112 HZ3 LYS 14 2HZ LYS 14 4.936 -12.092 8.375 113 H GLU 15 H GLU 15 7.096 -8.784 5.944 114 HA GLU 15 HA GLU 15 7.903 -6.696 7.723 115 HB2 GLU 15 2HB GLU 15 9.238 -8.208 5.471 116 HB3 GLU 15 1HB GLU 15 10.116 -7.063 6.486 117 HG2 GLU 15 2HG GLU 15 9.200 -8.402 8.487 118 HG3 GLU 15 1HG GLU 15 8.787 -9.647 7.306 119 H TYR 16 H TYR 16 6.799 -6.688 4.507 120 HA TYR 16 HA TYR 16 7.970 -4.069 3.839 121 HB2 TYR 16 2HB TYR 16 6.876 -6.371 2.476 122 HB3 TYR 16 1HB TYR 16 6.093 -4.900 1.901 123 HD1 TYR 16 2HD TYR 16 9.563 -5.379 3.197 124 HD2 TYR 16 1HD TYR 16 7.091 -4.461 -0.195 125 HE1 TYR 16 2HE TYR 16 11.585 -4.817 1.875 126 HE2 TYR 16 1HE TYR 16 9.113 -3.899 -1.517 127 HH TYR 16 HH TYR 16 11.663 -3.050 -0.701 128 H LEU 17 H LEU 17 4.796 -5.489 4.613 129 HA LEU 17 HA LEU 17 3.182 -3.204 4.043 130 HB2 LEU 17 2HB LEU 17 3.018 -5.462 6.061 131 HB3 LEU 17 1HB LEU 17 1.713 -4.294 5.840 132 HG LEU 17 HG LEU 17 2.882 -5.721 3.479 133 HD11 LEU 17 1HD1 LEU 17 1.134 -6.834 5.614 134 HD12 LEU 17 2HD1 LEU 17 2.257 -7.663 4.537 135 HD13 LEU 17 3HD1 LEU 17 0.664 -7.186 3.950 136 HD21 LEU 17 3HD2 LEU 17 0.752 -5.197 2.483 137 HD22 LEU 17 1HD2 LEU 17 1.312 -3.736 3.298 138 HD23 LEU 17 2HD2 LEU 17 0.072 -4.744 4.046 139 H GLN 18 H GLN 18 5.021 -4.155 6.899 140 HA GLN 18 HA GLN 18 4.233 -1.908 8.530 141 HB2 GLN 18 2HB GLN 18 5.247 -3.308 9.974 142 HB3 GLN 18 1HB GLN 18 5.824 -4.274 8.622 143 HG2 GLN 18 2HG GLN 18 7.868 -3.118 8.507 144 HG3 GLN 18 1HG GLN 18 7.249 -1.744 9.423 145 HE21 GLN 18 1HE2 GLN 18 9.114 -2.055 10.938 146 HE22 GLN 18 2HE2 GLN 18 9.046 -3.279 12.112 147 H ASN 19 H ASN 19 7.020 -2.679 6.570 148 HA ASN 19 HA ASN 19 8.371 -0.172 6.792 149 HB2 ASN 19 2HB ASN 19 8.574 -2.668 5.399 150 HB3 ASN 19 1HB ASN 19 8.677 -1.380 4.195 151 HD21 ASN 19 1HD2 ASN 19 11.024 -2.637 4.389 152 HD22 ASN 19 2HD2 ASN 19 12.144 -1.799 5.349 153 H LEU 20 H LEU 20 5.620 -1.305 5.102 154 HA LEU 20 HA LEU 20 5.448 1.062 3.343 155 HB2 LEU 20 2HB LEU 20 4.841 -0.984 2.301 156 HB3 LEU 20 1HB LEU 20 3.930 -1.519 3.714 157 HG LEU 20 HG LEU 20 2.316 0.357 3.315 158 HD11 LEU 20 1HD1 LEU 20 2.407 1.367 0.992 159 HD12 LEU 20 2HD1 LEU 20 4.031 0.693 0.840 160 HD13 LEU 20 3HD1 LEU 20 3.688 1.900 2.079 161 HD21 LEU 20 3HD2 LEU 20 1.162 -0.746 1.491 162 HD22 LEU 20 1HD2 LEU 20 1.985 -1.987 2.436 163 HD23 LEU 20 2HD2 LEU 20 2.669 -1.449 0.903 164 H ASN 21 H ASN 21 4.504 0.096 6.452 165 HA ASN 21 HA ASN 21 2.166 1.899 6.535 166 HB2 ASN 21 2HB ASN 21 3.233 -0.382 8.027 167 HB3 ASN 21 1HB ASN 21 2.774 0.952 9.089 168 HD21 ASN 21 1HD2 ASN 21 0.944 -0.471 9.831 169 HD22 ASN 21 2HD2 ASN 21 -0.454 -0.587 8.876 170 H ASP 22 H ASP 22 5.470 1.511 7.362 171 HA ASP 22 HA ASP 22 5.658 3.756 9.102 172 HB2 ASP 22 2HB ASP 22 7.361 1.713 7.953 173 HB3 ASP 22 1HB ASP 22 8.171 3.279 7.976 174 H THR 23 H THR 23 5.875 3.144 5.774 175 HA THR 23 HA THR 23 6.864 5.772 4.955 176 HB THR 23 HB THR 23 5.439 3.476 3.616 177 HG1 THR 23 1HG THR 23 7.679 3.354 4.644 178 HG21 THR 23 3HG2 THR 23 5.405 5.777 2.453 179 HG22 THR 23 1HG2 THR 23 6.009 4.413 1.511 180 HG23 THR 23 2HG2 THR 23 7.141 5.554 2.236 181 H LEU 24 H LEU 24 3.768 4.061 5.168 182 HA LEU 24 HA LEU 24 2.231 6.298 4.052 183 HB2 LEU 24 2HB LEU 24 1.672 3.570 5.221 184 HB3 LEU 24 1HB LEU 24 0.350 4.682 4.866 185 HG LEU 24 HG LEU 24 2.457 3.916 2.832 186 HD11 LEU 24 1HD1 LEU 24 0.177 2.414 3.836 187 HD12 LEU 24 2HD1 LEU 24 1.431 1.910 2.702 188 HD13 LEU 24 3HD1 LEU 24 0.004 2.765 2.117 189 HD21 LEU 24 3HD2 LEU 24 1.471 5.554 1.639 190 HD22 LEU 24 1HD2 LEU 24 0.314 5.841 2.940 191 HD23 LEU 24 2HD2 LEU 24 -0.039 4.643 1.694 192 H LEU 25 H LEU 25 3.171 5.059 7.220 193 HA LEU 25 HA LEU 25 1.214 6.853 8.524 194 HB2 LEU 25 2HB LEU 25 1.817 5.777 10.505 195 HB3 LEU 25 1HB LEU 25 2.024 4.529 9.284 196 HG LEU 25 HG LEU 25 4.421 5.435 9.108 197 HD11 LEU 25 1HD1 LEU 25 3.357 7.069 11.202 198 HD12 LEU 25 2HD1 LEU 25 4.987 7.088 10.531 199 HD13 LEU 25 3HD1 LEU 25 4.607 6.036 11.893 200 HD21 LEU 25 3HD2 LEU 25 5.066 3.967 11.097 201 HD22 LEU 25 1HD2 LEU 25 3.982 3.213 9.926 202 HD23 LEU 25 2HD2 LEU 25 3.342 3.839 11.446 203 H GLU 26 H GLU 26 4.340 6.977 7.352 204 HA GLU 26 HA GLU 26 5.066 9.367 8.946 205 HB2 GLU 26 2HB GLU 26 6.481 7.641 6.890 206 HB3 GLU 26 1HB GLU 26 7.181 9.136 7.513 207 HG2 GLU 26 2HG GLU 26 7.125 8.263 9.791 208 HG3 GLU 26 1HG GLU 26 6.318 6.796 9.235 209 H LEU 27 H LEU 27 3.858 8.216 5.982 210 HA LEU 27 HA LEU 27 4.248 10.498 4.367 211 HB2 LEU 27 2HB LEU 27 3.707 8.435 3.313 212 HB3 LEU 27 1HB LEU 27 2.343 8.164 4.396 213 HG LEU 27 HG LEU 27 1.296 10.262 3.365 214 HD11 LEU 27 1HD1 LEU 27 2.140 10.996 1.230 215 HD12 LEU 27 2HD1 LEU 27 3.336 9.700 1.198 216 HD13 LEU 27 3HD1 LEU 27 3.494 11.017 2.362 217 HD21 LEU 27 3HD2 LEU 27 0.399 8.126 2.769 218 HD22 LEU 27 1HD2 LEU 27 1.803 7.738 1.776 219 HD23 LEU 27 2HD2 LEU 27 0.666 8.977 1.247 220 H GLU 28 H GLU 28 1.872 9.579 6.769 221 HA GLU 28 HA GLU 28 -0.097 11.592 6.161 222 HB2 GLU 28 2HB GLU 28 -1.085 10.744 8.080 223 HB3 GLU 28 1HB GLU 28 0.017 9.430 7.688 224 HG2 GLU 28 2HG GLU 28 1.676 10.325 9.244 225 HG3 GLU 28 1HG GLU 28 0.605 11.671 9.627 226 H LYS 29 H LYS 29 2.756 11.487 8.269 227 HA LYS 29 HA LYS 29 2.407 14.249 9.175 228 HB2 LYS 29 2HB LYS 29 4.863 12.473 9.293 229 HB3 LYS 29 1HB LYS 29 4.496 13.844 10.340 230 HG2 LYS 29 2HG LYS 29 3.051 12.640 11.633 231 HG3 LYS 29 1HG LYS 29 2.462 11.695 10.267 232 HD2 LYS 29 2HD LYS 29 4.818 10.626 10.263 233 HD3 LYS 29 1HD LYS 29 4.955 11.278 11.896 234 HE2 LYS 29 2HE LYS 29 2.459 9.769 11.215 235 HE3 LYS 29 1HE LYS 29 3.946 8.842 11.494 236 HZ1 LYS 29 3HZ LYS 29 4.124 9.568 13.629 237 HZ2 LYS 29 1HZ LYS 29 2.435 9.633 13.491 238 HZ3 LYS 29 2HZ LYS 29 3.354 11.050 13.317 239 H ASN 30 H ASN 30 3.595 12.581 6.505 240 HA ASN 30 HA ASN 30 4.614 15.098 5.312 241 HB2 ASN 30 2HB ASN 30 6.230 12.522 5.357 242 HB3 ASN 30 1HB ASN 30 6.750 14.076 4.701 243 HD21 ASN 30 1HD2 ASN 30 6.578 15.948 6.469 244 HD22 ASN 30 2HD2 ASN 30 7.162 15.539 8.009 245 HA PRO 31 HA PRO 31 2.177 12.518 2.549 246 HB2 PRO 31 2HB PRO 31 0.123 14.263 2.284 247 HB3 PRO 31 1HB PRO 31 0.270 13.136 3.640 248 HG2 PRO 31 2HG PRO 31 0.650 16.038 3.585 249 HG3 PRO 31 1HG PRO 31 0.215 14.972 4.927 250 HD2 PRO 31 2HD PRO 31 2.771 16.055 4.320 251 HD3 PRO 31 1HD PRO 31 2.345 14.916 5.619 252 H GLU 32 H GLU 32 4.110 15.106 2.239 253 HA GLU 32 HA GLU 32 3.475 15.389 -0.664 254 HB2 GLU 32 2HB GLU 32 4.474 17.877 0.313 255 HB3 GLU 32 1HB GLU 32 2.874 17.543 -0.337 256 HG2 GLU 32 2HG GLU 32 1.981 17.060 1.817 257 HG3 GLU 32 1HG GLU 32 3.588 16.936 2.537 258 H ASP 33 H ASP 33 5.674 14.485 1.584 259 HA ASP 33 HA ASP 33 8.106 15.696 0.775 260 HB2 ASP 33 2HB ASP 33 9.044 13.492 1.710 261 HB3 ASP 33 1HB ASP 33 8.028 14.439 2.797 262 H MET 34 H MET 34 6.095 13.422 -0.737 263 HA MET 34 HA MET 34 6.193 12.371 -2.833 264 HB2 MET 34 2HB MET 34 8.116 14.602 -2.895 265 HB3 MET 34 1HB MET 34 8.510 13.310 -4.029 266 HG2 MET 34 2HG MET 34 5.691 14.338 -3.836 267 HG3 MET 34 1HG MET 34 6.887 15.211 -4.794 268 HE1 MET 34 3HE MET 34 5.714 14.702 -7.340 269 HE2 MET 34 1HE MET 34 4.563 14.575 -6.002 270 HE3 MET 34 2HE MET 34 4.585 13.352 -7.270 271 H GLU 35 H GLU 35 8.234 11.868 -0.336 272 HA GLU 35 HA GLU 35 9.847 9.817 -1.761 273 HB2 GLU 35 2HB GLU 35 11.255 9.897 0.232 274 HB3 GLU 35 1HB GLU 35 10.935 11.557 -0.266 275 HG2 GLU 35 2HG GLU 35 9.061 11.648 1.374 276 HG3 GLU 35 1HG GLU 35 9.502 10.030 1.923 277 H LEU 36 H LEU 36 7.662 10.394 0.964 278 HA LEU 36 HA LEU 36 7.370 7.554 1.603 279 HB2 LEU 36 2HB LEU 36 5.652 9.982 2.251 280 HB3 LEU 36 1HB LEU 36 5.540 8.411 3.044 281 HG LEU 36 HG LEU 36 7.777 10.419 3.178 282 HD11 LEU 36 1HD1 LEU 36 7.488 9.860 5.643 283 HD12 LEU 36 2HD1 LEU 36 6.047 8.957 5.175 284 HD13 LEU 36 3HD1 LEU 36 6.131 10.694 4.887 285 HD21 LEU 36 3HD2 LEU 36 8.998 8.429 2.775 286 HD22 LEU 36 1HD2 LEU 36 7.859 7.447 3.695 287 HD23 LEU 36 2HD2 LEU 36 8.948 8.552 4.534 288 H ILE 37 H ILE 37 5.978 9.857 -0.621 289 HA ILE 37 HA ILE 37 3.576 8.301 -1.214 290 HB ILE 37 HB ILE 37 5.072 10.583 -2.542 291 HG12 ILE 37 2HG1 ILE 37 2.457 10.420 -1.005 292 HG13 ILE 37 1HG1 ILE 37 3.967 11.105 -0.404 293 HG21 ILE 37 1HG2 ILE 37 3.350 8.843 -3.847 294 HG22 ILE 37 2HG2 ILE 37 3.693 10.500 -4.341 295 HG23 ILE 37 3HG2 ILE 37 2.282 10.151 -3.343 296 HD11 ILE 37 3HD1 ILE 37 3.038 12.186 -2.999 297 HD12 ILE 37 1HD1 ILE 37 3.726 13.027 -1.610 298 HD13 ILE 37 2HD1 ILE 37 2.021 12.577 -1.613 299 H ASN 38 H ASN 38 6.887 8.554 -2.456 300 HA ASN 38 HA ASN 38 6.286 6.682 -4.662 301 HB2 ASN 38 2HB ASN 38 8.097 8.786 -4.176 302 HB3 ASN 38 1HB ASN 38 9.082 7.325 -4.236 303 HD21 ASN 38 1HD2 ASN 38 9.975 7.543 -6.346 304 HD22 ASN 38 2HD2 ASN 38 9.031 7.606 -7.756 305 H GLU 39 H GLU 39 7.667 6.733 -1.506 306 HA GLU 39 HA GLU 39 9.067 4.198 -1.673 307 HB2 GLU 39 2HB GLU 39 8.187 6.134 0.437 308 HB3 GLU 39 1HB GLU 39 8.673 4.517 0.948 309 HG2 GLU 39 2HG GLU 39 10.710 5.051 -0.717 310 HG3 GLU 39 1HG GLU 39 10.310 6.701 -0.237 311 H ALA 40 H ALA 40 5.889 5.290 -0.992 312 HA ALA 40 HA ALA 40 4.918 2.634 -0.117 313 HB1 ALA 40 1HB ALA 40 3.664 5.370 -0.486 314 HB2 ALA 40 2HB ALA 40 4.108 4.603 1.039 315 HB3 ALA 40 3HB ALA 40 2.771 3.961 0.086 316 H PHE 41 H PHE 41 4.201 5.013 -2.737 317 HA PHE 41 HA PHE 41 2.412 3.498 -4.269 318 HB2 PHE 41 2HB PHE 41 2.929 5.749 -4.871 319 HB3 PHE 41 1HB PHE 41 4.657 5.407 -4.960 320 HD1 PHE 41 1HD PHE 41 5.558 3.982 -6.810 321 HD2 PHE 41 2HD PHE 41 1.474 5.310 -6.727 322 HE1 PHE 41 1HE PHE 41 5.331 3.436 -9.219 323 HE2 PHE 41 2HE PHE 41 1.248 4.763 -9.136 324 HZ PHE 41 HZ PHE 41 3.176 3.826 -10.381 325 H ARG 42 H ARG 42 5.890 3.109 -3.884 326 HA ARG 42 HA ARG 42 6.190 1.196 -6.083 327 HB2 ARG 42 2HB ARG 42 7.868 2.223 -3.789 328 HB3 ARG 42 1HB ARG 42 8.449 0.926 -4.833 329 HG2 ARG 42 2HG ARG 42 8.126 2.380 -6.809 330 HG3 ARG 42 1HG ARG 42 7.577 3.681 -5.752 331 HD2 ARG 42 2HD ARG 42 9.750 3.757 -4.635 332 HD3 ARG 42 1HD ARG 42 10.313 2.366 -5.583 333 HE ARG 42 HE ARG 42 9.450 4.913 -6.901 334 HH11 ARG 42 1HH1 ARG 42 10.543 1.985 -7.816 335 HH12 ARG 42 2HH1 ARG 42 12.024 2.514 -8.543 336 HH21 ARG 42 1HH2 ARG 42 11.825 5.722 -7.244 337 HH22 ARG 42 2HH2 ARG 42 12.750 4.629 -8.219 338 H ALA 43 H ALA 43 6.838 0.809 -2.586 339 HA ALA 43 HA ALA 43 6.839 -1.953 -2.372 340 HB1 ALA 43 1HB ALA 43 7.138 -1.140 -0.279 341 HB2 ALA 43 2HB ALA 43 5.381 -1.030 -0.158 342 HB3 ALA 43 3HB ALA 43 6.318 0.366 -0.692 343 H LEU 44 H LEU 44 3.930 0.137 -2.338 344 HA LEU 44 HA LEU 44 2.038 -1.991 -2.024 345 HB2 LEU 44 2HB LEU 44 2.001 0.815 -3.142 346 HB3 LEU 44 1HB LEU 44 0.542 -0.179 -3.136 347 HG LEU 44 HG LEU 44 2.120 0.009 -0.606 348 HD11 LEU 44 1HD1 LEU 44 0.548 2.043 -0.108 349 HD12 LEU 44 2HD1 LEU 44 0.521 2.225 -1.863 350 HD13 LEU 44 3HD1 LEU 44 2.050 2.317 -0.990 351 HD21 LEU 44 3HD2 LEU 44 -0.676 -0.527 -1.506 352 HD22 LEU 44 1HD2 LEU 44 -0.461 0.198 0.088 353 HD23 LEU 44 2HD2 LEU 44 0.286 -1.355 -0.284 354 H HIS 45 H HIS 45 3.576 -0.518 -4.849 355 HA HIS 45 HA HIS 45 2.030 -1.946 -6.840 356 HB2 HIS 45 2HB HIS 45 3.460 0.184 -7.026 357 HB3 HIS 45 1HB HIS 45 4.861 -0.886 -7.046 358 HD1 HIS 45 1HD HIS 45 2.183 0.450 -9.188 359 HD2 HIS 45 2HD HIS 45 4.848 -2.753 -9.323 360 HE1 HIS 45 1HE HIS 45 2.164 -0.396 -11.574 361 H THR 46 H THR 46 4.962 -2.549 -4.997 362 HA THR 46 HA THR 46 5.655 -5.008 -6.441 363 HB THR 46 HB THR 46 6.706 -3.217 -4.344 364 HG1 THR 46 1HG THR 46 8.270 -4.982 -5.812 365 HG21 THR 46 3HG2 THR 46 7.269 -6.193 -4.172 366 HG22 THR 46 1HG2 THR 46 6.471 -5.211 -2.943 367 HG23 THR 46 2HG2 THR 46 8.172 -4.941 -3.319 368 H LEU 47 H LEU 47 4.037 -4.052 -3.442 369 HA LEU 47 HA LEU 47 3.736 -6.702 -2.337 370 HB2 LEU 47 2HB LEU 47 2.925 -3.925 -1.847 371 HB3 LEU 47 1HB LEU 47 1.680 -5.084 -1.379 372 HG LEU 47 HG LEU 47 4.570 -5.429 -0.575 373 HD11 LEU 47 1HD1 LEU 47 4.019 -3.337 0.405 374 HD12 LEU 47 2HD1 LEU 47 3.705 -4.518 1.676 375 HD13 LEU 47 3HD1 LEU 47 2.366 -3.844 0.750 376 HD21 LEU 47 3HD2 LEU 47 3.086 -7.397 -0.428 377 HD22 LEU 47 1HD2 LEU 47 1.942 -6.466 0.537 378 HD23 LEU 47 2HD2 LEU 47 3.541 -6.839 1.182 379 H LYS 48 H LYS 48 1.796 -4.650 -4.489 380 HA LYS 48 HA LYS 48 -0.576 -6.262 -4.542 381 HB2 LYS 48 2HB LYS 48 -0.709 -4.049 -5.348 382 HB3 LYS 48 1HB LYS 48 0.773 -4.208 -6.287 383 HG2 LYS 48 2HG LYS 48 -0.459 -5.889 -7.742 384 HG3 LYS 48 1HG LYS 48 -1.936 -5.408 -6.903 385 HD2 LYS 48 2HD LYS 48 -2.004 -3.897 -8.643 386 HD3 LYS 48 1HD LYS 48 -1.024 -2.973 -7.501 387 HE2 LYS 48 2HE LYS 48 0.160 -2.891 -9.589 388 HE3 LYS 48 1HE LYS 48 1.019 -4.090 -8.603 389 HZ1 LYS 48 3HZ LYS 48 0.498 -4.950 -10.827 390 HZ2 LYS 48 1HZ LYS 48 -1.154 -4.708 -10.534 391 HZ3 LYS 48 2HZ LYS 48 -0.286 -5.838 -9.609 392 H GLY 49 H GLY 49 2.312 -6.150 -6.642 393 HA2 GLY 49 2HA GLY 49 1.499 -8.190 -8.458 394 HA3 GLY 49 1HA GLY 49 3.174 -7.732 -8.143 395 H MET 50 H MET 50 3.463 -8.382 -5.473 396 HA MET 50 HA MET 50 3.917 -11.198 -5.537 397 HB2 MET 50 2HB MET 50 3.692 -9.134 -3.331 398 HB3 MET 50 1HB MET 50 4.198 -10.796 -3.027 399 HG2 MET 50 2HG MET 50 5.925 -10.385 -4.925 400 HG3 MET 50 1HG MET 50 5.589 -8.675 -4.654 401 HE1 MET 50 3HE MET 50 5.057 -8.013 -2.166 402 HE2 MET 50 1HE MET 50 6.148 -8.377 -0.820 403 HE3 MET 50 2HE MET 50 4.848 -9.492 -1.232 404 H ALA 51 H ALA 51 1.055 -9.362 -4.870 405 HA ALA 51 HA ALA 51 -0.271 -11.551 -3.382 406 HB1 ALA 51 1HB ALA 51 -0.867 -9.412 -2.613 407 HB2 ALA 51 2HB ALA 51 -2.197 -9.781 -3.709 408 HB3 ALA 51 3HB ALA 51 -0.884 -8.730 -4.241 409 H GLY 52 H GLY 52 0.229 -10.580 -6.616 410 HA2 GLY 52 2HA GLY 52 -2.244 -11.847 -7.621 411 HA3 GLY 52 1HA GLY 52 -1.024 -11.031 -8.606 412 H THR 53 H THR 53 1.208 -12.404 -7.349 413 HA THR 53 HA THR 53 1.222 -14.827 -8.970 414 HB THR 53 HB THR 53 3.082 -13.304 -7.170 415 HG1 THR 53 1HG THR 53 4.314 -13.564 -9.223 416 HG21 THR 53 3HG2 THR 53 3.658 -15.525 -6.546 417 HG22 THR 53 1HG2 THR 53 4.830 -15.066 -7.781 418 HG23 THR 53 2HG2 THR 53 3.475 -16.116 -8.198 419 H MET 54 H MET 54 0.216 -14.038 -5.853 420 HA MET 54 HA MET 54 0.708 -16.737 -4.727 421 HB2 MET 54 2HB MET 54 -0.414 -14.141 -3.641 422 HB3 MET 54 1HB MET 54 -0.254 -15.611 -2.679 423 HG2 MET 54 2HG MET 54 2.144 -14.638 -4.179 424 HG3 MET 54 1HG MET 54 1.679 -13.788 -2.705 425 HE1 MET 54 3HE MET 54 4.308 -15.691 -3.597 426 HE2 MET 54 1HE MET 54 3.175 -16.811 -4.365 427 HE3 MET 54 2HE MET 54 4.197 -17.359 -3.039 428 H GLY 55 H GLY 55 -1.513 -15.415 -6.727 429 HA2 GLY 55 2HA GLY 55 -3.604 -16.268 -7.419 430 HA3 GLY 55 1HA GLY 55 -3.502 -17.458 -6.119 431 H PHE 56 H PHE 56 -2.874 -14.429 -4.843 432 HA PHE 56 HA PHE 56 -5.701 -14.228 -3.867 433 HB2 PHE 56 2HB PHE 56 -3.103 -13.144 -2.729 434 HB3 PHE 56 1HB PHE 56 -4.672 -13.135 -1.926 435 HD1 PHE 56 2HD PHE 56 -5.184 -16.036 -3.374 436 HD2 PHE 56 1HD PHE 56 -2.295 -14.380 -0.658 437 HE1 PHE 56 2HE PHE 56 -4.733 -18.301 -2.470 438 HE2 PHE 56 1HE PHE 56 -1.846 -16.644 0.244 439 HZ PHE 56 HZ PHE 56 -3.064 -18.605 -0.662 440 H SER 57 H SER 57 -5.879 -13.064 -6.166 441 HA SER 57 HA SER 57 -4.738 -10.434 -6.445 442 HB2 SER 57 2HB SER 57 -7.019 -11.955 -7.687 443 HB3 SER 57 1HB SER 57 -6.687 -10.287 -8.146 444 HG SER 57 HG SER 57 -5.543 -11.631 -9.511 445 H SER 58 H SER 58 -7.498 -11.688 -4.822 446 HA SER 58 HA SER 58 -9.122 -9.367 -4.571 447 HB2 SER 58 2HB SER 58 -8.704 -11.413 -2.390 448 HB3 SER 58 1HB SER 58 -10.201 -10.626 -2.883 449 HG SER 58 HG SER 58 -10.174 -11.837 -4.767 450 H MET 59 H MET 59 -6.214 -10.459 -2.948 451 HA MET 59 HA MET 59 -6.302 -8.197 -1.042 452 HB2 MET 59 2HB MET 59 -5.691 -10.390 -0.195 453 HB3 MET 59 1HB MET 59 -4.474 -10.580 -1.456 454 HG2 MET 59 2HG MET 59 -3.522 -8.332 -0.437 455 HG3 MET 59 1HG MET 59 -4.410 -8.855 0.995 456 HE1 MET 59 3HE MET 59 -2.558 -11.762 -1.456 457 HE2 MET 59 1HE MET 59 -1.099 -10.769 -1.333 458 HE3 MET 59 2HE MET 59 -2.608 -10.057 -1.897 459 H ALA 60 H ALA 60 -4.905 -9.133 -4.072 460 HA ALA 60 HA ALA 60 -2.632 -7.291 -3.960 461 HB1 ALA 60 1HB ALA 60 -3.284 -9.502 -5.404 462 HB2 ALA 60 2HB ALA 60 -2.100 -8.318 -5.957 463 HB3 ALA 60 3HB ALA 60 -3.761 -8.245 -6.545 464 H LYS 61 H LYS 61 -5.962 -7.251 -5.144 465 HA LYS 61 HA LYS 61 -5.830 -4.809 -6.639 466 HB2 LYS 61 2HB LYS 61 -8.001 -6.237 -5.061 467 HB3 LYS 61 1HB LYS 61 -8.327 -4.838 -6.089 468 HG2 LYS 61 2HG LYS 61 -8.071 -6.035 -8.015 469 HG3 LYS 61 1HG LYS 61 -6.750 -7.002 -7.353 470 HD2 LYS 61 2HD LYS 61 -8.570 -8.521 -7.619 471 HD3 LYS 61 1HD LYS 61 -8.512 -8.145 -5.895 472 HE2 LYS 61 2HE LYS 61 -10.478 -6.953 -5.947 473 HE3 LYS 61 1HE LYS 61 -10.201 -6.369 -7.599 474 HZ1 LYS 61 3HZ LYS 61 -11.691 -7.975 -8.101 475 HZ2 LYS 61 1HZ LYS 61 -11.378 -8.874 -6.697 476 HZ3 LYS 61 2HZ LYS 61 -10.327 -8.984 -8.027 477 H LEU 62 H LEU 62 -6.107 -5.605 -3.248 478 HA LEU 62 HA LEU 62 -6.792 -2.991 -2.240 479 HB2 LEU 62 2HB LEU 62 -5.378 -5.431 -1.112 480 HB3 LEU 62 1HB LEU 62 -5.851 -4.046 -0.123 481 HG LEU 62 HG LEU 62 -7.843 -5.463 -1.881 482 HD11 LEU 62 1HD1 LEU 62 -7.916 -7.242 -0.500 483 HD12 LEU 62 2HD1 LEU 62 -8.089 -6.184 0.901 484 HD13 LEU 62 3HD1 LEU 62 -6.483 -6.622 0.318 485 HD21 LEU 62 3HD2 LEU 62 -8.761 -3.452 -1.114 486 HD22 LEU 62 1HD2 LEU 62 -7.886 -3.523 0.415 487 HD23 LEU 62 2HD2 LEU 62 -9.275 -4.575 0.146 488 H CYS 63 H CYS 63 -3.779 -4.699 -2.933 489 HA CYS 63 HA CYS 63 -1.997 -2.688 -1.863 490 HB2 CYS 63 2HB CYS 63 -1.683 -4.873 -3.950 491 HB3 CYS 63 1HB CYS 63 -0.337 -3.987 -3.233 492 HG CYS 63 HG CYS 63 -1.361 -6.377 -1.992 493 H HIS 64 H HIS 64 -3.531 -3.257 -4.991 494 HA HIS 64 HA HIS 64 -2.035 -1.207 -6.423 495 HB2 HIS 64 2HB HIS 64 -3.231 -3.250 -7.359 496 HB3 HIS 64 1HB HIS 64 -4.750 -2.413 -7.036 497 HD1 HIS 64 1HD HIS 64 -5.522 -0.746 -8.752 498 HD2 HIS 64 2HD HIS 64 -1.512 -1.769 -9.264 499 HE1 HIS 64 1HE HIS 64 -4.774 0.345 -10.912 500 H THR 65 H THR 65 -5.153 -1.394 -4.754 501 HA THR 65 HA THR 65 -6.264 1.103 -5.479 502 HB THR 65 HB THR 65 -6.464 -0.925 -3.328 503 HG1 THR 65 1HG THR 65 -8.589 -0.833 -3.963 504 HG21 THR 65 3HG2 THR 65 -7.414 1.915 -2.918 505 HG22 THR 65 1HG2 THR 65 -6.376 0.961 -1.859 506 HG23 THR 65 2HG2 THR 65 -8.078 0.539 -2.039 507 H LEU 66 H LEU 66 -4.455 0.379 -2.466 508 HA LEU 66 HA LEU 66 -4.112 2.975 -1.453 509 HB2 LEU 66 2HB LEU 66 -2.532 0.412 -1.495 510 HB3 LEU 66 1HB LEU 66 -1.834 1.838 -0.728 511 HG LEU 66 HG LEU 66 -4.235 1.954 0.406 512 HD11 LEU 66 1HD1 LEU 66 -5.149 0.027 -0.801 513 HD12 LEU 66 2HD1 LEU 66 -5.027 -0.342 0.918 514 HD13 LEU 66 3HD1 LEU 66 -3.833 -0.987 -0.208 515 HD21 LEU 66 3HD2 LEU 66 -2.265 -0.117 1.378 516 HD22 LEU 66 1HD2 LEU 66 -3.214 1.019 2.332 517 HD23 LEU 66 2HD2 LEU 66 -1.860 1.598 1.370 518 H GLU 67 H GLU 67 -1.914 1.154 -3.586 519 HA GLU 67 HA GLU 67 -0.007 3.173 -4.083 520 HB2 GLU 67 2HB GLU 67 0.527 0.968 -4.690 521 HB3 GLU 67 1HB GLU 67 -1.041 0.704 -5.453 522 HG2 GLU 67 2HG GLU 67 0.558 2.854 -6.691 523 HG3 GLU 67 1HG GLU 67 1.283 1.251 -6.817 524 H ASN 68 H ASN 68 -3.216 2.704 -5.342 525 HA ASN 68 HA ASN 68 -2.959 4.295 -7.720 526 HB2 ASN 68 2HB ASN 68 -4.833 2.712 -6.478 527 HB3 ASN 68 1HB ASN 68 -5.500 4.328 -6.252 528 HD21 ASN 68 1HD2 ASN 68 -4.998 1.796 -8.578 529 HD22 ASN 68 2HD2 ASN 68 -5.605 2.629 -9.928 530 H ILE 69 H ILE 69 -3.940 4.965 -4.377 531 HA ILE 69 HA ILE 69 -4.518 7.759 -4.777 532 HB ILE 69 HB ILE 69 -3.832 6.001 -2.416 533 HG12 ILE 69 2HG1 ILE 69 -6.256 6.537 -1.906 534 HG13 ILE 69 1HG1 ILE 69 -6.334 7.298 -3.494 535 HG21 ILE 69 1HG2 ILE 69 -4.328 7.841 -0.933 536 HG22 ILE 69 2HG2 ILE 69 -4.788 8.875 -2.284 537 HG23 ILE 69 3HG2 ILE 69 -3.101 8.408 -2.066 538 HD11 ILE 69 3HD1 ILE 69 -5.895 5.250 -4.615 539 HD12 ILE 69 1HD1 ILE 69 -7.081 4.852 -3.375 540 HD13 ILE 69 2HD1 ILE 69 -5.384 4.461 -3.122 541 H LEU 70 H LEU 70 -1.763 5.889 -3.999 542 HA LEU 70 HA LEU 70 0.010 8.163 -3.523 543 HB2 LEU 70 2HB LEU 70 0.651 5.268 -4.170 544 HB3 LEU 70 1HB LEU 70 1.725 6.427 -3.387 545 HG LEU 70 HG LEU 70 -0.722 5.074 -2.275 546 HD11 LEU 70 1HD1 LEU 70 1.996 4.706 -1.968 547 HD12 LEU 70 2HD1 LEU 70 0.758 4.149 -0.840 548 HD13 LEU 70 3HD1 LEU 70 1.575 5.689 -0.564 549 HD21 LEU 70 3HD2 LEU 70 -1.340 7.236 -1.659 550 HD22 LEU 70 1HD2 LEU 70 0.328 7.810 -1.622 551 HD23 LEU 70 2HD2 LEU 70 -0.286 6.799 -0.315 552 H ASP 71 H ASP 71 -1.358 6.579 -6.175 553 HA ASP 71 HA ASP 71 0.759 7.282 -8.083 554 HB2 ASP 71 2HB ASP 71 -0.869 5.303 -8.222 555 HB3 ASP 71 1HB ASP 71 -2.126 6.483 -8.597 556 H LYS 72 H LYS 72 -2.631 8.341 -7.396 557 HA LYS 72 HA LYS 72 -2.564 10.610 -9.127 558 HB2 LYS 72 2HB LYS 72 -4.002 9.764 -6.643 559 HB3 LYS 72 1HB LYS 72 -4.359 11.320 -7.384 560 HG2 LYS 72 2HG LYS 72 -5.346 10.345 -9.227 561 HG3 LYS 72 1HG LYS 72 -4.329 8.900 -9.128 562 HD2 LYS 72 2HD LYS 72 -6.074 9.399 -6.816 563 HD3 LYS 72 1HD LYS 72 -6.906 8.939 -8.302 564 HE2 LYS 72 2HE LYS 72 -4.798 7.175 -8.251 565 HE3 LYS 72 1HE LYS 72 -5.189 7.341 -6.527 566 HZ1 LYS 72 3HZ LYS 72 -7.469 6.872 -6.966 567 HZ2 LYS 72 1HZ LYS 72 -6.562 5.648 -7.709 568 HZ3 LYS 72 2HZ LYS 72 -7.225 6.901 -8.647 569 H ALA 73 H ALA 73 -1.535 10.021 -5.854 570 HA ALA 73 HA ALA 73 -0.955 12.683 -5.002 571 HB1 ALA 73 1HB ALA 73 0.131 9.915 -4.428 572 HB2 ALA 73 2HB ALA 73 -0.942 10.893 -3.422 573 HB3 ALA 73 3HB ALA 73 0.756 11.334 -3.583 574 H ARG 74 H ARG 74 0.807 10.287 -6.901 575 HA ARG 74 HA ARG 74 3.121 12.089 -7.244 576 HB2 ARG 74 2HB ARG 74 4.115 10.051 -7.325 577 HB3 ARG 74 1HB ARG 74 2.541 9.265 -7.305 578 HG2 ARG 74 2HG ARG 74 2.379 9.412 -9.726 579 HG3 ARG 74 1HG ARG 74 3.866 10.357 -9.805 580 HD2 ARG 74 2HD ARG 74 4.931 8.295 -8.563 581 HD3 ARG 74 1HD ARG 74 3.525 7.427 -9.213 582 HE ARG 74 HE ARG 74 4.265 8.581 -11.460 583 HH11 ARG 74 1HH1 ARG 74 5.705 6.098 -9.998 584 HH12 ARG 74 2HH1 ARG 74 7.321 6.398 -10.545 585 HH21 ARG 74 1HH2 ARG 74 6.616 9.586 -11.713 586 HH22 ARG 74 2HH2 ARG 74 7.838 8.375 -11.513 587 H ASN 75 H ASN 75 0.116 11.381 -8.704 588 HA ASN 75 HA ASN 75 0.989 12.313 -11.402 589 HB2 ASN 75 2HB ASN 75 -0.831 10.415 -10.437 590 HB3 ASN 75 1HB ASN 75 -1.847 11.740 -10.999 591 HD21 ASN 75 1HD2 ASN 75 -1.889 12.194 -13.282 592 HD22 ASN 75 2HD2 ASN 75 -1.125 11.195 -14.421 593 H SER 76 H SER 76 0.034 13.659 -8.533 594 HA SER 76 HA SER 76 -0.604 15.874 -8.017 595 HB2 SER 76 2HB SER 76 0.328 15.899 -10.670 596 HB3 SER 76 1HB SER 76 -1.219 16.737 -10.726 597 HG SER 76 HG SER 76 0.528 18.136 -10.205 598 H GLU 77 H GLU 77 -2.496 13.550 -8.439 599 HA GLU 77 HA GLU 77 -4.932 15.027 -9.275 600 HB2 GLU 77 2HB GLU 77 -4.198 12.124 -8.985 601 HB3 GLU 77 1HB GLU 77 -5.854 12.641 -9.289 602 HG2 GLU 77 2HG GLU 77 -3.688 13.725 -11.039 603 HG3 GLU 77 1HG GLU 77 -4.190 12.051 -11.281 604 H ILE 78 H ILE 78 -3.667 12.997 -6.679 605 HA ILE 78 HA ILE 78 -5.692 14.265 -4.853 606 HB ILE 78 HB ILE 78 -5.950 12.102 -3.775 607 HG12 ILE 78 2HG1 ILE 78 -4.750 10.133 -4.998 608 HG13 ILE 78 1HG1 ILE 78 -3.645 11.390 -5.556 609 HG21 ILE 78 1HG2 ILE 78 -6.051 11.253 -6.622 610 HG22 ILE 78 2HG2 ILE 78 -6.951 12.710 -6.202 611 HG23 ILE 78 3HG2 ILE 78 -7.304 11.188 -5.383 612 HD11 ILE 78 3HD1 ILE 78 -2.660 11.563 -3.553 613 HD12 ILE 78 1HD1 ILE 78 -3.466 10.049 -3.146 614 HD13 ILE 78 2HD1 ILE 78 -4.205 11.587 -2.702 615 H LYS 79 H LYS 79 -5.013 13.808 -2.494 616 HA LYS 79 HA LYS 79 -2.088 13.684 -2.067 617 HB2 LYS 79 2HB LYS 79 -2.150 15.830 -0.866 618 HB3 LYS 79 1HB LYS 79 -2.732 16.057 -2.517 619 HG2 LYS 79 2HG LYS 79 -4.766 16.696 -1.792 620 HG3 LYS 79 1HG LYS 79 -4.895 15.284 -0.740 621 HD2 LYS 79 2HD LYS 79 -3.027 17.440 0.093 622 HD3 LYS 79 1HD LYS 79 -4.753 17.763 0.247 623 HE2 LYS 79 2HE LYS 79 -4.651 15.257 1.296 624 HE3 LYS 79 1HE LYS 79 -3.052 15.866 1.764 625 HZ1 LYS 79 3HZ LYS 79 -4.453 18.012 2.276 626 HZ2 LYS 79 1HZ LYS 79 -4.299 16.773 3.426 627 HZ3 LYS 79 2HZ LYS 79 -5.706 16.882 2.479 628 H ILE 80 H ILE 80 -1.634 13.269 0.261 629 HA ILE 80 HA ILE 80 -3.608 11.545 1.468 630 HB ILE 80 HB ILE 80 -0.988 12.757 2.201 631 HG12 ILE 80 2HG1 ILE 80 -0.289 10.395 2.130 632 HG13 ILE 80 1HG1 ILE 80 -1.960 9.925 1.821 633 HG21 ILE 80 1HG2 ILE 80 -1.621 12.621 4.393 634 HG22 ILE 80 2HG2 ILE 80 -1.337 10.897 4.159 635 HG23 ILE 80 3HG2 ILE 80 -2.970 11.547 4.025 636 HD11 ILE 80 3HD1 ILE 80 -1.975 11.079 -0.294 637 HD12 ILE 80 1HD1 ILE 80 -0.522 10.079 -0.255 638 HD13 ILE 80 2HD1 ILE 80 -0.406 11.815 0.036 639 H THR 81 H THR 81 -5.445 12.656 1.868 640 HA THR 81 HA THR 81 -5.496 15.193 3.385 641 HB THR 81 HB THR 81 -7.922 14.964 2.966 642 HG1 THR 81 1HG THR 81 -8.761 13.103 2.452 643 HG21 THR 81 3HG2 THR 81 -7.864 14.967 0.531 644 HG22 THR 81 1HG2 THR 81 -6.311 14.138 0.543 645 HG23 THR 81 2HG2 THR 81 -6.430 15.790 1.145 646 H SER 82 H SER 82 -4.755 12.280 4.448 647 HA SER 82 HA SER 82 -4.878 11.333 6.631 648 HB2 SER 82 2HB SER 82 -5.712 13.965 6.942 649 HB3 SER 82 1HB SER 82 -7.070 13.039 7.575 650 HG SER 82 HG SER 82 -5.760 12.122 9.060 651 H ASP 83 H ASP 83 -7.335 11.690 4.363 652 HA ASP 83 HA ASP 83 -9.102 9.686 5.698 653 HB2 ASP 83 2HB ASP 83 -9.644 12.185 4.639 654 HB3 ASP 83 1HB ASP 83 -10.034 11.113 3.294 655 H LEU 84 H LEU 84 -7.612 10.702 2.609 656 HA LEU 84 HA LEU 84 -8.283 8.296 1.158 657 HB2 LEU 84 2HB LEU 84 -5.985 10.256 0.811 658 HB3 LEU 84 1HB LEU 84 -6.628 9.182 -0.431 659 HG LEU 84 HG LEU 84 -7.979 11.560 0.853 660 HD11 LEU 84 1HD1 LEU 84 -6.511 11.859 -1.165 661 HD12 LEU 84 2HD1 LEU 84 -8.192 12.318 -1.439 662 HD13 LEU 84 3HD1 LEU 84 -7.588 10.777 -2.048 663 HD21 LEU 84 3HD2 LEU 84 -9.845 10.648 -0.876 664 HD22 LEU 84 1HD2 LEU 84 -9.837 10.203 0.832 665 HD23 LEU 84 2HD2 LEU 84 -9.149 9.108 -0.368 666 H LEU 85 H LEU 85 -5.827 9.212 3.437 667 HA LEU 85 HA LEU 85 -4.134 6.859 2.883 668 HB2 LEU 85 2HB LEU 85 -2.605 8.192 3.904 669 HB3 LEU 85 1HB LEU 85 -3.850 9.429 4.021 670 HG LEU 85 HG LEU 85 -4.583 8.189 6.179 671 HD11 LEU 85 1HD1 LEU 85 -1.855 7.357 6.707 672 HD12 LEU 85 2HD1 LEU 85 -2.526 6.476 5.335 673 HD13 LEU 85 3HD1 LEU 85 -3.351 6.442 6.892 674 HD21 LEU 85 3HD2 LEU 85 -3.329 9.699 7.415 675 HD22 LEU 85 1HD2 LEU 85 -3.138 10.389 5.804 676 HD23 LEU 85 2HD2 LEU 85 -1.858 9.390 6.492 677 H ASP 86 H ASP 86 -6.542 7.953 5.245 678 HA ASP 86 HA ASP 86 -6.260 5.831 7.146 679 HB2 ASP 86 2HB ASP 86 -7.508 7.881 7.583 680 HB3 ASP 86 1HB ASP 86 -8.622 7.522 6.262 681 H LYS 87 H LYS 87 -8.251 6.125 4.191 682 HA LYS 87 HA LYS 87 -9.480 3.507 4.505 683 HB2 LYS 87 2HB LYS 87 -9.087 5.421 2.174 684 HB3 LYS 87 1HB LYS 87 -10.073 3.961 2.079 685 HG2 LYS 87 2HG LYS 87 -10.522 6.388 3.828 686 HG3 LYS 87 1HG LYS 87 -11.590 5.738 2.583 687 HD2 LYS 87 2HD LYS 87 -11.549 3.571 4.065 688 HD3 LYS 87 1HD LYS 87 -11.035 4.678 5.338 689 HE2 LYS 87 2HE LYS 87 -13.385 5.504 3.679 690 HE3 LYS 87 1HE LYS 87 -13.632 4.225 4.886 691 HZ1 LYS 87 3HZ LYS 87 -12.657 6.982 5.295 692 HZ2 LYS 87 1HZ LYS 87 -12.268 5.759 6.404 693 HZ3 LYS 87 2HZ LYS 87 -13.894 6.159 6.117 694 H ILE 88 H ILE 88 -6.613 4.848 2.981 695 HA ILE 88 HA ILE 88 -5.792 2.533 1.495 696 HB ILE 88 HB ILE 88 -4.826 5.144 2.352 697 HG12 ILE 88 2HG1 ILE 88 -3.552 3.676 0.128 698 HG13 ILE 88 1HG1 ILE 88 -5.296 3.940 0.020 699 HG21 ILE 88 1HG2 ILE 88 -2.338 4.334 1.938 700 HG22 ILE 88 2HG2 ILE 88 -2.952 2.836 2.630 701 HG23 ILE 88 3HG2 ILE 88 -3.031 4.328 3.560 702 HD11 ILE 88 3HD1 ILE 88 -3.293 5.798 -0.607 703 HD12 ILE 88 1HD1 ILE 88 -3.929 6.329 0.951 704 HD13 ILE 88 2HD1 ILE 88 -5.016 6.133 -0.426 705 H PHE 89 H PHE 89 -4.752 3.756 4.700 706 HA PHE 89 HA PHE 89 -3.321 1.455 5.528 707 HB2 PHE 89 2HB PHE 89 -3.126 3.532 6.718 708 HB3 PHE 89 1HB PHE 89 -4.871 3.618 6.963 709 HD1 PHE 89 1HD PHE 89 -5.982 1.783 8.381 710 HD2 PHE 89 2HD PHE 89 -1.739 2.454 8.303 711 HE1 PHE 89 1HE PHE 89 -5.746 0.537 10.511 712 HE2 PHE 89 2HE PHE 89 -1.503 1.208 10.435 713 HZ PHE 89 HZ PHE 89 -3.507 0.250 11.539 714 H ALA 90 H ALA 90 -6.666 2.063 5.178 715 HA ALA 90 HA ALA 90 -7.613 -0.037 6.966 716 HB1 ALA 90 1HB ALA 90 -9.241 0.944 4.670 717 HB2 ALA 90 2HB ALA 90 -8.713 2.166 5.826 718 HB3 ALA 90 3HB ALA 90 -9.686 0.799 6.371 719 H GLY 91 H GLY 91 -6.795 0.370 3.573 720 HA2 GLY 91 2HA GLY 91 -7.748 -2.210 2.684 721 HA3 GLY 91 1HA GLY 91 -6.590 -1.184 1.827 722 H VAL 92 H VAL 92 -4.650 -0.904 3.810 723 HA VAL 92 HA VAL 92 -3.147 -3.357 3.550 724 HB VAL 92 HB VAL 92 -2.925 -0.705 4.950 725 HG11 VAL 92 1HG1 VAL 92 -0.958 -2.987 5.338 726 HG12 VAL 92 2HG1 VAL 92 -2.088 -2.424 6.570 727 HG13 VAL 92 3HG1 VAL 92 -0.813 -1.353 5.988 728 HG21 VAL 92 3HG2 VAL 92 -0.688 -1.845 3.398 729 HG22 VAL 92 1HG2 VAL 92 -1.444 -0.254 3.283 730 HG23 VAL 92 2HG2 VAL 92 -2.182 -1.641 2.482 731 H ASP 93 H ASP 93 -5.492 -2.142 5.785 732 HA ASP 93 HA ASP 93 -4.778 -3.763 8.089 733 HB2 ASP 93 2HB ASP 93 -6.349 -1.604 7.617 734 HB3 ASP 93 1HB ASP 93 -7.577 -2.868 7.569 735 H MET 94 H MET 94 -7.205 -4.035 5.476 736 HA MET 94 HA MET 94 -8.144 -6.647 6.318 737 HB2 MET 94 2HB MET 94 -8.223 -5.516 3.510 738 HB3 MET 94 1HB MET 94 -9.426 -6.527 4.309 739 HG2 MET 94 2HG MET 94 -9.538 -4.483 5.996 740 HG3 MET 94 1HG MET 94 -8.914 -3.595 4.607 741 HE1 MET 94 3HE MET 94 -9.542 -3.980 2.445 742 HE2 MET 94 1HE MET 94 -11.125 -3.271 2.098 743 HE3 MET 94 2HE MET 94 -10.860 -4.998 1.875 744 H ILE 95 H ILE 95 -5.836 -5.422 3.912 745 HA ILE 95 HA ILE 95 -4.988 -7.789 2.675 746 HB ILE 95 HB ILE 95 -3.879 -5.125 3.408 747 HG12 ILE 95 2HG1 ILE 95 -3.674 -6.693 0.828 748 HG13 ILE 95 1HG1 ILE 95 -5.111 -5.773 1.273 749 HG21 ILE 95 1HG2 ILE 95 -1.627 -5.777 2.444 750 HG22 ILE 95 2HG2 ILE 95 -2.108 -7.460 2.657 751 HG23 ILE 95 3HG2 ILE 95 -1.958 -6.401 4.059 752 HD11 ILE 95 3HD1 ILE 95 -2.441 -4.419 1.408 753 HD12 ILE 95 1HD1 ILE 95 -4.030 -3.727 1.083 754 HD13 ILE 95 2HD1 ILE 95 -3.197 -4.647 -0.168 755 H THR 96 H THR 96 -4.240 -6.478 5.872 756 HA THR 96 HA THR 96 -2.311 -8.547 6.581 757 HB THR 96 HB THR 96 -3.921 -6.467 8.099 758 HG1 THR 96 1HG THR 96 -1.769 -5.580 8.278 759 HG21 THR 96 3HG2 THR 96 -2.773 -7.026 10.085 760 HG22 THR 96 1HG2 THR 96 -1.597 -8.021 9.226 761 HG23 THR 96 2HG2 THR 96 -3.256 -8.586 9.418 762 H ARG 97 H ARG 97 -5.740 -7.859 7.350 763 HA ARG 97 HA ARG 97 -6.262 -10.115 8.991 764 HB2 ARG 97 2HB ARG 97 -7.992 -8.634 6.979 765 HB3 ARG 97 1HB ARG 97 -8.624 -9.748 8.189 766 HG2 ARG 97 2HG ARG 97 -7.408 -7.029 8.569 767 HG3 ARG 97 1HG ARG 97 -8.870 -7.701 9.281 768 HD2 ARG 97 2HD ARG 97 -7.203 -9.371 10.455 769 HD3 ARG 97 1HD ARG 97 -6.011 -8.103 10.113 770 HE ARG 97 HE ARG 97 -8.315 -6.833 11.168 771 HH11 ARG 97 1HH1 ARG 97 -5.246 -7.756 12.009 772 HH12 ARG 97 2HH1 ARG 97 -5.538 -7.888 13.711 773 HH21 ARG 97 1HH2 ARG 97 -8.977 -7.568 13.414 774 HH22 ARG 97 2HH2 ARG 97 -7.649 -7.782 14.505 775 H MET 98 H MET 98 -6.352 -9.795 5.429 776 HA MET 98 HA MET 98 -7.251 -12.480 4.902 777 HB2 MET 98 2HB MET 98 -5.660 -10.403 3.358 778 HB3 MET 98 1HB MET 98 -6.204 -11.919 2.638 779 HG2 MET 98 2HG MET 98 -8.416 -11.290 2.644 780 HG3 MET 98 1HG MET 98 -8.238 -10.285 4.083 781 HE1 MET 98 3HE MET 98 -7.528 -10.661 0.280 782 HE2 MET 98 1HE MET 98 -8.207 -9.107 -0.226 783 HE3 MET 98 2HE MET 98 -9.188 -10.243 0.696 784 H VAL 99 H VAL 99 -4.109 -10.926 5.331 785 HA VAL 99 HA VAL 99 -2.471 -13.197 4.679 786 HB VAL 99 HB VAL 99 -2.223 -10.563 6.102 787 HG11 VAL 99 1HG1 VAL 99 -0.610 -11.402 7.465 788 HG12 VAL 99 2HG1 VAL 99 0.379 -11.499 6.007 789 HG13 VAL 99 3HG1 VAL 99 -0.517 -12.914 6.561 790 HG21 VAL 99 3HG2 VAL 99 -0.177 -10.900 4.245 791 HG22 VAL 99 1HG2 VAL 99 -1.703 -10.064 3.957 792 HG23 VAL 99 2HG2 VAL 99 -1.534 -11.766 3.526 793 H ASP 100 H ASP 100 -4.102 -12.079 7.607 794 HA ASP 100 HA ASP 100 -2.767 -13.925 9.412 795 HB2 ASP 100 2HB ASP 100 -3.769 -11.866 10.212 796 HB3 ASP 100 1HB ASP 100 -5.329 -12.305 9.518 797 H LYS 101 H LYS 101 -5.637 -14.009 7.378 798 HA LYS 101 HA LYS 101 -6.487 -16.611 8.479 799 HB2 LYS 101 2HB LYS 101 -8.477 -15.821 7.802 800 HB3 LYS 101 1HB LYS 101 -7.667 -14.357 7.266 801 HG2 LYS 101 2HG LYS 101 -7.150 -16.085 5.182 802 HG3 LYS 101 1HG LYS 101 -8.764 -16.574 5.685 803 HD2 LYS 101 2HD LYS 101 -8.836 -13.817 5.795 804 HD3 LYS 101 1HD LYS 101 -7.870 -14.162 4.355 805 HE2 LYS 101 2HE LYS 101 -10.085 -14.235 3.524 806 HE3 LYS 101 1HE LYS 101 -9.726 -15.940 3.858 807 HZ1 LYS 101 3HZ LYS 101 -11.752 -14.437 4.989 808 HZ2 LYS 101 1HZ LYS 101 -10.594 -14.618 6.214 809 HZ3 LYS 101 2HZ LYS 101 -11.247 -15.990 5.454 810 H ILE 102 H ILE 102 -5.001 -15.159 5.641 811 HA ILE 102 HA ILE 102 -4.939 -17.488 3.963 812 HB ILE 102 HB ILE 102 -3.433 -14.887 4.216 813 HG12 ILE 102 2HG1 ILE 102 -5.178 -16.139 2.072 814 HG13 ILE 102 1HG1 ILE 102 -5.664 -14.868 3.196 815 HG21 ILE 102 1HG2 ILE 102 -2.094 -15.424 2.269 816 HG22 ILE 102 2HG2 ILE 102 -2.858 -17.008 2.133 817 HG23 ILE 102 3HG2 ILE 102 -1.808 -16.649 3.504 818 HD11 ILE 102 3HD1 ILE 102 -3.255 -14.017 1.936 819 HD12 ILE 102 1HD1 ILE 102 -4.868 -13.321 1.776 820 HD13 ILE 102 2HD1 ILE 102 -4.341 -14.591 0.671 821 H VAL 103 H VAL 103 -2.948 -16.174 6.512 822 HA VAL 103 HA VAL 103 -0.788 -18.139 6.282 823 HB VAL 103 HB VAL 103 -1.691 -15.987 8.195 824 HG11 VAL 103 1HG1 VAL 103 -0.109 -18.333 8.872 825 HG12 VAL 103 2HG1 VAL 103 -0.717 -17.055 9.926 826 HG13 VAL 103 3HG1 VAL 103 0.821 -16.849 9.087 827 HG21 VAL 103 3HG2 VAL 103 0.013 -14.770 7.278 828 HG22 VAL 103 1HG2 VAL 103 -0.148 -15.919 5.949 829 HG23 VAL 103 2HG2 VAL 103 1.088 -16.166 7.181 830 H SER 104 H SER 104 -3.849 -17.787 7.925 831 HA SER 104 HA SER 104 -3.432 -20.075 9.718 832 HB2 SER 104 2HB SER 104 -4.745 -17.878 10.102 833 HB3 SER 104 1HB SER 104 -5.995 -18.617 9.102 834 HG SER 104 HG SER 104 -5.180 -19.193 11.682 835 H GLU 105 H GLU 105 -4.764 -19.441 6.620 836 HA GLU 105 HA GLU 105 -5.497 -22.312 6.318 837 HB2 GLU 105 2HB GLU 105 -7.401 -20.210 5.326 838 HB3 GLU 105 1HB GLU 105 -7.736 -21.869 5.813 839 HG2 GLU 105 2HG GLU 105 -7.054 -21.067 8.196 840 HG3 GLU 105 1HG GLU 105 -7.308 -19.444 7.549 841 H GLY 106 H GLY 106 -5.060 -19.123 4.822 842 HA2 GLY 106 2HA GLY 106 -3.591 -18.896 2.862 843 HA3 GLY 106 1HA GLY 106 -4.080 -20.517 2.369 844 H SER 107 H SER 107 -6.515 -18.346 3.588 845 HA SER 107 HA SER 107 -7.566 -18.024 0.785 846 HB2 SER 107 2HB SER 107 -9.251 -17.864 3.252 847 HB3 SER 107 1HB SER 107 -9.679 -18.447 1.645 848 HG SER 107 HG SER 107 -8.000 -20.144 2.197 849 H ASP 108 H ASP 108 -7.838 -15.965 0.101 850 HA ASP 108 HA ASP 108 -7.357 -13.745 2.039 851 HB2 ASP 108 2HB ASP 108 -6.991 -12.454 -0.013 852 HB3 ASP 108 1HB ASP 108 -6.093 -13.968 -0.134 853 H ASP 109 H ASP 109 -9.896 -15.545 1.264 854 HA ASP 109 HA ASP 109 -11.847 -13.524 0.400 855 HB2 ASP 109 2HB ASP 109 -12.002 -16.374 1.420 856 HB3 ASP 109 1HB ASP 109 -13.404 -15.470 0.843 857 H ILE 110 H ILE 110 -11.595 -11.929 2.165 858 HA ILE 110 HA ILE 110 -12.654 -12.837 4.817 859 HB ILE 110 HB ILE 110 -11.633 -10.626 5.536 860 HG12 ILE 110 2HG1 ILE 110 -10.116 -10.619 2.961 861 HG13 ILE 110 1HG1 ILE 110 -11.739 -9.933 2.959 862 HG21 ILE 110 1HG2 ILE 110 -10.454 -12.856 5.683 863 HG22 ILE 110 2HG2 ILE 110 -9.369 -11.477 5.535 864 HG23 ILE 110 3HG2 ILE 110 -9.698 -12.492 4.133 865 HD11 ILE 110 3HD1 ILE 110 -10.051 -8.202 3.459 866 HD12 ILE 110 1HD1 ILE 110 -9.503 -9.141 4.847 867 HD13 ILE 110 2HD1 ILE 110 -11.128 -8.455 4.832 868 H GLY 111 H GLY 111 -14.411 -12.359 2.522 869 HA2 GLY 111 2HA GLY 111 -16.347 -11.149 1.963 870 HA3 GLY 111 1HA GLY 111 -16.461 -10.836 3.696 871 H GLU 112 H GLU 112 -13.598 -9.756 2.097 872 HA GLU 112 HA GLU 112 -13.995 -7.022 2.854 873 HB2 GLU 112 2HB GLU 112 -11.957 -6.695 1.478 874 HB3 GLU 112 1HB GLU 112 -11.815 -8.114 2.517 875 HG2 GLU 112 2HG GLU 112 -12.361 -9.591 0.685 876 HG3 GLU 112 1HG GLU 112 -12.739 -8.224 -0.361 877 H ASN 113 H ASN 113 -13.759 -5.248 1.052 878 HA ASN 113 HA ASN 113 -15.499 -5.854 -1.302 879 HB2 ASN 113 2HB ASN 113 -16.379 -4.647 1.000 880 HB3 ASN 113 1HB ASN 113 -15.909 -3.255 0.026 881 HD21 ASN 113 1HD2 ASN 113 -16.515 -4.671 -2.551 882 HD22 ASN 113 2HD2 ASN 113 -18.208 -4.718 -2.658 883 H ILE 114 H ILE 114 -13.382 -5.744 -2.447 884 HA ILE 114 HA ILE 114 -11.710 -3.415 -2.374 885 HB ILE 114 HB ILE 114 -12.150 -5.255 -4.734 886 HG12 ILE 114 2HG1 ILE 114 -11.962 -6.854 -3.032 887 HG13 ILE 114 1HG1 ILE 114 -10.276 -6.607 -3.477 888 HG21 ILE 114 1HG2 ILE 114 -10.226 -4.356 -5.481 889 HG22 ILE 114 2HG2 ILE 114 -9.426 -4.647 -3.936 890 HG23 ILE 114 3HG2 ILE 114 -10.359 -3.168 -4.183 891 HD11 ILE 114 3HD1 ILE 114 -10.526 -4.671 -1.613 892 HD12 ILE 114 1HD1 ILE 114 -10.041 -6.320 -1.215 893 HD13 ILE 114 2HD1 ILE 114 -11.719 -5.815 -1.000 894 H ASP 115 H ASP 115 -13.898 -4.412 -5.042 895 HA ASP 115 HA ASP 115 -13.911 -2.081 -6.527 896 HB2 ASP 115 2HB ASP 115 -15.757 -4.300 -5.956 897 HB3 ASP 115 1HB ASP 115 -16.559 -2.849 -6.558 898 H VAL 116 H VAL 116 -15.324 -2.651 -3.441 899 HA VAL 116 HA VAL 116 -16.792 -0.105 -3.401 900 HB VAL 116 HB VAL 116 -16.453 -2.471 -1.570 901 HG11 VAL 116 1HG1 VAL 116 -16.778 -0.987 0.134 902 HG12 VAL 116 2HG1 VAL 116 -18.456 -1.034 -0.408 903 HG13 VAL 116 3HG1 VAL 116 -17.394 0.268 -0.943 904 HG21 VAL 116 3HG2 VAL 116 -18.885 -1.253 -2.922 905 HG22 VAL 116 1HG2 VAL 116 -18.854 -2.750 -1.990 906 HG23 VAL 116 2HG2 VAL 116 -17.990 -2.647 -3.525 907 H PHE 117 H PHE 117 -14.275 -1.657 -1.479 908 HA PHE 117 HA PHE 117 -13.625 0.630 0.122 909 HB2 PHE 117 2HB PHE 117 -12.384 -1.971 -0.629 910 HB3 PHE 117 1HB PHE 117 -11.300 -0.750 0.032 911 HD1 PHE 117 2HD PHE 117 -12.253 0.541 2.159 912 HD2 PHE 117 1HD PHE 117 -13.520 -3.355 0.870 913 HE1 PHE 117 2HE PHE 117 -13.086 0.058 4.444 914 HE2 PHE 117 1HE PHE 117 -14.352 -3.840 3.156 915 HZ PHE 117 HZ PHE 117 -14.137 -2.133 4.943 916 H SER 118 H SER 118 -12.859 -0.175 -3.169 917 HA SER 118 HA SER 118 -10.693 1.794 -3.336 918 HB2 SER 118 2HB SER 118 -10.094 0.405 -5.029 919 HB3 SER 118 1HB SER 118 -11.505 -0.583 -4.656 920 HG SER 118 HG SER 118 -12.496 0.236 -6.324 921 H ASP 119 H ASP 119 -13.945 1.205 -4.469 922 HA ASP 119 HA ASP 119 -14.274 3.629 -5.969 923 HB2 ASP 119 2HB ASP 119 -16.039 1.559 -4.707 924 HB3 ASP 119 1HB ASP 119 -16.777 3.030 -5.345 925 H THR 120 H THR 120 -14.581 2.794 -2.635 926 HA THR 120 HA THR 120 -15.923 5.160 -1.705 927 HB THR 120 HB THR 120 -14.504 2.790 -0.684 928 HG1 THR 120 1HG THR 120 -16.257 3.408 1.001 929 HG21 THR 120 3HG2 THR 120 -14.308 3.816 1.642 930 HG22 THR 120 1HG2 THR 120 -14.425 5.391 0.854 931 HG23 THR 120 2HG2 THR 120 -13.083 4.311 0.474 932 H ILE 121 H ILE 121 -12.600 4.149 -1.885 933 HA ILE 121 HA ILE 121 -11.466 6.673 -1.021 934 HB ILE 121 HB ILE 121 -10.764 3.947 -1.553 935 HG12 ILE 121 2HG1 ILE 121 -9.322 6.259 -0.245 936 HG13 ILE 121 1HG1 ILE 121 -10.352 5.060 0.537 937 HG21 ILE 121 1HG2 ILE 121 -8.631 4.124 -2.629 938 HG22 ILE 121 2HG2 ILE 121 -8.723 5.885 -2.655 939 HG23 ILE 121 3HG2 ILE 121 -9.802 4.930 -3.673 940 HD11 ILE 121 3HD1 ILE 121 -8.441 3.558 -0.863 941 HD12 ILE 121 1HD1 ILE 121 -8.498 3.820 0.880 942 HD13 ILE 121 2HD1 ILE 121 -7.531 4.885 -0.140 943 H LYS 122 H LYS 122 -12.055 5.089 -4.151 944 HA LYS 122 HA LYS 122 -10.628 6.974 -5.774 945 HB2 LYS 122 2HB LYS 122 -12.480 4.696 -6.015 946 HB3 LYS 122 1HB LYS 122 -12.650 5.884 -7.310 947 HG2 LYS 122 2HG LYS 122 -10.781 5.080 -8.270 948 HG3 LYS 122 1HG LYS 122 -9.877 5.586 -6.845 949 HD2 LYS 122 2HD LYS 122 -11.312 3.150 -6.274 950 HD3 LYS 122 1HD LYS 122 -10.326 2.944 -7.719 951 HE2 LYS 122 2HE LYS 122 -8.537 4.259 -6.163 952 HE3 LYS 122 1HE LYS 122 -9.461 3.405 -4.910 953 HZ1 LYS 122 3HZ LYS 122 -7.876 2.316 -7.111 954 HZ2 LYS 122 1HZ LYS 122 -9.298 1.489 -6.701 955 HZ3 LYS 122 2HZ LYS 122 -8.087 1.725 -5.531 956 H SER 123 H SER 123 -13.889 6.806 -4.473 957 HA SER 123 HA SER 123 -14.758 9.201 -5.943 958 HB2 SER 123 2HB SER 123 -15.912 7.224 -4.012 959 HB3 SER 123 1HB SER 123 -16.767 8.729 -4.329 960 HG SER 123 HG SER 123 -17.519 7.540 -5.933 961 H PHE 124 H PHE 124 -13.202 8.369 -3.048 962 HA PHE 124 HA PHE 124 -14.058 10.678 -1.463 963 HB2 PHE 124 2HB PHE 124 -12.384 8.284 -1.248 964 HB3 PHE 124 1HB PHE 124 -11.693 9.674 -0.413 965 HD1 PHE 124 2HD PHE 124 -14.177 11.130 0.361 966 HD2 PHE 124 1HD PHE 124 -13.215 6.947 0.532 967 HE1 PHE 124 2HE PHE 124 -15.804 10.832 2.207 968 HE2 PHE 124 1HE PHE 124 -14.843 6.650 2.379 969 HZ PHE 124 HZ PHE 124 -16.138 8.593 3.217 970 H ALA 125 H ALA 125 -12.198 10.395 -4.155 971 HA ALA 125 HA ALA 125 -10.461 12.723 -3.387 972 HB1 ALA 125 1HB ALA 125 -9.203 11.474 -5.493 973 HB2 ALA 125 2HB ALA 125 -9.940 10.110 -4.650 974 HB3 ALA 125 3HB ALA 125 -8.830 11.181 -3.793 975 H SER 126 H SER 126 -10.913 11.243 -6.569 976 HA SER 126 HA SER 126 -11.367 13.774 -7.866 977 HB2 SER 126 2HB SER 126 -11.112 10.940 -8.493 978 HB3 SER 126 1HB SER 126 -12.335 11.711 -9.501 979 HG SER 126 HG SER 126 -10.102 11.821 -10.273 980 H SER 127 H SER 127 -13.213 14.903 -7.242 981 HA SER 127 HA SER 127 -15.822 13.429 -7.427 982 HB2 SER 127 2HB SER 127 -16.574 14.783 -5.588 983 HB3 SER 127 1HB SER 127 -14.980 14.184 -5.142 984 HG SER 127 HG SER 127 -15.584 16.587 -4.994 985 H GLY 128 H GLY 128 -17.599 14.691 -8.313 986 HA2 GLY 128 2HA GLY 128 -16.873 17.276 -9.582 987 HA3 GLY 128 1HA GLY 128 -17.461 15.980 -10.623 988 H LYS 129 H LYS 129 -18.480 17.180 -7.401 989 HA LYS 129 HA LYS 129 -21.208 16.647 -7.587 990 HB2 LYS 129 2HB LYS 129 -19.414 18.444 -6.143 991 HB3 LYS 129 1HB LYS 129 -21.019 19.146 -6.347 992 HG2 LYS 129 2HG LYS 129 -21.747 16.657 -5.641 993 HG3 LYS 129 1HG LYS 129 -20.187 16.730 -4.818 994 HD2 LYS 129 2HD LYS 129 -21.339 17.768 -3.158 995 HD3 LYS 129 1HD LYS 129 -21.259 19.185 -4.205 996 HE2 LYS 129 2HE LYS 129 -23.517 19.165 -4.371 997 HE3 LYS 129 1HE LYS 129 -23.438 17.550 -5.103 998 HZ1 LYS 129 3HZ LYS 129 -23.430 18.186 -2.200 999 HZ2 LYS 129 1HZ LYS 129 -23.168 16.637 -2.839 1000 HZ3 LYS 129 2HZ LYS 129 -24.667 17.403 -3.062 1001 H GLU 130 H GLU 130 -22.951 17.598 -8.666 1002 HA GLU 130 HA GLU 130 -24.047 18.908 -10.305 1003 HB2 GLU 130 2HB GLU 130 -23.155 20.499 -8.376 1004 HB3 GLU 130 1HB GLU 130 -22.095 21.093 -9.654 1005 HG2 GLU 130 2HG GLU 130 -24.580 20.946 -10.891 1006 HG3 GLU 130 1HG GLU 130 -24.958 21.533 -9.270 1007 H LYS 131 H LYS 131 -23.305 17.787 -12.186 1008 HA LYS 131 HA LYS 131 -21.142 19.208 -13.685 1009 HB2 LYS 131 2HB LYS 131 -20.086 17.294 -12.698 1010 HB3 LYS 131 1HB LYS 131 -21.455 16.255 -13.097 1011 HG2 LYS 131 2HG LYS 131 -20.601 17.420 -15.533 1012 HG3 LYS 131 1HG LYS 131 -19.145 16.875 -14.702 1013 HD2 LYS 131 2HD LYS 131 -21.597 15.132 -15.020 1014 HD3 LYS 131 1HD LYS 131 -20.269 15.135 -16.181 1015 HE2 LYS 131 2HE LYS 131 -18.738 14.720 -14.115 1016 HE3 LYS 131 1HE LYS 131 -20.238 14.245 -13.295 1017 HZ1 LYS 131 3HZ LYS 131 -19.859 13.228 -15.995 1018 HZ2 LYS 131 1HZ LYS 131 -20.528 12.465 -14.635 1019 HZ3 LYS 131 2HZ LYS 131 -18.841 12.568 -14.807 1020 H LEU 132 H LEU 132 -21.735 19.577 -15.800 1021 HA LEU 132 HA LEU 132 -23.220 19.688 -17.652 1022 HB2 LEU 132 2HB LEU 132 -21.880 17.324 -17.428 1023 HB3 LEU 132 1HB LEU 132 -23.546 16.746 -17.488 1024 HG LEU 132 HG LEU 132 -23.286 18.793 -19.452 1025 HD11 LEU 132 1HD1 LEU 132 -20.861 17.202 -19.072 1026 HD12 LEU 132 2HD1 LEU 132 -21.119 18.630 -20.075 1027 HD13 LEU 132 3HD1 LEU 132 -21.528 17.030 -20.695 1028 HD21 LEU 132 3HD2 LEU 132 -24.011 17.044 -20.935 1029 HD22 LEU 132 1HD2 LEU 132 -24.773 16.727 -19.377 1030 HD23 LEU 132 2HD2 LEU 132 -23.363 15.793 -19.875 1031 H GLU 133 H GLU 133 -24.981 20.656 -16.288 1032 HA GLU 133 HA GLU 133 -27.225 20.714 -15.541 1033 HB2 GLU 133 2HB GLU 133 -27.293 18.269 -17.342 1034 HB3 GLU 133 1HB GLU 133 -28.694 19.217 -16.847 1035 HG2 GLU 133 2HG GLU 133 -27.932 21.143 -18.044 1036 HG3 GLU 133 1HG GLU 133 -26.341 20.430 -18.309 Start of MODEL 2 1 H1 MET 1 1HT MET 1 6.653 -30.769 -1.336 2 H2 MET 1 2HT MET 1 7.358 -31.728 -0.124 3 H3 MET 1 3HT MET 1 8.185 -31.452 -1.582 4 HA MET 1 HA MET 1 7.708 -29.566 0.649 5 HB2 MET 1 2HB MET 1 9.772 -31.261 -0.286 6 HB3 MET 1 1HB MET 1 10.284 -29.616 -0.662 7 HG2 MET 1 2HG MET 1 9.369 -29.202 1.830 8 HG3 MET 1 1HG MET 1 9.820 -30.900 1.986 9 HE1 MET 1 2HE MET 1 12.695 -31.206 0.170 10 HE2 MET 1 3HE MET 1 11.714 -31.909 1.455 11 HE3 MET 1 1HE MET 1 13.330 -31.283 1.812 12 H MET 2 H MET 2 6.124 -28.809 -1.409 13 HA MET 2 HA MET 2 7.736 -26.801 -2.952 14 HB2 MET 2 2HB MET 2 6.190 -28.860 -3.873 15 HB3 MET 2 1HB MET 2 5.017 -27.543 -3.853 16 HG2 MET 2 2HG MET 2 7.734 -27.027 -5.008 17 HG3 MET 2 1HG MET 2 6.560 -27.924 -5.970 18 HE1 MET 2 3HE MET 2 5.972 -26.712 -7.746 19 HE2 MET 2 1HE MET 2 7.214 -25.466 -7.554 20 HE3 MET 2 2HE MET 2 5.545 -25.007 -7.877 21 H GLU 3 H GLU 3 6.659 -26.384 -0.241 22 HA GLU 3 HA GLU 3 4.595 -24.285 -0.838 23 HB2 GLU 3 2HB GLU 3 3.826 -24.738 1.484 24 HB3 GLU 3 1HB GLU 3 3.720 -26.177 0.466 25 HG2 GLU 3 2HG GLU 3 6.302 -25.766 1.869 26 HG3 GLU 3 1HG GLU 3 4.923 -26.152 2.901 27 H GLU 4 H GLU 4 7.757 -24.769 0.049 28 HA GLU 4 HA GLU 4 7.938 -22.852 2.186 29 HB2 GLU 4 2HB GLU 4 9.525 -24.756 1.648 30 HB3 GLU 4 1HB GLU 4 10.107 -23.791 0.292 31 HG2 GLU 4 2HG GLU 4 11.589 -23.410 2.169 32 HG3 GLU 4 1HG GLU 4 10.636 -21.947 1.919 33 H TYR 5 H TYR 5 7.530 -22.560 -1.143 34 HA TYR 5 HA TYR 5 8.969 -20.088 -1.600 35 HB2 TYR 5 2HB TYR 5 7.317 -21.989 -3.019 36 HB3 TYR 5 1HB TYR 5 6.808 -20.344 -3.403 37 HD1 TYR 5 1HD TYR 5 10.161 -21.831 -2.614 38 HD2 TYR 5 2HD TYR 5 7.730 -19.715 -5.454 39 HE1 TYR 5 1HE TYR 5 12.128 -21.565 -4.100 40 HE2 TYR 5 2HE TYR 5 9.697 -19.448 -6.939 41 HH TYR 5 HH TYR 5 11.968 -19.597 -7.025 42 H LEU 6 H LEU 6 5.982 -20.952 -0.198 43 HA LEU 6 HA LEU 6 4.786 -18.259 -0.442 44 HB2 LEU 6 2HB LEU 6 3.861 -20.699 1.103 45 HB3 LEU 6 1HB LEU 6 2.871 -19.341 0.568 46 HG LEU 6 HG LEU 6 4.309 -20.518 -1.662 47 HD11 LEU 6 1HD1 LEU 6 2.336 -22.335 -0.252 48 HD12 LEU 6 2HD1 LEU 6 4.085 -22.535 -0.143 49 HD13 LEU 6 3HD1 LEU 6 3.274 -22.693 -1.701 50 HD21 LEU 6 3HD2 LEU 6 1.355 -20.267 -1.002 51 HD22 LEU 6 1HD2 LEU 6 2.029 -20.586 -2.600 52 HD23 LEU 6 2HD2 LEU 6 2.327 -19.037 -1.811 53 H GLY 7 H GLY 7 5.888 -20.468 2.148 54 HA2 GLY 7 2HA GLY 7 5.464 -18.863 4.384 55 HA3 GLY 7 1HA GLY 7 6.853 -19.942 4.233 56 H VAL 8 H VAL 8 8.056 -18.603 1.970 57 HA VAL 8 HA VAL 8 9.308 -16.372 3.423 58 HB VAL 8 HB VAL 8 9.828 -17.770 0.795 59 HG11 VAL 8 1HG1 VAL 8 10.558 -15.425 0.656 60 HG12 VAL 8 2HG1 VAL 8 11.955 -16.499 0.756 61 HG13 VAL 8 3HG1 VAL 8 11.431 -15.597 2.178 62 HG21 VAL 8 3HG2 VAL 8 11.331 -17.745 3.433 63 HG22 VAL 8 1HG2 VAL 8 11.776 -18.668 1.998 64 HG23 VAL 8 2HG2 VAL 8 10.292 -19.055 2.870 65 H PHE 9 H PHE 9 7.208 -16.878 0.709 66 HA PHE 9 HA PHE 9 7.404 -14.274 -0.487 67 HB2 PHE 9 2HB PHE 9 5.756 -16.687 -0.631 68 HB3 PHE 9 1HB PHE 9 4.811 -15.227 -0.912 69 HD1 PHE 9 1HD PHE 9 7.008 -13.509 -2.119 70 HD2 PHE 9 2HD PHE 9 5.847 -17.583 -2.841 71 HE1 PHE 9 1HE PHE 9 7.933 -13.369 -4.415 72 HE2 PHE 9 2HE PHE 9 6.774 -17.441 -5.135 73 HZ PHE 9 HZ PHE 9 7.817 -15.334 -5.923 74 H VAL 10 H VAL 10 5.361 -15.615 2.088 75 HA VAL 10 HA VAL 10 3.861 -13.117 2.446 76 HB VAL 10 HB VAL 10 4.056 -15.549 4.243 77 HG11 VAL 10 1HG1 VAL 10 1.432 -14.578 4.075 78 HG12 VAL 10 2HG1 VAL 10 2.440 -13.135 4.174 79 HG13 VAL 10 3HG1 VAL 10 2.544 -14.371 5.428 80 HG21 VAL 10 3HG2 VAL 10 3.127 -15.345 1.510 81 HG22 VAL 10 1HG2 VAL 10 1.782 -15.733 2.582 82 HG23 VAL 10 2HG2 VAL 10 3.209 -16.770 2.547 83 H ASP 11 H ASP 11 6.702 -14.676 3.832 84 HA ASP 11 HA ASP 11 6.857 -13.123 6.248 85 HB2 ASP 11 2HB ASP 11 8.580 -14.905 4.608 86 HB3 ASP 11 1HB ASP 11 9.415 -13.828 5.727 87 H GLU 12 H GLU 12 7.776 -12.580 2.972 88 HA GLU 12 HA GLU 12 9.338 -10.149 3.598 89 HB2 GLU 12 2HB GLU 12 9.732 -10.165 1.174 90 HB3 GLU 12 1HB GLU 12 9.991 -11.785 1.825 91 HG2 GLU 12 2HG GLU 12 7.992 -12.605 0.936 92 HG3 GLU 12 1HG GLU 12 7.276 -10.998 0.812 93 H THR 13 H THR 13 6.160 -11.133 2.619 94 HA THR 13 HA THR 13 5.265 -8.602 1.531 95 HB THR 13 HB THR 13 4.142 -11.231 2.411 96 HG1 THR 13 1HG THR 13 4.096 -9.594 0.115 97 HG21 THR 13 3HG2 THR 13 2.656 -8.677 2.494 98 HG22 THR 13 1HG2 THR 13 2.308 -10.212 3.291 99 HG23 THR 13 2HG2 THR 13 1.868 -9.977 1.600 100 H LYS 14 H LYS 14 5.006 -10.172 4.734 101 HA LYS 14 HA LYS 14 3.517 -7.991 5.944 102 HB2 LYS 14 2HB LYS 14 5.223 -10.185 7.175 103 HB3 LYS 14 1HB LYS 14 3.954 -9.271 7.992 104 HG2 LYS 14 2HG LYS 14 2.275 -10.453 6.992 105 HG3 LYS 14 1HG LYS 14 3.148 -10.592 5.465 106 HD2 LYS 14 2HD LYS 14 3.403 -12.768 6.101 107 HD3 LYS 14 1HD LYS 14 4.724 -12.121 7.071 108 HE2 LYS 14 2HE LYS 14 3.051 -11.783 8.954 109 HE3 LYS 14 1HE LYS 14 1.892 -12.711 7.984 110 HZ1 LYS 14 3HZ LYS 14 3.065 -14.612 8.217 111 HZ2 LYS 14 1HZ LYS 14 3.641 -13.862 9.625 112 HZ3 LYS 14 2HZ LYS 14 4.570 -13.824 8.203 113 H GLU 15 H GLU 15 6.957 -8.931 5.851 114 HA GLU 15 HA GLU 15 7.877 -6.893 7.637 115 HB2 GLU 15 2HB GLU 15 9.169 -8.446 5.383 116 HB3 GLU 15 1HB GLU 15 10.078 -7.431 6.505 117 HG2 GLU 15 2HG GLU 15 8.204 -9.524 7.575 118 HG3 GLU 15 1HG GLU 15 9.812 -9.992 7.021 119 H TYR 16 H TYR 16 6.785 -6.823 4.418 120 HA TYR 16 HA TYR 16 8.139 -4.289 3.752 121 HB2 TYR 16 2HB TYR 16 6.870 -6.503 2.376 122 HB3 TYR 16 1HB TYR 16 6.228 -4.966 1.796 123 HD1 TYR 16 2HD TYR 16 8.562 -3.180 2.195 124 HD2 TYR 16 1HD TYR 16 8.353 -7.184 0.652 125 HE1 TYR 16 2HE TYR 16 10.644 -2.792 0.909 126 HE2 TYR 16 1HE TYR 16 10.438 -6.794 -0.635 127 HH TYR 16 HH TYR 16 11.808 -3.654 -1.005 128 H LEU 17 H LEU 17 4.874 -5.490 4.524 129 HA LEU 17 HA LEU 17 3.430 -3.093 3.957 130 HB2 LEU 17 2HB LEU 17 3.085 -5.314 5.994 131 HB3 LEU 17 1HB LEU 17 1.860 -4.077 5.706 132 HG LEU 17 HG LEU 17 3.002 -5.863 3.550 133 HD11 LEU 17 1HD1 LEU 17 0.191 -6.229 4.267 134 HD12 LEU 17 2HD1 LEU 17 1.281 -6.619 5.598 135 HD13 LEU 17 3HD1 LEU 17 1.456 -7.438 4.046 136 HD21 LEU 17 3HD2 LEU 17 0.855 -5.035 2.401 137 HD22 LEU 17 1HD2 LEU 17 2.156 -3.857 2.580 138 HD23 LEU 17 2HD2 LEU 17 0.776 -3.821 3.678 139 H GLN 18 H GLN 18 5.190 -4.189 6.817 140 HA GLN 18 HA GLN 18 4.576 -1.899 8.459 141 HB2 GLN 18 2HB GLN 18 5.525 -3.341 9.905 142 HB3 GLN 18 1HB GLN 18 5.958 -4.377 8.553 143 HG2 GLN 18 2HG GLN 18 8.098 -3.387 8.329 144 HG3 GLN 18 1HG GLN 18 7.648 -1.996 9.318 145 HE21 GLN 18 1HE2 GLN 18 9.634 -2.632 10.633 146 HE22 GLN 18 2HE2 GLN 18 9.467 -3.846 11.808 147 H ASN 19 H ASN 19 7.308 -2.857 6.505 148 HA ASN 19 HA ASN 19 8.825 -0.450 6.732 149 HB2 ASN 19 2HB ASN 19 8.713 -2.905 5.126 150 HB3 ASN 19 1HB ASN 19 9.269 -1.516 4.187 151 HD21 ASN 19 1HD2 ASN 19 10.930 -3.807 5.086 152 HD22 ASN 19 2HD2 ASN 19 12.147 -3.153 6.072 153 H LEU 20 H LEU 20 6.003 -1.387 5.044 154 HA LEU 20 HA LEU 20 5.988 0.977 3.272 155 HB2 LEU 20 2HB LEU 20 5.209 -0.941 2.175 156 HB3 LEU 20 1HB LEU 20 4.416 -1.556 3.623 157 HG LEU 20 HG LEU 20 2.755 0.308 3.447 158 HD11 LEU 20 1HD1 LEU 20 3.032 1.995 1.979 159 HD12 LEU 20 2HD1 LEU 20 3.280 0.870 0.644 160 HD13 LEU 20 3HD1 LEU 20 4.640 1.350 1.657 161 HD21 LEU 20 3HD2 LEU 20 2.909 -1.296 0.882 162 HD22 LEU 20 1HD2 LEU 20 1.461 -0.733 1.716 163 HD23 LEU 20 2HD2 LEU 20 2.448 -2.011 2.426 164 H ASN 21 H ASN 21 4.971 0.072 6.382 165 HA ASN 21 HA ASN 21 2.773 2.041 6.458 166 HB2 ASN 21 2HB ASN 21 3.728 -0.276 8.013 167 HB3 ASN 21 1HB ASN 21 3.211 1.091 9.004 168 HD21 ASN 21 1HD2 ASN 21 1.811 0.378 5.815 169 HD22 ASN 21 2HD2 ASN 21 0.273 -0.045 6.394 170 H ASP 22 H ASP 22 5.997 1.341 7.426 171 HA ASP 22 HA ASP 22 6.350 3.595 9.118 172 HB2 ASP 22 2HB ASP 22 7.897 1.401 8.005 173 HB3 ASP 22 1HB ASP 22 8.840 2.890 8.044 174 H THR 23 H THR 23 6.502 2.947 5.786 175 HA THR 23 HA THR 23 7.788 5.411 4.902 176 HB THR 23 HB THR 23 6.065 3.268 3.653 177 HG1 THR 23 1HG THR 23 8.827 3.698 3.960 178 HG21 THR 23 3HG2 THR 23 7.043 4.119 1.480 179 HG22 THR 23 1HG2 THR 23 7.633 5.521 2.374 180 HG23 THR 23 2HG2 THR 23 5.899 5.220 2.250 181 H LEU 24 H LEU 24 4.472 4.118 5.073 182 HA LEU 24 HA LEU 24 3.283 6.596 4.097 183 HB2 LEU 24 2HB LEU 24 1.490 5.220 3.818 184 HB3 LEU 24 1HB LEU 24 2.597 3.919 4.237 185 HG LEU 24 HG LEU 24 1.963 4.356 6.676 186 HD11 LEU 24 1HD1 LEU 24 0.664 6.548 5.509 187 HD12 LEU 24 2HD1 LEU 24 0.492 5.993 7.175 188 HD13 LEU 24 3HD1 LEU 24 -0.636 5.436 5.939 189 HD21 LEU 24 3HD2 LEU 24 -0.437 3.550 5.051 190 HD22 LEU 24 1HD2 LEU 24 0.197 2.822 6.528 191 HD23 LEU 24 2HD2 LEU 24 1.030 2.572 4.993 192 H LEU 25 H LEU 25 4.175 5.169 7.168 193 HA LEU 25 HA LEU 25 2.514 6.999 8.760 194 HB2 LEU 25 2HB LEU 25 4.772 5.072 9.311 195 HB3 LEU 25 1HB LEU 25 4.028 6.039 10.593 196 HG LEU 25 HG LEU 25 2.357 4.451 8.682 197 HD11 LEU 25 1HD1 LEU 25 2.426 2.544 10.117 198 HD12 LEU 25 2HD1 LEU 25 3.311 3.426 11.363 199 HD13 LEU 25 3HD1 LEU 25 4.105 3.004 9.845 200 HD21 LEU 25 3HD2 LEU 25 1.752 6.316 10.588 201 HD22 LEU 25 1HD2 LEU 25 1.610 4.821 11.517 202 HD23 LEU 25 2HD2 LEU 25 0.644 5.048 10.058 203 H GLU 26 H GLU 26 5.484 7.118 7.159 204 HA GLU 26 HA GLU 26 6.447 9.459 8.700 205 HB2 GLU 26 2HB GLU 26 7.541 7.774 6.415 206 HB3 GLU 26 1HB GLU 26 8.379 9.194 7.046 207 HG2 GLU 26 2HG GLU 26 7.500 7.110 8.997 208 HG3 GLU 26 1HG GLU 26 8.899 6.754 7.985 209 H LEU 27 H LEU 27 4.906 8.352 5.868 210 HA LEU 27 HA LEU 27 5.050 10.675 4.273 211 HB2 LEU 27 2HB LEU 27 4.419 8.528 3.355 212 HB3 LEU 27 1HB LEU 27 3.103 8.378 4.518 213 HG LEU 27 HG LEU 27 2.011 10.358 3.501 214 HD11 LEU 27 1HD1 LEU 27 3.905 10.110 1.183 215 HD12 LEU 27 2HD1 LEU 27 4.350 11.119 2.559 216 HD13 LEU 27 3HD1 LEU 27 2.886 11.474 1.643 217 HD21 LEU 27 3HD2 LEU 27 1.734 9.139 1.144 218 HD22 LEU 27 1HD2 LEU 27 1.078 8.430 2.620 219 HD23 LEU 27 2HD2 LEU 27 2.616 7.858 1.974 220 H GLU 28 H GLU 28 3.047 9.640 6.952 221 HA GLU 28 HA GLU 28 1.019 11.705 6.708 222 HB2 GLU 28 2HB GLU 28 2.043 9.845 8.870 223 HB3 GLU 28 1HB GLU 28 0.776 11.023 9.213 224 HG2 GLU 28 2HG GLU 28 -0.642 10.076 7.486 225 HG3 GLU 28 1HG GLU 28 0.639 8.969 6.990 226 H LYS 29 H LYS 29 4.107 11.322 8.402 227 HA LYS 29 HA LYS 29 4.031 13.859 9.806 228 HB2 LYS 29 2HB LYS 29 6.550 12.485 8.891 229 HB3 LYS 29 1HB LYS 29 6.252 13.322 10.411 230 HG2 LYS 29 2HG LYS 29 5.275 10.592 9.568 231 HG3 LYS 29 1HG LYS 29 6.273 11.008 10.955 232 HD2 LYS 29 2HD LYS 29 4.432 12.111 12.047 233 HD3 LYS 29 1HD LYS 29 3.424 11.970 10.607 234 HE2 LYS 29 2HE LYS 29 2.803 9.859 11.157 235 HE3 LYS 29 1HE LYS 29 4.490 9.379 11.443 236 HZ1 LYS 29 3HZ LYS 29 2.996 9.432 13.469 237 HZ2 LYS 29 1HZ LYS 29 2.992 11.121 13.318 238 HZ3 LYS 29 2HZ LYS 29 4.453 10.298 13.592 239 H ASN 30 H ASN 30 4.688 12.827 6.636 240 HA ASN 30 HA ASN 30 5.046 15.592 5.695 241 HB2 ASN 30 2HB ASN 30 7.106 13.373 5.422 242 HB3 ASN 30 1HB ASN 30 7.114 14.800 4.385 243 HD21 ASN 30 1HD2 ASN 30 8.427 13.597 7.230 244 HD22 ASN 30 2HD2 ASN 30 8.808 15.068 7.989 245 HA PRO 31 HA PRO 31 2.540 12.845 3.147 246 HB2 PRO 31 2HB PRO 31 0.268 14.315 3.363 247 HB3 PRO 31 1HB PRO 31 0.787 13.133 4.573 248 HG2 PRO 31 2HG PRO 31 0.826 16.064 4.696 249 HG3 PRO 31 1HG PRO 31 0.705 14.867 5.994 250 HD2 PRO 31 2HD PRO 31 3.005 16.282 5.194 251 HD3 PRO 31 1HD PRO 31 2.911 14.940 6.356 252 H GLU 32 H GLU 32 4.258 15.384 2.530 253 HA GLU 32 HA GLU 32 2.856 16.035 -0.024 254 HB2 GLU 32 2HB GLU 32 4.656 18.097 1.061 255 HB3 GLU 32 1HB GLU 32 3.017 18.268 0.436 256 HG2 GLU 32 2HG GLU 32 2.099 17.443 2.558 257 HG3 GLU 32 1HG GLU 32 3.733 17.198 3.180 258 H ASP 33 H ASP 33 5.532 14.764 1.514 259 HA ASP 33 HA ASP 33 7.563 15.554 -0.402 260 HB2 ASP 33 2HB ASP 33 7.369 14.317 2.156 261 HB3 ASP 33 1HB ASP 33 8.220 13.194 1.095 262 H MET 34 H MET 34 7.941 14.509 -2.344 263 HA MET 34 HA MET 34 6.191 12.384 -3.223 264 HB2 MET 34 2HB MET 34 8.750 13.571 -4.344 265 HB3 MET 34 1HB MET 34 7.664 12.511 -5.243 266 HG2 MET 34 2HG MET 34 5.903 14.373 -4.296 267 HG3 MET 34 1HG MET 34 7.346 15.360 -4.525 268 HE1 MET 34 3HE MET 34 5.859 12.234 -7.128 269 HE2 MET 34 1HE MET 34 4.508 13.372 -7.215 270 HE3 MET 34 2HE MET 34 5.096 12.816 -5.651 271 H GLU 35 H GLU 35 8.790 12.236 -1.144 272 HA GLU 35 HA GLU 35 9.979 9.758 -2.180 273 HB2 GLU 35 2HB GLU 35 10.403 11.735 -0.035 274 HB3 GLU 35 1HB GLU 35 10.767 10.079 0.454 275 HG2 GLU 35 2HG GLU 35 12.079 9.913 -1.762 276 HG3 GLU 35 1HG GLU 35 11.979 11.673 -1.801 277 H LEU 36 H LEU 36 8.237 10.583 0.856 278 HA LEU 36 HA LEU 36 7.640 7.838 1.469 279 HB2 LEU 36 2HB LEU 36 6.070 10.304 2.277 280 HB3 LEU 36 1HB LEU 36 6.250 8.805 3.185 281 HG LEU 36 HG LEU 36 8.243 11.013 2.775 282 HD11 LEU 36 1HD1 LEU 36 6.878 11.001 4.802 283 HD12 LEU 36 2HD1 LEU 36 8.556 10.641 5.207 284 HD13 LEU 36 3HD1 LEU 36 7.367 9.341 5.139 285 HD21 LEU 36 3HD2 LEU 36 9.711 9.309 2.187 286 HD22 LEU 36 1HD2 LEU 36 8.794 8.080 3.060 287 HD23 LEU 36 2HD2 LEU 36 9.820 9.210 3.944 288 H ILE 37 H ILE 37 6.313 10.161 -0.729 289 HA ILE 37 HA ILE 37 3.685 8.898 -0.984 290 HB ILE 37 HB ILE 37 5.312 10.997 -2.415 291 HG12 ILE 37 2HG1 ILE 37 2.667 11.002 -0.932 292 HG13 ILE 37 1HG1 ILE 37 4.198 11.649 -0.341 293 HG21 ILE 37 1HG2 ILE 37 3.079 11.338 -3.724 294 HG22 ILE 37 2HG2 ILE 37 2.784 9.645 -3.327 295 HG23 ILE 37 3HG2 ILE 37 4.203 10.096 -4.273 296 HD11 ILE 37 3HD1 ILE 37 2.614 13.381 -1.301 297 HD12 ILE 37 1HD1 ILE 37 2.860 12.624 -2.875 298 HD13 ILE 37 2HD1 ILE 37 4.220 13.361 -2.029 299 H ASN 38 H ASN 38 6.852 8.745 -2.580 300 HA ASN 38 HA ASN 38 5.821 6.846 -4.599 301 HB2 ASN 38 2HB ASN 38 8.555 8.035 -4.041 302 HB3 ASN 38 1HB ASN 38 8.174 7.025 -5.436 303 HD21 ASN 38 1HD2 ASN 38 9.052 9.483 -6.146 304 HD22 ASN 38 2HD2 ASN 38 7.779 10.499 -6.622 305 H GLU 39 H GLU 39 7.502 6.886 -1.601 306 HA GLU 39 HA GLU 39 8.686 4.246 -1.788 307 HB2 GLU 39 2HB GLU 39 8.048 6.210 0.416 308 HB3 GLU 39 1HB GLU 39 8.739 4.629 0.782 309 HG2 GLU 39 2HG GLU 39 10.273 5.683 -1.349 310 HG3 GLU 39 1HG GLU 39 10.069 6.996 -0.187 311 H ALA 40 H ALA 40 5.627 5.548 -0.943 312 HA ALA 40 HA ALA 40 4.609 3.064 0.284 313 HB1 ALA 40 1HB ALA 40 2.664 4.401 0.692 314 HB2 ALA 40 2HB ALA 40 3.083 5.528 -0.600 315 HB3 ALA 40 3HB ALA 40 4.028 5.501 0.889 316 H PHE 41 H PHE 41 3.936 5.046 -2.625 317 HA PHE 41 HA PHE 41 2.113 3.284 -3.906 318 HB2 PHE 41 2HB PHE 41 2.401 5.497 -4.731 319 HB3 PHE 41 1HB PHE 41 4.154 5.325 -4.809 320 HD1 PHE 41 2HD PHE 41 0.951 4.417 -6.409 321 HD2 PHE 41 1HD PHE 41 5.234 4.206 -6.668 322 HE1 PHE 41 2HE PHE 41 0.772 3.668 -8.766 323 HE2 PHE 41 1HE PHE 41 5.055 3.458 -9.026 324 HZ PHE 41 HZ PHE 41 2.823 3.187 -10.075 325 H ARG 42 H ARG 42 5.515 3.046 -3.349 326 HA ARG 42 HA ARG 42 6.102 1.161 -5.513 327 HB2 ARG 42 2HB ARG 42 7.449 2.555 -3.274 328 HB3 ARG 42 1HB ARG 42 8.131 0.979 -3.676 329 HG2 ARG 42 2HG ARG 42 7.644 3.229 -5.653 330 HG3 ARG 42 1HG ARG 42 9.213 2.789 -4.975 331 HD2 ARG 42 2HD ARG 42 7.987 0.408 -6.002 332 HD3 ARG 42 1HD ARG 42 7.945 1.658 -7.261 333 HE ARG 42 HE ARG 42 10.466 1.983 -6.376 334 HH11 ARG 42 1HH1 ARG 42 8.645 -0.680 -7.528 335 HH12 ARG 42 2HH1 ARG 42 10.013 -1.728 -7.697 336 HH21 ARG 42 1HH2 ARG 42 12.257 0.548 -6.355 337 HH22 ARG 42 2HH2 ARG 42 12.058 -1.032 -7.035 338 H ALA 43 H ALA 43 6.404 0.791 -1.971 339 HA ALA 43 HA ALA 43 6.484 -1.976 -1.764 340 HB1 ALA 43 1HB ALA 43 5.578 0.320 -0.140 341 HB2 ALA 43 2HB ALA 43 6.674 -0.994 0.291 342 HB3 ALA 43 3HB ALA 43 4.928 -1.238 0.367 343 H LEU 44 H LEU 44 3.527 0.033 -1.963 344 HA LEU 44 HA LEU 44 1.686 -2.173 -1.820 345 HB2 LEU 44 2HB LEU 44 1.604 0.662 -2.870 346 HB3 LEU 44 1HB LEU 44 0.182 -0.383 -2.917 347 HG LEU 44 HG LEU 44 1.648 -0.212 -0.332 348 HD11 LEU 44 1HD1 LEU 44 -0.236 1.865 -0.236 349 HD12 LEU 44 2HD1 LEU 44 0.649 2.123 -1.739 350 HD13 LEU 44 3HD1 LEU 44 1.518 2.036 -0.208 351 HD21 LEU 44 3HD2 LEU 44 -0.828 -0.098 0.404 352 HD22 LEU 44 1HD2 LEU 44 -0.277 -1.600 -0.336 353 HD23 LEU 44 2HD2 LEU 44 -1.211 -0.442 -1.282 354 H HIS 45 H HIS 45 3.117 -0.382 -4.549 355 HA HIS 45 HA HIS 45 1.820 -1.884 -6.634 356 HB2 HIS 45 2HB HIS 45 2.872 0.299 -6.979 357 HB3 HIS 45 1HB HIS 45 4.435 -0.343 -6.471 358 HD1 HIS 45 1HD HIS 45 1.803 -1.265 -9.091 359 HD2 HIS 45 2HD HIS 45 5.945 -1.083 -8.656 360 HE1 HIS 45 1HE HIS 45 2.786 -1.951 -11.320 361 H THR 46 H THR 46 4.690 -2.336 -4.668 362 HA THR 46 HA THR 46 5.710 -4.600 -6.213 363 HB THR 46 HB THR 46 6.440 -2.885 -3.941 364 HG1 THR 46 1HG THR 46 7.779 -2.729 -5.574 365 HG21 THR 46 3HG2 THR 46 6.310 -4.823 -2.558 366 HG22 THR 46 1HG2 THR 46 8.014 -4.645 -2.979 367 HG23 THR 46 2HG2 THR 46 7.022 -5.848 -3.805 368 H LEU 47 H LEU 47 3.932 -4.101 -3.156 369 HA LEU 47 HA LEU 47 3.736 -6.923 -2.505 370 HB2 LEU 47 2HB LEU 47 2.758 -4.292 -1.562 371 HB3 LEU 47 1HB LEU 47 1.695 -5.649 -1.187 372 HG LEU 47 HG LEU 47 4.593 -6.085 -0.706 373 HD11 LEU 47 1HD1 LEU 47 4.655 -3.983 0.293 374 HD12 LEU 47 2HD1 LEU 47 4.094 -4.973 1.641 375 HD13 LEU 47 3HD1 LEU 47 2.941 -4.017 0.709 376 HD21 LEU 47 3HD2 LEU 47 3.776 -7.437 1.066 377 HD22 LEU 47 1HD2 LEU 47 2.596 -7.657 -0.225 378 HD23 LEU 47 2HD2 LEU 47 2.238 -6.577 1.123 379 H LYS 48 H LYS 48 1.764 -4.605 -4.311 380 HA LYS 48 HA LYS 48 -0.633 -6.135 -4.568 381 HB2 LYS 48 2HB LYS 48 -0.453 -3.765 -5.079 382 HB3 LYS 48 1HB LYS 48 0.765 -4.083 -6.313 383 HG2 LYS 48 2HG LYS 48 -1.312 -5.709 -7.109 384 HG3 LYS 48 1HG LYS 48 -2.152 -4.295 -6.475 385 HD2 LYS 48 2HD LYS 48 -1.766 -3.587 -8.642 386 HD3 LYS 48 1HD LYS 48 -0.304 -2.993 -7.848 387 HE2 LYS 48 2HE LYS 48 0.706 -5.316 -8.455 388 HE3 LYS 48 1HE LYS 48 -0.629 -5.409 -9.622 389 HZ1 LYS 48 3HZ LYS 48 0.017 -3.128 -10.347 390 HZ2 LYS 48 1HZ LYS 48 1.175 -4.316 -10.702 391 HZ3 LYS 48 2HZ LYS 48 1.412 -3.264 -9.389 392 H GLY 49 H GLY 49 2.392 -6.060 -6.442 393 HA2 GLY 49 2HA GLY 49 1.473 -7.854 -8.516 394 HA3 GLY 49 1HA GLY 49 3.157 -7.448 -8.181 395 H MET 50 H MET 50 3.312 -8.295 -5.498 396 HA MET 50 HA MET 50 3.804 -11.103 -5.803 397 HB2 MET 50 2HB MET 50 3.546 -9.214 -3.447 398 HB3 MET 50 1HB MET 50 4.030 -10.900 -3.258 399 HG2 MET 50 2HG MET 50 5.760 -10.293 -5.163 400 HG3 MET 50 1HG MET 50 5.497 -8.648 -4.584 401 HE1 MET 50 3HE MET 50 4.647 -8.977 -1.897 402 HE2 MET 50 1HE MET 50 6.063 -7.918 -1.859 403 HE3 MET 50 2HE MET 50 5.935 -9.262 -0.727 404 H ALA 51 H ALA 51 0.928 -9.332 -5.139 405 HA ALA 51 HA ALA 51 -0.436 -11.592 -3.799 406 HB1 ALA 51 1HB ALA 51 -1.112 -8.748 -4.574 407 HB2 ALA 51 2HB ALA 51 -0.945 -9.428 -2.954 408 HB3 ALA 51 3HB ALA 51 -2.340 -9.848 -3.947 409 H GLY 52 H GLY 52 -0.038 -10.221 -6.965 410 HA2 GLY 52 2HA GLY 52 -2.406 -11.618 -8.051 411 HA3 GLY 52 1HA GLY 52 -1.314 -10.569 -8.962 412 H THR 53 H THR 53 0.989 -12.016 -7.635 413 HA THR 53 HA THR 53 1.248 -14.136 -9.658 414 HB THR 53 HB THR 53 2.974 -12.681 -7.677 415 HG1 THR 53 1HG THR 53 3.929 -11.996 -9.478 416 HG21 THR 53 3HG2 THR 53 3.573 -15.067 -7.438 417 HG22 THR 53 1HG2 THR 53 4.865 -14.149 -8.209 418 HG23 THR 53 2HG2 THR 53 3.810 -15.173 -9.183 419 H MET 54 H MET 54 0.209 -13.842 -6.463 420 HA MET 54 HA MET 54 0.891 -16.658 -5.766 421 HB2 MET 54 2HB MET 54 0.913 -14.233 -4.383 422 HB3 MET 54 1HB MET 54 -0.525 -15.056 -3.777 423 HG2 MET 54 2HG MET 54 0.685 -16.694 -2.750 424 HG3 MET 54 1HG MET 54 1.877 -16.763 -4.048 425 HE1 MET 54 3HE MET 54 3.082 -14.375 -4.613 426 HE2 MET 54 1HE MET 54 4.182 -15.612 -3.986 427 HE3 MET 54 2HE MET 54 4.299 -13.951 -3.411 428 H GLY 55 H GLY 55 -1.469 -15.202 -7.430 429 HA2 GLY 55 2HA GLY 55 -3.568 -16.113 -8.066 430 HA3 GLY 55 1HA GLY 55 -3.428 -17.279 -6.749 431 H PHE 56 H PHE 56 -2.701 -14.427 -5.323 432 HA PHE 56 HA PHE 56 -5.500 -14.111 -4.342 433 HB2 PHE 56 2HB PHE 56 -2.823 -13.091 -3.332 434 HB3 PHE 56 1HB PHE 56 -4.359 -12.959 -2.474 435 HD1 PHE 56 1HD PHE 56 -5.483 -15.677 -3.313 436 HD2 PHE 56 2HD PHE 56 -1.654 -14.497 -1.766 437 HE1 PHE 56 1HE PHE 56 -5.160 -17.950 -2.378 438 HE2 PHE 56 2HE PHE 56 -1.331 -16.772 -0.831 439 HZ PHE 56 HZ PHE 56 -3.084 -18.497 -1.138 440 H SER 57 H SER 57 -5.673 -13.024 -6.693 441 HA SER 57 HA SER 57 -4.571 -10.374 -7.007 442 HB2 SER 57 2HB SER 57 -7.066 -11.376 -8.335 443 HB3 SER 57 1HB SER 57 -5.772 -10.398 -9.020 444 HG SER 57 HG SER 57 -4.441 -12.205 -8.980 445 H SER 58 H SER 58 -7.411 -11.650 -5.511 446 HA SER 58 HA SER 58 -9.048 -9.310 -5.416 447 HB2 SER 58 2HB SER 58 -9.048 -11.955 -4.445 448 HB3 SER 58 1HB SER 58 -9.128 -10.944 -3.005 449 HG SER 58 HG SER 58 -11.027 -10.189 -3.625 450 H MET 59 H MET 59 -6.392 -10.508 -3.442 451 HA MET 59 HA MET 59 -6.519 -8.224 -1.600 452 HB2 MET 59 2HB MET 59 -5.933 -10.490 -0.840 453 HB3 MET 59 1HB MET 59 -4.590 -10.537 -1.977 454 HG2 MET 59 2HG MET 59 -3.842 -8.336 -0.741 455 HG3 MET 59 1HG MET 59 -4.877 -8.939 0.553 456 HE1 MET 59 3HE MET 59 -1.273 -10.754 -1.431 457 HE2 MET 59 1HE MET 59 -2.689 -9.960 -2.134 458 HE3 MET 59 2HE MET 59 -2.728 -11.685 -1.778 459 H ALA 60 H ALA 60 -4.970 -9.157 -4.552 460 HA ALA 60 HA ALA 60 -2.746 -7.266 -4.336 461 HB1 ALA 60 1HB ALA 60 -3.912 -8.600 -6.800 462 HB2 ALA 60 2HB ALA 60 -2.862 -9.454 -5.673 463 HB3 ALA 60 3HB ALA 60 -2.253 -8.060 -6.562 464 H LYS 61 H LYS 61 -5.993 -7.343 -5.766 465 HA LYS 61 HA LYS 61 -5.696 -4.797 -7.153 466 HB2 LYS 61 2HB LYS 61 -8.149 -6.317 -6.174 467 HB3 LYS 61 1HB LYS 61 -8.143 -5.057 -7.410 468 HG2 LYS 61 2HG LYS 61 -7.286 -6.444 -9.010 469 HG3 LYS 61 1HG LYS 61 -6.265 -7.307 -7.857 470 HD2 LYS 61 2HD LYS 61 -7.950 -8.862 -8.568 471 HD3 LYS 61 1HD LYS 61 -8.390 -8.354 -6.936 472 HE2 LYS 61 2HE LYS 61 -10.337 -7.461 -7.666 473 HE3 LYS 61 1HE LYS 61 -9.506 -6.560 -8.950 474 HZ1 LYS 61 3HZ LYS 61 -11.096 -8.510 -9.571 475 HZ2 LYS 61 1HZ LYS 61 -9.764 -9.481 -9.170 476 HZ3 LYS 61 2HZ LYS 61 -9.626 -8.319 -10.401 477 H LEU 62 H LEU 62 -6.362 -5.894 -3.954 478 HA LEU 62 HA LEU 62 -7.627 -3.515 -2.901 479 HB2 LEU 62 2HB LEU 62 -7.846 -5.675 -1.831 480 HB3 LEU 62 1HB LEU 62 -6.091 -5.872 -1.761 481 HG LEU 62 HG LEU 62 -5.873 -4.139 -0.130 482 HD11 LEU 62 1HD1 LEU 62 -7.421 -2.510 -1.060 483 HD12 LEU 62 2HD1 LEU 62 -7.875 -2.820 0.615 484 HD13 LEU 62 3HD1 LEU 62 -8.795 -3.556 -0.698 485 HD21 LEU 62 3HD2 LEU 62 -6.804 -6.364 0.643 486 HD22 LEU 62 1HD2 LEU 62 -8.406 -5.630 0.609 487 HD23 LEU 62 2HD2 LEU 62 -7.173 -5.008 1.707 488 H CYS 63 H CYS 63 -4.302 -4.730 -3.183 489 HA CYS 63 HA CYS 63 -3.088 -2.559 -1.668 490 HB2 CYS 63 2HB CYS 63 -2.189 -4.811 -3.458 491 HB3 CYS 63 1HB CYS 63 -1.029 -3.600 -2.910 492 HG CYS 63 HG CYS 63 -1.007 -4.686 -0.689 493 H HIS 64 H HIS 64 -3.687 -3.227 -5.119 494 HA HIS 64 HA HIS 64 -2.117 -1.066 -6.178 495 HB2 HIS 64 2HB HIS 64 -3.035 -2.995 -7.456 496 HB3 HIS 64 1HB HIS 64 -4.663 -2.371 -7.202 497 HD1 HIS 64 1HD HIS 64 -5.498 -0.748 -8.911 498 HD2 HIS 64 2HD HIS 64 -1.339 -1.028 -8.953 499 HE1 HIS 64 1HE HIS 64 -4.704 0.679 -10.847 500 H THR 65 H THR 65 -5.357 -1.299 -4.857 501 HA THR 65 HA THR 65 -6.343 1.249 -5.718 502 HB THR 65 HB THR 65 -7.036 -0.976 -3.941 503 HG1 THR 65 1HG THR 65 -7.989 -0.327 -5.980 504 HG21 THR 65 3HG2 THR 65 -8.604 0.251 -2.519 505 HG22 THR 65 1HG2 THR 65 -8.060 1.779 -3.209 506 HG23 THR 65 2HG2 THR 65 -6.958 0.811 -2.233 507 H LEU 66 H LEU 66 -4.919 0.238 -2.573 508 HA LEU 66 HA LEU 66 -4.858 2.814 -1.342 509 HB2 LEU 66 2HB LEU 66 -2.700 0.712 -1.042 510 HB3 LEU 66 1HB LEU 66 -3.348 1.788 0.189 511 HG LEU 66 HG LEU 66 -4.664 -0.644 -1.032 512 HD11 LEU 66 1HD1 LEU 66 -4.241 0.138 1.855 513 HD12 LEU 66 2HD1 LEU 66 -3.083 -0.825 0.937 514 HD13 LEU 66 3HD1 LEU 66 -4.710 -1.441 1.226 515 HD21 LEU 66 3HD2 LEU 66 -6.738 0.104 -0.496 516 HD22 LEU 66 1HD2 LEU 66 -6.023 1.713 -0.434 517 HD23 LEU 66 2HD2 LEU 66 -6.181 0.761 1.039 518 H GLU 67 H GLU 67 -2.484 1.135 -3.399 519 HA GLU 67 HA GLU 67 -0.491 3.213 -3.380 520 HB2 GLU 67 2HB GLU 67 0.534 1.384 -4.237 521 HB3 GLU 67 1HB GLU 67 -1.022 0.600 -4.489 522 HG2 GLU 67 2HG GLU 67 -1.223 1.966 -6.631 523 HG3 GLU 67 1HG GLU 67 0.467 2.414 -6.401 524 H ASN 68 H ASN 68 -3.462 2.789 -5.125 525 HA ASN 68 HA ASN 68 -2.897 4.410 -7.426 526 HB2 ASN 68 2HB ASN 68 -5.022 2.990 -6.244 527 HB3 ASN 68 1HB ASN 68 -5.581 4.655 -6.387 528 HD21 ASN 68 1HD2 ASN 68 -3.583 2.472 -8.474 529 HD22 ASN 68 2HD2 ASN 68 -4.453 2.801 -9.895 530 H ILE 69 H ILE 69 -4.212 5.115 -4.214 531 HA ILE 69 HA ILE 69 -4.634 7.912 -4.618 532 HB ILE 69 HB ILE 69 -4.196 6.064 -2.286 533 HG12 ILE 69 2HG1 ILE 69 -6.580 6.735 -1.882 534 HG13 ILE 69 1HG1 ILE 69 -6.514 7.649 -3.386 535 HG21 ILE 69 1HG2 ILE 69 -4.600 7.866 -0.743 536 HG22 ILE 69 2HG2 ILE 69 -4.912 9.000 -2.056 537 HG23 ILE 69 3HG2 ILE 69 -3.280 8.385 -1.790 538 HD11 ILE 69 3HD1 ILE 69 -7.476 5.313 -3.599 539 HD12 ILE 69 1HD1 ILE 69 -5.865 4.704 -3.221 540 HD13 ILE 69 2HD1 ILE 69 -6.126 5.670 -4.677 541 H LEU 70 H LEU 70 -2.008 5.969 -3.566 542 HA LEU 70 HA LEU 70 -0.222 8.198 -2.991 543 HB2 LEU 70 2HB LEU 70 0.445 5.290 -3.541 544 HB3 LEU 70 1HB LEU 70 1.414 6.442 -2.621 545 HG LEU 70 HG LEU 70 -1.258 5.257 -1.865 546 HD11 LEU 70 1HD1 LEU 70 0.913 5.382 0.093 547 HD12 LEU 70 2HD1 LEU 70 1.332 4.450 -1.345 548 HD13 LEU 70 3HD1 LEU 70 -0.085 4.011 -0.391 549 HD21 LEU 70 3HD2 LEU 70 -0.062 7.845 -1.160 550 HD22 LEU 70 1HD2 LEU 70 -0.472 6.859 0.243 551 HD23 LEU 70 2HD2 LEU 70 -1.716 7.277 -0.936 552 H ASP 71 H ASP 71 -1.374 6.665 -5.765 553 HA ASP 71 HA ASP 71 0.989 7.276 -7.414 554 HB2 ASP 71 2HB ASP 71 -0.433 5.293 -7.848 555 HB3 ASP 71 1HB ASP 71 -1.829 6.343 -8.079 556 H LYS 72 H LYS 72 -2.286 8.536 -6.792 557 HA LYS 72 HA LYS 72 -2.134 10.686 -8.719 558 HB2 LYS 72 2HB LYS 72 -3.741 9.956 -6.297 559 HB3 LYS 72 1HB LYS 72 -3.903 11.567 -6.989 560 HG2 LYS 72 2HG LYS 72 -5.561 10.333 -8.088 561 HG3 LYS 72 1HG LYS 72 -4.219 10.346 -9.230 562 HD2 LYS 72 2HD LYS 72 -4.855 8.106 -9.186 563 HD3 LYS 72 1HD LYS 72 -3.512 8.174 -8.056 564 HE2 LYS 72 2HE LYS 72 -5.260 6.934 -6.943 565 HE3 LYS 72 1HE LYS 72 -5.255 8.552 -6.215 566 HZ1 LYS 72 3HZ LYS 72 -7.386 8.644 -6.849 567 HZ2 LYS 72 1HZ LYS 72 -7.241 7.314 -7.891 568 HZ3 LYS 72 2HZ LYS 72 -6.795 8.864 -8.427 569 H ALA 73 H ALA 73 -1.410 10.213 -5.371 570 HA ALA 73 HA ALA 73 -0.620 12.855 -4.619 571 HB1 ALA 73 1HB ALA 73 0.131 10.034 -3.811 572 HB2 ALA 73 2HB ALA 73 -0.956 11.144 -2.968 573 HB3 ALA 73 3HB ALA 73 0.783 11.442 -2.967 574 H ARG 74 H ARG 74 0.863 10.256 -6.379 575 HA ARG 74 HA ARG 74 3.490 11.603 -6.529 576 HB2 ARG 74 2HB ARG 74 4.077 9.408 -6.565 577 HB3 ARG 74 1HB ARG 74 2.389 8.935 -6.710 578 HG2 ARG 74 2HG ARG 74 2.474 9.111 -9.117 579 HG3 ARG 74 1HG ARG 74 4.092 9.813 -9.056 580 HD2 ARG 74 2HD ARG 74 3.475 7.061 -7.941 581 HD3 ARG 74 1HD ARG 74 4.035 7.322 -9.605 582 HE ARG 74 HE ARG 74 5.579 8.218 -7.197 583 HH11 ARG 74 1HH1 ARG 74 5.535 8.392 -10.530 584 HH12 ARG 74 2HH1 ARG 74 7.133 7.767 -10.770 585 HH21 ARG 74 1HH2 ARG 74 7.558 6.856 -7.450 586 HH22 ARG 74 2HH2 ARG 74 8.280 6.899 -9.024 587 H ASN 75 H ASN 75 0.506 11.292 -8.254 588 HA ASN 75 HA ASN 75 1.656 12.040 -10.866 589 HB2 ASN 75 2HB ASN 75 -0.667 10.800 -9.878 590 HB3 ASN 75 1HB ASN 75 -1.222 12.345 -10.525 591 HD21 ASN 75 1HD2 ASN 75 -2.178 11.511 -12.472 592 HD22 ASN 75 2HD2 ASN 75 -1.264 10.771 -13.696 593 H SER 76 H SER 76 -0.846 13.459 -8.796 594 HA SER 76 HA SER 76 0.014 15.909 -8.037 595 HB2 SER 76 2HB SER 76 0.985 16.527 -10.100 596 HB3 SER 76 1HB SER 76 -0.340 15.840 -11.034 597 HG SER 76 HG SER 76 -1.247 17.723 -10.941 598 H GLU 77 H GLU 77 -2.378 13.936 -8.079 599 HA GLU 77 HA GLU 77 -4.492 15.982 -8.491 600 HB2 GLU 77 2HB GLU 77 -5.552 14.367 -9.635 601 HB3 GLU 77 1HB GLU 77 -4.098 13.393 -9.449 602 HG2 GLU 77 2HG GLU 77 -5.708 12.010 -8.553 603 HG3 GLU 77 1HG GLU 77 -5.105 12.821 -7.118 604 H ILE 78 H ILE 78 -3.307 13.593 -6.192 605 HA ILE 78 HA ILE 78 -5.018 14.978 -4.135 606 HB ILE 78 HB ILE 78 -5.458 12.707 -3.185 607 HG12 ILE 78 2HG1 ILE 78 -4.941 11.013 -5.297 608 HG13 ILE 78 1HG1 ILE 78 -3.512 12.048 -5.270 609 HG21 ILE 78 1HG2 ILE 78 -6.557 13.907 -5.498 610 HG22 ILE 78 2HG2 ILE 78 -7.327 12.721 -4.445 611 HG23 ILE 78 3HG2 ILE 78 -6.418 12.185 -5.859 612 HD11 ILE 78 3HD1 ILE 78 -4.129 11.394 -2.584 613 HD12 ILE 78 1HD1 ILE 78 -2.720 10.918 -3.532 614 HD13 ILE 78 2HD1 ILE 78 -4.159 9.898 -3.520 615 H LYS 79 H LYS 79 -4.310 13.911 -1.864 616 HA LYS 79 HA LYS 79 -1.439 13.369 -1.629 617 HB2 LYS 79 2HB LYS 79 -1.250 15.466 -0.138 618 HB3 LYS 79 1HB LYS 79 -1.298 15.724 -1.882 619 HG2 LYS 79 2HG LYS 79 -3.219 16.889 -1.726 620 HG3 LYS 79 1HG LYS 79 -3.975 15.618 -0.764 621 HD2 LYS 79 2HD LYS 79 -1.913 17.164 0.658 622 HD3 LYS 79 1HD LYS 79 -3.338 18.095 0.201 623 HE2 LYS 79 2HE LYS 79 -3.956 15.432 1.314 624 HE3 LYS 79 1HE LYS 79 -3.189 16.547 2.462 625 HZ1 LYS 79 3HZ LYS 79 -5.357 17.236 2.605 626 HZ2 LYS 79 1HZ LYS 79 -5.716 16.843 0.996 627 HZ3 LYS 79 2HZ LYS 79 -4.816 18.241 1.346 628 H ILE 80 H ILE 80 -0.876 13.121 0.770 629 HA ILE 80 HA ILE 80 -2.908 11.577 2.102 630 HB ILE 80 HB ILE 80 -0.177 12.615 2.713 631 HG12 ILE 80 2HG1 ILE 80 0.312 10.199 2.759 632 HG13 ILE 80 1HG1 ILE 80 -1.402 9.858 2.524 633 HG21 ILE 80 1HG2 ILE 80 -0.372 11.176 4.839 634 HG22 ILE 80 2HG2 ILE 80 -2.118 11.316 4.615 635 HG23 ILE 80 3HG2 ILE 80 -1.141 12.761 4.874 636 HD11 ILE 80 3HD1 ILE 80 0.293 11.460 0.585 637 HD12 ILE 80 1HD1 ILE 80 -1.372 10.930 0.346 638 HD13 ILE 80 2HD1 ILE 80 -0.070 9.743 0.399 639 H THR 81 H THR 81 -4.625 12.824 2.494 640 HA THR 81 HA THR 81 -4.379 15.325 4.094 641 HB THR 81 HB THR 81 -5.689 15.178 1.953 642 HG1 THR 81 1HG THR 81 -6.322 16.343 4.134 643 HG21 THR 81 3HG2 THR 81 -6.406 12.813 2.338 644 HG22 THR 81 1HG2 THR 81 -7.711 13.891 1.855 645 HG23 THR 81 2HG2 THR 81 -7.546 13.411 3.543 646 H SER 82 H SER 82 -4.178 12.343 4.982 647 HA SER 82 HA SER 82 -4.701 11.236 7.015 648 HB2 SER 82 2HB SER 82 -4.898 13.731 7.717 649 HB3 SER 82 1HB SER 82 -6.636 13.473 7.584 650 HG SER 82 HG SER 82 -4.780 12.074 9.214 651 H ASP 83 H ASP 83 -6.763 12.013 4.509 652 HA ASP 83 HA ASP 83 -8.965 10.253 5.506 653 HB2 ASP 83 2HB ASP 83 -8.908 12.179 3.160 654 HB3 ASP 83 1HB ASP 83 -10.333 11.449 3.901 655 H LEU 84 H LEU 84 -6.878 11.040 2.713 656 HA LEU 84 HA LEU 84 -7.629 8.774 1.101 657 HB2 LEU 84 2HB LEU 84 -5.051 10.376 1.326 658 HB3 LEU 84 1HB LEU 84 -5.470 9.324 -0.026 659 HG LEU 84 HG LEU 84 -6.924 11.825 0.856 660 HD11 LEU 84 1HD1 LEU 84 -6.142 11.432 -1.953 661 HD12 LEU 84 2HD1 LEU 84 -4.778 11.511 -0.838 662 HD13 LEU 84 3HD1 LEU 84 -5.932 12.842 -0.914 663 HD21 LEU 84 3HD2 LEU 84 -8.727 10.527 0.216 664 HD22 LEU 84 1HD2 LEU 84 -7.752 9.509 -0.843 665 HD23 LEU 84 2HD2 LEU 84 -8.227 11.125 -1.367 666 H LEU 85 H LEU 85 -5.520 9.280 3.812 667 HA LEU 85 HA LEU 85 -4.138 6.699 3.649 668 HB2 LEU 85 2HB LEU 85 -4.472 8.915 5.688 669 HB3 LEU 85 1HB LEU 85 -3.523 7.470 6.031 670 HG LEU 85 HG LEU 85 -3.025 9.572 3.927 671 HD11 LEU 85 1HD1 LEU 85 -1.576 8.484 6.341 672 HD12 LEU 85 2HD1 LEU 85 -2.044 10.153 6.011 673 HD13 LEU 85 3HD1 LEU 85 -0.729 9.404 5.098 674 HD21 LEU 85 3HD2 LEU 85 -2.177 6.708 4.060 675 HD22 LEU 85 1HD2 LEU 85 -0.965 7.891 3.567 676 HD23 LEU 85 2HD2 LEU 85 -2.462 7.726 2.648 677 H ASP 86 H ASP 86 -6.695 8.195 5.591 678 HA ASP 86 HA ASP 86 -7.336 6.216 7.428 679 HB2 ASP 86 2HB ASP 86 -8.400 8.534 6.790 680 HB3 ASP 86 1HB ASP 86 -9.491 7.555 5.807 681 H LYS 87 H LYS 87 -8.351 6.312 4.004 682 HA LYS 87 HA LYS 87 -9.722 3.721 4.242 683 HB2 LYS 87 2HB LYS 87 -8.961 5.307 1.770 684 HB3 LYS 87 1HB LYS 87 -10.264 4.128 1.927 685 HG2 LYS 87 2HG LYS 87 -10.103 6.768 3.410 686 HG3 LYS 87 1HG LYS 87 -11.144 6.435 2.026 687 HD2 LYS 87 2HD LYS 87 -11.788 4.349 3.665 688 HD3 LYS 87 1HD LYS 87 -11.442 5.610 4.849 689 HE2 LYS 87 2HE LYS 87 -12.948 6.933 2.903 690 HE3 LYS 87 1HE LYS 87 -13.740 5.353 3.068 691 HZ1 LYS 87 3HZ LYS 87 -13.572 5.645 5.511 692 HZ2 LYS 87 1HZ LYS 87 -14.591 6.780 4.769 693 HZ3 LYS 87 2HZ LYS 87 -13.027 7.233 5.254 694 H ILE 88 H ILE 88 -6.701 4.969 2.798 695 HA ILE 88 HA ILE 88 -5.838 2.498 1.627 696 HB ILE 88 HB ILE 88 -4.776 5.146 2.360 697 HG12 ILE 88 2HG1 ILE 88 -3.706 3.621 0.081 698 HG13 ILE 88 1HG1 ILE 88 -5.455 3.856 0.086 699 HG21 ILE 88 1HG2 ILE 88 -2.377 4.343 1.944 700 HG22 ILE 88 2HG2 ILE 88 -2.968 2.724 2.318 701 HG23 ILE 88 3HG2 ILE 88 -3.049 3.996 3.537 702 HD11 ILE 88 3HD1 ILE 88 -4.300 6.323 0.873 703 HD12 ILE 88 1HD1 ILE 88 -5.149 5.964 -0.630 704 HD13 ILE 88 2HD1 ILE 88 -3.399 5.767 -0.539 705 H PHE 89 H PHE 89 -5.219 3.982 4.788 706 HA PHE 89 HA PHE 89 -3.650 1.866 5.884 707 HB2 PHE 89 2HB PHE 89 -3.743 4.144 6.789 708 HB3 PHE 89 1HB PHE 89 -5.463 3.950 7.130 709 HD1 PHE 89 2HD PHE 89 -2.807 1.389 7.599 710 HD2 PHE 89 1HD PHE 89 -5.479 4.155 9.512 711 HE1 PHE 89 2HE PHE 89 -2.255 0.396 9.804 712 HE2 PHE 89 1HE PHE 89 -4.927 3.163 11.717 713 HZ PHE 89 HZ PHE 89 -3.316 1.282 11.863 714 H ALA 90 H ALA 90 -7.048 2.399 5.549 715 HA ALA 90 HA ALA 90 -7.860 0.210 7.305 716 HB1 ALA 90 1HB ALA 90 -9.944 0.807 5.546 717 HB2 ALA 90 2HB ALA 90 -9.046 2.323 5.642 718 HB3 ALA 90 3HB ALA 90 -9.681 1.579 7.109 719 H GLY 91 H GLY 91 -7.073 0.756 3.948 720 HA2 GLY 91 2HA GLY 91 -8.057 -1.795 2.970 721 HA3 GLY 91 1HA GLY 91 -6.956 -0.709 2.113 722 H VAL 92 H VAL 92 -4.932 -0.457 4.011 723 HA VAL 92 HA VAL 92 -3.398 -2.870 3.602 724 HB VAL 92 HB VAL 92 -3.162 -0.285 5.127 725 HG11 VAL 92 1HG1 VAL 92 -1.746 -2.801 5.735 726 HG12 VAL 92 2HG1 VAL 92 -1.920 -1.344 6.712 727 HG13 VAL 92 3HG1 VAL 92 -0.684 -1.420 5.457 728 HG21 VAL 92 3HG2 VAL 92 -2.608 -0.258 2.768 729 HG22 VAL 92 1HG2 VAL 92 -1.564 -1.667 2.952 730 HG23 VAL 92 2HG2 VAL 92 -1.107 -0.129 3.682 731 H ASP 93 H ASP 93 -5.716 -1.829 5.941 732 HA ASP 93 HA ASP 93 -4.841 -3.583 8.118 733 HB2 ASP 93 2HB ASP 93 -6.349 -1.336 7.912 734 HB3 ASP 93 1HB ASP 93 -7.630 -2.549 7.899 735 H MET 94 H MET 94 -6.924 -3.803 5.314 736 HA MET 94 HA MET 94 -8.336 -6.204 6.203 737 HB2 MET 94 2HB MET 94 -8.008 -5.285 3.349 738 HB3 MET 94 1HB MET 94 -9.421 -6.006 4.117 739 HG2 MET 94 2HG MET 94 -9.226 -3.792 5.627 740 HG3 MET 94 1HG MET 94 -8.480 -3.181 4.151 741 HE1 MET 94 3HE MET 94 -10.807 -3.383 1.438 742 HE2 MET 94 1HE MET 94 -10.481 -5.075 1.841 743 HE3 MET 94 2HE MET 94 -9.210 -3.865 2.007 744 H ILE 95 H ILE 95 -5.700 -5.509 3.861 745 HA ILE 95 HA ILE 95 -5.202 -8.186 3.079 746 HB ILE 95 HB ILE 95 -3.006 -7.173 2.455 747 HG12 ILE 95 2HG1 ILE 95 -4.038 -4.625 3.682 748 HG13 ILE 95 1HG1 ILE 95 -2.976 -5.713 4.576 749 HG21 ILE 95 1HG2 ILE 95 -5.069 -6.866 1.081 750 HG22 ILE 95 2HG2 ILE 95 -3.914 -5.544 0.911 751 HG23 ILE 95 3HG2 ILE 95 -5.343 -5.341 1.924 752 HD11 ILE 95 3HD1 ILE 95 -1.332 -5.581 2.698 753 HD12 ILE 95 1HD1 ILE 95 -1.615 -4.021 3.472 754 HD13 ILE 95 2HD1 ILE 95 -2.369 -4.387 1.919 755 H THR 96 H THR 96 -4.208 -6.289 5.886 756 HA THR 96 HA THR 96 -2.213 -8.122 6.884 757 HB THR 96 HB THR 96 -3.992 -5.986 8.100 758 HG1 THR 96 1HG THR 96 -1.974 -5.775 6.615 759 HG21 THR 96 3HG2 THR 96 -1.975 -6.299 9.899 760 HG22 THR 96 1HG2 THR 96 -2.222 -7.971 9.394 761 HG23 THR 96 2HG2 THR 96 -3.563 -7.047 10.071 762 H ARG 97 H ARG 97 -5.710 -7.713 7.312 763 HA ARG 97 HA ARG 97 -5.939 -9.964 9.182 764 HB2 ARG 97 2HB ARG 97 -7.855 -8.189 7.647 765 HB3 ARG 97 1HB ARG 97 -8.421 -9.504 8.677 766 HG2 ARG 97 2HG ARG 97 -7.704 -8.472 10.630 767 HG3 ARG 97 1HG ARG 97 -6.458 -7.539 9.800 768 HD2 ARG 97 2HD ARG 97 -8.245 -6.168 8.717 769 HD3 ARG 97 1HD ARG 97 -9.455 -7.054 9.665 770 HE ARG 97 HE ARG 97 -7.270 -5.947 11.272 771 HH11 ARG 97 1HH1 ARG 97 -8.657 -3.665 9.828 772 HH12 ARG 97 2HH1 ARG 97 -9.888 -3.239 10.968 773 HH21 ARG 97 1HH2 ARG 97 -9.599 -6.177 12.783 774 HH22 ARG 97 2HH2 ARG 97 -10.422 -4.660 12.642 775 H MET 98 H MET 98 -6.261 -9.395 5.717 776 HA MET 98 HA MET 98 -7.482 -11.964 5.096 777 HB2 MET 98 2HB MET 98 -5.934 -9.915 3.468 778 HB3 MET 98 1HB MET 98 -6.837 -11.263 2.775 779 HG2 MET 98 2HG MET 98 -8.899 -10.358 3.352 780 HG3 MET 98 1HG MET 98 -8.225 -9.410 4.677 781 HE1 MET 98 3HE MET 98 -8.577 -8.397 0.264 782 HE2 MET 98 1HE MET 98 -9.540 -9.498 1.257 783 HE3 MET 98 2HE MET 98 -7.897 -9.933 0.795 784 H VAL 99 H VAL 99 -4.243 -10.662 5.426 785 HA VAL 99 HA VAL 99 -2.927 -13.026 4.329 786 HB VAL 99 HB VAL 99 -2.161 -10.454 5.701 787 HG11 VAL 99 1HG1 VAL 99 0.194 -11.093 5.647 788 HG12 VAL 99 2HG1 VAL 99 -0.220 -12.675 4.985 789 HG13 VAL 99 3HG1 VAL 99 -0.697 -12.256 6.631 790 HG21 VAL 99 3HG2 VAL 99 -0.650 -10.939 3.378 791 HG22 VAL 99 1HG2 VAL 99 -2.033 -9.855 3.531 792 HG23 VAL 99 2HG2 VAL 99 -2.273 -11.521 3.005 793 H ASP 100 H ASP 100 -3.810 -11.773 7.529 794 HA ASP 100 HA ASP 100 -2.328 -13.715 9.072 795 HB2 ASP 100 2HB ASP 100 -3.744 -11.457 9.590 796 HB3 ASP 100 1HB ASP 100 -4.957 -12.665 10.020 797 H LYS 101 H LYS 101 -5.361 -13.692 7.357 798 HA LYS 101 HA LYS 101 -6.178 -16.316 8.444 799 HB2 LYS 101 2HB LYS 101 -8.258 -15.651 7.753 800 HB3 LYS 101 1HB LYS 101 -7.514 -14.057 7.655 801 HG2 LYS 101 2HG LYS 101 -8.545 -14.366 5.539 802 HG3 LYS 101 1HG LYS 101 -6.837 -14.724 5.266 803 HD2 LYS 101 2HD LYS 101 -7.428 -16.717 4.493 804 HD3 LYS 101 1HD LYS 101 -7.964 -17.138 6.116 805 HE2 LYS 101 2HE LYS 101 -9.709 -15.703 4.079 806 HE3 LYS 101 1HE LYS 101 -9.786 -17.446 4.413 807 HZ1 LYS 101 3HZ LYS 101 -10.245 -15.222 6.324 808 HZ2 LYS 101 1HZ LYS 101 -10.036 -16.833 6.809 809 HZ3 LYS 101 2HZ LYS 101 -11.360 -16.407 5.832 810 H ILE 102 H ILE 102 -4.429 -14.962 5.794 811 HA ILE 102 HA ILE 102 -4.854 -17.183 3.939 812 HB ILE 102 HB ILE 102 -3.683 -14.576 4.010 813 HG12 ILE 102 2HG1 ILE 102 -3.681 -16.226 1.530 814 HG13 ILE 102 1HG1 ILE 102 -5.226 -15.935 2.330 815 HG21 ILE 102 1HG2 ILE 102 -1.692 -15.161 2.473 816 HG22 ILE 102 2HG2 ILE 102 -1.801 -16.776 3.172 817 HG23 ILE 102 3HG2 ILE 102 -1.468 -15.387 4.207 818 HD11 ILE 102 3HD1 ILE 102 -5.126 -13.637 1.992 819 HD12 ILE 102 1HD1 ILE 102 -4.317 -14.219 0.536 820 HD13 ILE 102 2HD1 ILE 102 -3.366 -13.626 1.897 821 H VAL 103 H VAL 103 -2.163 -16.058 5.997 822 HA VAL 103 HA VAL 103 -0.503 -18.371 5.704 823 HB VAL 103 HB VAL 103 -0.919 -16.221 7.798 824 HG11 VAL 103 1HG1 VAL 103 -0.020 -17.786 9.231 825 HG12 VAL 103 2HG1 VAL 103 1.476 -17.199 8.505 826 HG13 VAL 103 3HG1 VAL 103 0.744 -18.696 7.928 827 HG21 VAL 103 3HG2 VAL 103 1.062 -16.799 5.602 828 HG22 VAL 103 1HG2 VAL 103 1.514 -15.761 6.956 829 HG23 VAL 103 2HG2 VAL 103 0.160 -15.316 5.918 830 H SER 104 H SER 104 -3.347 -17.598 7.567 831 HA SER 104 HA SER 104 -3.199 -19.933 9.325 832 HB2 SER 104 2HB SER 104 -4.191 -17.702 9.900 833 HB3 SER 104 1HB SER 104 -5.452 -18.016 8.710 834 HG SER 104 HG SER 104 -5.651 -18.644 11.129 835 H GLU 105 H GLU 105 -5.549 -18.856 6.929 836 HA GLU 105 HA GLU 105 -6.340 -21.702 6.452 837 HB2 GLU 105 2HB GLU 105 -7.684 -19.238 5.340 838 HB3 GLU 105 1HB GLU 105 -8.402 -20.798 5.735 839 HG2 GLU 105 2HG GLU 105 -7.517 -20.128 8.183 840 HG3 GLU 105 1HG GLU 105 -7.748 -18.508 7.522 841 H GLY 106 H GLY 106 -5.334 -18.757 4.725 842 HA2 GLY 106 2HA GLY 106 -3.724 -18.976 2.859 843 HA3 GLY 106 1HA GLY 106 -4.509 -20.498 2.442 844 H SER 107 H SER 107 -6.499 -17.795 3.381 845 HA SER 107 HA SER 107 -7.134 -17.262 0.492 846 HB2 SER 107 2HB SER 107 -9.028 -17.847 2.770 847 HB3 SER 107 1HB SER 107 -9.527 -17.302 1.171 848 HG SER 107 HG SER 107 -7.794 -19.480 1.316 849 H ASP 108 H ASP 108 -7.081 -15.132 0.073 850 HA ASP 108 HA ASP 108 -6.903 -13.156 2.223 851 HB2 ASP 108 2HB ASP 108 -6.787 -11.600 0.287 852 HB3 ASP 108 1HB ASP 108 -5.671 -12.950 0.097 853 H ASP 109 H ASP 109 -9.456 -14.876 1.076 854 HA ASP 109 HA ASP 109 -11.414 -12.735 0.689 855 HB2 ASP 109 2HB ASP 109 -11.792 -15.693 1.239 856 HB3 ASP 109 1HB ASP 109 -12.936 -14.610 0.446 857 H ILE 110 H ILE 110 -11.847 -11.499 2.513 858 HA ILE 110 HA ILE 110 -12.554 -12.995 5.015 859 HB ILE 110 HB ILE 110 -11.573 -11.113 6.246 860 HG12 ILE 110 2HG1 ILE 110 -10.705 -9.961 3.591 861 HG13 ILE 110 1HG1 ILE 110 -12.208 -9.468 4.369 862 HG21 ILE 110 1HG2 ILE 110 -9.835 -12.287 4.062 863 HG22 ILE 110 2HG2 ILE 110 -9.988 -12.837 5.732 864 HG23 ILE 110 3HG2 ILE 110 -9.188 -11.306 5.376 865 HD11 ILE 110 3HD1 ILE 110 -9.773 -9.487 6.077 866 HD12 ILE 110 1HD1 ILE 110 -11.130 -8.361 6.066 867 HD13 ILE 110 2HD1 ILE 110 -9.864 -8.228 4.845 868 H GLY 111 H GLY 111 -14.204 -11.927 2.687 869 HA2 GLY 111 2HA GLY 111 -16.452 -11.149 2.674 870 HA3 GLY 111 1HA GLY 111 -16.252 -10.626 4.346 871 H GLU 112 H GLU 112 -13.586 -9.423 2.973 872 HA GLU 112 HA GLU 112 -14.618 -6.708 2.881 873 HB2 GLU 112 2HB GLU 112 -12.000 -8.100 2.325 874 HB3 GLU 112 1HB GLU 112 -12.184 -6.372 2.024 875 HG2 GLU 112 2HG GLU 112 -12.792 -7.722 4.670 876 HG3 GLU 112 1HG GLU 112 -11.292 -6.866 4.307 877 H ASN 113 H ASN 113 -14.068 -5.302 0.891 878 HA ASN 113 HA ASN 113 -14.723 -6.788 -1.631 879 HB2 ASN 113 2HB ASN 113 -15.577 -3.982 -0.920 880 HB3 ASN 113 1HB ASN 113 -16.234 -5.033 -2.176 881 HD21 ASN 113 1HD2 ASN 113 -17.989 -6.354 -1.601 882 HD22 ASN 113 2HD2 ASN 113 -18.538 -6.575 -0.010 883 H ILE 114 H ILE 114 -13.949 -5.707 -3.608 884 HA ILE 114 HA ILE 114 -11.529 -4.008 -3.105 885 HB ILE 114 HB ILE 114 -12.130 -6.337 -4.911 886 HG12 ILE 114 2HG1 ILE 114 -9.919 -7.048 -4.190 887 HG13 ILE 114 1HG1 ILE 114 -9.618 -5.477 -3.446 888 HG21 ILE 114 1HG2 ILE 114 -11.462 -4.824 -6.600 889 HG22 ILE 114 2HG2 ILE 114 -9.961 -5.638 -6.153 890 HG23 ILE 114 3HG2 ILE 114 -10.303 -4.018 -5.542 891 HD11 ILE 114 3HD1 ILE 114 -12.050 -6.987 -2.593 892 HD12 ILE 114 1HD1 ILE 114 -11.024 -5.893 -1.664 893 HD13 ILE 114 2HD1 ILE 114 -10.480 -7.537 -2.003 894 H ASP 115 H ASP 115 -13.337 -4.848 -6.072 895 HA ASP 115 HA ASP 115 -13.190 -2.360 -7.316 896 HB2 ASP 115 2HB ASP 115 -14.086 -4.310 -8.431 897 HB3 ASP 115 1HB ASP 115 -15.387 -4.442 -7.247 898 H VAL 116 H VAL 116 -15.093 -3.371 -4.641 899 HA VAL 116 HA VAL 116 -16.756 -0.945 -4.626 900 HB VAL 116 HB VAL 116 -16.547 -3.289 -2.728 901 HG11 VAL 116 1HG1 VAL 116 -18.659 -1.135 -3.046 902 HG12 VAL 116 2HG1 VAL 116 -17.566 -1.325 -1.677 903 HG13 VAL 116 3HG1 VAL 116 -18.804 -2.541 -1.992 904 HG21 VAL 116 3HG2 VAL 116 -18.161 -2.771 -5.215 905 HG22 VAL 116 1HG2 VAL 116 -18.817 -3.800 -3.942 906 HG23 VAL 116 2HG2 VAL 116 -17.304 -4.236 -4.735 907 H PHE 117 H PHE 117 -14.406 -2.530 -2.512 908 HA PHE 117 HA PHE 117 -14.226 -0.345 -0.631 909 HB2 PHE 117 2HB PHE 117 -13.507 -2.717 -0.261 910 HB3 PHE 117 1HB PHE 117 -12.168 -2.447 -1.378 911 HD1 PHE 117 2HD PHE 117 -13.669 -1.271 1.827 912 HD2 PHE 117 1HD PHE 117 -10.178 -1.361 -0.676 913 HE1 PHE 117 2HE PHE 117 -12.326 -0.281 3.662 914 HE2 PHE 117 1HE PHE 117 -8.838 -0.369 1.159 915 HZ PHE 117 HZ PHE 117 -9.911 0.170 3.327 916 H SER 118 H SER 118 -12.934 -0.864 -3.798 917 HA SER 118 HA SER 118 -10.851 1.183 -3.514 918 HB2 SER 118 2HB SER 118 -10.285 -0.730 -4.843 919 HB3 SER 118 1HB SER 118 -11.828 -0.670 -5.689 920 HG SER 118 HG SER 118 -9.953 0.214 -6.833 921 H ASP 119 H ASP 119 -13.900 0.579 -5.096 922 HA ASP 119 HA ASP 119 -14.131 3.079 -6.477 923 HB2 ASP 119 2HB ASP 119 -15.476 1.103 -7.019 924 HB3 ASP 119 1HB ASP 119 -16.191 1.129 -5.406 925 H THR 120 H THR 120 -14.705 2.030 -3.253 926 HA THR 120 HA THR 120 -16.264 4.258 -2.316 927 HB THR 120 HB THR 120 -14.818 1.907 -1.296 928 HG1 THR 120 1HG THR 120 -16.854 1.620 -0.940 929 HG21 THR 120 3HG2 THR 120 -13.542 3.360 0.057 930 HG22 THR 120 1HG2 THR 120 -14.884 2.875 1.093 931 HG23 THR 120 2HG2 THR 120 -14.898 4.457 0.313 932 H ILE 121 H ILE 121 -12.881 3.416 -2.067 933 HA ILE 121 HA ILE 121 -11.933 5.937 -1.090 934 HB ILE 121 HB ILE 121 -11.021 3.338 -1.808 935 HG12 ILE 121 2HG1 ILE 121 -10.696 4.787 0.276 936 HG13 ILE 121 1HG1 ILE 121 -9.328 3.793 -0.226 937 HG21 ILE 121 1HG2 ILE 121 -9.463 5.561 -3.133 938 HG22 ILE 121 2HG2 ILE 121 -10.098 4.093 -3.875 939 HG23 ILE 121 3HG2 ILE 121 -8.748 3.996 -2.744 940 HD11 ILE 121 3HD1 ILE 121 -9.455 6.503 -1.426 941 HD12 ILE 121 1HD1 ILE 121 -8.063 5.605 -0.821 942 HD13 ILE 121 2HD1 ILE 121 -9.124 6.451 0.305 943 H LYS 122 H LYS 122 -12.167 4.518 -4.353 944 HA LYS 122 HA LYS 122 -11.051 6.722 -5.790 945 HB2 LYS 122 2HB LYS 122 -12.522 4.209 -6.235 946 HB3 LYS 122 1HB LYS 122 -12.867 5.446 -7.446 947 HG2 LYS 122 2HG LYS 122 -10.899 4.965 -8.429 948 HG3 LYS 122 1HG LYS 122 -10.097 5.581 -6.985 949 HD2 LYS 122 2HD LYS 122 -11.084 2.930 -6.467 950 HD3 LYS 122 1HD LYS 122 -10.102 2.919 -7.931 951 HE2 LYS 122 2HE LYS 122 -8.783 4.587 -6.002 952 HE3 LYS 122 1HE LYS 122 -9.177 3.035 -5.234 953 HZ1 LYS 122 3HZ LYS 122 -8.288 1.897 -7.186 954 HZ2 LYS 122 1HZ LYS 122 -7.101 2.863 -6.454 955 HZ3 LYS 122 2HZ LYS 122 -7.864 3.389 -7.878 956 H SER 123 H SER 123 -14.255 5.936 -4.578 957 HA SER 123 HA SER 123 -15.609 8.127 -5.927 958 HB2 SER 123 2HB SER 123 -16.197 6.161 -3.736 959 HB3 SER 123 1HB SER 123 -17.324 7.470 -4.072 960 HG SER 123 HG SER 123 -17.284 5.219 -5.280 961 H PHE 124 H PHE 124 -13.618 7.767 -3.193 962 HA PHE 124 HA PHE 124 -14.671 10.010 -1.638 963 HB2 PHE 124 2HB PHE 124 -13.405 8.072 -0.708 964 HB3 PHE 124 1HB PHE 124 -11.981 8.610 -1.602 965 HD1 PHE 124 2HD PHE 124 -14.372 9.532 1.089 966 HD2 PHE 124 1HD PHE 124 -10.643 10.441 -0.837 967 HE1 PHE 124 2HE PHE 124 -13.809 11.107 2.922 968 HE2 PHE 124 1HE PHE 124 -10.079 12.016 0.994 969 HZ PHE 124 HZ PHE 124 -11.663 12.349 2.873 970 H ALA 125 H ALA 125 -13.136 9.863 -4.547 971 HA ALA 125 HA ALA 125 -11.999 12.612 -4.214 972 HB1 ALA 125 1HB ALA 125 -10.767 10.064 -5.167 973 HB2 ALA 125 2HB ALA 125 -10.037 11.390 -4.263 974 HB3 ALA 125 3HB ALA 125 -10.301 11.547 -5.999 975 H SER 126 H SER 126 -14.417 11.026 -5.582 976 HA SER 126 HA SER 126 -14.216 11.428 -8.402 977 HB2 SER 126 2HB SER 126 -15.914 10.042 -7.311 978 HB3 SER 126 1HB SER 126 -16.572 11.452 -6.486 979 HG SER 126 HG SER 126 -17.188 12.282 -8.472 980 H SER 127 H SER 127 -13.971 13.371 -9.433 981 HA SER 127 HA SER 127 -14.746 15.879 -8.050 982 HB2 SER 127 2HB SER 127 -12.543 15.258 -9.352 983 HB3 SER 127 1HB SER 127 -13.497 15.657 -10.778 984 HG SER 127 HG SER 127 -13.896 17.696 -9.845 985 H GLY 128 H GLY 128 -16.854 16.500 -8.367 986 HA2 GLY 128 2HA GLY 128 -18.121 15.922 -11.006 987 HA3 GLY 128 1HA GLY 128 -19.005 16.260 -9.517 988 H LYS 129 H LYS 129 -16.589 17.837 -11.637 989 HA LYS 129 HA LYS 129 -16.324 20.134 -12.161 990 HB2 LYS 129 2HB LYS 129 -19.210 19.364 -12.370 991 HB3 LYS 129 1HB LYS 129 -18.788 21.062 -12.597 992 HG2 LYS 129 2HG LYS 129 -17.443 20.610 -14.470 993 HG3 LYS 129 1HG LYS 129 -17.258 18.909 -14.043 994 HD2 LYS 129 2HD LYS 129 -19.910 18.926 -14.333 995 HD3 LYS 129 1HD LYS 129 -19.538 20.286 -15.394 996 HE2 LYS 129 2HE LYS 129 -17.641 18.482 -16.195 997 HE3 LYS 129 1HE LYS 129 -18.991 17.407 -15.782 998 HZ1 LYS 129 3HZ LYS 129 -19.632 18.036 -17.866 999 HZ2 LYS 129 1HZ LYS 129 -18.868 19.547 -17.780 1000 HZ3 LYS 129 2HZ LYS 129 -20.344 19.297 -16.977 1001 H GLU 130 H GLU 130 -16.276 19.631 -9.321 1002 HA GLU 130 HA GLU 130 -16.834 22.300 -8.330 1003 HB2 GLU 130 2HB GLU 130 -18.952 20.398 -8.378 1004 HB3 GLU 130 1HB GLU 130 -18.476 20.598 -6.690 1005 HG2 GLU 130 2HG GLU 130 -18.722 23.021 -6.867 1006 HG3 GLU 130 1HG GLU 130 -19.093 22.882 -8.587 1007 H LYS 131 H LYS 131 -14.677 22.133 -7.524 1008 HA LYS 131 HA LYS 131 -14.071 19.948 -5.597 1009 HB2 LYS 131 2HB LYS 131 -12.663 21.212 -7.603 1010 HB3 LYS 131 1HB LYS 131 -12.065 22.032 -6.161 1011 HG2 LYS 131 2HG LYS 131 -12.292 19.048 -6.105 1012 HG3 LYS 131 1HG LYS 131 -10.950 19.772 -6.993 1013 HD2 LYS 131 2HD LYS 131 -10.230 20.988 -5.014 1014 HD3 LYS 131 1HD LYS 131 -11.640 20.427 -4.115 1015 HE2 LYS 131 2HE LYS 131 -10.773 18.031 -4.673 1016 HE3 LYS 131 1HE LYS 131 -9.232 18.845 -5.007 1017 HZ1 LYS 131 3HZ LYS 131 -9.023 19.554 -2.866 1018 HZ2 LYS 131 1HZ LYS 131 -9.881 18.120 -2.574 1019 HZ3 LYS 131 2HZ LYS 131 -10.698 19.609 -2.591 1020 H LEU 132 H LEU 132 -15.845 22.491 -5.179 1021 HA LEU 132 HA LEU 132 -16.324 23.854 -3.305 1022 HB2 LEU 132 2HB LEU 132 -15.294 21.562 -2.354 1023 HB3 LEU 132 1HB LEU 132 -14.022 22.664 -1.825 1024 HG LEU 132 HG LEU 132 -16.402 23.997 -1.203 1025 HD11 LEU 132 1HD1 LEU 132 -17.665 21.923 -1.552 1026 HD12 LEU 132 2HD1 LEU 132 -17.623 22.319 0.167 1027 HD13 LEU 132 3HD1 LEU 132 -16.571 21.057 -0.473 1028 HD21 LEU 132 3HD2 LEU 132 -14.695 24.230 0.343 1029 HD22 LEU 132 1HD2 LEU 132 -14.259 22.523 0.274 1030 HD23 LEU 132 2HD2 LEU 132 -15.683 23.034 1.181 1031 H GLU 133 H GLU 133 -15.250 25.606 -1.937 1032 HA GLU 133 HA GLU 133 -13.884 27.534 -1.870 1033 HB2 GLU 133 2HB GLU 133 -12.392 25.230 -1.598 1034 HB3 GLU 133 1HB GLU 133 -11.542 26.071 -2.895 1035 HG2 GLU 133 2HG GLU 133 -11.968 28.143 -1.201 1036 HG3 GLU 133 1HG GLU 133 -11.850 26.820 -0.040 Start of MODEL 3 1 H1 MET 1 1HT MET 1 11.465 -29.124 0.784 2 H2 MET 1 2HT MET 1 11.389 -30.155 -0.563 3 H3 MET 1 3HT MET 1 10.959 -30.732 0.976 4 HA MET 1 HA MET 1 8.935 -30.337 -0.198 5 HB2 MET 1 2HB MET 1 9.883 -28.624 2.036 6 HB3 MET 1 1HB MET 1 8.360 -28.138 1.292 7 HG2 MET 1 2HG MET 1 8.349 -30.987 1.622 8 HG3 MET 1 1HG MET 1 8.792 -30.243 3.158 9 HE1 MET 1 2HE MET 1 6.220 -30.179 4.770 10 HE2 MET 1 3HE MET 1 7.038 -31.475 3.900 11 HE3 MET 1 1HE MET 1 5.300 -31.221 3.686 12 H MET 2 H MET 2 7.542 -28.710 -1.291 13 HA MET 2 HA MET 2 9.157 -26.655 -2.773 14 HB2 MET 2 2HB MET 2 7.893 -28.901 -3.731 15 HB3 MET 2 1HB MET 2 6.648 -27.672 -3.957 16 HG2 MET 2 2HG MET 2 9.396 -26.887 -4.750 17 HG3 MET 2 1HG MET 2 8.631 -28.119 -5.752 18 HE1 MET 2 3HE MET 2 6.522 -27.824 -7.162 19 HE2 MET 2 1HE MET 2 5.357 -26.514 -6.924 20 HE3 MET 2 2HE MET 2 5.697 -27.644 -5.615 21 H GLU 3 H GLU 3 7.811 -26.132 -0.257 22 HA GLU 3 HA GLU 3 5.659 -24.265 -1.198 23 HB2 GLU 3 2HB GLU 3 4.602 -24.742 1.024 24 HB3 GLU 3 1HB GLU 3 4.695 -26.174 -0.009 25 HG2 GLU 3 2HG GLU 3 6.697 -26.928 1.159 26 HG3 GLU 3 1HG GLU 3 6.736 -25.442 2.111 27 H GLU 4 H GLU 4 8.669 -24.521 0.182 28 HA GLU 4 HA GLU 4 8.392 -22.547 2.269 29 HB2 GLU 4 2HB GLU 4 10.150 -24.199 2.363 30 HB3 GLU 4 1HB GLU 4 10.735 -23.737 0.764 31 HG2 GLU 4 2HG GLU 4 11.310 -21.487 1.644 32 HG3 GLU 4 1HG GLU 4 10.783 -21.996 3.247 33 H TYR 5 H TYR 5 8.326 -22.303 -1.053 34 HA TYR 5 HA TYR 5 9.812 -19.835 -1.413 35 HB2 TYR 5 2HB TYR 5 8.669 -21.835 -2.990 36 HB3 TYR 5 1HB TYR 5 7.720 -20.394 -3.357 37 HD1 TYR 5 2HD TYR 5 9.193 -18.169 -3.627 38 HD2 TYR 5 1HD TYR 5 10.625 -22.178 -4.210 39 HE1 TYR 5 2HE TYR 5 11.045 -17.303 -5.032 40 HE2 TYR 5 1HE TYR 5 12.476 -21.310 -5.616 41 HH TYR 5 HH TYR 5 12.951 -17.817 -6.074 42 H LEU 6 H LEU 6 6.491 -20.703 -0.824 43 HA LEU 6 HA LEU 6 5.532 -17.926 -1.030 44 HB2 LEU 6 2HB LEU 6 3.370 -18.951 -0.550 45 HB3 LEU 6 1HB LEU 6 4.220 -19.959 -1.720 46 HG LEU 6 HG LEU 6 5.112 -21.049 0.600 47 HD11 LEU 6 1HD1 LEU 6 2.206 -20.533 1.179 48 HD12 LEU 6 2HD1 LEU 6 3.437 -19.398 1.733 49 HD13 LEU 6 3HD1 LEU 6 3.475 -21.075 2.279 50 HD21 LEU 6 3HD2 LEU 6 2.942 -22.584 0.212 51 HD22 LEU 6 1HD2 LEU 6 4.301 -22.587 -0.913 52 HD23 LEU 6 2HD2 LEU 6 2.863 -21.630 -1.268 53 H GLY 7 H GLY 7 6.526 -20.215 1.453 54 HA2 GLY 7 2HA GLY 7 5.410 -18.874 3.721 55 HA3 GLY 7 1HA GLY 7 6.821 -19.934 3.766 56 H VAL 8 H VAL 8 8.404 -18.410 1.887 57 HA VAL 8 HA VAL 8 9.402 -16.348 3.713 58 HB VAL 8 HB VAL 8 10.220 -17.471 1.030 59 HG11 VAL 8 1HG1 VAL 8 11.783 -15.450 2.657 60 HG12 VAL 8 2HG1 VAL 8 10.777 -15.004 1.278 61 HG13 VAL 8 3HG1 VAL 8 12.167 -16.065 1.050 62 HG21 VAL 8 3HG2 VAL 8 11.850 -17.493 3.554 63 HG22 VAL 8 1HG2 VAL 8 11.845 -18.648 2.222 64 HG23 VAL 8 2HG2 VAL 8 10.515 -18.634 3.380 65 H PHE 9 H PHE 9 7.565 -16.535 0.797 66 HA PHE 9 HA PHE 9 7.815 -13.768 -0.012 67 HB2 PHE 9 2HB PHE 9 6.404 -16.197 -0.760 68 HB3 PHE 9 1HB PHE 9 5.329 -14.800 -0.854 69 HD1 PHE 9 2HD PHE 9 8.647 -16.101 -1.949 70 HD2 PHE 9 1HD PHE 9 5.556 -13.187 -2.584 71 HE1 PHE 9 2HE PHE 9 9.751 -15.389 -4.052 72 HE2 PHE 9 1HE PHE 9 6.662 -12.473 -4.687 73 HZ PHE 9 HZ PHE 9 8.758 -13.575 -5.421 74 H VAL 10 H VAL 10 5.625 -15.568 2.114 75 HA VAL 10 HA VAL 10 3.793 -13.375 2.609 76 HB VAL 10 HB VAL 10 4.511 -15.958 4.032 77 HG11 VAL 10 1HG1 VAL 10 2.698 -15.618 5.539 78 HG12 VAL 10 2HG1 VAL 10 2.102 -14.229 4.628 79 HG13 VAL 10 3HG1 VAL 10 3.599 -14.102 5.552 80 HG21 VAL 10 3HG2 VAL 10 3.073 -16.876 2.561 81 HG22 VAL 10 1HG2 VAL 10 2.922 -15.311 1.762 82 HG23 VAL 10 2HG2 VAL 10 1.811 -15.749 3.061 83 H ASP 11 H ASP 11 6.733 -14.615 4.193 84 HA ASP 11 HA ASP 11 6.640 -12.804 6.438 85 HB2 ASP 11 2HB ASP 11 7.938 -14.873 6.458 86 HB3 ASP 11 1HB ASP 11 8.875 -14.328 5.065 87 H GLU 12 H GLU 12 7.544 -12.549 3.156 88 HA GLU 12 HA GLU 12 9.162 -10.105 3.480 89 HB2 GLU 12 2HB GLU 12 8.291 -11.971 1.311 90 HB3 GLU 12 1HB GLU 12 8.750 -10.335 0.837 91 HG2 GLU 12 2HG GLU 12 10.681 -11.248 2.717 92 HG3 GLU 12 1HG GLU 12 10.459 -12.527 1.523 93 H THR 13 H THR 13 5.958 -11.046 2.240 94 HA THR 13 HA THR 13 5.111 -8.477 1.346 95 HB THR 13 HB THR 13 4.147 -10.964 1.202 96 HG1 THR 13 1HG THR 13 2.241 -10.021 0.471 97 HG21 THR 13 3HG2 THR 13 3.598 -10.795 3.733 98 HG22 THR 13 1HG2 THR 13 2.363 -11.447 2.658 99 HG23 THR 13 2HG2 THR 13 2.252 -9.780 3.222 100 H LYS 14 H LYS 14 5.060 -9.977 4.557 101 HA LYS 14 HA LYS 14 3.489 -7.858 5.800 102 HB2 LYS 14 2HB LYS 14 5.184 -10.189 6.715 103 HB3 LYS 14 1HB LYS 14 4.479 -9.067 7.880 104 HG2 LYS 14 2HG LYS 14 2.437 -9.995 7.654 105 HG3 LYS 14 1HG LYS 14 2.520 -9.888 5.895 106 HD2 LYS 14 2HD LYS 14 2.888 -12.101 5.767 107 HD3 LYS 14 1HD LYS 14 4.340 -11.924 6.753 108 HE2 LYS 14 2HE LYS 14 1.645 -11.923 8.096 109 HE3 LYS 14 1HE LYS 14 2.397 -13.462 7.632 110 HZ1 LYS 14 3HZ LYS 14 4.497 -12.275 8.653 111 HZ2 LYS 14 1HZ LYS 14 3.416 -13.144 9.630 112 HZ3 LYS 14 2HZ LYS 14 3.315 -11.450 9.552 113 H GLU 15 H GLU 15 6.966 -8.670 5.600 114 HA GLU 15 HA GLU 15 7.902 -6.522 7.243 115 HB2 GLU 15 2HB GLU 15 9.084 -8.121 4.960 116 HB3 GLU 15 1HB GLU 15 10.031 -6.960 5.890 117 HG2 GLU 15 2HG GLU 15 9.526 -8.187 7.961 118 HG3 GLU 15 1HG GLU 15 8.551 -9.339 7.047 119 H TYR 16 H TYR 16 6.473 -6.571 4.185 120 HA TYR 16 HA TYR 16 7.686 -4.077 3.208 121 HB2 TYR 16 2HB TYR 16 6.475 -6.374 2.124 122 HB3 TYR 16 1HB TYR 16 5.331 -5.070 1.810 123 HD1 TYR 16 2HD TYR 16 6.992 -2.731 1.403 124 HD2 TYR 16 1HD TYR 16 7.660 -6.786 0.156 125 HE1 TYR 16 2HE TYR 16 8.417 -1.923 -0.459 126 HE2 TYR 16 1HE TYR 16 9.082 -5.979 -1.707 127 HH TYR 16 HH TYR 16 10.269 -4.137 -2.447 128 H LEU 17 H LEU 17 4.525 -5.252 4.393 129 HA LEU 17 HA LEU 17 3.096 -2.800 4.065 130 HB2 LEU 17 2HB LEU 17 2.873 -5.077 6.064 131 HB3 LEU 17 1HB LEU 17 1.640 -3.831 5.851 132 HG LEU 17 HG LEU 17 2.626 -5.743 3.715 133 HD11 LEU 17 1HD1 LEU 17 1.162 -7.047 4.941 134 HD12 LEU 17 2HD1 LEU 17 0.005 -6.226 3.891 135 HD13 LEU 17 3HD1 LEU 17 0.259 -5.655 5.540 136 HD21 LEU 17 3HD2 LEU 17 0.665 -4.706 2.443 137 HD22 LEU 17 1HD2 LEU 17 2.072 -3.663 2.657 138 HD23 LEU 17 2HD2 LEU 17 0.651 -3.446 3.679 139 H GLN 18 H GLN 18 5.183 -4.037 6.629 140 HA GLN 18 HA GLN 18 4.746 -1.831 8.449 141 HB2 GLN 18 2HB GLN 18 5.782 -3.367 9.722 142 HB3 GLN 18 1HB GLN 18 6.103 -4.323 8.284 143 HG2 GLN 18 2HG GLN 18 8.230 -3.360 7.966 144 HG3 GLN 18 1HG GLN 18 7.862 -1.988 9.012 145 HE21 GLN 18 1HE2 GLN 18 8.830 -5.389 8.995 146 HE22 GLN 18 2HE2 GLN 18 9.191 -5.481 10.651 147 H ASN 19 H ASN 19 7.215 -2.702 6.133 148 HA ASN 19 HA ASN 19 8.780 -0.302 6.367 149 HB2 ASN 19 2HB ASN 19 9.792 -2.172 5.297 150 HB3 ASN 19 1HB ASN 19 8.357 -2.485 4.316 151 HD21 ASN 19 1HD2 ASN 19 10.005 0.672 4.801 152 HD22 ASN 19 2HD2 ASN 19 10.412 0.886 3.167 153 H LEU 20 H LEU 20 5.834 -1.201 4.892 154 HA LEU 20 HA LEU 20 5.659 1.242 3.244 155 HB2 LEU 20 2HB LEU 20 4.830 -0.685 2.161 156 HB3 LEU 20 1HB LEU 20 4.066 -1.283 3.633 157 HG LEU 20 HG LEU 20 2.494 0.677 3.529 158 HD11 LEU 20 1HD1 LEU 20 2.339 1.825 1.305 159 HD12 LEU 20 2HD1 LEU 20 3.847 1.037 0.840 160 HD13 LEU 20 3HD1 LEU 20 3.829 2.190 2.174 161 HD21 LEU 20 3HD2 LEU 20 1.706 -1.451 2.721 162 HD22 LEU 20 1HD2 LEU 20 2.608 -1.276 1.214 163 HD23 LEU 20 2HD2 LEU 20 1.216 -0.241 1.536 164 H ASN 21 H ASN 21 4.964 0.221 6.399 165 HA ASN 21 HA ASN 21 2.743 2.137 6.765 166 HB2 ASN 21 2HB ASN 21 3.917 -0.196 8.157 167 HB3 ASN 21 1HB ASN 21 3.400 1.113 9.223 168 HD21 ASN 21 1HD2 ASN 21 1.816 -0.904 9.716 169 HD22 ASN 21 2HD2 ASN 21 0.350 -0.868 8.861 170 H ASP 22 H ASP 22 6.089 1.571 7.224 171 HA ASP 22 HA ASP 22 6.572 3.728 9.017 172 HB2 ASP 22 2HB ASP 22 8.022 1.636 7.689 173 HB3 ASP 22 1HB ASP 22 8.890 3.159 7.497 174 H THR 23 H THR 23 6.417 3.220 5.671 175 HA THR 23 HA THR 23 7.334 5.864 4.810 176 HB THR 23 HB THR 23 5.726 3.643 3.557 177 HG1 THR 23 1HG THR 23 7.614 2.716 3.864 178 HG21 THR 23 3HG2 THR 23 7.438 5.601 2.045 179 HG22 THR 23 1HG2 THR 23 5.788 6.029 2.491 180 HG23 THR 23 2HG2 THR 23 6.088 4.631 1.460 181 H LEU 24 H LEU 24 4.272 4.158 5.350 182 HA LEU 24 HA LEU 24 2.607 6.371 4.408 183 HB2 LEU 24 2HB LEU 24 2.321 3.614 5.474 184 HB3 LEU 24 1HB LEU 24 0.965 4.693 5.794 185 HG LEU 24 HG LEU 24 2.176 4.365 3.041 186 HD11 LEU 24 1HD1 LEU 24 1.076 2.266 4.220 187 HD12 LEU 24 2HD1 LEU 24 0.677 2.655 2.547 188 HD13 LEU 24 3HD1 LEU 24 -0.428 3.110 3.845 189 HD21 LEU 24 3HD2 LEU 24 -0.587 5.051 3.054 190 HD22 LEU 24 1HD2 LEU 24 0.773 6.061 2.560 191 HD23 LEU 24 2HD2 LEU 24 0.211 6.095 4.232 192 H LEU 25 H LEU 25 3.959 5.235 7.451 193 HA LEU 25 HA LEU 25 2.203 7.077 8.959 194 HB2 LEU 25 2HB LEU 25 3.043 6.021 10.861 195 HB3 LEU 25 1HB LEU 25 3.082 4.756 9.640 196 HG LEU 25 HG LEU 25 5.439 5.625 9.144 197 HD11 LEU 25 1HD1 LEU 25 5.996 7.435 10.391 198 HD12 LEU 25 2HD1 LEU 25 6.201 6.297 11.722 199 HD13 LEU 25 3HD1 LEU 25 4.673 7.156 11.523 200 HD21 LEU 25 3HD2 LEU 25 5.029 3.426 10.069 201 HD22 LEU 25 1HD2 LEU 25 4.684 4.109 11.659 202 HD23 LEU 25 2HD2 LEU 25 6.326 4.161 11.017 203 H GLU 26 H GLU 26 5.172 7.113 7.417 204 HA GLU 26 HA GLU 26 6.135 9.529 8.833 205 HB2 GLU 26 2HB GLU 26 7.236 7.681 6.692 206 HB3 GLU 26 1HB GLU 26 8.051 9.177 7.145 207 HG2 GLU 26 2HG GLU 26 7.320 7.019 9.138 208 HG3 GLU 26 1HG GLU 26 8.894 7.115 8.348 209 H LEU 27 H LEU 27 4.591 8.316 6.040 210 HA LEU 27 HA LEU 27 4.825 10.630 4.411 211 HB2 LEU 27 2HB LEU 27 4.298 8.544 3.379 212 HB3 LEU 27 1HB LEU 27 2.979 8.244 4.510 213 HG LEU 27 HG LEU 27 1.893 10.360 3.534 214 HD11 LEU 27 1HD1 LEU 27 2.659 11.157 1.429 215 HD12 LEU 27 2HD1 LEU 27 3.729 9.772 1.209 216 HD13 LEU 27 3HD1 LEU 27 4.118 11.004 2.408 217 HD21 LEU 27 3HD2 LEU 27 2.312 7.838 1.909 218 HD22 LEU 27 1HD2 LEU 27 1.119 9.068 1.486 219 HD23 LEU 27 2HD2 LEU 27 0.982 8.192 3.012 220 H GLU 28 H GLU 28 2.787 9.664 7.063 221 HA GLU 28 HA GLU 28 0.622 11.541 6.652 222 HB2 GLU 28 2HB GLU 28 1.797 10.264 9.155 223 HB3 GLU 28 1HB GLU 28 0.219 11.045 9.068 224 HG2 GLU 28 2HG GLU 28 0.242 9.219 6.937 225 HG3 GLU 28 1HG GLU 28 0.973 8.353 8.292 226 H LYS 29 H LYS 29 3.721 11.627 8.415 227 HA LYS 29 HA LYS 29 3.338 14.340 9.399 228 HB2 LYS 29 2HB LYS 29 5.897 12.752 9.049 229 HB3 LYS 29 1HB LYS 29 5.617 14.066 10.191 230 HG2 LYS 29 2HG LYS 29 4.408 12.742 11.632 231 HG3 LYS 29 1HG LYS 29 3.782 11.720 10.336 232 HD2 LYS 29 2HD LYS 29 6.232 10.922 10.065 233 HD3 LYS 29 1HD LYS 29 6.482 11.614 11.668 234 HE2 LYS 29 2HE LYS 29 4.051 10.005 11.579 235 HE3 LYS 29 1HE LYS 29 5.487 9.059 11.141 236 HZ1 LYS 29 3HZ LYS 29 6.593 10.240 13.084 237 HZ2 LYS 29 1HZ LYS 29 5.467 9.030 13.467 238 HZ3 LYS 29 2HZ LYS 29 5.026 10.666 13.582 239 H ASN 30 H ASN 30 4.414 12.803 6.566 240 HA ASN 30 HA ASN 30 4.856 15.420 5.251 241 HB2 ASN 30 2HB ASN 30 6.870 13.322 5.826 242 HB3 ASN 30 1HB ASN 30 6.859 13.876 4.151 243 HD21 ASN 30 1HD2 ASN 30 9.137 14.603 5.345 244 HD22 ASN 30 2HD2 ASN 30 9.124 16.220 5.859 245 HA PRO 31 HA PRO 31 2.348 12.494 2.927 246 HB2 PRO 31 2HB PRO 31 0.092 14.007 2.974 247 HB3 PRO 31 1HB PRO 31 0.570 12.927 4.293 248 HG2 PRO 31 2HG PRO 31 0.599 15.847 4.179 249 HG3 PRO 31 1HG PRO 31 0.523 14.761 5.573 250 HD2 PRO 31 2HD PRO 31 2.796 16.125 4.546 251 HD3 PRO 31 1HD PRO 31 2.724 14.984 5.905 252 H GLU 32 H GLU 32 3.978 15.173 2.293 253 HA GLU 32 HA GLU 32 2.786 15.517 -0.429 254 HB2 GLU 32 2HB GLU 32 4.374 17.763 0.598 255 HB3 GLU 32 1HB GLU 32 2.759 17.778 -0.107 256 HG2 GLU 32 2HG GLU 32 1.773 17.117 2.021 257 HG3 GLU 32 1HG GLU 32 3.377 16.936 2.738 258 H ASP 33 H ASP 33 5.337 14.457 1.409 259 HA ASP 33 HA ASP 33 7.554 15.254 -0.268 260 HB2 ASP 33 2HB ASP 33 7.262 14.370 2.265 261 HB3 ASP 33 1HB ASP 33 7.666 12.845 1.479 262 H MET 34 H MET 34 8.087 14.273 -2.203 263 HA MET 34 HA MET 34 6.522 12.097 -3.264 264 HB2 MET 34 2HB MET 34 9.062 13.535 -4.057 265 HB3 MET 34 1HB MET 34 8.379 12.243 -5.046 266 HG2 MET 34 2HG MET 34 6.178 13.830 -4.511 267 HG3 MET 34 1HG MET 34 7.470 15.011 -4.713 268 HE1 MET 34 3HE MET 34 4.730 13.959 -7.112 269 HE2 MET 34 1HE MET 34 5.629 15.256 -7.912 270 HE3 MET 34 2HE MET 34 5.345 15.317 -6.173 271 H GLU 35 H GLU 35 8.995 12.038 -0.981 272 HA GLU 35 HA GLU 35 10.307 9.586 -1.892 273 HB2 GLU 35 2HB GLU 35 10.511 11.581 0.249 274 HB3 GLU 35 1HB GLU 35 10.789 9.940 0.834 275 HG2 GLU 35 2HG GLU 35 12.315 9.722 -1.281 276 HG3 GLU 35 1HG GLU 35 12.312 11.486 -1.245 277 H LEU 36 H LEU 36 8.241 10.349 0.952 278 HA LEU 36 HA LEU 36 7.686 7.575 1.489 279 HB2 LEU 36 2HB LEU 36 5.941 9.953 2.190 280 HB3 LEU 36 1HB LEU 36 6.137 8.457 3.099 281 HG LEU 36 HG LEU 36 8.033 10.773 2.852 282 HD11 LEU 36 1HD1 LEU 36 6.818 9.141 5.074 283 HD12 LEU 36 2HD1 LEU 36 6.666 10.874 4.781 284 HD13 LEU 36 3HD1 LEU 36 8.196 10.206 5.353 285 HD21 LEU 36 3HD2 LEU 36 9.651 9.177 2.439 286 HD22 LEU 36 1HD2 LEU 36 8.699 7.880 3.162 287 HD23 LEU 36 2HD2 LEU 36 9.558 9.023 4.193 288 H ILE 37 H ILE 37 6.468 9.886 -0.787 289 HA ILE 37 HA ILE 37 3.934 8.494 -1.280 290 HB ILE 37 HB ILE 37 5.517 10.756 -2.495 291 HG12 ILE 37 2HG1 ILE 37 2.740 10.543 -1.290 292 HG13 ILE 37 1HG1 ILE 37 4.170 11.161 -0.465 293 HG21 ILE 37 1HG2 ILE 37 3.295 9.178 -3.711 294 HG22 ILE 37 2HG2 ILE 37 4.627 10.028 -4.495 295 HG23 ILE 37 3HG2 ILE 37 3.238 10.932 -3.889 296 HD11 ILE 37 3HD1 ILE 37 2.459 12.462 -2.487 297 HD12 ILE 37 1HD1 ILE 37 4.190 12.658 -2.757 298 HD13 ILE 37 2HD1 ILE 37 3.470 13.184 -1.235 299 H ASN 38 H ASN 38 7.230 8.544 -2.585 300 HA ASN 38 HA ASN 38 6.454 6.711 -4.774 301 HB2 ASN 38 2HB ASN 38 8.909 8.239 -3.951 302 HB3 ASN 38 1HB ASN 38 9.052 6.928 -5.121 303 HD21 ASN 38 1HD2 ASN 38 9.684 9.288 -6.238 304 HD22 ASN 38 2HD2 ASN 38 8.415 9.925 -7.169 305 H GLU 39 H GLU 39 7.812 6.656 -1.628 306 HA GLU 39 HA GLU 39 8.999 3.991 -1.877 307 HB2 GLU 39 2HB GLU 39 8.436 5.938 0.366 308 HB3 GLU 39 1HB GLU 39 9.108 4.338 0.684 309 HG2 GLU 39 2HG GLU 39 10.990 4.831 -0.849 310 HG3 GLU 39 1HG GLU 39 10.328 6.442 -1.131 311 H ALA 40 H ALA 40 5.999 5.426 -1.073 312 HA ALA 40 HA ALA 40 4.852 2.960 0.091 313 HB1 ALA 40 1HB ALA 40 4.391 5.253 0.975 314 HB2 ALA 40 2HB ALA 40 2.921 4.424 0.463 315 HB3 ALA 40 3HB ALA 40 3.641 5.665 -0.566 316 H PHE 41 H PHE 41 4.373 5.089 -2.771 317 HA PHE 41 HA PHE 41 2.316 3.559 -4.017 318 HB2 PHE 41 2HB PHE 41 2.823 5.757 -4.795 319 HB3 PHE 41 1HB PHE 41 4.533 5.374 -4.990 320 HD1 PHE 41 1HD PHE 41 1.151 4.927 -6.400 321 HD2 PHE 41 2HD PHE 41 5.339 4.123 -6.915 322 HE1 PHE 41 1HE PHE 41 0.731 4.235 -8.746 323 HE2 PHE 41 2HE PHE 41 4.918 3.432 -9.259 324 HZ PHE 41 HZ PHE 41 2.614 3.488 -10.174 325 H ARG 42 H ARG 42 5.810 3.140 -3.886 326 HA ARG 42 HA ARG 42 5.962 1.138 -5.997 327 HB2 ARG 42 2HB ARG 42 7.681 2.424 -3.942 328 HB3 ARG 42 1HB ARG 42 8.199 0.830 -4.491 329 HG2 ARG 42 2HG ARG 42 7.747 1.812 -6.884 330 HG3 ARG 42 1HG ARG 42 7.904 3.368 -6.066 331 HD2 ARG 42 2HD ARG 42 10.152 3.137 -6.236 332 HD3 ARG 42 1HD ARG 42 10.034 1.774 -5.104 333 HE ARG 42 HE ARG 42 10.144 0.281 -6.948 334 HH11 ARG 42 1HH1 ARG 42 11.723 2.656 -8.158 335 HH12 ARG 42 2HH1 ARG 42 11.015 2.722 -9.738 336 HH21 ARG 42 1HH2 ARG 42 8.302 0.736 -8.898 337 HH22 ARG 42 2HH2 ARG 42 9.079 1.635 -10.156 338 H ALA 43 H ALA 43 6.663 0.821 -2.500 339 HA ALA 43 HA ALA 43 6.679 -1.910 -2.172 340 HB1 ALA 43 1HB ALA 43 5.523 0.344 -0.536 341 HB2 ALA 43 2HB ALA 43 7.033 -0.534 -0.288 342 HB3 ALA 43 3HB ALA 43 5.491 -1.313 0.073 343 H LEU 44 H LEU 44 3.698 0.082 -2.232 344 HA LEU 44 HA LEU 44 1.888 -2.132 -1.969 345 HB2 LEU 44 2HB LEU 44 1.712 0.676 -3.083 346 HB3 LEU 44 1HB LEU 44 0.302 -0.381 -2.969 347 HG LEU 44 HG LEU 44 2.061 0.050 -0.568 348 HD11 LEU 44 1HD1 LEU 44 1.375 2.173 -0.256 349 HD12 LEU 44 2HD1 LEU 44 -0.302 1.736 -0.577 350 HD13 LEU 44 3HD1 LEU 44 0.771 2.150 -1.913 351 HD21 LEU 44 3HD2 LEU 44 -0.685 -0.955 -1.189 352 HD22 LEU 44 1HD2 LEU 44 -0.442 -0.145 0.357 353 HD23 LEU 44 2HD2 LEU 44 0.505 -1.576 -0.045 354 H HIS 45 H HIS 45 3.381 -0.535 -4.762 355 HA HIS 45 HA HIS 45 1.886 -1.964 -6.787 356 HB2 HIS 45 2HB HIS 45 3.430 0.196 -6.792 357 HB3 HIS 45 1HB HIS 45 4.702 -0.973 -7.142 358 HD1 HIS 45 1HD HIS 45 4.331 0.776 -9.435 359 HD2 HIS 45 2HD HIS 45 1.770 -2.461 -8.850 360 HE1 HIS 45 1HE HIS 45 3.294 0.267 -11.689 361 H THR 46 H THR 46 4.838 -2.542 -4.959 362 HA THR 46 HA THR 46 5.573 -4.942 -6.473 363 HB THR 46 HB THR 46 6.605 -3.192 -4.340 364 HG1 THR 46 1HG THR 46 7.908 -3.152 -5.976 365 HG21 THR 46 3HG2 THR 46 6.659 -4.930 -2.809 366 HG22 THR 46 1HG2 THR 46 8.195 -5.187 -3.637 367 HG23 THR 46 2HG2 THR 46 6.790 -6.168 -4.058 368 H LEU 47 H LEU 47 3.911 -4.106 -3.469 369 HA LEU 47 HA LEU 47 3.654 -6.833 -2.501 370 HB2 LEU 47 2HB LEU 47 2.869 -4.088 -1.799 371 HB3 LEU 47 1HB LEU 47 1.659 -5.289 -1.345 372 HG LEU 47 HG LEU 47 4.601 -5.355 -0.611 373 HD11 LEU 47 1HD1 LEU 47 2.093 -4.514 0.781 374 HD12 LEU 47 2HD1 LEU 47 3.719 -3.840 0.896 375 HD13 LEU 47 3HD1 LEU 47 3.324 -5.341 1.733 376 HD21 LEU 47 3HD2 LEU 47 3.134 -7.195 0.923 377 HD22 LEU 47 1HD2 LEU 47 4.276 -7.576 -0.367 378 HD23 LEU 47 2HD2 LEU 47 2.556 -7.418 -0.729 379 H LYS 48 H LYS 48 1.775 -4.692 -4.590 380 HA LYS 48 HA LYS 48 -0.676 -6.205 -4.622 381 HB2 LYS 48 2HB LYS 48 -0.575 -3.904 -5.329 382 HB3 LYS 48 1HB LYS 48 0.704 -4.258 -6.488 383 HG2 LYS 48 2HG LYS 48 -1.103 -5.929 -7.474 384 HG3 LYS 48 1HG LYS 48 -2.226 -4.831 -6.667 385 HD2 LYS 48 2HD LYS 48 -1.983 -3.851 -8.786 386 HD3 LYS 48 1HD LYS 48 -0.827 -2.954 -7.796 387 HE2 LYS 48 2HE LYS 48 0.430 -3.530 -9.717 388 HE3 LYS 48 1HE LYS 48 0.872 -4.792 -8.549 389 HZ1 LYS 48 3HZ LYS 48 -1.551 -5.234 -10.103 390 HZ2 LYS 48 1HZ LYS 48 -0.372 -6.344 -9.600 391 HZ3 LYS 48 2HZ LYS 48 -0.085 -5.358 -10.953 392 H GLY 49 H GLY 49 2.231 -6.182 -6.700 393 HA2 GLY 49 2HA GLY 49 1.302 -8.116 -8.589 394 HA3 GLY 49 1HA GLY 49 2.996 -7.738 -8.281 395 H MET 50 H MET 50 3.246 -8.487 -5.614 396 HA MET 50 HA MET 50 3.604 -11.324 -5.803 397 HB2 MET 50 2HB MET 50 3.518 -9.341 -3.512 398 HB3 MET 50 1HB MET 50 3.991 -11.027 -3.299 399 HG2 MET 50 2HG MET 50 5.644 -10.534 -5.274 400 HG3 MET 50 1HG MET 50 5.396 -8.848 -4.820 401 HE1 MET 50 3HE MET 50 5.130 -8.236 -2.429 402 HE2 MET 50 1HE MET 50 6.372 -8.582 -1.217 403 HE3 MET 50 2HE MET 50 4.950 -9.614 -1.345 404 H ALA 51 H ALA 51 0.899 -9.360 -4.722 405 HA ALA 51 HA ALA 51 -0.452 -11.658 -3.439 406 HB1 ALA 51 1HB ALA 51 -2.247 -9.751 -3.264 407 HB2 ALA 51 2HB ALA 51 -0.930 -8.708 -3.804 408 HB3 ALA 51 3HB ALA 51 -0.771 -9.624 -2.305 409 H GLY 52 H GLY 52 -0.200 -10.273 -6.550 410 HA2 GLY 52 2HA GLY 52 -2.904 -11.074 -7.388 411 HA3 GLY 52 1HA GLY 52 -1.683 -10.325 -8.418 412 H THR 53 H THR 53 -1.379 -13.221 -6.389 413 HA THR 53 HA THR 53 -1.750 -15.228 -8.281 414 HB THR 53 HB THR 53 0.543 -13.531 -8.793 415 HG1 THR 53 1HG THR 53 0.379 -14.500 -10.761 416 HG21 THR 53 3HG2 THR 53 2.041 -15.582 -9.388 417 HG22 THR 53 1HG2 THR 53 1.089 -16.424 -8.165 418 HG23 THR 53 2HG2 THR 53 2.028 -14.998 -7.722 419 H MET 54 H MET 54 0.135 -14.012 -5.685 420 HA MET 54 HA MET 54 0.304 -16.755 -4.497 421 HB2 MET 54 2HB MET 54 2.169 -14.473 -4.794 422 HB3 MET 54 1HB MET 54 2.266 -15.380 -3.287 423 HG2 MET 54 2HG MET 54 2.058 -17.158 -5.583 424 HG3 MET 54 1HG MET 54 3.457 -16.093 -5.720 425 HE1 MET 54 3HE MET 54 5.416 -15.945 -3.959 426 HE2 MET 54 1HE MET 54 5.245 -16.586 -2.319 427 HE3 MET 54 2HE MET 54 4.120 -15.368 -2.913 428 H GLY 55 H GLY 55 -1.024 -13.699 -4.280 429 HA2 GLY 55 2HA GLY 55 -1.659 -14.123 -1.387 430 HA3 GLY 55 1HA GLY 55 -1.261 -12.511 -1.996 431 H PHE 56 H PHE 56 -2.776 -14.254 -4.386 432 HA PHE 56 HA PHE 56 -5.009 -14.304 -5.205 433 HB2 PHE 56 2HB PHE 56 -5.185 -14.409 -2.404 434 HB3 PHE 56 1HB PHE 56 -6.281 -13.108 -2.870 435 HD1 PHE 56 2HD PHE 56 -5.334 -16.264 -4.653 436 HD2 PHE 56 1HD PHE 56 -8.456 -13.981 -2.785 437 HE1 PHE 56 2HE PHE 56 -7.006 -17.937 -5.400 438 HE2 PHE 56 1HE PHE 56 -10.126 -15.655 -3.531 439 HZ PHE 56 HZ PHE 56 -9.401 -17.632 -4.839 440 H SER 57 H SER 57 -5.639 -12.746 -6.623 441 HA SER 57 HA SER 57 -4.828 -10.030 -6.472 442 HB2 SER 57 2HB SER 57 -7.241 -10.958 -7.998 443 HB3 SER 57 1HB SER 57 -5.976 -9.843 -8.508 444 HG SER 57 HG SER 57 -6.067 -12.261 -9.198 445 H SER 58 H SER 58 -7.310 -11.622 -4.819 446 HA SER 58 HA SER 58 -9.282 -9.542 -4.637 447 HB2 SER 58 2HB SER 58 -8.469 -11.937 -2.984 448 HB3 SER 58 1HB SER 58 -9.760 -10.869 -2.441 449 HG SER 58 HG SER 58 -10.970 -11.447 -4.135 450 H MET 59 H MET 59 -6.271 -10.237 -2.995 451 HA MET 59 HA MET 59 -6.648 -7.901 -1.184 452 HB2 MET 59 2HB MET 59 -6.036 -10.036 -0.158 453 HB3 MET 59 1HB MET 59 -4.675 -10.212 -1.268 454 HG2 MET 59 2HG MET 59 -3.957 -7.874 -0.282 455 HG3 MET 59 1HG MET 59 -4.993 -8.347 1.064 456 HE1 MET 59 3HE MET 59 -2.885 -11.146 -1.085 457 HE2 MET 59 1HE MET 59 -1.332 -10.437 -0.625 458 HE3 MET 59 2HE MET 59 -2.548 -9.455 -1.438 459 H ALA 60 H ALA 60 -5.102 -8.918 -4.068 460 HA ALA 60 HA ALA 60 -2.807 -7.109 -3.926 461 HB1 ALA 60 1HB ALA 60 -3.940 -8.221 -6.470 462 HB2 ALA 60 2HB ALA 60 -3.319 -9.357 -5.271 463 HB3 ALA 60 3HB ALA 60 -2.259 -8.124 -5.951 464 H LYS 61 H LYS 61 -6.081 -7.050 -5.287 465 HA LYS 61 HA LYS 61 -5.863 -4.698 -6.882 466 HB2 LYS 61 2HB LYS 61 -7.918 -6.339 -5.533 467 HB3 LYS 61 1HB LYS 61 -8.388 -4.653 -5.748 468 HG2 LYS 61 2HG LYS 61 -9.094 -5.730 -7.730 469 HG3 LYS 61 1HG LYS 61 -7.595 -4.916 -8.169 470 HD2 LYS 61 2HD LYS 61 -7.080 -6.990 -9.009 471 HD3 LYS 61 1HD LYS 61 -6.575 -7.265 -7.341 472 HE2 LYS 61 2HE LYS 61 -7.984 -9.118 -7.815 473 HE3 LYS 61 1HE LYS 61 -9.056 -7.996 -6.956 474 HZ1 LYS 61 3HZ LYS 61 -10.303 -8.255 -8.812 475 HZ2 LYS 61 1HZ LYS 61 -8.984 -8.685 -9.787 476 HZ3 LYS 61 2HZ LYS 61 -9.268 -7.051 -9.418 477 H LEU 62 H LEU 62 -6.465 -5.274 -3.489 478 HA LEU 62 HA LEU 62 -6.896 -2.597 -2.609 479 HB2 LEU 62 2HB LEU 62 -5.668 -5.060 -1.324 480 HB3 LEU 62 1HB LEU 62 -6.119 -3.611 -0.421 481 HG LEU 62 HG LEU 62 -7.991 -5.337 -2.068 482 HD11 LEU 62 1HD1 LEU 62 -8.662 -6.321 -0.115 483 HD12 LEU 62 2HD1 LEU 62 -8.409 -4.855 0.830 484 HD13 LEU 62 3HD1 LEU 62 -7.038 -5.883 0.414 485 HD21 LEU 62 3HD2 LEU 62 -8.176 -2.603 -1.008 486 HD22 LEU 62 1HD2 LEU 62 -9.500 -3.643 -0.482 487 HD23 LEU 62 2HD2 LEU 62 -9.189 -3.414 -2.203 488 H CYS 63 H CYS 63 -3.976 -4.550 -3.090 489 HA CYS 63 HA CYS 63 -2.096 -2.668 -2.035 490 HB2 CYS 63 2HB CYS 63 -1.847 -4.812 -4.174 491 HB3 CYS 63 1HB CYS 63 -0.492 -4.078 -3.312 492 HG CYS 63 HG CYS 63 -2.653 -5.476 -1.580 493 H HIS 64 H HIS 64 -3.576 -3.137 -5.204 494 HA HIS 64 HA HIS 64 -1.963 -1.102 -6.539 495 HB2 HIS 64 2HB HIS 64 -3.161 -3.124 -7.555 496 HB3 HIS 64 1HB HIS 64 -4.665 -2.241 -7.313 497 HD1 HIS 64 1HD HIS 64 -5.309 -0.609 -9.098 498 HD2 HIS 64 2HD HIS 64 -1.265 -1.604 -9.302 499 HE1 HIS 64 1HE HIS 64 -4.402 0.503 -11.185 500 H THR 65 H THR 65 -5.127 -1.337 -5.010 501 HA THR 65 HA THR 65 -6.223 1.184 -5.701 502 HB THR 65 HB THR 65 -6.472 -0.856 -3.520 503 HG1 THR 65 1HG THR 65 -7.885 0.096 -5.707 504 HG21 THR 65 3HG2 THR 65 -6.729 1.258 -2.319 505 HG22 THR 65 1HG2 THR 65 -8.288 0.452 -2.476 506 HG23 THR 65 2HG2 THR 65 -7.894 1.817 -3.520 507 H LEU 66 H LEU 66 -4.721 0.349 -2.549 508 HA LEU 66 HA LEU 66 -4.429 2.891 -1.445 509 HB2 LEU 66 2HB LEU 66 -2.893 0.303 -1.413 510 HB3 LEU 66 1HB LEU 66 -2.231 1.694 -0.554 511 HG LEU 66 HG LEU 66 -4.631 1.895 0.443 512 HD11 LEU 66 1HD1 LEU 66 -4.565 -1.008 -0.407 513 HD12 LEU 66 2HD1 LEU 66 -5.684 0.221 -1.002 514 HD13 LEU 66 3HD1 LEU 66 -5.753 -0.296 0.681 515 HD21 LEU 66 3HD2 LEU 66 -3.699 -0.396 1.815 516 HD22 LEU 66 1HD2 LEU 66 -3.377 1.288 2.224 517 HD23 LEU 66 2HD2 LEU 66 -2.266 0.408 1.178 518 H GLU 67 H GLU 67 -2.166 1.148 -3.568 519 HA GLU 67 HA GLU 67 -0.186 3.180 -3.832 520 HB2 GLU 67 2HB GLU 67 0.432 1.020 -4.459 521 HB3 GLU 67 1HB GLU 67 -1.109 0.709 -5.254 522 HG2 GLU 67 2HG GLU 67 0.422 2.887 -6.502 523 HG3 GLU 67 1HG GLU 67 1.257 1.335 -6.547 524 H ASN 68 H ASN 68 -3.268 2.677 -5.440 525 HA ASN 68 HA ASN 68 -2.832 4.328 -7.729 526 HB2 ASN 68 2HB ASN 68 -4.870 2.840 -6.522 527 HB3 ASN 68 1HB ASN 68 -5.474 4.495 -6.538 528 HD21 ASN 68 1HD2 ASN 68 -4.012 2.033 -8.720 529 HD22 ASN 68 2HD2 ASN 68 -4.780 2.601 -10.123 530 H ILE 69 H ILE 69 -4.037 4.976 -4.464 531 HA ILE 69 HA ILE 69 -4.517 7.776 -4.817 532 HB ILE 69 HB ILE 69 -3.912 5.977 -2.469 533 HG12 ILE 69 2HG1 ILE 69 -6.331 6.538 -1.994 534 HG13 ILE 69 1HG1 ILE 69 -6.374 7.359 -3.551 535 HG21 ILE 69 1HG2 ILE 69 -4.688 7.936 -1.067 536 HG22 ILE 69 2HG2 ILE 69 -4.546 8.943 -2.504 537 HG23 ILE 69 3HG2 ILE 69 -3.113 8.172 -1.823 538 HD11 ILE 69 3HD1 ILE 69 -7.198 4.943 -3.540 539 HD12 ILE 69 1HD1 ILE 69 -5.518 4.479 -3.270 540 HD13 ILE 69 2HD1 ILE 69 -5.971 5.339 -4.745 541 H LEU 70 H LEU 70 -1.808 5.853 -3.896 542 HA LEU 70 HA LEU 70 0.015 8.037 -3.338 543 HB2 LEU 70 2HB LEU 70 0.638 5.213 -4.251 544 HB3 LEU 70 1HB LEU 70 1.703 6.282 -3.344 545 HG LEU 70 HG LEU 70 -0.654 4.713 -2.402 546 HD11 LEU 70 1HD1 LEU 70 1.982 4.470 -2.009 547 HD12 LEU 70 2HD1 LEU 70 0.804 4.005 -0.782 548 HD13 LEU 70 3HD1 LEU 70 1.610 5.570 -0.682 549 HD21 LEU 70 3HD2 LEU 70 -1.544 6.787 -1.741 550 HD22 LEU 70 1HD2 LEU 70 0.051 7.494 -1.486 551 HD23 LEU 70 2HD2 LEU 70 -0.590 6.321 -0.334 552 H ASP 71 H ASP 71 -1.290 6.609 -6.135 553 HA ASP 71 HA ASP 71 0.834 7.493 -7.953 554 HB2 ASP 71 2HB ASP 71 -1.024 5.577 -8.109 555 HB3 ASP 71 1HB ASP 71 -1.984 6.885 -8.798 556 H LYS 72 H LYS 72 -2.547 8.509 -7.235 557 HA LYS 72 HA LYS 72 -2.443 10.906 -8.786 558 HB2 LYS 72 2HB LYS 72 -3.971 9.873 -6.427 559 HB3 LYS 72 1HB LYS 72 -4.305 11.477 -7.069 560 HG2 LYS 72 2HG LYS 72 -5.249 10.637 -8.983 561 HG3 LYS 72 1HG LYS 72 -4.176 9.230 -9.010 562 HD2 LYS 72 2HD LYS 72 -6.015 9.447 -6.718 563 HD3 LYS 72 1HD LYS 72 -6.755 9.053 -8.269 564 HE2 LYS 72 2HE LYS 72 -4.557 7.406 -8.256 565 HE3 LYS 72 1HE LYS 72 -5.014 7.428 -6.540 566 HZ1 LYS 72 3HZ LYS 72 -7.046 7.134 -8.670 567 HZ2 LYS 72 1HZ LYS 72 -7.178 6.747 -7.025 568 HZ3 LYS 72 2HZ LYS 72 -6.230 5.779 -8.050 569 H ALA 73 H ALA 73 -1.295 9.986 -5.675 570 HA ALA 73 HA ALA 73 -0.872 12.563 -4.484 571 HB1 ALA 73 1HB ALA 73 -0.494 10.987 -2.879 572 HB2 ALA 73 2HB ALA 73 1.114 10.811 -3.583 573 HB3 ALA 73 3HB ALA 73 -0.192 9.741 -4.094 574 H ARG 74 H ARG 74 1.062 10.458 -6.584 575 HA ARG 74 HA ARG 74 3.261 12.436 -6.682 576 HB2 ARG 74 2HB ARG 74 4.369 10.665 -7.981 577 HB3 ARG 74 1HB ARG 74 3.660 9.980 -6.519 578 HG2 ARG 74 2HG ARG 74 1.810 9.073 -7.723 579 HG3 ARG 74 1HG ARG 74 2.195 10.015 -9.165 580 HD2 ARG 74 2HD ARG 74 4.442 8.340 -8.293 581 HD3 ARG 74 1HD ARG 74 3.000 7.397 -8.719 582 HE ARG 74 HE ARG 74 2.972 8.917 -10.836 583 HH11 ARG 74 1HH1 ARG 74 5.164 6.633 -10.215 584 HH12 ARG 74 2HH1 ARG 74 6.493 7.333 -11.077 585 HH21 ARG 74 1HH2 ARG 74 4.957 10.416 -11.478 586 HH22 ARG 74 2HH2 ARG 74 6.377 9.473 -11.789 587 H ASN 75 H ASN 75 0.371 11.667 -8.345 588 HA ASN 75 HA ASN 75 1.298 12.886 -10.903 589 HB2 ASN 75 2HB ASN 75 0.004 10.784 -10.915 590 HB3 ASN 75 1HB ASN 75 -1.303 11.582 -10.046 591 HD21 ASN 75 1HD2 ASN 75 0.647 12.108 -13.041 592 HD22 ASN 75 2HD2 ASN 75 -0.663 12.661 -13.967 593 H SER 76 H SER 76 0.095 13.925 -7.990 594 HA SER 76 HA SER 76 -0.655 16.074 -7.340 595 HB2 SER 76 2HB SER 76 0.560 16.578 -9.625 596 HB3 SER 76 1HB SER 76 -1.082 16.747 -10.240 597 HG SER 76 HG SER 76 -1.304 18.135 -8.223 598 H GLU 77 H GLU 77 -2.424 13.776 -7.661 599 HA GLU 77 HA GLU 77 -4.920 15.156 -8.519 600 HB2 GLU 77 2HB GLU 77 -3.925 12.335 -8.638 601 HB3 GLU 77 1HB GLU 77 -5.658 12.662 -8.720 602 HG2 GLU 77 2HG GLU 77 -3.509 13.775 -10.547 603 HG3 GLU 77 1HG GLU 77 -4.724 12.568 -10.979 604 H ILE 78 H ILE 78 -3.490 13.038 -6.098 605 HA ILE 78 HA ILE 78 -5.621 13.960 -4.192 606 HB ILE 78 HB ILE 78 -5.618 11.715 -3.222 607 HG12 ILE 78 2HG1 ILE 78 -4.324 9.946 -4.625 608 HG13 ILE 78 1HG1 ILE 78 -3.371 11.325 -5.175 609 HG21 ILE 78 1HG2 ILE 78 -6.475 10.437 -5.212 610 HG22 ILE 78 2HG2 ILE 78 -5.934 11.769 -6.232 611 HG23 ILE 78 3HG2 ILE 78 -7.188 12.038 -5.024 612 HD11 ILE 78 3HD1 ILE 78 -3.753 11.370 -2.298 613 HD12 ILE 78 1HD1 ILE 78 -2.260 11.435 -3.237 614 HD13 ILE 78 2HD1 ILE 78 -2.979 9.878 -2.831 615 H LYS 79 H LYS 79 -4.850 13.503 -1.861 616 HA LYS 79 HA LYS 79 -1.937 13.546 -1.466 617 HB2 LYS 79 2HB LYS 79 -3.844 15.841 -0.931 618 HB3 LYS 79 1HB LYS 79 -2.269 15.729 -0.144 619 HG2 LYS 79 2HG LYS 79 -2.749 15.764 -3.134 620 HG3 LYS 79 1HG LYS 79 -2.136 17.114 -2.182 621 HD2 LYS 79 2HD LYS 79 -0.762 14.578 -2.986 622 HD3 LYS 79 1HD LYS 79 -0.135 16.222 -2.940 623 HE2 LYS 79 2HE LYS 79 -0.770 14.594 -0.451 624 HE3 LYS 79 1HE LYS 79 0.851 14.748 -1.155 625 HZ1 LYS 79 3HZ LYS 79 -0.762 16.742 0.221 626 HZ2 LYS 79 1HZ LYS 79 0.075 17.288 -1.149 627 HZ3 LYS 79 2HZ LYS 79 0.927 16.581 0.139 628 H ILE 80 H ILE 80 -1.427 12.833 0.694 629 HA ILE 80 HA ILE 80 -3.421 11.343 2.084 630 HB ILE 80 HB ILE 80 -0.681 12.369 2.648 631 HG12 ILE 80 2HG1 ILE 80 -0.179 9.983 2.640 632 HG13 ILE 80 1HG1 ILE 80 -1.902 9.610 2.558 633 HG21 ILE 80 1HG2 ILE 80 -0.757 11.004 4.786 634 HG22 ILE 80 2HG2 ILE 80 -2.511 10.995 4.618 635 HG23 ILE 80 3HG2 ILE 80 -1.656 12.517 4.842 636 HD11 ILE 80 3HD1 ILE 80 -2.073 10.683 0.379 637 HD12 ILE 80 1HD1 ILE 80 -0.784 9.481 0.329 638 HD13 ILE 80 2HD1 ILE 80 -0.388 11.194 0.464 639 H THR 81 H THR 81 -5.161 12.538 2.545 640 HA THR 81 HA THR 81 -4.966 15.007 4.186 641 HB THR 81 HB THR 81 -7.288 15.234 3.585 642 HG1 THR 81 1HG THR 81 -8.410 13.481 3.633 643 HG21 THR 81 3HG2 THR 81 -7.024 15.496 1.329 644 HG22 THR 81 1HG2 THR 81 -6.442 13.846 1.109 645 HG23 THR 81 2HG2 THR 81 -5.347 15.095 1.702 646 H SER 82 H SER 82 -4.247 12.252 5.171 647 HA SER 82 HA SER 82 -4.516 11.106 7.231 648 HB2 SER 82 2HB SER 82 -6.890 12.770 7.939 649 HB3 SER 82 1HB SER 82 -5.508 12.313 8.930 650 HG SER 82 HG SER 82 -5.902 14.514 7.360 651 H ASP 83 H ASP 83 -7.699 12.166 5.946 652 HA ASP 83 HA ASP 83 -9.050 9.688 6.531 653 HB2 ASP 83 2HB ASP 83 -9.483 12.221 5.041 654 HB3 ASP 83 1HB ASP 83 -10.493 10.858 4.562 655 H LEU 84 H LEU 84 -7.360 10.960 3.645 656 HA LEU 84 HA LEU 84 -8.137 8.886 1.828 657 HB2 LEU 84 2HB LEU 84 -7.074 10.948 1.093 658 HB3 LEU 84 1HB LEU 84 -5.670 10.640 2.118 659 HG LEU 84 HG LEU 84 -5.068 8.704 0.805 660 HD11 LEU 84 1HD1 LEU 84 -7.744 9.218 -0.476 661 HD12 LEU 84 2HD1 LEU 84 -7.092 7.705 0.156 662 HD13 LEU 84 3HD1 LEU 84 -6.486 8.361 -1.365 663 HD21 LEU 84 3HD2 LEU 84 -5.101 11.351 -0.164 664 HD22 LEU 84 1HD2 LEU 84 -5.572 10.340 -1.530 665 HD23 LEU 84 2HD2 LEU 84 -4.046 10.042 -0.696 666 H LEU 85 H LEU 85 -5.838 9.147 4.412 667 HA LEU 85 HA LEU 85 -4.425 6.642 3.817 668 HB2 LEU 85 2HB LEU 85 -4.575 8.625 6.099 669 HB3 LEU 85 1HB LEU 85 -3.604 7.155 6.219 670 HG LEU 85 HG LEU 85 -3.317 9.383 4.201 671 HD11 LEU 85 1HD1 LEU 85 -1.714 8.342 6.528 672 HD12 LEU 85 2HD1 LEU 85 -2.176 10.006 6.169 673 HD13 LEU 85 3HD1 LEU 85 -0.914 9.213 5.222 674 HD21 LEU 85 3HD2 LEU 85 -1.191 7.617 3.876 675 HD22 LEU 85 1HD2 LEU 85 -2.571 7.771 2.791 676 HD23 LEU 85 2HD2 LEU 85 -2.582 6.552 4.065 677 H ASP 86 H ASP 86 -6.806 7.804 6.177 678 HA ASP 86 HA ASP 86 -7.248 5.551 7.752 679 HB2 ASP 86 2HB ASP 86 -9.020 7.693 6.595 680 HB3 ASP 86 1HB ASP 86 -9.726 6.427 7.601 681 H LYS 87 H LYS 87 -8.293 6.092 4.411 682 HA LYS 87 HA LYS 87 -9.841 3.578 4.340 683 HB2 LYS 87 2HB LYS 87 -8.994 5.491 2.135 684 HB3 LYS 87 1HB LYS 87 -10.295 4.304 2.050 685 HG2 LYS 87 2HG LYS 87 -10.178 6.763 3.817 686 HG3 LYS 87 1HG LYS 87 -11.305 6.453 2.495 687 HD2 LYS 87 2HD LYS 87 -12.146 4.455 3.762 688 HD3 LYS 87 1HD LYS 87 -11.125 4.941 5.116 689 HE2 LYS 87 2HE LYS 87 -12.755 7.160 4.105 690 HE3 LYS 87 1HE LYS 87 -13.730 5.804 4.706 691 HZ1 LYS 87 3HZ LYS 87 -12.480 5.774 6.727 692 HZ2 LYS 87 1HZ LYS 87 -13.023 7.361 6.481 693 HZ3 LYS 87 2HZ LYS 87 -11.405 6.956 6.152 694 H ILE 88 H ILE 88 -6.893 4.886 2.773 695 HA ILE 88 HA ILE 88 -6.093 2.472 1.480 696 HB ILE 88 HB ILE 88 -4.910 5.040 2.398 697 HG12 ILE 88 2HG1 ILE 88 -4.016 4.033 -0.125 698 HG13 ILE 88 1HG1 ILE 88 -5.764 3.831 0.024 699 HG21 ILE 88 1HG2 ILE 88 -3.263 3.212 3.144 700 HG22 ILE 88 2HG2 ILE 88 -2.635 4.462 2.075 701 HG23 ILE 88 3HG2 ILE 88 -3.051 2.880 1.425 702 HD11 ILE 88 3HD1 ILE 88 -4.866 6.411 1.043 703 HD12 ILE 88 1HD1 ILE 88 -6.121 6.054 -0.146 704 HD13 ILE 88 2HD1 ILE 88 -4.437 6.180 -0.650 705 H PHE 89 H PHE 89 -5.356 3.778 4.694 706 HA PHE 89 HA PHE 89 -3.774 1.593 5.649 707 HB2 PHE 89 2HB PHE 89 -4.446 4.094 6.473 708 HB3 PHE 89 1HB PHE 89 -5.483 3.130 7.524 709 HD1 PHE 89 1HD PHE 89 -1.942 3.395 6.335 710 HD2 PHE 89 2HD PHE 89 -4.608 2.145 9.462 711 HE1 PHE 89 1HE PHE 89 0.002 2.873 7.784 712 HE2 PHE 89 2HE PHE 89 -2.665 1.623 10.911 713 HZ PHE 89 HZ PHE 89 -0.359 1.986 10.071 714 H ALA 90 H ALA 90 -7.161 2.105 5.316 715 HA ALA 90 HA ALA 90 -8.002 -0.040 7.107 716 HB1 ALA 90 1HB ALA 90 -10.015 0.508 5.219 717 HB2 ALA 90 2HB ALA 90 -9.148 2.034 5.397 718 HB3 ALA 90 3HB ALA 90 -9.857 1.253 6.810 719 H GLY 91 H GLY 91 -7.042 0.382 3.798 720 HA2 GLY 91 2HA GLY 91 -8.026 -2.173 2.825 721 HA3 GLY 91 1HA GLY 91 -6.839 -1.142 2.015 722 H VAL 92 H VAL 92 -4.905 -0.905 3.972 723 HA VAL 92 HA VAL 92 -3.448 -3.384 3.751 724 HB VAL 92 HB VAL 92 -3.194 -0.755 5.207 725 HG11 VAL 92 1HG1 VAL 92 -1.005 -1.492 6.097 726 HG12 VAL 92 2HG1 VAL 92 -1.305 -3.118 5.485 727 HG13 VAL 92 3HG1 VAL 92 -2.318 -2.459 6.769 728 HG21 VAL 92 3HG2 VAL 92 -2.113 -0.279 3.288 729 HG22 VAL 92 1HG2 VAL 92 -2.262 -1.950 2.745 730 HG23 VAL 92 2HG2 VAL 92 -0.885 -1.463 3.733 731 H ASP 93 H ASP 93 -5.785 -2.121 5.968 732 HA ASP 93 HA ASP 93 -5.117 -3.732 8.286 733 HB2 ASP 93 2HB ASP 93 -6.951 -1.692 7.464 734 HB3 ASP 93 1HB ASP 93 -7.898 -3.029 8.122 735 H MET 94 H MET 94 -7.454 -4.035 5.606 736 HA MET 94 HA MET 94 -8.433 -6.634 6.478 737 HB2 MET 94 2HB MET 94 -8.498 -5.111 3.845 738 HB3 MET 94 1HB MET 94 -9.401 -6.598 4.142 739 HG2 MET 94 2HG MET 94 -10.999 -5.503 5.304 740 HG3 MET 94 1HG MET 94 -9.803 -4.631 6.261 741 HE1 MET 94 3HE MET 94 -11.185 -3.741 2.046 742 HE2 MET 94 1HE MET 94 -10.620 -5.253 2.772 743 HE3 MET 94 2HE MET 94 -9.460 -4.059 2.194 744 H ILE 95 H ILE 95 -6.182 -5.423 4.024 745 HA ILE 95 HA ILE 95 -5.253 -7.736 2.805 746 HB ILE 95 HB ILE 95 -4.106 -5.125 3.708 747 HG12 ILE 95 2HG1 ILE 95 -4.319 -6.504 1.013 748 HG13 ILE 95 1HG1 ILE 95 -5.457 -5.314 1.645 749 HG21 ILE 95 1HG2 ILE 95 -2.054 -6.088 2.207 750 HG22 ILE 95 2HG2 ILE 95 -2.533 -7.545 3.082 751 HG23 ILE 95 3HG2 ILE 95 -2.070 -6.091 3.971 752 HD11 ILE 95 3HD1 ILE 95 -3.318 -4.676 0.081 753 HD12 ILE 95 1HD1 ILE 95 -2.620 -4.478 1.689 754 HD13 ILE 95 2HD1 ILE 95 -4.058 -3.564 1.232 755 H THR 96 H THR 96 -4.360 -6.435 6.001 756 HA THR 96 HA THR 96 -2.487 -8.557 6.642 757 HB THR 96 HB THR 96 -4.009 -6.444 8.188 758 HG1 THR 96 1HG THR 96 -2.297 -5.756 6.871 759 HG21 THR 96 3HG2 THR 96 -3.678 -7.785 9.997 760 HG22 THR 96 1HG2 THR 96 -2.009 -7.228 9.874 761 HG23 THR 96 2HG2 THR 96 -2.477 -8.774 9.165 762 H ARG 97 H ARG 97 -5.889 -7.852 7.467 763 HA ARG 97 HA ARG 97 -6.421 -10.047 9.157 764 HB2 ARG 97 2HB ARG 97 -7.896 -8.206 7.372 765 HB3 ARG 97 1HB ARG 97 -8.739 -9.712 7.731 766 HG2 ARG 97 2HG ARG 97 -9.299 -8.904 9.752 767 HG3 ARG 97 1HG ARG 97 -7.587 -8.790 10.165 768 HD2 ARG 97 2HD ARG 97 -7.643 -6.530 10.002 769 HD3 ARG 97 1HD ARG 97 -8.375 -6.620 8.387 770 HE ARG 97 HE ARG 97 -10.428 -6.161 9.445 771 HH11 ARG 97 1HH2 ARG 97 -8.140 -7.166 11.770 772 HH12 ARG 97 2HH2 ARG 97 -9.316 -7.519 12.992 773 HH21 ARG 97 1HH1 ARG 97 -12.034 -6.915 10.922 774 HH22 ARG 97 2HH1 ARG 97 -11.524 -7.380 12.511 775 H MET 98 H MET 98 -6.936 -9.905 5.592 776 HA MET 98 HA MET 98 -7.545 -12.690 5.330 777 HB2 MET 98 2HB MET 98 -6.808 -12.185 2.899 778 HB3 MET 98 1HB MET 98 -8.141 -11.234 3.542 779 HG2 MET 98 2HG MET 98 -5.779 -9.848 4.239 780 HG3 MET 98 1HG MET 98 -5.590 -10.337 2.559 781 HE1 MET 98 3HE MET 98 -9.059 -10.403 1.934 782 HE2 MET 98 1HE MET 98 -7.551 -10.409 1.008 783 HE3 MET 98 2HE MET 98 -8.708 -9.097 0.804 784 H VAL 99 H VAL 99 -4.569 -10.856 5.494 785 HA VAL 99 HA VAL 99 -2.783 -12.951 4.630 786 HB VAL 99 HB VAL 99 -2.694 -10.292 5.991 787 HG11 VAL 99 1HG1 VAL 99 -1.199 -11.696 7.401 788 HG12 VAL 99 2HG1 VAL 99 -0.289 -10.501 6.476 789 HG13 VAL 99 3HG1 VAL 99 -0.317 -12.186 5.954 790 HG21 VAL 99 3HG2 VAL 99 -0.620 -10.844 4.059 791 HG22 VAL 99 1HG2 VAL 99 -1.958 -9.702 3.945 792 HG23 VAL 99 2HG2 VAL 99 -2.178 -11.373 3.426 793 H ASP 100 H ASP 100 -4.163 -11.933 7.744 794 HA ASP 100 HA ASP 100 -2.594 -13.743 9.376 795 HB2 ASP 100 2HB ASP 100 -4.080 -11.599 9.886 796 HB3 ASP 100 1HB ASP 100 -5.357 -12.800 10.083 797 H LYS 101 H LYS 101 -5.639 -13.952 7.610 798 HA LYS 101 HA LYS 101 -6.269 -16.607 8.688 799 HB2 LYS 101 2HB LYS 101 -8.314 -15.932 8.033 800 HB3 LYS 101 1HB LYS 101 -7.594 -14.436 7.454 801 HG2 LYS 101 2HG LYS 101 -7.014 -16.098 5.371 802 HG3 LYS 101 1HG LYS 101 -8.534 -16.788 5.931 803 HD2 LYS 101 2HD LYS 101 -8.910 -14.043 6.045 804 HD3 LYS 101 1HD LYS 101 -8.017 -14.312 4.549 805 HE2 LYS 101 2HE LYS 101 -10.213 -14.680 3.812 806 HE3 LYS 101 1HE LYS 101 -9.740 -16.324 4.288 807 HZ1 LYS 101 3HZ LYS 101 -11.513 -14.452 5.643 808 HZ2 LYS 101 1HZ LYS 101 -10.474 -15.350 6.636 809 HZ3 LYS 101 2HZ LYS 101 -11.557 -16.148 5.598 810 H ILE 102 H ILE 102 -4.970 -15.099 5.780 811 HA ILE 102 HA ILE 102 -4.784 -17.401 4.106 812 HB ILE 102 HB ILE 102 -3.456 -14.721 4.407 813 HG12 ILE 102 2HG1 ILE 102 -4.948 -16.151 2.189 814 HG13 ILE 102 1HG1 ILE 102 -5.551 -14.844 3.205 815 HG21 ILE 102 1HG2 ILE 102 -2.188 -17.059 3.177 816 HG22 ILE 102 2HG2 ILE 102 -1.498 -15.489 3.588 817 HG23 ILE 102 3HG2 ILE 102 -2.355 -15.703 2.063 818 HD11 ILE 102 3HD1 ILE 102 -4.804 -13.407 1.651 819 HD12 ILE 102 1HD1 ILE 102 -3.950 -14.689 0.793 820 HD13 ILE 102 2HD1 ILE 102 -3.170 -13.853 2.138 821 H VAL 103 H VAL 103 -2.895 -16.082 6.713 822 HA VAL 103 HA VAL 103 -0.635 -17.927 6.458 823 HB VAL 103 HB VAL 103 -1.648 -15.804 8.325 824 HG11 VAL 103 1HG1 VAL 103 -0.955 -17.382 9.966 825 HG12 VAL 103 2HG1 VAL 103 0.430 -16.310 9.758 826 HG13 VAL 103 3HG1 VAL 103 0.424 -17.901 8.997 827 HG21 VAL 103 3HG2 VAL 103 0.838 -15.120 7.944 828 HG22 VAL 103 1HG2 VAL 103 -0.293 -14.952 6.601 829 HG23 VAL 103 2HG2 VAL 103 0.808 -16.329 6.660 830 H SER 104 H SER 104 -3.662 -17.723 8.237 831 HA SER 104 HA SER 104 -3.112 -20.056 9.913 832 HB2 SER 104 2HB SER 104 -4.549 -17.931 10.344 833 HB3 SER 104 1HB SER 104 -5.773 -18.761 9.387 834 HG SER 104 HG SER 104 -4.484 -19.743 11.726 835 H GLU 105 H GLU 105 -4.487 -19.441 6.835 836 HA GLU 105 HA GLU 105 -5.064 -22.337 6.486 837 HB2 GLU 105 2HB GLU 105 -7.142 -20.351 5.614 838 HB3 GLU 105 1HB GLU 105 -7.342 -22.044 6.059 839 HG2 GLU 105 2HG GLU 105 -6.681 -21.300 8.445 840 HG3 GLU 105 1HG GLU 105 -6.993 -19.658 7.876 841 H GLY 106 H GLY 106 -4.826 -19.092 5.053 842 HA2 GLY 106 2HA GLY 106 -3.442 -18.784 3.035 843 HA3 GLY 106 1HA GLY 106 -3.915 -20.405 2.525 844 H SER 107 H SER 107 -6.391 -18.446 3.924 845 HA SER 107 HA SER 107 -7.666 -18.175 1.229 846 HB2 SER 107 2HB SER 107 -8.718 -18.007 4.064 847 HB3 SER 107 1HB SER 107 -9.703 -17.838 2.613 848 HG SER 107 HG SER 107 -8.035 -20.076 2.916 849 H ASP 108 H ASP 108 -7.693 -16.203 0.332 850 HA ASP 108 HA ASP 108 -7.011 -13.829 2.018 851 HB2 ASP 108 2HB ASP 108 -5.766 -14.492 -0.112 852 HB3 ASP 108 1HB ASP 108 -7.242 -14.122 -1.000 853 H ASP 109 H ASP 109 -9.696 -15.437 1.451 854 HA ASP 109 HA ASP 109 -11.344 -13.106 0.531 855 HB2 ASP 109 2HB ASP 109 -13.056 -14.851 0.175 856 HB3 ASP 109 1HB ASP 109 -11.546 -15.289 -0.622 857 H ILE 110 H ILE 110 -11.615 -11.868 2.437 858 HA ILE 110 HA ILE 110 -12.696 -13.304 4.826 859 HB ILE 110 HB ILE 110 -12.018 -11.122 5.961 860 HG12 ILE 110 2HG1 ILE 110 -10.540 -10.666 3.355 861 HG13 ILE 110 1HG1 ILE 110 -12.033 -9.827 3.779 862 HG21 ILE 110 1HG2 ILE 110 -9.513 -11.654 5.689 863 HG22 ILE 110 2HG2 ILE 110 -10.020 -12.908 4.559 864 HG23 ILE 110 3HG2 ILE 110 -10.545 -12.973 6.241 865 HD11 ILE 110 3HD1 ILE 110 -10.960 -8.950 5.824 866 HD12 ILE 110 1HD1 ILE 110 -10.058 -8.472 4.385 867 HD13 ILE 110 2HD1 ILE 110 -9.467 -9.788 5.399 868 H GLY 111 H GLY 111 -14.120 -12.289 2.284 869 HA2 GLY 111 2HA GLY 111 -16.309 -11.522 1.898 870 HA3 GLY 111 1HA GLY 111 -16.500 -11.344 3.642 871 H GLU 112 H GLU 112 -13.726 -9.708 2.848 872 HA GLU 112 HA GLU 112 -14.927 -7.121 3.307 873 HB2 GLU 112 2HB GLU 112 -12.226 -8.185 2.496 874 HB3 GLU 112 1HB GLU 112 -12.518 -6.446 2.553 875 HG2 GLU 112 2HG GLU 112 -12.865 -8.411 4.835 876 HG3 GLU 112 1HG GLU 112 -11.638 -7.151 4.707 877 H ASN 113 H ASN 113 -15.052 -5.340 1.800 878 HA ASN 113 HA ASN 113 -15.734 -6.179 -0.954 879 HB2 ASN 113 2HB ASN 113 -15.833 -3.368 0.101 880 HB3 ASN 113 1HB ASN 113 -16.936 -4.177 -1.010 881 HD21 ASN 113 1HD2 ASN 113 -17.605 -6.499 0.401 882 HD22 ASN 113 2HD2 ASN 113 -18.389 -6.085 1.848 883 H ILE 114 H ILE 114 -14.509 -5.667 -2.753 884 HA ILE 114 HA ILE 114 -11.967 -4.159 -2.265 885 HB ILE 114 HB ILE 114 -12.748 -6.212 -4.360 886 HG12 ILE 114 2HG1 ILE 114 -12.445 -7.445 -2.385 887 HG13 ILE 114 1HG1 ILE 114 -10.829 -7.461 -3.086 888 HG21 ILE 114 1HG2 ILE 114 -9.925 -5.387 -3.865 889 HG22 ILE 114 2HG2 ILE 114 -10.954 -4.266 -4.758 890 HG23 ILE 114 3HG2 ILE 114 -10.700 -5.905 -5.363 891 HD11 ILE 114 3HD1 ILE 114 -10.784 -6.913 -0.665 892 HD12 ILE 114 1HD1 ILE 114 -11.790 -5.498 -0.983 893 HD13 ILE 114 2HD1 ILE 114 -10.158 -5.591 -1.650 894 H ASP 115 H ASP 115 -13.643 -4.901 -5.325 895 HA ASP 115 HA ASP 115 -13.138 -2.517 -6.647 896 HB2 ASP 115 2HB ASP 115 -14.301 -4.584 -7.512 897 HB3 ASP 115 1HB ASP 115 -15.760 -4.037 -6.683 898 H VAL 116 H VAL 116 -15.344 -3.160 -4.100 899 HA VAL 116 HA VAL 116 -16.760 -0.610 -4.259 900 HB VAL 116 HB VAL 116 -16.619 -2.785 -2.160 901 HG11 VAL 116 1HG1 VAL 116 -17.486 -0.496 -1.444 902 HG12 VAL 116 2HG1 VAL 116 -18.615 -1.834 -1.226 903 HG13 VAL 116 3HG1 VAL 116 -18.805 -0.733 -2.590 904 HG21 VAL 116 3HG2 VAL 116 -17.456 -3.286 -4.595 905 HG22 VAL 116 1HG2 VAL 116 -18.883 -2.372 -4.103 906 HG23 VAL 116 2HG2 VAL 116 -18.427 -3.834 -3.227 907 H PHE 117 H PHE 117 -14.534 -2.167 -2.026 908 HA PHE 117 HA PHE 117 -14.090 0.101 -0.324 909 HB2 PHE 117 2HB PHE 117 -13.500 -2.139 0.353 910 HB3 PHE 117 1HB PHE 117 -12.462 -2.348 -1.058 911 HD1 PHE 117 1HD PHE 117 -12.846 -0.515 2.151 912 HD2 PHE 117 2HD PHE 117 -10.221 -1.532 -1.092 913 HE1 PHE 117 1HE PHE 117 -10.922 0.397 3.422 914 HE2 PHE 117 2HE PHE 117 -8.298 -0.618 0.177 915 HZ PHE 117 HZ PHE 117 -8.649 0.343 2.434 916 H SER 118 H SER 118 -12.914 -0.758 -3.479 917 HA SER 118 HA SER 118 -10.719 1.186 -3.418 918 HB2 SER 118 2HB SER 118 -9.949 -0.089 -5.152 919 HB3 SER 118 1HB SER 118 -11.186 -1.238 -4.646 920 HG SER 118 HG SER 118 -11.855 -0.892 -6.628 921 H ASP 119 H ASP 119 -13.789 0.580 -4.967 922 HA ASP 119 HA ASP 119 -13.887 2.983 -6.545 923 HB2 ASP 119 2HB ASP 119 -15.286 1.025 -7.001 924 HB3 ASP 119 1HB ASP 119 -16.040 1.171 -5.412 925 H THR 120 H THR 120 -14.595 2.160 -3.291 926 HA THR 120 HA THR 120 -16.091 4.503 -2.538 927 HB THR 120 HB THR 120 -14.706 2.184 -1.308 928 HG1 THR 120 1HG THR 120 -17.189 3.429 -1.302 929 HG21 THR 120 3HG2 THR 120 -15.223 3.349 0.997 930 HG22 THR 120 1HG2 THR 120 -14.964 4.828 0.072 931 HG23 THR 120 2HG2 THR 120 -13.681 3.623 0.186 932 H ILE 121 H ILE 121 -12.750 3.530 -2.355 933 HA ILE 121 HA ILE 121 -11.741 6.060 -1.346 934 HB ILE 121 HB ILE 121 -10.920 3.360 -1.863 935 HG12 ILE 121 2HG1 ILE 121 -10.736 4.588 0.254 936 HG13 ILE 121 1HG1 ILE 121 -9.173 3.933 -0.238 937 HG21 ILE 121 1HG2 ILE 121 -9.719 3.955 -3.814 938 HG22 ILE 121 2HG2 ILE 121 -8.510 3.948 -2.530 939 HG23 ILE 121 3HG2 ILE 121 -9.169 5.478 -3.111 940 HD11 ILE 121 3HD1 ILE 121 -8.368 6.033 0.011 941 HD12 ILE 121 1HD1 ILE 121 -9.989 6.720 0.106 942 HD13 ILE 121 2HD1 ILE 121 -9.246 6.428 -1.466 943 H LYS 122 H LYS 122 -11.926 4.471 -4.533 944 HA LYS 122 HA LYS 122 -10.511 6.393 -6.062 945 HB2 LYS 122 2HB LYS 122 -12.264 4.075 -6.359 946 HB3 LYS 122 1HB LYS 122 -12.572 5.282 -7.612 947 HG2 LYS 122 2HG LYS 122 -10.754 4.465 -8.671 948 HG3 LYS 122 1HG LYS 122 -9.815 5.254 -7.406 949 HD2 LYS 122 2HD LYS 122 -10.860 2.718 -6.476 950 HD3 LYS 122 1HD LYS 122 -9.900 2.507 -7.939 951 HE2 LYS 122 2HE LYS 122 -8.707 4.376 -5.978 952 HE3 LYS 122 1HE LYS 122 -8.806 2.689 -5.431 953 HZ1 LYS 122 3HZ LYS 122 -7.434 3.801 -7.780 954 HZ2 LYS 122 1HZ LYS 122 -8.040 2.219 -7.862 955 HZ3 LYS 122 2HZ LYS 122 -6.895 2.627 -6.675 956 H SER 123 H SER 123 -13.855 6.161 -4.968 957 HA SER 123 HA SER 123 -14.718 8.535 -6.427 958 HB2 SER 123 2HB SER 123 -15.817 6.535 -4.516 959 HB3 SER 123 1HB SER 123 -16.664 8.072 -4.658 960 HG SER 123 HG SER 123 -15.890 6.655 -6.963 961 H PHE 124 H PHE 124 -13.172 7.813 -3.487 962 HA PHE 124 HA PHE 124 -14.049 10.136 -1.965 963 HB2 PHE 124 2HB PHE 124 -13.180 7.989 -1.018 964 HB3 PHE 124 1HB PHE 124 -11.597 8.370 -1.697 965 HD1 PHE 124 1HD PHE 124 -14.075 10.678 -0.129 966 HD2 PHE 124 2HD PHE 124 -10.243 8.768 0.206 967 HE1 PHE 124 1HE PHE 124 -13.556 12.071 1.855 968 HE2 PHE 124 2HE PHE 124 -9.722 10.160 2.192 969 HZ PHE 124 HZ PHE 124 -11.380 11.812 3.017 970 H ALA 125 H ALA 125 -12.167 9.825 -4.671 971 HA ALA 125 HA ALA 125 -10.604 12.308 -4.024 972 HB1 ALA 125 1HB ALA 125 -9.356 10.880 -6.117 973 HB2 ALA 125 2HB ALA 125 -9.839 9.666 -4.933 974 HB3 ALA 125 3HB ALA 125 -8.804 11.008 -4.447 975 H SER 126 H SER 126 -12.849 10.751 -6.144 976 HA SER 126 HA SER 126 -12.430 12.822 -8.258 977 HB2 SER 126 2HB SER 126 -13.742 11.256 -9.636 978 HB3 SER 126 1HB SER 126 -12.402 10.414 -8.862 979 HG SER 126 HG SER 126 -13.953 9.146 -8.196 980 H SER 127 H SER 127 -15.251 11.122 -6.829 981 HA SER 127 HA SER 127 -17.267 12.909 -7.519 982 HB2 SER 127 2HB SER 127 -16.778 11.284 -5.012 983 HB3 SER 127 1HB SER 127 -18.310 12.089 -5.337 984 HG SER 127 HG SER 127 -18.637 10.794 -7.052 985 H GLY 128 H GLY 128 -16.704 15.126 -7.420 986 HA2 GLY 128 2HA GLY 128 -17.187 16.565 -5.062 987 HA3 GLY 128 1HA GLY 128 -15.439 16.342 -5.135 988 H LYS 129 H LYS 129 -14.857 18.465 -5.616 989 HA LYS 129 HA LYS 129 -14.516 20.365 -6.982 990 HB2 LYS 129 2HB LYS 129 -15.526 18.499 -9.150 991 HB3 LYS 129 1HB LYS 129 -14.399 19.844 -9.335 992 HG2 LYS 129 2HG LYS 129 -12.651 18.526 -8.809 993 HG3 LYS 129 1HG LYS 129 -13.435 18.009 -7.316 994 HD2 LYS 129 2HD LYS 129 -14.548 16.211 -8.388 995 HD3 LYS 129 1HD LYS 129 -14.236 16.870 -9.994 996 HE2 LYS 129 2HE LYS 129 -11.717 16.580 -9.391 997 HE3 LYS 129 1HE LYS 129 -12.312 15.484 -8.128 998 HZ1 LYS 129 3HZ LYS 129 -13.668 14.384 -9.867 999 HZ2 LYS 129 1HZ LYS 129 -12.000 14.216 -10.118 1000 HZ3 LYS 129 2HZ LYS 129 -12.889 15.334 -11.039 1001 H GLU 130 H GLU 130 -15.815 21.654 -8.855 1002 HA GLU 130 HA GLU 130 -18.406 22.303 -7.721 1003 HB2 GLU 130 2HB GLU 130 -16.550 23.652 -9.082 1004 HB3 GLU 130 1HB GLU 130 -17.535 23.153 -10.458 1005 HG2 GLU 130 2HG GLU 130 -18.847 24.932 -9.988 1006 HG3 GLU 130 1HG GLU 130 -19.414 24.007 -8.598 1007 H LYS 131 H LYS 131 -19.839 20.531 -7.939 1008 HA LYS 131 HA LYS 131 -20.748 19.975 -10.720 1009 HB2 LYS 131 2HB LYS 131 -19.044 18.305 -9.221 1010 HB3 LYS 131 1HB LYS 131 -20.636 17.552 -9.126 1011 HG2 LYS 131 2HG LYS 131 -20.811 17.348 -11.473 1012 HG3 LYS 131 1HG LYS 131 -19.529 18.526 -11.757 1013 HD2 LYS 131 2HD LYS 131 -18.636 16.256 -10.137 1014 HD3 LYS 131 1HD LYS 131 -19.204 15.772 -11.735 1015 HE2 LYS 131 2HE LYS 131 -17.365 18.142 -11.495 1016 HE3 LYS 131 1HE LYS 131 -16.692 16.500 -11.455 1017 HZ1 LYS 131 3HZ LYS 131 -17.406 16.046 -13.553 1018 HZ2 LYS 131 1HZ LYS 131 -17.183 17.718 -13.727 1019 HZ3 LYS 131 2HZ LYS 131 -18.740 17.094 -13.458 1020 H LEU 132 H LEU 132 -22.810 18.510 -10.549 1021 HA LEU 132 HA LEU 132 -24.740 19.829 -8.860 1022 HB2 LEU 132 2HB LEU 132 -24.823 18.474 -11.161 1023 HB3 LEU 132 1HB LEU 132 -25.219 17.138 -10.079 1024 HG LEU 132 HG LEU 132 -26.796 19.220 -9.130 1025 HD11 LEU 132 1HD1 LEU 132 -27.862 19.449 -11.708 1026 HD12 LEU 132 2HD1 LEU 132 -26.128 19.684 -11.926 1027 HD13 LEU 132 3HD1 LEU 132 -27.023 20.712 -10.808 1028 HD21 LEU 132 3HD2 LEU 132 -28.637 17.917 -10.326 1029 HD22 LEU 132 1HD2 LEU 132 -27.586 16.959 -9.282 1030 HD23 LEU 132 2HD2 LEU 132 -27.357 16.928 -11.031 1031 H GLU 133 H GLU 133 -24.957 19.452 -6.686 1032 HA GLU 133 HA GLU 133 -24.915 16.656 -5.693 1033 HB2 GLU 133 2HB GLU 133 -22.585 17.848 -5.703 1034 HB3 GLU 133 1HB GLU 133 -23.231 18.751 -4.333 1035 HG2 GLU 133 2HG GLU 133 -23.602 16.733 -3.075 1036 HG3 GLU 133 1HG GLU 133 -23.240 15.727 -4.478 Start of MODEL 4 1 H1 MET 1 1HT MET 1 7.688 -29.761 0.644 2 H2 MET 1 2HT MET 1 8.621 -28.581 1.434 3 H3 MET 1 3HT MET 1 8.792 -30.220 1.849 4 HA MET 1 HA MET 1 10.656 -29.666 0.489 5 HB2 MET 1 2HB MET 1 8.417 -31.163 -0.911 6 HB3 MET 1 1HB MET 1 10.105 -31.226 -1.421 7 HG2 MET 1 2HG MET 1 10.080 -31.705 1.376 8 HG3 MET 1 1HG MET 1 8.812 -32.711 0.675 9 HE1 MET 1 2HE MET 1 11.951 -31.120 -0.101 10 HE2 MET 1 3HE MET 1 12.406 -31.993 -1.563 11 HE3 MET 1 1HE MET 1 13.182 -32.379 -0.022 12 H MET 2 H MET 2 7.558 -28.654 -0.924 13 HA MET 2 HA MET 2 9.072 -26.712 -2.635 14 HB2 MET 2 2HB MET 2 7.697 -28.979 -3.472 15 HB3 MET 2 1HB MET 2 6.530 -27.680 -3.722 16 HG2 MET 2 2HG MET 2 8.219 -26.405 -4.991 17 HG3 MET 2 1HG MET 2 9.382 -27.710 -4.751 18 HE1 MET 2 3HE MET 2 8.189 -27.421 -8.455 19 HE2 MET 2 1HE MET 2 8.691 -26.340 -7.149 20 HE3 MET 2 2HE MET 2 6.994 -26.441 -7.609 21 H GLU 3 H GLU 3 7.938 -26.117 -0.076 22 HA GLU 3 HA GLU 3 5.527 -24.492 -0.820 23 HB2 GLU 3 2HB GLU 3 5.084 -24.650 1.659 24 HB3 GLU 3 1HB GLU 3 5.041 -26.210 0.828 25 HG2 GLU 3 2HG GLU 3 7.243 -26.768 1.590 26 HG3 GLU 3 1HG GLU 3 7.536 -25.117 2.151 27 H GLU 4 H GLU 4 8.773 -24.275 -0.167 28 HA GLU 4 HA GLU 4 8.841 -22.085 1.659 29 HB2 GLU 4 2HB GLU 4 10.706 -23.670 1.049 30 HB3 GLU 4 1HB GLU 4 10.837 -22.833 -0.498 31 HG2 GLU 4 2HG GLU 4 11.657 -20.880 0.471 32 HG3 GLU 4 1HG GLU 4 10.931 -21.233 2.040 33 H TYR 5 H TYR 5 7.722 -22.213 -1.488 34 HA TYR 5 HA TYR 5 8.632 -19.722 -2.571 35 HB2 TYR 5 2HB TYR 5 6.403 -21.660 -3.021 36 HB3 TYR 5 1HB TYR 5 6.288 -20.079 -3.795 37 HD1 TYR 5 2HD TYR 5 8.956 -22.659 -3.171 38 HD2 TYR 5 1HD TYR 5 7.107 -19.967 -5.963 39 HE1 TYR 5 2HE TYR 5 10.529 -23.410 -4.939 40 HE2 TYR 5 1HE TYR 5 8.676 -20.720 -7.729 41 HH TYR 5 HH TYR 5 10.209 -23.323 -7.836 42 H LEU 6 H LEU 6 5.829 -20.631 -0.699 43 HA LEU 6 HA LEU 6 4.834 -17.863 -0.517 44 HB2 LEU 6 2HB LEU 6 2.971 -18.916 0.593 45 HB3 LEU 6 1HB LEU 6 3.446 -19.991 -0.721 46 HG LEU 6 HG LEU 6 5.055 -20.815 1.389 47 HD11 LEU 6 1HD1 LEU 6 4.013 -19.817 3.190 48 HD12 LEU 6 2HD1 LEU 6 3.018 -21.267 3.058 49 HD13 LEU 6 3HD1 LEU 6 2.448 -19.743 2.380 50 HD21 LEU 6 3HD2 LEU 6 2.825 -21.799 -0.199 51 HD22 LEU 6 1HD2 LEU 6 2.778 -22.457 1.435 52 HD23 LEU 6 2HD2 LEU 6 4.214 -22.680 0.437 53 H GLY 7 H GLY 7 6.789 -20.091 1.321 54 HA2 GLY 7 2HA GLY 7 6.483 -18.978 3.926 55 HA3 GLY 7 1HA GLY 7 7.911 -19.848 3.365 56 H VAL 8 H VAL 8 8.868 -18.220 1.356 57 HA VAL 8 HA VAL 8 9.901 -15.955 2.914 58 HB VAL 8 HB VAL 8 10.482 -17.304 0.294 59 HG11 VAL 8 1HG1 VAL 8 12.194 -15.611 -0.201 60 HG12 VAL 8 2HG1 VAL 8 11.698 -14.679 1.212 61 HG13 VAL 8 3HG1 VAL 8 10.597 -14.865 -0.153 62 HG21 VAL 8 3HG2 VAL 8 11.796 -16.900 2.946 63 HG22 VAL 8 1HG2 VAL 8 12.839 -17.056 1.533 64 HG23 VAL 8 2HG2 VAL 8 11.714 -18.350 1.945 65 H PHE 9 H PHE 9 7.582 -16.528 0.445 66 HA PHE 9 HA PHE 9 7.446 -13.793 -0.557 67 HB2 PHE 9 2HB PHE 9 5.873 -16.343 -0.781 68 HB3 PHE 9 1HB PHE 9 5.150 -14.840 -1.350 69 HD1 PHE 9 2HD PHE 9 8.759 -15.755 -1.392 70 HD2 PHE 9 1HD PHE 9 5.198 -15.133 -3.712 71 HE1 PHE 9 2HE PHE 9 10.092 -15.901 -3.478 72 HE2 PHE 9 1HE PHE 9 6.531 -15.278 -5.798 73 HZ PHE 9 HZ PHE 9 8.978 -15.663 -5.682 74 H VAL 10 H VAL 10 6.090 -15.572 2.118 75 HA VAL 10 HA VAL 10 3.994 -13.549 2.645 76 HB VAL 10 HB VAL 10 4.916 -16.115 3.979 77 HG11 VAL 10 1HG1 VAL 10 3.091 -15.900 5.522 78 HG12 VAL 10 2HG1 VAL 10 2.460 -14.488 4.676 79 HG13 VAL 10 3HG1 VAL 10 3.971 -14.372 5.576 80 HG21 VAL 10 3HG2 VAL 10 3.674 -16.168 1.751 81 HG22 VAL 10 1HG2 VAL 10 2.296 -15.471 2.601 82 HG23 VAL 10 2HG2 VAL 10 2.908 -17.058 3.067 83 H ASP 11 H ASP 11 7.151 -14.581 3.903 84 HA ASP 11 HA ASP 11 7.060 -12.931 6.273 85 HB2 ASP 11 2HB ASP 11 8.518 -14.911 5.954 86 HB3 ASP 11 1HB ASP 11 9.379 -14.053 4.675 87 H GLU 12 H GLU 12 7.710 -12.375 2.964 88 HA GLU 12 HA GLU 12 9.079 -9.789 3.414 89 HB2 GLU 12 2HB GLU 12 8.375 -11.570 1.092 90 HB3 GLU 12 1HB GLU 12 8.852 -9.898 0.793 91 HG2 GLU 12 2HG GLU 12 10.586 -11.323 2.701 92 HG3 GLU 12 1HG GLU 12 10.609 -11.990 1.069 93 H THR 13 H THR 13 5.978 -11.037 2.180 94 HA THR 13 HA THR 13 4.865 -8.572 1.298 95 HB THR 13 HB THR 13 4.130 -11.108 1.144 96 HG1 THR 13 1HG THR 13 2.371 -8.903 1.369 97 HG21 THR 13 3HG2 THR 13 2.430 -11.779 2.680 98 HG22 THR 13 1HG2 THR 13 2.342 -10.168 3.394 99 HG23 THR 13 2HG2 THR 13 3.760 -11.179 3.671 100 H LYS 14 H LYS 14 5.046 -10.017 4.527 101 HA LYS 14 HA LYS 14 3.323 -7.951 5.726 102 HB2 LYS 14 2HB LYS 14 5.066 -10.166 6.862 103 HB3 LYS 14 1HB LYS 14 3.919 -9.208 7.801 104 HG2 LYS 14 2HG LYS 14 2.122 -10.336 6.988 105 HG3 LYS 14 1HG LYS 14 2.785 -10.398 5.355 106 HD2 LYS 14 2HD LYS 14 3.275 -12.565 5.717 107 HD3 LYS 14 1HD LYS 14 4.472 -12.033 6.898 108 HE2 LYS 14 2HE LYS 14 1.621 -12.137 7.796 109 HE3 LYS 14 1HE LYS 14 2.489 -13.675 7.612 110 HZ1 LYS 14 3HZ LYS 14 3.620 -11.325 9.027 111 HZ2 LYS 14 1HZ LYS 14 4.231 -12.907 9.002 112 HZ3 LYS 14 2HZ LYS 14 2.783 -12.571 9.825 113 H GLU 15 H GLU 15 6.806 -8.786 5.750 114 HA GLU 15 HA GLU 15 7.612 -6.681 7.512 115 HB2 GLU 15 2HB GLU 15 8.950 -8.298 5.339 116 HB3 GLU 15 1HB GLU 15 9.845 -7.125 6.307 117 HG2 GLU 15 2HG GLU 15 8.895 -8.332 8.361 118 HG3 GLU 15 1HG GLU 15 8.421 -9.616 7.250 119 H TYR 16 H TYR 16 6.472 -6.645 4.335 120 HA TYR 16 HA TYR 16 7.803 -4.122 3.594 121 HB2 TYR 16 2HB TYR 16 6.289 -6.303 2.298 122 HB3 TYR 16 1HB TYR 16 5.970 -4.700 1.632 123 HD1 TYR 16 2HD TYR 16 8.955 -6.579 2.932 124 HD2 TYR 16 1HD TYR 16 7.314 -4.105 -0.172 125 HE1 TYR 16 2HE TYR 16 11.126 -6.640 1.735 126 HE2 TYR 16 1HE TYR 16 9.485 -4.165 -1.369 127 HH TYR 16 HH TYR 16 11.796 -4.581 -0.962 128 H LEU 17 H LEU 17 4.547 -5.323 4.429 129 HA LEU 17 HA LEU 17 3.133 -2.877 3.962 130 HB2 LEU 17 2HB LEU 17 2.754 -5.184 5.897 131 HB3 LEU 17 1HB LEU 17 1.549 -3.918 5.659 132 HG LEU 17 HG LEU 17 2.642 -5.741 3.507 133 HD11 LEU 17 1HD1 LEU 17 1.149 -7.040 4.800 134 HD12 LEU 17 2HD1 LEU 17 0.143 -6.423 3.489 135 HD13 LEU 17 3HD1 LEU 17 0.072 -5.673 5.084 136 HD21 LEU 17 3HD2 LEU 17 0.634 -4.653 2.261 137 HD22 LEU 17 1HD2 LEU 17 2.114 -3.708 2.429 138 HD23 LEU 17 2HD2 LEU 17 0.745 -3.398 3.496 139 H GLN 18 H GLN 18 4.921 -4.139 6.729 140 HA GLN 18 HA GLN 18 4.350 -1.933 8.501 141 HB2 GLN 18 2HB GLN 18 5.281 -3.450 9.873 142 HB3 GLN 18 1HB GLN 18 5.655 -4.440 8.472 143 HG2 GLN 18 2HG GLN 18 7.803 -3.315 8.196 144 HG3 GLN 18 1HG GLN 18 7.424 -2.216 9.524 145 HE21 GLN 18 1HE2 GLN 18 8.710 -5.339 8.745 146 HE22 GLN 18 2HE2 GLN 18 8.898 -5.894 10.338 147 H ASN 19 H ASN 19 7.049 -2.822 6.462 148 HA ASN 19 HA ASN 19 8.584 -0.430 6.838 149 HB2 ASN 19 2HB ASN 19 9.704 -2.280 5.865 150 HB3 ASN 19 1HB ASN 19 8.362 -2.618 4.768 151 HD21 ASN 19 1HD2 ASN 19 8.384 -1.589 2.717 152 HD22 ASN 19 2HD2 ASN 19 9.577 -0.484 2.231 153 H LEU 20 H LEU 20 5.774 -1.290 5.102 154 HA LEU 20 HA LEU 20 5.776 1.144 3.429 155 HB2 LEU 20 2HB LEU 20 5.001 -0.806 2.320 156 HB3 LEU 20 1HB LEU 20 4.081 -1.328 3.729 157 HG LEU 20 HG LEU 20 2.603 0.676 3.436 158 HD11 LEU 20 1HD1 LEU 20 3.131 2.287 1.951 159 HD12 LEU 20 2HD1 LEU 20 3.280 1.106 0.650 160 HD13 LEU 20 3HD1 LEU 20 4.663 1.456 1.686 161 HD21 LEU 20 3HD2 LEU 20 2.082 -1.612 2.502 162 HD22 LEU 20 1HD2 LEU 20 2.760 -1.075 0.966 163 HD23 LEU 20 2HD2 LEU 20 1.325 -0.286 1.620 164 H ASN 21 H ASN 21 4.822 0.152 6.520 165 HA ASN 21 HA ASN 21 2.610 2.093 6.714 166 HB2 ASN 21 2HB ASN 21 3.672 -0.231 8.207 167 HB3 ASN 21 1HB ASN 21 3.093 1.097 9.217 168 HD21 ASN 21 1HD2 ASN 21 1.321 -0.512 9.826 169 HD22 ASN 21 2HD2 ASN 21 -0.023 -0.650 8.798 170 H ASP 22 H ASP 22 5.889 1.436 7.513 171 HA ASP 22 HA ASP 22 6.285 3.601 9.299 172 HB2 ASP 22 2HB ASP 22 8.202 2.154 7.457 173 HB3 ASP 22 1HB ASP 22 8.689 3.156 8.825 174 H THR 23 H THR 23 6.373 3.111 5.922 175 HA THR 23 HA THR 23 7.356 5.732 5.111 176 HB THR 23 HB THR 23 5.774 3.499 3.831 177 HG1 THR 23 1HG THR 23 8.489 4.279 3.555 178 HG21 THR 23 3HG2 THR 23 5.278 5.393 2.500 179 HG22 THR 23 1HG2 THR 23 6.628 4.620 1.668 180 HG23 THR 23 2HG2 THR 23 6.909 6.043 2.671 181 H LEU 24 H LEU 24 4.196 4.118 5.400 182 HA LEU 24 HA LEU 24 2.615 6.391 4.558 183 HB2 LEU 24 2HB LEU 24 2.261 3.683 5.744 184 HB3 LEU 24 1HB LEU 24 0.951 4.826 6.043 185 HG LEU 24 HG LEU 24 2.091 4.256 3.295 186 HD11 LEU 24 1HD1 LEU 24 0.628 2.534 3.034 187 HD12 LEU 24 2HD1 LEU 24 -0.640 3.353 3.945 188 HD13 LEU 24 3HD1 LEU 24 0.631 2.478 4.797 189 HD21 LEU 24 3HD2 LEU 24 -0.610 5.418 3.906 190 HD22 LEU 24 1HD2 LEU 24 0.398 5.638 2.476 191 HD23 LEU 24 2HD2 LEU 24 0.810 6.461 3.981 192 H LEU 25 H LEU 25 4.029 5.246 7.552 193 HA LEU 25 HA LEU 25 2.461 7.118 9.208 194 HB2 LEU 25 2HB LEU 25 4.788 5.251 9.699 195 HB3 LEU 25 1HB LEU 25 4.036 6.212 10.978 196 HG LEU 25 HG LEU 25 2.370 4.509 9.161 197 HD11 LEU 25 1HD1 LEU 25 2.537 2.955 11.356 198 HD12 LEU 25 2HD1 LEU 25 4.160 3.646 11.375 199 HD13 LEU 25 3HD1 LEU 25 3.600 2.747 9.965 200 HD21 LEU 25 3HD2 LEU 25 1.538 6.337 10.826 201 HD22 LEU 25 1HD2 LEU 25 1.907 5.138 12.068 202 HD23 LEU 25 2HD2 LEU 25 0.723 4.772 10.813 203 H GLU 26 H GLU 26 5.271 7.204 7.342 204 HA GLU 26 HA GLU 26 6.319 9.599 8.736 205 HB2 GLU 26 2HB GLU 26 7.316 7.762 6.540 206 HB3 GLU 26 1HB GLU 26 8.124 9.284 6.913 207 HG2 GLU 26 2HG GLU 26 8.530 8.563 9.201 208 HG3 GLU 26 1HG GLU 26 7.615 7.079 8.928 209 H LEU 27 H LEU 27 4.685 8.371 6.002 210 HA LEU 27 HA LEU 27 4.740 10.758 4.447 211 HB2 LEU 27 2HB LEU 27 4.403 8.665 3.339 212 HB3 LEU 27 1HB LEU 27 3.096 8.231 4.442 213 HG LEU 27 HG LEU 27 1.831 10.246 3.551 214 HD11 LEU 27 1HD1 LEU 27 2.563 11.308 1.559 215 HD12 LEU 27 2HD1 LEU 27 3.791 10.078 1.260 216 HD13 LEU 27 3HD1 LEU 27 3.999 11.231 2.579 217 HD21 LEU 27 3HD2 LEU 27 2.577 7.939 1.735 218 HD22 LEU 27 1HD2 LEU 27 1.271 9.066 1.370 219 HD23 LEU 27 2HD2 LEU 27 1.184 8.052 2.810 220 H GLU 28 H GLU 28 2.811 9.539 7.057 221 HA GLU 28 HA GLU 28 0.536 11.312 6.647 222 HB2 GLU 28 2HB GLU 28 -0.234 10.258 8.578 223 HB3 GLU 28 1HB GLU 28 0.938 9.074 8.015 224 HG2 GLU 28 2HG GLU 28 2.632 10.000 9.505 225 HG3 GLU 28 1HG GLU 28 1.505 11.239 10.048 226 H LYS 29 H LYS 29 3.518 11.312 8.557 227 HA LYS 29 HA LYS 29 3.035 13.935 9.744 228 HB2 LYS 29 2HB LYS 29 4.817 13.262 11.001 229 HB3 LYS 29 1HB LYS 29 4.623 11.722 10.175 230 HG2 LYS 29 2HG LYS 29 6.132 12.900 8.332 231 HG3 LYS 29 1HG LYS 29 6.650 13.868 9.715 232 HD2 LYS 29 2HD LYS 29 7.566 12.048 10.815 233 HD3 LYS 29 1HD LYS 29 6.481 10.904 10.025 234 HE2 LYS 29 2HE LYS 29 7.812 10.736 8.135 235 HE3 LYS 29 1HE LYS 29 8.430 12.390 8.303 236 HZ1 LYS 29 3HZ LYS 29 9.739 11.753 10.165 237 HZ2 LYS 29 1HZ LYS 29 10.057 10.624 8.940 238 HZ3 LYS 29 2HZ LYS 29 9.029 10.210 10.228 239 H ASN 30 H ASN 30 4.013 12.660 6.809 240 HA ASN 30 HA ASN 30 4.591 15.345 5.708 241 HB2 ASN 30 2HB ASN 30 6.569 13.229 6.227 242 HB3 ASN 30 1HB ASN 30 6.564 13.752 4.543 243 HD21 ASN 30 1HD2 ASN 30 6.496 16.308 4.332 244 HD22 ASN 30 2HD2 ASN 30 7.508 17.156 5.399 245 HA PRO 31 HA PRO 31 2.075 12.619 3.132 246 HB2 PRO 31 2HB PRO 31 -0.153 14.164 3.215 247 HB3 PRO 31 1HB PRO 31 0.271 13.001 4.478 248 HG2 PRO 31 2HG PRO 31 0.393 15.930 4.527 249 HG3 PRO 31 1HG PRO 31 0.189 14.774 5.851 250 HD2 PRO 31 2HD PRO 31 2.561 16.101 5.087 251 HD3 PRO 31 1HD PRO 31 2.379 14.818 6.302 252 H GLU 32 H GLU 32 3.878 15.135 2.572 253 HA GLU 32 HA GLU 32 2.641 15.730 -0.085 254 HB2 GLU 32 2HB GLU 32 4.269 17.906 0.944 255 HB3 GLU 32 1HB GLU 32 2.589 17.945 0.418 256 HG2 GLU 32 2HG GLU 32 1.831 17.209 2.605 257 HG3 GLU 32 1HG GLU 32 3.498 16.970 3.138 258 H ASP 33 H ASP 33 5.138 14.382 1.570 259 HA ASP 33 HA ASP 33 7.348 15.291 -0.104 260 HB2 ASP 33 2HB ASP 33 7.052 13.056 1.930 261 HB3 ASP 33 1HB ASP 33 8.586 13.621 1.263 262 H MET 34 H MET 34 7.624 14.456 -2.147 263 HA MET 34 HA MET 34 6.103 12.244 -3.162 264 HB2 MET 34 2HB MET 34 8.649 13.534 -4.194 265 HB3 MET 34 1HB MET 34 7.489 12.611 -5.152 266 HG2 MET 34 2HG MET 34 5.742 14.333 -4.302 267 HG3 MET 34 1HG MET 34 7.141 15.322 -3.885 268 HE1 MET 34 3HE MET 34 4.752 14.053 -6.119 269 HE2 MET 34 1HE MET 34 5.109 14.616 -7.758 270 HE3 MET 34 2HE MET 34 4.651 15.769 -6.506 271 H GLU 35 H GLU 35 8.767 12.209 -1.089 272 HA GLU 35 HA GLU 35 10.077 9.854 -2.229 273 HB2 GLU 35 2HB GLU 35 11.437 10.005 -0.178 274 HB3 GLU 35 1HB GLU 35 11.264 11.597 -0.911 275 HG2 GLU 35 2HG GLU 35 9.317 11.998 0.663 276 HG3 GLU 35 1HG GLU 35 9.775 10.506 1.485 277 H LEU 36 H LEU 36 8.004 10.467 0.644 278 HA LEU 36 HA LEU 36 7.778 7.624 1.234 279 HB2 LEU 36 2HB LEU 36 5.922 9.880 2.058 280 HB3 LEU 36 1HB LEU 36 6.215 8.371 2.917 281 HG LEU 36 HG LEU 36 8.027 10.757 2.641 282 HD11 LEU 36 1HD1 LEU 36 8.251 10.065 5.163 283 HD12 LEU 36 2HD1 LEU 36 6.758 9.181 4.849 284 HD13 LEU 36 3HD1 LEU 36 6.814 10.928 4.616 285 HD21 LEU 36 3HD2 LEU 36 9.885 9.445 3.493 286 HD22 LEU 36 1HD2 LEU 36 9.294 8.665 2.026 287 HD23 LEU 36 2HD2 LEU 36 8.869 8.008 3.607 288 H ILE 37 H ILE 37 6.242 9.923 -0.851 289 HA ILE 37 HA ILE 37 3.796 8.400 -1.316 290 HB ILE 37 HB ILE 37 5.243 10.748 -2.538 291 HG12 ILE 37 2HG1 ILE 37 2.566 10.385 -1.164 292 HG13 ILE 37 1HG1 ILE 37 4.003 11.132 -0.467 293 HG21 ILE 37 1HG2 ILE 37 4.153 9.411 -4.358 294 HG22 ILE 37 2HG2 ILE 37 3.460 11.021 -4.154 295 HG23 ILE 37 3HG2 ILE 37 2.614 9.609 -3.519 296 HD11 ILE 37 3HD1 ILE 37 2.784 12.176 -3.021 297 HD12 ILE 37 1HD1 ILE 37 3.874 13.002 -1.908 298 HD13 ILE 37 2HD1 ILE 37 2.198 12.707 -1.445 299 H ASN 38 H ASN 38 7.023 8.671 -2.779 300 HA ASN 38 HA ASN 38 6.251 6.828 -4.962 301 HB2 ASN 38 2HB ASN 38 8.701 8.432 -4.222 302 HB3 ASN 38 1HB ASN 38 8.733 7.261 -5.542 303 HD21 ASN 38 1HD2 ASN 38 8.860 10.314 -5.603 304 HD22 ASN 38 2HD2 ASN 38 7.612 10.769 -6.659 305 H GLU 39 H GLU 39 7.767 6.786 -1.888 306 HA GLU 39 HA GLU 39 9.152 4.234 -2.271 307 HB2 GLU 39 2HB GLU 39 8.545 6.100 0.020 308 HB3 GLU 39 1HB GLU 39 9.260 4.516 0.324 309 HG2 GLU 39 2HG GLU 39 10.555 6.029 -1.848 310 HG3 GLU 39 1HG GLU 39 10.702 6.776 -0.257 311 H ALA 40 H ALA 40 6.069 5.379 -1.343 312 HA ALA 40 HA ALA 40 5.182 2.799 -0.207 313 HB1 ALA 40 1HB ALA 40 3.122 4.081 0.219 314 HB2 ALA 40 2HB ALA 40 3.730 5.406 -0.775 315 HB3 ALA 40 3HB ALA 40 4.527 5.007 0.745 316 H PHE 41 H PHE 41 4.387 4.933 -3.007 317 HA PHE 41 HA PHE 41 2.463 3.347 -4.288 318 HB2 PHE 41 2HB PHE 41 2.966 5.426 -5.260 319 HB3 PHE 41 1HB PHE 41 4.705 5.151 -5.176 320 HD1 PHE 41 1HD PHE 41 5.852 3.774 -6.845 321 HD2 PHE 41 2HD PHE 41 1.619 4.473 -7.068 322 HE1 PHE 41 1HE PHE 41 5.836 2.932 -9.177 323 HE2 PHE 41 2HE PHE 41 1.604 3.631 -9.400 324 HZ PHE 41 HZ PHE 41 3.713 2.861 -10.455 325 H ARG 42 H ARG 42 6.022 3.053 -4.440 326 HA ARG 42 HA ARG 42 6.117 0.825 -6.243 327 HB2 ARG 42 2HB ARG 42 7.944 1.897 -4.076 328 HB3 ARG 42 1HB ARG 42 8.415 0.580 -5.150 329 HG2 ARG 42 2HG ARG 42 8.034 2.028 -7.106 330 HG3 ARG 42 1HG ARG 42 7.552 3.348 -6.038 331 HD2 ARG 42 2HD ARG 42 9.869 2.989 -4.904 332 HD3 ARG 42 1HD ARG 42 10.287 2.129 -6.400 333 HE ARG 42 HE ARG 42 9.177 4.910 -6.457 334 HH11 ARG 42 1HH1 ARG 42 12.152 3.515 -6.467 335 HH12 ARG 42 2HH1 ARG 42 12.624 4.036 -8.050 336 HH21 ARG 42 1HH2 ARG 42 9.456 5.141 -8.921 337 HH22 ARG 42 2HH2 ARG 42 11.098 4.954 -9.440 338 H ALA 43 H ALA 43 6.687 0.817 -2.697 339 HA ALA 43 HA ALA 43 6.717 -1.896 -2.158 340 HB1 ALA 43 1HB ALA 43 5.077 0.110 -0.587 341 HB2 ALA 43 2HB ALA 43 6.841 0.121 -0.594 342 HB3 ALA 43 3HB ALA 43 5.970 -1.275 0.043 343 H LEU 44 H LEU 44 3.701 0.045 -2.233 344 HA LEU 44 HA LEU 44 1.940 -2.210 -2.052 345 HB2 LEU 44 2HB LEU 44 1.674 0.617 -3.111 346 HB3 LEU 44 1HB LEU 44 0.300 -0.477 -2.940 347 HG LEU 44 HG LEU 44 2.162 0.094 -0.640 348 HD11 LEU 44 1HD1 LEU 44 1.358 2.263 -1.155 349 HD12 LEU 44 2HD1 LEU 44 0.251 1.672 0.082 350 HD13 LEU 44 3HD1 LEU 44 -0.233 1.655 -1.614 351 HD21 LEU 44 3HD2 LEU 44 0.866 -1.671 0.049 352 HD22 LEU 44 1HD2 LEU 44 -0.424 -1.304 -1.096 353 HD23 LEU 44 2HD2 LEU 44 -0.286 -0.383 0.402 354 H HIS 45 H HIS 45 3.427 -0.523 -4.783 355 HA HIS 45 HA HIS 45 1.932 -1.862 -6.867 356 HB2 HIS 45 2HB HIS 45 3.110 0.238 -7.225 357 HB3 HIS 45 1HB HIS 45 4.635 -0.484 -6.718 358 HD1 HIS 45 1HD HIS 45 5.794 -2.135 -8.383 359 HD2 HIS 45 2HD HIS 45 2.311 -0.393 -9.873 360 HE1 HIS 45 1HE HIS 45 5.761 -2.610 -10.871 361 H THR 46 H THR 46 4.883 -2.525 -5.067 362 HA THR 46 HA THR 46 5.565 -4.894 -6.665 363 HB THR 46 HB THR 46 6.690 -3.169 -4.563 364 HG1 THR 46 1HG THR 46 8.621 -4.195 -5.664 365 HG21 THR 46 3HG2 THR 46 8.282 -5.066 -3.820 366 HG22 THR 46 1HG2 THR 46 7.012 -6.161 -4.369 367 HG23 THR 46 2HG2 THR 46 6.682 -5.004 -3.081 368 H LEU 47 H LEU 47 3.866 -4.072 -3.709 369 HA LEU 47 HA LEU 47 3.727 -6.783 -2.659 370 HB2 LEU 47 2HB LEU 47 2.879 -4.049 -2.012 371 HB3 LEU 47 1HB LEU 47 1.698 -5.267 -1.523 372 HG LEU 47 HG LEU 47 4.653 -5.380 -0.866 373 HD11 LEU 47 1HD1 LEU 47 2.667 -3.735 0.258 374 HD12 LEU 47 2HD1 LEU 47 4.249 -4.102 0.947 375 HD13 LEU 47 3HD1 LEU 47 2.847 -5.080 1.383 376 HD21 LEU 47 3HD2 LEU 47 3.275 -6.969 0.916 377 HD22 LEU 47 1HD2 LEU 47 4.100 -7.558 -0.526 378 HD23 LEU 47 2HD2 LEU 47 2.371 -7.219 -0.578 379 H LYS 48 H LYS 48 1.559 -4.663 -4.559 380 HA LYS 48 HA LYS 48 -0.647 -6.547 -4.595 381 HB2 LYS 48 2HB LYS 48 -1.542 -5.007 -6.275 382 HB3 LYS 48 1HB LYS 48 -0.815 -4.083 -4.964 383 HG2 LYS 48 2HG LYS 48 0.583 -3.084 -6.409 384 HG3 LYS 48 1HG LYS 48 1.205 -4.649 -6.924 385 HD2 LYS 48 2HD LYS 48 -1.475 -3.878 -7.959 386 HD3 LYS 48 1HD LYS 48 -0.092 -2.995 -8.603 387 HE2 LYS 48 2HE LYS 48 0.817 -5.604 -8.660 388 HE3 LYS 48 1HE LYS 48 -0.899 -5.787 -9.070 389 HZ1 LYS 48 3HZ LYS 48 -0.608 -4.752 -11.010 390 HZ2 LYS 48 1HZ LYS 48 1.060 -4.930 -10.772 391 HZ3 LYS 48 2HZ LYS 48 0.288 -3.490 -10.311 392 H GLY 49 H GLY 49 2.263 -6.088 -6.504 393 HA2 GLY 49 2HA GLY 49 1.393 -7.721 -8.748 394 HA3 GLY 49 1HA GLY 49 3.049 -7.207 -8.427 395 H MET 50 H MET 50 3.309 -8.313 -5.800 396 HA MET 50 HA MET 50 3.890 -11.081 -6.500 397 HB2 MET 50 2HB MET 50 4.825 -11.123 -4.239 398 HB3 MET 50 1HB MET 50 5.278 -9.613 -5.032 399 HG2 MET 50 2HG MET 50 3.971 -8.342 -3.660 400 HG3 MET 50 1HG MET 50 2.717 -9.575 -3.545 401 HE1 MET 50 3HE MET 50 6.612 -8.990 -2.328 402 HE2 MET 50 1HE MET 50 5.992 -8.526 -0.738 403 HE3 MET 50 2HE MET 50 5.384 -7.734 -2.192 404 H ALA 51 H ALA 51 1.145 -9.459 -5.235 405 HA ALA 51 HA ALA 51 0.103 -11.789 -3.749 406 HB1 ALA 51 1HB ALA 51 -0.613 -9.811 -2.776 407 HB2 ALA 51 2HB ALA 51 -1.951 -10.060 -3.898 408 HB3 ALA 51 3HB ALA 51 -0.646 -8.951 -4.315 409 H GLY 52 H GLY 52 -0.075 -10.359 -6.919 410 HA2 GLY 52 2HA GLY 52 -2.460 -11.832 -7.741 411 HA3 GLY 52 1HA GLY 52 -1.391 -10.909 -8.803 412 H THR 53 H THR 53 0.987 -12.311 -7.674 413 HA THR 53 HA THR 53 1.058 -14.532 -9.542 414 HB THR 53 HB THR 53 2.833 -13.031 -7.711 415 HG1 THR 53 1HG THR 53 2.529 -13.254 -10.218 416 HG21 THR 53 3HG2 THR 53 3.201 -15.306 -6.855 417 HG22 THR 53 1HG2 THR 53 4.613 -14.737 -7.745 418 HG23 THR 53 2HG2 THR 53 3.499 -15.882 -8.495 419 H MET 54 H MET 54 0.153 -14.121 -6.291 420 HA MET 54 HA MET 54 0.506 -16.983 -5.593 421 HB2 MET 54 2HB MET 54 0.971 -14.844 -4.144 422 HB3 MET 54 1HB MET 54 -0.770 -14.871 -3.877 423 HG2 MET 54 2HG MET 54 -0.124 -16.225 -2.126 424 HG3 MET 54 1HG MET 54 -0.276 -17.451 -3.384 425 HE1 MET 54 3HE MET 54 1.832 -14.745 -2.027 426 HE2 MET 54 1HE MET 54 2.792 -14.789 -3.511 427 HE3 MET 54 2HE MET 54 3.496 -15.319 -1.985 428 H GLY 55 H GLY 55 -1.695 -15.219 -7.251 429 HA2 GLY 55 2HA GLY 55 -3.856 -15.870 -7.979 430 HA3 GLY 55 1HA GLY 55 -3.817 -17.188 -6.806 431 H PHE 56 H PHE 56 -2.875 -14.430 -5.203 432 HA PHE 56 HA PHE 56 -5.603 -14.120 -4.040 433 HB2 PHE 56 2HB PHE 56 -2.793 -13.388 -3.169 434 HB3 PHE 56 1HB PHE 56 -4.230 -12.937 -2.252 435 HD1 PHE 56 1HD PHE 56 -5.988 -15.138 -2.244 436 HD2 PHE 56 2HD PHE 56 -1.694 -15.206 -2.226 437 HE1 PHE 56 1HE PHE 56 -6.029 -17.384 -1.194 438 HE2 PHE 56 2HE PHE 56 -1.734 -17.453 -1.178 439 HZ PHE 56 HZ PHE 56 -3.902 -18.541 -0.661 440 H SER 57 H SER 57 -5.599 -12.904 -6.470 441 HA SER 57 HA SER 57 -4.561 -10.248 -6.576 442 HB2 SER 57 2HB SER 57 -7.129 -11.094 -7.876 443 HB3 SER 57 1HB SER 57 -5.835 -10.102 -8.539 444 HG SER 57 HG SER 57 -5.641 -12.115 -9.443 445 H SER 58 H SER 58 -7.307 -11.624 -5.041 446 HA SER 58 HA SER 58 -8.967 -9.343 -4.673 447 HB2 SER 58 2HB SER 58 -8.419 -11.852 -3.062 448 HB3 SER 58 1HB SER 58 -9.676 -10.704 -2.613 449 HG SER 58 HG SER 58 -10.810 -11.243 -4.354 450 H MET 59 H MET 59 -6.092 -10.525 -3.040 451 HA MET 59 HA MET 59 -6.182 -8.323 -1.064 452 HB2 MET 59 2HB MET 59 -5.618 -10.567 -0.289 453 HB3 MET 59 1HB MET 59 -4.365 -10.713 -1.522 454 HG2 MET 59 2HG MET 59 -3.430 -8.515 -0.382 455 HG3 MET 59 1HG MET 59 -4.365 -9.088 0.999 456 HE1 MET 59 3HE MET 59 -0.975 -10.906 -1.291 457 HE2 MET 59 1HE MET 59 -2.461 -10.147 -1.880 458 HE3 MET 59 2HE MET 59 -2.426 -11.875 -1.535 459 H ALA 60 H ALA 60 -4.750 -9.228 -4.073 460 HA ALA 60 HA ALA 60 -2.461 -7.405 -3.908 461 HB1 ALA 60 1HB ALA 60 -1.848 -8.599 -5.748 462 HB2 ALA 60 2HB ALA 60 -3.384 -8.286 -6.552 463 HB3 ALA 60 3HB ALA 60 -3.244 -9.616 -5.404 464 H LYS 61 H LYS 61 -5.775 -7.340 -5.163 465 HA LYS 61 HA LYS 61 -5.479 -4.883 -6.653 466 HB2 LYS 61 2HB LYS 61 -7.868 -6.199 -5.301 467 HB3 LYS 61 1HB LYS 61 -7.971 -4.934 -6.528 468 HG2 LYS 61 2HG LYS 61 -7.430 -6.359 -8.233 469 HG3 LYS 61 1HG LYS 61 -6.324 -7.300 -7.230 470 HD2 LYS 61 2HD LYS 61 -8.179 -8.741 -7.666 471 HD3 LYS 61 1HD LYS 61 -8.397 -8.167 -6.011 472 HE2 LYS 61 2HE LYS 61 -10.122 -6.690 -6.613 473 HE3 LYS 61 1HE LYS 61 -9.648 -6.686 -8.323 474 HZ1 LYS 61 3HZ LYS 61 -10.157 -9.089 -8.373 475 HZ2 LYS 61 1HZ LYS 61 -11.525 -8.138 -8.060 476 HZ3 LYS 61 2HZ LYS 61 -10.766 -8.974 -6.791 477 H LEU 62 H LEU 62 -5.916 -5.756 -3.332 478 HA LEU 62 HA LEU 62 -6.802 -3.209 -2.297 479 HB2 LEU 62 2HB LEU 62 -5.334 -5.622 -1.188 480 HB3 LEU 62 1HB LEU 62 -5.842 -4.269 -0.172 481 HG LEU 62 HG LEU 62 -7.753 -5.753 -1.974 482 HD11 LEU 62 1HD1 LEU 62 -6.471 -6.740 0.362 483 HD12 LEU 62 2HD1 LEU 62 -7.823 -7.462 -0.508 484 HD13 LEU 62 3HD1 LEU 62 -8.126 -6.339 0.817 485 HD21 LEU 62 3HD2 LEU 62 -7.919 -3.676 0.188 486 HD22 LEU 62 1HD2 LEU 62 -9.276 -4.776 -0.049 487 HD23 LEU 62 2HD2 LEU 62 -8.748 -3.730 -1.367 488 H CYS 63 H CYS 63 -3.659 -4.781 -2.756 489 HA CYS 63 HA CYS 63 -2.086 -2.615 -1.643 490 HB2 CYS 63 2HB CYS 63 -1.624 -5.070 -3.323 491 HB3 CYS 63 1HB CYS 63 -0.305 -3.924 -3.078 492 HG CYS 63 HG CYS 63 -0.158 -4.565 -0.658 493 H HIS 64 H HIS 64 -3.467 -3.341 -4.764 494 HA HIS 64 HA HIS 64 -1.890 -1.318 -6.215 495 HB2 HIS 64 2HB HIS 64 -3.028 -3.570 -6.992 496 HB3 HIS 64 1HB HIS 64 -4.471 -2.567 -7.139 497 HD1 HIS 64 1HD HIS 64 -2.781 0.036 -8.010 498 HD2 HIS 64 2HD HIS 64 -2.652 -3.719 -9.817 499 HE1 HIS 64 1HE HIS 64 -1.972 0.409 -10.381 500 H THR 65 H THR 65 -4.740 -1.479 -4.305 501 HA THR 65 HA THR 65 -6.100 0.848 -5.419 502 HB THR 65 HB THR 65 -6.322 -1.004 -3.059 503 HG1 THR 65 1HG THR 65 -7.507 -0.609 -5.478 504 HG21 THR 65 3HG2 THR 65 -6.819 1.266 -2.215 505 HG22 THR 65 1HG2 THR 65 -8.247 0.232 -2.234 506 HG23 THR 65 2HG2 THR 65 -8.027 1.455 -3.486 507 H LEU 66 H LEU 66 -4.314 0.207 -2.369 508 HA LEU 66 HA LEU 66 -4.355 2.891 -1.376 509 HB2 LEU 66 2HB LEU 66 -2.051 0.965 -1.011 510 HB3 LEU 66 1HB LEU 66 -2.738 2.081 0.163 511 HG LEU 66 HG LEU 66 -3.772 -0.583 -0.742 512 HD11 LEU 66 1HD1 LEU 66 -3.179 0.816 1.847 513 HD12 LEU 66 2HD1 LEU 66 -2.621 -0.758 1.281 514 HD13 LEU 66 3HD1 LEU 66 -4.288 -0.556 1.820 515 HD21 LEU 66 3HD2 LEU 66 -5.867 0.260 -0.918 516 HD22 LEU 66 1HD2 LEU 66 -5.378 1.814 -0.247 517 HD23 LEU 66 2HD2 LEU 66 -5.797 0.481 0.830 518 H GLU 67 H GLU 67 -2.058 1.153 -3.464 519 HA GLU 67 HA GLU 67 -0.087 3.195 -3.734 520 HB2 GLU 67 2HB GLU 67 0.291 0.885 -4.361 521 HB3 GLU 67 1HB GLU 67 -1.036 0.935 -5.516 522 HG2 GLU 67 2HG GLU 67 1.023 3.015 -5.919 523 HG3 GLU 67 1HG GLU 67 1.586 1.363 -6.176 524 H ASN 68 H ASN 68 -3.156 2.649 -5.369 525 HA ASN 68 HA ASN 68 -2.767 4.342 -7.612 526 HB2 ASN 68 2HB ASN 68 -4.938 3.140 -6.050 527 HB3 ASN 68 1HB ASN 68 -5.397 4.640 -6.856 528 HD21 ASN 68 1HD2 ASN 68 -4.060 4.571 -9.254 529 HD22 ASN 68 2HD2 ASN 68 -4.475 3.190 -10.148 530 H ILE 69 H ILE 69 -3.932 4.987 -4.330 531 HA ILE 69 HA ILE 69 -4.395 7.797 -4.670 532 HB ILE 69 HB ILE 69 -3.827 5.953 -2.351 533 HG12 ILE 69 2HG1 ILE 69 -6.240 6.586 -1.881 534 HG13 ILE 69 1HG1 ILE 69 -6.243 7.390 -3.446 535 HG21 ILE 69 1HG2 ILE 69 -3.035 8.382 -1.968 536 HG22 ILE 69 2HG2 ILE 69 -4.181 7.725 -0.802 537 HG23 ILE 69 3HG2 ILE 69 -4.740 8.821 -2.063 538 HD11 ILE 69 3HD1 ILE 69 -5.847 5.354 -4.607 539 HD12 ILE 69 1HD1 ILE 69 -7.111 5.000 -3.432 540 HD13 ILE 69 2HD1 ILE 69 -5.454 4.504 -3.111 541 H LEU 70 H LEU 70 -1.713 5.860 -3.833 542 HA LEU 70 HA LEU 70 0.098 8.058 -3.240 543 HB2 LEU 70 2HB LEU 70 0.708 5.191 -4.011 544 HB3 LEU 70 1HB LEU 70 1.785 6.292 -3.155 545 HG LEU 70 HG LEU 70 -0.656 4.874 -2.155 546 HD11 LEU 70 1HD1 LEU 70 1.618 5.543 -0.408 547 HD12 LEU 70 2HD1 LEU 70 2.015 4.519 -1.791 548 HD13 LEU 70 3HD1 LEU 70 0.783 4.006 -0.636 549 HD21 LEU 70 3HD2 LEU 70 -0.393 6.529 -0.127 550 HD22 LEU 70 1HD2 LEU 70 -1.376 7.006 -1.512 551 HD23 LEU 70 2HD2 LEU 70 0.271 7.616 -1.348 552 H ASP 71 H ASP 71 -1.141 6.600 -6.048 553 HA ASP 71 HA ASP 71 1.106 7.515 -7.745 554 HB2 ASP 71 2HB ASP 71 -0.180 5.357 -8.096 555 HB3 ASP 71 1HB ASP 71 -1.593 6.335 -8.497 556 H LYS 72 H LYS 72 -2.296 8.329 -7.084 557 HA LYS 72 HA LYS 72 -2.157 10.628 -8.896 558 HB2 LYS 72 2HB LYS 72 -4.296 10.915 -7.055 559 HB3 LYS 72 1HB LYS 72 -4.403 10.389 -8.725 560 HG2 LYS 72 2HG LYS 72 -3.925 8.066 -7.982 561 HG3 LYS 72 1HG LYS 72 -3.961 8.628 -6.306 562 HD2 LYS 72 2HD LYS 72 -6.265 9.658 -7.413 563 HD3 LYS 72 1HD LYS 72 -6.133 8.043 -8.109 564 HE2 LYS 72 2HE LYS 72 -5.729 7.136 -5.798 565 HE3 LYS 72 1HE LYS 72 -6.091 8.755 -5.165 566 HZ1 LYS 72 3HZ LYS 72 -7.876 6.832 -6.458 567 HZ2 LYS 72 1HZ LYS 72 -8.127 8.471 -6.812 568 HZ3 LYS 72 2HZ LYS 72 -8.197 7.931 -5.203 569 H ALA 73 H ALA 73 -1.544 9.827 -5.608 570 HA ALA 73 HA ALA 73 -1.473 12.408 -4.387 571 HB1 ALA 73 1HB ALA 73 -0.219 9.711 -4.014 572 HB2 ALA 73 2HB ALA 73 -1.241 10.620 -2.898 573 HB3 ALA 73 3HB ALA 73 0.452 11.059 -3.098 574 H ARG 74 H ARG 74 0.882 10.529 -6.288 575 HA ARG 74 HA ARG 74 2.851 12.730 -6.115 576 HB2 ARG 74 2HB ARG 74 4.372 11.131 -6.916 577 HB3 ARG 74 1HB ARG 74 3.222 10.129 -6.033 578 HG2 ARG 74 2HG ARG 74 2.006 9.730 -8.181 579 HG3 ARG 74 1HG ARG 74 3.274 10.613 -9.025 580 HD2 ARG 74 2HD ARG 74 3.986 8.307 -7.215 581 HD3 ARG 74 1HD ARG 74 3.481 8.014 -8.890 582 HE ARG 74 HE ARG 74 5.847 9.646 -8.086 583 HH11 ARG 74 1HH2 ARG 74 4.057 10.004 -10.705 584 HH12 ARG 74 2HH2 ARG 74 5.137 9.290 -11.855 585 HH21 ARG 74 1HH1 ARG 74 7.189 7.872 -9.443 586 HH22 ARG 74 2HH1 ARG 74 6.910 8.081 -11.140 587 H ASN 75 H ASN 75 0.299 11.652 -8.130 588 HA ASN 75 HA ASN 75 1.315 12.978 -10.573 589 HB2 ASN 75 2HB ASN 75 -0.103 10.813 -10.348 590 HB3 ASN 75 1HB ASN 75 -1.459 11.902 -10.056 591 HD21 ASN 75 1HD2 ASN 75 -1.810 13.625 -11.809 592 HD22 ASN 75 2HD2 ASN 75 -1.449 13.204 -13.412 593 H SER 76 H SER 76 -0.003 14.016 -7.719 594 HA SER 76 HA SER 76 -0.777 16.160 -7.102 595 HB2 SER 76 2HB SER 76 0.288 16.457 -9.662 596 HB3 SER 76 1HB SER 76 -1.332 17.137 -9.796 597 HG SER 76 HG SER 76 -0.177 18.787 -9.010 598 H GLU 77 H GLU 77 -2.542 13.756 -7.803 599 HA GLU 77 HA GLU 77 -5.012 15.215 -8.591 600 HB2 GLU 77 2HB GLU 77 -4.960 12.272 -8.138 601 HB3 GLU 77 1HB GLU 77 -5.824 13.185 -9.363 602 HG2 GLU 77 2HG GLU 77 -2.856 13.226 -9.582 603 HG3 GLU 77 1HG GLU 77 -3.640 11.684 -9.900 604 H ILE 78 H ILE 78 -3.502 13.426 -6.031 605 HA ILE 78 HA ILE 78 -5.570 14.407 -4.132 606 HB ILE 78 HB ILE 78 -5.804 12.050 -3.266 607 HG12 ILE 78 2HG1 ILE 78 -5.123 10.485 -5.403 608 HG13 ILE 78 1HG1 ILE 78 -3.800 11.655 -5.368 609 HG21 ILE 78 1HG2 ILE 78 -7.529 11.580 -4.728 610 HG22 ILE 78 2HG2 ILE 78 -6.556 11.943 -6.153 611 HG23 ILE 78 3HG2 ILE 78 -7.223 13.255 -5.182 612 HD11 ILE 78 3HD1 ILE 78 -4.457 10.796 -2.690 613 HD12 ILE 78 1HD1 ILE 78 -2.923 10.696 -3.547 614 HD13 ILE 78 2HD1 ILE 78 -4.106 9.404 -3.715 615 H LYS 79 H LYS 79 -4.766 12.915 -1.928 616 HA LYS 79 HA LYS 79 -1.901 12.768 -1.598 617 HB2 LYS 79 2HB LYS 79 -1.536 14.807 -0.385 618 HB3 LYS 79 1HB LYS 79 -2.392 15.256 -1.857 619 HG2 LYS 79 2HG LYS 79 -3.871 14.673 0.712 620 HG3 LYS 79 1HG LYS 79 -3.238 16.279 0.350 621 HD2 LYS 79 2HD LYS 79 -4.994 16.685 -0.977 622 HD3 LYS 79 1HD LYS 79 -4.560 15.303 -1.976 623 HE2 LYS 79 2HE LYS 79 -6.376 14.189 -1.214 624 HE3 LYS 79 1HE LYS 79 -5.753 14.321 0.443 625 HZ1 LYS 79 3HZ LYS 79 -7.674 15.566 0.571 626 HZ2 LYS 79 1HZ LYS 79 -7.541 16.151 -1.015 627 HZ3 LYS 79 2HZ LYS 79 -6.530 16.767 0.203 628 H ILE 80 H ILE 80 -1.594 13.207 1.028 629 HA ILE 80 HA ILE 80 -3.405 11.214 2.262 630 HB ILE 80 HB ILE 80 -0.701 12.374 2.759 631 HG12 ILE 80 2HG1 ILE 80 -0.140 9.934 2.696 632 HG13 ILE 80 1HG1 ILE 80 -1.843 9.616 2.368 633 HG21 ILE 80 1HG2 ILE 80 -1.434 12.324 4.986 634 HG22 ILE 80 2HG2 ILE 80 -0.758 10.708 4.784 635 HG23 ILE 80 3HG2 ILE 80 -2.503 10.953 4.694 636 HD11 ILE 80 3HD1 ILE 80 -0.299 9.748 0.324 637 HD12 ILE 80 1HD1 ILE 80 -0.211 11.480 0.647 638 HD13 ILE 80 2HD1 ILE 80 -1.763 10.730 0.276 639 H THR 81 H THR 81 -5.139 12.625 2.532 640 HA THR 81 HA THR 81 -4.870 15.014 4.273 641 HB THR 81 HB THR 81 -6.221 14.901 2.148 642 HG1 THR 81 1HG THR 81 -6.706 16.294 4.018 643 HG21 THR 81 3HG2 THR 81 -8.046 13.135 3.782 644 HG22 THR 81 1HG2 THR 81 -6.982 12.558 2.498 645 HG23 THR 81 2HG2 THR 81 -8.295 13.670 2.118 646 H SER 82 H SER 82 -4.625 12.053 5.159 647 HA SER 82 HA SER 82 -5.130 10.942 7.196 648 HB2 SER 82 2HB SER 82 -5.423 13.458 7.864 649 HB3 SER 82 1HB SER 82 -7.146 13.104 7.765 650 HG SER 82 HG SER 82 -6.313 11.142 9.109 651 H ASP 83 H ASP 83 -7.252 11.708 4.699 652 HA ASP 83 HA ASP 83 -9.374 9.850 5.689 653 HB2 ASP 83 2HB ASP 83 -9.578 12.389 4.734 654 HB3 ASP 83 1HB ASP 83 -9.686 11.489 3.221 655 H LEU 84 H LEU 84 -7.369 10.744 2.857 656 HA LEU 84 HA LEU 84 -8.062 8.458 1.262 657 HB2 LEU 84 2HB LEU 84 -5.520 10.119 1.444 658 HB3 LEU 84 1HB LEU 84 -5.932 9.048 0.102 659 HG LEU 84 HG LEU 84 -7.306 11.601 0.946 660 HD11 LEU 84 1HD1 LEU 84 -6.156 12.373 -0.819 661 HD12 LEU 84 2HD1 LEU 84 -7.080 11.286 -1.855 662 HD13 LEU 84 3HD1 LEU 84 -5.543 10.757 -1.169 663 HD21 LEU 84 3HD2 LEU 84 -8.393 9.284 -0.657 664 HD22 LEU 84 1HD2 LEU 84 -8.980 10.927 -0.908 665 HD23 LEU 84 2HD2 LEU 84 -9.164 10.156 0.668 666 H LEU 85 H LEU 85 -5.870 9.043 3.911 667 HA LEU 85 HA LEU 85 -4.423 6.520 3.783 668 HB2 LEU 85 2HB LEU 85 -4.938 8.687 5.831 669 HB3 LEU 85 1HB LEU 85 -4.004 7.252 6.245 670 HG LEU 85 HG LEU 85 -3.363 9.375 4.205 671 HD11 LEU 85 1HD1 LEU 85 -1.123 9.072 5.558 672 HD12 LEU 85 2HD1 LEU 85 -2.173 8.312 6.752 673 HD13 LEU 85 3HD1 LEU 85 -2.452 9.986 6.275 674 HD21 LEU 85 3HD2 LEU 85 -1.269 7.651 4.037 675 HD22 LEU 85 1HD2 LEU 85 -2.634 7.621 2.920 676 HD23 LEU 85 2HD2 LEU 85 -2.589 6.508 4.287 677 H ASP 86 H ASP 86 -7.014 7.830 5.831 678 HA ASP 86 HA ASP 86 -7.664 5.717 7.483 679 HB2 ASP 86 2HB ASP 86 -8.774 8.021 7.098 680 HB3 ASP 86 1HB ASP 86 -9.757 7.202 5.884 681 H LYS 87 H LYS 87 -8.494 6.006 4.035 682 HA LYS 87 HA LYS 87 -9.900 3.420 4.033 683 HB2 LYS 87 2HB LYS 87 -9.011 5.331 1.845 684 HB3 LYS 87 1HB LYS 87 -10.083 3.951 1.600 685 HG2 LYS 87 2HG LYS 87 -10.603 6.409 3.287 686 HG3 LYS 87 1HG LYS 87 -11.497 5.874 1.863 687 HD2 LYS 87 2HD LYS 87 -12.068 3.761 3.157 688 HD3 LYS 87 1HD LYS 87 -11.403 4.553 4.585 689 HE2 LYS 87 2HE LYS 87 -13.486 5.969 2.926 690 HE3 LYS 87 1HE LYS 87 -13.970 4.773 4.145 691 HZ1 LYS 87 3HZ LYS 87 -12.952 5.959 5.840 692 HZ2 LYS 87 1HZ LYS 87 -13.637 7.192 4.899 693 HZ3 LYS 87 2HZ LYS 87 -11.976 6.856 4.777 694 H ILE 88 H ILE 88 -6.822 4.738 2.784 695 HA ILE 88 HA ILE 88 -5.870 2.317 1.595 696 HB ILE 88 HB ILE 88 -4.854 4.948 2.492 697 HG12 ILE 88 2HG1 ILE 88 -3.676 3.685 0.152 698 HG13 ILE 88 1HG1 ILE 88 -5.439 3.680 0.120 699 HG21 ILE 88 1HG2 ILE 88 -2.928 2.648 2.077 700 HG22 ILE 88 2HG2 ILE 88 -3.236 3.445 3.620 701 HG23 ILE 88 3HG2 ILE 88 -2.489 4.341 2.298 702 HD11 ILE 88 3HD1 ILE 88 -3.718 5.853 -0.455 703 HD12 ILE 88 1HD1 ILE 88 -4.506 6.230 1.078 704 HD13 ILE 88 2HD1 ILE 88 -5.477 5.877 -0.350 705 H PHE 89 H PHE 89 -5.384 3.735 4.817 706 HA PHE 89 HA PHE 89 -3.894 1.534 5.910 707 HB2 PHE 89 2HB PHE 89 -4.817 4.115 6.642 708 HB3 PHE 89 1HB PHE 89 -5.418 2.999 7.870 709 HD1 PHE 89 1HD PHE 89 -2.276 3.356 5.835 710 HD2 PHE 89 2HD PHE 89 -4.024 2.776 9.716 711 HE1 PHE 89 1HE PHE 89 -0.012 3.235 6.837 712 HE2 PHE 89 2HE PHE 89 -1.759 2.654 10.717 713 HZ PHE 89 HZ PHE 89 0.248 2.884 9.278 714 H ALA 90 H ALA 90 -7.214 2.110 5.321 715 HA ALA 90 HA ALA 90 -8.239 0.078 7.168 716 HB1 ALA 90 1HB ALA 90 -9.714 1.880 6.660 717 HB2 ALA 90 2HB ALA 90 -10.324 0.555 5.668 718 HB3 ALA 90 3HB ALA 90 -9.327 1.816 4.940 719 H GLY 91 H GLY 91 -7.181 0.391 3.852 720 HA2 GLY 91 2HA GLY 91 -8.166 -2.200 2.966 721 HA3 GLY 91 1HA GLY 91 -6.980 -1.194 2.121 722 H VAL 92 H VAL 92 -5.128 -0.858 4.205 723 HA VAL 92 HA VAL 92 -3.611 -3.322 4.047 724 HB VAL 92 HB VAL 92 -3.403 -0.638 5.403 725 HG11 VAL 92 1HG1 VAL 92 -2.222 -1.626 7.078 726 HG12 VAL 92 2HG1 VAL 92 -0.949 -1.775 5.866 727 HG13 VAL 92 3HG1 VAL 92 -2.030 -3.133 6.180 728 HG21 VAL 92 3HG2 VAL 92 -2.090 -0.165 3.625 729 HG22 VAL 92 1HG2 VAL 92 -2.638 -1.689 2.927 730 HG23 VAL 92 2HG2 VAL 92 -1.141 -1.633 3.857 731 H ASP 93 H ASP 93 -6.062 -2.110 6.154 732 HA ASP 93 HA ASP 93 -5.294 -3.626 8.536 733 HB2 ASP 93 2HB ASP 93 -7.156 -1.602 7.707 734 HB3 ASP 93 1HB ASP 93 -8.070 -2.916 8.456 735 H MET 94 H MET 94 -7.841 -3.974 6.044 736 HA MET 94 HA MET 94 -8.614 -6.612 7.024 737 HB2 MET 94 2HB MET 94 -9.963 -6.591 4.911 738 HB3 MET 94 1HB MET 94 -10.195 -5.131 5.871 739 HG2 MET 94 2HG MET 94 -8.017 -4.489 4.290 740 HG3 MET 94 1HG MET 94 -9.026 -5.443 3.205 741 HE1 MET 94 3HE MET 94 -11.126 -4.355 1.925 742 HE2 MET 94 1HE MET 94 -9.423 -3.943 1.680 743 HE3 MET 94 2HE MET 94 -10.643 -2.674 1.692 744 H ILE 95 H ILE 95 -6.363 -5.239 4.757 745 HA ILE 95 HA ILE 95 -5.720 -7.536 3.184 746 HB ILE 95 HB ILE 95 -4.519 -4.927 3.994 747 HG12 ILE 95 2HG1 ILE 95 -4.875 -6.352 1.340 748 HG13 ILE 95 1HG1 ILE 95 -5.968 -5.141 2.014 749 HG21 ILE 95 1HG2 ILE 95 -2.503 -6.066 4.248 750 HG22 ILE 95 2HG2 ILE 95 -2.469 -5.674 2.528 751 HG23 ILE 95 3HG2 ILE 95 -2.929 -7.293 3.056 752 HD11 ILE 95 3HD1 ILE 95 -3.872 -4.580 0.327 753 HD12 ILE 95 1HD1 ILE 95 -3.150 -4.289 1.909 754 HD13 ILE 95 2HD1 ILE 95 -4.606 -3.418 1.432 755 H THR 96 H THR 96 -4.588 -6.339 6.322 756 HA THR 96 HA THR 96 -2.622 -8.431 6.747 757 HB THR 96 HB THR 96 -4.057 -6.351 8.408 758 HG1 THR 96 1HG THR 96 -1.299 -6.604 8.233 759 HG21 THR 96 3HG2 THR 96 -2.160 -7.151 10.118 760 HG22 THR 96 1HG2 THR 96 -2.463 -8.698 9.326 761 HG23 THR 96 2HG2 THR 96 -3.780 -7.847 10.133 762 H ARG 97 H ARG 97 -5.988 -7.845 7.782 763 HA ARG 97 HA ARG 97 -6.326 -10.186 9.376 764 HB2 ARG 97 2HB ARG 97 -7.930 -8.111 8.074 765 HB3 ARG 97 1HB ARG 97 -8.776 -9.657 8.160 766 HG2 ARG 97 2HG ARG 97 -8.964 -9.570 10.424 767 HG3 ARG 97 1HG ARG 97 -7.340 -8.912 10.626 768 HD2 ARG 97 2HD ARG 97 -8.080 -6.681 10.145 769 HD3 ARG 97 1HD ARG 97 -9.656 -7.261 9.572 770 HE ARG 97 HE ARG 97 -8.804 -7.749 12.396 771 HH11 ARG 97 1HH1 ARG 97 -11.472 -8.285 10.686 772 HH12 ARG 97 2HH1 ARG 97 -12.524 -7.194 11.523 773 HH21 ARG 97 1HH2 ARG 97 -9.957 -5.585 13.204 774 HH22 ARG 97 2HH2 ARG 97 -11.668 -5.668 12.947 775 H MET 98 H MET 98 -7.065 -9.682 5.881 776 HA MET 98 HA MET 98 -7.854 -12.422 5.442 777 HB2 MET 98 2HB MET 98 -8.066 -11.718 3.201 778 HB3 MET 98 1HB MET 98 -8.265 -10.210 4.086 779 HG2 MET 98 2HG MET 98 -5.741 -9.889 3.809 780 HG3 MET 98 1HG MET 98 -5.809 -11.199 2.631 781 HE1 MET 98 3HE MET 98 -9.124 -10.162 2.178 782 HE2 MET 98 1HE MET 98 -8.194 -11.097 1.000 783 HE3 MET 98 2HE MET 98 -8.924 -9.563 0.533 784 H VAL 99 H VAL 99 -4.842 -10.779 5.720 785 HA VAL 99 HA VAL 99 -3.249 -12.840 4.360 786 HB VAL 99 HB VAL 99 -2.845 -10.250 5.829 787 HG11 VAL 99 1HG1 VAL 99 -0.723 -12.345 5.293 788 HG12 VAL 99 2HG1 VAL 99 -1.081 -11.536 6.818 789 HG13 VAL 99 3HG1 VAL 99 -0.335 -10.636 5.497 790 HG21 VAL 99 3HG2 VAL 99 -1.699 -11.246 3.210 791 HG22 VAL 99 1HG2 VAL 99 -1.836 -9.578 3.762 792 HG23 VAL 99 2HG2 VAL 99 -3.285 -10.485 3.330 793 H ASP 100 H ASP 100 -4.244 -11.947 7.635 794 HA ASP 100 HA ASP 100 -2.431 -13.764 9.009 795 HB2 ASP 100 2HB ASP 100 -4.102 -11.652 9.645 796 HB3 ASP 100 1HB ASP 100 -4.979 -13.037 10.299 797 H LYS 101 H LYS 101 -5.785 -13.917 7.844 798 HA LYS 101 HA LYS 101 -6.210 -16.594 8.916 799 HB2 LYS 101 2HB LYS 101 -8.353 -16.032 8.454 800 HB3 LYS 101 1HB LYS 101 -7.738 -14.456 7.978 801 HG2 LYS 101 2HG LYS 101 -7.307 -16.007 5.706 802 HG3 LYS 101 1HG LYS 101 -8.851 -16.592 6.316 803 HD2 LYS 101 2HD LYS 101 -8.725 -13.740 6.533 804 HD3 LYS 101 1HD LYS 101 -8.331 -14.227 4.888 805 HE2 LYS 101 2HE LYS 101 -10.820 -14.986 6.466 806 HE3 LYS 101 1HE LYS 101 -10.754 -14.016 4.983 807 HZ1 LYS 101 3HZ LYS 101 -10.790 -16.826 5.242 808 HZ2 LYS 101 1HZ LYS 101 -9.351 -16.357 4.482 809 HZ3 LYS 101 2HZ LYS 101 -10.840 -15.886 3.832 810 H ILE 102 H ILE 102 -5.104 -15.095 5.964 811 HA ILE 102 HA ILE 102 -5.245 -17.364 4.211 812 HB ILE 102 HB ILE 102 -3.954 -14.691 4.402 813 HG12 ILE 102 2HG1 ILE 102 -5.305 -16.218 2.160 814 HG13 ILE 102 1HG1 ILE 102 -6.091 -15.065 3.240 815 HG21 ILE 102 1HG2 ILE 102 -2.720 -15.364 2.165 816 HG22 ILE 102 2HG2 ILE 102 -2.725 -16.969 2.898 817 HG23 ILE 102 3HG2 ILE 102 -1.944 -15.623 3.727 818 HD11 ILE 102 3HD1 ILE 102 -3.797 -13.766 2.229 819 HD12 ILE 102 1HD1 ILE 102 -5.480 -13.409 1.850 820 HD13 ILE 102 2HD1 ILE 102 -4.571 -14.544 0.850 821 H VAL 103 H VAL 103 -2.969 -16.150 6.565 822 HA VAL 103 HA VAL 103 -0.911 -18.180 6.019 823 HB VAL 103 HB VAL 103 -1.429 -15.931 7.951 824 HG11 VAL 103 1HG1 VAL 103 -0.570 -17.480 9.515 825 HG12 VAL 103 2HG1 VAL 103 0.863 -16.607 8.974 826 HG13 VAL 103 3HG1 VAL 103 0.513 -18.211 8.330 827 HG21 VAL 103 3HG2 VAL 103 -0.152 -16.058 5.559 828 HG22 VAL 103 1HG2 VAL 103 1.199 -16.384 6.645 829 HG23 VAL 103 2HG2 VAL 103 0.269 -14.896 6.817 830 H SER 104 H SER 104 -3.714 -17.739 8.022 831 HA SER 104 HA SER 104 -3.117 -19.994 9.814 832 HB2 SER 104 2HB SER 104 -4.256 -17.807 10.414 833 HB3 SER 104 1HB SER 104 -5.628 -18.354 9.450 834 HG SER 104 HG SER 104 -4.679 -19.241 11.917 835 H GLU 105 H GLU 105 -4.920 -19.342 6.955 836 HA GLU 105 HA GLU 105 -5.830 -22.187 6.849 837 HB2 GLU 105 2HB GLU 105 -7.577 -19.828 6.094 838 HB3 GLU 105 1HB GLU 105 -8.070 -21.497 6.375 839 HG2 GLU 105 2HG GLU 105 -6.843 -19.798 8.554 840 HG3 GLU 105 1HG GLU 105 -8.576 -19.830 8.250 841 H GLY 106 H GLY 106 -5.283 -19.116 5.128 842 HA2 GLY 106 2HA GLY 106 -4.037 -19.126 3.007 843 HA3 GLY 106 1HA GLY 106 -4.709 -20.722 2.676 844 H SER 107 H SER 107 -6.830 -18.331 4.039 845 HA SER 107 HA SER 107 -8.103 -18.001 1.327 846 HB2 SER 107 2HB SER 107 -10.085 -17.580 3.134 847 HB3 SER 107 1HB SER 107 -9.735 -19.150 2.422 848 HG SER 107 HG SER 107 -9.137 -18.142 4.961 849 H ASP 108 H ASP 108 -8.154 -15.955 0.637 850 HA ASP 108 HA ASP 108 -7.533 -13.735 2.519 851 HB2 ASP 108 2HB ASP 108 -7.095 -12.517 0.487 852 HB3 ASP 108 1HB ASP 108 -6.462 -14.141 0.213 853 H ASP 109 H ASP 109 -10.212 -15.401 1.912 854 HA ASP 109 HA ASP 109 -12.023 -13.187 1.172 855 HB2 ASP 109 2HB ASP 109 -13.735 -15.037 1.504 856 HB3 ASP 109 1HB ASP 109 -12.489 -15.379 0.306 857 H ILE 110 H ILE 110 -11.636 -11.759 3.006 858 HA ILE 110 HA ILE 110 -12.666 -12.743 5.638 859 HB ILE 110 HB ILE 110 -11.648 -10.459 6.343 860 HG12 ILE 110 2HG1 ILE 110 -10.058 -10.749 3.805 861 HG13 ILE 110 1HG1 ILE 110 -11.559 -9.820 3.802 862 HG21 ILE 110 1HG2 ILE 110 -10.618 -12.770 6.662 863 HG22 ILE 110 2HG2 ILE 110 -9.474 -11.430 6.600 864 HG23 ILE 110 3HG2 ILE 110 -9.698 -12.461 5.190 865 HD11 ILE 110 3HD1 ILE 110 -9.622 -8.362 4.253 866 HD12 ILE 110 1HD1 ILE 110 -9.200 -9.351 5.649 867 HD13 ILE 110 2HD1 ILE 110 -10.701 -8.425 5.647 868 H GLY 111 H GLY 111 -14.137 -11.759 3.065 869 HA2 GLY 111 2HA GLY 111 -16.295 -10.787 2.854 870 HA3 GLY 111 1HA GLY 111 -16.164 -10.205 4.515 871 H GLU 112 H GLU 112 -13.310 -9.382 3.123 872 HA GLU 112 HA GLU 112 -13.603 -6.622 3.204 873 HB2 GLU 112 2HB GLU 112 -11.667 -6.682 1.546 874 HB3 GLU 112 1HB GLU 112 -11.461 -7.663 2.997 875 HG2 GLU 112 2HG GLU 112 -11.037 -9.382 1.602 876 HG3 GLU 112 1HG GLU 112 -12.764 -9.375 1.250 877 H ASN 113 H ASN 113 -13.552 -5.092 1.311 878 HA ASN 113 HA ASN 113 -15.298 -5.951 -0.962 879 HB2 ASN 113 2HB ASN 113 -16.088 -4.481 1.240 880 HB3 ASN 113 1HB ASN 113 -15.696 -3.228 0.064 881 HD21 ASN 113 1HD2 ASN 113 -18.415 -3.835 0.929 882 HD22 ASN 113 2HD2 ASN 113 -19.260 -4.409 -0.428 883 H ILE 114 H ILE 114 -13.383 -5.930 -2.323 884 HA ILE 114 HA ILE 114 -11.595 -3.671 -2.462 885 HB ILE 114 HB ILE 114 -12.184 -5.633 -4.680 886 HG12 ILE 114 2HG1 ILE 114 -12.053 -7.131 -2.866 887 HG13 ILE 114 1HG1 ILE 114 -10.377 -7.033 -3.401 888 HG21 ILE 114 1HG2 ILE 114 -9.460 -4.840 -3.758 889 HG22 ILE 114 2HG2 ILE 114 -10.424 -3.622 -4.599 890 HG23 ILE 114 3HG2 ILE 114 -10.048 -5.154 -5.391 891 HD11 ILE 114 3HD1 ILE 114 -10.479 -4.941 -1.660 892 HD12 ILE 114 1HD1 ILE 114 -9.957 -6.565 -1.214 893 HD13 ILE 114 2HD1 ILE 114 -11.618 -6.052 -0.903 894 H ASP 115 H ASP 115 -13.820 -4.778 -5.044 895 HA ASP 115 HA ASP 115 -13.845 -2.546 -6.652 896 HB2 ASP 115 2HB ASP 115 -16.298 -4.088 -5.762 897 HB3 ASP 115 1HB ASP 115 -16.079 -3.272 -7.311 898 H VAL 116 H VAL 116 -15.226 -2.901 -3.520 899 HA VAL 116 HA VAL 116 -16.645 -0.333 -3.613 900 HB VAL 116 HB VAL 116 -16.277 -2.495 -1.536 901 HG11 VAL 116 1HG1 VAL 116 -16.708 -0.106 -0.673 902 HG12 VAL 116 2HG1 VAL 116 -17.840 -1.354 -0.152 903 HG13 VAL 116 3HG1 VAL 116 -18.289 -0.239 -1.442 904 HG21 VAL 116 3HG2 VAL 116 -17.750 -3.474 -2.992 905 HG22 VAL 116 1HG2 VAL 116 -18.227 -1.933 -3.705 906 HG23 VAL 116 2HG2 VAL 116 -18.921 -2.444 -2.167 907 H PHE 117 H PHE 117 -14.124 -1.797 -1.606 908 HA PHE 117 HA PHE 117 -13.479 0.561 -0.124 909 HB2 PHE 117 2HB PHE 117 -12.092 -1.995 -0.846 910 HB3 PHE 117 1HB PHE 117 -11.157 -0.719 -0.075 911 HD1 PHE 117 1HD PHE 117 -12.877 0.549 1.799 912 HD2 PHE 117 2HD PHE 117 -12.711 -3.601 0.726 913 HE1 PHE 117 1HE PHE 117 -13.834 -0.057 4.006 914 HE2 PHE 117 2HE PHE 117 -13.669 -4.210 2.936 915 HZ PHE 117 HZ PHE 117 -14.229 -2.437 4.573 916 H SER 118 H SER 118 -12.670 -0.388 -3.376 917 HA SER 118 HA SER 118 -10.571 1.643 -3.614 918 HB2 SER 118 2HB SER 118 -11.204 -0.833 -4.782 919 HB3 SER 118 1HB SER 118 -11.469 0.360 -6.052 920 HG SER 118 HG SER 118 -9.294 -0.348 -5.984 921 H ASP 119 H ASP 119 -13.786 0.894 -4.728 922 HA ASP 119 HA ASP 119 -14.120 3.211 -6.409 923 HB2 ASP 119 2HB ASP 119 -15.528 1.306 -6.749 924 HB3 ASP 119 1HB ASP 119 -15.972 1.254 -5.043 925 H THR 120 H THR 120 -14.611 2.514 -3.063 926 HA THR 120 HA THR 120 -16.067 4.885 -2.336 927 HB THR 120 HB THR 120 -14.573 2.652 -1.073 928 HG1 THR 120 1HG THR 120 -16.584 2.244 -0.725 929 HG21 THR 120 3HG2 THR 120 -14.922 3.905 1.195 930 HG22 THR 120 1HG2 THR 120 -14.832 5.357 0.197 931 HG23 THR 120 2HG2 THR 120 -13.477 4.229 0.238 932 H ILE 121 H ILE 121 -12.717 3.940 -2.257 933 HA ILE 121 HA ILE 121 -11.668 6.506 -1.431 934 HB ILE 121 HB ILE 121 -10.863 3.796 -1.955 935 HG12 ILE 121 2HG1 ILE 121 -10.603 5.022 0.160 936 HG13 ILE 121 1HG1 ILE 121 -9.055 4.386 -0.398 937 HG21 ILE 121 1HG2 ILE 121 -9.849 4.800 -4.020 938 HG22 ILE 121 2HG2 ILE 121 -8.673 4.088 -2.917 939 HG23 ILE 121 3HG2 ILE 121 -8.880 5.839 -2.974 940 HD11 ILE 121 3HD1 ILE 121 -10.014 7.215 -0.917 941 HD12 ILE 121 1HD1 ILE 121 -8.420 6.556 -1.285 942 HD13 ILE 121 2HD1 ILE 121 -8.923 6.764 0.393 943 H LYS 122 H LYS 122 -11.961 4.801 -4.569 944 HA LYS 122 HA LYS 122 -10.695 6.827 -6.152 945 HB2 LYS 122 2HB LYS 122 -12.299 4.369 -6.463 946 HB3 LYS 122 1HB LYS 122 -12.532 5.535 -7.764 947 HG2 LYS 122 2HG LYS 122 -10.562 4.913 -8.648 948 HG3 LYS 122 1HG LYS 122 -9.767 5.515 -7.194 949 HD2 LYS 122 2HD LYS 122 -10.987 2.943 -6.681 950 HD3 LYS 122 1HD LYS 122 -9.891 2.846 -8.058 951 HE2 LYS 122 2HE LYS 122 -8.366 4.345 -6.377 952 HE3 LYS 122 1HE LYS 122 -9.272 3.374 -5.198 953 HZ1 LYS 122 3HZ LYS 122 -7.123 2.474 -6.523 954 HZ2 LYS 122 1HZ LYS 122 -8.363 1.939 -7.549 955 HZ3 LYS 122 2HZ LYS 122 -8.350 1.468 -5.916 956 H SER 123 H SER 123 -13.956 6.293 -4.965 957 HA SER 123 HA SER 123 -15.173 8.444 -6.493 958 HB2 SER 123 2HB SER 123 -15.902 6.738 -4.121 959 HB3 SER 123 1HB SER 123 -16.984 7.995 -4.715 960 HG SER 123 HG SER 123 -17.605 6.493 -6.058 961 H PHE 124 H PHE 124 -13.169 8.230 -3.775 962 HA PHE 124 HA PHE 124 -14.144 10.525 -2.284 963 HB2 PHE 124 2HB PHE 124 -12.410 8.432 -1.892 964 HB3 PHE 124 1HB PHE 124 -11.296 9.780 -2.116 965 HD1 PHE 124 1HD PHE 124 -11.669 11.902 -0.720 966 HD2 PHE 124 2HD PHE 124 -13.574 8.151 0.143 967 HE1 PHE 124 1HE PHE 124 -12.139 12.672 1.590 968 HE2 PHE 124 2HE PHE 124 -14.046 8.921 2.452 969 HZ PHE 124 HZ PHE 124 -13.328 11.182 3.177 970 H ALA 125 H ALA 125 -12.746 10.283 -5.276 971 HA ALA 125 HA ALA 125 -11.547 13.026 -5.073 972 HB1 ALA 125 1HB ALA 125 -10.080 12.127 -6.991 973 HB2 ALA 125 2HB ALA 125 -10.707 10.534 -6.569 974 HB3 ALA 125 3HB ALA 125 -9.776 11.457 -5.388 975 H SER 126 H SER 126 -12.776 14.455 -6.238 976 HA SER 126 HA SER 126 -13.657 13.789 -8.959 977 HB2 SER 126 2HB SER 126 -16.062 14.104 -8.384 978 HB3 SER 126 1HB SER 126 -15.361 12.712 -7.562 979 HG SER 126 HG SER 126 -15.526 13.722 -5.701 980 H SER 127 H SER 127 -14.311 16.048 -6.244 981 HA SER 127 HA SER 127 -13.309 18.319 -7.811 982 HB2 SER 127 2HB SER 127 -16.242 17.800 -7.309 983 HB3 SER 127 1HB SER 127 -15.636 19.424 -7.620 984 HG SER 127 HG SER 127 -15.770 17.188 -9.294 985 H GLY 128 H GLY 128 -12.050 19.024 -6.067 986 HA2 GLY 128 2HA GLY 128 -13.553 19.848 -3.623 987 HA3 GLY 128 1HA GLY 128 -12.034 18.967 -3.461 988 H LYS 129 H LYS 129 -12.117 21.420 -2.295 989 HA LYS 129 HA LYS 129 -10.826 23.314 -4.220 990 HB2 LYS 129 2HB LYS 129 -12.121 23.612 -1.494 991 HB3 LYS 129 1HB LYS 129 -11.325 24.939 -2.340 992 HG2 LYS 129 2HG LYS 129 -13.180 23.543 -4.090 993 HG3 LYS 129 1HG LYS 129 -13.993 24.137 -2.642 994 HD2 LYS 129 2HD LYS 129 -14.111 25.971 -4.114 995 HD3 LYS 129 1HD LYS 129 -12.717 26.354 -3.104 996 HE2 LYS 129 2HE LYS 129 -11.620 26.620 -5.093 997 HE3 LYS 129 1HE LYS 129 -11.577 24.846 -5.124 998 HZ1 LYS 129 3HZ LYS 129 -13.631 26.629 -6.310 999 HZ2 LYS 129 1HZ LYS 129 -13.869 24.962 -6.101 1000 HZ3 LYS 129 2HZ LYS 129 -12.629 25.520 -7.119 1001 H GLU 130 H GLU 130 -9.215 21.148 -3.374 1002 HA GLU 130 HA GLU 130 -7.121 20.708 -2.362 1003 HB2 GLU 130 2HB GLU 130 -7.348 23.607 -2.939 1004 HB3 GLU 130 1HB GLU 130 -6.068 23.166 -1.808 1005 HG2 GLU 130 2HG GLU 130 -4.918 21.909 -3.383 1006 HG3 GLU 130 1HG GLU 130 -6.372 21.560 -4.317 1007 H LYS 131 H LYS 131 -9.624 21.182 -0.652 1008 HA LYS 131 HA LYS 131 -10.152 21.401 1.646 1009 HB2 LYS 131 2HB LYS 131 -7.306 20.369 1.562 1010 HB3 LYS 131 1HB LYS 131 -8.229 20.472 3.062 1011 HG2 LYS 131 2HG LYS 131 -9.294 19.045 0.618 1012 HG3 LYS 131 1HG LYS 131 -8.313 18.223 1.831 1013 HD2 LYS 131 2HD LYS 131 -10.000 19.220 3.543 1014 HD3 LYS 131 1HD LYS 131 -11.044 19.455 2.140 1015 HE2 LYS 131 2HE LYS 131 -11.666 17.302 2.876 1016 HE3 LYS 131 1HE LYS 131 -10.450 16.930 1.637 1017 HZ1 LYS 131 3HZ LYS 131 -8.756 16.831 3.306 1018 HZ2 LYS 131 1HZ LYS 131 -10.019 15.807 3.787 1019 HZ3 LYS 131 2HZ LYS 131 -9.837 17.330 4.517 1020 H LEU 132 H LEU 132 -8.834 22.294 3.834 1021 HA LEU 132 HA LEU 132 -7.297 24.737 3.181 1022 HB2 LEU 132 2HB LEU 132 -9.007 26.154 4.330 1023 HB3 LEU 132 1HB LEU 132 -9.635 25.396 2.866 1024 HG LEU 132 HG LEU 132 -10.143 23.498 4.819 1025 HD11 LEU 132 1HD1 LEU 132 -10.398 26.288 5.938 1026 HD12 LEU 132 2HD1 LEU 132 -9.687 24.862 6.694 1027 HD13 LEU 132 3HD1 LEU 132 -11.436 24.980 6.503 1028 HD21 LEU 132 3HD2 LEU 132 -12.358 25.355 4.490 1029 HD22 LEU 132 1HD2 LEU 132 -12.184 23.711 3.873 1030 HD23 LEU 132 2HD2 LEU 132 -11.535 25.071 2.956 1031 H GLU 133 H GLU 133 -6.657 25.870 5.271 1032 HA GLU 133 HA GLU 133 -6.846 24.199 7.714 1033 HB2 GLU 133 2HB GLU 133 -4.828 23.769 5.942 1034 HB3 GLU 133 1HB GLU 133 -4.102 25.023 6.949 1035 HG2 GLU 133 2HG GLU 133 -4.917 23.599 8.952 1036 HG3 GLU 133 1HG GLU 133 -5.102 22.300 7.771 Start of MODEL 5 1 H1 MET 1 1HT MET 1 7.299 -31.352 -3.673 2 H2 MET 1 2HT MET 1 7.825 -30.407 -4.985 3 H3 MET 1 3HT MET 1 6.359 -31.260 -5.081 4 HA MET 1 HA MET 1 6.444 -28.681 -4.503 5 HB2 MET 1 2HB MET 1 4.616 -30.606 -4.765 6 HB3 MET 1 1HB MET 1 4.515 -30.421 -3.013 7 HG2 MET 1 2HG MET 1 4.305 -27.900 -3.450 8 HG3 MET 1 1HG MET 1 4.019 -28.328 -5.137 9 HE1 MET 1 2HE MET 1 2.258 -26.645 -3.877 10 HE2 MET 1 3HE MET 1 0.628 -27.246 -3.581 11 HE3 MET 1 1HE MET 1 1.338 -27.360 -5.198 12 H MET 2 H MET 2 7.694 -27.647 -2.965 13 HA MET 2 HA MET 2 7.889 -28.824 -0.231 14 HB2 MET 2 2HB MET 2 9.467 -27.001 -1.980 15 HB3 MET 2 1HB MET 2 9.556 -26.695 -0.246 16 HG2 MET 2 2HG MET 2 9.909 -29.483 -1.334 17 HG3 MET 2 1HG MET 2 11.265 -28.355 -1.284 18 HE1 MET 2 3HE MET 2 11.612 -30.979 1.676 19 HE2 MET 2 1HE MET 2 11.984 -30.642 -0.020 20 HE3 MET 2 2HE MET 2 10.417 -31.312 0.425 21 H GLU 3 H GLU 3 8.362 -26.459 1.195 22 HA GLU 3 HA GLU 3 5.795 -24.937 0.896 23 HB2 GLU 3 2HB GLU 3 5.791 -24.947 3.412 24 HB3 GLU 3 1HB GLU 3 5.619 -26.558 2.706 25 HG2 GLU 3 2HG GLU 3 7.909 -27.086 3.128 26 HG3 GLU 3 1HG GLU 3 8.305 -25.400 3.477 27 H GLU 4 H GLU 4 9.140 -24.789 1.071 28 HA GLU 4 HA GLU 4 9.439 -22.392 2.623 29 HB2 GLU 4 2HB GLU 4 11.171 -23.744 0.536 30 HB3 GLU 4 1HB GLU 4 11.729 -22.437 1.581 31 HG2 GLU 4 2HG GLU 4 10.502 -24.313 3.291 32 HG3 GLU 4 1HG GLU 4 11.492 -25.256 2.177 33 H TYR 5 H TYR 5 8.056 -22.873 -0.357 34 HA TYR 5 HA TYR 5 9.014 -20.580 -1.819 35 HB2 TYR 5 2HB TYR 5 6.592 -22.371 -1.952 36 HB3 TYR 5 1HB TYR 5 6.833 -21.052 -3.099 37 HD1 TYR 5 2HD TYR 5 9.100 -20.969 -4.348 38 HD2 TYR 5 1HD TYR 5 7.631 -24.451 -2.310 39 HE1 TYR 5 2HE TYR 5 10.641 -22.392 -5.671 40 HE2 TYR 5 1HE TYR 5 9.173 -25.876 -3.631 41 HH TYR 5 HH TYR 5 10.765 -25.922 -5.169 42 H LEU 6 H LEU 6 6.208 -21.182 0.186 43 HA LEU 6 HA LEU 6 5.312 -18.375 0.006 44 HB2 LEU 6 2HB LEU 6 3.486 -19.261 1.483 45 HB3 LEU 6 1HB LEU 6 3.684 -20.197 0.002 46 HG LEU 6 HG LEU 6 5.391 -21.150 2.187 47 HD11 LEU 6 1HD1 LEU 6 3.405 -22.251 3.349 48 HD12 LEU 6 2HD1 LEU 6 2.380 -21.088 2.507 49 HD13 LEU 6 3HD1 LEU 6 3.599 -20.526 3.651 50 HD21 LEU 6 3HD2 LEU 6 3.781 -22.146 -0.054 51 HD22 LEU 6 1HD2 LEU 6 3.663 -23.167 1.380 52 HD23 LEU 6 2HD2 LEU 6 5.239 -22.826 0.668 53 H GLY 7 H GLY 7 7.253 -20.378 2.068 54 HA2 GLY 7 2HA GLY 7 6.954 -18.990 4.545 55 HA3 GLY 7 1HA GLY 7 8.381 -19.915 4.073 56 H VAL 8 H VAL 8 9.169 -18.459 1.797 57 HA VAL 8 HA VAL 8 10.297 -16.069 3.096 58 HB VAL 8 HB VAL 8 10.752 -17.641 0.570 59 HG11 VAL 8 1HG1 VAL 8 12.759 -15.714 0.649 60 HG12 VAL 8 2HG1 VAL 8 11.291 -14.800 0.999 61 HG13 VAL 8 3HG1 VAL 8 11.405 -15.751 -0.482 62 HG21 VAL 8 3HG2 VAL 8 11.786 -17.769 3.141 63 HG22 VAL 8 1HG2 VAL 8 13.019 -16.868 2.260 64 HG23 VAL 8 2HG2 VAL 8 12.530 -18.469 1.704 65 H PHE 9 H PHE 9 7.956 -16.899 0.702 66 HA PHE 9 HA PHE 9 7.729 -14.252 -0.497 67 HB2 PHE 9 2HB PHE 9 7.061 -16.657 -1.336 68 HB3 PHE 9 1HB PHE 9 5.560 -16.336 -0.467 69 HD1 PHE 9 1HD PHE 9 7.702 -15.316 -3.286 70 HD2 PHE 9 2HD PHE 9 4.034 -14.577 -1.177 71 HE1 PHE 9 1HE PHE 9 6.899 -13.921 -5.173 72 HE2 PHE 9 2HE PHE 9 3.232 -13.184 -3.061 73 HZ PHE 9 HZ PHE 9 4.664 -12.855 -5.060 74 H VAL 10 H VAL 10 6.289 -15.938 2.233 75 HA VAL 10 HA VAL 10 4.243 -13.839 2.642 76 HB VAL 10 HB VAL 10 5.038 -16.373 4.115 77 HG11 VAL 10 1HG1 VAL 10 3.341 -16.013 5.651 78 HG12 VAL 10 2HG1 VAL 10 2.429 -14.973 4.558 79 HG13 VAL 10 3HG1 VAL 10 3.860 -14.350 5.380 80 HG21 VAL 10 3HG2 VAL 10 3.917 -16.382 1.756 81 HG22 VAL 10 1HG2 VAL 10 2.472 -15.858 2.621 82 HG23 VAL 10 2HG2 VAL 10 3.229 -17.400 3.020 83 H ASP 11 H ASP 11 7.441 -14.713 3.779 84 HA ASP 11 HA ASP 11 7.294 -13.109 6.216 85 HB2 ASP 11 2HB ASP 11 8.746 -15.156 5.768 86 HB3 ASP 11 1HB ASP 11 9.726 -14.123 4.726 87 H GLU 12 H GLU 12 8.039 -12.623 2.910 88 HA GLU 12 HA GLU 12 9.373 -10.022 3.359 89 HB2 GLU 12 2HB GLU 12 9.845 -10.157 1.014 90 HB3 GLU 12 1HB GLU 12 10.017 -11.799 1.634 91 HG2 GLU 12 2HG GLU 12 7.801 -12.389 0.861 92 HG3 GLU 12 1HG GLU 12 7.478 -10.721 0.390 93 H THR 13 H THR 13 6.286 -11.340 2.243 94 HA THR 13 HA THR 13 5.196 -8.905 1.183 95 HB THR 13 HB THR 13 4.472 -11.419 1.027 96 HG1 THR 13 1HG THR 13 2.182 -10.556 0.933 97 HG21 THR 13 3HG2 THR 13 2.737 -10.550 3.347 98 HG22 THR 13 1HG2 THR 13 4.168 -11.561 3.548 99 HG23 THR 13 2HG2 THR 13 2.808 -12.141 2.588 100 H LYS 14 H LYS 14 5.234 -10.317 4.440 101 HA LYS 14 HA LYS 14 3.533 -8.206 5.570 102 HB2 LYS 14 2HB LYS 14 5.143 -10.552 6.593 103 HB3 LYS 14 1HB LYS 14 4.371 -9.426 7.708 104 HG2 LYS 14 2HG LYS 14 2.334 -10.318 7.332 105 HG3 LYS 14 1HG LYS 14 2.556 -10.248 5.583 106 HD2 LYS 14 2HD LYS 14 2.913 -12.466 5.529 107 HD3 LYS 14 1HD LYS 14 4.283 -12.279 6.623 108 HE2 LYS 14 2HE LYS 14 3.102 -13.147 8.352 109 HE3 LYS 14 1HE LYS 14 1.757 -12.028 8.058 110 HZ1 LYS 14 3HZ LYS 14 0.747 -13.949 7.430 111 HZ2 LYS 14 1HZ LYS 14 2.198 -14.715 6.997 112 HZ3 LYS 14 2HZ LYS 14 1.492 -13.580 5.949 113 H GLU 15 H GLU 15 7.006 -9.000 5.469 114 HA GLU 15 HA GLU 15 7.898 -6.933 7.242 115 HB2 GLU 15 2HB GLU 15 9.068 -8.566 5.002 116 HB3 GLU 15 1HB GLU 15 10.029 -7.288 5.748 117 HG2 GLU 15 2HG GLU 15 9.450 -8.352 7.993 118 HG3 GLU 15 1HG GLU 15 8.849 -9.730 7.073 119 H TYR 16 H TYR 16 6.657 -6.891 4.091 120 HA TYR 16 HA TYR 16 7.856 -4.310 3.338 121 HB2 TYR 16 2HB TYR 16 6.499 -6.572 2.085 122 HB3 TYR 16 1HB TYR 16 5.877 -5.028 1.501 123 HD1 TYR 16 1HD TYR 16 7.993 -3.202 1.348 124 HD2 TYR 16 2HD TYR 16 8.164 -7.447 0.710 125 HE1 TYR 16 1HE TYR 16 10.017 -2.910 -0.054 126 HE2 TYR 16 2HE TYR 16 10.190 -7.155 -0.692 127 HH TYR 16 HH TYR 16 11.587 -3.917 -1.246 128 H LEU 17 H LEU 17 4.672 -5.626 4.278 129 HA LEU 17 HA LEU 17 3.127 -3.270 3.847 130 HB2 LEU 17 2HB LEU 17 2.986 -5.507 5.896 131 HB3 LEU 17 1HB LEU 17 1.702 -4.316 5.675 132 HG LEU 17 HG LEU 17 2.779 -5.978 3.396 133 HD11 LEU 17 1HD1 LEU 17 0.654 -6.587 5.440 134 HD12 LEU 17 2HD1 LEU 17 1.899 -7.653 4.786 135 HD13 LEU 17 3HD1 LEU 17 0.505 -7.212 3.798 136 HD21 LEU 17 3HD2 LEU 17 1.504 -3.834 2.968 137 HD22 LEU 17 1HD2 LEU 17 0.121 -4.570 3.778 138 HD23 LEU 17 2HD2 LEU 17 0.747 -5.277 2.288 139 H GLN 18 H GLN 18 5.083 -4.349 6.583 140 HA GLN 18 HA GLN 18 4.524 -2.094 8.282 141 HB2 GLN 18 2HB GLN 18 5.558 -3.553 9.645 142 HB3 GLN 18 1HB GLN 18 5.965 -4.543 8.251 143 HG2 GLN 18 2HG GLN 18 8.066 -3.501 7.975 144 HG3 GLN 18 1HG GLN 18 7.618 -2.133 8.994 145 HE21 GLN 18 1HE2 GLN 18 9.360 -5.015 9.022 146 HE22 GLN 18 2HE2 GLN 18 9.391 -5.285 10.698 147 H ASN 19 H ASN 19 7.108 -2.958 6.096 148 HA ASN 19 HA ASN 19 8.621 -0.539 6.296 149 HB2 ASN 19 2HB ASN 19 8.754 -2.984 4.966 150 HB3 ASN 19 1HB ASN 19 8.503 -1.829 3.656 151 HD21 ASN 19 1HD2 ASN 19 10.283 -1.276 6.726 152 HD22 ASN 19 2HD2 ASN 19 11.775 -0.955 5.981 153 H LEU 20 H LEU 20 5.696 -1.481 4.797 154 HA LEU 20 HA LEU 20 5.495 0.939 3.114 155 HB2 LEU 20 2HB LEU 20 4.685 -1.000 2.042 156 HB3 LEU 20 1HB LEU 20 3.965 -1.621 3.526 157 HG LEU 20 HG LEU 20 2.332 0.305 3.438 158 HD11 LEU 20 1HD1 LEU 20 2.100 1.298 1.086 159 HD12 LEU 20 2HD1 LEU 20 3.726 0.686 0.782 160 HD13 LEU 20 3HD1 LEU 20 3.456 1.882 2.050 161 HD21 LEU 20 3HD2 LEU 20 1.669 -1.919 2.681 162 HD22 LEU 20 1HD2 LEU 20 2.401 -1.630 1.102 163 HD23 LEU 20 2HD2 LEU 20 0.980 -0.709 1.599 164 H ASN 21 H ASN 21 4.735 -0.093 6.256 165 HA ASN 21 HA ASN 21 2.514 1.821 6.565 166 HB2 ASN 21 2HB ASN 21 3.756 -0.433 8.084 167 HB3 ASN 21 1HB ASN 21 2.954 0.836 9.016 168 HD21 ASN 21 1HD2 ASN 21 1.946 -1.891 8.826 169 HD22 ASN 21 2HD2 ASN 21 0.451 -1.825 8.025 170 H ASP 22 H ASP 22 5.823 1.185 7.257 171 HA ASP 22 HA ASP 22 6.225 3.375 9.022 172 HB2 ASP 22 2HB ASP 22 7.713 1.382 8.837 173 HB3 ASP 22 1HB ASP 22 8.174 1.924 7.223 174 H THR 23 H THR 23 6.217 2.866 5.655 175 HA THR 23 HA THR 23 7.314 5.446 4.831 176 HB THR 23 HB THR 23 5.683 3.250 3.561 177 HG1 THR 23 1HG THR 23 7.828 2.882 2.577 178 HG21 THR 23 3HG2 THR 23 5.558 5.560 2.452 179 HG22 THR 23 1HG2 THR 23 6.083 4.225 1.428 180 HG23 THR 23 2HG2 THR 23 7.270 5.353 2.083 181 H LEU 24 H LEU 24 4.123 3.921 5.157 182 HA LEU 24 HA LEU 24 2.648 6.278 4.267 183 HB2 LEU 24 2HB LEU 24 2.106 3.538 5.362 184 HB3 LEU 24 1HB LEU 24 0.807 4.729 5.431 185 HG LEU 24 HG LEU 24 2.347 4.170 2.889 186 HD11 LEU 24 1HD1 LEU 24 -0.200 2.882 3.914 187 HD12 LEU 24 2HD1 LEU 24 1.319 2.069 3.544 188 HD13 LEU 24 3HD1 LEU 24 0.360 2.776 2.245 189 HD21 LEU 24 3HD2 LEU 24 -0.490 5.115 3.043 190 HD22 LEU 24 1HD2 LEU 24 0.757 5.499 1.855 191 HD23 LEU 24 2HD2 LEU 24 0.786 6.264 3.444 192 H LEU 25 H LEU 25 3.918 4.972 7.254 193 HA LEU 25 HA LEU 25 2.230 6.668 8.965 194 HB2 LEU 25 2HB LEU 25 4.617 4.871 9.345 195 HB3 LEU 25 1HB LEU 25 3.936 5.804 10.685 196 HG LEU 25 HG LEU 25 2.187 4.150 8.910 197 HD11 LEU 25 1HD1 LEU 25 4.072 2.758 9.880 198 HD12 LEU 25 2HD1 LEU 25 2.452 2.247 10.353 199 HD13 LEU 25 3HD1 LEU 25 3.451 3.166 11.480 200 HD21 LEU 25 3HD2 LEU 25 0.583 4.526 10.533 201 HD22 LEU 25 1HD2 LEU 25 1.561 5.977 10.763 202 HD23 LEU 25 2HD2 LEU 25 1.767 4.592 11.838 203 H GLU 26 H GLU 26 5.121 6.983 7.236 204 HA GLU 26 HA GLU 26 5.971 9.367 8.777 205 HB2 GLU 26 2HB GLU 26 7.112 7.804 6.428 206 HB3 GLU 26 1HB GLU 26 7.879 9.251 7.088 207 HG2 GLU 26 2HG GLU 26 7.164 7.083 9.009 208 HG3 GLU 26 1HG GLU 26 8.535 6.796 7.936 209 H LEU 27 H LEU 27 4.373 8.221 5.999 210 HA LEU 27 HA LEU 27 4.372 10.563 4.429 211 HB2 LEU 27 2HB LEU 27 3.869 8.353 3.541 212 HB3 LEU 27 1HB LEU 27 2.513 8.187 4.655 213 HG LEU 27 HG LEU 27 1.331 10.001 3.562 214 HD11 LEU 27 1HD1 LEU 27 3.386 11.319 3.011 215 HD12 LEU 27 2HD1 LEU 27 2.261 11.189 1.660 216 HD13 LEU 27 3HD1 LEU 27 3.712 10.186 1.700 217 HD21 LEU 27 3HD2 LEU 27 1.440 8.991 1.106 218 HD22 LEU 27 1HD2 LEU 27 0.763 8.050 2.435 219 HD23 LEU 27 2HD2 LEU 27 2.418 7.756 1.900 220 H GLU 28 H GLU 28 2.421 9.379 7.113 221 HA GLU 28 HA GLU 28 0.305 11.353 6.895 222 HB2 GLU 28 2HB GLU 28 1.291 10.111 9.464 223 HB3 GLU 28 1HB GLU 28 -0.367 10.473 8.990 224 HG2 GLU 28 2HG GLU 28 0.259 8.724 7.040 225 HG3 GLU 28 1HG GLU 28 1.330 8.134 8.312 226 H LYS 29 H LYS 29 3.418 11.141 8.571 227 HA LYS 29 HA LYS 29 3.185 13.709 9.920 228 HB2 LYS 29 2HB LYS 29 5.833 12.525 9.172 229 HB3 LYS 29 1HB LYS 29 5.341 13.254 10.695 230 HG2 LYS 29 2HG LYS 29 4.667 10.488 9.669 231 HG3 LYS 29 1HG LYS 29 5.597 10.913 11.099 232 HD2 LYS 29 2HD LYS 29 3.601 11.911 12.128 233 HD3 LYS 29 1HD LYS 29 2.651 11.503 10.699 234 HE2 LYS 29 2HE LYS 29 2.302 9.430 11.527 235 HE3 LYS 29 1HE LYS 29 4.055 9.152 11.548 236 HZ1 LYS 29 3HZ LYS 29 3.146 9.037 13.791 237 HZ2 LYS 29 1HZ LYS 29 2.504 10.599 13.633 238 HZ3 LYS 29 2HZ LYS 29 4.189 10.370 13.636 239 H ASN 30 H ASN 30 3.928 12.610 6.800 240 HA ASN 30 HA ASN 30 4.292 15.366 5.819 241 HB2 ASN 30 2HB ASN 30 6.495 13.725 6.424 242 HB3 ASN 30 1HB ASN 30 6.309 13.581 4.677 243 HD21 ASN 30 1HD2 ASN 30 6.917 15.900 7.304 244 HD22 ASN 30 2HD2 ASN 30 7.477 17.149 6.300 245 HA PRO 31 HA PRO 31 1.885 12.624 3.168 246 HB2 PRO 31 2HB PRO 31 -0.425 14.036 3.375 247 HB3 PRO 31 1HB PRO 31 0.097 12.840 4.570 248 HG2 PRO 31 2HG PRO 31 0.047 15.762 4.764 249 HG3 PRO 31 1HG PRO 31 -0.042 14.534 6.032 250 HD2 PRO 31 2HD PRO 31 2.220 16.042 5.254 251 HD3 PRO 31 1HD PRO 31 2.153 14.707 6.428 252 H GLU 32 H GLU 32 3.630 15.070 2.570 253 HA GLU 32 HA GLU 32 2.260 15.811 0.027 254 HB2 GLU 32 2HB GLU 32 3.785 18.041 0.968 255 HB3 GLU 32 1HB GLU 32 2.040 17.948 0.751 256 HG2 GLU 32 2HG GLU 32 1.694 17.225 2.993 257 HG3 GLU 32 1HG GLU 32 3.408 16.871 3.220 258 H ASP 33 H ASP 33 4.802 14.360 1.442 259 HA ASP 33 HA ASP 33 6.910 15.448 -0.306 260 HB2 ASP 33 2HB ASP 33 6.852 14.528 2.262 261 HB3 ASP 33 1HB ASP 33 7.385 13.080 1.408 262 H MET 34 H MET 34 7.373 14.451 -2.252 263 HA MET 34 HA MET 34 5.848 12.194 -3.182 264 HB2 MET 34 2HB MET 34 8.339 13.617 -4.166 265 HB3 MET 34 1HB MET 34 7.487 12.391 -5.105 266 HG2 MET 34 2HG MET 34 5.388 13.937 -4.509 267 HG3 MET 34 1HG MET 34 6.645 15.169 -4.407 268 HE1 MET 34 3HE MET 34 4.554 15.501 -7.536 269 HE2 MET 34 1HE MET 34 4.202 14.846 -5.930 270 HE3 MET 34 2HE MET 34 4.198 13.787 -7.338 271 H GLU 35 H GLU 35 8.405 12.242 -1.008 272 HA GLU 35 HA GLU 35 9.830 9.880 -1.971 273 HB2 GLU 35 2HB GLU 35 9.950 11.857 0.190 274 HB3 GLU 35 1HB GLU 35 10.332 10.229 0.754 275 HG2 GLU 35 2HG GLU 35 11.984 9.998 -1.081 276 HG3 GLU 35 1HG GLU 35 11.633 11.652 -1.585 277 H LEU 36 H LEU 36 7.795 10.477 0.924 278 HA LEU 36 HA LEU 36 7.420 7.685 1.469 279 HB2 LEU 36 2HB LEU 36 5.547 9.963 2.169 280 HB3 LEU 36 1HB LEU 36 5.836 8.490 3.091 281 HG LEU 36 HG LEU 36 7.617 10.892 2.776 282 HD11 LEU 36 1HD1 LEU 36 6.192 10.897 4.710 283 HD12 LEU 36 2HD1 LEU 36 7.817 10.492 5.262 284 HD13 LEU 36 3HD1 LEU 36 6.606 9.224 5.079 285 HD21 LEU 36 3HD2 LEU 36 8.405 8.032 3.235 286 HD22 LEU 36 1HD2 LEU 36 9.283 9.307 4.082 287 HD23 LEU 36 2HD2 LEU 36 9.248 9.283 2.319 288 H ILE 37 H ILE 37 6.065 9.862 -0.831 289 HA ILE 37 HA ILE 37 3.599 8.341 -1.261 290 HB ILE 37 HB ILE 37 5.058 10.649 -2.545 291 HG12 ILE 37 2HG1 ILE 37 2.337 10.348 -1.235 292 HG13 ILE 37 1HG1 ILE 37 3.776 11.002 -0.455 293 HG21 ILE 37 1HG2 ILE 37 4.010 9.303 -4.350 294 HG22 ILE 37 2HG2 ILE 37 3.213 10.862 -4.141 295 HG23 ILE 37 3HG2 ILE 37 2.467 9.397 -3.500 296 HD11 ILE 37 3HD1 ILE 37 2.926 12.212 -3.050 297 HD12 ILE 37 1HD1 ILE 37 3.709 12.969 -1.664 298 HD13 ILE 37 2HD1 ILE 37 1.986 12.600 -1.609 299 H ASN 38 H ASN 38 6.871 8.525 -2.625 300 HA ASN 38 HA ASN 38 6.146 6.597 -4.752 301 HB2 ASN 38 2HB ASN 38 8.304 8.503 -4.152 302 HB3 ASN 38 1HB ASN 38 8.879 6.987 -4.837 303 HD21 ASN 38 1HD2 ASN 38 8.322 6.500 -7.046 304 HD22 ASN 38 2HD2 ASN 38 7.550 7.623 -8.058 305 H GLU 39 H GLU 39 7.560 6.713 -1.628 306 HA GLU 39 HA GLU 39 8.928 4.143 -1.771 307 HB2 GLU 39 2HB GLU 39 8.133 6.096 0.387 308 HB3 GLU 39 1HB GLU 39 8.856 4.542 0.802 309 HG2 GLU 39 2HG GLU 39 10.516 5.470 -1.208 310 HG3 GLU 39 1HG GLU 39 10.114 6.941 -0.323 311 H ALA 40 H ALA 40 5.794 5.328 -1.043 312 HA ALA 40 HA ALA 40 4.836 2.766 0.084 313 HB1 ALA 40 1HB ALA 40 3.444 5.390 -0.564 314 HB2 ALA 40 2HB ALA 40 4.149 4.973 0.997 315 HB3 ALA 40 3HB ALA 40 2.762 4.071 0.390 316 H PHE 41 H PHE 41 4.193 4.878 -2.754 317 HA PHE 41 HA PHE 41 2.302 3.280 -4.096 318 HB2 PHE 41 2HB PHE 41 2.787 5.412 -4.976 319 HB3 PHE 41 1HB PHE 41 4.528 5.145 -4.908 320 HD1 PHE 41 2HD PHE 41 5.622 3.602 -6.554 321 HD2 PHE 41 1HD PHE 41 1.495 4.746 -6.877 322 HE1 PHE 41 2HE PHE 41 5.599 2.852 -8.918 323 HE2 PHE 41 1HE PHE 41 1.472 3.998 -9.242 324 HZ PHE 41 HZ PHE 41 3.525 3.051 -10.263 325 H ARG 42 H ARG 42 5.875 3.095 -4.232 326 HA ARG 42 HA ARG 42 5.996 0.872 -6.049 327 HB2 ARG 42 2HB ARG 42 8.345 0.733 -5.164 328 HB3 ARG 42 1HB ARG 42 7.878 2.359 -5.656 329 HG2 ARG 42 2HG ARG 42 8.732 2.893 -3.600 330 HG3 ARG 42 1HG ARG 42 7.115 2.445 -3.064 331 HD2 ARG 42 2HD ARG 42 7.993 0.763 -1.826 332 HD3 ARG 42 1HD ARG 42 8.711 0.057 -3.290 333 HE ARG 42 HE ARG 42 10.245 2.344 -2.542 334 HH11 ARG 42 1HH2 ARG 42 9.327 -0.673 -1.171 335 HH12 ARG 42 2HH2 ARG 42 10.892 -1.000 -0.504 336 HH21 ARG 42 1HH1 ARG 42 12.349 1.855 -1.824 337 HH22 ARG 42 2HH1 ARG 42 12.601 0.430 -0.872 338 H ALA 43 H ALA 43 6.242 0.978 -2.457 339 HA ALA 43 HA ALA 43 6.607 -1.766 -1.953 340 HB1 ALA 43 1HB ALA 43 6.694 -0.545 -0.019 341 HB2 ALA 43 2HB ALA 43 4.977 -0.937 0.080 342 HB3 ALA 43 3HB ALA 43 5.490 0.613 -0.586 343 H LEU 44 H LEU 44 3.454 -0.054 -2.002 344 HA LEU 44 HA LEU 44 1.835 -2.401 -1.883 345 HB2 LEU 44 2HB LEU 44 1.532 0.443 -2.819 346 HB3 LEU 44 1HB LEU 44 0.205 -0.698 -3.055 347 HG LEU 44 HG LEU 44 1.519 -0.490 -0.366 348 HD11 LEU 44 1HD1 LEU 44 -0.220 1.530 -1.699 349 HD12 LEU 44 2HD1 LEU 44 1.007 1.751 -0.451 350 HD13 LEU 44 3HD1 LEU 44 -0.590 1.140 -0.020 351 HD21 LEU 44 3HD2 LEU 44 -0.883 -1.024 0.293 352 HD22 LEU 44 1HD2 LEU 44 -0.061 -2.281 -0.630 353 HD23 LEU 44 2HD2 LEU 44 -1.223 -1.222 -1.427 354 H HIS 45 H HIS 45 3.163 -0.561 -4.617 355 HA HIS 45 HA HIS 45 1.914 -2.036 -6.734 356 HB2 HIS 45 2HB HIS 45 2.932 0.038 -7.256 357 HB3 HIS 45 1HB HIS 45 4.399 -0.359 -6.365 358 HD1 HIS 45 1HD HIS 45 6.301 -0.926 -7.861 359 HD2 HIS 45 2HD HIS 45 2.651 -1.985 -9.575 360 HE1 HIS 45 1HE HIS 45 6.835 -1.914 -10.131 361 H THR 46 H THR 46 4.795 -2.521 -4.774 362 HA THR 46 HA THR 46 5.737 -4.829 -6.301 363 HB THR 46 HB THR 46 6.571 -3.053 -4.127 364 HG1 THR 46 1HG THR 46 7.668 -4.560 -6.191 365 HG21 THR 46 3HG2 THR 46 6.327 -5.026 -2.710 366 HG22 THR 46 1HG2 THR 46 8.038 -4.703 -2.983 367 HG23 THR 46 2HG2 THR 46 7.235 -6.000 -3.866 368 H LEU 47 H LEU 47 4.117 -4.242 -3.178 369 HA LEU 47 HA LEU 47 3.886 -7.011 -2.418 370 HB2 LEU 47 2HB LEU 47 3.113 -4.341 -1.539 371 HB3 LEU 47 1HB LEU 47 1.833 -5.518 -1.225 372 HG LEU 47 HG LEU 47 4.729 -5.976 -0.485 373 HD11 LEU 47 1HD1 LEU 47 3.964 -4.068 0.792 374 HD12 LEU 47 2HD1 LEU 47 3.939 -5.474 1.855 375 HD13 LEU 47 3HD1 LEU 47 2.436 -4.868 1.160 376 HD21 LEU 47 3HD2 LEU 47 3.997 -8.046 0.034 377 HD22 LEU 47 1HD2 LEU 47 2.394 -7.622 -0.565 378 HD23 LEU 47 2HD2 LEU 47 2.802 -7.354 1.130 379 H LYS 48 H LYS 48 1.792 -4.740 -4.176 380 HA LYS 48 HA LYS 48 -0.560 -6.332 -4.345 381 HB2 LYS 48 2HB LYS 48 -0.535 -4.006 -4.951 382 HB3 LYS 48 1HB LYS 48 0.737 -4.271 -6.143 383 HG2 LYS 48 2HG LYS 48 -1.275 -6.048 -6.902 384 HG3 LYS 48 1HG LYS 48 -2.144 -4.589 -6.425 385 HD2 LYS 48 2HD LYS 48 -1.660 -4.042 -8.615 386 HD3 LYS 48 1HD LYS 48 -0.213 -3.412 -7.825 387 HE2 LYS 48 2HE LYS 48 1.112 -5.241 -8.510 388 HE3 LYS 48 1HE LYS 48 -0.305 -6.262 -8.825 389 HZ1 LYS 48 3HZ LYS 48 -0.228 -3.734 -10.250 390 HZ2 LYS 48 1HZ LYS 48 -0.707 -5.269 -10.793 391 HZ3 LYS 48 2HZ LYS 48 0.942 -4.867 -10.729 392 H GLY 49 H GLY 49 2.358 -6.207 -6.394 393 HA2 GLY 49 2HA GLY 49 1.423 -8.053 -8.385 394 HA3 GLY 49 1HA GLY 49 3.112 -7.650 -8.085 395 H MET 50 H MET 50 3.639 -8.548 -5.618 396 HA MET 50 HA MET 50 3.965 -11.343 -5.891 397 HB2 MET 50 2HB MET 50 4.076 -9.324 -3.676 398 HB3 MET 50 1HB MET 50 4.241 -11.035 -3.274 399 HG2 MET 50 2HG MET 50 6.265 -11.232 -4.340 400 HG3 MET 50 1HG MET 50 5.850 -10.039 -5.570 401 HE1 MET 50 3HE MET 50 5.760 -10.281 -1.806 402 HE2 MET 50 1HE MET 50 4.932 -8.731 -2.020 403 HE3 MET 50 2HE MET 50 6.498 -8.794 -1.212 404 H ALA 51 H ALA 51 1.270 -9.499 -4.556 405 HA ALA 51 HA ALA 51 0.039 -11.897 -3.353 406 HB1 ALA 51 1HB ALA 51 -1.808 -9.896 -3.230 407 HB2 ALA 51 2HB ALA 51 -0.319 -8.962 -3.382 408 HB3 ALA 51 3HB ALA 51 -0.512 -10.103 -2.051 409 H GLY 52 H GLY 52 0.200 -10.549 -6.427 410 HA2 GLY 52 2HA GLY 52 -2.560 -11.176 -7.185 411 HA3 GLY 52 1HA GLY 52 -1.305 -10.570 -8.264 412 H THR 53 H THR 53 -1.056 -13.412 -6.159 413 HA THR 53 HA THR 53 -1.698 -15.383 -8.078 414 HB THR 53 HB THR 53 0.576 -13.934 -8.738 415 HG1 THR 53 1HG THR 53 -0.506 -15.106 -10.233 416 HG21 THR 53 3HG2 THR 53 1.383 -16.587 -7.514 417 HG22 THR 53 1HG2 THR 53 1.932 -14.984 -7.026 418 HG23 THR 53 2HG2 THR 53 2.411 -15.641 -8.590 419 H MET 54 H MET 54 0.555 -14.544 -5.575 420 HA MET 54 HA MET 54 0.146 -17.216 -4.303 421 HB2 MET 54 2HB MET 54 2.420 -15.846 -5.007 422 HB3 MET 54 1HB MET 54 2.237 -15.415 -3.309 423 HG2 MET 54 2HG MET 54 2.941 -17.457 -2.660 424 HG3 MET 54 1HG MET 54 1.714 -18.234 -3.663 425 HE1 MET 54 3HE MET 54 5.939 -16.959 -4.936 426 HE2 MET 54 1HE MET 54 5.324 -17.011 -3.278 427 HE3 MET 54 2HE MET 54 4.674 -15.842 -4.426 428 H GLY 55 H GLY 55 -0.596 -13.939 -4.125 429 HA2 GLY 55 2HA GLY 55 -1.357 -14.207 -1.236 430 HA3 GLY 55 1HA GLY 55 -0.890 -12.665 -1.962 431 H PHE 56 H PHE 56 -2.495 -14.469 -4.227 432 HA PHE 56 HA PHE 56 -4.726 -14.511 -5.029 433 HB2 PHE 56 2HB PHE 56 -4.907 -14.363 -2.235 434 HB3 PHE 56 1HB PHE 56 -5.949 -13.064 -2.815 435 HD1 PHE 56 2HD PHE 56 -7.223 -13.882 -5.151 436 HD2 PHE 56 1HD PHE 56 -6.052 -16.349 -1.837 437 HE1 PHE 56 2HE PHE 56 -8.953 -15.543 -5.777 438 HE2 PHE 56 1HE PHE 56 -7.784 -18.011 -2.462 439 HZ PHE 56 HZ PHE 56 -9.235 -17.607 -4.432 440 H SER 57 H SER 57 -4.934 -13.065 -6.677 441 HA SER 57 HA SER 57 -4.182 -10.343 -6.599 442 HB2 SER 57 2HB SER 57 -6.369 -11.189 -8.414 443 HB3 SER 57 1HB SER 57 -4.846 -10.393 -8.797 444 HG SER 57 HG SER 57 -3.799 -12.355 -8.575 445 H SER 58 H SER 58 -6.917 -11.899 -5.325 446 HA SER 58 HA SER 58 -8.878 -9.825 -5.496 447 HB2 SER 58 2HB SER 58 -8.457 -11.799 -3.235 448 HB3 SER 58 1HB SER 58 -9.981 -11.100 -3.771 449 HG SER 58 HG SER 58 -9.650 -12.201 -5.773 450 H MET 59 H MET 59 -6.310 -10.585 -3.164 451 HA MET 59 HA MET 59 -6.915 -8.174 -1.588 452 HB2 MET 59 2HB MET 59 -6.269 -10.334 -0.550 453 HB3 MET 59 1HB MET 59 -4.725 -10.273 -1.403 454 HG2 MET 59 2HG MET 59 -4.848 -7.793 -0.174 455 HG3 MET 59 1HG MET 59 -5.577 -8.858 1.026 456 HE1 MET 59 3HE MET 59 -2.475 -10.489 -1.364 457 HE2 MET 59 1HE MET 59 -1.613 -8.979 -1.036 458 HE3 MET 59 2HE MET 59 -3.234 -8.942 -1.723 459 H ALA 60 H ALA 60 -4.930 -9.101 -4.249 460 HA ALA 60 HA ALA 60 -2.809 -7.147 -3.818 461 HB1 ALA 60 1HB ALA 60 -2.170 -7.839 -6.078 462 HB2 ALA 60 2HB ALA 60 -3.748 -8.575 -6.325 463 HB3 ALA 60 3HB ALA 60 -2.628 -9.264 -5.148 464 H LYS 61 H LYS 61 -5.840 -7.273 -5.659 465 HA LYS 61 HA LYS 61 -5.557 -4.833 -7.121 466 HB2 LYS 61 2HB LYS 61 -7.693 -6.665 -6.169 467 HB3 LYS 61 1HB LYS 61 -8.229 -5.018 -6.513 468 HG2 LYS 61 2HG LYS 61 -8.430 -5.962 -8.611 469 HG3 LYS 61 1HG LYS 61 -6.776 -5.358 -8.688 470 HD2 LYS 61 2HD LYS 61 -6.593 -7.590 -9.446 471 HD3 LYS 61 1HD LYS 61 -6.093 -7.663 -7.755 472 HE2 LYS 61 2HE LYS 61 -7.637 -9.482 -8.060 473 HE3 LYS 61 1HE LYS 61 -8.559 -8.216 -7.224 474 HZ1 LYS 61 3HZ LYS 61 -8.863 -7.437 -9.732 475 HZ2 LYS 61 1HZ LYS 61 -9.944 -8.501 -8.973 476 HZ3 LYS 61 2HZ LYS 61 -8.728 -9.111 -9.992 477 H LEU 62 H LEU 62 -6.533 -5.625 -3.888 478 HA LEU 62 HA LEU 62 -7.430 -3.049 -3.023 479 HB2 LEU 62 2HB LEU 62 -7.942 -5.098 -1.826 480 HB3 LEU 62 1HB LEU 62 -6.226 -5.470 -1.641 481 HG LEU 62 HG LEU 62 -5.898 -3.647 -0.145 482 HD11 LEU 62 1HD1 LEU 62 -8.533 -2.740 -1.242 483 HD12 LEU 62 2HD1 LEU 62 -7.057 -1.814 -0.972 484 HD13 LEU 62 3HD1 LEU 62 -8.086 -2.249 0.392 485 HD21 LEU 62 3HD2 LEU 62 -7.494 -5.749 0.488 486 HD22 LEU 62 1HD2 LEU 62 -8.585 -4.413 0.858 487 HD23 LEU 62 2HD2 LEU 62 -7.015 -4.518 1.656 488 H CYS 63 H CYS 63 -4.261 -4.635 -3.178 489 HA CYS 63 HA CYS 63 -2.829 -2.580 -1.725 490 HB2 CYS 63 2HB CYS 63 -2.106 -4.835 -3.610 491 HB3 CYS 63 1HB CYS 63 -0.877 -3.796 -2.889 492 HG CYS 63 HG CYS 63 -2.538 -5.913 -1.388 493 H HIS 64 H HIS 64 -3.447 -3.266 -5.171 494 HA HIS 64 HA HIS 64 -1.821 -1.123 -6.207 495 HB2 HIS 64 2HB HIS 64 -2.762 -3.137 -7.427 496 HB3 HIS 64 1HB HIS 64 -4.341 -2.354 -7.368 497 HD1 HIS 64 1HD HIS 64 -0.834 -1.145 -8.306 498 HD2 HIS 64 2HD HIS 64 -4.742 -1.036 -9.753 499 HE1 HIS 64 1HE HIS 64 -0.765 0.190 -10.457 500 H THR 65 H THR 65 -5.034 -1.321 -4.862 501 HA THR 65 HA THR 65 -6.030 1.205 -5.845 502 HB THR 65 HB THR 65 -6.777 -0.995 -4.072 503 HG1 THR 65 1HG THR 65 -8.124 0.935 -5.635 504 HG21 THR 65 3HG2 THR 65 -6.646 0.822 -2.368 505 HG22 THR 65 1HG2 THR 65 -8.284 0.216 -2.601 506 HG23 THR 65 2HG2 THR 65 -7.801 1.754 -3.317 507 H LEU 66 H LEU 66 -4.544 0.228 -2.720 508 HA LEU 66 HA LEU 66 -4.553 2.804 -1.476 509 HB2 LEU 66 2HB LEU 66 -2.466 0.600 -1.289 510 HB3 LEU 66 1HB LEU 66 -2.826 1.811 -0.062 511 HG LEU 66 HG LEU 66 -4.594 -0.456 -0.987 512 HD11 LEU 66 1HD1 LEU 66 -3.574 -1.441 0.768 513 HD12 LEU 66 2HD1 LEU 66 -4.502 -0.339 1.785 514 HD13 LEU 66 3HD1 LEU 66 -2.860 0.082 1.296 515 HD21 LEU 66 3HD2 LEU 66 -5.849 0.858 1.131 516 HD22 LEU 66 1HD2 LEU 66 -6.364 0.879 -0.553 517 HD23 LEU 66 2HD2 LEU 66 -5.323 2.158 0.065 518 H GLU 67 H GLU 67 -2.162 1.173 -3.548 519 HA GLU 67 HA GLU 67 -0.229 3.306 -3.598 520 HB2 GLU 67 2HB GLU 67 0.379 1.052 -4.150 521 HB3 GLU 67 1HB GLU 67 -0.894 0.939 -5.362 522 HG2 GLU 67 2HG GLU 67 1.142 3.101 -5.686 523 HG3 GLU 67 1HG GLU 67 1.639 1.447 -6.045 524 H ASN 68 H ASN 68 -3.220 2.780 -5.327 525 HA ASN 68 HA ASN 68 -2.685 4.381 -7.640 526 HB2 ASN 68 2HB ASN 68 -4.886 3.131 -6.256 527 HB3 ASN 68 1HB ASN 68 -5.348 4.750 -6.773 528 HD21 ASN 68 1HD2 ASN 68 -3.271 2.207 -8.281 529 HD22 ASN 68 2HD2 ASN 68 -4.085 2.220 -9.770 530 H ILE 69 H ILE 69 -4.026 5.108 -4.453 531 HA ILE 69 HA ILE 69 -4.416 7.897 -4.767 532 HB ILE 69 HB ILE 69 -3.884 5.983 -2.510 533 HG12 ILE 69 2HG1 ILE 69 -6.238 6.726 -1.960 534 HG13 ILE 69 1HG1 ILE 69 -6.223 7.624 -3.474 535 HG21 ILE 69 1HG2 ILE 69 -3.372 8.788 -2.385 536 HG22 ILE 69 2HG2 ILE 69 -3.386 7.630 -1.059 537 HG23 ILE 69 3HG2 ILE 69 -4.866 8.480 -1.503 538 HD11 ILE 69 3HD1 ILE 69 -5.895 5.603 -4.748 539 HD12 ILE 69 1HD1 ILE 69 -7.253 5.337 -3.656 540 HD13 ILE 69 2HD1 ILE 69 -5.672 4.658 -3.275 541 H LEU 70 H LEU 70 -1.714 5.970 -3.791 542 HA LEU 70 HA LEU 70 0.084 8.174 -3.269 543 HB2 LEU 70 2HB LEU 70 0.821 5.366 -4.128 544 HB3 LEU 70 1HB LEU 70 1.746 6.445 -3.082 545 HG LEU 70 HG LEU 70 -0.818 4.994 -2.459 546 HD11 LEU 70 1HD1 LEU 70 0.516 3.673 -1.230 547 HD12 LEU 70 2HD1 LEU 70 1.214 5.070 -0.412 548 HD13 LEU 70 3HD1 LEU 70 1.900 4.507 -1.938 549 HD21 LEU 70 3HD2 LEU 70 0.390 7.423 -1.139 550 HD22 LEU 70 1HD2 LEU 70 -0.641 6.306 -0.244 551 HD23 LEU 70 2HD2 LEU 70 -1.281 7.172 -1.641 552 H ASP 71 H ASP 71 -1.209 6.733 -6.032 553 HA ASP 71 HA ASP 71 0.958 7.497 -7.843 554 HB2 ASP 71 2HB ASP 71 -1.279 5.788 -7.856 555 HB3 ASP 71 1HB ASP 71 -1.675 7.048 -9.025 556 H LYS 72 H LYS 72 -2.457 8.588 -7.306 557 HA LYS 72 HA LYS 72 -2.172 10.951 -8.882 558 HB2 LYS 72 2HB LYS 72 -3.859 10.063 -6.570 559 HB3 LYS 72 1HB LYS 72 -4.122 11.615 -7.360 560 HG2 LYS 72 2HG LYS 72 -4.962 10.644 -9.258 561 HG3 LYS 72 1HG LYS 72 -3.901 9.235 -9.118 562 HD2 LYS 72 2HD LYS 72 -6.079 9.745 -7.134 563 HD3 LYS 72 1HD LYS 72 -6.401 8.873 -8.630 564 HE2 LYS 72 2HE LYS 72 -4.290 8.141 -6.598 565 HE3 LYS 72 1HE LYS 72 -5.853 7.323 -6.773 566 HZ1 LYS 72 3HZ LYS 72 -4.557 6.073 -8.184 567 HZ2 LYS 72 1HZ LYS 72 -3.578 7.381 -8.637 568 HZ3 LYS 72 2HZ LYS 72 -5.149 7.242 -9.265 569 H ALA 73 H ALA 73 -1.459 10.131 -5.572 570 HA ALA 73 HA ALA 73 -0.918 12.714 -4.500 571 HB1 ALA 73 1HB ALA 73 0.630 11.294 -3.018 572 HB2 ALA 73 2HB ALA 73 0.192 9.923 -4.046 573 HB3 ALA 73 3HB ALA 73 -1.049 10.754 -3.100 574 H ARG 74 H ARG 74 0.862 10.491 -6.543 575 HA ARG 74 HA ARG 74 3.264 12.219 -6.587 576 HB2 ARG 74 2HB ARG 74 4.277 10.244 -7.091 577 HB3 ARG 74 1HB ARG 74 2.722 9.476 -6.794 578 HG2 ARG 74 2HG ARG 74 2.131 9.676 -9.158 579 HG3 ARG 74 1HG ARG 74 3.620 10.562 -9.482 580 HD2 ARG 74 2HD ARG 74 4.979 8.645 -9.064 581 HD3 ARG 74 1HD ARG 74 3.635 7.769 -8.305 582 HE ARG 74 HE ARG 74 2.595 7.552 -10.502 583 HH11 ARG 74 1HH2 ARG 74 5.546 6.718 -10.851 584 HH12 ARG 74 2HH2 ARG 74 5.916 7.494 -12.353 585 HH21 ARG 74 1HH1 ARG 74 3.135 9.564 -12.273 586 HH22 ARG 74 2HH1 ARG 74 4.549 9.104 -13.160 587 H ASN 75 H ASN 75 0.353 11.590 -8.343 588 HA ASN 75 HA ASN 75 1.297 12.858 -10.846 589 HB2 ASN 75 2HB ASN 75 -0.378 10.862 -10.456 590 HB3 ASN 75 1HB ASN 75 -1.549 12.149 -10.163 591 HD21 ASN 75 1HD2 ASN 75 0.940 11.208 -12.606 592 HD22 ASN 75 2HD2 ASN 75 0.065 11.798 -13.935 593 H SER 76 H SER 76 0.166 13.861 -7.844 594 HA SER 76 HA SER 76 -0.284 16.053 -7.081 595 HB2 SER 76 2HB SER 76 0.324 17.733 -8.495 596 HB3 SER 76 1HB SER 76 0.869 16.414 -9.528 597 HG SER 76 HG SER 76 -0.537 17.195 -10.882 598 H GLU 77 H GLU 77 -2.399 13.977 -7.789 599 HA GLU 77 HA GLU 77 -4.625 15.860 -8.407 600 HB2 GLU 77 2HB GLU 77 -4.897 12.875 -8.340 601 HB3 GLU 77 1HB GLU 77 -5.784 14.036 -9.312 602 HG2 GLU 77 2HG GLU 77 -2.826 13.502 -9.685 603 HG3 GLU 77 1HG GLU 77 -4.081 12.657 -10.589 604 H ILE 78 H ILE 78 -3.403 13.569 -6.079 605 HA ILE 78 HA ILE 78 -5.323 14.673 -4.071 606 HB ILE 78 HB ILE 78 -5.714 12.308 -3.293 607 HG12 ILE 78 2HG1 ILE 78 -5.205 10.759 -5.466 608 HG13 ILE 78 1HG1 ILE 78 -3.820 11.852 -5.500 609 HG21 ILE 78 1HG2 ILE 78 -7.565 12.916 -4.498 610 HG22 ILE 78 2HG2 ILE 78 -6.944 11.708 -5.623 611 HG23 ILE 78 3HG2 ILE 78 -6.619 13.418 -5.897 612 HD11 ILE 78 3HD1 ILE 78 -4.119 9.593 -3.875 613 HD12 ILE 78 1HD1 ILE 78 -4.375 10.964 -2.796 614 HD13 ILE 78 2HD1 ILE 78 -2.881 10.841 -3.728 615 H LYS 79 H LYS 79 -4.611 13.034 -1.956 616 HA LYS 79 HA LYS 79 -1.784 12.592 -1.687 617 HB2 LYS 79 2HB LYS 79 -1.110 14.545 -0.528 618 HB3 LYS 79 1HB LYS 79 -2.078 15.152 -1.866 619 HG2 LYS 79 2HG LYS 79 -3.641 14.555 0.570 620 HG3 LYS 79 1HG LYS 79 -2.456 15.842 0.763 621 HD2 LYS 79 2HD LYS 79 -4.193 17.084 -0.075 622 HD3 LYS 79 1HD LYS 79 -3.456 16.584 -1.597 623 HE2 LYS 79 2HE LYS 79 -5.158 15.109 -2.094 624 HE3 LYS 79 1HE LYS 79 -5.457 14.726 -0.387 625 HZ1 LYS 79 3HZ LYS 79 -6.717 16.582 -0.084 626 HZ2 LYS 79 1HZ LYS 79 -7.054 16.322 -1.726 627 HZ3 LYS 79 2HZ LYS 79 -5.899 17.481 -1.273 628 H ILE 80 H ILE 80 -1.514 13.121 1.045 629 HA ILE 80 HA ILE 80 -3.480 11.182 2.162 630 HB ILE 80 HB ILE 80 -0.700 12.085 2.850 631 HG12 ILE 80 2HG1 ILE 80 -0.351 9.580 2.529 632 HG13 ILE 80 1HG1 ILE 80 -1.997 9.544 1.903 633 HG21 ILE 80 1HG2 ILE 80 -1.576 9.843 4.418 634 HG22 ILE 80 2HG2 ILE 80 -2.702 11.180 4.651 635 HG23 ILE 80 3HG2 ILE 80 -0.986 11.404 4.986 636 HD11 ILE 80 3HD1 ILE 80 -0.070 11.541 0.782 637 HD12 ILE 80 1HD1 ILE 80 -1.466 10.779 0.020 638 HD13 ILE 80 2HD1 ILE 80 0.025 9.864 0.244 639 H THR 81 H THR 81 -5.067 12.750 2.464 640 HA THR 81 HA THR 81 -4.640 15.128 4.136 641 HB THR 81 HB THR 81 -7.125 15.298 3.794 642 HG1 THR 81 1HG THR 81 -8.184 13.673 2.903 643 HG21 THR 81 3HG2 THR 81 -6.938 15.250 1.206 644 HG22 THR 81 1HG2 THR 81 -5.255 14.803 1.489 645 HG23 THR 81 2HG2 THR 81 -5.874 16.339 2.096 646 H SER 82 H SER 82 -4.315 12.196 5.189 647 HA SER 82 HA SER 82 -4.579 11.252 7.351 648 HB2 SER 82 2HB SER 82 -5.058 13.945 7.675 649 HB3 SER 82 1HB SER 82 -6.565 13.233 8.240 650 HG SER 82 HG SER 82 -4.880 11.725 9.338 651 H ASP 83 H ASP 83 -6.982 11.897 5.081 652 HA ASP 83 HA ASP 83 -8.930 10.058 6.409 653 HB2 ASP 83 2HB ASP 83 -9.218 12.653 5.467 654 HB3 ASP 83 1HB ASP 83 -9.809 11.679 4.121 655 H LEU 84 H LEU 84 -7.559 11.100 3.271 656 HA LEU 84 HA LEU 84 -8.506 8.852 1.755 657 HB2 LEU 84 2HB LEU 84 -6.064 10.638 1.454 658 HB3 LEU 84 1HB LEU 84 -6.729 9.615 0.180 659 HG LEU 84 HG LEU 84 -8.031 12.005 1.500 660 HD11 LEU 84 1HD1 LEU 84 -6.430 12.276 -0.459 661 HD12 LEU 84 2HD1 LEU 84 -8.053 12.916 -0.720 662 HD13 LEU 84 3HD1 LEU 84 -7.592 11.366 -1.427 663 HD21 LEU 84 3HD2 LEU 84 -9.790 10.402 1.360 664 HD22 LEU 84 1HD2 LEU 84 -9.216 9.796 -0.194 665 HD23 LEU 84 2HD2 LEU 84 -9.959 11.393 -0.091 666 H LEU 85 H LEU 85 -5.705 9.474 3.786 667 HA LEU 85 HA LEU 85 -4.408 6.922 3.126 668 HB2 LEU 85 2HB LEU 85 -2.650 7.993 4.091 669 HB3 LEU 85 1HB LEU 85 -3.700 9.402 4.211 670 HG LEU 85 HG LEU 85 -4.518 8.379 6.430 671 HD11 LEU 85 1HD1 LEU 85 -2.140 7.080 7.156 672 HD12 LEU 85 2HD1 LEU 85 -2.555 6.418 5.575 673 HD13 LEU 85 3HD1 LEU 85 -3.713 6.327 6.903 674 HD21 LEU 85 3HD2 LEU 85 -1.631 9.285 6.203 675 HD22 LEU 85 1HD2 LEU 85 -2.622 9.352 7.658 676 HD23 LEU 85 2HD2 LEU 85 -3.032 10.356 6.272 677 H ASP 86 H ASP 86 -6.472 8.240 5.683 678 HA ASP 86 HA ASP 86 -6.299 6.085 7.552 679 HB2 ASP 86 2HB ASP 86 -7.269 8.284 8.042 680 HB3 ASP 86 1HB ASP 86 -8.536 8.016 6.844 681 H LYS 87 H LYS 87 -7.985 6.431 4.507 682 HA LYS 87 HA LYS 87 -9.709 4.075 4.973 683 HB2 LYS 87 2HB LYS 87 -9.166 5.897 2.600 684 HB3 LYS 87 1HB LYS 87 -10.371 4.609 2.597 685 HG2 LYS 87 2HG LYS 87 -10.335 7.131 4.259 686 HG3 LYS 87 1HG LYS 87 -11.590 6.567 3.155 687 HD2 LYS 87 2HD LYS 87 -11.966 4.607 4.679 688 HD3 LYS 87 1HD LYS 87 -10.828 5.333 5.817 689 HE2 LYS 87 2HE LYS 87 -13.361 6.678 4.810 690 HE3 LYS 87 1HE LYS 87 -13.168 5.923 6.404 691 HZ1 LYS 87 3HZ LYS 87 -11.643 8.210 5.289 692 HZ2 LYS 87 1HZ LYS 87 -11.149 7.359 6.671 693 HZ3 LYS 87 2HZ LYS 87 -12.626 8.199 6.675 694 H ILE 88 H ILE 88 -6.974 5.076 2.937 695 HA ILE 88 HA ILE 88 -6.532 2.536 1.688 696 HB ILE 88 HB ILE 88 -4.842 4.958 2.332 697 HG12 ILE 88 2HG1 ILE 88 -5.377 4.081 -0.437 698 HG13 ILE 88 1HG1 ILE 88 -6.786 4.621 0.476 699 HG21 ILE 88 1HG2 ILE 88 -4.002 2.313 1.407 700 HG22 ILE 88 2HG2 ILE 88 -3.044 3.635 2.073 701 HG23 ILE 88 3HG2 ILE 88 -3.479 3.635 0.364 702 HD11 ILE 88 3HD1 ILE 88 -6.135 6.715 -0.099 703 HD12 ILE 88 1HD1 ILE 88 -4.518 6.181 -0.554 704 HD13 ILE 88 2HD1 ILE 88 -4.894 6.518 1.137 705 H PHE 89 H PHE 89 -5.526 3.998 4.737 706 HA PHE 89 HA PHE 89 -3.680 1.902 5.507 707 HB2 PHE 89 2HB PHE 89 -3.465 4.107 6.448 708 HB3 PHE 89 1HB PHE 89 -5.157 4.114 6.944 709 HD1 PHE 89 2HD PHE 89 -1.925 2.306 7.491 710 HD2 PHE 89 1HD PHE 89 -5.779 3.347 9.078 711 HE1 PHE 89 2HE PHE 89 -1.296 1.310 9.676 712 HE2 PHE 89 1HE PHE 89 -5.150 2.351 11.260 713 HZ PHE 89 HZ PHE 89 -2.910 1.332 11.560 714 H ALA 90 H ALA 90 -7.073 2.401 5.668 715 HA ALA 90 HA ALA 90 -7.641 0.341 7.663 716 HB1 ALA 90 1HB ALA 90 -9.970 0.723 6.344 717 HB2 ALA 90 2HB ALA 90 -9.117 2.171 5.811 718 HB3 ALA 90 3HB ALA 90 -9.375 1.884 7.532 719 H GLY 91 H GLY 91 -7.459 0.685 4.162 720 HA2 GLY 91 2HA GLY 91 -8.396 -1.965 3.511 721 HA3 GLY 91 1HA GLY 91 -7.447 -0.916 2.448 722 H VAL 92 H VAL 92 -5.227 -0.465 4.084 723 HA VAL 92 HA VAL 92 -3.613 -2.793 3.638 724 HB VAL 92 HB VAL 92 -3.430 -0.145 5.021 725 HG11 VAL 92 1HG1 VAL 92 -1.426 -2.379 5.477 726 HG12 VAL 92 2HG1 VAL 92 -2.452 -1.643 6.707 727 HG13 VAL 92 3HG1 VAL 92 -1.186 -0.692 5.929 728 HG21 VAL 92 3HG2 VAL 92 -1.086 -0.835 3.590 729 HG22 VAL 92 1HG2 VAL 92 -2.368 0.264 3.080 730 HG23 VAL 92 2HG2 VAL 92 -2.443 -1.443 2.642 731 H ASP 93 H ASP 93 -5.728 -1.745 6.169 732 HA ASP 93 HA ASP 93 -4.709 -3.550 8.242 733 HB2 ASP 93 2HB ASP 93 -6.345 -1.276 8.031 734 HB3 ASP 93 1HB ASP 93 -7.454 -2.569 8.493 735 H MET 94 H MET 94 -6.954 -3.651 5.594 736 HA MET 94 HA MET 94 -8.410 -6.010 6.540 737 HB2 MET 94 2HB MET 94 -8.198 -4.714 3.800 738 HB3 MET 94 1HB MET 94 -9.456 -5.833 4.329 739 HG2 MET 94 2HG MET 94 -9.580 -3.951 6.302 740 HG3 MET 94 1HG MET 94 -9.130 -2.957 4.917 741 HE1 MET 94 3HE MET 94 -9.846 -3.789 2.708 742 HE2 MET 94 1HE MET 94 -11.152 -2.597 2.654 743 HE3 MET 94 2HE MET 94 -11.476 -4.282 2.249 744 H ILE 95 H ILE 95 -6.018 -5.354 3.922 745 HA ILE 95 HA ILE 95 -5.609 -7.995 3.062 746 HB ILE 95 HB ILE 95 -3.443 -7.061 2.334 747 HG12 ILE 95 2HG1 ILE 95 -4.189 -4.676 4.041 748 HG13 ILE 95 1HG1 ILE 95 -2.944 -5.853 4.461 749 HG21 ILE 95 1HG2 ILE 95 -4.544 -5.924 0.739 750 HG22 ILE 95 2HG2 ILE 95 -5.002 -4.666 1.888 751 HG23 ILE 95 3HG2 ILE 95 -5.994 -6.114 1.722 752 HD11 ILE 95 3HD1 ILE 95 -2.966 -3.918 2.142 753 HD12 ILE 95 1HD1 ILE 95 -1.888 -5.313 2.184 754 HD13 ILE 95 2HD1 ILE 95 -1.766 -4.068 3.427 755 H THR 96 H THR 96 -4.286 -6.223 5.839 756 HA THR 96 HA THR 96 -2.387 -8.192 6.703 757 HB THR 96 HB THR 96 -4.078 -6.169 8.227 758 HG1 THR 96 1HG THR 96 -2.859 -4.976 6.949 759 HG21 THR 96 3HG2 THR 96 -3.222 -7.414 9.962 760 HG22 THR 96 1HG2 THR 96 -1.839 -6.357 9.677 761 HG23 THR 96 2HG2 THR 96 -1.852 -7.991 9.013 762 H ARG 97 H ARG 97 -5.826 -7.604 7.368 763 HA ARG 97 HA ARG 97 -6.154 -9.910 9.106 764 HB2 ARG 97 2HB ARG 97 -7.872 -7.901 7.682 765 HB3 ARG 97 1HB ARG 97 -8.644 -9.348 8.334 766 HG2 ARG 97 2HG ARG 97 -8.237 -8.748 10.521 767 HG3 ARG 97 1HG ARG 97 -6.756 -7.878 10.118 768 HD2 ARG 97 2HD ARG 97 -8.103 -6.040 10.481 769 HD3 ARG 97 1HD ARG 97 -8.576 -6.345 8.798 770 HE ARG 97 HE ARG 97 -10.698 -6.892 9.666 771 HH11 ARG 97 1HH1 ARG 97 -9.998 -5.982 12.445 772 HH12 ARG 97 2HH1 ARG 97 -10.281 -7.417 13.371 773 HH21 ARG 97 1HH2 ARG 97 -10.292 -9.515 10.609 774 HH22 ARG 97 2HH2 ARG 97 -10.443 -9.420 12.333 775 H MET 98 H MET 98 -6.488 -9.255 5.648 776 HA MET 98 HA MET 98 -7.748 -11.774 4.944 777 HB2 MET 98 2HB MET 98 -6.067 -9.772 3.388 778 HB3 MET 98 1HB MET 98 -7.023 -11.059 2.655 779 HG2 MET 98 2HG MET 98 -9.067 -10.086 3.340 780 HG3 MET 98 1HG MET 98 -8.270 -9.034 4.509 781 HE1 MET 98 3HE MET 98 -9.551 -8.261 0.418 782 HE2 MET 98 1HE MET 98 -9.756 -9.666 1.473 783 HE3 MET 98 2HE MET 98 -8.398 -9.592 0.354 784 H VAL 99 H VAL 99 -4.468 -10.561 5.280 785 HA VAL 99 HA VAL 99 -3.227 -12.976 4.220 786 HB VAL 99 HB VAL 99 -2.384 -10.399 5.535 787 HG11 VAL 99 1HG1 VAL 99 -0.780 -12.914 5.222 788 HG12 VAL 99 2HG1 VAL 99 -0.728 -11.709 6.507 789 HG13 VAL 99 3HG1 VAL 99 0.018 -11.366 4.946 790 HG21 VAL 99 3HG2 VAL 99 -1.038 -11.228 3.091 791 HG22 VAL 99 1HG2 VAL 99 -1.991 -9.776 3.401 792 HG23 VAL 99 2HG2 VAL 99 -2.791 -11.267 2.900 793 H ASP 100 H ASP 100 -3.995 -11.609 7.413 794 HA ASP 100 HA ASP 100 -2.534 -13.528 8.993 795 HB2 ASP 100 2HB ASP 100 -4.862 -11.650 9.354 796 HB3 ASP 100 1HB ASP 100 -4.488 -12.804 10.635 797 H LYS 101 H LYS 101 -5.696 -13.456 7.471 798 HA LYS 101 HA LYS 101 -6.575 -15.990 8.622 799 HB2 LYS 101 2HB LYS 101 -8.568 -15.376 7.653 800 HB3 LYS 101 1HB LYS 101 -7.781 -13.804 7.514 801 HG2 LYS 101 2HG LYS 101 -8.516 -14.187 5.321 802 HG3 LYS 101 1HG LYS 101 -6.850 -14.767 5.274 803 HD2 LYS 101 2HD LYS 101 -7.757 -16.649 4.441 804 HD3 LYS 101 1HD LYS 101 -8.125 -16.999 6.123 805 HE2 LYS 101 2HE LYS 101 -10.342 -15.811 5.801 806 HE3 LYS 101 1HE LYS 101 -9.979 -15.760 4.064 807 HZ1 LYS 101 3HZ LYS 101 -9.383 -18.274 4.557 808 HZ2 LYS 101 1HZ LYS 101 -10.958 -17.794 4.150 809 HZ3 LYS 101 2HZ LYS 101 -10.548 -18.059 5.777 810 H ILE 102 H ILE 102 -4.592 -14.915 6.015 811 HA ILE 102 HA ILE 102 -4.868 -17.246 4.290 812 HB ILE 102 HB ILE 102 -3.535 -14.688 4.408 813 HG12 ILE 102 2HG1 ILE 102 -3.495 -16.318 1.934 814 HG13 ILE 102 1HG1 ILE 102 -5.077 -16.031 2.655 815 HG21 ILE 102 1HG2 ILE 102 -1.526 -15.439 3.011 816 HG22 ILE 102 2HG2 ILE 102 -1.824 -17.053 3.658 817 HG23 ILE 102 3HG2 ILE 102 -1.428 -15.725 4.749 818 HD11 ILE 102 3HD1 ILE 102 -3.070 -13.838 2.057 819 HD12 ILE 102 1HD1 ILE 102 -4.739 -13.629 2.589 820 HD13 ILE 102 2HD1 ILE 102 -4.399 -14.276 0.982 821 H VAL 103 H VAL 103 -2.446 -16.089 6.640 822 HA VAL 103 HA VAL 103 -0.796 -18.430 6.649 823 HB VAL 103 HB VAL 103 -1.421 -16.140 8.518 824 HG11 VAL 103 1HG1 VAL 103 -0.956 -17.746 10.157 825 HG12 VAL 103 2HG1 VAL 103 0.645 -17.085 9.826 826 HG13 VAL 103 3HG1 VAL 103 0.164 -18.627 9.118 827 HG21 VAL 103 3HG2 VAL 103 1.049 -15.718 8.093 828 HG22 VAL 103 1HG2 VAL 103 0.020 -15.601 6.666 829 HG23 VAL 103 2HG2 VAL 103 0.999 -17.043 6.930 830 H SER 104 H SER 104 -3.812 -17.529 8.172 831 HA SER 104 HA SER 104 -3.912 -19.818 9.985 832 HB2 SER 104 2HB SER 104 -4.908 -17.488 10.300 833 HB3 SER 104 1HB SER 104 -6.125 -17.962 9.117 834 HG SER 104 HG SER 104 -5.704 -18.835 11.732 835 H GLU 105 H GLU 105 -5.850 -18.781 7.224 836 HA GLU 105 HA GLU 105 -6.651 -21.639 6.771 837 HB2 GLU 105 2HB GLU 105 -7.920 -19.182 5.560 838 HB3 GLU 105 1HB GLU 105 -8.652 -20.758 5.856 839 HG2 GLU 105 2HG GLU 105 -7.824 -19.939 8.382 840 HG3 GLU 105 1HG GLU 105 -8.425 -18.456 7.639 841 H GLY 106 H GLY 106 -5.477 -18.709 5.145 842 HA2 GLY 106 2HA GLY 106 -3.737 -18.927 3.405 843 HA3 GLY 106 1HA GLY 106 -4.497 -20.444 2.917 844 H SER 107 H SER 107 -6.534 -17.737 3.705 845 HA SER 107 HA SER 107 -7.046 -17.295 0.775 846 HB2 SER 107 2HB SER 107 -9.171 -17.082 2.870 847 HB3 SER 107 1HB SER 107 -9.323 -17.482 1.162 848 HG SER 107 HG SER 107 -8.072 -19.433 1.757 849 H ASP 108 H ASP 108 -6.755 -15.240 0.185 850 HA ASP 108 HA ASP 108 -6.477 -13.097 2.179 851 HB2 ASP 108 2HB ASP 108 -5.545 -13.688 -0.407 852 HB3 ASP 108 1HB ASP 108 -6.607 -12.294 -0.616 853 H ASP 109 H ASP 109 -9.094 -14.616 0.897 854 HA ASP 109 HA ASP 109 -10.698 -12.176 0.338 855 HB2 ASP 109 2HB ASP 109 -11.048 -15.159 0.084 856 HB3 ASP 109 1HB ASP 109 -12.425 -14.071 -0.098 857 H ILE 110 H ILE 110 -11.480 -11.162 2.144 858 HA ILE 110 HA ILE 110 -12.591 -12.865 4.352 859 HB ILE 110 HB ILE 110 -11.974 -10.996 5.823 860 HG12 ILE 110 2HG1 ILE 110 -10.865 -9.702 3.317 861 HG13 ILE 110 1HG1 ILE 110 -12.363 -9.223 4.111 862 HG21 ILE 110 1HG2 ILE 110 -9.457 -11.032 5.420 863 HG22 ILE 110 2HG2 ILE 110 -9.789 -11.972 3.966 864 HG23 ILE 110 3HG2 ILE 110 -10.222 -12.616 5.551 865 HD11 ILE 110 3HD1 ILE 110 -10.143 -7.956 4.701 866 HD12 ILE 110 1HD1 ILE 110 -9.823 -9.369 5.708 867 HD13 ILE 110 2HD1 ILE 110 -11.261 -8.391 5.994 868 H GLY 111 H GLY 111 -14.037 -12.001 1.947 869 HA2 GLY 111 2HA GLY 111 -16.261 -11.245 1.602 870 HA3 GLY 111 1HA GLY 111 -16.282 -10.649 3.264 871 H GLU 112 H GLU 112 -13.467 -9.510 2.121 872 HA GLU 112 HA GLU 112 -13.936 -6.813 2.151 873 HB2 GLU 112 2HB GLU 112 -12.062 -8.679 0.867 874 HB3 GLU 112 1HB GLU 112 -12.140 -7.103 0.080 875 HG2 GLU 112 2HG GLU 112 -12.101 -6.414 2.743 876 HG3 GLU 112 1HG GLU 112 -11.051 -7.832 2.714 877 H ASN 113 H ASN 113 -13.998 -5.252 0.284 878 HA ASN 113 HA ASN 113 -15.663 -6.190 -2.019 879 HB2 ASN 113 2HB ASN 113 -16.684 -4.891 0.130 880 HB3 ASN 113 1HB ASN 113 -16.170 -3.509 -0.839 881 HD21 ASN 113 1HD2 ASN 113 -18.857 -3.617 -0.609 882 HD22 ASN 113 2HD2 ASN 113 -19.596 -4.256 -1.998 883 H ILE 114 H ILE 114 -13.340 -6.079 -2.902 884 HA ILE 114 HA ILE 114 -11.789 -3.766 -3.089 885 HB ILE 114 HB ILE 114 -12.291 -5.757 -5.313 886 HG12 ILE 114 2HG1 ILE 114 -11.937 -7.181 -3.485 887 HG13 ILE 114 1HG1 ILE 114 -10.292 -6.922 -4.062 888 HG21 ILE 114 1HG2 ILE 114 -10.003 -5.313 -5.915 889 HG22 ILE 114 2HG2 ILE 114 -9.745 -4.366 -4.450 890 HG23 ILE 114 3HG2 ILE 114 -10.803 -3.751 -5.721 891 HD11 ILE 114 3HD1 ILE 114 -11.657 -5.528 -1.739 892 HD12 ILE 114 1HD1 ILE 114 -10.098 -5.029 -2.398 893 HD13 ILE 114 2HD1 ILE 114 -10.274 -6.622 -1.664 894 H ASP 115 H ASP 115 -13.873 -4.784 -5.826 895 HA ASP 115 HA ASP 115 -13.851 -2.485 -7.326 896 HB2 ASP 115 2HB ASP 115 -15.473 -4.784 -7.015 897 HB3 ASP 115 1HB ASP 115 -16.572 -3.404 -7.080 898 H VAL 116 H VAL 116 -15.406 -2.974 -4.291 899 HA VAL 116 HA VAL 116 -16.795 -0.383 -4.345 900 HB VAL 116 HB VAL 116 -16.600 -2.731 -2.469 901 HG11 VAL 116 1HG1 VAL 116 -16.756 -0.557 -1.199 902 HG12 VAL 116 2HG1 VAL 116 -18.147 -1.617 -0.968 903 HG13 VAL 116 3HG1 VAL 116 -18.266 -0.229 -2.049 904 HG21 VAL 116 3HG2 VAL 116 -19.253 -1.884 -3.260 905 HG22 VAL 116 1HG2 VAL 116 -18.451 -3.426 -3.557 906 HG23 VAL 116 2HG2 VAL 116 -18.236 -2.089 -4.687 907 H PHE 117 H PHE 117 -14.429 -1.991 -2.293 908 HA PHE 117 HA PHE 117 -13.796 0.246 -0.635 909 HB2 PHE 117 2HB PHE 117 -12.943 -2.443 -1.112 910 HB3 PHE 117 1HB PHE 117 -11.507 -1.422 -1.040 911 HD1 PHE 117 2HD PHE 117 -11.336 0.251 0.925 912 HD2 PHE 117 1HD PHE 117 -14.047 -3.080 0.872 913 HE1 PHE 117 2HE PHE 117 -11.544 0.382 3.392 914 HE2 PHE 117 1HE PHE 117 -14.256 -2.948 3.340 915 HZ PHE 117 HZ PHE 117 -13.005 -1.216 4.599 916 H SER 118 H SER 118 -12.898 -0.487 -3.911 917 HA SER 118 HA SER 118 -10.654 1.398 -3.922 918 HB2 SER 118 2HB SER 118 -10.131 -0.307 -5.373 919 HB3 SER 118 1HB SER 118 -11.824 -0.729 -5.609 920 HG SER 118 HG SER 118 -10.249 0.657 -7.211 921 H ASP 119 H ASP 119 -13.893 0.986 -5.136 922 HA ASP 119 HA ASP 119 -14.019 3.533 -6.529 923 HB2 ASP 119 2HB ASP 119 -15.401 1.506 -7.039 924 HB3 ASP 119 1HB ASP 119 -16.211 1.715 -5.485 925 H THR 120 H THR 120 -14.824 2.308 -3.394 926 HA THR 120 HA THR 120 -16.223 4.552 -2.331 927 HB THR 120 HB THR 120 -14.670 2.197 -1.342 928 HG1 THR 120 1HG THR 120 -17.210 3.188 -0.591 929 HG21 THR 120 3HG2 THR 120 -15.493 4.537 0.387 930 HG22 THR 120 1HG2 THR 120 -13.870 3.880 0.176 931 HG23 THR 120 2HG2 THR 120 -15.099 2.938 1.021 932 H ILE 121 H ILE 121 -12.873 3.634 -2.478 933 HA ILE 121 HA ILE 121 -11.852 6.044 -1.202 934 HB ILE 121 HB ILE 121 -11.003 3.432 -2.103 935 HG12 ILE 121 2HG1 ILE 121 -10.852 4.337 0.191 936 HG13 ILE 121 1HG1 ILE 121 -9.289 3.766 -0.392 937 HG21 ILE 121 1HG2 ILE 121 -9.756 4.258 -3.893 938 HG22 ILE 121 2HG2 ILE 121 -8.577 4.274 -2.581 939 HG23 ILE 121 3HG2 ILE 121 -9.379 5.769 -3.065 940 HD11 ILE 121 3HD1 ILE 121 -8.427 5.804 0.009 941 HD12 ILE 121 1HD1 ILE 121 -10.013 6.407 0.489 942 HD13 ILE 121 2HD1 ILE 121 -9.519 6.475 -1.202 943 H LYS 122 H LYS 122 -12.001 4.766 -4.546 944 HA LYS 122 HA LYS 122 -10.735 6.981 -5.829 945 HB2 LYS 122 2HB LYS 122 -12.282 4.560 -6.461 946 HB3 LYS 122 1HB LYS 122 -12.552 5.870 -7.612 947 HG2 LYS 122 2HG LYS 122 -10.564 5.428 -8.564 948 HG3 LYS 122 1HG LYS 122 -9.781 5.844 -7.040 949 HD2 LYS 122 2HD LYS 122 -10.952 3.196 -6.901 950 HD3 LYS 122 1HD LYS 122 -9.827 3.318 -8.253 951 HE2 LYS 122 2HE LYS 122 -8.654 4.669 -6.002 952 HE3 LYS 122 1HE LYS 122 -9.175 3.049 -5.489 953 HZ1 LYS 122 3HZ LYS 122 -7.279 3.811 -7.590 954 HZ2 LYS 122 1HZ LYS 122 -8.216 2.419 -7.833 955 HZ3 LYS 122 2HZ LYS 122 -7.198 2.531 -6.476 956 H SER 123 H SER 123 -14.029 6.331 -4.796 957 HA SER 123 HA SER 123 -15.079 8.749 -6.088 958 HB2 SER 123 2HB SER 123 -16.203 6.449 -5.668 959 HB3 SER 123 1HB SER 123 -16.415 7.031 -4.020 960 HG SER 123 HG SER 123 -17.354 8.223 -6.423 961 H PHE 124 H PHE 124 -13.441 7.947 -3.261 962 HA PHE 124 HA PHE 124 -14.699 9.814 -1.423 963 HB2 PHE 124 2HB PHE 124 -13.085 7.720 -1.109 964 HB3 PHE 124 1HB PHE 124 -11.835 8.956 -1.223 965 HD1 PHE 124 1HD PHE 124 -11.721 10.797 0.420 966 HD2 PHE 124 2HD PHE 124 -14.597 7.626 0.782 967 HE1 PHE 124 1HE PHE 124 -12.158 11.463 2.769 968 HE2 PHE 124 2HE PHE 124 -15.034 8.291 3.132 969 HZ PHE 124 HZ PHE 124 -13.815 10.209 4.125 970 H ALA 125 H ALA 125 -12.910 10.249 -4.189 971 HA ALA 125 HA ALA 125 -12.605 13.087 -3.803 972 HB1 ALA 125 1HB ALA 125 -10.476 11.267 -2.892 973 HB2 ALA 125 2HB ALA 125 -10.772 12.950 -2.460 974 HB3 ALA 125 3HB ALA 125 -9.905 12.561 -3.946 975 H SER 126 H SER 126 -13.582 11.393 -5.885 976 HA SER 126 HA SER 126 -11.753 10.902 -8.011 977 HB2 SER 126 2HB SER 126 -13.833 10.928 -9.365 978 HB3 SER 126 1HB SER 126 -14.066 10.061 -7.850 979 HG SER 126 HG SER 126 -15.218 12.366 -8.759 980 H SER 127 H SER 127 -12.012 12.232 -10.182 981 HA SER 127 HA SER 127 -11.494 15.097 -9.507 982 HB2 SER 127 2HB SER 127 -10.227 13.107 -11.092 983 HB3 SER 127 1HB SER 127 -10.841 14.327 -12.204 984 HG SER 127 HG SER 127 -9.791 15.898 -10.898 985 H GLY 128 H GLY 128 -14.047 15.104 -9.429 986 HA2 GLY 128 2HA GLY 128 -15.012 15.757 -12.182 987 HA3 GLY 128 1HA GLY 128 -16.035 14.890 -11.036 988 H LYS 129 H LYS 129 -14.202 17.044 -9.285 989 HA LYS 129 HA LYS 129 -16.148 19.287 -9.631 990 HB2 LYS 129 2HB LYS 129 -16.885 17.693 -7.852 991 HB3 LYS 129 1HB LYS 129 -15.359 17.970 -7.012 992 HG2 LYS 129 2HG LYS 129 -16.431 19.663 -5.959 993 HG3 LYS 129 1HG LYS 129 -16.272 20.541 -7.480 994 HD2 LYS 129 2HD LYS 129 -18.461 20.038 -8.149 995 HD3 LYS 129 1HD LYS 129 -18.576 18.652 -7.063 996 HE2 LYS 129 2HE LYS 129 -18.161 20.643 -5.250 997 HE3 LYS 129 1HE LYS 129 -19.061 21.523 -6.501 998 HZ1 LYS 129 3HZ LYS 129 -19.863 19.119 -4.993 999 HZ2 LYS 129 1HZ LYS 129 -20.511 19.405 -6.533 1000 HZ3 LYS 129 2HZ LYS 129 -20.748 20.539 -5.289 1001 H GLU 130 H GLU 130 -13.249 18.944 -10.319 1002 HA GLU 130 HA GLU 130 -11.551 20.239 -8.422 1003 HB2 GLU 130 2HB GLU 130 -10.167 20.657 -10.476 1004 HB3 GLU 130 1HB GLU 130 -10.746 18.995 -10.364 1005 HG2 GLU 130 2HG GLU 130 -12.811 20.140 -11.712 1006 HG3 GLU 130 1HG GLU 130 -11.465 21.117 -12.300 1007 H LYS 131 H LYS 131 -10.694 22.496 -8.631 1008 HA LYS 131 HA LYS 131 -12.847 24.441 -8.785 1009 HB2 LYS 131 2HB LYS 131 -10.024 24.244 -7.995 1010 HB3 LYS 131 1HB LYS 131 -10.440 25.813 -8.687 1011 HG2 LYS 131 2HG LYS 131 -12.566 25.530 -7.091 1012 HG3 LYS 131 1HG LYS 131 -11.440 24.515 -6.189 1013 HD2 LYS 131 2HD LYS 131 -9.788 26.419 -6.264 1014 HD3 LYS 131 1HD LYS 131 -11.061 27.419 -6.963 1015 HE2 LYS 131 2HE LYS 131 -11.275 27.893 -4.666 1016 HE3 LYS 131 1HE LYS 131 -12.455 26.583 -4.873 1017 HZ1 LYS 131 3HZ LYS 131 -10.505 25.041 -4.444 1018 HZ2 LYS 131 1HZ LYS 131 -11.108 25.886 -3.104 1019 HZ3 LYS 131 2HZ LYS 131 -9.678 26.405 -3.861 1020 H LEU 132 H LEU 132 -13.077 23.518 -11.252 1021 HA LEU 132 HA LEU 132 -11.271 24.664 -13.199 1022 HB2 LEU 132 2HB LEU 132 -12.560 23.460 -14.678 1023 HB3 LEU 132 1HB LEU 132 -13.073 22.672 -13.194 1024 HG LEU 132 HG LEU 132 -15.079 23.162 -14.360 1025 HD11 LEU 132 1HD1 LEU 132 -15.313 25.639 -12.843 1026 HD12 LEU 132 2HD1 LEU 132 -14.570 24.354 -11.897 1027 HD13 LEU 132 3HD1 LEU 132 -16.156 24.107 -12.624 1028 HD21 LEU 132 3HD2 LEU 132 -15.209 24.785 -15.908 1029 HD22 LEU 132 1HD2 LEU 132 -13.553 25.239 -15.501 1030 HD23 LEU 132 2HD2 LEU 132 -14.908 26.027 -14.693 1031 H GLU 133 H GLU 133 -13.533 26.093 -11.219 1032 HA GLU 133 HA GLU 133 -14.808 28.008 -12.920 1033 HB2 GLU 133 2HB GLU 133 -14.753 27.283 -10.230 1034 HB3 GLU 133 1HB GLU 133 -14.124 28.932 -10.228 1035 HG2 GLU 133 2HG GLU 133 -16.075 29.789 -11.292 1036 HG3 GLU 133 1HG GLU 133 -16.634 28.174 -11.731 Start of MODEL 6 1 H1 MET 1 1HT MET 1 3.004 -31.341 -3.527 2 H2 MET 1 2HT MET 1 3.739 -30.445 -2.285 3 H3 MET 1 3HT MET 1 4.440 -31.898 -2.818 4 HA MET 1 HA MET 1 5.337 -30.967 -4.686 5 HB2 MET 1 2HB MET 1 2.702 -29.663 -4.561 6 HB3 MET 1 1HB MET 1 3.954 -28.652 -5.281 7 HG2 MET 1 2HG MET 1 4.067 -31.428 -6.209 8 HG3 MET 1 1HG MET 1 2.538 -30.640 -6.597 9 HE1 MET 1 2HE MET 1 5.639 -31.147 -8.977 10 HE2 MET 1 3HE MET 1 4.113 -30.736 -9.758 11 HE3 MET 1 1HE MET 1 4.136 -31.845 -8.380 12 H MET 2 H MET 2 4.009 -27.954 -3.384 13 HA MET 2 HA MET 2 6.583 -27.390 -1.991 14 HB2 MET 2 2HB MET 2 6.507 -25.128 -3.205 15 HB3 MET 2 1HB MET 2 6.940 -26.526 -4.192 16 HG2 MET 2 2HG MET 2 5.100 -26.302 -5.472 17 HG3 MET 2 1HG MET 2 4.057 -26.147 -4.060 18 HE1 MET 2 3HE MET 2 5.765 -24.504 -6.978 19 HE2 MET 2 1HE MET 2 7.018 -24.247 -5.754 20 HE3 MET 2 2HE MET 2 6.168 -22.871 -6.454 21 H GLU 3 H GLU 3 6.370 -25.480 -0.534 22 HA GLU 3 HA GLU 3 3.742 -24.320 -0.061 23 HB2 GLU 3 2HB GLU 3 3.497 -25.405 2.178 24 HB3 GLU 3 1HB GLU 3 3.414 -26.560 0.847 25 HG2 GLU 3 2HG GLU 3 5.767 -27.151 1.174 26 HG3 GLU 3 1HG GLU 3 5.913 -25.941 2.449 27 H GLU 4 H GLU 4 6.931 -25.003 1.162 28 HA GLU 4 HA GLU 4 7.031 -22.931 3.129 29 HB2 GLU 4 2HB GLU 4 8.518 -24.856 3.137 30 HB3 GLU 4 1HB GLU 4 9.165 -24.400 1.561 31 HG2 GLU 4 2HG GLU 4 9.997 -22.268 2.562 32 HG3 GLU 4 1HG GLU 4 9.442 -22.830 4.140 33 H TYR 5 H TYR 5 7.104 -22.800 -0.251 34 HA TYR 5 HA TYR 5 8.789 -20.451 -0.547 35 HB2 TYR 5 2HB TYR 5 7.390 -22.360 -2.174 36 HB3 TYR 5 1HB TYR 5 6.964 -20.733 -2.711 37 HD1 TYR 5 2HD TYR 5 10.155 -21.709 -1.085 38 HD2 TYR 5 1HD TYR 5 8.209 -20.646 -4.765 39 HE1 TYR 5 2HE TYR 5 12.363 -21.490 -2.189 40 HE2 TYR 5 1HE TYR 5 10.420 -20.427 -5.869 41 HH TYR 5 HH TYR 5 13.375 -21.416 -4.268 42 H LEU 6 H LEU 6 5.554 -21.044 0.343 43 HA LEU 6 HA LEU 6 4.622 -18.295 -0.257 44 HB2 LEU 6 2HB LEU 6 3.265 -20.573 1.220 45 HB3 LEU 6 1HB LEU 6 2.486 -19.176 0.477 46 HG LEU 6 HG LEU 6 4.066 -20.357 -1.541 47 HD11 LEU 6 1HD1 LEU 6 4.244 -22.450 -0.472 48 HD12 LEU 6 2HD1 LEU 6 2.848 -22.645 -1.532 49 HD13 LEU 6 3HD1 LEU 6 2.612 -22.351 0.190 50 HD21 LEU 6 3HD2 LEU 6 2.129 -19.472 -2.377 51 HD22 LEU 6 1HD2 LEU 6 1.209 -19.862 -0.923 52 HD23 LEU 6 2HD2 LEU 6 1.512 -21.107 -2.136 53 H GLY 7 H GLY 7 5.121 -20.417 2.568 54 HA2 GLY 7 2HA GLY 7 4.449 -18.700 4.650 55 HA3 GLY 7 1HA GLY 7 5.789 -19.846 4.758 56 H VAL 8 H VAL 8 7.479 -18.755 2.776 57 HA VAL 8 HA VAL 8 8.616 -16.509 4.255 58 HB VAL 8 HB VAL 8 9.324 -18.024 1.737 59 HG11 VAL 8 1HG1 VAL 8 10.655 -15.644 3.031 60 HG12 VAL 8 2HG1 VAL 8 10.262 -15.893 1.330 61 HG13 VAL 8 3HG1 VAL 8 11.580 -16.800 2.073 62 HG21 VAL 8 3HG2 VAL 8 10.051 -18.143 4.622 63 HG22 VAL 8 1HG2 VAL 8 11.365 -18.400 3.474 64 HG23 VAL 8 2HG2 VAL 8 9.942 -19.442 3.435 65 H PHE 9 H PHE 9 6.918 -16.999 1.254 66 HA PHE 9 HA PHE 9 7.273 -14.373 0.137 67 HB2 PHE 9 2HB PHE 9 5.866 -16.821 -0.386 68 HB3 PHE 9 1HB PHE 9 4.733 -15.482 -0.561 69 HD1 PHE 9 2HD PHE 9 6.336 -13.285 -1.544 70 HD2 PHE 9 1HD PHE 9 6.581 -17.462 -2.521 71 HE1 PHE 9 2HE PHE 9 7.345 -12.714 -3.736 72 HE2 PHE 9 1HE PHE 9 7.590 -16.890 -4.712 73 HZ PHE 9 HZ PHE 9 7.973 -14.516 -5.320 74 H VAL 10 H VAL 10 4.857 -15.782 2.330 75 HA VAL 10 HA VAL 10 3.212 -13.386 2.472 76 HB VAL 10 HB VAL 10 3.422 -15.656 4.468 77 HG11 VAL 10 1HG1 VAL 10 0.836 -14.527 3.542 78 HG12 VAL 10 2HG1 VAL 10 1.848 -13.450 4.504 79 HG13 VAL 10 3HG1 VAL 10 1.339 -15.006 5.163 80 HG21 VAL 10 3HG2 VAL 10 2.887 -17.109 2.830 81 HG22 VAL 10 1HG2 VAL 10 2.867 -15.807 1.642 82 HG23 VAL 10 2HG2 VAL 10 1.405 -16.196 2.547 83 H ASP 11 H ASP 11 5.910 -14.737 4.357 84 HA ASP 11 HA ASP 11 5.719 -12.836 6.528 85 HB2 ASP 11 2HB ASP 11 6.889 -15.129 6.406 86 HB3 ASP 11 1HB ASP 11 8.188 -14.286 5.562 87 H GLU 12 H GLU 12 6.940 -12.742 3.345 88 HA GLU 12 HA GLU 12 8.701 -10.413 3.795 89 HB2 GLU 12 2HB GLU 12 7.858 -12.134 1.457 90 HB3 GLU 12 1HB GLU 12 8.794 -10.660 1.209 91 HG2 GLU 12 2HG GLU 12 10.470 -11.554 2.881 92 HG3 GLU 12 1HG GLU 12 9.590 -13.083 2.843 93 H THR 13 H THR 13 5.527 -11.185 2.424 94 HA THR 13 HA THR 13 4.960 -8.625 1.266 95 HB THR 13 HB THR 13 2.656 -9.478 1.294 96 HG1 THR 13 1HG THR 13 3.749 -11.370 3.098 97 HG21 THR 13 3HG2 THR 13 4.962 -11.005 0.404 98 HG22 THR 13 1HG2 THR 13 3.423 -10.727 -0.413 99 HG23 THR 13 2HG2 THR 13 3.584 -12.055 0.737 100 H LYS 14 H LYS 14 4.478 -9.960 4.526 101 HA LYS 14 HA LYS 14 3.006 -7.681 5.548 102 HB2 LYS 14 2HB LYS 14 4.570 -9.977 6.761 103 HB3 LYS 14 1HB LYS 14 3.699 -8.800 7.745 104 HG2 LYS 14 2HG LYS 14 1.625 -9.538 7.045 105 HG3 LYS 14 1HG LYS 14 2.233 -10.095 5.486 106 HD2 LYS 14 2HD LYS 14 1.823 -12.102 6.648 107 HD3 LYS 14 1HD LYS 14 3.556 -11.847 6.868 108 HE2 LYS 14 2HE LYS 14 2.272 -12.454 8.995 109 HE3 LYS 14 1HE LYS 14 3.213 -10.954 9.096 110 HZ1 LYS 14 3HZ LYS 14 1.368 -9.668 8.998 111 HZ2 LYS 14 1HZ LYS 14 0.638 -11.037 9.682 112 HZ3 LYS 14 2HZ LYS 14 0.513 -10.756 8.011 113 H GLU 15 H GLU 15 6.416 -8.737 5.738 114 HA GLU 15 HA GLU 15 7.394 -6.562 7.269 115 HB2 GLU 15 2HB GLU 15 8.606 -8.352 5.150 116 HB3 GLU 15 1HB GLU 15 9.570 -7.208 6.086 117 HG2 GLU 15 2HG GLU 15 7.866 -8.749 7.846 118 HG3 GLU 15 1HG GLU 15 8.839 -9.823 6.843 119 H TYR 16 H TYR 16 6.242 -6.740 4.080 120 HA TYR 16 HA TYR 16 7.608 -4.300 3.158 121 HB2 TYR 16 2HB TYR 16 5.741 -6.374 2.017 122 HB3 TYR 16 1HB TYR 16 5.988 -4.853 1.159 123 HD1 TYR 16 2HD TYR 16 8.676 -6.252 3.226 124 HD2 TYR 16 1HD TYR 16 7.054 -6.013 -0.745 125 HE1 TYR 16 2HE TYR 16 10.808 -7.118 2.302 126 HE2 TYR 16 1HE TYR 16 9.188 -6.879 -1.668 127 HH TYR 16 HH TYR 16 11.800 -7.969 0.454 128 H LEU 17 H LEU 17 4.644 -5.305 4.648 129 HA LEU 17 HA LEU 17 3.114 -2.890 3.931 130 HB2 LEU 17 2HB LEU 17 2.757 -5.199 5.878 131 HB3 LEU 17 1HB LEU 17 1.571 -3.904 5.698 132 HG LEU 17 HG LEU 17 2.489 -5.848 3.567 133 HD11 LEU 17 1HD1 LEU 17 0.635 -6.316 5.413 134 HD12 LEU 17 2HD1 LEU 17 0.387 -6.811 3.739 135 HD13 LEU 17 3HD1 LEU 17 -0.356 -5.329 4.339 136 HD21 LEU 17 3HD2 LEU 17 2.234 -3.862 2.349 137 HD22 LEU 17 1HD2 LEU 17 0.967 -3.256 3.417 138 HD23 LEU 17 2HD2 LEU 17 0.612 -4.550 2.271 139 H GLN 18 H GLN 18 5.057 -4.207 6.509 140 HA GLN 18 HA GLN 18 4.693 -2.106 8.456 141 HB2 GLN 18 2HB GLN 18 7.166 -3.767 8.041 142 HB3 GLN 18 1HB GLN 18 6.462 -3.239 9.569 143 HG2 GLN 18 2HG GLN 18 4.462 -4.740 8.336 144 HG3 GLN 18 1HG GLN 18 5.951 -5.626 8.016 145 HE21 GLN 18 1HE2 GLN 18 6.429 -7.106 9.644 146 HE22 GLN 18 2HE2 GLN 18 6.042 -6.914 11.286 147 H ASN 19 H ASN 19 7.060 -2.927 6.053 148 HA ASN 19 HA ASN 19 8.696 -0.605 6.315 149 HB2 ASN 19 2HB ASN 19 9.639 -2.487 5.220 150 HB3 ASN 19 1HB ASN 19 8.201 -2.719 4.221 151 HD21 ASN 19 1HD2 ASN 19 11.160 -0.790 4.580 152 HD22 ASN 19 2HD2 ASN 19 11.094 -0.082 3.038 153 H LEU 20 H LEU 20 5.749 -1.328 4.754 154 HA LEU 20 HA LEU 20 5.694 1.168 3.179 155 HB2 LEU 20 2HB LEU 20 4.768 -0.702 2.055 156 HB3 LEU 20 1HB LEU 20 3.977 -1.287 3.518 157 HG LEU 20 HG LEU 20 2.509 0.758 3.455 158 HD11 LEU 20 1HD1 LEU 20 4.248 1.932 1.898 159 HD12 LEU 20 2HD1 LEU 20 2.531 2.227 1.628 160 HD13 LEU 20 3HD1 LEU 20 3.403 1.090 0.601 161 HD21 LEU 20 3HD2 LEU 20 1.511 -1.229 2.638 162 HD22 LEU 20 1HD2 LEU 20 2.526 -1.246 1.195 163 HD23 LEU 20 2HD2 LEU 20 1.238 -0.051 1.355 164 H ASN 21 H ASN 21 5.069 0.174 6.315 165 HA ASN 21 HA ASN 21 2.840 2.056 6.771 166 HB2 ASN 21 2HB ASN 21 4.091 -0.277 8.096 167 HB3 ASN 21 1HB ASN 21 3.607 1.021 9.194 168 HD21 ASN 21 1HD2 ASN 21 2.139 -0.385 6.202 169 HD22 ASN 21 2HD2 ASN 21 0.605 -0.617 6.892 170 H ASP 22 H ASP 22 6.195 1.477 7.195 171 HA ASP 22 HA ASP 22 6.704 3.667 8.941 172 HB2 ASP 22 2HB ASP 22 8.333 1.861 7.191 173 HB3 ASP 22 1HB ASP 22 9.105 3.216 8.013 174 H THR 23 H THR 23 6.573 3.085 5.609 175 HA THR 23 HA THR 23 7.530 5.690 4.677 176 HB THR 23 HB THR 23 5.892 3.463 3.483 177 HG1 THR 23 1HG THR 23 8.013 2.885 2.612 178 HG21 THR 23 3HG2 THR 23 5.943 5.736 2.295 179 HG22 THR 23 1HG2 THR 23 6.427 4.340 1.333 180 HG23 THR 23 2HG2 THR 23 7.652 5.421 1.998 181 H LEU 24 H LEU 24 4.467 4.036 5.275 182 HA LEU 24 HA LEU 24 2.814 6.223 4.237 183 HB2 LEU 24 2HB LEU 24 2.428 3.550 5.567 184 HB3 LEU 24 1HB LEU 24 1.066 4.660 5.452 185 HG LEU 24 HG LEU 24 2.705 3.550 3.158 186 HD11 LEU 24 1HD1 LEU 24 0.723 2.295 4.403 187 HD12 LEU 24 2HD1 LEU 24 0.847 2.257 2.645 188 HD13 LEU 24 3HD1 LEU 24 -0.274 3.372 3.425 189 HD21 LEU 24 3HD2 LEU 24 0.907 5.907 3.384 190 HD22 LEU 24 1HD2 LEU 24 0.643 4.864 1.986 191 HD23 LEU 24 2HD2 LEU 24 2.224 5.601 2.250 192 H LEU 25 H LEU 25 4.086 5.122 7.345 193 HA LEU 25 HA LEU 25 2.294 6.987 8.769 194 HB2 LEU 25 2HB LEU 25 3.158 6.032 10.719 195 HB3 LEU 25 1HB LEU 25 3.239 4.722 9.550 196 HG LEU 25 HG LEU 25 5.577 5.654 9.031 197 HD11 LEU 25 1HD1 LEU 25 6.387 6.443 11.512 198 HD12 LEU 25 2HD1 LEU 25 4.771 7.147 11.456 199 HD13 LEU 25 3HD1 LEU 25 5.959 7.568 10.222 200 HD21 LEU 25 3HD2 LEU 25 5.185 3.467 10.039 201 HD22 LEU 25 1HD2 LEU 25 4.898 4.213 11.613 202 HD23 LEU 25 2HD2 LEU 25 6.511 4.254 10.900 203 H GLU 26 H GLU 26 5.284 7.069 7.263 204 HA GLU 26 HA GLU 26 6.119 9.557 8.630 205 HB2 GLU 26 2HB GLU 26 7.358 7.730 6.553 206 HB3 GLU 26 1HB GLU 26 8.104 9.248 7.058 207 HG2 GLU 26 2HG GLU 26 7.321 7.085 9.021 208 HG3 GLU 26 1HG GLU 26 8.922 7.170 8.285 209 H LEU 27 H LEU 27 4.487 8.289 5.954 210 HA LEU 27 HA LEU 27 4.773 10.492 4.176 211 HB2 LEU 27 2HB LEU 27 4.144 8.319 3.335 212 HB3 LEU 27 1HB LEU 27 2.797 8.221 4.467 213 HG LEU 27 HG LEU 27 1.871 10.309 3.314 214 HD11 LEU 27 1HD1 LEU 27 2.677 10.714 1.027 215 HD12 LEU 27 2HD1 LEU 27 3.893 9.451 1.220 216 HD13 LEU 27 3HD1 LEU 27 3.993 10.925 2.182 217 HD21 LEU 27 3HD2 LEU 27 2.078 7.565 2.121 218 HD22 LEU 27 1HD2 LEU 27 1.264 8.830 1.201 219 HD23 LEU 27 2HD2 LEU 27 0.671 8.382 2.800 220 H GLU 28 H GLU 28 2.643 9.646 6.826 221 HA GLU 28 HA GLU 28 0.603 11.637 6.342 222 HB2 GLU 28 2HB GLU 28 1.409 10.717 9.080 223 HB3 GLU 28 1HB GLU 28 -0.208 10.978 8.437 224 HG2 GLU 28 2HG GLU 28 1.644 8.646 7.935 225 HG3 GLU 28 1HG GLU 28 0.032 8.621 8.626 226 H LYS 29 H LYS 29 3.653 11.620 8.149 227 HA LYS 29 HA LYS 29 3.277 14.349 9.127 228 HB2 LYS 29 2HB LYS 29 5.792 12.670 8.958 229 HB3 LYS 29 1HB LYS 29 5.500 14.023 10.050 230 HG2 LYS 29 2HG LYS 29 4.173 12.781 11.454 231 HG3 LYS 29 1HG LYS 29 3.556 11.771 10.144 232 HD2 LYS 29 2HD LYS 29 5.077 10.534 11.696 233 HD3 LYS 29 1HD LYS 29 5.639 10.557 10.027 234 HE2 LYS 29 2HE LYS 29 7.529 11.056 11.502 235 HE3 LYS 29 1HE LYS 29 7.100 12.528 10.610 236 HZ1 LYS 29 3HZ LYS 29 5.786 13.281 12.440 237 HZ2 LYS 29 1HZ LYS 29 7.318 12.880 13.044 238 HZ3 LYS 29 2HZ LYS 29 6.011 11.823 13.282 239 H ASN 30 H ASN 30 4.412 12.764 6.360 240 HA ASN 30 HA ASN 30 4.999 15.342 5.046 241 HB2 ASN 30 2HB ASN 30 6.977 13.201 5.727 242 HB3 ASN 30 1HB ASN 30 7.143 13.971 4.148 243 HD21 ASN 30 1HD2 ASN 30 7.082 14.665 7.657 244 HD22 ASN 30 2HD2 ASN 30 7.885 16.154 7.538 245 HA PRO 31 HA PRO 31 2.796 12.371 2.487 246 HB2 PRO 31 2HB PRO 31 0.532 13.847 2.280 247 HB3 PRO 31 1HB PRO 31 0.879 12.796 3.662 248 HG2 PRO 31 2HG PRO 31 0.879 15.715 3.501 249 HG3 PRO 31 1HG PRO 31 0.680 14.653 4.901 250 HD2 PRO 31 2HD PRO 31 3.029 16.033 4.067 251 HD3 PRO 31 1HD PRO 31 2.832 14.933 5.452 252 H GLU 32 H GLU 32 4.436 15.091 1.993 253 HA GLU 32 HA GLU 32 3.623 15.265 -0.873 254 HB2 GLU 32 2HB GLU 32 4.393 17.858 -0.092 255 HB3 GLU 32 1HB GLU 32 2.758 17.320 -0.461 256 HG2 GLU 32 2HG GLU 32 2.223 16.973 1.803 257 HG3 GLU 32 1HG GLU 32 3.921 16.876 2.283 258 H ASP 33 H ASP 33 5.980 14.500 1.210 259 HA ASP 33 HA ASP 33 8.253 15.966 0.252 260 HB2 ASP 33 2HB ASP 33 7.635 14.146 2.251 261 HB3 ASP 33 1HB ASP 33 8.731 13.248 1.204 262 H MET 34 H MET 34 6.307 13.675 -1.201 263 HA MET 34 HA MET 34 6.463 12.449 -3.188 264 HB2 MET 34 2HB MET 34 8.685 14.491 -3.394 265 HB3 MET 34 1HB MET 34 8.414 13.320 -4.684 266 HG2 MET 34 2HG MET 34 5.866 14.339 -4.030 267 HG3 MET 34 1HG MET 34 6.942 15.735 -4.091 268 HE1 MET 34 3HE MET 34 4.735 13.441 -6.437 269 HE2 MET 34 1HE MET 34 4.718 14.950 -7.362 270 HE3 MET 34 2HE MET 34 4.507 14.982 -5.612 271 H GLU 35 H GLU 35 8.305 11.994 -0.636 272 HA GLU 35 HA GLU 35 10.049 9.964 -1.941 273 HB2 GLU 35 2HB GLU 35 11.593 10.357 -0.202 274 HB3 GLU 35 1HB GLU 35 10.898 11.961 -0.420 275 HG2 GLU 35 2HG GLU 35 9.311 11.520 1.423 276 HG3 GLU 35 1HG GLU 35 10.023 9.924 1.650 277 H LEU 36 H LEU 36 7.822 10.688 0.686 278 HA LEU 36 HA LEU 36 7.558 7.875 1.503 279 HB2 LEU 36 2HB LEU 36 5.835 10.317 2.078 280 HB3 LEU 36 1HB LEU 36 5.866 8.817 3.004 281 HG LEU 36 HG LEU 36 8.536 9.703 2.805 282 HD11 LEU 36 1HD1 LEU 36 7.174 11.926 2.336 283 HD12 LEU 36 2HD1 LEU 36 8.575 11.941 3.408 284 HD13 LEU 36 3HD1 LEU 36 6.948 11.889 4.085 285 HD21 LEU 36 3HD2 LEU 36 6.625 8.882 4.768 286 HD22 LEU 36 1HD2 LEU 36 7.448 10.324 5.363 287 HD23 LEU 36 2HD2 LEU 36 8.384 8.903 4.898 288 H ILE 37 H ILE 37 6.178 10.108 -0.772 289 HA ILE 37 HA ILE 37 3.728 8.582 -1.273 290 HB ILE 37 HB ILE 37 5.232 10.817 -2.668 291 HG12 ILE 37 2HG1 ILE 37 2.623 10.719 -1.115 292 HG13 ILE 37 1HG1 ILE 37 4.146 11.387 -0.527 293 HG21 ILE 37 1HG2 ILE 37 2.582 10.745 -3.601 294 HG22 ILE 37 2HG2 ILE 37 3.146 9.076 -3.690 295 HG23 ILE 37 3HG2 ILE 37 4.035 10.353 -4.520 296 HD11 ILE 37 3HD1 ILE 37 3.425 13.357 -1.375 297 HD12 ILE 37 1HD1 ILE 37 2.166 12.576 -2.333 298 HD13 ILE 37 2HD1 ILE 37 3.814 12.673 -2.954 299 H ASN 38 H ASN 38 7.028 8.745 -2.552 300 HA ASN 38 HA ASN 38 6.357 6.873 -4.733 301 HB2 ASN 38 2HB ASN 38 7.905 8.902 -4.898 302 HB3 ASN 38 1HB ASN 38 9.048 7.985 -3.916 303 HD21 ASN 38 1HD2 ASN 38 9.036 8.838 -6.908 304 HD22 ASN 38 2HD2 ASN 38 9.396 7.396 -7.728 305 H GLU 39 H GLU 39 7.837 6.900 -1.607 306 HA GLU 39 HA GLU 39 9.070 4.271 -1.844 307 HB2 GLU 39 2HB GLU 39 8.408 6.168 0.416 308 HB3 GLU 39 1HB GLU 39 9.158 4.599 0.713 309 HG2 GLU 39 2HG GLU 39 10.338 6.495 -1.309 310 HG3 GLU 39 1HG GLU 39 10.707 6.673 0.407 311 H ALA 40 H ALA 40 6.012 5.582 -1.058 312 HA ALA 40 HA ALA 40 4.955 3.062 0.072 313 HB1 ALA 40 1HB ALA 40 2.984 4.451 0.485 314 HB2 ALA 40 2HB ALA 40 3.638 5.728 -0.543 315 HB3 ALA 40 3HB ALA 40 4.425 5.336 0.984 316 H PHE 41 H PHE 41 4.281 5.257 -2.709 317 HA PHE 41 HA PHE 41 2.336 3.657 -4.007 318 HB2 PHE 41 2HB PHE 41 2.729 5.884 -4.739 319 HB3 PHE 41 1HB PHE 41 4.463 5.607 -4.906 320 HD1 PHE 41 2HD PHE 41 5.350 4.256 -6.784 321 HD2 PHE 41 1HD PHE 41 1.175 5.220 -6.464 322 HE1 PHE 41 2HE PHE 41 5.021 3.620 -9.158 323 HE2 PHE 41 1HE PHE 41 0.848 4.583 -8.838 324 HZ PHE 41 HZ PHE 41 2.770 3.783 -10.185 325 H ARG 42 H ARG 42 5.803 3.274 -3.745 326 HA ARG 42 HA ARG 42 6.018 1.341 -5.948 327 HB2 ARG 42 2HB ARG 42 7.803 2.452 -3.779 328 HB3 ARG 42 1HB ARG 42 8.345 1.124 -4.805 329 HG2 ARG 42 2HG ARG 42 7.908 2.496 -6.813 330 HG3 ARG 42 1HG ARG 42 7.387 3.830 -5.782 331 HD2 ARG 42 2HD ARG 42 9.563 4.167 -4.912 332 HD3 ARG 42 1HD ARG 42 10.117 2.571 -5.456 333 HE ARG 42 HE ARG 42 9.196 4.059 -7.723 334 HH11 ARG 42 1HH2 ARG 42 11.924 2.961 -6.105 335 HH12 ARG 42 2HH2 ARG 42 13.026 4.077 -6.840 336 HH21 ARG 42 1HH1 ARG 42 10.538 5.931 -8.385 337 HH22 ARG 42 2HH1 ARG 42 12.242 5.757 -8.131 338 H ALA 43 H ALA 43 6.808 1.047 -2.463 339 HA ALA 43 HA ALA 43 6.919 -1.690 -2.138 340 HB1 ALA 43 1HB ALA 43 6.787 0.489 -0.514 341 HB2 ALA 43 2HB ALA 43 6.707 -1.167 0.089 342 HB3 ALA 43 3HB ALA 43 5.223 -0.250 -0.171 343 H LEU 44 H LEU 44 3.928 0.232 -2.391 344 HA LEU 44 HA LEU 44 2.172 -2.043 -2.033 345 HB2 LEU 44 2HB LEU 44 1.936 0.759 -3.141 346 HB3 LEU 44 1HB LEU 44 0.558 -0.343 -3.136 347 HG LEU 44 HG LEU 44 2.104 -0.036 -0.603 348 HD11 LEU 44 1HD1 LEU 44 0.522 2.106 -1.946 349 HD12 LEU 44 2HD1 LEU 44 1.884 2.243 -0.832 350 HD13 LEU 44 3HD1 LEU 44 0.273 1.883 -0.213 351 HD21 LEU 44 3HD2 LEU 44 -0.291 -0.187 0.269 352 HD22 LEU 44 1HD2 LEU 44 0.295 -1.609 -0.593 353 HD23 LEU 44 2HD2 LEU 44 -0.784 -0.472 -1.400 354 H HIS 45 H HIS 45 3.475 -0.311 -4.866 355 HA HIS 45 HA HIS 45 2.165 -1.927 -6.863 356 HB2 HIS 45 2HB HIS 45 3.396 0.359 -7.008 357 HB3 HIS 45 1HB HIS 45 4.875 -0.598 -7.099 358 HD1 HIS 45 1HD HIS 45 1.523 -1.385 -8.710 359 HD2 HIS 45 2HD HIS 45 5.433 -0.470 -9.824 360 HE1 HIS 45 1HE HIS 45 1.632 -1.660 -11.225 361 H THR 46 H THR 46 5.152 -2.169 -5.018 362 HA THR 46 HA THR 46 6.258 -4.441 -6.421 363 HB THR 46 HB THR 46 6.721 -2.774 -4.032 364 HG1 THR 46 1HG THR 46 8.472 -2.528 -5.121 365 HG21 THR 46 3HG2 THR 46 8.163 -4.409 -2.874 366 HG22 THR 46 1HG2 THR 46 7.630 -5.665 -3.991 367 HG23 THR 46 2HG2 THR 46 6.477 -4.929 -2.878 368 H LEU 47 H LEU 47 4.303 -4.010 -3.476 369 HA LEU 47 HA LEU 47 3.999 -6.816 -2.887 370 HB2 LEU 47 2HB LEU 47 3.215 -4.190 -1.931 371 HB3 LEU 47 1HB LEU 47 1.854 -5.313 -1.836 372 HG LEU 47 HG LEU 47 4.631 -5.891 -0.785 373 HD11 LEU 47 1HD1 LEU 47 3.481 -5.648 1.462 374 HD12 LEU 47 2HD1 LEU 47 2.110 -4.941 0.605 375 HD13 LEU 47 3HD1 LEU 47 3.681 -4.139 0.571 376 HD21 LEU 47 3HD2 LEU 47 3.700 -7.879 0.114 377 HD22 LEU 47 1HD2 LEU 47 3.027 -7.789 -1.513 378 HD23 LEU 47 2HD2 LEU 47 2.047 -7.313 -0.125 379 H LYS 48 H LYS 48 2.214 -4.472 -4.854 380 HA LYS 48 HA LYS 48 -0.199 -5.887 -5.288 381 HB2 LYS 48 2HB LYS 48 0.812 -3.511 -6.003 382 HB3 LYS 48 1HB LYS 48 1.154 -4.379 -7.496 383 HG2 LYS 48 2HG LYS 48 -1.524 -3.930 -6.175 384 HG3 LYS 48 1HG LYS 48 -1.015 -3.434 -7.790 385 HD2 LYS 48 2HD LYS 48 -1.327 -6.292 -6.848 386 HD3 LYS 48 1HD LYS 48 -2.473 -5.428 -7.876 387 HE2 LYS 48 2HE LYS 48 0.414 -5.567 -8.713 388 HE3 LYS 48 1HE LYS 48 -0.644 -6.964 -9.000 389 HZ1 LYS 48 3HZ LYS 48 -1.892 -5.836 -10.473 390 HZ2 LYS 48 1HZ LYS 48 -0.534 -4.832 -10.620 391 HZ3 LYS 48 2HZ LYS 48 -1.814 -4.381 -9.599 392 H GLY 49 H GLY 49 2.964 -6.086 -6.904 393 HA2 GLY 49 2HA GLY 49 2.121 -8.014 -8.890 394 HA3 GLY 49 1HA GLY 49 3.793 -7.640 -8.467 395 H MET 50 H MET 50 4.039 -8.330 -5.878 396 HA MET 50 HA MET 50 4.279 -11.151 -5.869 397 HB2 MET 50 2HB MET 50 4.014 -9.092 -3.656 398 HB3 MET 50 1HB MET 50 4.499 -10.765 -3.373 399 HG2 MET 50 2HG MET 50 6.272 -10.284 -5.246 400 HG3 MET 50 1HG MET 50 5.971 -8.595 -4.843 401 HE1 MET 50 3HE MET 50 6.421 -8.576 -1.026 402 HE2 MET 50 1HE MET 50 5.225 -9.820 -1.418 403 HE3 MET 50 2HE MET 50 5.245 -8.300 -2.311 404 H ALA 51 H ALA 51 1.503 -9.148 -5.386 405 HA ALA 51 HA ALA 51 -0.042 -11.217 -3.947 406 HB1 ALA 51 1HB ALA 51 -1.839 -9.431 -4.254 407 HB2 ALA 51 2HB ALA 51 -0.617 -8.457 -5.070 408 HB3 ALA 51 3HB ALA 51 -0.405 -8.896 -3.377 409 H GLY 52 H GLY 52 0.612 -10.168 -7.178 410 HA2 GLY 52 2HA GLY 52 -1.756 -11.535 -8.302 411 HA3 GLY 52 1HA GLY 52 -0.542 -10.639 -9.222 412 H THR 53 H THR 53 1.640 -11.994 -7.730 413 HA THR 53 HA THR 53 1.874 -14.357 -9.452 414 HB THR 53 HB THR 53 3.575 -12.768 -7.557 415 HG1 THR 53 1HG THR 53 3.955 -12.008 -9.474 416 HG21 THR 53 3HG2 THR 53 5.433 -14.431 -8.079 417 HG22 THR 53 1HG2 THR 53 4.164 -15.542 -8.596 418 HG23 THR 53 2HG2 THR 53 4.214 -14.976 -6.927 419 H MET 54 H MET 54 0.700 -13.659 -6.370 420 HA MET 54 HA MET 54 1.234 -16.386 -5.300 421 HB2 MET 54 2HB MET 54 1.455 -13.985 -4.141 422 HB3 MET 54 1HB MET 54 -0.257 -14.258 -3.819 423 HG2 MET 54 2HG MET 54 0.241 -15.701 -2.167 424 HG3 MET 54 1HG MET 54 1.221 -16.670 -3.268 425 HE1 MET 54 3HE MET 54 4.487 -14.520 -3.369 426 HE2 MET 54 1HE MET 54 3.092 -14.877 -4.395 427 HE3 MET 54 2HE MET 54 3.991 -16.189 -3.636 428 H GLY 55 H GLY 55 -0.951 -15.101 -7.314 429 HA2 GLY 55 2HA GLY 55 -3.075 -15.864 -7.983 430 HA3 GLY 55 1HA GLY 55 -2.966 -17.101 -6.729 431 H PHE 56 H PHE 56 -2.326 -14.096 -5.375 432 HA PHE 56 HA PHE 56 -5.118 -13.960 -4.305 433 HB2 PHE 56 2HB PHE 56 -2.381 -13.134 -3.322 434 HB3 PHE 56 1HB PHE 56 -3.852 -12.561 -2.537 435 HD1 PHE 56 1HD PHE 56 -5.527 -14.278 -1.672 436 HD2 PHE 56 2HD PHE 56 -1.546 -15.312 -2.911 437 HE1 PHE 56 1HE PHE 56 -5.691 -16.414 -0.421 438 HE2 PHE 56 2HE PHE 56 -1.710 -17.447 -1.662 439 HZ PHE 56 HZ PHE 56 -3.784 -17.999 -0.417 440 H SER 57 H SER 57 -5.183 -12.818 -6.723 441 HA SER 57 HA SER 57 -4.232 -10.125 -6.926 442 HB2 SER 57 2HB SER 57 -6.722 -11.229 -8.211 443 HB3 SER 57 1HB SER 57 -5.581 -10.067 -8.879 444 HG SER 57 HG SER 57 -5.507 -12.805 -8.839 445 H SER 58 H SER 58 -6.870 -11.533 -5.264 446 HA SER 58 HA SER 58 -8.654 -9.309 -5.050 447 HB2 SER 58 2HB SER 58 -8.024 -11.504 -3.046 448 HB3 SER 58 1HB SER 58 -9.520 -10.579 -3.138 449 HG SER 58 HG SER 58 -8.702 -12.745 -4.574 450 H MET 59 H MET 59 -5.804 -10.350 -3.252 451 HA MET 59 HA MET 59 -5.943 -8.046 -1.422 452 HB2 MET 59 2HB MET 59 -5.242 -10.299 -0.670 453 HB3 MET 59 1HB MET 59 -3.921 -10.275 -1.837 454 HG2 MET 59 2HG MET 59 -4.187 -8.073 0.200 455 HG3 MET 59 1HG MET 59 -3.419 -9.598 0.636 456 HE1 MET 59 3HE MET 59 -1.848 -10.769 -0.924 457 HE2 MET 59 1HE MET 59 -0.566 -9.983 -1.855 458 HE3 MET 59 2HE MET 59 -2.168 -10.191 -2.558 459 H ALA 60 H ALA 60 -4.543 -8.949 -4.452 460 HA ALA 60 HA ALA 60 -2.323 -7.046 -4.390 461 HB1 ALA 60 1HB ALA 60 -3.506 -8.066 -6.935 462 HB2 ALA 60 2HB ALA 60 -2.906 -9.278 -5.803 463 HB3 ALA 60 3HB ALA 60 -1.821 -8.034 -6.422 464 H LYS 61 H LYS 61 -5.682 -7.085 -5.531 465 HA LYS 61 HA LYS 61 -5.631 -4.675 -7.058 466 HB2 LYS 61 2HB LYS 61 -7.694 -6.149 -5.404 467 HB3 LYS 61 1HB LYS 61 -8.108 -4.689 -6.307 468 HG2 LYS 61 2HG LYS 61 -8.021 -5.760 -8.308 469 HG3 LYS 61 1HG LYS 61 -6.594 -6.691 -7.851 470 HD2 LYS 61 2HD LYS 61 -8.297 -8.321 -8.016 471 HD3 LYS 61 1HD LYS 61 -8.189 -7.988 -6.287 472 HE2 LYS 61 2HE LYS 61 -10.439 -7.630 -6.420 473 HE3 LYS 61 1HE LYS 61 -9.990 -6.073 -7.143 474 HZ1 LYS 61 3HZ LYS 61 -10.850 -8.548 -8.454 475 HZ2 LYS 61 1HZ LYS 61 -9.705 -7.588 -9.255 476 HZ3 LYS 61 2HZ LYS 61 -11.219 -6.936 -8.843 477 H LEU 62 H LEU 62 -5.857 -5.383 -3.638 478 HA LEU 62 HA LEU 62 -6.457 -2.732 -2.697 479 HB2 LEU 62 2HB LEU 62 -5.032 -5.142 -1.517 480 HB3 LEU 62 1HB LEU 62 -5.504 -3.728 -0.569 481 HG LEU 62 HG LEU 62 -7.539 -5.147 -2.264 482 HD11 LEU 62 1HD1 LEU 62 -7.620 -5.950 0.523 483 HD12 LEU 62 2HD1 LEU 62 -6.094 -6.428 -0.223 484 HD13 LEU 62 3HD1 LEU 62 -7.622 -6.958 -0.924 485 HD21 LEU 62 3HD2 LEU 62 -8.844 -3.568 -1.324 486 HD22 LEU 62 1HD2 LEU 62 -7.476 -2.972 -0.384 487 HD23 LEU 62 2HD2 LEU 62 -8.498 -4.256 0.262 488 H CYS 63 H CYS 63 -3.485 -4.535 -3.369 489 HA CYS 63 HA CYS 63 -1.634 -2.520 -2.454 490 HB2 CYS 63 2HB CYS 63 -1.468 -4.800 -4.452 491 HB3 CYS 63 1HB CYS 63 -0.064 -3.882 -3.906 492 HG CYS 63 HG CYS 63 -0.877 -6.177 -2.442 493 H HIS 64 H HIS 64 -3.399 -3.103 -5.422 494 HA HIS 64 HA HIS 64 -1.930 -1.069 -6.958 495 HB2 HIS 64 2HB HIS 64 -3.124 -3.296 -7.705 496 HB3 HIS 64 1HB HIS 64 -4.579 -2.299 -7.693 497 HD1 HIS 64 1HD HIS 64 -1.034 -2.072 -9.107 498 HD2 HIS 64 2HD HIS 64 -4.932 -0.953 -10.073 499 HE1 HIS 64 1HE HIS 64 -0.926 -1.007 -11.403 500 H THR 65 H THR 65 -4.786 -1.373 -4.994 501 HA THR 65 HA THR 65 -6.081 1.090 -5.863 502 HB THR 65 HB THR 65 -6.383 -1.040 -3.775 503 HG1 THR 65 1HG THR 65 -7.334 -0.995 -5.942 504 HG21 THR 65 3HG2 THR 65 -6.750 0.886 -2.399 505 HG22 THR 65 1HG2 THR 65 -8.341 0.264 -2.838 506 HG23 THR 65 2HG2 THR 65 -7.692 1.684 -3.659 507 H LEU 66 H LEU 66 -4.558 0.149 -2.745 508 HA LEU 66 HA LEU 66 -4.402 2.656 -1.497 509 HB2 LEU 66 2HB LEU 66 -2.776 0.124 -1.571 510 HB3 LEU 66 1HB LEU 66 -2.173 1.496 -0.639 511 HG LEU 66 HG LEU 66 -4.610 1.567 0.298 512 HD11 LEU 66 1HD1 LEU 66 -5.641 -0.660 0.453 513 HD12 LEU 66 2HD1 LEU 66 -4.379 -1.314 -0.584 514 HD13 LEU 66 3HD1 LEU 66 -5.522 -0.131 -1.222 515 HD21 LEU 66 3HD2 LEU 66 -3.305 1.032 2.069 516 HD22 LEU 66 1HD2 LEU 66 -2.203 0.113 1.045 517 HD23 LEU 66 2HD2 LEU 66 -3.650 -0.656 1.698 518 H GLU 67 H GLU 67 -2.040 1.096 -3.657 519 HA GLU 67 HA GLU 67 -0.172 3.249 -3.794 520 HB2 GLU 67 2HB GLU 67 0.557 1.117 -4.459 521 HB3 GLU 67 1HB GLU 67 -0.911 0.808 -5.384 522 HG2 GLU 67 2HG GLU 67 0.560 3.120 -6.400 523 HG3 GLU 67 1HG GLU 67 1.535 1.651 -6.428 524 H ASN 68 H ASN 68 -3.208 2.650 -5.447 525 HA ASN 68 HA ASN 68 -2.783 4.396 -7.681 526 HB2 ASN 68 2HB ASN 68 -4.832 2.820 -6.477 527 HB3 ASN 68 1HB ASN 68 -5.481 4.435 -6.745 528 HD21 ASN 68 1HD2 ASN 68 -6.804 3.876 -8.591 529 HD22 ASN 68 2HD2 ASN 68 -6.134 3.384 -10.072 530 H ILE 69 H ILE 69 -4.148 4.842 -4.435 531 HA ILE 69 HA ILE 69 -4.734 7.638 -4.691 532 HB ILE 69 HB ILE 69 -4.117 5.773 -2.395 533 HG12 ILE 69 2HG1 ILE 69 -6.568 6.246 -1.956 534 HG13 ILE 69 1HG1 ILE 69 -6.602 7.085 -3.503 535 HG21 ILE 69 1HG2 ILE 69 -4.772 8.726 -2.381 536 HG22 ILE 69 2HG2 ILE 69 -3.444 7.908 -1.557 537 HG23 ILE 69 3HG2 ILE 69 -5.101 7.697 -0.992 538 HD11 ILE 69 3HD1 ILE 69 -6.062 5.096 -4.703 539 HD12 ILE 69 1HD1 ILE 69 -7.335 4.654 -3.563 540 HD13 ILE 69 2HD1 ILE 69 -5.659 4.236 -3.213 541 H LEU 70 H LEU 70 -1.985 5.783 -3.752 542 HA LEU 70 HA LEU 70 -0.254 7.986 -3.051 543 HB2 LEU 70 2HB LEU 70 0.379 5.188 -4.043 544 HB3 LEU 70 1HB LEU 70 1.510 6.256 -3.217 545 HG LEU 70 HG LEU 70 -0.764 4.682 -2.109 546 HD11 LEU 70 1HD1 LEU 70 0.793 4.045 -0.555 547 HD12 LEU 70 2HD1 LEU 70 1.561 5.633 -0.525 548 HD13 LEU 70 3HD1 LEU 70 1.894 4.515 -1.850 549 HD21 LEU 70 3HD2 LEU 70 -0.680 6.314 -0.083 550 HD22 LEU 70 1HD2 LEU 70 -1.667 6.770 -1.473 551 HD23 LEU 70 2HD2 LEU 70 -0.071 7.488 -1.250 552 H ASP 71 H ASP 71 -1.417 6.664 -5.969 553 HA ASP 71 HA ASP 71 0.713 7.740 -7.676 554 HB2 ASP 71 2HB ASP 71 -1.179 5.796 -7.949 555 HB3 ASP 71 1HB ASP 71 -2.001 7.137 -8.748 556 H LYS 72 H LYS 72 -2.742 8.550 -7.037 557 HA LYS 72 HA LYS 72 -2.725 11.040 -8.418 558 HB2 LYS 72 2HB LYS 72 -4.214 9.781 -6.145 559 HB3 LYS 72 1HB LYS 72 -4.609 11.424 -6.638 560 HG2 LYS 72 2HG LYS 72 -5.557 10.718 -8.599 561 HG3 LYS 72 1HG LYS 72 -4.403 9.391 -8.788 562 HD2 LYS 72 2HD LYS 72 -6.252 9.266 -6.481 563 HD3 LYS 72 1HD LYS 72 -6.935 8.934 -8.074 564 HE2 LYS 72 2HE LYS 72 -4.533 7.536 -8.066 565 HE3 LYS 72 1HE LYS 72 -5.175 7.299 -6.430 566 HZ1 LYS 72 3HZ LYS 72 -7.283 6.647 -7.339 567 HZ2 LYS 72 1HZ LYS 72 -6.083 5.690 -8.059 568 HZ3 LYS 72 2HZ LYS 72 -6.767 6.984 -8.923 569 H ALA 73 H ALA 73 -1.564 9.983 -5.352 570 HA ALA 73 HA ALA 73 -1.194 12.528 -4.043 571 HB1 ALA 73 1HB ALA 73 0.592 10.133 -3.679 572 HB2 ALA 73 2HB ALA 73 -1.112 10.001 -3.251 573 HB3 ALA 73 3HB ALA 73 -0.092 11.197 -2.448 574 H ARG 74 H ARG 74 0.618 10.606 -6.333 575 HA ARG 74 HA ARG 74 2.993 12.362 -6.217 576 HB2 ARG 74 2HB ARG 74 3.972 10.460 -6.988 577 HB3 ARG 74 1HB ARG 74 2.403 9.673 -6.865 578 HG2 ARG 74 2HG ARG 74 1.874 10.411 -9.180 579 HG3 ARG 74 1HG ARG 74 3.478 11.135 -9.299 580 HD2 ARG 74 2HD ARG 74 4.035 8.560 -8.421 581 HD3 ARG 74 1HD ARG 74 2.700 8.322 -9.567 582 HE ARG 74 HE ARG 74 4.515 10.212 -10.690 583 HH11 ARG 74 1HH1 ARG 74 6.327 8.046 -9.464 584 HH12 ARG 74 2HH1 ARG 74 6.541 7.001 -10.827 585 HH21 ARG 74 1HH2 ARG 74 3.915 8.369 -12.628 586 HH22 ARG 74 2HH2 ARG 74 5.179 7.186 -12.619 587 H ASN 75 H ASN 75 0.050 11.936 -7.982 588 HA ASN 75 HA ASN 75 0.941 13.729 -10.192 589 HB2 ASN 75 2HB ASN 75 -0.410 11.490 -10.352 590 HB3 ASN 75 1HB ASN 75 -1.779 12.480 -9.844 591 HD21 ASN 75 1HD2 ASN 75 -2.659 12.015 -12.085 592 HD22 ASN 75 2HD2 ASN 75 -2.112 12.958 -13.387 593 H SER 76 H SER 76 -0.328 14.011 -7.125 594 HA SER 76 HA SER 76 -1.249 15.884 -6.010 595 HB2 SER 76 2HB SER 76 0.119 16.960 -7.999 596 HB3 SER 76 1HB SER 76 -1.479 17.261 -8.675 597 HG SER 76 HG SER 76 -0.618 18.958 -7.296 598 H GLU 77 H GLU 77 -2.913 13.748 -6.840 599 HA GLU 77 HA GLU 77 -5.363 15.165 -7.772 600 HB2 GLU 77 2HB GLU 77 -4.242 12.418 -8.127 601 HB3 GLU 77 1HB GLU 77 -5.979 12.670 -8.301 602 HG2 GLU 77 2HG GLU 77 -3.821 14.181 -9.792 603 HG3 GLU 77 1HG GLU 77 -4.772 12.853 -10.462 604 H ILE 78 H ILE 78 -4.055 12.969 -5.378 605 HA ILE 78 HA ILE 78 -6.626 13.280 -3.871 606 HB ILE 78 HB ILE 78 -5.950 11.126 -2.743 607 HG12 ILE 78 2HG1 ILE 78 -4.433 9.740 -4.379 608 HG13 ILE 78 1HG1 ILE 78 -3.768 11.317 -4.788 609 HG21 ILE 78 1HG2 ILE 78 -7.662 11.216 -4.491 610 HG22 ILE 78 2HG2 ILE 78 -6.711 9.738 -4.638 611 HG23 ILE 78 3HG2 ILE 78 -6.416 11.091 -5.732 612 HD11 ILE 78 3HD1 ILE 78 -2.520 11.238 -2.931 613 HD12 ILE 78 1HD1 ILE 78 -3.230 9.683 -2.513 614 HD13 ILE 78 2HD1 ILE 78 -3.989 11.173 -1.956 615 H LYS 79 H LYS 79 -3.188 12.881 -3.419 616 HA LYS 79 HA LYS 79 -1.739 13.673 -1.718 617 HB2 LYS 79 2HB LYS 79 -4.024 15.608 -1.883 618 HB3 LYS 79 1HB LYS 79 -2.867 15.787 -0.564 619 HG2 LYS 79 2HG LYS 79 -2.069 15.571 -3.478 620 HG3 LYS 79 1HG LYS 79 -2.273 17.104 -2.630 621 HD2 LYS 79 2HD LYS 79 -0.211 16.923 -1.757 622 HD3 LYS 79 1HD LYS 79 -0.640 15.377 -1.023 623 HE2 LYS 79 2HE LYS 79 0.658 14.288 -2.521 624 HE3 LYS 79 1HE LYS 79 -0.259 15.007 -3.861 625 HZ1 LYS 79 3HZ LYS 79 1.568 16.743 -2.383 626 HZ2 LYS 79 1HZ LYS 79 1.158 16.759 -4.029 627 HZ3 LYS 79 2HZ LYS 79 2.265 15.612 -3.441 628 H ILE 80 H ILE 80 -1.395 13.044 0.441 629 HA ILE 80 HA ILE 80 -3.444 11.462 1.728 630 HB ILE 80 HB ILE 80 -0.759 12.563 2.470 631 HG12 ILE 80 2HG1 ILE 80 -0.159 10.156 2.382 632 HG13 ILE 80 1HG1 ILE 80 -1.836 9.777 1.995 633 HG21 ILE 80 1HG2 ILE 80 -1.249 12.288 4.654 634 HG22 ILE 80 2HG2 ILE 80 -1.414 10.564 4.320 635 HG23 ILE 80 3HG2 ILE 80 -2.828 11.612 4.259 636 HD11 ILE 80 3HD1 ILE 80 -0.146 11.636 0.307 637 HD12 ILE 80 1HD1 ILE 80 -1.707 10.924 -0.105 638 HD13 ILE 80 2HD1 ILE 80 -0.272 9.903 -0.006 639 H THR 81 H THR 81 -5.195 12.672 2.127 640 HA THR 81 HA THR 81 -5.080 15.232 3.602 641 HB THR 81 HB THR 81 -7.518 15.162 3.135 642 HG1 THR 81 1HG THR 81 -7.979 13.032 3.328 643 HG21 THR 81 3HG2 THR 81 -7.273 15.623 0.894 644 HG22 THR 81 1HG2 THR 81 -6.320 14.167 0.598 645 HG23 THR 81 2HG2 THR 81 -5.568 15.577 1.344 646 H SER 82 H SER 82 -4.476 12.370 4.744 647 HA SER 82 HA SER 82 -4.671 11.483 6.945 648 HB2 SER 82 2HB SER 82 -5.552 14.112 7.151 649 HB3 SER 82 1HB SER 82 -6.903 13.175 7.782 650 HG SER 82 HG SER 82 -5.712 12.554 9.421 651 H ASP 83 H ASP 83 -7.144 11.837 4.643 652 HA ASP 83 HA ASP 83 -8.846 9.783 5.987 653 HB2 ASP 83 2HB ASP 83 -9.343 12.289 4.650 654 HB3 ASP 83 1HB ASP 83 -10.116 10.989 3.743 655 H LEU 84 H LEU 84 -7.532 10.876 2.833 656 HA LEU 84 HA LEU 84 -8.202 8.511 1.355 657 HB2 LEU 84 2HB LEU 84 -5.852 10.429 1.095 658 HB3 LEU 84 1HB LEU 84 -6.458 9.369 -0.179 659 HG LEU 84 HG LEU 84 -7.913 11.688 1.118 660 HD11 LEU 84 1HD1 LEU 84 -7.598 11.325 -1.825 661 HD12 LEU 84 2HD1 LEU 84 -6.161 11.786 -0.914 662 HD13 LEU 84 3HD1 LEU 84 -7.598 12.807 -0.869 663 HD21 LEU 84 3HD2 LEU 84 -8.874 9.361 -0.509 664 HD22 LEU 84 1HD2 LEU 84 -9.618 10.937 -0.775 665 HD23 LEU 84 2HD2 LEU 84 -9.669 10.196 0.824 666 H LEU 85 H LEU 85 -5.695 9.313 3.647 667 HA LEU 85 HA LEU 85 -4.107 6.910 3.046 668 HB2 LEU 85 2HB LEU 85 -2.530 8.194 4.056 669 HB3 LEU 85 1HB LEU 85 -3.749 9.446 4.266 670 HG LEU 85 HG LEU 85 -4.440 8.122 6.383 671 HD11 LEU 85 1HD1 LEU 85 -2.096 7.093 7.240 672 HD12 LEU 85 2HD1 LEU 85 -1.954 6.741 5.518 673 HD13 LEU 85 3HD1 LEU 85 -3.325 6.117 6.435 674 HD21 LEU 85 3HD2 LEU 85 -2.061 9.073 7.405 675 HD22 LEU 85 1HD2 LEU 85 -3.494 10.053 7.107 676 HD23 LEU 85 2HD2 LEU 85 -2.213 9.977 5.900 677 H ASP 86 H ASP 86 -6.418 8.056 5.490 678 HA ASP 86 HA ASP 86 -6.228 5.882 7.330 679 HB2 ASP 86 2HB ASP 86 -7.734 8.220 6.915 680 HB3 ASP 86 1HB ASP 86 -8.924 6.919 6.937 681 H LYS 87 H LYS 87 -7.802 6.192 4.208 682 HA LYS 87 HA LYS 87 -9.346 3.710 4.500 683 HB2 LYS 87 2HB LYS 87 -8.670 5.477 2.118 684 HB3 LYS 87 1HB LYS 87 -9.874 4.191 2.119 685 HG2 LYS 87 2HG LYS 87 -9.939 6.818 3.594 686 HG3 LYS 87 1HG LYS 87 -11.148 6.140 2.508 687 HD2 LYS 87 2HD LYS 87 -10.437 5.101 5.267 688 HD3 LYS 87 1HD LYS 87 -11.917 5.952 4.826 689 HE2 LYS 87 2HE LYS 87 -11.294 3.570 3.167 690 HE3 LYS 87 1HE LYS 87 -11.739 3.240 4.854 691 HZ1 LYS 87 3HZ LYS 87 -13.694 3.451 3.392 692 HZ2 LYS 87 1HZ LYS 87 -13.238 5.043 3.030 693 HZ3 LYS 87 2HZ LYS 87 -13.672 4.626 4.618 694 H ILE 88 H ILE 88 -6.492 4.819 2.637 695 HA ILE 88 HA ILE 88 -5.781 2.339 1.462 696 HB ILE 88 HB ILE 88 -4.442 4.858 2.333 697 HG12 ILE 88 2HG1 ILE 88 -3.704 3.793 -0.237 698 HG13 ILE 88 1HG1 ILE 88 -5.459 3.803 -0.030 699 HG21 ILE 88 1HG2 ILE 88 -2.222 4.147 1.938 700 HG22 ILE 88 2HG2 ILE 88 -2.751 2.598 1.290 701 HG23 ILE 88 3HG2 ILE 88 -2.895 2.928 3.016 702 HD11 ILE 88 3HD1 ILE 88 -3.771 6.013 -0.588 703 HD12 ILE 88 1HD1 ILE 88 -4.363 6.227 1.059 704 HD13 ILE 88 2HD1 ILE 88 -5.506 6.037 -0.274 705 H PHE 89 H PHE 89 -4.867 3.765 4.588 706 HA PHE 89 HA PHE 89 -3.404 1.565 5.638 707 HB2 PHE 89 2HB PHE 89 -4.146 4.122 6.385 708 HB3 PHE 89 1HB PHE 89 -5.030 3.117 7.532 709 HD1 PHE 89 2HD PHE 89 -3.739 1.338 8.842 710 HD2 PHE 89 1HD PHE 89 -1.814 4.471 6.620 711 HE1 PHE 89 2HE PHE 89 -1.652 0.970 10.129 712 HE2 PHE 89 1HE PHE 89 0.272 4.102 7.909 713 HZ PHE 89 HZ PHE 89 0.353 2.351 9.663 714 H ALA 90 H ALA 90 -6.752 2.189 5.245 715 HA ALA 90 HA ALA 90 -7.715 0.110 7.057 716 HB1 ALA 90 1HB ALA 90 -8.743 2.323 5.654 717 HB2 ALA 90 2HB ALA 90 -9.673 1.195 6.639 718 HB3 ALA 90 3HB ALA 90 -9.510 0.923 4.904 719 H GLY 91 H GLY 91 -6.756 0.459 3.722 720 HA2 GLY 91 2HA GLY 91 -7.833 -2.088 2.812 721 HA3 GLY 91 1HA GLY 91 -6.649 -1.093 1.953 722 H VAL 92 H VAL 92 -4.728 -0.836 3.964 723 HA VAL 92 HA VAL 92 -3.240 -3.298 3.731 724 HB VAL 92 HB VAL 92 -3.037 -0.770 5.396 725 HG11 VAL 92 1HG1 VAL 92 -1.982 -2.918 6.434 726 HG12 VAL 92 2HG1 VAL 92 -0.973 -1.480 6.293 727 HG13 VAL 92 3HG1 VAL 92 -0.811 -2.789 5.124 728 HG21 VAL 92 3HG2 VAL 92 -0.830 -1.033 3.718 729 HG22 VAL 92 1HG2 VAL 92 -2.244 -0.024 3.414 730 HG23 VAL 92 2HG2 VAL 92 -2.165 -1.655 2.748 731 H ASP 93 H ASP 93 -5.593 -2.020 5.936 732 HA ASP 93 HA ASP 93 -5.031 -3.698 8.226 733 HB2 ASP 93 2HB ASP 93 -6.696 -1.554 7.502 734 HB3 ASP 93 1HB ASP 93 -7.809 -2.882 7.839 735 H MET 94 H MET 94 -7.223 -3.899 5.427 736 HA MET 94 HA MET 94 -8.338 -6.481 6.188 737 HB2 MET 94 2HB MET 94 -8.206 -5.029 3.517 738 HB3 MET 94 1HB MET 94 -9.319 -6.334 3.929 739 HG2 MET 94 2HG MET 94 -10.069 -4.809 5.883 740 HG3 MET 94 1HG MET 94 -9.256 -3.516 5.002 741 HE1 MET 94 3HE MET 94 -9.688 -5.170 2.152 742 HE2 MET 94 1HE MET 94 -9.630 -3.404 2.235 743 HE3 MET 94 2HE MET 94 -10.977 -4.208 1.433 744 H ILE 95 H ILE 95 -5.828 -5.284 3.995 745 HA ILE 95 HA ILE 95 -5.013 -7.687 2.754 746 HB ILE 95 HB ILE 95 -3.912 -5.018 3.463 747 HG12 ILE 95 2HG1 ILE 95 -3.425 -6.473 0.891 748 HG13 ILE 95 1HG1 ILE 95 -5.070 -5.960 1.272 749 HG21 ILE 95 1HG2 ILE 95 -2.009 -6.295 4.184 750 HG22 ILE 95 2HG2 ILE 95 -1.638 -5.669 2.578 751 HG23 ILE 95 3HG2 ILE 95 -2.114 -7.355 2.778 752 HD11 ILE 95 3HD1 ILE 95 -2.832 -3.996 1.618 753 HD12 ILE 95 1HD1 ILE 95 -4.526 -3.701 1.224 754 HD13 ILE 95 2HD1 ILE 95 -3.430 -4.326 -0.009 755 H THR 96 H THR 96 -4.126 -6.283 5.903 756 HA THR 96 HA THR 96 -2.288 -8.415 6.636 757 HB THR 96 HB THR 96 -3.756 -6.223 8.136 758 HG1 THR 96 1HG THR 96 -1.476 -5.493 8.198 759 HG21 THR 96 3HG2 THR 96 -1.488 -7.047 9.587 760 HG22 THR 96 1HG2 THR 96 -2.340 -8.529 9.153 761 HG23 THR 96 2HG2 THR 96 -3.177 -7.259 10.044 762 H ARG 97 H ARG 97 -5.710 -7.668 7.272 763 HA ARG 97 HA ARG 97 -6.207 -9.793 9.133 764 HB2 ARG 97 2HB ARG 97 -7.811 -8.067 7.260 765 HB3 ARG 97 1HB ARG 97 -8.607 -9.394 8.109 766 HG2 ARG 97 2HG ARG 97 -8.363 -8.404 10.173 767 HG3 ARG 97 1HG ARG 97 -6.862 -7.593 9.724 768 HD2 ARG 97 2HD ARG 97 -8.550 -6.314 8.046 769 HD3 ARG 97 1HD ARG 97 -9.675 -6.685 9.367 770 HE ARG 97 HE ARG 97 -7.075 -5.251 9.771 771 HH11 ARG 97 1HH2 ARG 97 -10.112 -4.257 9.697 772 HH12 ARG 97 2HH2 ARG 97 -10.303 -3.890 11.379 773 HH21 ARG 97 1HH1 ARG 97 -7.404 -5.536 12.337 774 HH22 ARG 97 2HH1 ARG 97 -8.772 -4.619 12.875 775 H MET 98 H MET 98 -6.369 -9.599 5.581 776 HA MET 98 HA MET 98 -7.435 -12.252 5.172 777 HB2 MET 98 2HB MET 98 -5.716 -10.422 3.453 778 HB3 MET 98 1HB MET 98 -6.588 -11.835 2.857 779 HG2 MET 98 2HG MET 98 -8.602 -10.781 2.918 780 HG3 MET 98 1HG MET 98 -8.220 -9.920 4.409 781 HE1 MET 98 3HE MET 98 -9.055 -8.145 0.774 782 HE2 MET 98 1HE MET 98 -9.317 -9.783 1.387 783 HE3 MET 98 2HE MET 98 -8.001 -9.460 0.261 784 H VAL 99 H VAL 99 -4.221 -10.840 5.442 785 HA VAL 99 HA VAL 99 -2.710 -13.206 4.806 786 HB VAL 99 HB VAL 99 -2.254 -10.582 6.225 787 HG11 VAL 99 1HG1 VAL 99 0.196 -11.208 6.221 788 HG12 VAL 99 2HG1 VAL 99 -0.290 -12.865 5.856 789 HG13 VAL 99 3HG1 VAL 99 -0.779 -12.116 7.376 790 HG21 VAL 99 3HG2 VAL 99 -1.539 -9.893 4.187 791 HG22 VAL 99 1HG2 VAL 99 -2.298 -11.356 3.558 792 HG23 VAL 99 2HG2 VAL 99 -0.577 -11.351 3.945 793 H ASP 100 H ASP 100 -4.124 -11.887 7.781 794 HA ASP 100 HA ASP 100 -2.776 -13.709 9.585 795 HB2 ASP 100 2HB ASP 100 -4.059 -11.433 9.939 796 HB3 ASP 100 1HB ASP 100 -5.479 -12.473 10.074 797 H LYS 101 H LYS 101 -5.736 -13.822 7.680 798 HA LYS 101 HA LYS 101 -6.530 -16.385 8.900 799 HB2 LYS 101 2HB LYS 101 -8.559 -15.597 8.345 800 HB3 LYS 101 1HB LYS 101 -7.780 -14.151 7.717 801 HG2 LYS 101 2HG LYS 101 -7.433 -15.969 5.657 802 HG3 LYS 101 1HG LYS 101 -9.034 -16.364 6.275 803 HD2 LYS 101 2HD LYS 101 -8.994 -13.621 6.292 804 HD3 LYS 101 1HD LYS 101 -8.115 -14.026 4.819 805 HE2 LYS 101 2HE LYS 101 -10.299 -14.148 3.997 806 HE3 LYS 101 1HE LYS 101 -10.112 -15.807 4.595 807 HZ1 LYS 101 3HZ LYS 101 -10.769 -14.607 6.842 808 HZ2 LYS 101 1HZ LYS 101 -11.936 -15.241 5.789 809 HZ3 LYS 101 2HZ LYS 101 -11.586 -13.582 5.765 810 H ILE 102 H ILE 102 -5.226 -15.023 5.924 811 HA ILE 102 HA ILE 102 -5.292 -17.386 4.301 812 HB ILE 102 HB ILE 102 -3.720 -14.816 4.423 813 HG12 ILE 102 2HG1 ILE 102 -5.584 -16.098 2.399 814 HG13 ILE 102 1HG1 ILE 102 -5.958 -14.739 3.459 815 HG21 ILE 102 1HG2 ILE 102 -3.039 -15.987 1.991 816 HG22 ILE 102 2HG2 ILE 102 -2.855 -17.297 3.156 817 HG23 ILE 102 3HG2 ILE 102 -1.973 -15.786 3.382 818 HD11 ILE 102 3HD1 ILE 102 -3.561 -14.101 2.055 819 HD12 ILE 102 1HD1 ILE 102 -5.135 -13.317 1.928 820 HD13 ILE 102 2HD1 ILE 102 -4.737 -14.674 0.874 821 H VAL 103 H VAL 103 -3.095 -16.060 6.682 822 HA VAL 103 HA VAL 103 -1.007 -18.067 6.376 823 HB VAL 103 HB VAL 103 -1.807 -15.909 8.321 824 HG11 VAL 103 1HG1 VAL 103 0.481 -16.551 9.450 825 HG12 VAL 103 2HG1 VAL 103 0.137 -18.151 8.793 826 HG13 VAL 103 3HG1 VAL 103 -0.992 -17.400 9.921 827 HG21 VAL 103 3HG2 VAL 103 -0.596 -15.149 6.393 828 HG22 VAL 103 1HG2 VAL 103 0.574 -16.462 6.530 829 HG23 VAL 103 2HG2 VAL 103 0.562 -15.162 7.722 830 H SER 104 H SER 104 -3.922 -17.631 8.284 831 HA SER 104 HA SER 104 -3.479 -19.946 10.002 832 HB2 SER 104 2HB SER 104 -5.498 -17.822 9.528 833 HB3 SER 104 1HB SER 104 -6.075 -19.296 10.300 834 HG SER 104 HG SER 104 -5.279 -18.402 12.035 835 H GLU 105 H GLU 105 -5.070 -19.292 7.006 836 HA GLU 105 HA GLU 105 -5.752 -22.187 6.740 837 HB2 GLU 105 2HB GLU 105 -7.685 -19.995 5.970 838 HB3 GLU 105 1HB GLU 105 -8.022 -21.704 6.237 839 HG2 GLU 105 2HG GLU 105 -7.089 -19.820 8.419 840 HG3 GLU 105 1HG GLU 105 -8.783 -20.194 8.109 841 H GLY 106 H GLY 106 -5.367 -19.015 5.200 842 HA2 GLY 106 2HA GLY 106 -4.015 -18.831 3.151 843 HA3 GLY 106 1HA GLY 106 -4.579 -20.438 2.694 844 H SER 107 H SER 107 -6.895 -18.260 4.076 845 HA SER 107 HA SER 107 -8.150 -17.915 1.364 846 HB2 SER 107 2HB SER 107 -9.793 -17.424 3.722 847 HB3 SER 107 1HB SER 107 -10.077 -18.525 2.379 848 HG SER 107 HG SER 107 -9.708 -19.921 3.955 849 H ASP 108 H ASP 108 -8.391 -15.868 0.638 850 HA ASP 108 HA ASP 108 -7.651 -13.631 2.481 851 HB2 ASP 108 2HB ASP 108 -7.247 -12.432 0.386 852 HB3 ASP 108 1HB ASP 108 -6.466 -14.010 0.287 853 H ASP 109 H ASP 109 -10.316 -15.264 1.886 854 HA ASP 109 HA ASP 109 -12.137 -13.142 0.968 855 HB2 ASP 109 2HB ASP 109 -13.806 -14.906 1.253 856 HB3 ASP 109 1HB ASP 109 -12.373 -15.580 0.477 857 H ILE 110 H ILE 110 -11.533 -11.585 2.783 858 HA ILE 110 HA ILE 110 -12.818 -12.298 5.394 859 HB ILE 110 HB ILE 110 -11.523 -10.365 6.237 860 HG12 ILE 110 2HG1 ILE 110 -10.208 -10.126 3.547 861 HG13 ILE 110 1HG1 ILE 110 -11.704 -9.253 3.870 862 HG21 ILE 110 1HG2 ILE 110 -10.048 -12.441 4.626 863 HG22 ILE 110 2HG2 ILE 110 -10.301 -12.382 6.369 864 HG23 ILE 110 3HG2 ILE 110 -9.191 -11.250 5.600 865 HD11 ILE 110 3HD1 ILE 110 -10.729 -7.872 5.433 866 HD12 ILE 110 1HD1 ILE 110 -9.311 -8.194 4.435 867 HD13 ILE 110 2HD1 ILE 110 -9.557 -9.091 5.933 868 H GLY 111 H GLY 111 -14.109 -11.375 2.749 869 HA2 GLY 111 2HA GLY 111 -15.993 -10.047 2.249 870 HA3 GLY 111 1HA GLY 111 -16.006 -9.519 3.935 871 H GLU 112 H GLU 112 -12.960 -9.204 2.488 872 HA GLU 112 HA GLU 112 -12.500 -6.537 2.900 873 HB2 GLU 112 2HB GLU 112 -11.083 -6.801 0.685 874 HB3 GLU 112 1HB GLU 112 -10.690 -7.761 2.109 875 HG2 GLU 112 2HG GLU 112 -11.148 -9.678 1.021 876 HG3 GLU 112 1HG GLU 112 -12.727 -9.082 0.519 877 H ASN 113 H ASN 113 -13.741 -7.755 -0.254 878 HA ASN 113 HA ASN 113 -15.203 -6.682 -1.789 879 HB2 ASN 113 2HB ASN 113 -15.948 -5.826 0.731 880 HB3 ASN 113 1HB ASN 113 -15.628 -4.306 -0.107 881 HD21 ASN 113 1HD2 ASN 113 -18.281 -4.851 0.565 882 HD22 ASN 113 2HD2 ASN 113 -19.167 -5.239 -0.830 883 H ILE 114 H ILE 114 -13.116 -6.338 -2.975 884 HA ILE 114 HA ILE 114 -11.656 -3.846 -2.676 885 HB ILE 114 HB ILE 114 -11.770 -5.685 -5.076 886 HG12 ILE 114 2HG1 ILE 114 -11.442 -7.257 -3.367 887 HG13 ILE 114 1HG1 ILE 114 -9.786 -6.799 -3.761 888 HG21 ILE 114 1HG2 ILE 114 -9.166 -4.782 -4.224 889 HG22 ILE 114 2HG2 ILE 114 -10.249 -3.401 -4.406 890 HG23 ILE 114 3HG2 ILE 114 -9.988 -4.500 -5.759 891 HD11 ILE 114 3HD1 ILE 114 -9.772 -6.610 -1.433 892 HD12 ILE 114 1HD1 ILE 114 -11.443 -6.045 -1.372 893 HD13 ILE 114 2HD1 ILE 114 -10.164 -4.958 -1.914 894 H ASP 115 H ASP 115 -13.662 -5.041 -5.408 895 HA ASP 115 HA ASP 115 -13.915 -2.771 -6.944 896 HB2 ASP 115 2HB ASP 115 -16.035 -3.706 -7.630 897 HB3 ASP 115 1HB ASP 115 -14.995 -5.060 -7.190 898 H VAL 116 H VAL 116 -15.326 -3.440 -3.887 899 HA VAL 116 HA VAL 116 -16.890 -0.946 -3.789 900 HB VAL 116 HB VAL 116 -16.452 -3.300 -1.944 901 HG11 VAL 116 1HG1 VAL 116 -18.730 -1.562 -1.343 902 HG12 VAL 116 2HG1 VAL 116 -17.184 -0.738 -1.142 903 HG13 VAL 116 3HG1 VAL 116 -17.511 -2.228 -0.256 904 HG21 VAL 116 3HG2 VAL 116 -18.314 -4.189 -2.898 905 HG22 VAL 116 1HG2 VAL 116 -18.017 -3.040 -4.204 906 HG23 VAL 116 2HG2 VAL 116 -19.152 -2.637 -2.915 907 H PHE 117 H PHE 117 -14.345 -2.486 -1.914 908 HA PHE 117 HA PHE 117 -13.748 -0.293 -0.191 909 HB2 PHE 117 2HB PHE 117 -12.945 -2.552 0.214 910 HB3 PHE 117 1HB PHE 117 -12.050 -2.549 -1.306 911 HD1 PHE 117 1HD PHE 117 -12.302 -0.843 2.004 912 HD2 PHE 117 2HD PHE 117 -9.850 -1.682 -1.421 913 HE1 PHE 117 1HE PHE 117 -10.352 0.171 3.152 914 HE2 PHE 117 2HE PHE 117 -7.899 -0.668 -0.273 915 HZ PHE 117 HZ PHE 117 -8.150 0.259 2.013 916 H SER 118 H SER 118 -13.027 -0.835 -3.540 917 HA SER 118 HA SER 118 -10.923 1.197 -3.639 918 HB2 SER 118 2HB SER 118 -10.483 -0.575 -5.098 919 HB3 SER 118 1HB SER 118 -12.191 -0.830 -5.438 920 HG SER 118 HG SER 118 -12.159 1.092 -6.656 921 H ASP 119 H ASP 119 -14.180 0.604 -4.777 922 HA ASP 119 HA ASP 119 -14.559 3.175 -6.022 923 HB2 ASP 119 2HB ASP 119 -15.953 1.309 -6.639 924 HB3 ASP 119 1HB ASP 119 -16.407 1.026 -4.958 925 H THR 120 H THR 120 -14.727 1.967 -2.829 926 HA THR 120 HA THR 120 -16.271 4.105 -1.638 927 HB THR 120 HB THR 120 -14.676 1.732 -0.875 928 HG1 THR 120 1HG THR 120 -16.567 1.225 -0.160 929 HG21 THR 120 3HG2 THR 120 -15.015 4.037 1.063 930 HG22 THR 120 1HG2 THR 120 -13.488 3.394 0.458 931 HG23 THR 120 2HG2 THR 120 -14.505 2.407 1.508 932 H ILE 121 H ILE 121 -12.914 3.341 -2.067 933 HA ILE 121 HA ILE 121 -11.909 5.813 -0.874 934 HB ILE 121 HB ILE 121 -11.054 3.186 -1.686 935 HG12 ILE 121 2HG1 ILE 121 -9.865 5.413 -0.030 936 HG13 ILE 121 1HG1 ILE 121 -10.757 3.997 0.530 937 HG21 ILE 121 1HG2 ILE 121 -8.788 3.746 -2.507 938 HG22 ILE 121 2HG2 ILE 121 -9.261 5.442 -2.618 939 HG23 ILE 121 3HG2 ILE 121 -10.046 4.236 -3.641 940 HD11 ILE 121 3HD1 ILE 121 -7.924 4.229 -0.329 941 HD12 ILE 121 1HD1 ILE 121 -8.775 2.772 -0.845 942 HD13 ILE 121 2HD1 ILE 121 -8.654 3.161 0.871 943 H LYS 122 H LYS 122 -12.246 4.457 -4.162 944 HA LYS 122 HA LYS 122 -11.002 6.639 -5.549 945 HB2 LYS 122 2HB LYS 122 -12.610 4.213 -6.075 946 HB3 LYS 122 1HB LYS 122 -12.796 5.485 -7.284 947 HG2 LYS 122 2HG LYS 122 -10.806 4.918 -8.167 948 HG3 LYS 122 1HG LYS 122 -10.037 5.351 -6.640 949 HD2 LYS 122 2HD LYS 122 -11.316 2.815 -6.309 950 HD3 LYS 122 1HD LYS 122 -10.328 2.754 -7.769 951 HE2 LYS 122 2HE LYS 122 -8.616 4.051 -6.084 952 HE3 LYS 122 1HE LYS 122 -9.479 3.002 -4.940 953 HZ1 LYS 122 3HZ LYS 122 -7.940 1.533 -5.747 954 HZ2 LYS 122 1HZ LYS 122 -7.858 2.268 -7.273 955 HZ3 LYS 122 2HZ LYS 122 -9.184 1.282 -6.876 956 H SER 123 H SER 123 -14.248 5.982 -4.394 957 HA SER 123 HA SER 123 -15.362 8.377 -5.698 958 HB2 SER 123 2HB SER 123 -16.473 6.085 -5.308 959 HB3 SER 123 1HB SER 123 -16.622 6.592 -3.629 960 HG SER 123 HG SER 123 -17.480 8.258 -5.736 961 H PHE 124 H PHE 124 -13.724 7.545 -2.868 962 HA PHE 124 HA PHE 124 -14.947 9.457 -1.044 963 HB2 PHE 124 2HB PHE 124 -13.008 7.369 -1.035 964 HB3 PHE 124 1HB PHE 124 -12.219 8.818 -0.412 965 HD1 PHE 124 1HD PHE 124 -15.625 7.248 -0.155 966 HD2 PHE 124 2HD PHE 124 -12.311 9.050 1.901 967 HE1 PHE 124 1HE PHE 124 -16.815 6.976 2.003 968 HE2 PHE 124 2HE PHE 124 -13.502 8.777 4.060 969 HZ PHE 124 HZ PHE 124 -15.755 7.740 4.110 970 H ALA 125 H ALA 125 -13.147 9.821 -3.794 971 HA ALA 125 HA ALA 125 -12.790 12.620 -3.603 972 HB1 ALA 125 1HB ALA 125 -10.186 12.430 -3.226 973 HB2 ALA 125 2HB ALA 125 -10.608 10.899 -2.458 974 HB3 ALA 125 3HB ALA 125 -11.271 12.410 -1.836 975 H SER 126 H SER 126 -13.454 12.081 -5.843 976 HA SER 126 HA SER 126 -11.240 12.095 -7.696 977 HB2 SER 126 2HB SER 126 -11.520 9.668 -6.702 978 HB3 SER 126 1HB SER 126 -12.871 9.572 -7.828 979 HG SER 126 HG SER 126 -11.312 9.042 -9.161 980 H SER 127 H SER 127 -12.676 13.915 -8.325 981 HA SER 127 HA SER 127 -14.914 12.987 -10.091 982 HB2 SER 127 2HB SER 127 -15.396 14.068 -7.718 983 HB3 SER 127 1HB SER 127 -15.055 15.572 -8.570 984 HG SER 127 HG SER 127 -16.637 14.882 -10.130 985 H GLY 128 H GLY 128 -11.978 14.080 -10.342 986 HA2 GLY 128 2HA GLY 128 -10.821 15.530 -11.785 987 HA3 GLY 128 1HA GLY 128 -12.227 15.355 -12.837 988 H LYS 129 H LYS 129 -10.847 17.281 -10.218 989 HA LYS 129 HA LYS 129 -11.195 19.562 -9.691 990 HB2 LYS 129 2HB LYS 129 -11.322 19.347 -12.376 991 HB3 LYS 129 1HB LYS 129 -12.972 19.886 -12.061 992 HG2 LYS 129 2HG LYS 129 -11.669 21.617 -10.474 993 HG3 LYS 129 1HG LYS 129 -10.396 21.332 -11.661 994 HD2 LYS 129 2HD LYS 129 -13.132 21.804 -12.731 995 HD3 LYS 129 1HD LYS 129 -12.312 23.194 -12.019 996 HE2 LYS 129 2HE LYS 129 -10.992 21.402 -14.083 997 HE3 LYS 129 1HE LYS 129 -11.879 22.881 -14.506 998 HZ1 LYS 129 3HZ LYS 129 -9.461 22.600 -12.830 999 HZ2 LYS 129 1HZ LYS 129 -10.474 23.951 -12.676 1000 HZ3 LYS 129 2HZ LYS 129 -9.715 23.626 -14.160 1001 H GLU 130 H GLU 130 -13.395 21.173 -9.833 1002 HA GLU 130 HA GLU 130 -15.267 19.863 -8.013 1003 HB2 GLU 130 2HB GLU 130 -16.311 22.159 -8.099 1004 HB3 GLU 130 1HB GLU 130 -14.593 22.175 -7.695 1005 HG2 GLU 130 2HG GLU 130 -14.983 22.249 -10.572 1006 HG3 GLU 130 1HG GLU 130 -15.834 23.579 -9.787 1007 H LYS 131 H LYS 131 -16.733 18.448 -8.931 1008 HA LYS 131 HA LYS 131 -18.712 19.441 -10.812 1009 HB2 LYS 131 2HB LYS 131 -16.799 19.125 -12.318 1010 HB3 LYS 131 1HB LYS 131 -16.596 17.470 -11.740 1011 HG2 LYS 131 2HG LYS 131 -18.972 17.021 -12.519 1012 HG3 LYS 131 1HG LYS 131 -18.925 18.597 -13.312 1013 HD2 LYS 131 2HD LYS 131 -16.697 17.719 -14.366 1014 HD3 LYS 131 1HD LYS 131 -17.319 16.128 -13.928 1015 HE2 LYS 131 2HE LYS 131 -18.724 16.152 -15.705 1016 HE3 LYS 131 1HE LYS 131 -19.411 17.701 -15.177 1017 HZ1 LYS 131 3HZ LYS 131 -18.367 18.275 -17.145 1018 HZ2 LYS 131 1HZ LYS 131 -17.071 17.209 -16.901 1019 HZ3 LYS 131 2HZ LYS 131 -17.170 18.644 -15.998 1020 H LEU 132 H LEU 132 -20.525 18.376 -10.144 1021 HA LEU 132 HA LEU 132 -20.325 15.851 -8.645 1022 HB2 LEU 132 2HB LEU 132 -22.201 18.055 -9.105 1023 HB3 LEU 132 1HB LEU 132 -22.999 16.482 -9.066 1024 HG LEU 132 HG LEU 132 -21.051 17.439 -6.952 1025 HD11 LEU 132 1HD1 LEU 132 -22.852 18.848 -6.556 1026 HD12 LEU 132 2HD1 LEU 132 -23.361 17.427 -5.642 1027 HD13 LEU 132 3HD1 LEU 132 -24.018 17.722 -7.252 1028 HD21 LEU 132 3HD2 LEU 132 -21.781 15.514 -5.714 1029 HD22 LEU 132 1HD2 LEU 132 -21.400 14.943 -7.338 1030 HD23 LEU 132 2HD2 LEU 132 -23.081 15.191 -6.861 1031 H GLU 133 H GLU 133 -20.903 13.836 -9.452 1032 HA GLU 133 HA GLU 133 -21.600 13.702 -12.354 1033 HB2 GLU 133 2HB GLU 133 -19.580 12.563 -11.017 1034 HB3 GLU 133 1HB GLU 133 -20.807 11.335 -10.707 1035 HG2 GLU 133 2HG GLU 133 -21.017 10.777 -12.956 1036 HG3 GLU 133 1HG GLU 133 -20.459 12.358 -13.505 Start of MODEL 7 1 H1 MET 1 1HT MET 1 7.875 -30.512 0.838 2 H2 MET 1 2HT MET 1 6.431 -30.663 -0.044 3 H3 MET 1 3HT MET 1 6.771 -29.226 0.795 4 HA MET 1 HA MET 1 8.738 -28.895 -0.681 5 HB2 MET 1 2HB MET 1 8.885 -30.386 -2.609 6 HB3 MET 1 1HB MET 1 8.854 -31.360 -1.138 7 HG2 MET 1 2HG MET 1 6.159 -30.821 -2.064 8 HG3 MET 1 1HG MET 1 7.116 -31.580 -3.337 9 HE1 MET 1 2HE MET 1 4.773 -34.146 -1.269 10 HE2 MET 1 3HE MET 1 4.736 -32.877 -2.490 11 HE3 MET 1 1HE MET 1 4.646 -32.460 -0.774 12 H MET 2 H MET 2 8.376 -27.780 -2.811 13 HA MET 2 HA MET 2 7.098 -26.321 -4.161 14 HB2 MET 2 2HB MET 2 5.065 -28.509 -3.607 15 HB3 MET 2 1HB MET 2 4.966 -27.336 -4.920 16 HG2 MET 2 2HG MET 2 7.478 -28.932 -4.672 17 HG3 MET 2 1HG MET 2 6.044 -29.748 -5.294 18 HE1 MET 2 3HE MET 2 8.882 -26.898 -7.045 19 HE2 MET 2 1HE MET 2 9.030 -28.646 -7.270 20 HE3 MET 2 2HE MET 2 8.893 -27.972 -5.649 21 H GLU 3 H GLU 3 7.248 -25.184 -1.780 22 HA GLU 3 HA GLU 3 4.668 -23.904 -1.381 23 HB2 GLU 3 2HB GLU 3 4.552 -24.672 1.028 24 HB3 GLU 3 1HB GLU 3 4.256 -25.944 -0.160 25 HG2 GLU 3 2HG GLU 3 6.719 -26.514 -0.013 26 HG3 GLU 3 1HG GLU 3 6.821 -25.405 1.356 27 H GLU 4 H GLU 4 7.868 -24.535 -0.159 28 HA GLU 4 HA GLU 4 8.346 -22.507 1.630 29 HB2 GLU 4 2HB GLU 4 10.676 -22.558 0.743 30 HB3 GLU 4 1HB GLU 4 9.994 -24.176 0.911 31 HG2 GLU 4 2HG GLU 4 9.298 -24.018 -1.522 32 HG3 GLU 4 1HG GLU 4 10.267 -22.547 -1.625 33 H TYR 5 H TYR 5 8.157 -22.259 -1.827 34 HA TYR 5 HA TYR 5 9.034 -19.689 -2.373 35 HB2 TYR 5 2HB TYR 5 6.829 -21.430 -3.397 36 HB3 TYR 5 1HB TYR 5 6.955 -19.783 -4.018 37 HD1 TYR 5 1HD TYR 5 9.668 -19.155 -4.350 38 HD2 TYR 5 2HD TYR 5 7.808 -22.999 -4.809 39 HE1 TYR 5 1HE TYR 5 11.507 -19.864 -5.856 40 HE2 TYR 5 2HE TYR 5 9.647 -23.708 -6.315 41 HH TYR 5 HH TYR 5 11.439 -22.081 -7.923 42 H LEU 6 H LEU 6 6.009 -20.651 -0.930 43 HA LEU 6 HA LEU 6 4.955 -17.918 -0.790 44 HB2 LEU 6 2HB LEU 6 3.023 -18.983 0.046 45 HB3 LEU 6 1HB LEU 6 3.726 -20.215 -1.000 46 HG LEU 6 HG LEU 6 5.001 -20.862 1.262 47 HD11 LEU 6 1HD1 LEU 6 2.352 -20.121 2.431 48 HD12 LEU 6 2HD1 LEU 6 3.564 -18.850 2.275 49 HD13 LEU 6 3HD1 LEU 6 3.918 -20.295 3.223 50 HD21 LEU 6 3HD2 LEU 6 2.103 -21.648 0.914 51 HD22 LEU 6 1HD2 LEU 6 3.437 -22.641 1.499 52 HD23 LEU 6 2HD2 LEU 6 3.353 -22.192 -0.204 53 H GLY 7 H GLY 7 6.745 -20.124 1.272 54 HA2 GLY 7 2HA GLY 7 6.296 -19.007 3.813 55 HA3 GLY 7 1HA GLY 7 7.827 -19.734 3.322 56 H VAL 8 H VAL 8 8.797 -18.047 1.431 57 HA VAL 8 HA VAL 8 9.559 -15.714 3.007 58 HB VAL 8 HB VAL 8 10.179 -16.693 0.213 59 HG11 VAL 8 1HG1 VAL 8 10.391 -14.173 0.581 60 HG12 VAL 8 2HG1 VAL 8 11.859 -15.001 0.057 61 HG13 VAL 8 3HG1 VAL 8 11.657 -14.548 1.750 62 HG21 VAL 8 3HG2 VAL 8 11.850 -16.666 2.745 63 HG22 VAL 8 1HG2 VAL 8 12.303 -17.381 1.197 64 HG23 VAL 8 2HG2 VAL 8 10.982 -18.076 2.137 65 H PHE 9 H PHE 9 7.420 -16.414 0.393 66 HA PHE 9 HA PHE 9 6.987 -13.744 -0.586 67 HB2 PHE 9 2HB PHE 9 6.040 -16.422 -0.984 68 HB3 PHE 9 1HB PHE 9 4.642 -15.360 -0.827 69 HD1 PHE 9 1HD PHE 9 5.084 -12.951 -2.068 70 HD2 PHE 9 2HD PHE 9 6.809 -16.731 -3.156 71 HE1 PHE 9 1HE PHE 9 5.454 -12.120 -4.375 72 HE2 PHE 9 2HE PHE 9 7.180 -15.900 -5.461 73 HZ PHE 9 HZ PHE 9 6.502 -13.594 -6.072 74 H VAL 10 H VAL 10 5.638 -15.602 2.093 75 HA VAL 10 HA VAL 10 3.595 -13.540 2.669 76 HB VAL 10 HB VAL 10 4.417 -16.140 4.009 77 HG11 VAL 10 1HG1 VAL 10 3.344 -14.919 5.712 78 HG12 VAL 10 2HG1 VAL 10 2.022 -15.835 4.987 79 HG13 VAL 10 3HG1 VAL 10 2.242 -14.133 4.580 80 HG21 VAL 10 3HG2 VAL 10 2.303 -16.970 2.981 81 HG22 VAL 10 1HG2 VAL 10 3.475 -16.453 1.768 82 HG23 VAL 10 2HG2 VAL 10 2.110 -15.413 2.174 83 H ASP 11 H ASP 11 6.645 -14.785 4.052 84 HA ASP 11 HA ASP 11 6.574 -13.173 6.433 85 HB2 ASP 11 2HB ASP 11 8.350 -14.980 5.008 86 HB3 ASP 11 1HB ASP 11 9.247 -13.628 5.697 87 H GLU 12 H GLU 12 7.220 -12.512 3.159 88 HA GLU 12 HA GLU 12 8.680 -9.993 3.686 89 HB2 GLU 12 2HB GLU 12 7.785 -11.548 1.247 90 HB3 GLU 12 1HB GLU 12 8.518 -9.949 1.113 91 HG2 GLU 12 2HG GLU 12 9.948 -11.885 2.848 92 HG3 GLU 12 1HG GLU 12 9.963 -12.241 1.120 93 H THR 13 H THR 13 5.657 -11.012 2.048 94 HA THR 13 HA THR 13 4.533 -8.514 1.509 95 HB THR 13 HB THR 13 3.751 -10.968 1.081 96 HG1 THR 13 1HG THR 13 1.847 -8.990 1.785 97 HG21 THR 13 3HG2 THR 13 1.860 -10.531 3.335 98 HG22 THR 13 1HG2 THR 13 3.478 -11.088 3.754 99 HG23 THR 13 2HG2 THR 13 2.477 -12.038 2.659 100 H LYS 14 H LYS 14 4.853 -10.151 4.608 101 HA LYS 14 HA LYS 14 3.066 -8.308 6.030 102 HB2 LYS 14 2HB LYS 14 5.017 -10.503 6.769 103 HB3 LYS 14 1HB LYS 14 4.189 -9.549 8.000 104 HG2 LYS 14 2HG LYS 14 2.165 -10.524 7.587 105 HG3 LYS 14 1HG LYS 14 2.462 -10.636 5.851 106 HD2 LYS 14 2HD LYS 14 3.108 -12.781 6.053 107 HD3 LYS 14 1HD LYS 14 4.318 -12.336 7.257 108 HE2 LYS 14 2HE LYS 14 2.191 -12.172 8.851 109 HE3 LYS 14 1HE LYS 14 1.516 -13.310 7.667 110 HZ1 LYS 14 3HZ LYS 14 3.019 -14.151 9.640 111 HZ2 LYS 14 1HZ LYS 14 4.270 -13.728 8.575 112 HZ3 LYS 14 2HZ LYS 14 3.102 -14.868 8.101 113 H GLU 15 H GLU 15 6.601 -8.939 6.091 114 HA GLU 15 HA GLU 15 7.268 -6.659 7.657 115 HB2 GLU 15 2HB GLU 15 8.865 -8.110 5.528 116 HB3 GLU 15 1HB GLU 15 9.538 -7.132 6.833 117 HG2 GLU 15 2HG GLU 15 7.671 -9.272 7.677 118 HG3 GLU 15 1HG GLU 15 9.206 -9.823 7.005 119 H TYR 16 H TYR 16 6.159 -6.913 4.472 120 HA TYR 16 HA TYR 16 7.401 -4.398 3.562 121 HB2 TYR 16 2HB TYR 16 6.089 -6.745 2.409 122 HB3 TYR 16 1HB TYR 16 5.515 -5.242 1.686 123 HD1 TYR 16 1HD TYR 16 7.672 -3.450 1.544 124 HD2 TYR 16 2HD TYR 16 7.792 -7.726 1.154 125 HE1 TYR 16 1HE TYR 16 9.764 -3.271 0.225 126 HE2 TYR 16 2HE TYR 16 9.884 -7.546 -0.166 127 HH TYR 16 HH TYR 16 11.374 -6.181 -1.071 128 H LEU 17 H LEU 17 4.351 -5.570 4.852 129 HA LEU 17 HA LEU 17 2.874 -3.149 4.075 130 HB2 LEU 17 2HB LEU 17 1.042 -4.262 5.052 131 HB3 LEU 17 1HB LEU 17 2.054 -5.618 4.561 132 HG LEU 17 HG LEU 17 3.091 -5.399 6.938 133 HD11 LEU 17 1HD1 LEU 17 2.255 -3.684 8.145 134 HD12 LEU 17 2HD1 LEU 17 0.768 -4.625 8.274 135 HD13 LEU 17 3HD1 LEU 17 0.945 -3.427 6.992 136 HD21 LEU 17 3HD2 LEU 17 0.949 -6.880 5.855 137 HD22 LEU 17 1HD2 LEU 17 0.413 -6.366 7.455 138 HD23 LEU 17 2HD2 LEU 17 1.907 -7.287 7.279 139 H GLN 18 H GLN 18 4.678 -4.437 6.766 140 HA GLN 18 HA GLN 18 4.079 -2.344 8.682 141 HB2 GLN 18 2HB GLN 18 6.580 -4.001 8.465 142 HB3 GLN 18 1HB GLN 18 5.793 -3.430 9.938 143 HG2 GLN 18 2HG GLN 18 3.898 -4.970 8.523 144 HG3 GLN 18 1HG GLN 18 5.408 -5.875 8.508 145 HE21 GLN 18 1HE2 GLN 18 5.787 -7.111 10.356 146 HE22 GLN 18 2HE2 GLN 18 5.075 -6.839 11.872 147 H ASN 19 H ASN 19 6.699 -3.158 6.539 148 HA ASN 19 HA ASN 19 8.252 -0.806 6.977 149 HB2 ASN 19 2HB ASN 19 9.368 -2.656 6.019 150 HB3 ASN 19 1HB ASN 19 8.065 -2.944 4.865 151 HD21 ASN 19 1HD2 ASN 19 10.782 -0.734 5.598 152 HD22 ASN 19 2HD2 ASN 19 10.923 -0.124 4.020 153 H LEU 20 H LEU 20 5.530 -1.578 5.048 154 HA LEU 20 HA LEU 20 5.660 0.929 3.490 155 HB2 LEU 20 2HB LEU 20 4.945 -1.097 2.352 156 HB3 LEU 20 1HB LEU 20 3.750 -1.421 3.608 157 HG LEU 20 HG LEU 20 2.555 0.661 3.000 158 HD11 LEU 20 1HD1 LEU 20 4.361 0.833 0.589 159 HD12 LEU 20 2HD1 LEU 20 4.734 1.707 2.074 160 HD13 LEU 20 3HD1 LEU 20 3.236 2.042 1.206 161 HD21 LEU 20 3HD2 LEU 20 2.381 -1.707 1.764 162 HD22 LEU 20 1HD2 LEU 20 2.920 -0.744 0.389 163 HD23 LEU 20 2HD2 LEU 20 1.432 -0.318 1.234 164 H ASN 21 H ASN 21 4.648 -0.061 6.521 165 HA ASN 21 HA ASN 21 2.356 1.799 6.650 166 HB2 ASN 21 2HB ASN 21 3.399 -0.523 8.134 167 HB3 ASN 21 1HB ASN 21 2.840 0.795 9.169 168 HD21 ASN 21 1HD2 ASN 21 0.698 1.799 7.594 169 HD22 ASN 21 2HD2 ASN 21 -0.505 0.609 7.479 170 H ASP 22 H ASP 22 5.591 1.183 7.666 171 HA ASP 22 HA ASP 22 5.857 3.422 9.392 172 HB2 ASP 22 2HB ASP 22 7.560 1.389 8.117 173 HB3 ASP 22 1HB ASP 22 8.387 2.914 8.436 174 H THR 23 H THR 23 6.152 2.805 6.059 175 HA THR 23 HA THR 23 7.265 5.337 5.185 176 HB THR 23 HB THR 23 5.577 3.171 3.916 177 HG1 THR 23 1HG THR 23 8.298 3.532 3.409 178 HG21 THR 23 3HG2 THR 23 7.340 5.172 2.488 179 HG22 THR 23 1HG2 THR 23 5.613 5.432 2.732 180 HG23 THR 23 2HG2 THR 23 6.172 4.060 1.777 181 H LEU 24 H LEU 24 4.018 3.892 5.359 182 HA LEU 24 HA LEU 24 2.605 6.238 4.411 183 HB2 LEU 24 2HB LEU 24 2.074 3.529 5.487 184 HB3 LEU 24 1HB LEU 24 0.803 4.710 5.806 185 HG LEU 24 HG LEU 24 1.931 4.645 3.048 186 HD11 LEU 24 1HD1 LEU 24 0.563 2.373 4.375 187 HD12 LEU 24 2HD1 LEU 24 1.614 2.382 2.958 188 HD13 LEU 24 3HD1 LEU 24 -0.083 2.836 2.800 189 HD21 LEU 24 3HD2 LEU 24 -0.955 4.714 3.934 190 HD22 LEU 24 1HD2 LEU 24 -0.240 5.383 2.467 191 HD23 LEU 24 2HD2 LEU 24 0.055 6.156 4.024 192 H LEU 25 H LEU 25 3.692 4.980 7.508 193 HA LEU 25 HA LEU 25 2.092 6.856 9.096 194 HB2 LEU 25 2HB LEU 25 4.445 5.037 9.652 195 HB3 LEU 25 1HB LEU 25 3.636 5.978 10.912 196 HG LEU 25 HG LEU 25 2.009 4.293 9.056 197 HD11 LEU 25 1HD1 LEU 25 3.919 2.913 10.031 198 HD12 LEU 25 2HD1 LEU 25 2.297 2.340 10.419 199 HD13 LEU 25 3HD1 LEU 25 3.226 3.237 11.620 200 HD21 LEU 25 3HD2 LEU 25 0.370 4.570 10.658 201 HD22 LEU 25 1HD2 LEU 25 1.313 6.026 10.982 202 HD23 LEU 25 2HD2 LEU 25 1.529 4.592 11.989 203 H GLU 26 H GLU 26 4.951 7.013 7.321 204 HA GLU 26 HA GLU 26 5.940 9.380 8.788 205 HB2 GLU 26 2HB GLU 26 6.992 7.623 6.554 206 HB3 GLU 26 1HB GLU 26 7.809 9.110 7.040 207 HG2 GLU 26 2HG GLU 26 7.093 7.103 9.146 208 HG3 GLU 26 1HG GLU 26 8.497 6.797 8.122 209 H LEU 27 H LEU 27 4.415 8.214 5.963 210 HA LEU 27 HA LEU 27 4.472 10.638 4.472 211 HB2 LEU 27 2HB LEU 27 4.165 8.573 3.307 212 HB3 LEU 27 1HB LEU 27 2.860 8.092 4.389 213 HG LEU 27 HG LEU 27 1.634 10.201 3.504 214 HD11 LEU 27 1HD1 LEU 27 3.895 10.878 2.345 215 HD12 LEU 27 2HD1 LEU 27 2.368 11.174 1.515 216 HD13 LEU 27 3HD1 LEU 27 3.354 9.779 1.078 217 HD21 LEU 27 3HD2 LEU 27 2.163 7.697 1.896 218 HD22 LEU 27 1HD2 LEU 27 0.970 8.895 1.394 219 HD23 LEU 27 2HD2 LEU 27 0.782 8.054 2.932 220 H GLU 28 H GLU 28 2.415 9.273 6.930 221 HA GLU 28 HA GLU 28 0.170 11.068 6.538 222 HB2 GLU 28 2HB GLU 28 -0.668 9.907 8.372 223 HB3 GLU 28 1HB GLU 28 0.524 8.764 7.768 224 HG2 GLU 28 2HG GLU 28 2.177 9.689 9.373 225 HG3 GLU 28 1HG GLU 28 0.914 10.725 10.034 226 H LYS 29 H LYS 29 3.095 11.045 8.548 227 HA LYS 29 HA LYS 29 2.419 13.582 9.843 228 HB2 LYS 29 2HB LYS 29 3.966 12.752 11.265 229 HB3 LYS 29 1HB LYS 29 4.141 11.379 10.184 230 HG2 LYS 29 2HG LYS 29 5.715 13.121 8.876 231 HG3 LYS 29 1HG LYS 29 5.898 13.755 10.515 232 HD2 LYS 29 2HD LYS 29 6.220 10.870 9.730 233 HD3 LYS 29 1HD LYS 29 7.565 11.988 9.948 234 HE2 LYS 29 2HE LYS 29 5.747 12.046 12.226 235 HE3 LYS 29 1HE LYS 29 6.396 10.418 11.944 236 HZ1 LYS 29 3HZ LYS 29 8.504 11.087 12.309 237 HZ2 LYS 29 1HZ LYS 29 7.768 12.327 13.199 238 HZ3 LYS 29 2HZ LYS 29 8.267 12.613 11.601 239 H ASN 30 H ASN 30 3.641 12.482 6.938 240 HA ASN 30 HA ASN 30 4.204 15.219 6.001 241 HB2 ASN 30 2HB ASN 30 6.259 13.031 6.332 242 HB3 ASN 30 1HB ASN 30 6.453 14.228 5.051 243 HD21 ASN 30 1HD2 ASN 30 5.496 16.555 6.339 244 HD22 ASN 30 2HD2 ASN 30 6.509 16.923 7.651 245 HA PRO 31 HA PRO 31 2.203 12.459 3.053 246 HB2 PRO 31 2HB PRO 31 -0.079 13.912 2.873 247 HB3 PRO 31 1HB PRO 31 0.222 12.731 4.155 248 HG2 PRO 31 2HG PRO 31 0.206 15.659 4.282 249 HG3 PRO 31 1HG PRO 31 -0.114 14.461 5.543 250 HD2 PRO 31 2HD PRO 31 2.275 15.908 5.121 251 HD3 PRO 31 1HD PRO 31 1.995 14.590 6.280 252 H GLU 32 H GLU 32 3.930 15.084 2.801 253 HA GLU 32 HA GLU 32 3.125 15.600 -0.024 254 HB2 GLU 32 2HB GLU 32 4.034 18.045 1.167 255 HB3 GLU 32 1HB GLU 32 2.443 17.694 0.500 256 HG2 GLU 32 2HG GLU 32 1.618 16.928 2.608 257 HG3 GLU 32 1HG GLU 32 3.245 16.861 3.293 258 H ASP 33 H ASP 33 5.455 14.579 2.003 259 HA ASP 33 HA ASP 33 7.797 16.013 1.268 260 HB2 ASP 33 2HB ASP 33 7.199 14.084 3.021 261 HB3 ASP 33 1HB ASP 33 7.873 13.073 1.743 262 H MET 34 H MET 34 5.822 13.881 -0.465 263 HA MET 34 HA MET 34 5.924 12.999 -2.630 264 HB2 MET 34 2HB MET 34 8.124 15.089 -2.731 265 HB3 MET 34 1HB MET 34 7.458 14.282 -4.150 266 HG2 MET 34 2HG MET 34 5.234 15.204 -2.686 267 HG3 MET 34 1HG MET 34 6.396 16.531 -2.675 268 HE1 MET 34 3HE MET 34 3.705 15.085 -5.898 269 HE2 MET 34 1HE MET 34 3.782 14.741 -4.164 270 HE3 MET 34 2HE MET 34 4.774 13.822 -5.293 271 H GLU 35 H GLU 35 7.990 12.309 -0.302 272 HA GLU 35 HA GLU 35 9.770 10.683 -2.047 273 HB2 GLU 35 2HB GLU 35 11.453 11.268 -0.614 274 HB3 GLU 35 1HB GLU 35 10.340 12.471 0.027 275 HG2 GLU 35 2HG GLU 35 9.504 10.734 1.646 276 HG3 GLU 35 1HG GLU 35 10.781 9.660 1.074 277 H LEU 36 H LEU 36 7.562 10.739 0.691 278 HA LEU 36 HA LEU 36 7.681 7.830 1.096 279 HB2 LEU 36 2HB LEU 36 5.617 9.887 1.977 280 HB3 LEU 36 1HB LEU 36 5.866 8.288 2.677 281 HG LEU 36 HG LEU 36 8.360 9.671 2.677 282 HD11 LEU 36 1HD1 LEU 36 6.755 11.674 2.599 283 HD12 LEU 36 2HD1 LEU 36 7.905 11.636 3.935 284 HD13 LEU 36 3HD1 LEU 36 6.229 11.163 4.203 285 HD21 LEU 36 3HD2 LEU 36 7.261 7.829 4.189 286 HD22 LEU 36 1HD2 LEU 36 6.666 9.211 5.108 287 HD23 LEU 36 2HD2 LEU 36 8.400 8.969 4.902 288 H ILE 37 H ILE 37 5.923 10.182 -0.790 289 HA ILE 37 HA ILE 37 3.711 8.461 -1.541 290 HB ILE 37 HB ILE 37 4.998 10.971 -2.648 291 HG12 ILE 37 2HG1 ILE 37 2.296 10.531 -1.346 292 HG13 ILE 37 1HG1 ILE 37 3.740 10.998 -0.445 293 HG21 ILE 37 1HG2 ILE 37 4.009 10.092 -4.585 294 HG22 ILE 37 2HG2 ILE 37 2.707 11.072 -3.908 295 HG23 ILE 37 3HG2 ILE 37 2.702 9.323 -3.683 296 HD11 ILE 37 3HD1 ILE 37 2.277 12.557 -2.575 297 HD12 ILE 37 1HD1 ILE 37 3.946 12.931 -2.143 298 HD13 ILE 37 2HD1 ILE 37 2.673 13.054 -0.929 299 H ASN 38 H ASN 38 7.025 8.915 -2.634 300 HA ASN 38 HA ASN 38 6.533 7.377 -5.102 301 HB2 ASN 38 2HB ASN 38 8.597 9.136 -3.959 302 HB3 ASN 38 1HB ASN 38 9.244 7.787 -4.896 303 HD21 ASN 38 1HD2 ASN 38 9.914 9.448 -6.541 304 HD22 ASN 38 2HD2 ASN 38 8.758 10.049 -7.629 305 H GLU 39 H GLU 39 8.252 7.014 -2.057 306 HA GLU 39 HA GLU 39 9.275 4.377 -2.708 307 HB2 GLU 39 2HB GLU 39 10.129 4.435 -0.494 308 HB3 GLU 39 1HB GLU 39 10.095 6.130 -0.974 309 HG2 GLU 39 2HG GLU 39 7.807 6.286 0.097 310 HG3 GLU 39 1HG GLU 39 8.077 4.669 0.746 311 H ALA 40 H ALA 40 6.306 5.648 -1.663 312 HA ALA 40 HA ALA 40 5.293 3.101 -0.556 313 HB1 ALA 40 1HB ALA 40 3.978 5.792 -1.061 314 HB2 ALA 40 2HB ALA 40 4.781 5.329 0.439 315 HB3 ALA 40 3HB ALA 40 3.320 4.486 -0.073 316 H PHE 41 H PHE 41 4.579 5.317 -3.316 317 HA PHE 41 HA PHE 41 2.527 3.820 -4.540 318 HB2 PHE 41 2HB PHE 41 3.056 5.952 -5.416 319 HB3 PHE 41 1HB PHE 41 4.778 5.581 -5.516 320 HD1 PHE 41 1HD PHE 41 5.616 3.999 -7.261 321 HD2 PHE 41 2HD PHE 41 1.548 5.373 -7.186 322 HE1 PHE 41 1HE PHE 41 5.322 3.250 -9.607 323 HE2 PHE 41 2HE PHE 41 1.253 4.626 -9.533 324 HZ PHE 41 HZ PHE 41 3.140 3.564 -10.743 325 H ARG 42 H ARG 42 6.032 3.304 -4.567 326 HA ARG 42 HA ARG 42 5.997 1.210 -6.589 327 HB2 ARG 42 2HB ARG 42 7.960 2.183 -4.499 328 HB3 ARG 42 1HB ARG 42 8.350 0.893 -5.637 329 HG2 ARG 42 2HG ARG 42 7.931 2.392 -7.527 330 HG3 ARG 42 1HG ARG 42 7.452 3.682 -6.422 331 HD2 ARG 42 2HD ARG 42 9.713 3.678 -5.421 332 HD3 ARG 42 1HD ARG 42 10.202 2.391 -6.540 333 HE ARG 42 HE ARG 42 9.738 5.201 -7.259 334 HH11 ARG 42 1HH1 ARG 42 11.929 3.357 -8.300 335 HH12 ARG 42 2HH1 ARG 42 11.408 3.104 -9.932 336 HH21 ARG 42 1HH2 ARG 42 8.188 4.259 -9.361 337 HH22 ARG 42 2HH2 ARG 42 9.290 3.617 -10.533 338 H ALA 43 H ALA 43 6.834 1.034 -3.104 339 HA ALA 43 HA ALA 43 6.849 -1.688 -2.674 340 HB1 ALA 43 1HB ALA 43 7.170 -0.650 -0.680 341 HB2 ALA 43 2HB ALA 43 5.416 -0.710 -0.507 342 HB3 ALA 43 3HB ALA 43 6.189 0.735 -1.158 343 H LEU 44 H LEU 44 3.880 0.318 -2.690 344 HA LEU 44 HA LEU 44 2.045 -1.822 -2.252 345 HB2 LEU 44 2HB LEU 44 1.911 0.875 -3.613 346 HB3 LEU 44 1HB LEU 44 0.483 -0.143 -3.415 347 HG LEU 44 HG LEU 44 2.249 0.504 -1.064 348 HD11 LEU 44 1HD1 LEU 44 -0.040 2.151 -2.178 349 HD12 LEU 44 2HD1 LEU 44 1.640 2.663 -2.015 350 HD13 LEU 44 3HD1 LEU 44 0.662 2.376 -0.575 351 HD21 LEU 44 3HD2 LEU 44 0.731 -1.092 -0.375 352 HD22 LEU 44 1HD2 LEU 44 -0.467 -0.623 -1.581 353 HD23 LEU 44 2HD2 LEU 44 -0.257 0.347 -0.123 354 H HIS 45 H HIS 45 3.403 -0.450 -5.245 355 HA HIS 45 HA HIS 45 1.878 -2.064 -7.076 356 HB2 HIS 45 2HB HIS 45 3.946 -0.078 -7.060 357 HB3 HIS 45 1HB HIS 45 4.482 -1.415 -8.077 358 HD1 HIS 45 1HD HIS 45 4.094 0.418 -10.061 359 HD2 HIS 45 2HD HIS 45 0.664 -1.030 -8.185 360 HE1 HIS 45 1HE HIS 45 2.152 0.975 -11.589 361 H THR 46 H THR 46 4.879 -2.509 -5.290 362 HA THR 46 HA THR 46 5.551 -5.037 -6.620 363 HB THR 46 HB THR 46 6.746 -3.042 -4.895 364 HG1 THR 46 1HG THR 46 7.698 -3.700 -6.769 365 HG21 THR 46 3HG2 THR 46 6.478 -4.526 -3.014 366 HG22 THR 46 1HG2 THR 46 8.158 -4.647 -3.541 367 HG23 THR 46 2HG2 THR 46 7.008 -5.915 -3.965 368 H LEU 47 H LEU 47 3.891 -3.912 -3.755 369 HA LEU 47 HA LEU 47 3.763 -6.504 -2.427 370 HB2 LEU 47 2HB LEU 47 2.956 -3.701 -2.055 371 HB3 LEU 47 1HB LEU 47 1.803 -4.855 -1.378 372 HG LEU 47 HG LEU 47 4.777 -5.034 -0.869 373 HD11 LEU 47 1HD1 LEU 47 3.417 -2.870 -0.091 374 HD12 LEU 47 2HD1 LEU 47 4.608 -3.634 0.962 375 HD13 LEU 47 3HD1 LEU 47 2.890 -3.964 1.188 376 HD21 LEU 47 3HD2 LEU 47 2.884 -5.991 1.146 377 HD22 LEU 47 1HD2 LEU 47 4.237 -6.834 0.392 378 HD23 LEU 47 2HD2 LEU 47 2.667 -6.791 -0.411 379 H LYS 48 H LYS 48 1.541 -4.510 -4.393 380 HA LYS 48 HA LYS 48 -0.671 -6.386 -4.220 381 HB2 LYS 48 2HB LYS 48 -1.704 -4.858 -5.764 382 HB3 LYS 48 1HB LYS 48 -0.718 -3.880 -4.678 383 HG2 LYS 48 2HG LYS 48 0.379 -3.060 -6.456 384 HG3 LYS 48 1HG LYS 48 0.967 -4.683 -6.819 385 HD2 LYS 48 2HD LYS 48 -1.829 -4.256 -7.603 386 HD3 LYS 48 1HD LYS 48 -0.697 -3.198 -8.448 387 HE2 LYS 48 2HE LYS 48 0.256 -5.977 -8.242 388 HE3 LYS 48 1HE LYS 48 -1.239 -5.804 -9.181 389 HZ1 LYS 48 3HZ LYS 48 1.395 -4.600 -9.650 390 HZ2 LYS 48 1HZ LYS 48 0.019 -3.713 -10.094 391 HZ3 LYS 48 2HZ LYS 48 0.291 -5.250 -10.768 392 H GLY 49 H GLY 49 2.194 -6.135 -6.177 393 HA2 GLY 49 2HA GLY 49 1.121 -7.865 -8.310 394 HA3 GLY 49 1HA GLY 49 2.758 -7.213 -8.234 395 H MET 50 H MET 50 2.973 -8.143 -5.369 396 HA MET 50 HA MET 50 4.100 -10.766 -5.935 397 HB2 MET 50 2HB MET 50 3.922 -8.794 -3.736 398 HB3 MET 50 1HB MET 50 4.084 -10.473 -3.214 399 HG2 MET 50 2HG MET 50 5.945 -10.468 -5.150 400 HG3 MET 50 1HG MET 50 6.007 -8.760 -4.711 401 HE1 MET 50 3HE MET 50 4.785 -9.607 -1.574 402 HE2 MET 50 1HE MET 50 5.657 -8.161 -2.099 403 HE3 MET 50 2HE MET 50 6.281 -9.138 -0.773 404 H ALA 51 H ALA 51 1.119 -9.551 -4.498 405 HA ALA 51 HA ALA 51 0.302 -12.242 -3.575 406 HB1 ALA 51 1HB ALA 51 -0.555 -9.404 -3.305 407 HB2 ALA 51 2HB ALA 51 -0.443 -10.663 -2.074 408 HB3 ALA 51 3HB ALA 51 -1.825 -10.622 -3.171 409 H GLY 52 H GLY 52 -0.119 -10.141 -6.315 410 HA2 GLY 52 2HA GLY 52 -2.588 -11.383 -7.250 411 HA3 GLY 52 1HA GLY 52 -1.580 -10.260 -8.166 412 H THR 53 H THR 53 0.868 -11.780 -7.780 413 HA THR 53 HA THR 53 0.567 -13.667 -9.976 414 HB THR 53 HB THR 53 2.664 -12.350 -8.372 415 HG1 THR 53 1HG THR 53 3.548 -12.812 -10.714 416 HG21 THR 53 3HG2 THR 53 4.434 -13.937 -8.941 417 HG22 THR 53 1HG2 THR 53 3.256 -15.012 -9.696 418 HG23 THR 53 2HG2 THR 53 3.211 -14.738 -7.954 419 H MET 54 H MET 54 0.378 -13.804 -6.585 420 HA MET 54 HA MET 54 0.991 -16.694 -6.413 421 HB2 MET 54 2HB MET 54 1.695 -14.945 -4.725 422 HB3 MET 54 1HB MET 54 -0.007 -14.774 -4.294 423 HG2 MET 54 2HG MET 54 -0.088 -17.209 -3.769 424 HG3 MET 54 1HG MET 54 1.638 -17.317 -4.112 425 HE1 MET 54 3HE MET 54 2.899 -14.488 -1.605 426 HE2 MET 54 1HE MET 54 1.926 -14.042 -3.016 427 HE3 MET 54 2HE MET 54 3.178 -15.276 -3.156 428 H GLY 55 H GLY 55 -1.565 -15.016 -7.498 429 HA2 GLY 55 2HA GLY 55 -3.703 -15.954 -8.030 430 HA3 GLY 55 1HA GLY 55 -3.444 -17.184 -6.790 431 H PHE 56 H PHE 56 -2.525 -14.632 -5.128 432 HA PHE 56 HA PHE 56 -5.252 -14.179 -4.014 433 HB2 PHE 56 2HB PHE 56 -2.476 -13.503 -2.984 434 HB3 PHE 56 1HB PHE 56 -3.975 -13.407 -2.058 435 HD1 PHE 56 1HD PHE 56 -5.297 -15.903 -3.203 436 HD2 PHE 56 2HD PHE 56 -1.339 -15.187 -1.696 437 HE1 PHE 56 1HE PHE 56 -5.091 -18.301 -2.607 438 HE2 PHE 56 2HE PHE 56 -1.132 -17.585 -1.100 439 HZ PHE 56 HZ PHE 56 -3.008 -19.143 -1.555 440 H SER 57 H SER 57 -4.784 -12.835 -6.462 441 HA SER 57 HA SER 57 -3.712 -10.202 -6.171 442 HB2 SER 57 2HB SER 57 -5.940 -10.431 -8.021 443 HB3 SER 57 1HB SER 57 -4.238 -10.154 -8.365 444 HG SER 57 HG SER 57 -4.220 -12.152 -9.007 445 H SER 58 H SER 58 -6.611 -11.625 -5.085 446 HA SER 58 HA SER 58 -8.326 -9.325 -4.955 447 HB2 SER 58 2HB SER 58 -8.082 -11.754 -3.144 448 HB3 SER 58 1HB SER 58 -9.491 -10.704 -3.257 449 HG SER 58 HG SER 58 -10.056 -11.701 -5.019 450 H MET 59 H MET 59 -5.894 -10.733 -2.835 451 HA MET 59 HA MET 59 -6.171 -8.753 -0.724 452 HB2 MET 59 2HB MET 59 -5.326 -11.129 -0.521 453 HB3 MET 59 1HB MET 59 -3.890 -10.641 -1.421 454 HG2 MET 59 2HG MET 59 -4.313 -8.748 0.687 455 HG3 MET 59 1HG MET 59 -4.386 -10.369 1.376 456 HE1 MET 59 3HE MET 59 -2.572 -9.452 -1.899 457 HE2 MET 59 1HE MET 59 -0.992 -8.882 -1.344 458 HE3 MET 59 2HE MET 59 -2.449 -7.968 -0.956 459 H ALA 60 H ALA 60 -4.183 -9.225 -3.616 460 HA ALA 60 HA ALA 60 -2.406 -6.977 -3.071 461 HB1 ALA 60 1HB ALA 60 -2.768 -9.131 -4.968 462 HB2 ALA 60 2HB ALA 60 -1.316 -8.183 -4.651 463 HB3 ALA 60 3HB ALA 60 -2.497 -7.619 -5.833 464 H LYS 61 H LYS 61 -5.534 -7.447 -4.527 465 HA LYS 61 HA LYS 61 -5.769 -5.182 -6.189 466 HB2 LYS 61 2HB LYS 61 -7.389 -7.171 -4.850 467 HB3 LYS 61 1HB LYS 61 -8.170 -5.593 -4.710 468 HG2 LYS 61 2HG LYS 61 -7.192 -6.851 -7.281 469 HG3 LYS 61 1HG LYS 61 -8.878 -6.735 -6.767 470 HD2 LYS 61 2HD LYS 61 -8.907 -4.742 -7.839 471 HD3 LYS 61 1HD LYS 61 -7.959 -4.152 -6.472 472 HE2 LYS 61 2HE LYS 61 -6.273 -3.721 -7.906 473 HE3 LYS 61 1HE LYS 61 -6.131 -5.469 -8.183 474 HZ1 LYS 61 3HZ LYS 61 -7.881 -5.332 -9.831 475 HZ2 LYS 61 1HZ LYS 61 -6.623 -4.275 -10.250 476 HZ3 LYS 61 2HZ LYS 61 -8.051 -3.663 -9.561 477 H LEU 62 H LEU 62 -6.259 -5.642 -2.744 478 HA LEU 62 HA LEU 62 -6.961 -2.964 -2.063 479 HB2 LEU 62 2HB LEU 62 -5.550 -5.203 -0.573 480 HB3 LEU 62 1HB LEU 62 -6.188 -3.752 0.207 481 HG LEU 62 HG LEU 62 -7.892 -5.585 -1.493 482 HD11 LEU 62 1HD1 LEU 62 -7.187 -6.956 0.327 483 HD12 LEU 62 2HD1 LEU 62 -8.773 -6.338 0.791 484 HD13 LEU 62 3HD1 LEU 62 -7.313 -5.623 1.475 485 HD21 LEU 62 3HD2 LEU 62 -9.001 -3.532 -1.291 486 HD22 LEU 62 1HD2 LEU 62 -8.355 -3.232 0.322 487 HD23 LEU 62 2HD2 LEU 62 -9.633 -4.425 0.092 488 H CYS 63 H CYS 63 -3.886 -4.692 -2.393 489 HA CYS 63 HA CYS 63 -2.198 -2.555 -1.440 490 HB2 CYS 63 2HB CYS 63 -1.783 -4.968 -3.227 491 HB3 CYS 63 1HB CYS 63 -0.458 -3.943 -2.675 492 HG CYS 63 HG CYS 63 -1.618 -4.581 -0.169 493 H HIS 64 H HIS 64 -3.633 -3.344 -4.554 494 HA HIS 64 HA HIS 64 -2.015 -1.426 -6.056 495 HB2 HIS 64 2HB HIS 64 -3.414 -3.623 -6.705 496 HB3 HIS 64 1HB HIS 64 -4.677 -2.424 -6.985 497 HD1 HIS 64 1HD HIS 64 -3.445 -3.934 -9.381 498 HD2 HIS 64 2HD HIS 64 -2.059 -0.249 -8.012 499 HE1 HIS 64 1HE HIS 64 -2.233 -2.858 -11.327 500 H THR 65 H THR 65 -5.069 -1.474 -4.349 501 HA THR 65 HA THR 65 -6.192 0.959 -5.387 502 HB THR 65 HB THR 65 -6.515 -0.894 -3.065 503 HG1 THR 65 1HG THR 65 -7.731 -1.311 -4.824 504 HG21 THR 65 3HG2 THR 65 -6.651 1.174 -1.864 505 HG22 THR 65 1HG2 THR 65 -8.306 0.627 -2.137 506 HG23 THR 65 2HG2 THR 65 -7.628 1.916 -3.133 507 H LEU 66 H LEU 66 -4.557 0.342 -2.251 508 HA LEU 66 HA LEU 66 -4.235 2.946 -1.301 509 HB2 LEU 66 2HB LEU 66 -2.660 0.382 -1.235 510 HB3 LEU 66 1HB LEU 66 -1.963 1.825 -0.498 511 HG LEU 66 HG LEU 66 -4.312 2.035 0.637 512 HD11 LEU 66 1HD1 LEU 66 -5.385 0.232 -0.624 513 HD12 LEU 66 2HD1 LEU 66 -5.325 -0.176 1.090 514 HD13 LEU 66 3HD1 LEU 66 -4.179 -0.910 -0.030 515 HD21 LEU 66 3HD2 LEU 66 -3.119 -0.184 2.011 516 HD22 LEU 66 1HD2 LEU 66 -3.022 1.526 2.421 517 HD23 LEU 66 2HD2 LEU 66 -1.833 0.815 1.335 518 H GLU 67 H GLU 67 -2.172 1.123 -3.549 519 HA GLU 67 HA GLU 67 -0.170 3.104 -3.978 520 HB2 GLU 67 2HB GLU 67 0.618 1.236 -4.993 521 HB3 GLU 67 1HB GLU 67 -0.970 0.487 -4.837 522 HG2 GLU 67 2HG GLU 67 -0.419 0.460 -7.173 523 HG3 GLU 67 1HG GLU 67 -1.630 1.725 -6.960 524 H ASN 68 H ASN 68 -3.325 2.580 -5.459 525 HA ASN 68 HA ASN 68 -3.002 4.286 -7.714 526 HB2 ASN 68 2HB ASN 68 -5.031 2.849 -6.305 527 HB3 ASN 68 1HB ASN 68 -5.625 4.475 -6.638 528 HD21 ASN 68 1HD2 ASN 68 -4.598 1.448 -8.147 529 HD22 ASN 68 2HD2 ASN 68 -5.069 1.864 -9.724 530 H ILE 69 H ILE 69 -4.027 4.913 -4.376 531 HA ILE 69 HA ILE 69 -4.569 7.717 -4.793 532 HB ILE 69 HB ILE 69 -3.957 5.979 -2.394 533 HG12 ILE 69 2HG1 ILE 69 -6.403 6.488 -1.981 534 HG13 ILE 69 1HG1 ILE 69 -6.434 7.242 -3.573 535 HG21 ILE 69 1HG2 ILE 69 -4.822 7.954 -1.068 536 HG22 ILE 69 2HG2 ILE 69 -4.686 8.920 -2.533 537 HG23 ILE 69 3HG2 ILE 69 -3.241 8.220 -1.803 538 HD11 ILE 69 3HD1 ILE 69 -5.977 5.201 -4.675 539 HD12 ILE 69 1HD1 ILE 69 -7.170 4.791 -3.446 540 HD13 ILE 69 2HD1 ILE 69 -5.472 4.419 -3.174 541 H LEU 70 H LEU 70 -1.866 5.775 -4.033 542 HA LEU 70 HA LEU 70 -0.019 7.938 -3.429 543 HB2 LEU 70 2HB LEU 70 0.414 5.066 -4.304 544 HB3 LEU 70 1HB LEU 70 1.664 6.113 -3.641 545 HG LEU 70 HG LEU 70 -0.477 4.632 -2.255 546 HD11 LEU 70 1HD1 LEU 70 1.902 5.914 -0.977 547 HD12 LEU 70 2HD1 LEU 70 2.149 4.583 -2.107 548 HD13 LEU 70 3HD1 LEU 70 1.172 4.341 -0.658 549 HD21 LEU 70 3HD2 LEU 70 -1.444 6.820 -1.886 550 HD22 LEU 70 1HD2 LEU 70 0.139 7.514 -1.537 551 HD23 LEU 70 2HD2 LEU 70 -0.588 6.369 -0.411 552 H ASP 71 H ASP 71 -1.375 6.533 -6.231 553 HA ASP 71 HA ASP 71 0.765 7.434 -8.030 554 HB2 ASP 71 2HB ASP 71 -0.439 5.555 -8.810 555 HB3 ASP 71 1HB ASP 71 -1.986 6.225 -8.303 556 H LYS 72 H LYS 72 -2.603 8.467 -7.254 557 HA LYS 72 HA LYS 72 -2.506 10.856 -8.836 558 HB2 LYS 72 2HB LYS 72 -3.990 9.862 -6.431 559 HB3 LYS 72 1HB LYS 72 -4.321 11.461 -7.086 560 HG2 LYS 72 2HG LYS 72 -5.293 10.605 -8.992 561 HG3 LYS 72 1HG LYS 72 -4.294 9.143 -8.965 562 HD2 LYS 72 2HD LYS 72 -6.039 9.524 -6.642 563 HD3 LYS 72 1HD LYS 72 -6.881 9.183 -8.153 564 HE2 LYS 72 2HE LYS 72 -4.767 7.395 -8.182 565 HE3 LYS 72 1HE LYS 72 -5.244 7.429 -6.475 566 HZ1 LYS 72 3HZ LYS 72 -6.974 6.163 -7.050 567 HZ2 LYS 72 1HZ LYS 72 -6.660 6.346 -8.706 568 HZ3 LYS 72 2HZ LYS 72 -7.606 7.496 -7.889 569 H ALA 73 H ALA 73 -1.459 9.975 -5.652 570 HA ALA 73 HA ALA 73 -0.950 12.542 -4.519 571 HB1 ALA 73 1HB ALA 73 -0.846 10.702 -3.060 572 HB2 ALA 73 2HB ALA 73 0.864 11.034 -3.319 573 HB3 ALA 73 3HB ALA 73 0.075 9.730 -4.209 574 H ARG 74 H ARG 74 0.975 10.372 -6.557 575 HA ARG 74 HA ARG 74 3.175 12.343 -6.699 576 HB2 ARG 74 2HB ARG 74 4.307 10.534 -7.898 577 HB3 ARG 74 1HB ARG 74 3.532 9.871 -6.460 578 HG2 ARG 74 2HG ARG 74 1.711 8.993 -7.730 579 HG3 ARG 74 1HG ARG 74 2.188 9.897 -9.167 580 HD2 ARG 74 2HD ARG 74 4.471 8.414 -8.520 581 HD3 ARG 74 1HD ARG 74 3.121 7.290 -8.260 582 HE ARG 74 HE ARG 74 2.323 7.950 -10.570 583 HH11 ARG 74 1HH1 ARG 74 5.291 6.747 -10.180 584 HH12 ARG 74 2HH1 ARG 74 6.046 7.528 -11.529 585 HH21 ARG 74 1HH2 ARG 74 3.420 9.728 -12.063 586 HH22 ARG 74 2HH2 ARG 74 4.987 9.217 -12.594 587 H ASN 75 H ASN 75 0.271 11.603 -8.299 588 HA ASN 75 HA ASN 75 1.187 12.680 -10.922 589 HB2 ASN 75 2HB ASN 75 -0.300 10.581 -10.466 590 HB3 ASN 75 1HB ASN 75 -1.588 11.755 -10.189 591 HD21 ASN 75 1HD2 ASN 75 -1.970 13.354 -12.039 592 HD22 ASN 75 2HD2 ASN 75 -1.695 12.815 -13.625 593 H SER 76 H SER 76 0.147 13.902 -8.039 594 HA SER 76 HA SER 76 -0.551 16.086 -7.461 595 HB2 SER 76 2HB SER 76 0.654 16.457 -9.770 596 HB3 SER 76 1HB SER 76 -0.986 16.631 -10.388 597 HG SER 76 HG SER 76 -1.041 18.534 -9.519 598 H GLU 77 H GLU 77 -2.402 13.774 -7.832 599 HA GLU 77 HA GLU 77 -4.854 15.242 -8.655 600 HB2 GLU 77 2HB GLU 77 -4.017 12.361 -8.626 601 HB3 GLU 77 1HB GLU 77 -5.712 12.811 -8.804 602 HG2 GLU 77 2HG GLU 77 -3.404 13.609 -10.595 603 HG3 GLU 77 1HG GLU 77 -4.747 12.542 -11.014 604 H ILE 78 H ILE 78 -3.547 13.066 -6.201 605 HA ILE 78 HA ILE 78 -5.612 14.159 -4.305 606 HB ILE 78 HB ILE 78 -5.801 11.922 -3.365 607 HG12 ILE 78 2HG1 ILE 78 -4.555 10.061 -4.686 608 HG13 ILE 78 1HG1 ILE 78 -3.498 11.371 -5.221 609 HG21 ILE 78 1HG2 ILE 78 -7.243 12.360 -5.265 610 HG22 ILE 78 2HG2 ILE 78 -6.670 10.698 -5.366 611 HG23 ILE 78 3HG2 ILE 78 -5.954 11.943 -6.390 612 HD11 ILE 78 3HD1 ILE 78 -3.210 9.944 -2.879 613 HD12 ILE 78 1HD1 ILE 78 -4.016 11.418 -2.344 614 HD13 ILE 78 2HD1 ILE 78 -2.489 11.517 -3.219 615 H LYS 79 H LYS 79 -4.904 13.646 -1.965 616 HA LYS 79 HA LYS 79 -1.997 13.459 -1.549 617 HB2 LYS 79 2HB LYS 79 -1.912 15.623 -0.426 618 HB3 LYS 79 1HB LYS 79 -2.574 15.855 -2.046 619 HG2 LYS 79 2HG LYS 79 -4.560 16.559 -1.236 620 HG3 LYS 79 1HG LYS 79 -4.645 15.227 -0.082 621 HD2 LYS 79 2HD LYS 79 -2.566 17.138 0.600 622 HD3 LYS 79 1HD LYS 79 -4.161 17.886 0.540 623 HE2 LYS 79 2HE LYS 79 -4.994 16.552 2.271 624 HE3 LYS 79 1HE LYS 79 -3.813 15.260 1.968 625 HZ1 LYS 79 3HZ LYS 79 -3.425 16.904 3.926 626 HZ2 LYS 79 1HZ LYS 79 -2.873 17.948 2.709 627 HZ3 LYS 79 2HZ LYS 79 -2.118 16.445 2.943 628 H ILE 80 H ILE 80 -1.544 12.858 0.684 629 HA ILE 80 HA ILE 80 -3.644 11.363 1.960 630 HB ILE 80 HB ILE 80 -0.872 12.254 2.588 631 HG12 ILE 80 2HG1 ILE 80 -0.489 9.803 2.541 632 HG13 ILE 80 1HG1 ILE 80 -2.209 9.572 2.235 633 HG21 ILE 80 1HG2 ILE 80 -1.511 12.251 4.801 634 HG22 ILE 80 2HG2 ILE 80 -1.260 10.518 4.593 635 HG23 ILE 80 3HG2 ILE 80 -2.888 11.191 4.499 636 HD11 ILE 80 3HD1 ILE 80 -0.422 11.246 0.457 637 HD12 ILE 80 1HD1 ILE 80 -2.070 10.713 0.123 638 HD13 ILE 80 2HD1 ILE 80 -0.754 9.539 0.162 639 H THR 81 H THR 81 -5.327 12.654 2.429 640 HA THR 81 HA THR 81 -5.078 15.155 3.972 641 HB THR 81 HB THR 81 -7.514 15.186 3.618 642 HG1 THR 81 1HG THR 81 -8.559 13.405 3.284 643 HG21 THR 81 3HG2 THR 81 -6.824 15.967 1.609 644 HG22 THR 81 1HG2 THR 81 -7.237 14.366 0.994 645 HG23 THR 81 2HG2 THR 81 -5.577 14.728 1.467 646 H SER 82 H SER 82 -4.476 12.258 5.025 647 HA SER 82 HA SER 82 -4.553 11.334 7.218 648 HB2 SER 82 2HB SER 82 -5.421 13.981 7.512 649 HB3 SER 82 1HB SER 82 -6.689 13.016 8.261 650 HG SER 82 HG SER 82 -5.093 12.015 9.520 651 H ASP 83 H ASP 83 -7.163 11.786 5.084 652 HA ASP 83 HA ASP 83 -8.800 9.698 6.463 653 HB2 ASP 83 2HB ASP 83 -9.693 12.075 6.048 654 HB3 ASP 83 1HB ASP 83 -9.651 11.675 4.331 655 H LEU 84 H LEU 84 -7.663 10.931 3.308 656 HA LEU 84 HA LEU 84 -8.471 8.636 1.763 657 HB2 LEU 84 2HB LEU 84 -7.967 10.595 0.554 658 HB3 LEU 84 1HB LEU 84 -6.534 10.933 1.524 659 HG LEU 84 HG LEU 84 -5.458 8.897 0.510 660 HD11 LEU 84 1HD1 LEU 84 -6.969 7.482 -0.442 661 HD12 LEU 84 2HD1 LEU 84 -6.785 8.526 -1.850 662 HD13 LEU 84 3HD1 LEU 84 -8.133 8.772 -0.740 663 HD21 LEU 84 3HD2 LEU 84 -5.914 11.478 -0.608 664 HD22 LEU 84 1HD2 LEU 84 -5.933 10.313 -1.934 665 HD23 LEU 84 2HD2 LEU 84 -4.532 10.412 -0.866 666 H LEU 85 H LEU 85 -5.785 9.388 3.849 667 HA LEU 85 HA LEU 85 -4.189 7.065 3.012 668 HB2 LEU 85 2HB LEU 85 -2.559 8.217 4.123 669 HB3 LEU 85 1HB LEU 85 -3.730 9.528 4.212 670 HG LEU 85 HG LEU 85 -4.565 8.420 6.372 671 HD11 LEU 85 1HD1 LEU 85 -3.486 6.615 7.225 672 HD12 LEU 85 2HD1 LEU 85 -1.899 7.251 6.794 673 HD13 LEU 85 3HD1 LEU 85 -2.866 6.401 5.588 674 HD21 LEU 85 3HD2 LEU 85 -2.829 9.519 7.701 675 HD22 LEU 85 1HD2 LEU 85 -3.167 10.489 6.268 676 HD23 LEU 85 2HD2 LEU 85 -1.721 9.481 6.328 677 H ASP 86 H ASP 86 -6.400 8.019 5.609 678 HA ASP 86 HA ASP 86 -6.070 5.763 7.333 679 HB2 ASP 86 2HB ASP 86 -7.315 7.941 7.731 680 HB3 ASP 86 1HB ASP 86 -8.610 7.306 6.717 681 H LYS 87 H LYS 87 -8.060 6.269 4.423 682 HA LYS 87 HA LYS 87 -9.428 3.707 4.586 683 HB2 LYS 87 2HB LYS 87 -8.860 5.594 2.265 684 HB3 LYS 87 1HB LYS 87 -10.065 4.306 2.260 685 HG2 LYS 87 2HG LYS 87 -10.039 6.726 4.085 686 HG3 LYS 87 1HG LYS 87 -11.158 6.436 2.755 687 HD2 LYS 87 2HD LYS 87 -11.943 4.372 3.914 688 HD3 LYS 87 1HD LYS 87 -10.889 4.767 5.271 689 HE2 LYS 87 2HE LYS 87 -12.476 7.083 4.573 690 HE3 LYS 87 1HE LYS 87 -13.531 5.687 4.870 691 HZ1 LYS 87 3HZ LYS 87 -12.469 7.142 6.832 692 HZ2 LYS 87 1HZ LYS 87 -11.253 5.975 6.652 693 HZ3 LYS 87 2HZ LYS 87 -12.845 5.492 6.996 694 H ILE 88 H ILE 88 -6.557 4.993 2.964 695 HA ILE 88 HA ILE 88 -5.821 2.651 1.492 696 HB ILE 88 HB ILE 88 -4.679 5.203 2.446 697 HG12 ILE 88 2HG1 ILE 88 -3.698 4.101 -0.046 698 HG13 ILE 88 1HG1 ILE 88 -5.461 4.072 0.060 699 HG21 ILE 88 1HG2 ILE 88 -2.698 3.122 1.551 700 HG22 ILE 88 2HG2 ILE 88 -3.003 3.419 3.262 701 HG23 ILE 88 3HG2 ILE 88 -2.380 4.709 2.241 702 HD11 ILE 88 3HD1 ILE 88 -5.528 6.288 -0.308 703 HD12 ILE 88 1HD1 ILE 88 -3.770 6.310 -0.449 704 HD13 ILE 88 2HD1 ILE 88 -4.531 6.560 1.123 705 H PHE 89 H PHE 89 -4.869 3.850 4.699 706 HA PHE 89 HA PHE 89 -3.352 1.564 5.504 707 HB2 PHE 89 2HB PHE 89 -3.248 3.814 6.522 708 HB3 PHE 89 1HB PHE 89 -4.910 3.628 7.085 709 HD1 PHE 89 1HD PHE 89 -5.468 1.970 8.842 710 HD2 PHE 89 2HD PHE 89 -1.414 2.676 7.610 711 HE1 PHE 89 1HE PHE 89 -4.648 0.805 10.873 712 HE2 PHE 89 2HE PHE 89 -0.594 1.512 9.640 713 HZ PHE 89 HZ PHE 89 -2.210 0.576 11.272 714 H ALA 90 H ALA 90 -6.697 2.152 5.223 715 HA ALA 90 HA ALA 90 -7.598 0.107 7.110 716 HB1 ALA 90 1HB ALA 90 -8.705 2.109 5.240 717 HB2 ALA 90 2HB ALA 90 -9.335 1.570 6.797 718 HB3 ALA 90 3HB ALA 90 -9.659 0.629 5.342 719 H GLY 91 H GLY 91 -6.855 0.443 3.697 720 HA2 GLY 91 2HA GLY 91 -7.869 -2.126 2.855 721 HA3 GLY 91 1HA GLY 91 -6.686 -1.146 1.977 722 H VAL 92 H VAL 92 -4.713 -0.882 3.904 723 HA VAL 92 HA VAL 92 -3.270 -3.360 3.691 724 HB VAL 92 HB VAL 92 -3.015 -0.701 5.059 725 HG11 VAL 92 1HG1 VAL 92 -1.288 -3.123 5.665 726 HG12 VAL 92 2HG1 VAL 92 -2.245 -2.192 6.817 727 HG13 VAL 92 3HG1 VAL 92 -0.832 -1.464 6.054 728 HG21 VAL 92 3HG2 VAL 92 -0.766 -1.969 3.611 729 HG22 VAL 92 1HG2 VAL 92 -1.425 -0.340 3.463 730 HG23 VAL 92 2HG2 VAL 92 -2.213 -1.689 2.645 731 H ASP 93 H ASP 93 -5.510 -2.014 5.988 732 HA ASP 93 HA ASP 93 -4.897 -3.706 8.254 733 HB2 ASP 93 2HB ASP 93 -6.782 -1.645 7.401 734 HB3 ASP 93 1HB ASP 93 -7.595 -2.913 8.325 735 H MET 94 H MET 94 -7.213 -3.871 5.553 736 HA MET 94 HA MET 94 -8.359 -6.404 6.433 737 HB2 MET 94 2HB MET 94 -8.374 -4.891 3.796 738 HB3 MET 94 1HB MET 94 -9.400 -6.280 4.153 739 HG2 MET 94 2HG MET 94 -10.106 -4.877 6.254 740 HG3 MET 94 1HG MET 94 -9.492 -3.513 5.322 741 HE1 MET 94 3HE MET 94 -9.639 -3.898 2.819 742 HE2 MET 94 1HE MET 94 -11.204 -3.371 2.187 743 HE3 MET 94 2HE MET 94 -10.732 -5.066 2.082 744 H ILE 95 H ILE 95 -5.761 -5.289 4.378 745 HA ILE 95 HA ILE 95 -5.146 -7.736 3.010 746 HB ILE 95 HB ILE 95 -3.926 -5.099 3.656 747 HG12 ILE 95 2HG1 ILE 95 -3.608 -6.569 1.070 748 HG13 ILE 95 1HG1 ILE 95 -5.219 -6.013 1.526 749 HG21 ILE 95 1HG2 ILE 95 -1.915 -6.075 4.157 750 HG22 ILE 95 2HG2 ILE 95 -1.793 -6.137 2.399 751 HG23 ILE 95 3HG2 ILE 95 -2.302 -7.566 3.299 752 HD11 ILE 95 3HD1 ILE 95 -3.865 -4.358 0.155 753 HD12 ILE 95 1HD1 ILE 95 -2.786 -4.211 1.542 754 HD13 ILE 95 2HD1 ILE 95 -4.478 -3.734 1.686 755 H THR 96 H THR 96 -4.229 -6.378 6.157 756 HA THR 96 HA THR 96 -2.328 -8.437 6.866 757 HB THR 96 HB THR 96 -4.010 -6.405 8.362 758 HG1 THR 96 1HG THR 96 -2.183 -5.273 8.348 759 HG21 THR 96 3HG2 THR 96 -3.578 -7.443 10.306 760 HG22 THR 96 1HG2 THR 96 -1.849 -7.377 9.959 761 HG23 THR 96 2HG2 THR 96 -2.804 -8.761 9.428 762 H ARG 97 H ARG 97 -5.763 -7.840 7.671 763 HA ARG 97 HA ARG 97 -6.259 -10.182 9.172 764 HB2 ARG 97 2HB ARG 97 -7.791 -8.265 7.460 765 HB3 ARG 97 1HB ARG 97 -8.613 -9.742 7.959 766 HG2 ARG 97 2HG ARG 97 -8.763 -7.611 9.478 767 HG3 ARG 97 1HG ARG 97 -8.518 -9.185 10.228 768 HD2 ARG 97 2HD ARG 97 -6.115 -8.766 10.420 769 HD3 ARG 97 1HD ARG 97 -6.290 -7.230 9.547 770 HE ARG 97 HE ARG 97 -7.332 -7.784 12.280 771 HH11 ARG 97 1HH2 ARG 97 -5.579 -5.561 10.663 772 HH12 ARG 97 2HH2 ARG 97 -6.554 -4.184 11.048 773 HH21 ARG 97 1HH1 ARG 97 -9.179 -6.062 12.311 774 HH22 ARG 97 2HH1 ARG 97 -8.594 -4.467 11.977 775 H MET 98 H MET 98 -6.094 -9.657 5.677 776 HA MET 98 HA MET 98 -7.124 -12.246 4.893 777 HB2 MET 98 2HB MET 98 -5.494 -10.026 3.651 778 HB3 MET 98 1HB MET 98 -5.756 -11.531 2.770 779 HG2 MET 98 2HG MET 98 -7.986 -11.121 2.458 780 HG3 MET 98 1HG MET 98 -8.158 -10.306 4.013 781 HE1 MET 98 3HE MET 98 -9.309 -8.316 0.917 782 HE2 MET 98 1HE MET 98 -9.124 -10.054 1.189 783 HE3 MET 98 2HE MET 98 -8.079 -9.222 0.041 784 H VAL 99 H VAL 99 -3.944 -10.886 5.591 785 HA VAL 99 HA VAL 99 -2.416 -13.239 4.878 786 HB VAL 99 HB VAL 99 -2.016 -10.661 6.385 787 HG11 VAL 99 1HG1 VAL 99 -0.375 -11.615 7.618 788 HG12 VAL 99 2HG1 VAL 99 0.526 -11.761 6.108 789 HG13 VAL 99 3HG1 VAL 99 -0.447 -13.113 6.690 790 HG21 VAL 99 3HG2 VAL 99 -0.072 -10.894 4.461 791 HG22 VAL 99 1HG2 VAL 99 -1.636 -10.120 4.207 792 HG23 VAL 99 2HG2 VAL 99 -1.397 -11.801 3.733 793 H ASP 100 H ASP 100 -3.917 -12.008 7.858 794 HA ASP 100 HA ASP 100 -2.708 -13.940 9.639 795 HB2 ASP 100 2HB ASP 100 -3.820 -11.714 10.188 796 HB3 ASP 100 1HB ASP 100 -5.369 -12.505 9.893 797 H LYS 101 H LYS 101 -5.538 -13.913 7.559 798 HA LYS 101 HA LYS 101 -6.457 -16.510 8.616 799 HB2 LYS 101 2HB LYS 101 -8.437 -15.697 7.913 800 HB3 LYS 101 1HB LYS 101 -7.605 -14.223 7.438 801 HG2 LYS 101 2HG LYS 101 -7.061 -15.854 5.298 802 HG3 LYS 101 1HG LYS 101 -8.667 -16.403 5.764 803 HD2 LYS 101 2HD LYS 101 -8.493 -13.545 5.918 804 HD3 LYS 101 1HD LYS 101 -7.990 -14.095 4.324 805 HE2 LYS 101 2HE LYS 101 -10.594 -14.829 5.729 806 HE3 LYS 101 1HE LYS 101 -10.433 -13.789 4.302 807 HZ1 LYS 101 3HZ LYS 101 -10.598 -16.569 4.367 808 HZ2 LYS 101 1HZ LYS 101 -9.024 -16.187 3.872 809 HZ3 LYS 101 2HZ LYS 101 -10.352 -15.574 3.013 810 H ILE 102 H ILE 102 -4.923 -15.052 5.798 811 HA ILE 102 HA ILE 102 -4.895 -17.360 4.102 812 HB ILE 102 HB ILE 102 -3.318 -14.818 4.442 813 HG12 ILE 102 2HG1 ILE 102 -4.699 -15.910 1.989 814 HG13 ILE 102 1HG1 ILE 102 -5.597 -15.081 3.262 815 HG21 ILE 102 1HG2 ILE 102 -1.630 -16.490 3.823 816 HG22 ILE 102 2HG2 ILE 102 -1.952 -15.408 2.468 817 HG23 ILE 102 3HG2 ILE 102 -2.643 -17.031 2.483 818 HD11 ILE 102 3HD1 ILE 102 -3.840 -13.972 1.208 819 HD12 ILE 102 1HD1 ILE 102 -3.417 -13.423 2.829 820 HD13 ILE 102 2HD1 ILE 102 -5.047 -13.164 2.210 821 H VAL 103 H VAL 103 -3.010 -16.219 6.790 822 HA VAL 103 HA VAL 103 -0.904 -18.255 6.582 823 HB VAL 103 HB VAL 103 -1.781 -16.075 8.466 824 HG11 VAL 103 1HG1 VAL 103 0.225 -18.267 9.072 825 HG12 VAL 103 2HG1 VAL 103 -1.206 -17.838 10.011 826 HG13 VAL 103 3HG1 VAL 103 0.168 -16.734 9.943 827 HG21 VAL 103 3HG2 VAL 103 0.649 -15.426 8.086 828 HG22 VAL 103 1HG2 VAL 103 -0.370 -15.391 6.648 829 HG23 VAL 103 2HG2 VAL 103 0.733 -16.740 6.913 830 H SER 104 H SER 104 -3.982 -17.769 8.171 831 HA SER 104 HA SER 104 -3.768 -20.123 9.902 832 HB2 SER 104 2HB SER 104 -4.986 -17.932 10.351 833 HB3 SER 104 1HB SER 104 -6.170 -18.455 9.153 834 HG SER 104 HG SER 104 -6.883 -19.117 11.157 835 H GLU 105 H GLU 105 -5.005 -19.339 6.786 836 HA GLU 105 HA GLU 105 -5.877 -22.168 6.399 837 HB2 GLU 105 2HB GLU 105 -7.510 -19.783 5.496 838 HB3 GLU 105 1HB GLU 105 -8.027 -21.464 5.639 839 HG2 GLU 105 2HG GLU 105 -7.194 -19.743 7.989 840 HG3 GLU 105 1HG GLU 105 -8.866 -19.994 7.492 841 H GLY 106 H GLY 106 -5.072 -19.017 4.944 842 HA2 GLY 106 2HA GLY 106 -3.523 -18.914 3.040 843 HA3 GLY 106 1HA GLY 106 -4.102 -20.503 2.541 844 H SER 107 H SER 107 -6.469 -18.208 3.637 845 HA SER 107 HA SER 107 -7.259 -17.738 0.764 846 HB2 SER 107 2HB SER 107 -9.061 -17.960 3.179 847 HB3 SER 107 1HB SER 107 -9.537 -17.958 1.484 848 HG SER 107 HG SER 107 -9.332 -20.066 2.659 849 H ASP 108 H ASP 108 -7.340 -15.627 0.220 850 HA ASP 108 HA ASP 108 -7.103 -13.566 2.343 851 HB2 ASP 108 2HB ASP 108 -6.721 -12.102 0.365 852 HB3 ASP 108 1HB ASP 108 -5.669 -13.519 0.321 853 H ASP 109 H ASP 109 -9.576 -15.300 1.276 854 HA ASP 109 HA ASP 109 -11.469 -13.259 0.387 855 HB2 ASP 109 2HB ASP 109 -11.375 -15.798 -0.076 856 HB3 ASP 109 1HB ASP 109 -12.094 -15.986 1.524 857 H ILE 110 H ILE 110 -10.950 -11.816 2.381 858 HA ILE 110 HA ILE 110 -12.244 -12.709 4.897 859 HB ILE 110 HB ILE 110 -11.398 -10.442 5.648 860 HG12 ILE 110 2HG1 ILE 110 -9.857 -10.310 3.084 861 HG13 ILE 110 1HG1 ILE 110 -11.509 -9.700 3.109 862 HG21 ILE 110 1HG2 ILE 110 -10.028 -12.514 5.888 863 HG22 ILE 110 2HG2 ILE 110 -9.038 -11.078 5.634 864 HG23 ILE 110 3HG2 ILE 110 -9.319 -12.197 4.302 865 HD11 ILE 110 3HD1 ILE 110 -10.444 -8.649 5.432 866 HD12 ILE 110 1HD1 ILE 110 -10.615 -7.779 3.907 867 HD13 ILE 110 2HD1 ILE 110 -9.086 -8.562 4.309 868 H GLY 111 H GLY 111 -13.820 -12.205 2.381 869 HA2 GLY 111 2HA GLY 111 -15.885 -11.222 1.845 870 HA3 GLY 111 1HA GLY 111 -16.011 -10.758 3.545 871 H GLU 112 H GLU 112 -13.143 -9.748 1.971 872 HA GLU 112 HA GLU 112 -13.533 -6.987 2.457 873 HB2 GLU 112 2HB GLU 112 -11.600 -6.789 0.854 874 HB3 GLU 112 1HB GLU 112 -11.360 -8.004 2.112 875 HG2 GLU 112 2HG GLU 112 -10.865 -9.376 0.368 876 HG3 GLU 112 1HG GLU 112 -12.616 -9.479 0.196 877 H ASN 113 H ASN 113 -13.384 -5.341 0.548 878 HA ASN 113 HA ASN 113 -15.192 -6.084 -1.712 879 HB2 ASN 113 2HB ASN 113 -15.468 -3.541 -0.099 880 HB3 ASN 113 1HB ASN 113 -16.634 -4.249 -1.217 881 HD21 ASN 113 1HD2 ASN 113 -18.058 -5.879 -0.404 882 HD22 ASN 113 2HD2 ASN 113 -18.053 -6.390 1.215 883 H ILE 114 H ILE 114 -13.365 -5.932 -3.134 884 HA ILE 114 HA ILE 114 -11.557 -3.673 -3.101 885 HB ILE 114 HB ILE 114 -12.182 -5.630 -5.329 886 HG12 ILE 114 2HG1 ILE 114 -11.777 -7.026 -3.465 887 HG13 ILE 114 1HG1 ILE 114 -10.190 -6.873 -4.218 888 HG21 ILE 114 1HG2 ILE 114 -9.842 -5.253 -5.937 889 HG22 ILE 114 2HG2 ILE 114 -9.643 -4.158 -4.572 890 HG23 ILE 114 3HG2 ILE 114 -10.710 -3.721 -5.907 891 HD11 ILE 114 3HD1 ILE 114 -9.959 -6.537 -1.817 892 HD12 ILE 114 1HD1 ILE 114 -11.216 -5.296 -1.840 893 HD13 ILE 114 2HD1 ILE 114 -9.669 -5.004 -2.644 894 H ASP 115 H ASP 115 -13.750 -4.623 -5.779 895 HA ASP 115 HA ASP 115 -13.768 -2.252 -7.198 896 HB2 ASP 115 2HB ASP 115 -14.970 -4.188 -7.964 897 HB3 ASP 115 1HB ASP 115 -15.995 -4.186 -6.528 898 H VAL 116 H VAL 116 -15.176 -2.908 -4.135 899 HA VAL 116 HA VAL 116 -16.683 -0.392 -4.024 900 HB VAL 116 HB VAL 116 -16.211 -2.590 -2.002 901 HG11 VAL 116 1HG1 VAL 116 -17.448 -1.347 -0.584 902 HG12 VAL 116 2HG1 VAL 116 -18.738 -1.218 -1.780 903 HG13 VAL 116 3HG1 VAL 116 -17.431 -0.034 -1.762 904 HG21 VAL 116 3HG2 VAL 116 -17.613 -2.675 -4.447 905 HG22 VAL 116 1HG2 VAL 116 -18.853 -2.497 -3.205 906 HG23 VAL 116 2HG2 VAL 116 -17.715 -3.842 -3.129 907 H PHE 117 H PHE 117 -14.166 -1.937 -2.092 908 HA PHE 117 HA PHE 117 -13.556 0.346 -0.475 909 HB2 PHE 117 2HB PHE 117 -12.872 -1.898 0.133 910 HB3 PHE 117 1HB PHE 117 -11.942 -2.066 -1.357 911 HD1 PHE 117 1HD PHE 117 -12.213 0.296 1.558 912 HD2 PHE 117 2HD PHE 117 -9.649 -1.727 -1.232 913 HE1 PHE 117 1HE PHE 117 -10.226 1.268 2.679 914 HE2 PHE 117 2HE PHE 117 -7.661 -0.755 -0.111 915 HZ PHE 117 HZ PHE 117 -7.950 0.741 1.845 916 H SER 118 H SER 118 -12.673 -0.486 -3.741 917 HA SER 118 HA SER 118 -10.512 1.486 -3.847 918 HB2 SER 118 2HB SER 118 -9.930 -0.324 -5.157 919 HB3 SER 118 1HB SER 118 -11.611 -0.742 -5.475 920 HG SER 118 HG SER 118 -11.475 0.359 -7.251 921 H ASP 119 H ASP 119 -13.768 0.922 -4.957 922 HA ASP 119 HA ASP 119 -13.933 3.354 -6.550 923 HB2 ASP 119 2HB ASP 119 -15.263 1.324 -7.011 924 HB3 ASP 119 1HB ASP 119 -16.037 1.477 -5.433 925 H THR 120 H THR 120 -14.634 2.345 -3.329 926 HA THR 120 HA THR 120 -16.130 4.647 -2.469 927 HB THR 120 HB THR 120 -14.603 2.376 -1.245 928 HG1 THR 120 1HG THR 120 -16.556 1.688 -0.935 929 HG21 THR 120 3HG2 THR 120 -15.769 4.665 0.352 930 HG22 THR 120 1HG2 THR 120 -14.047 4.365 0.123 931 HG23 THR 120 2HG2 THR 120 -15.035 3.200 1.003 932 H ILE 121 H ILE 121 -12.784 3.720 -2.473 933 HA ILE 121 HA ILE 121 -11.820 6.201 -1.264 934 HB ILE 121 HB ILE 121 -10.947 3.526 -1.949 935 HG12 ILE 121 2HG1 ILE 121 -10.999 4.672 0.295 936 HG13 ILE 121 1HG1 ILE 121 -9.481 3.854 -0.076 937 HG21 ILE 121 1HG2 ILE 121 -9.635 4.455 -3.727 938 HG22 ILE 121 2HG2 ILE 121 -8.541 4.138 -2.380 939 HG23 ILE 121 3HG2 ILE 121 -9.085 5.784 -2.705 940 HD11 ILE 121 3HD1 ILE 121 -9.715 6.492 0.724 941 HD12 ILE 121 1HD1 ILE 121 -9.551 6.627 -1.027 942 HD13 ILE 121 2HD1 ILE 121 -8.313 5.794 -0.087 943 H LYS 122 H LYS 122 -12.004 4.781 -4.534 944 HA LYS 122 HA LYS 122 -10.495 6.853 -5.855 945 HB2 LYS 122 2HB LYS 122 -12.167 4.504 -6.491 946 HB3 LYS 122 1HB LYS 122 -12.239 5.779 -7.706 947 HG2 LYS 122 2HG LYS 122 -10.181 5.260 -8.448 948 HG3 LYS 122 1HG LYS 122 -9.526 5.478 -6.826 949 HD2 LYS 122 2HD LYS 122 -11.029 2.990 -7.072 950 HD3 LYS 122 1HD LYS 122 -9.679 3.068 -8.204 951 HE2 LYS 122 2HE LYS 122 -8.278 3.883 -6.162 952 HE3 LYS 122 1HE LYS 122 -9.606 3.217 -5.188 953 HZ1 LYS 122 3HZ LYS 122 -8.532 1.279 -5.490 954 HZ2 LYS 122 1HZ LYS 122 -7.663 1.836 -6.835 955 HZ3 LYS 122 2HZ LYS 122 -9.263 1.295 -7.024 956 H SER 123 H SER 123 -13.859 6.384 -4.975 957 HA SER 123 HA SER 123 -14.761 8.796 -6.391 958 HB2 SER 123 2HB SER 123 -15.976 6.754 -4.537 959 HB3 SER 123 1HB SER 123 -16.893 8.130 -5.141 960 HG SER 123 HG SER 123 -15.913 7.248 -7.275 961 H PHE 124 H PHE 124 -13.346 7.966 -3.432 962 HA PHE 124 HA PHE 124 -14.544 9.961 -1.716 963 HB2 PHE 124 2HB PHE 124 -12.785 7.803 -1.527 964 HB3 PHE 124 1HB PHE 124 -11.781 9.198 -1.137 965 HD1 PHE 124 2HD PHE 124 -12.932 10.967 0.488 966 HD2 PHE 124 1HD PHE 124 -14.028 6.827 0.188 967 HE1 PHE 124 2HE PHE 124 -13.953 11.074 2.745 968 HE2 PHE 124 1HE PHE 124 -15.050 6.932 2.444 969 HZ PHE 124 HZ PHE 124 -15.012 9.057 3.724 970 H ALA 125 H ALA 125 -12.555 10.218 -4.385 971 HA ALA 125 HA ALA 125 -11.337 12.027 -5.303 972 HB1 ALA 125 1HB ALA 125 -12.911 13.645 -5.049 973 HB2 ALA 125 2HB ALA 125 -11.999 14.153 -3.629 974 HB3 ALA 125 3HB ALA 125 -13.364 13.051 -3.452 975 H SER 126 H SER 126 -11.367 13.193 -1.957 976 HA SER 126 HA SER 126 -8.722 12.163 -1.325 977 HB2 SER 126 2HB SER 126 -7.802 14.603 -1.295 978 HB3 SER 126 1HB SER 126 -7.925 13.782 -2.848 979 HG SER 126 HG SER 126 -8.849 15.840 -2.974 980 H SER 127 H SER 127 -10.804 15.011 -0.676 981 HA SER 127 HA SER 127 -10.319 14.710 2.236 982 HB2 SER 127 2HB SER 127 -10.931 16.938 2.308 983 HB3 SER 127 1HB SER 127 -10.452 16.851 0.616 984 HG SER 127 HG SER 127 -13.027 16.814 1.764 985 H GLY 128 H GLY 128 -12.236 14.685 3.704 986 HA2 GLY 128 2HA GLY 128 -14.633 13.438 2.419 987 HA3 GLY 128 1HA GLY 128 -13.960 12.809 3.922 988 H LYS 129 H LYS 129 -16.645 13.758 3.658 989 HA LYS 129 HA LYS 129 -16.631 15.794 5.798 990 HB2 LYS 129 2HB LYS 129 -16.447 17.099 3.721 991 HB3 LYS 129 1HB LYS 129 -17.843 16.254 3.053 992 HG2 LYS 129 2HG LYS 129 -18.788 17.168 5.491 993 HG3 LYS 129 1HG LYS 129 -17.756 18.491 4.945 994 HD2 LYS 129 2HD LYS 129 -18.967 18.141 2.649 995 HD3 LYS 129 1HD LYS 129 -20.194 17.330 3.623 996 HE2 LYS 129 2HE LYS 129 -20.874 19.633 3.504 997 HE3 LYS 129 1HE LYS 129 -20.161 19.436 5.118 998 HZ1 LYS 129 3HZ LYS 129 -17.972 19.948 3.790 999 HZ2 LYS 129 1HZ LYS 129 -18.950 21.206 4.371 1000 HZ3 LYS 129 2HZ LYS 129 -19.047 20.742 2.741 1001 H GLU 130 H GLU 130 -17.505 13.211 6.085 1002 HA GLU 130 HA GLU 130 -19.395 11.911 6.660 1003 HB2 GLU 130 2HB GLU 130 -19.702 14.655 7.461 1004 HB3 GLU 130 1HB GLU 130 -21.284 14.012 7.020 1005 HG2 GLU 130 2HG GLU 130 -19.529 12.264 8.676 1006 HG3 GLU 130 1HG GLU 130 -20.242 13.668 9.471 1007 H LYS 131 H LYS 131 -19.802 10.966 4.575 1008 HA LYS 131 HA LYS 131 -21.094 12.196 2.373 1009 HB2 LYS 131 2HB LYS 131 -19.937 9.864 2.773 1010 HB3 LYS 131 1HB LYS 131 -21.575 9.333 3.162 1011 HG2 LYS 131 2HG LYS 131 -22.252 9.442 0.998 1012 HG3 LYS 131 1HG LYS 131 -21.399 10.961 0.715 1013 HD2 LYS 131 2HD LYS 131 -19.288 9.274 0.986 1014 HD3 LYS 131 1HD LYS 131 -20.482 8.174 0.293 1015 HE2 LYS 131 2HE LYS 131 -20.338 10.847 -0.992 1016 HE3 LYS 131 1HE LYS 131 -18.925 9.800 -1.233 1017 HZ1 LYS 131 3HZ LYS 131 -21.767 9.061 -1.694 1018 HZ2 LYS 131 1HZ LYS 131 -20.462 7.984 -1.802 1019 HZ3 LYS 131 2HZ LYS 131 -20.581 9.284 -2.888 1020 H LEU 132 H LEU 132 -23.397 10.847 1.774 1021 HA LEU 132 HA LEU 132 -25.280 11.514 4.015 1022 HB2 LEU 132 2HB LEU 132 -25.233 12.244 1.095 1023 HB3 LEU 132 1HB LEU 132 -26.776 12.153 1.947 1024 HG LEU 132 HG LEU 132 -25.453 13.603 3.750 1025 HD11 LEU 132 1HD1 LEU 132 -23.387 14.132 2.987 1026 HD12 LEU 132 2HD1 LEU 132 -24.217 15.255 1.908 1027 HD13 LEU 132 3HD1 LEU 132 -23.781 13.643 1.338 1028 HD21 LEU 132 3HD2 LEU 132 -26.400 14.961 1.223 1029 HD22 LEU 132 1HD2 LEU 132 -26.578 15.506 2.890 1030 HD23 LEU 132 2HD2 LEU 132 -27.528 14.141 2.303 1031 H GLU 133 H GLU 133 -26.879 9.975 4.372 1032 HA GLU 133 HA GLU 133 -27.038 7.694 2.424 1033 HB2 GLU 133 2HB GLU 133 -27.144 6.223 4.324 1034 HB3 GLU 133 1HB GLU 133 -25.812 7.336 4.633 1035 HG2 GLU 133 2HG GLU 133 -27.776 8.770 5.750 1036 HG3 GLU 133 1HG GLU 133 -28.485 7.167 5.949 Start of MODEL 8 1 H1 MET 1 1HT MET 1 8.416 -29.047 -2.779 2 H2 MET 1 2HT MET 1 7.923 -30.539 -2.133 3 H3 MET 1 3HT MET 1 7.804 -29.124 -1.200 4 HA MET 1 HA MET 1 6.103 -30.026 -3.429 5 HB2 MET 1 2HB MET 1 6.029 -29.663 -0.594 6 HB3 MET 1 1HB MET 1 4.879 -28.536 -1.313 7 HG2 MET 1 2HG MET 1 3.646 -30.255 -2.344 8 HG3 MET 1 1HG MET 1 4.971 -31.411 -2.209 9 HE1 MET 1 2HE MET 1 3.681 -33.190 -1.432 10 HE2 MET 1 3HE MET 1 3.416 -33.507 0.280 11 HE3 MET 1 1HE MET 1 5.051 -33.205 -0.325 12 H MET 2 H MET 2 4.251 -27.990 -3.328 13 HA MET 2 HA MET 2 5.804 -25.643 -4.366 14 HB2 MET 2 2HB MET 2 4.073 -27.283 -5.665 15 HB3 MET 2 1HB MET 2 2.947 -26.062 -5.071 16 HG2 MET 2 2HG MET 2 5.084 -24.557 -6.008 17 HG3 MET 2 1HG MET 2 4.956 -25.860 -7.188 18 HE1 MET 2 3HE MET 2 3.019 -25.762 -9.195 19 HE2 MET 2 1HE MET 2 1.431 -25.825 -8.419 20 HE3 MET 2 2HE MET 2 2.757 -26.802 -7.797 21 H GLU 3 H GLU 3 5.492 -25.554 -1.659 22 HA GLU 3 HA GLU 3 3.178 -23.689 -1.256 23 HB2 GLU 3 2HB GLU 3 3.220 -24.558 1.094 24 HB3 GLU 3 1HB GLU 3 2.848 -25.812 -0.095 25 HG2 GLU 3 2HG GLU 3 5.082 -26.669 -0.016 26 HG3 GLU 3 1HG GLU 3 5.658 -25.262 0.886 27 H GLU 4 H GLU 4 6.526 -24.070 -1.222 28 HA GLU 4 HA GLU 4 7.116 -22.266 0.954 29 HB2 GLU 4 2HB GLU 4 8.877 -22.994 -1.396 30 HB3 GLU 4 1HB GLU 4 9.388 -22.578 0.240 31 HG2 GLU 4 2HG GLU 4 7.558 -24.760 0.432 32 HG3 GLU 4 1HG GLU 4 8.749 -25.163 -0.804 33 H TYR 5 H TYR 5 5.890 -21.785 -2.121 34 HA TYR 5 HA TYR 5 7.205 -19.272 -2.768 35 HB2 TYR 5 2HB TYR 5 5.052 -21.027 -3.819 36 HB3 TYR 5 1HB TYR 5 4.962 -19.328 -4.284 37 HD1 TYR 5 1HD TYR 5 6.726 -18.287 -5.625 38 HD2 TYR 5 2HD TYR 5 6.914 -22.437 -4.531 39 HE1 TYR 5 1HE TYR 5 8.512 -18.649 -7.308 40 HE2 TYR 5 2HE TYR 5 8.701 -22.798 -6.213 41 HH TYR 5 HH TYR 5 10.555 -21.002 -7.339 42 H LEU 6 H LEU 6 4.401 -20.280 -1.026 43 HA LEU 6 HA LEU 6 3.341 -17.526 -0.775 44 HB2 LEU 6 2HB LEU 6 1.464 -18.632 0.265 45 HB3 LEU 6 1HB LEU 6 1.948 -19.634 -1.101 46 HG LEU 6 HG LEU 6 3.532 -20.615 0.925 47 HD11 LEU 6 1HD1 LEU 6 1.484 -19.126 2.186 48 HD12 LEU 6 2HD1 LEU 6 2.613 -20.248 2.944 49 HD13 LEU 6 3HD1 LEU 6 1.049 -20.826 2.372 50 HD21 LEU 6 3HD2 LEU 6 0.742 -21.575 0.225 51 HD22 LEU 6 1HD2 LEU 6 2.075 -22.558 0.830 52 HD23 LEU 6 2HD2 LEU 6 2.162 -21.852 -0.783 53 H GLY 7 H GLY 7 5.227 -19.869 1.018 54 HA2 GLY 7 2HA GLY 7 4.902 -18.778 3.641 55 HA3 GLY 7 1HA GLY 7 6.295 -19.716 3.103 56 H VAL 8 H VAL 8 7.303 -18.097 1.079 57 HA VAL 8 HA VAL 8 8.523 -15.950 2.660 58 HB VAL 8 HB VAL 8 8.890 -16.529 -0.275 59 HG11 VAL 8 1HG1 VAL 8 11.214 -15.830 0.238 60 HG12 VAL 8 2HG1 VAL 8 10.750 -15.566 1.920 61 HG13 VAL 8 3HG1 VAL 8 10.048 -14.570 0.644 62 HG21 VAL 8 3HG2 VAL 8 9.143 -18.695 0.553 63 HG22 VAL 8 1HG2 VAL 8 9.725 -18.137 2.122 64 HG23 VAL 8 2HG2 VAL 8 10.786 -18.070 0.714 65 H PHE 9 H PHE 9 6.203 -16.276 0.115 66 HA PHE 9 HA PHE 9 6.111 -13.585 -0.833 67 HB2 PHE 9 2HB PHE 9 4.943 -15.078 -2.159 68 HB3 PHE 9 1HB PHE 9 4.378 -16.012 -0.779 69 HD1 PHE 9 1HD PHE 9 4.014 -12.523 -2.131 70 HD2 PHE 9 2HD PHE 9 2.104 -15.918 -0.324 71 HE1 PHE 9 1HE PHE 9 1.834 -11.344 -2.222 72 HE2 PHE 9 2HE PHE 9 -0.076 -14.741 -0.414 73 HZ PHE 9 HZ PHE 9 -0.211 -12.455 -1.363 74 H VAL 10 H VAL 10 4.270 -15.212 1.773 75 HA VAL 10 HA VAL 10 2.826 -12.817 2.549 76 HB VAL 10 HB VAL 10 3.418 -15.393 4.046 77 HG11 VAL 10 1HG1 VAL 10 1.871 -13.001 4.659 78 HG12 VAL 10 2HG1 VAL 10 2.278 -14.365 5.702 79 HG13 VAL 10 3HG1 VAL 10 0.858 -14.445 4.657 80 HG21 VAL 10 3HG2 VAL 10 1.069 -14.678 2.260 81 HG22 VAL 10 1HG2 VAL 10 1.336 -16.218 3.078 82 HG23 VAL 10 2HG2 VAL 10 2.410 -15.714 1.774 83 H ASP 11 H ASP 11 5.866 -14.349 3.552 84 HA ASP 11 HA ASP 11 6.264 -12.751 5.917 85 HB2 ASP 11 2HB ASP 11 7.367 -14.959 5.092 86 HB3 ASP 11 1HB ASP 11 8.432 -13.899 4.168 87 H GLU 12 H GLU 12 6.647 -12.192 2.566 88 HA GLU 12 HA GLU 12 8.383 -9.821 2.926 89 HB2 GLU 12 2HB GLU 12 7.229 -11.413 0.647 90 HB3 GLU 12 1HB GLU 12 7.874 -9.799 0.340 91 HG2 GLU 12 2HG GLU 12 10.044 -10.409 0.892 92 HG3 GLU 12 1HG GLU 12 9.515 -11.718 1.949 93 H THR 13 H THR 13 5.087 -10.602 1.786 94 HA THR 13 HA THR 13 4.213 -7.957 1.250 95 HB THR 13 HB THR 13 3.169 -10.361 0.909 96 HG1 THR 13 1HG THR 13 2.040 -7.859 1.185 97 HG21 THR 13 3HG2 THR 13 2.990 -10.538 3.510 98 HG22 THR 13 1HG2 THR 13 1.644 -11.106 2.524 99 HG23 THR 13 2HG2 THR 13 1.558 -9.530 3.309 100 H LYS 14 H LYS 14 4.534 -9.718 4.290 101 HA LYS 14 HA LYS 14 3.075 -7.771 5.901 102 HB2 LYS 14 2HB LYS 14 4.950 -10.090 6.398 103 HB3 LYS 14 1HB LYS 14 4.349 -9.100 7.729 104 HG2 LYS 14 2HG LYS 14 2.188 -9.860 7.506 105 HG3 LYS 14 1HG LYS 14 2.345 -10.110 5.765 106 HD2 LYS 14 2HD LYS 14 2.926 -12.267 6.054 107 HD3 LYS 14 1HD LYS 14 4.165 -11.832 7.232 108 HE2 LYS 14 2HE LYS 14 1.246 -11.813 8.010 109 HE3 LYS 14 1HE LYS 14 2.194 -13.312 8.063 110 HZ1 LYS 14 3HZ LYS 14 3.669 -12.439 9.587 111 HZ2 LYS 14 1HZ LYS 14 2.207 -11.762 10.115 112 HZ3 LYS 14 2HZ LYS 14 3.293 -10.827 9.202 113 H GLU 15 H GLU 15 6.530 -8.539 5.364 114 HA GLU 15 HA GLU 15 7.568 -6.437 6.996 115 HB2 GLU 15 2HB GLU 15 8.608 -7.930 4.577 116 HB3 GLU 15 1HB GLU 15 9.612 -6.841 5.534 117 HG2 GLU 15 2HG GLU 15 9.134 -8.194 7.554 118 HG3 GLU 15 1HG GLU 15 8.172 -9.299 6.572 119 H TYR 16 H TYR 16 5.939 -6.371 4.029 120 HA TYR 16 HA TYR 16 7.116 -3.821 3.130 121 HB2 TYR 16 2HB TYR 16 5.114 -5.818 2.073 122 HB3 TYR 16 1HB TYR 16 5.304 -4.244 1.301 123 HD1 TYR 16 2HD TYR 16 8.215 -3.772 1.625 124 HD2 TYR 16 1HD TYR 16 6.078 -7.342 0.554 125 HE1 TYR 16 2HE TYR 16 10.215 -4.610 0.423 126 HE2 TYR 16 1HE TYR 16 8.079 -8.178 -0.650 127 HH TYR 16 HH TYR 16 10.900 -7.450 -0.249 128 H LEU 17 H LEU 17 3.972 -5.063 4.321 129 HA LEU 17 HA LEU 17 2.574 -2.572 4.112 130 HB2 LEU 17 2HB LEU 17 0.899 -3.706 5.333 131 HB3 LEU 17 1HB LEU 17 1.782 -5.025 4.567 132 HG LEU 17 HG LEU 17 3.219 -5.009 6.746 133 HD11 LEU 17 1HD1 LEU 17 0.999 -3.151 7.363 134 HD12 LEU 17 2HD1 LEU 17 2.599 -3.275 8.095 135 HD13 LEU 17 3HD1 LEU 17 1.314 -4.377 8.592 136 HD21 LEU 17 3HD2 LEU 17 2.059 -6.895 7.212 137 HD22 LEU 17 1HD2 LEU 17 0.975 -6.437 5.899 138 HD23 LEU 17 2HD2 LEU 17 0.590 -5.984 7.559 139 H GLN 18 H GLN 18 4.696 -3.924 6.581 140 HA GLN 18 HA GLN 18 4.223 -1.804 8.504 141 HB2 GLN 18 2HB GLN 18 5.170 -3.432 9.736 142 HB3 GLN 18 1HB GLN 18 5.542 -4.323 8.268 143 HG2 GLN 18 2HG GLN 18 7.648 -3.132 8.022 144 HG3 GLN 18 1HG GLN 18 7.267 -2.109 9.407 145 HE21 GLN 18 1HE2 GLN 18 6.428 -5.538 9.444 146 HE22 GLN 18 2HE2 GLN 18 7.593 -5.997 10.590 147 H ASN 19 H ASN 19 6.695 -2.668 6.184 148 HA ASN 19 HA ASN 19 8.343 -0.341 6.532 149 HB2 ASN 19 2HB ASN 19 9.207 -2.285 5.391 150 HB3 ASN 19 1HB ASN 19 7.837 -2.311 4.280 151 HD21 ASN 19 1HD2 ASN 19 8.457 -1.572 2.246 152 HD22 ASN 19 2HD2 ASN 19 9.576 -0.330 1.954 153 H LEU 20 H LEU 20 5.363 -1.064 5.023 154 HA LEU 20 HA LEU 20 5.261 1.449 3.474 155 HB2 LEU 20 2HB LEU 20 4.412 -0.543 2.413 156 HB3 LEU 20 1HB LEU 20 3.461 -0.958 3.838 157 HG LEU 20 HG LEU 20 2.287 1.330 3.440 158 HD11 LEU 20 1HD1 LEU 20 2.284 2.053 1.094 159 HD12 LEU 20 2HD1 LEU 20 3.439 0.782 0.688 160 HD13 LEU 20 3HD1 LEU 20 3.923 2.109 1.743 161 HD21 LEU 20 3HD2 LEU 20 0.594 0.049 2.668 162 HD22 LEU 20 1HD2 LEU 20 1.742 -1.289 2.672 163 HD23 LEU 20 2HD2 LEU 20 1.477 -0.360 1.198 164 H ASN 21 H ASN 21 4.545 0.325 6.590 165 HA ASN 21 HA ASN 21 2.376 2.273 7.033 166 HB2 ASN 21 2HB ASN 21 3.570 -0.086 8.396 167 HB3 ASN 21 1HB ASN 21 2.913 1.182 9.437 168 HD21 ASN 21 1HD2 ASN 21 1.374 -0.871 9.833 169 HD22 ASN 21 2HD2 ASN 21 -0.017 -0.921 8.861 170 H ASP 22 H ASP 22 5.681 1.531 7.636 171 HA ASP 22 HA ASP 22 6.179 3.675 9.438 172 HB2 ASP 22 2HB ASP 22 7.543 1.493 8.796 173 HB3 ASP 22 1HB ASP 22 8.268 2.567 7.600 174 H THR 23 H THR 23 6.083 3.206 6.071 175 HA THR 23 HA THR 23 7.149 5.807 5.256 176 HB THR 23 HB THR 23 5.516 3.620 3.958 177 HG1 THR 23 1HG THR 23 8.243 4.195 3.535 178 HG21 THR 23 3HG2 THR 23 6.971 4.965 1.984 179 HG22 THR 23 1HG2 THR 23 6.323 6.249 3.006 180 HG23 THR 23 2HG2 THR 23 5.233 5.080 2.262 181 H LEU 24 H LEU 24 3.996 4.217 5.654 182 HA LEU 24 HA LEU 24 2.416 6.490 4.777 183 HB2 LEU 24 2HB LEU 24 1.952 3.877 6.214 184 HB3 LEU 24 1HB LEU 24 0.641 5.043 6.044 185 HG LEU 24 HG LEU 24 2.279 4.027 3.707 186 HD11 LEU 24 1HD1 LEU 24 0.694 2.363 3.312 187 HD12 LEU 24 2HD1 LEU 24 -0.547 3.176 4.265 188 HD13 LEU 24 3HD1 LEU 24 0.779 2.341 5.073 189 HD21 LEU 24 3HD2 LEU 24 -0.409 4.921 3.138 190 HD22 LEU 24 1HD2 LEU 24 1.117 5.549 2.517 191 HD23 LEU 24 2HD2 LEU 24 0.457 6.175 4.027 192 H LEU 25 H LEU 25 3.912 5.386 7.739 193 HA LEU 25 HA LEU 25 2.329 7.202 9.440 194 HB2 LEU 25 2HB LEU 25 4.715 5.394 9.816 195 HB3 LEU 25 1HB LEU 25 4.073 6.387 11.132 196 HG LEU 25 HG LEU 25 2.279 4.642 9.485 197 HD11 LEU 25 1HD1 LEU 25 2.512 3.036 11.508 198 HD12 LEU 25 2HD1 LEU 25 4.025 3.885 11.825 199 HD13 LEU 25 3HD1 LEU 25 3.797 3.028 10.299 200 HD21 LEU 25 3HD2 LEU 25 0.711 5.079 11.135 201 HD22 LEU 25 1HD2 LEU 25 1.651 6.571 11.198 202 HD23 LEU 25 2HD2 LEU 25 1.936 5.296 12.387 203 H GLU 26 H GLU 26 5.171 7.336 7.590 204 HA GLU 26 HA GLU 26 6.077 9.835 8.900 205 HB2 GLU 26 2HB GLU 26 7.202 8.013 6.746 206 HB3 GLU 26 1HB GLU 26 7.973 9.530 7.212 207 HG2 GLU 26 2HG GLU 26 7.329 7.918 9.544 208 HG3 GLU 26 1HG GLU 26 8.363 7.037 8.420 209 H LEU 27 H LEU 27 4.468 8.463 6.243 210 HA LEU 27 HA LEU 27 4.514 10.728 4.530 211 HB2 LEU 27 2HB LEU 27 4.156 8.486 3.683 212 HB3 LEU 27 1HB LEU 27 2.778 8.271 4.761 213 HG LEU 27 HG LEU 27 1.560 10.045 3.579 214 HD11 LEU 27 1HD1 LEU 27 2.465 11.143 1.651 215 HD12 LEU 27 2HD1 LEU 27 3.859 10.063 1.610 216 HD13 LEU 27 3HD1 LEU 27 3.703 11.251 2.903 217 HD21 LEU 27 3HD2 LEU 27 1.610 8.833 1.238 218 HD22 LEU 27 1HD2 LEU 27 1.032 7.963 2.658 219 HD23 LEU 27 2HD2 LEU 27 2.672 7.697 2.069 220 H GLU 28 H GLU 28 2.558 9.667 7.223 221 HA GLU 28 HA GLU 28 0.350 11.494 6.718 222 HB2 GLU 28 2HB GLU 28 -0.035 11.019 9.213 223 HB3 GLU 28 1HB GLU 28 -0.132 9.654 8.108 224 HG2 GLU 28 2HG GLU 28 2.010 8.861 8.753 225 HG3 GLU 28 1HG GLU 28 2.415 10.378 9.549 226 H LYS 29 H LYS 29 3.346 11.587 8.611 227 HA LYS 29 HA LYS 29 2.796 14.223 9.717 228 HB2 LYS 29 2HB LYS 29 4.520 13.553 11.016 229 HB3 LYS 29 1HB LYS 29 4.566 12.071 10.070 230 HG2 LYS 29 2HG LYS 29 5.971 13.658 8.410 231 HG3 LYS 29 1HG LYS 29 6.347 14.450 9.942 232 HD2 LYS 29 2HD LYS 29 6.561 11.486 9.466 233 HD3 LYS 29 1HD LYS 29 7.924 12.596 9.322 234 HE2 LYS 29 2HE LYS 29 6.655 13.160 11.804 235 HE3 LYS 29 1HE LYS 29 6.859 11.399 11.705 236 HZ1 LYS 29 3HZ LYS 29 9.161 12.019 10.747 237 HZ2 LYS 29 1HZ LYS 29 8.932 12.085 12.427 238 HZ3 LYS 29 2HZ LYS 29 8.905 13.516 11.511 239 H ASN 30 H ASN 30 3.779 12.895 6.805 240 HA ASN 30 HA ASN 30 4.153 15.550 5.579 241 HB2 ASN 30 2HB ASN 30 6.364 14.071 6.506 242 HB3 ASN 30 1HB ASN 30 6.323 13.774 4.768 243 HD21 ASN 30 1HD2 ASN 30 7.299 16.031 7.146 244 HD22 ASN 30 2HD2 ASN 30 7.592 17.346 6.114 245 HA PRO 31 HA PRO 31 2.048 12.459 3.065 246 HB2 PRO 31 2HB PRO 31 -0.283 13.832 2.892 247 HB3 PRO 31 1HB PRO 31 0.138 12.795 4.262 248 HG2 PRO 31 2HG PRO 31 0.059 15.723 4.098 249 HG3 PRO 31 1HG PRO 31 -0.170 14.650 5.485 250 HD2 PRO 31 2HD PRO 31 2.157 16.086 4.815 251 HD3 PRO 31 1HD PRO 31 1.976 14.852 6.083 252 H GLU 32 H GLU 32 3.706 15.052 2.410 253 HA GLU 32 HA GLU 32 2.760 15.199 -0.403 254 HB2 GLU 32 2HB GLU 32 3.291 17.814 0.037 255 HB3 GLU 32 1HB GLU 32 1.683 17.125 0.240 256 HG2 GLU 32 2HG GLU 32 1.800 17.172 2.548 257 HG3 GLU 32 1HG GLU 32 3.558 17.018 2.567 258 H ASP 33 H ASP 33 5.179 14.386 1.476 259 HA ASP 33 HA ASP 33 7.405 15.977 0.573 260 HB2 ASP 33 2HB ASP 33 8.673 13.958 1.462 261 HB3 ASP 33 1HB ASP 33 7.549 14.695 2.604 262 H MET 34 H MET 34 5.542 13.514 -0.828 263 HA MET 34 HA MET 34 5.624 12.463 -2.923 264 HB2 MET 34 2HB MET 34 7.261 14.911 -3.090 265 HB3 MET 34 1HB MET 34 7.673 13.692 -4.298 266 HG2 MET 34 2HG MET 34 5.149 13.521 -4.747 267 HG3 MET 34 1HG MET 34 4.998 15.014 -3.819 268 HE1 MET 34 3HE MET 34 3.756 15.234 -5.895 269 HE2 MET 34 1HE MET 34 4.436 14.827 -7.477 270 HE3 MET 34 2HE MET 34 4.330 16.510 -6.966 271 H GLU 35 H GLU 35 7.840 12.162 -0.583 272 HA GLU 35 HA GLU 35 9.611 10.363 -2.156 273 HB2 GLU 35 2HB GLU 35 11.227 10.754 -0.464 274 HB3 GLU 35 1HB GLU 35 10.414 12.312 -0.584 275 HG2 GLU 35 2HG GLU 35 8.999 11.767 1.330 276 HG3 GLU 35 1HG GLU 35 9.703 10.153 1.421 277 H LEU 36 H LEU 36 7.581 10.661 0.713 278 HA LEU 36 HA LEU 36 7.674 7.810 1.363 279 HB2 LEU 36 2HB LEU 36 5.740 10.036 2.119 280 HB3 LEU 36 1HB LEU 36 5.861 8.471 2.923 281 HG LEU 36 HG LEU 36 7.900 10.692 2.861 282 HD11 LEU 36 1HD1 LEU 36 7.817 10.197 5.354 283 HD12 LEU 36 2HD1 LEU 36 6.424 9.174 5.008 284 HD13 LEU 36 3HD1 LEU 36 6.357 10.902 4.664 285 HD21 LEU 36 3HD2 LEU 36 9.141 8.658 2.387 286 HD22 LEU 36 1HD2 LEU 36 8.271 7.788 3.650 287 HD23 LEU 36 2HD2 LEU 36 9.397 9.074 4.082 288 H ILE 37 H ILE 37 5.922 9.917 -0.786 289 HA ILE 37 HA ILE 37 3.638 8.159 -1.223 290 HB ILE 37 HB ILE 37 4.885 10.524 -2.651 291 HG12 ILE 37 2HG1 ILE 37 2.213 10.268 -1.252 292 HG13 ILE 37 1HG1 ILE 37 3.681 10.762 -0.410 293 HG21 ILE 37 1HG2 ILE 37 3.795 9.170 -4.354 294 HG22 ILE 37 2HG2 ILE 37 2.774 10.564 -4.002 295 HG23 ILE 37 3HG2 ILE 37 2.366 8.982 -3.338 296 HD11 ILE 37 3HD1 ILE 37 3.810 12.785 -1.526 297 HD12 ILE 37 1HD1 ILE 37 2.059 12.568 -1.496 298 HD13 ILE 37 2HD1 ILE 37 2.973 12.171 -2.952 299 H ASN 38 H ASN 38 6.857 8.613 -2.640 300 HA ASN 38 HA ASN 38 6.293 6.686 -4.797 301 HB2 ASN 38 2HB ASN 38 7.788 8.843 -4.803 302 HB3 ASN 38 1HB ASN 38 8.990 7.793 -4.052 303 HD21 ASN 38 1HD2 ASN 38 6.787 7.857 -6.910 304 HD22 ASN 38 2HD2 ASN 38 7.849 7.014 -7.931 305 H GLU 39 H GLU 39 7.680 6.798 -1.656 306 HA GLU 39 HA GLU 39 9.121 4.273 -1.820 307 HB2 GLU 39 2HB GLU 39 8.199 6.118 0.390 308 HB3 GLU 39 1HB GLU 39 9.047 4.611 0.738 309 HG2 GLU 39 2HG GLU 39 10.218 6.509 -1.268 310 HG3 GLU 39 1HG GLU 39 10.410 6.852 0.452 311 H ALA 40 H ALA 40 5.947 5.365 -1.130 312 HA ALA 40 HA ALA 40 5.013 2.755 -0.092 313 HB1 ALA 40 1HB ALA 40 4.365 5.211 0.615 314 HB2 ALA 40 2HB ALA 40 3.107 3.978 0.538 315 HB3 ALA 40 3HB ALA 40 3.296 5.130 -0.785 316 H PHE 41 H PHE 41 4.313 4.975 -2.827 317 HA PHE 41 HA PHE 41 2.512 3.445 -4.311 318 HB2 PHE 41 2HB PHE 41 3.407 5.732 -4.806 319 HB3 PHE 41 1HB PHE 41 4.925 4.998 -5.315 320 HD1 PHE 41 2HD PHE 41 1.240 4.596 -5.947 321 HD2 PHE 41 1HD PHE 41 5.209 4.611 -7.585 322 HE1 PHE 41 2HE PHE 41 0.307 4.233 -8.217 323 HE2 PHE 41 1HE PHE 41 4.277 4.246 -9.853 324 HZ PHE 41 HZ PHE 41 1.825 4.059 -10.169 325 H ARG 42 H ARG 42 6.052 3.118 -4.122 326 HA ARG 42 HA ARG 42 6.273 0.976 -6.054 327 HB2 ARG 42 2HB ARG 42 7.928 2.346 -3.962 328 HB3 ARG 42 1HB ARG 42 8.517 0.824 -4.627 329 HG2 ARG 42 2HG ARG 42 9.341 2.864 -5.840 330 HG3 ARG 42 1HG ARG 42 8.492 1.715 -6.866 331 HD2 ARG 42 2HD ARG 42 6.836 3.855 -5.611 332 HD3 ARG 42 1HD ARG 42 7.925 4.338 -6.922 333 HE ARG 42 HE ARG 42 5.628 2.528 -7.192 334 HH11 ARG 42 1HH2 ARG 42 7.155 4.716 -8.967 335 HH12 ARG 42 2HH2 ARG 42 7.517 3.722 -10.339 336 HH21 ARG 42 1HH1 ARG 42 6.736 0.753 -8.727 337 HH22 ARG 42 2HH1 ARG 42 7.278 1.478 -10.204 338 H ALA 43 H ALA 43 6.909 0.925 -2.538 339 HA ALA 43 HA ALA 43 7.073 -1.743 -1.980 340 HB1 ALA 43 1HB ALA 43 7.233 -0.049 -0.282 341 HB2 ALA 43 2HB ALA 43 5.914 -1.119 0.193 342 HB3 ALA 43 3HB ALA 43 5.560 0.447 -0.538 343 H LEU 44 H LEU 44 3.963 -0.009 -2.427 344 HA LEU 44 HA LEU 44 2.370 -2.399 -1.992 345 HB2 LEU 44 2HB LEU 44 1.909 0.368 -3.115 346 HB3 LEU 44 1HB LEU 44 0.618 -0.834 -3.079 347 HG LEU 44 HG LEU 44 2.188 -0.377 -0.579 348 HD11 LEU 44 1HD1 LEU 44 1.723 1.898 -1.147 349 HD12 LEU 44 2HD1 LEU 44 0.469 1.423 -0.004 350 HD13 LEU 44 3HD1 LEU 44 0.108 1.495 -1.728 351 HD21 LEU 44 3HD2 LEU 44 -0.481 -0.537 0.033 352 HD22 LEU 44 1HD2 LEU 44 0.599 -1.928 -0.064 353 HD23 LEU 44 2HD2 LEU 44 -0.405 -1.493 -1.447 354 H HIS 45 H HIS 45 3.313 -0.566 -4.923 355 HA HIS 45 HA HIS 45 2.079 -2.319 -6.815 356 HB2 HIS 45 2HB HIS 45 3.233 0.039 -6.989 357 HB3 HIS 45 1HB HIS 45 4.703 -0.897 -7.260 358 HD1 HIS 45 1HD HIS 45 4.602 0.169 -9.739 359 HD2 HIS 45 2HD HIS 45 1.579 -2.548 -8.815 360 HE1 HIS 45 1HE HIS 45 3.563 -0.522 -11.942 361 H THR 46 H THR 46 5.058 -2.436 -4.989 362 HA THR 46 HA THR 46 6.260 -4.627 -6.479 363 HB THR 46 HB THR 46 6.848 -2.775 -4.306 364 HG1 THR 46 1HG THR 46 8.799 -4.311 -5.543 365 HG21 THR 46 3HG2 THR 46 8.549 -4.353 -3.222 366 HG22 THR 46 1HG2 THR 46 7.622 -5.673 -3.934 367 HG23 THR 46 2HG2 THR 46 6.862 -4.591 -2.767 368 H LEU 47 H LEU 47 4.642 -4.348 -3.273 369 HA LEU 47 HA LEU 47 4.683 -7.249 -2.891 370 HB2 LEU 47 2HB LEU 47 3.800 -6.725 -0.775 371 HB3 LEU 47 1HB LEU 47 4.723 -5.277 -1.175 372 HG LEU 47 HG LEU 47 2.494 -4.402 -2.182 373 HD11 LEU 47 1HD1 LEU 47 0.903 -6.048 -2.161 374 HD12 LEU 47 2HD1 LEU 47 0.676 -5.527 -0.493 375 HD13 LEU 47 3HD1 LEU 47 1.690 -6.925 -0.850 376 HD21 LEU 47 3HD2 LEU 47 1.729 -4.085 0.403 377 HD22 LEU 47 1HD2 LEU 47 3.062 -3.187 -0.323 378 HD23 LEU 47 2HD2 LEU 47 3.391 -4.628 0.640 379 H LYS 48 H LYS 48 2.328 -4.836 -4.002 380 HA LYS 48 HA LYS 48 -0.056 -6.325 -4.007 381 HB2 LYS 48 2HB LYS 48 -0.004 -4.011 -4.632 382 HB3 LYS 48 1HB LYS 48 1.164 -4.316 -5.916 383 HG2 LYS 48 2HG LYS 48 -1.005 -6.014 -6.479 384 HG3 LYS 48 1HG LYS 48 -1.722 -4.475 -6.006 385 HD2 LYS 48 2HD LYS 48 -1.357 -4.039 -8.238 386 HD3 LYS 48 1HD LYS 48 0.190 -3.506 -7.578 387 HE2 LYS 48 2HE LYS 48 1.239 -5.618 -8.153 388 HE3 LYS 48 1HE LYS 48 -0.322 -6.307 -8.642 389 HZ1 LYS 48 3HZ LYS 48 1.187 -4.099 -9.909 390 HZ2 LYS 48 1HZ LYS 48 -0.478 -4.292 -10.169 391 HZ3 LYS 48 2HZ LYS 48 0.600 -5.523 -10.626 392 H GLY 49 H GLY 49 2.514 -6.201 -6.506 393 HA2 GLY 49 2HA GLY 49 1.349 -8.107 -8.277 394 HA3 GLY 49 1HA GLY 49 3.073 -7.738 -8.191 395 H MET 50 H MET 50 3.801 -8.561 -5.698 396 HA MET 50 HA MET 50 4.200 -11.323 -5.872 397 HB2 MET 50 2HB MET 50 4.275 -9.211 -3.813 398 HB3 MET 50 1HB MET 50 4.082 -10.839 -3.162 399 HG2 MET 50 2HG MET 50 6.016 -11.472 -4.785 400 HG3 MET 50 1HG MET 50 6.328 -9.737 -4.842 401 HE1 MET 50 3HE MET 50 6.352 -8.289 -2.497 402 HE2 MET 50 1HE MET 50 6.410 -9.059 -0.905 403 HE3 MET 50 2HE MET 50 4.981 -9.233 -1.921 404 H ALA 51 H ALA 51 1.329 -9.600 -4.912 405 HA ALA 51 HA ALA 51 0.054 -11.980 -3.702 406 HB1 ALA 51 1HB ALA 51 -0.645 -9.079 -4.174 407 HB2 ALA 51 2HB ALA 51 -0.413 -9.907 -2.637 408 HB3 ALA 51 3HB ALA 51 -1.857 -10.223 -3.600 409 H GLY 52 H GLY 52 0.172 -10.235 -6.724 410 HA2 GLY 52 2HA GLY 52 -2.202 -11.635 -7.791 411 HA3 GLY 52 1HA GLY 52 -1.237 -10.430 -8.650 412 H THR 53 H THR 53 1.258 -11.788 -7.764 413 HA THR 53 HA THR 53 1.505 -13.658 -9.996 414 HB THR 53 HB THR 53 3.237 -12.414 -7.880 415 HG1 THR 53 1HG THR 53 3.882 -12.581 -10.580 416 HG21 THR 53 3HG2 THR 53 5.165 -13.705 -8.632 417 HG22 THR 53 1HG2 THR 53 4.154 -14.600 -9.766 418 HG23 THR 53 2HG2 THR 53 3.921 -14.801 -8.030 419 H MET 54 H MET 54 0.549 -13.855 -6.774 420 HA MET 54 HA MET 54 1.340 -16.723 -6.528 421 HB2 MET 54 2HB MET 54 1.947 -14.912 -4.812 422 HB3 MET 54 1HB MET 54 0.232 -14.889 -4.396 423 HG2 MET 54 2HG MET 54 0.433 -16.777 -3.185 424 HG3 MET 54 1HG MET 54 1.216 -17.613 -4.525 425 HE1 MET 54 3HE MET 54 4.079 -15.276 -4.599 426 HE2 MET 54 1HE MET 54 3.307 -16.649 -5.401 427 HE3 MET 54 2HE MET 54 4.760 -16.892 -4.435 428 H GLY 55 H GLY 55 -1.163 -15.072 -7.737 429 HA2 GLY 55 2HA GLY 55 -3.281 -16.020 -8.331 430 HA3 GLY 55 1HA GLY 55 -3.074 -17.220 -7.054 431 H PHE 56 H PHE 56 -2.229 -14.669 -5.373 432 HA PHE 56 HA PHE 56 -4.961 -14.243 -4.318 433 HB2 PHE 56 2HB PHE 56 -2.165 -13.443 -3.456 434 HB3 PHE 56 1HB PHE 56 -3.618 -13.043 -2.537 435 HD1 PHE 56 2HD PHE 56 -5.273 -15.437 -2.868 436 HD2 PHE 56 1HD PHE 56 -1.044 -15.092 -2.199 437 HE1 PHE 56 2HE PHE 56 -5.251 -17.695 -1.844 438 HE2 PHE 56 1HE PHE 56 -1.023 -17.351 -1.175 439 HZ PHE 56 HZ PHE 56 -3.125 -18.652 -0.998 440 H SER 57 H SER 57 -4.676 -13.106 -6.877 441 HA SER 57 HA SER 57 -3.789 -10.402 -6.901 442 HB2 SER 57 2HB SER 57 -5.946 -11.833 -8.463 443 HB3 SER 57 1HB SER 57 -5.258 -10.274 -8.908 444 HG SER 57 HG SER 57 -4.046 -11.710 -10.000 445 H SER 58 H SER 58 -6.592 -11.895 -5.618 446 HA SER 58 HA SER 58 -8.403 -9.679 -5.551 447 HB2 SER 58 2HB SER 58 -7.972 -12.224 -4.001 448 HB3 SER 58 1HB SER 58 -9.171 -11.064 -3.437 449 HG SER 58 HG SER 58 -10.427 -11.737 -4.968 450 H MET 59 H MET 59 -5.866 -10.860 -3.390 451 HA MET 59 HA MET 59 -6.224 -8.660 -1.495 452 HB2 MET 59 2HB MET 59 -5.564 -10.947 -0.827 453 HB3 MET 59 1HB MET 59 -4.123 -10.830 -1.839 454 HG2 MET 59 2HG MET 59 -3.655 -8.665 -0.407 455 HG3 MET 59 1HG MET 59 -4.747 -9.429 0.748 456 HE1 MET 59 3HE MET 59 -2.311 -10.129 -1.810 457 HE2 MET 59 1HE MET 59 -2.110 -11.861 -1.517 458 HE3 MET 59 2HE MET 59 -0.856 -10.727 -1.017 459 H ALA 60 H ALA 60 -4.442 -9.307 -4.400 460 HA ALA 60 HA ALA 60 -2.317 -7.348 -3.926 461 HB1 ALA 60 1HB ALA 60 -3.386 -8.642 -6.464 462 HB2 ALA 60 2HB ALA 60 -2.133 -9.332 -5.434 463 HB3 ALA 60 3HB ALA 60 -1.832 -7.827 -6.303 464 H LYS 61 H LYS 61 -5.476 -7.424 -5.558 465 HA LYS 61 HA LYS 61 -5.312 -4.835 -6.787 466 HB2 LYS 61 2HB LYS 61 -7.595 -6.538 -5.727 467 HB3 LYS 61 1HB LYS 61 -7.842 -5.084 -6.697 468 HG2 LYS 61 2HG LYS 61 -7.204 -6.116 -8.623 469 HG3 LYS 61 1HG LYS 61 -5.901 -7.002 -7.824 470 HD2 LYS 61 2HD LYS 61 -7.441 -8.693 -8.414 471 HD3 LYS 61 1HD LYS 61 -7.793 -8.373 -6.715 472 HE2 LYS 61 2HE LYS 61 -9.944 -8.241 -7.559 473 HE3 LYS 61 1HE LYS 61 -9.442 -6.559 -7.820 474 HZ1 LYS 61 3HZ LYS 61 -9.274 -8.794 -9.768 475 HZ2 LYS 61 1HZ LYS 61 -8.565 -7.273 -10.012 476 HZ3 LYS 61 2HZ LYS 61 -10.254 -7.412 -9.886 477 H LEU 62 H LEU 62 -5.912 -5.967 -3.561 478 HA LEU 62 HA LEU 62 -7.047 -3.535 -2.481 479 HB2 LEU 62 2HB LEU 62 -7.353 -5.673 -1.394 480 HB3 LEU 62 1HB LEU 62 -5.611 -5.959 -1.355 481 HG LEU 62 HG LEU 62 -5.264 -4.300 0.296 482 HD11 LEU 62 1HD1 LEU 62 -6.409 -2.371 -0.133 483 HD12 LEU 62 2HD1 LEU 62 -7.603 -3.058 0.967 484 HD13 LEU 62 3HD1 LEU 62 -7.807 -3.234 -0.775 485 HD21 LEU 62 3HD2 LEU 62 -6.648 -6.448 0.916 486 HD22 LEU 62 1HD2 LEU 62 -7.959 -5.298 1.170 487 HD23 LEU 62 2HD2 LEU 62 -6.472 -5.158 2.106 488 H CYS 63 H CYS 63 -3.787 -4.869 -2.866 489 HA CYS 63 HA CYS 63 -2.460 -2.741 -1.373 490 HB2 CYS 63 2HB CYS 63 -1.415 -4.756 -3.392 491 HB3 CYS 63 1HB CYS 63 -0.450 -3.878 -2.207 492 HG CYS 63 HG CYS 63 -1.650 -6.452 -1.596 493 H HIS 64 H HIS 64 -3.130 -3.430 -4.809 494 HA HIS 64 HA HIS 64 -1.562 -1.251 -5.870 495 HB2 HIS 64 2HB HIS 64 -2.914 -3.379 -6.887 496 HB3 HIS 64 1HB HIS 64 -4.073 -2.094 -7.229 497 HD1 HIS 64 1HD HIS 64 -2.956 -3.122 -9.724 498 HD2 HIS 64 2HD HIS 64 -0.852 -0.298 -7.492 499 HE1 HIS 64 1HE HIS 64 -1.323 -2.019 -11.317 500 H THR 65 H THR 65 -4.737 -1.530 -4.455 501 HA THR 65 HA THR 65 -5.844 0.972 -5.345 502 HB THR 65 HB THR 65 -6.379 -1.229 -3.468 503 HG1 THR 65 1HG THR 65 -7.374 -0.456 -5.585 504 HG21 THR 65 3HG2 THR 65 -7.464 1.528 -2.842 505 HG22 THR 65 1HG2 THR 65 -6.393 0.572 -1.817 506 HG23 THR 65 2HG2 THR 65 -8.039 0.022 -2.127 507 H LEU 66 H LEU 66 -4.404 0.073 -2.165 508 HA LEU 66 HA LEU 66 -4.298 2.675 -1.021 509 HB2 LEU 66 2HB LEU 66 -2.053 0.654 -0.782 510 HB3 LEU 66 1HB LEU 66 -2.697 1.721 0.460 511 HG LEU 66 HG LEU 66 -3.941 -0.794 -0.659 512 HD11 LEU 66 1HD1 LEU 66 -2.426 -0.111 1.658 513 HD12 LEU 66 2HD1 LEU 66 -3.124 -1.674 1.230 514 HD13 LEU 66 3HD1 LEU 66 -4.063 -0.515 2.170 515 HD21 LEU 66 3HD2 LEU 66 -6.030 -0.139 -0.062 516 HD22 LEU 66 1HD2 LEU 66 -5.396 1.505 -0.079 517 HD23 LEU 66 2HD2 LEU 66 -5.452 0.599 1.431 518 H GLU 67 H GLU 67 -2.266 1.021 -3.359 519 HA GLU 67 HA GLU 67 -0.199 3.054 -3.527 520 HB2 GLU 67 2HB GLU 67 0.059 0.648 -4.089 521 HB3 GLU 67 1HB GLU 67 -1.086 0.848 -5.412 522 HG2 GLU 67 2HG GLU 67 1.131 2.791 -5.429 523 HG3 GLU 67 1HG GLU 67 1.633 1.117 -5.665 524 H ASN 68 H ASN 68 -3.084 2.226 -5.447 525 HA ASN 68 HA ASN 68 -2.878 3.986 -7.592 526 HB2 ASN 68 2HB ASN 68 -4.949 2.736 -5.951 527 HB3 ASN 68 1HB ASN 68 -5.486 4.245 -6.687 528 HD21 ASN 68 1HD2 ASN 68 -4.742 0.909 -7.330 529 HD22 ASN 68 2HD2 ASN 68 -4.990 0.960 -9.008 530 H ILE 69 H ILE 69 -4.100 4.700 -4.344 531 HA ILE 69 HA ILE 69 -4.595 7.482 -4.707 532 HB ILE 69 HB ILE 69 -3.485 6.670 -2.083 533 HG12 ILE 69 2HG1 ILE 69 -4.501 4.539 -2.694 534 HG13 ILE 69 1HG1 ILE 69 -5.497 5.341 -1.497 535 HG21 ILE 69 1HG2 ILE 69 -6.112 7.484 -1.775 536 HG22 ILE 69 2HG2 ILE 69 -5.585 8.368 -3.206 537 HG23 ILE 69 3HG2 ILE 69 -4.697 8.533 -1.692 538 HD11 ILE 69 3HD1 ILE 69 -7.209 5.697 -2.923 539 HD12 ILE 69 1HD1 ILE 69 -6.501 4.329 -3.780 540 HD13 ILE 69 2HD1 ILE 69 -6.144 5.978 -4.301 541 H LEU 70 H LEU 70 -1.825 5.680 -3.664 542 HA LEU 70 HA LEU 70 -0.044 7.888 -3.283 543 HB2 LEU 70 2HB LEU 70 0.477 5.007 -4.087 544 HB3 LEU 70 1HB LEU 70 1.707 6.118 -3.485 545 HG LEU 70 HG LEU 70 -0.797 5.401 -1.941 546 HD11 LEU 70 1HD1 LEU 70 0.265 3.381 -1.759 547 HD12 LEU 70 2HD1 LEU 70 1.216 4.244 -0.554 548 HD13 LEU 70 3HD1 LEU 70 1.837 4.049 -2.193 549 HD21 LEU 70 3HD2 LEU 70 1.284 6.211 -0.246 550 HD22 LEU 70 1HD2 LEU 70 -0.128 7.166 -0.699 551 HD23 LEU 70 2HD2 LEU 70 1.370 7.317 -1.618 552 H ASP 71 H ASP 71 -1.336 6.294 -5.994 553 HA ASP 71 HA ASP 71 0.627 7.256 -7.930 554 HB2 ASP 71 2HB ASP 71 -1.212 5.255 -7.879 555 HB3 ASP 71 1HB ASP 71 -2.152 6.496 -8.707 556 H LYS 72 H LYS 72 -2.762 8.108 -6.981 557 HA LYS 72 HA LYS 72 -2.849 10.445 -8.674 558 HB2 LYS 72 2HB LYS 72 -4.259 9.360 -6.281 559 HB3 LYS 72 1HB LYS 72 -4.615 11.010 -6.791 560 HG2 LYS 72 2HG LYS 72 -5.750 10.300 -8.621 561 HG3 LYS 72 1HG LYS 72 -4.566 9.030 -8.963 562 HD2 LYS 72 2HD LYS 72 -6.271 8.782 -6.541 563 HD3 LYS 72 1HD LYS 72 -6.984 8.390 -8.109 564 HE2 LYS 72 2HE LYS 72 -4.420 7.187 -8.057 565 HE3 LYS 72 1HE LYS 72 -5.189 6.816 -6.501 566 HZ1 LYS 72 3HZ LYS 72 -6.678 6.623 -9.053 567 HZ2 LYS 72 1HZ LYS 72 -7.063 5.930 -7.554 568 HZ3 LYS 72 2HZ LYS 72 -5.769 5.313 -8.466 569 H ALA 73 H ALA 73 -1.611 9.714 -5.544 570 HA ALA 73 HA ALA 73 -1.213 12.327 -4.478 571 HB1 ALA 73 1HB ALA 73 0.009 9.598 -4.184 572 HB2 ALA 73 2HB ALA 73 -0.874 10.550 -2.990 573 HB3 ALA 73 3HB ALA 73 0.791 10.967 -3.393 574 H ARG 74 H ARG 74 0.710 10.265 -6.630 575 HA ARG 74 HA ARG 74 2.727 12.403 -6.951 576 HB2 ARG 74 2HB ARG 74 4.035 10.713 -7.967 577 HB3 ARG 74 1HB ARG 74 3.118 9.833 -6.747 578 HG2 ARG 74 2HG ARG 74 1.595 8.972 -8.368 579 HG3 ARG 74 1HG ARG 74 2.158 10.096 -9.605 580 HD2 ARG 74 2HD ARG 74 4.296 8.977 -9.759 581 HD3 ARG 74 1HD ARG 74 3.918 7.963 -8.353 582 HE ARG 74 HE ARG 74 1.986 7.059 -9.748 583 HH11 ARG 74 1HH2 ARG 74 5.136 7.255 -10.787 584 HH12 ARG 74 2HH2 ARG 74 4.800 7.019 -12.470 585 HH21 ARG 74 1HH1 ARG 74 1.364 7.306 -12.096 586 HH22 ARG 74 2HH1 ARG 74 2.664 7.042 -13.209 587 H ASN 75 H ASN 75 -0.217 11.374 -8.330 588 HA ASN 75 HA ASN 75 0.402 12.521 -11.013 589 HB2 ASN 75 2HB ASN 75 -1.083 10.380 -10.187 590 HB3 ASN 75 1HB ASN 75 -2.335 11.614 -10.316 591 HD21 ASN 75 1HD2 ASN 75 -2.603 12.671 -12.468 592 HD22 ASN 75 2HD2 ASN 75 -2.066 11.882 -13.871 593 H SER 76 H SER 76 -0.518 13.643 -8.029 594 HA SER 76 HA SER 76 -1.265 15.788 -7.377 595 HB2 SER 76 2HB SER 76 -0.388 16.092 -9.944 596 HB3 SER 76 1HB SER 76 -2.081 16.545 -10.122 597 HG SER 76 HG SER 76 -0.053 17.912 -9.005 598 H GLU 77 H GLU 77 -3.032 13.387 -7.636 599 HA GLU 77 HA GLU 77 -5.607 14.779 -8.187 600 HB2 GLU 77 2HB GLU 77 -4.703 11.915 -8.369 601 HB3 GLU 77 1HB GLU 77 -6.408 12.354 -8.436 602 HG2 GLU 77 2HG GLU 77 -4.297 13.534 -10.259 603 HG3 GLU 77 1HG GLU 77 -5.284 12.137 -10.693 604 H ILE 78 H ILE 78 -3.895 12.686 -5.947 605 HA ILE 78 HA ILE 78 -5.822 13.545 -3.815 606 HB ILE 78 HB ILE 78 -5.950 11.268 -3.006 607 HG12 ILE 78 2HG1 ILE 78 -4.780 9.489 -4.521 608 HG13 ILE 78 1HG1 ILE 78 -3.748 10.835 -5.007 609 HG21 ILE 78 1HG2 ILE 78 -6.920 10.126 -5.017 610 HG22 ILE 78 2HG2 ILE 78 -6.271 11.426 -6.016 611 HG23 ILE 78 3HG2 ILE 78 -7.504 11.776 -4.804 612 HD11 ILE 78 3HD1 ILE 78 -4.169 10.564 -2.099 613 HD12 ILE 78 1HD1 ILE 78 -2.695 10.919 -3.004 614 HD13 ILE 78 2HD1 ILE 78 -3.261 9.255 -2.850 615 H LYS 79 H LYS 79 -4.756 12.369 -1.660 616 HA LYS 79 HA LYS 79 -1.845 12.489 -1.567 617 HB2 LYS 79 2HB LYS 79 -1.659 14.518 -0.298 618 HB3 LYS 79 1HB LYS 79 -2.679 14.897 -1.686 619 HG2 LYS 79 2HG LYS 79 -4.317 13.901 0.469 620 HG3 LYS 79 1HG LYS 79 -3.316 15.231 1.051 621 HD2 LYS 79 2HD LYS 79 -5.186 15.245 -1.325 622 HD3 LYS 79 1HD LYS 79 -5.342 16.181 0.162 623 HE2 LYS 79 2HE LYS 79 -2.800 16.859 -0.744 624 HE3 LYS 79 1HE LYS 79 -3.767 16.777 -2.230 625 HZ1 LYS 79 3HZ LYS 79 -5.526 17.983 -0.807 626 HZ2 LYS 79 1HZ LYS 79 -4.246 18.886 -1.456 627 HZ3 LYS 79 2HZ LYS 79 -4.212 18.419 0.177 628 H ILE 80 H ILE 80 -1.738 13.111 1.252 629 HA ILE 80 HA ILE 80 -3.295 10.810 2.367 630 HB ILE 80 HB ILE 80 -0.480 11.780 2.656 631 HG12 ILE 80 2HG1 ILE 80 -0.435 9.095 2.359 632 HG13 ILE 80 1HG1 ILE 80 -1.976 9.478 1.590 633 HG21 ILE 80 1HG2 ILE 80 -0.414 11.119 4.813 634 HG22 ILE 80 2HG2 ILE 80 -0.888 9.502 4.300 635 HG23 ILE 80 3HG2 ILE 80 -2.119 10.682 4.747 636 HD11 ILE 80 3HD1 ILE 80 0.246 9.530 0.174 637 HD12 ILE 80 1HD1 ILE 80 0.408 11.132 0.893 638 HD13 ILE 80 2HD1 ILE 80 -1.012 10.739 -0.077 639 H THR 81 H THR 81 -4.784 12.697 2.736 640 HA THR 81 HA THR 81 -4.152 14.591 4.882 641 HB THR 81 HB THR 81 -6.588 15.126 4.527 642 HG1 THR 81 1HG THR 81 -7.021 12.858 3.948 643 HG21 THR 81 3HG2 THR 81 -5.807 15.016 1.752 644 HG22 THR 81 1HG2 THR 81 -4.418 15.443 2.751 645 HG23 THR 81 2HG2 THR 81 -5.887 16.417 2.821 646 H SER 82 H SER 82 -3.774 11.857 5.740 647 HA SER 82 HA SER 82 -4.334 10.548 7.636 648 HB2 SER 82 2HB SER 82 -5.208 11.810 9.325 649 HB3 SER 82 1HB SER 82 -5.157 13.135 8.167 650 HG SER 82 HG SER 82 -7.316 11.375 8.718 651 H ASP 83 H ASP 83 -7.336 11.969 6.291 652 HA ASP 83 HA ASP 83 -8.948 9.624 6.570 653 HB2 ASP 83 2HB ASP 83 -9.223 12.272 5.894 654 HB3 ASP 83 1HB ASP 83 -9.512 11.469 4.352 655 H LEU 84 H LEU 84 -7.358 11.007 3.637 656 HA LEU 84 HA LEU 84 -8.065 8.864 1.881 657 HB2 LEU 84 2HB LEU 84 -5.712 10.787 1.980 658 HB3 LEU 84 1HB LEU 84 -6.072 9.758 0.593 659 HG LEU 84 HG LEU 84 -8.130 11.632 1.760 660 HD11 LEU 84 1HD1 LEU 84 -7.326 13.412 0.565 661 HD12 LEU 84 2HD1 LEU 84 -6.691 12.390 -0.724 662 HD13 LEU 84 3HD1 LEU 84 -5.789 12.575 0.780 663 HD21 LEU 84 3HD2 LEU 84 -9.319 11.214 -0.224 664 HD22 LEU 84 1HD2 LEU 84 -8.601 9.641 0.125 665 HD23 LEU 84 2HD2 LEU 84 -7.875 10.692 -1.091 666 H LEU 85 H LEU 85 -5.282 9.449 3.969 667 HA LEU 85 HA LEU 85 -3.926 6.990 3.296 668 HB2 LEU 85 2HB LEU 85 -2.334 8.055 4.512 669 HB3 LEU 85 1HB LEU 85 -3.495 9.359 4.742 670 HG LEU 85 HG LEU 85 -4.388 8.042 6.727 671 HD11 LEU 85 1HD1 LEU 85 -2.026 6.652 7.396 672 HD12 LEU 85 2HD1 LEU 85 -2.390 6.206 5.729 673 HD13 LEU 85 3HD1 LEU 85 -3.594 5.952 6.992 674 HD21 LEU 85 3HD2 LEU 85 -2.425 9.924 6.554 675 HD22 LEU 85 1HD2 LEU 85 -1.550 8.622 7.359 676 HD23 LEU 85 2HD2 LEU 85 -3.018 9.276 8.083 677 H ASP 86 H ASP 86 -6.382 7.926 5.647 678 HA ASP 86 HA ASP 86 -6.298 5.643 7.362 679 HB2 ASP 86 2HB ASP 86 -8.002 7.918 6.750 680 HB3 ASP 86 1HB ASP 86 -8.974 6.485 7.088 681 H LYS 87 H LYS 87 -8.004 6.234 4.287 682 HA LYS 87 HA LYS 87 -9.360 3.664 4.239 683 HB2 LYS 87 2HB LYS 87 -8.574 5.526 1.964 684 HB3 LYS 87 1HB LYS 87 -9.880 4.340 1.949 685 HG2 LYS 87 2HG LYS 87 -9.711 6.881 3.581 686 HG3 LYS 87 1HG LYS 87 -10.916 6.454 2.367 687 HD2 LYS 87 2HD LYS 87 -11.380 4.406 3.941 688 HD3 LYS 87 1HD LYS 87 -10.603 5.410 5.166 689 HE2 LYS 87 2HE LYS 87 -12.532 6.945 3.604 690 HE3 LYS 87 1HE LYS 87 -13.288 5.560 4.419 691 HZ1 LYS 87 3HZ LYS 87 -12.899 7.748 5.735 692 HZ2 LYS 87 1HZ LYS 87 -11.300 7.193 5.849 693 HZ3 LYS 87 2HZ LYS 87 -12.571 6.255 6.477 694 H ILE 88 H ILE 88 -6.416 5.020 2.792 695 HA ILE 88 HA ILE 88 -5.526 2.679 1.408 696 HB ILE 88 HB ILE 88 -4.454 5.233 2.482 697 HG12 ILE 88 2HG1 ILE 88 -3.600 4.245 -0.132 698 HG13 ILE 88 1HG1 ILE 88 -5.350 4.381 0.071 699 HG21 ILE 88 1HG2 ILE 88 -2.139 4.417 1.539 700 HG22 ILE 88 2HG2 ILE 88 -2.754 2.823 1.977 701 HG23 ILE 88 3HG2 ILE 88 -2.582 4.072 3.210 702 HD11 ILE 88 3HD1 ILE 88 -4.250 6.683 1.284 703 HD12 ILE 88 1HD1 ILE 88 -5.163 6.614 -0.222 704 HD13 ILE 88 2HD1 ILE 88 -3.403 6.496 -0.251 705 H PHE 89 H PHE 89 -5.068 3.885 4.699 706 HA PHE 89 HA PHE 89 -3.370 1.722 5.604 707 HB2 PHE 89 2HB PHE 89 -3.327 3.900 6.660 708 HB3 PHE 89 1HB PHE 89 -5.063 3.831 6.965 709 HD1 PHE 89 2HD PHE 89 -1.779 2.362 7.882 710 HD2 PHE 89 1HD PHE 89 -5.957 2.636 8.843 711 HE1 PHE 89 2HE PHE 89 -1.353 1.249 10.056 712 HE2 PHE 89 1HE PHE 89 -5.529 1.525 11.017 713 HZ PHE 89 HZ PHE 89 -3.227 0.830 11.623 714 H ALA 90 H ALA 90 -6.717 2.109 5.126 715 HA ALA 90 HA ALA 90 -7.611 0.049 7.002 716 HB1 ALA 90 1HB ALA 90 -9.037 1.200 4.582 717 HB2 ALA 90 2HB ALA 90 -8.911 2.083 6.104 718 HB3 ALA 90 3HB ALA 90 -9.768 0.543 6.047 719 H GLY 91 H GLY 91 -6.749 0.394 3.612 720 HA2 GLY 91 2HA GLY 91 -7.543 -2.263 2.796 721 HA3 GLY 91 1HA GLY 91 -6.425 -1.205 1.924 722 H VAL 92 H VAL 92 -4.556 -0.746 3.950 723 HA VAL 92 HA VAL 92 -2.873 -3.076 3.793 724 HB VAL 92 HB VAL 92 -2.933 -0.432 5.231 725 HG11 VAL 92 1HG1 VAL 92 -2.058 -2.080 6.883 726 HG12 VAL 92 2HG1 VAL 92 -0.817 -0.942 6.358 727 HG13 VAL 92 3HG1 VAL 92 -0.841 -2.581 5.709 728 HG21 VAL 92 3HG2 VAL 92 -1.780 -1.528 2.856 729 HG22 VAL 92 1HG2 VAL 92 -0.463 -1.068 3.934 730 HG23 VAL 92 2HG2 VAL 92 -1.669 0.126 3.455 731 H ASP 93 H ASP 93 -5.370 -1.990 5.935 732 HA ASP 93 HA ASP 93 -4.665 -3.721 8.192 733 HB2 ASP 93 2HB ASP 93 -6.057 -1.440 7.922 734 HB3 ASP 93 1HB ASP 93 -7.394 -2.574 7.724 735 H MET 94 H MET 94 -6.678 -3.891 5.313 736 HA MET 94 HA MET 94 -8.100 -6.297 6.161 737 HB2 MET 94 2HB MET 94 -7.929 -4.470 3.834 738 HB3 MET 94 1HB MET 94 -8.396 -6.129 3.457 739 HG2 MET 94 2HG MET 94 -10.419 -5.905 4.456 740 HG3 MET 94 1HG MET 94 -9.729 -5.065 5.843 741 HE1 MET 94 3HE MET 94 -10.479 -4.939 2.177 742 HE2 MET 94 1HE MET 94 -9.100 -3.833 2.102 743 HE3 MET 94 2HE MET 94 -10.724 -3.244 1.765 744 H ILE 95 H ILE 95 -5.348 -5.576 3.955 745 HA ILE 95 HA ILE 95 -4.884 -8.236 3.086 746 HB ILE 95 HB ILE 95 -2.667 -7.308 2.571 747 HG12 ILE 95 2HG1 ILE 95 -3.530 -4.880 4.151 748 HG13 ILE 95 1HG1 ILE 95 -2.416 -6.101 4.769 749 HG21 ILE 95 1HG2 ILE 95 -4.866 -6.626 1.379 750 HG22 ILE 95 2HG2 ILE 95 -3.404 -5.701 1.042 751 HG23 ILE 95 3HG2 ILE 95 -4.611 -5.068 2.161 752 HD11 ILE 95 3HD1 ILE 95 -1.009 -5.682 2.680 753 HD12 ILE 95 1HD1 ILE 95 -1.039 -4.374 3.862 754 HD13 ILE 95 2HD1 ILE 95 -2.019 -4.263 2.401 755 H THR 96 H THR 96 -3.918 -6.457 6.001 756 HA THR 96 HA THR 96 -2.093 -8.401 7.061 757 HB THR 96 HB THR 96 -3.961 -6.359 8.324 758 HG1 THR 96 1HG THR 96 -1.233 -6.386 7.586 759 HG21 THR 96 3HG2 THR 96 -1.860 -8.156 9.515 760 HG22 THR 96 1HG2 THR 96 -3.486 -7.816 10.106 761 HG23 THR 96 2HG2 THR 96 -2.225 -6.591 10.243 762 H ARG 97 H ARG 97 -5.590 -7.858 7.383 763 HA ARG 97 HA ARG 97 -6.066 -10.187 9.039 764 HB2 ARG 97 2HB ARG 97 -7.671 -8.238 7.396 765 HB3 ARG 97 1HB ARG 97 -8.464 -9.650 8.088 766 HG2 ARG 97 2HG ARG 97 -8.390 -7.414 9.454 767 HG3 ARG 97 1HG ARG 97 -8.109 -8.941 10.283 768 HD2 ARG 97 2HD ARG 97 -5.714 -8.598 10.254 769 HD3 ARG 97 1HD ARG 97 -5.884 -7.180 9.200 770 HE ARG 97 HE ARG 97 -7.334 -6.240 11.144 771 HH11 ARG 97 1HH1 ARG 97 -6.474 -8.901 12.618 772 HH12 ARG 97 2HH1 ARG 97 -5.343 -8.235 13.748 773 HH21 ARG 97 1HH2 ARG 97 -5.116 -5.178 12.125 774 HH22 ARG 97 2HH2 ARG 97 -4.573 -6.127 13.469 775 H MET 98 H MET 98 -6.159 -9.514 5.550 776 HA MET 98 HA MET 98 -7.264 -12.048 4.728 777 HB2 MET 98 2HB MET 98 -6.064 -9.623 3.605 778 HB3 MET 98 1HB MET 98 -5.583 -11.065 2.711 779 HG2 MET 98 2HG MET 98 -8.105 -11.682 2.777 780 HG3 MET 98 1HG MET 98 -8.352 -9.984 3.185 781 HE1 MET 98 3HE MET 98 -9.321 -8.931 0.080 782 HE2 MET 98 1HE MET 98 -9.778 -9.756 1.577 783 HE3 MET 98 2HE MET 98 -9.702 -10.649 0.061 784 H VAL 99 H VAL 99 -4.061 -10.796 5.415 785 HA VAL 99 HA VAL 99 -2.691 -13.238 4.565 786 HB VAL 99 HB VAL 99 -2.012 -10.556 5.743 787 HG11 VAL 99 1HG1 VAL 99 -0.283 -13.024 5.678 788 HG12 VAL 99 2HG1 VAL 99 -0.449 -11.823 6.959 789 HG13 VAL 99 3HG1 VAL 99 0.446 -11.430 5.492 790 HG21 VAL 99 3HG2 VAL 99 -2.097 -11.741 3.152 791 HG22 VAL 99 1HG2 VAL 99 -0.404 -11.410 3.521 792 HG23 VAL 99 2HG2 VAL 99 -1.590 -10.106 3.576 793 H ASP 100 H ASP 100 -3.489 -11.603 7.651 794 HA ASP 100 HA ASP 100 -2.168 -13.453 9.385 795 HB2 ASP 100 2HB ASP 100 -2.941 -11.403 10.303 796 HB3 ASP 100 1HB ASP 100 -4.542 -11.590 9.585 797 H LYS 101 H LYS 101 -5.184 -13.537 7.629 798 HA LYS 101 HA LYS 101 -6.038 -16.023 8.969 799 HB2 LYS 101 2HB LYS 101 -8.111 -15.411 8.202 800 HB3 LYS 101 1HB LYS 101 -7.349 -13.846 7.940 801 HG2 LYS 101 2HG LYS 101 -8.382 -14.367 5.868 802 HG3 LYS 101 1HG LYS 101 -6.675 -14.757 5.639 803 HD2 LYS 101 2HD LYS 101 -7.270 -16.807 5.071 804 HD3 LYS 101 1HD LYS 101 -7.812 -17.067 6.724 805 HE2 LYS 101 2HE LYS 101 -9.560 -15.817 4.574 806 HE3 LYS 101 1HE LYS 101 -9.605 -17.539 5.004 807 HZ1 LYS 101 3HZ LYS 101 -11.055 -16.843 6.562 808 HZ2 LYS 101 1HZ LYS 101 -10.515 -15.237 6.520 809 HZ3 LYS 101 2HZ LYS 101 -9.657 -16.397 7.417 810 H ILE 102 H ILE 102 -4.396 -14.944 6.084 811 HA ILE 102 HA ILE 102 -4.809 -17.371 4.527 812 HB ILE 102 HB ILE 102 -3.365 -14.819 4.408 813 HG12 ILE 102 2HG1 ILE 102 -4.168 -16.498 2.058 814 HG13 ILE 102 1HG1 ILE 102 -5.404 -15.769 3.079 815 HG21 ILE 102 1HG2 ILE 102 -1.824 -15.765 2.549 816 HG22 ILE 102 2HG2 ILE 102 -2.072 -17.319 3.348 817 HG23 ILE 102 3HG2 ILE 102 -1.328 -15.983 4.227 818 HD11 ILE 102 3HD1 ILE 102 -5.096 -13.770 2.096 819 HD12 ILE 102 1HD1 ILE 102 -3.935 -14.518 0.998 820 HD13 ILE 102 2HD1 ILE 102 -3.383 -13.804 2.514 821 H VAL 103 H VAL 103 -2.139 -16.046 6.487 822 HA VAL 103 HA VAL 103 -0.435 -18.340 6.389 823 HB VAL 103 HB VAL 103 -0.901 -15.986 8.220 824 HG11 VAL 103 1HG1 VAL 103 1.180 -18.152 8.653 825 HG12 VAL 103 2HG1 VAL 103 -0.243 -17.899 9.663 826 HG13 VAL 103 3HG1 VAL 103 1.016 -16.666 9.588 827 HG21 VAL 103 3HG2 VAL 103 1.722 -16.673 6.975 828 HG22 VAL 103 1HG2 VAL 103 0.956 -15.099 7.186 829 HG23 VAL 103 2HG2 VAL 103 0.425 -16.171 5.892 830 H SER 104 H SER 104 -3.255 -17.440 8.254 831 HA SER 104 HA SER 104 -3.065 -19.641 10.161 832 HB2 SER 104 2HB SER 104 -4.083 -17.318 10.476 833 HB3 SER 104 1HB SER 104 -5.425 -17.891 9.487 834 HG SER 104 HG SER 104 -4.477 -19.035 11.912 835 H GLU 105 H GLU 105 -5.414 -18.771 7.680 836 HA GLU 105 HA GLU 105 -6.231 -21.647 7.482 837 HB2 GLU 105 2HB GLU 105 -7.603 -19.252 6.256 838 HB3 GLU 105 1HB GLU 105 -8.316 -20.789 6.741 839 HG2 GLU 105 2HG GLU 105 -7.396 -20.029 9.134 840 HG3 GLU 105 1HG GLU 105 -7.576 -18.429 8.411 841 H GLY 106 H GLY 106 -5.182 -18.869 5.532 842 HA2 GLY 106 2HA GLY 106 -3.714 -19.184 3.597 843 HA3 GLY 106 1HA GLY 106 -4.444 -20.771 3.356 844 H SER 107 H SER 107 -6.499 -18.092 4.145 845 HA SER 107 HA SER 107 -7.393 -17.947 1.273 846 HB2 SER 107 2HB SER 107 -9.517 -17.446 3.124 847 HB3 SER 107 1HB SER 107 -9.380 -18.732 1.932 848 HG SER 107 HG SER 107 -9.530 -19.531 4.082 849 H ASP 108 H ASP 108 -7.307 -15.932 0.493 850 HA ASP 108 HA ASP 108 -6.995 -13.616 2.311 851 HB2 ASP 108 2HB ASP 108 -6.552 -12.443 0.220 852 HB3 ASP 108 1HB ASP 108 -5.722 -13.998 0.146 853 H ASP 109 H ASP 109 -9.570 -15.404 1.601 854 HA ASP 109 HA ASP 109 -11.422 -13.275 0.700 855 HB2 ASP 109 2HB ASP 109 -11.230 -15.981 0.336 856 HB3 ASP 109 1HB ASP 109 -12.436 -15.896 1.621 857 H ILE 110 H ILE 110 -10.968 -11.977 2.765 858 HA ILE 110 HA ILE 110 -12.313 -13.084 5.183 859 HB ILE 110 HB ILE 110 -11.244 -11.164 6.284 860 HG12 ILE 110 2HG1 ILE 110 -10.099 -10.424 3.591 861 HG13 ILE 110 1HG1 ILE 110 -11.580 -9.694 4.208 862 HG21 ILE 110 1HG2 ILE 110 -9.315 -12.487 4.350 863 HG22 ILE 110 2HG2 ILE 110 -9.906 -13.234 5.835 864 HG23 ILE 110 3HG2 ILE 110 -8.913 -11.778 5.916 865 HD11 ILE 110 3HD1 ILE 110 -10.209 -9.191 6.344 866 HD12 ILE 110 1HD1 ILE 110 -9.886 -8.208 4.916 867 HD13 ILE 110 2HD1 ILE 110 -8.793 -9.522 5.346 868 H GLY 111 H GLY 111 -13.880 -12.304 2.811 869 HA2 GLY 111 2HA GLY 111 -15.948 -11.208 2.497 870 HA3 GLY 111 1HA GLY 111 -15.798 -10.559 4.132 871 H GLU 112 H GLU 112 -12.936 -9.922 2.588 872 HA GLU 112 HA GLU 112 -13.001 -7.168 2.624 873 HB2 GLU 112 2HB GLU 112 -11.562 -9.302 1.217 874 HB3 GLU 112 1HB GLU 112 -11.532 -7.765 0.353 875 HG2 GLU 112 2HG GLU 112 -11.068 -6.946 2.923 876 HG3 GLU 112 1HG GLU 112 -10.259 -8.512 2.906 877 H ASN 113 H ASN 113 -13.002 -5.681 0.651 878 HA ASN 113 HA ASN 113 -14.969 -6.411 -1.456 879 HB2 ASN 113 2HB ASN 113 -15.227 -3.930 0.253 880 HB3 ASN 113 1HB ASN 113 -16.414 -4.593 -0.870 881 HD21 ASN 113 1HD2 ASN 113 -17.812 -6.254 -0.106 882 HD22 ASN 113 2HD2 ASN 113 -17.761 -6.858 1.480 883 H ILE 114 H ILE 114 -12.780 -6.271 -2.580 884 HA ILE 114 HA ILE 114 -11.247 -3.898 -2.750 885 HB ILE 114 HB ILE 114 -11.784 -5.813 -5.029 886 HG12 ILE 114 2HG1 ILE 114 -11.435 -7.353 -3.294 887 HG13 ILE 114 1HG1 ILE 114 -9.794 -7.080 -3.872 888 HG21 ILE 114 1HG2 ILE 114 -9.785 -5.095 -5.866 889 HG22 ILE 114 2HG2 ILE 114 -9.063 -4.912 -4.267 890 HG23 ILE 114 3HG2 ILE 114 -10.141 -3.664 -4.898 891 HD11 ILE 114 3HD1 ILE 114 -9.765 -5.164 -2.080 892 HD12 ILE 114 1HD1 ILE 114 -9.538 -6.833 -1.558 893 HD13 ILE 114 2HD1 ILE 114 -11.111 -6.056 -1.369 894 H ASP 115 H ASP 115 -13.519 -4.978 -5.321 895 HA ASP 115 HA ASP 115 -13.651 -2.643 -6.797 896 HB2 ASP 115 2HB ASP 115 -14.883 -4.958 -6.954 897 HB3 ASP 115 1HB ASP 115 -16.168 -4.118 -6.084 898 H VAL 116 H VAL 116 -14.925 -3.232 -3.659 899 HA VAL 116 HA VAL 116 -16.512 -0.758 -3.586 900 HB VAL 116 HB VAL 116 -15.888 -2.910 -1.555 901 HG11 VAL 116 1HG1 VAL 116 -16.758 -1.432 -0.078 902 HG12 VAL 116 2HG1 VAL 116 -18.303 -1.702 -0.884 903 HG13 VAL 116 3HG1 VAL 116 -17.285 -0.344 -1.362 904 HG21 VAL 116 3HG2 VAL 116 -18.377 -2.439 -3.229 905 HG22 VAL 116 1HG2 VAL 116 -18.111 -3.769 -2.102 906 HG23 VAL 116 2HG2 VAL 116 -17.151 -3.658 -3.577 907 H PHE 117 H PHE 117 -13.853 -2.163 -1.748 908 HA PHE 117 HA PHE 117 -13.223 0.206 -0.248 909 HB2 PHE 117 2HB PHE 117 -12.191 -2.463 -0.711 910 HB3 PHE 117 1HB PHE 117 -10.867 -1.303 -0.639 911 HD1 PHE 117 1HD PHE 117 -10.634 0.204 1.355 912 HD2 PHE 117 2HD PHE 117 -13.468 -3.021 1.235 913 HE1 PHE 117 1HE PHE 117 -10.865 0.316 3.822 914 HE2 PHE 117 2HE PHE 117 -13.702 -2.908 3.701 915 HZ PHE 117 HZ PHE 117 -12.399 -1.242 4.996 916 H SER 118 H SER 118 -12.571 -0.717 -3.529 917 HA SER 118 HA SER 118 -10.444 1.275 -3.867 918 HB2 SER 118 2HB SER 118 -10.010 -0.636 -5.137 919 HB3 SER 118 1HB SER 118 -11.722 -0.936 -5.426 920 HG SER 118 HG SER 118 -9.961 0.859 -6.686 921 H ASP 119 H ASP 119 -13.741 0.593 -4.777 922 HA ASP 119 HA ASP 119 -14.157 2.970 -6.359 923 HB2 ASP 119 2HB ASP 119 -15.566 1.004 -6.605 924 HB3 ASP 119 1HB ASP 119 -15.999 1.060 -4.897 925 H THR 120 H THR 120 -14.412 2.121 -3.026 926 HA THR 120 HA THR 120 -15.787 4.448 -2.065 927 HB THR 120 HB THR 120 -14.164 2.176 -1.047 928 HG1 THR 120 1HG THR 120 -16.110 1.699 -0.495 929 HG21 THR 120 3HG2 THR 120 -12.996 3.709 0.259 930 HG22 THR 120 1HG2 THR 120 -14.358 3.309 1.303 931 HG23 THR 120 2HG2 THR 120 -14.368 4.810 0.378 932 H ILE 121 H ILE 121 -12.453 3.551 -2.451 933 HA ILE 121 HA ILE 121 -11.350 6.095 -1.570 934 HB ILE 121 HB ILE 121 -10.575 3.399 -2.225 935 HG12 ILE 121 2HG1 ILE 121 -10.186 4.521 -0.089 936 HG13 ILE 121 1HG1 ILE 121 -8.655 3.978 -0.780 937 HG21 ILE 121 1HG2 ILE 121 -8.997 5.583 -3.577 938 HG22 ILE 121 2HG2 ILE 121 -9.580 4.065 -4.259 939 HG23 ILE 121 3HG2 ILE 121 -8.251 4.057 -3.102 940 HD11 ILE 121 3HD1 ILE 121 -8.817 6.456 -1.876 941 HD12 ILE 121 1HD1 ILE 121 -8.010 6.128 -0.343 942 HD13 ILE 121 2HD1 ILE 121 -9.667 6.734 -0.357 943 H LYS 122 H LYS 122 -11.842 4.464 -4.710 944 HA LYS 122 HA LYS 122 -10.700 6.538 -6.333 945 HB2 LYS 122 2HB LYS 122 -12.283 4.051 -6.587 946 HB3 LYS 122 1HB LYS 122 -12.549 5.218 -7.884 947 HG2 LYS 122 2HG LYS 122 -10.585 4.633 -8.809 948 HG3 LYS 122 1HG LYS 122 -9.760 5.179 -7.351 949 HD2 LYS 122 2HD LYS 122 -10.981 2.632 -6.831 950 HD3 LYS 122 1HD LYS 122 -10.010 2.517 -8.297 951 HE2 LYS 122 2HE LYS 122 -8.453 4.044 -6.502 952 HE3 LYS 122 1HE LYS 122 -9.100 2.691 -5.553 953 HZ1 LYS 122 3HZ LYS 122 -7.416 1.586 -6.557 954 HZ2 LYS 122 1HZ LYS 122 -7.340 2.650 -7.876 955 HZ3 LYS 122 2HZ LYS 122 -8.540 1.448 -7.824 956 H SER 123 H SER 123 -13.882 5.938 -4.965 957 HA SER 123 HA SER 123 -15.120 8.176 -6.420 958 HB2 SER 123 2HB SER 123 -16.184 5.949 -5.716 959 HB3 SER 123 1HB SER 123 -16.185 6.606 -4.083 960 HG SER 123 HG SER 123 -17.191 8.209 -6.128 961 H PHE 124 H PHE 124 -13.276 7.670 -3.645 962 HA PHE 124 HA PHE 124 -14.372 9.744 -1.931 963 HB2 PHE 124 2HB PHE 124 -12.254 7.772 -1.991 964 HB3 PHE 124 1HB PHE 124 -11.631 9.311 -1.397 965 HD1 PHE 124 2HD PHE 124 -13.867 10.502 0.012 966 HD2 PHE 124 1HD PHE 124 -12.638 6.388 -0.140 967 HE1 PHE 124 2HE PHE 124 -14.951 10.096 2.206 968 HE2 PHE 124 1HE PHE 124 -13.722 5.984 2.054 969 HZ PHE 124 HZ PHE 124 -14.879 7.837 3.225 970 H ALA 125 H ALA 125 -12.825 9.860 -4.865 971 HA ALA 125 HA ALA 125 -11.612 12.547 -4.296 972 HB1 ALA 125 1HB ALA 125 -9.780 11.701 -5.308 973 HB2 ALA 125 2HB ALA 125 -10.725 11.360 -6.758 974 HB3 ALA 125 3HB ALA 125 -10.610 10.153 -5.476 975 H SER 126 H SER 126 -11.328 13.242 -7.049 976 HA SER 126 HA SER 126 -14.080 14.097 -7.635 977 HB2 SER 126 2HB SER 126 -12.298 15.686 -7.885 978 HB3 SER 126 1HB SER 126 -11.344 14.561 -8.847 979 HG SER 126 HG SER 126 -13.511 16.152 -9.551 980 H SER 127 H SER 127 -11.838 13.231 -10.197 981 HA SER 127 HA SER 127 -13.403 10.814 -10.910 982 HB2 SER 127 2HB SER 127 -14.744 12.469 -11.941 983 HB3 SER 127 1HB SER 127 -13.345 13.439 -12.396 984 HG SER 127 HG SER 127 -14.579 11.517 -13.777 985 H GLY 128 H GLY 128 -12.472 10.327 -13.405 986 HA2 GLY 128 2HA GLY 128 -9.839 10.957 -14.110 987 HA3 GLY 128 1HA GLY 128 -9.707 9.617 -12.968 988 H LYS 129 H LYS 129 -10.086 10.364 -16.217 989 HA LYS 129 HA LYS 129 -10.728 9.072 -18.100 990 HB2 LYS 129 2HB LYS 129 -9.908 6.851 -16.201 991 HB3 LYS 129 1HB LYS 129 -9.801 6.834 -17.961 992 HG2 LYS 129 2HG LYS 129 -8.331 8.830 -16.220 993 HG3 LYS 129 1HG LYS 129 -7.614 7.323 -16.793 994 HD2 LYS 129 2HD LYS 129 -8.170 8.044 -19.144 995 HD3 LYS 129 1HD LYS 129 -8.655 9.609 -18.488 996 HE2 LYS 129 2HE LYS 129 -6.455 10.145 -17.814 997 HE3 LYS 129 1HE LYS 129 -5.925 8.453 -17.889 998 HZ1 LYS 129 3HZ LYS 129 -5.375 10.001 -19.860 999 HZ2 LYS 129 1HZ LYS 129 -7.004 9.791 -20.285 1000 HZ3 LYS 129 2HZ LYS 129 -5.971 8.444 -20.187 1001 H GLU 130 H GLU 130 -11.631 6.173 -17.571 1002 HA GLU 130 HA GLU 130 -14.417 6.483 -17.795 1003 HB2 GLU 130 2HB GLU 130 -12.456 4.368 -17.171 1004 HB3 GLU 130 1HB GLU 130 -14.081 4.040 -16.568 1005 HG2 GLU 130 2HG GLU 130 -14.896 4.707 -18.921 1006 HG3 GLU 130 1HG GLU 130 -13.211 4.538 -19.415 1007 H LYS 131 H LYS 131 -16.129 6.098 -16.195 1008 HA LYS 131 HA LYS 131 -15.335 6.355 -13.335 1009 HB2 LYS 131 2HB LYS 131 -16.708 8.328 -13.065 1010 HB3 LYS 131 1HB LYS 131 -15.637 8.617 -14.436 1011 HG2 LYS 131 2HG LYS 131 -17.765 7.427 -15.674 1012 HG3 LYS 131 1HG LYS 131 -18.572 8.306 -14.376 1013 HD2 LYS 131 2HD LYS 131 -18.330 10.219 -15.529 1014 HD3 LYS 131 1HD LYS 131 -16.578 10.027 -15.467 1015 HE2 LYS 131 2HE LYS 131 -17.518 8.195 -17.428 1016 HE3 LYS 131 1HE LYS 131 -18.306 9.753 -17.749 1017 HZ1 LYS 131 3HZ LYS 131 -15.418 9.168 -17.512 1018 HZ2 LYS 131 1HZ LYS 131 -16.014 10.738 -17.272 1019 HZ3 LYS 131 2HZ LYS 131 -16.238 9.965 -18.768 1020 H LEU 132 H LEU 132 -18.166 7.047 -12.696 1021 HA LEU 132 HA LEU 132 -19.229 4.390 -12.403 1022 HB2 LEU 132 2HB LEU 132 -19.638 6.915 -11.354 1023 HB3 LEU 132 1HB LEU 132 -21.117 6.643 -12.277 1024 HG LEU 132 HG LEU 132 -20.440 4.232 -10.869 1025 HD11 LEU 132 1HD1 LEU 132 -19.281 5.415 -9.188 1026 HD12 LEU 132 2HD1 LEU 132 -20.922 5.299 -8.550 1027 HD13 LEU 132 3HD1 LEU 132 -20.367 6.801 -9.291 1028 HD21 LEU 132 3HD2 LEU 132 -22.693 6.107 -10.178 1029 HD22 LEU 132 1HD2 LEU 132 -22.698 4.344 -10.225 1030 HD23 LEU 132 2HD2 LEU 132 -22.680 5.267 -11.729 1031 H GLU 133 H GLU 133 -19.707 3.294 -14.319 1032 HA GLU 133 HA GLU 133 -20.714 4.479 -16.720 1033 HB2 GLU 133 2HB GLU 133 -21.311 2.063 -17.202 1034 HB3 GLU 133 1HB GLU 133 -19.644 2.310 -16.679 1035 HG2 GLU 133 2HG GLU 133 -20.058 1.456 -14.528 1036 HG3 GLU 133 1HG GLU 133 -21.799 1.699 -14.666 Start of MODEL 9 1 H1 MET 1 1HT MET 1 11.456 -26.032 -3.058 2 H2 MET 1 2HT MET 1 13.094 -26.124 -3.496 3 H3 MET 1 3HT MET 1 12.660 -25.822 -1.881 4 HA MET 1 HA MET 1 12.504 -28.355 -3.395 5 HB2 MET 1 2HB MET 1 13.589 -27.329 -0.758 6 HB3 MET 1 1HB MET 1 13.557 -29.044 -1.172 7 HG2 MET 1 2HG MET 1 14.808 -28.421 -3.305 8 HG3 MET 1 1HG MET 1 15.051 -26.828 -2.588 9 HE1 MET 1 2HE MET 1 15.591 -26.457 -0.410 10 HE2 MET 1 3HE MET 1 17.332 -26.693 -0.269 11 HE3 MET 1 1HE MET 1 16.226 -27.583 0.786 12 H MET 2 H MET 2 10.726 -26.322 -1.226 13 HA MET 2 HA MET 2 8.643 -28.400 -0.954 14 HB2 MET 2 2HB MET 2 8.720 -28.225 1.532 15 HB3 MET 2 1HB MET 2 10.225 -28.863 0.868 16 HG2 MET 2 2HG MET 2 10.598 -26.112 0.812 17 HG3 MET 2 1HG MET 2 9.758 -26.386 2.337 18 HE1 MET 2 3HE MET 2 10.892 -26.151 4.030 19 HE2 MET 2 1HE MET 2 12.450 -26.818 4.538 20 HE3 MET 2 2HE MET 2 11.018 -27.844 4.499 21 H GLU 3 H GLU 3 7.349 -26.994 1.249 22 HA GLU 3 HA GLU 3 6.031 -24.866 -0.255 23 HB2 GLU 3 2HB GLU 3 4.746 -24.682 1.886 24 HB3 GLU 3 1HB GLU 3 4.797 -26.333 1.257 25 HG2 GLU 3 2HG GLU 3 6.427 -26.994 2.853 26 HG3 GLU 3 1HG GLU 3 6.836 -25.321 3.243 27 H GLU 4 H GLU 4 8.898 -24.901 1.377 28 HA GLU 4 HA GLU 4 8.669 -22.579 3.016 29 HB2 GLU 4 2HB GLU 4 10.441 -24.345 3.118 30 HB3 GLU 4 1HB GLU 4 11.096 -23.725 1.602 31 HG2 GLU 4 2HG GLU 4 11.175 -21.436 2.835 32 HG3 GLU 4 1HG GLU 4 11.035 -22.401 4.305 33 H TYR 5 H TYR 5 8.527 -22.878 -0.312 34 HA TYR 5 HA TYR 5 9.953 -20.548 -1.188 35 HB2 TYR 5 2HB TYR 5 8.232 -22.619 -2.224 36 HB3 TYR 5 1HB TYR 5 7.768 -21.057 -2.899 37 HD1 TYR 5 2HD TYR 5 11.027 -22.651 -1.924 38 HD2 TYR 5 1HD TYR 5 8.744 -20.667 -4.974 39 HE1 TYR 5 2HE TYR 5 12.990 -22.719 -3.437 40 HE2 TYR 5 1HE TYR 5 10.707 -20.733 -6.486 41 HH TYR 5 HH TYR 5 13.453 -20.887 -5.923 42 H LEU 6 H LEU 6 6.620 -21.125 -0.293 43 HA LEU 6 HA LEU 6 5.811 -18.338 -0.683 44 HB2 LEU 6 2HB LEU 6 3.669 -19.154 0.124 45 HB3 LEU 6 1HB LEU 6 4.345 -20.383 -0.946 46 HG LEU 6 HG LEU 6 5.413 -21.159 1.430 47 HD11 LEU 6 1HD1 LEU 6 4.301 -19.566 2.816 48 HD12 LEU 6 2HD1 LEU 6 3.420 -21.079 3.031 49 HD13 LEU 6 3HD1 LEU 6 2.763 -19.817 1.990 50 HD21 LEU 6 3HD2 LEU 6 2.655 -21.890 0.398 51 HD22 LEU 6 1HD2 LEU 6 3.667 -22.887 1.442 52 HD23 LEU 6 2HD2 LEU 6 4.171 -22.550 -0.213 53 H GLY 7 H GLY 7 7.017 -20.357 1.919 54 HA2 GLY 7 2HA GLY 7 6.211 -18.843 4.172 55 HA3 GLY 7 1HA GLY 7 7.703 -19.783 4.091 56 H VAL 8 H VAL 8 8.910 -18.370 1.915 57 HA VAL 8 HA VAL 8 9.942 -16.054 3.368 58 HB VAL 8 HB VAL 8 10.484 -17.325 0.679 59 HG11 VAL 8 1HG1 VAL 8 11.037 -14.678 1.395 60 HG12 VAL 8 2HG1 VAL 8 11.800 -15.588 0.091 61 HG13 VAL 8 3HG1 VAL 8 12.550 -15.535 1.687 62 HG21 VAL 8 3HG2 VAL 8 12.656 -17.225 2.604 63 HG22 VAL 8 1HG2 VAL 8 11.935 -18.628 1.816 64 HG23 VAL 8 2HG2 VAL 8 11.232 -17.995 3.305 65 H PHE 9 H PHE 9 7.845 -16.675 0.675 66 HA PHE 9 HA PHE 9 7.697 -13.992 -0.371 67 HB2 PHE 9 2HB PHE 9 6.480 -16.596 -0.742 68 HB3 PHE 9 1HB PHE 9 5.246 -15.337 -0.791 69 HD1 PHE 9 1HD PHE 9 5.855 -13.199 -2.211 70 HD2 PHE 9 2HD PHE 9 7.721 -17.042 -2.673 71 HE1 PHE 9 1HE PHE 9 6.580 -12.573 -4.498 72 HE2 PHE 9 2HE PHE 9 8.445 -16.415 -4.960 73 HZ PHE 9 HZ PHE 9 7.873 -14.182 -5.873 74 H VAL 10 H VAL 10 5.992 -15.727 2.197 75 HA VAL 10 HA VAL 10 4.081 -13.539 2.655 76 HB VAL 10 HB VAL 10 4.759 -16.076 4.183 77 HG11 VAL 10 1HG1 VAL 10 2.667 -13.947 4.513 78 HG12 VAL 10 2HG1 VAL 10 3.596 -14.797 5.747 79 HG13 VAL 10 3HG1 VAL 10 2.268 -15.614 4.923 80 HG21 VAL 10 3HG2 VAL 10 3.951 -16.505 1.898 81 HG22 VAL 10 1HG2 VAL 10 2.571 -15.443 2.175 82 HG23 VAL 10 2HG2 VAL 10 2.716 -16.953 3.076 83 H ASP 11 H ASP 11 7.097 -14.761 4.069 84 HA ASP 11 HA ASP 11 7.038 -13.146 6.445 85 HB2 ASP 11 2HB ASP 11 9.212 -14.459 4.802 86 HB3 ASP 11 1HB ASP 11 9.553 -13.630 6.321 87 H GLU 12 H GLU 12 7.686 -12.505 3.158 88 HA GLU 12 HA GLU 12 9.118 -9.968 3.670 89 HB2 GLU 12 2HB GLU 12 8.404 -11.712 1.342 90 HB3 GLU 12 1HB GLU 12 8.759 -10.013 1.026 91 HG2 GLU 12 2HG GLU 12 10.738 -10.932 2.837 92 HG3 GLU 12 1HG GLU 12 10.599 -12.155 1.574 93 H THR 13 H THR 13 6.044 -11.054 2.183 94 HA THR 13 HA THR 13 4.968 -8.520 1.554 95 HB THR 13 HB THR 13 4.160 -10.952 1.094 96 HG1 THR 13 1HG THR 13 2.076 -9.237 1.854 97 HG21 THR 13 3HG2 THR 13 3.885 -11.100 3.773 98 HG22 THR 13 1HG2 THR 13 2.901 -12.048 2.662 99 HG23 THR 13 2HG2 THR 13 2.265 -10.553 3.348 100 H LYS 14 H LYS 14 5.230 -10.165 4.653 101 HA LYS 14 HA LYS 14 3.443 -8.284 6.037 102 HB2 LYS 14 2HB LYS 14 5.207 -10.626 6.729 103 HB3 LYS 14 1HB LYS 14 4.561 -9.607 8.017 104 HG2 LYS 14 2HG LYS 14 2.424 -10.344 7.709 105 HG3 LYS 14 1HG LYS 14 2.604 -10.436 5.956 106 HD2 LYS 14 2HD LYS 14 2.700 -12.679 6.248 107 HD3 LYS 14 1HD LYS 14 4.336 -12.397 6.848 108 HE2 LYS 14 2HE LYS 14 1.938 -12.196 8.684 109 HE3 LYS 14 1HE LYS 14 2.771 -13.738 8.399 110 HZ1 LYS 14 3HZ LYS 14 4.690 -12.995 9.342 111 HZ2 LYS 14 1HZ LYS 14 3.596 -12.065 10.246 112 HZ3 LYS 14 2HZ LYS 14 4.409 -11.372 8.924 113 H GLU 15 H GLU 15 6.957 -9.000 6.052 114 HA GLU 15 HA GLU 15 7.685 -6.820 7.758 115 HB2 GLU 15 2HB GLU 15 9.116 -8.427 5.629 116 HB3 GLU 15 1HB GLU 15 9.948 -7.250 6.646 117 HG2 GLU 15 2HG GLU 15 8.858 -8.540 8.628 118 HG3 GLU 15 1HG GLU 15 8.624 -9.832 7.451 119 H TYR 16 H TYR 16 6.584 -6.931 4.563 120 HA TYR 16 HA TYR 16 7.849 -4.398 3.734 121 HB2 TYR 16 2HB TYR 16 6.298 -6.635 2.521 122 HB3 TYR 16 1HB TYR 16 6.151 -5.060 1.740 123 HD1 TYR 16 1HD TYR 16 9.106 -6.428 3.564 124 HD2 TYR 16 2HD TYR 16 7.427 -5.347 -0.240 125 HE1 TYR 16 1HE TYR 16 11.324 -6.739 2.496 126 HE2 TYR 16 2HE TYR 16 9.644 -5.658 -1.307 127 HH TYR 16 HH TYR 16 12.224 -7.227 0.235 128 H LEU 17 H LEU 17 4.558 -5.669 4.427 129 HA LEU 17 HA LEU 17 3.151 -3.245 3.880 130 HB2 LEU 17 2HB LEU 17 1.339 -4.356 4.919 131 HB3 LEU 17 1HB LEU 17 2.353 -5.687 4.366 132 HG LEU 17 HG LEU 17 3.455 -5.498 6.727 133 HD11 LEU 17 1HD1 LEU 17 2.574 -3.948 8.097 134 HD12 LEU 17 2HD1 LEU 17 1.031 -4.800 8.026 135 HD13 LEU 17 3HD1 LEU 17 1.382 -3.514 6.871 136 HD21 LEU 17 3HD2 LEU 17 2.153 -7.293 7.367 137 HD22 LEU 17 1HD2 LEU 17 1.677 -7.199 5.672 138 HD23 LEU 17 2HD2 LEU 17 0.647 -6.493 6.917 139 H GLN 18 H GLN 18 4.908 -4.372 6.720 140 HA GLN 18 HA GLN 18 4.106 -2.169 8.425 141 HB2 GLN 18 2HB GLN 18 4.966 -3.648 9.882 142 HB3 GLN 18 1HB GLN 18 5.499 -4.638 8.533 143 HG2 GLN 18 2HG GLN 18 7.592 -3.319 8.405 144 HG3 GLN 18 1HG GLN 18 7.063 -2.364 9.791 145 HE21 GLN 18 1HE2 GLN 18 9.359 -4.417 9.405 146 HE22 GLN 18 2HE2 GLN 18 9.169 -5.478 10.717 147 H ASN 19 H ASN 19 6.898 -3.030 6.508 148 HA ASN 19 HA ASN 19 8.396 -0.617 6.932 149 HB2 ASN 19 2HB ASN 19 8.334 -2.950 5.084 150 HB3 ASN 19 1HB ASN 19 9.120 -1.501 4.449 151 HD21 ASN 19 1HD2 ASN 19 11.342 -1.805 4.747 152 HD22 ASN 19 2HD2 ASN 19 12.061 -2.337 6.189 153 H LEU 20 H LEU 20 5.656 -1.530 5.110 154 HA LEU 20 HA LEU 20 5.675 0.892 3.416 155 HB2 LEU 20 2HB LEU 20 4.961 -1.076 2.294 156 HB3 LEU 20 1HB LEU 20 4.012 -1.611 3.678 157 HG LEU 20 HG LEU 20 2.533 0.420 3.321 158 HD11 LEU 20 1HD1 LEU 20 3.637 0.513 0.532 159 HD12 LEU 20 2HD1 LEU 20 4.447 1.428 1.804 160 HD13 LEU 20 3HD1 LEU 20 2.755 1.752 1.425 161 HD21 LEU 20 3HD2 LEU 20 1.616 -1.631 2.599 162 HD22 LEU 20 1HD2 LEU 20 2.802 -1.811 1.307 163 HD23 LEU 20 2HD2 LEU 20 1.514 -0.615 1.163 164 H ASN 21 H ASN 21 4.682 -0.049 6.501 165 HA ASN 21 HA ASN 21 2.401 1.823 6.601 166 HB2 ASN 21 2HB ASN 21 3.453 -0.476 8.108 167 HB3 ASN 21 1HB ASN 21 2.916 0.857 9.136 168 HD21 ASN 21 1HD2 ASN 21 1.369 -1.382 9.367 169 HD22 ASN 21 2HD2 ASN 21 -0.099 -1.213 8.532 170 H ASP 22 H ASP 22 5.660 1.261 7.556 171 HA ASP 22 HA ASP 22 5.910 3.516 9.270 172 HB2 ASP 22 2HB ASP 22 7.949 1.951 7.673 173 HB3 ASP 22 1HB ASP 22 8.355 3.069 8.977 174 H THR 23 H THR 23 6.166 2.869 5.938 175 HA THR 23 HA THR 23 7.279 5.411 5.053 176 HB THR 23 HB THR 23 5.659 3.200 3.785 177 HG1 THR 23 1HG THR 23 7.481 2.198 4.016 178 HG21 THR 23 3HG2 THR 23 5.851 4.214 1.759 179 HG22 THR 23 1HG2 THR 23 7.484 4.788 2.095 180 HG23 THR 23 2HG2 THR 23 6.091 5.681 2.707 181 H LEU 24 H LEU 24 4.054 3.931 5.283 182 HA LEU 24 HA LEU 24 2.662 6.279 4.249 183 HB2 LEU 24 2HB LEU 24 1.878 3.689 5.618 184 HB3 LEU 24 1HB LEU 24 0.686 4.885 5.106 185 HG LEU 24 HG LEU 24 2.753 3.743 3.216 186 HD11 LEU 24 1HD1 LEU 24 1.129 2.034 4.298 187 HD12 LEU 24 2HD1 LEU 24 1.229 2.072 2.537 188 HD13 LEU 24 3HD1 LEU 24 -0.123 2.848 3.361 189 HD21 LEU 24 3HD2 LEU 24 0.836 5.841 3.071 190 HD22 LEU 24 1HD2 LEU 24 0.242 4.526 2.056 191 HD23 LEU 24 2HD2 LEU 24 1.843 5.207 1.767 192 H LEU 25 H LEU 25 3.689 4.995 7.348 193 HA LEU 25 HA LEU 25 1.986 6.786 8.924 194 HB2 LEU 25 2HB LEU 25 4.317 4.953 9.463 195 HB3 LEU 25 1HB LEU 25 3.576 5.918 10.747 196 HG LEU 25 HG LEU 25 1.938 4.210 8.903 197 HD11 LEU 25 1HD1 LEU 25 3.305 2.565 9.870 198 HD12 LEU 25 2HD1 LEU 25 1.938 2.630 10.984 199 HD13 LEU 25 3HD1 LEU 25 3.448 3.444 11.393 200 HD21 LEU 25 3HD2 LEU 25 1.265 4.844 11.746 201 HD22 LEU 25 1HD2 LEU 25 0.198 4.682 10.350 202 HD23 LEU 25 2HD2 LEU 25 1.158 6.149 10.562 203 H GLU 26 H GLU 26 4.948 7.004 7.314 204 HA GLU 26 HA GLU 26 5.785 9.411 8.824 205 HB2 GLU 26 2HB GLU 26 6.999 7.641 6.687 206 HB3 GLU 26 1HB GLU 26 7.721 9.195 7.106 207 HG2 GLU 26 2HG GLU 26 7.817 8.445 9.494 208 HG3 GLU 26 1HG GLU 26 7.252 6.858 8.974 209 H LEU 27 H LEU 27 4.266 8.219 6.026 210 HA LEU 27 HA LEU 27 4.412 10.556 4.425 211 HB2 LEU 27 2HB LEU 27 3.990 8.379 3.458 212 HB3 LEU 27 1HB LEU 27 2.585 8.149 4.501 213 HG LEU 27 HG LEU 27 1.514 10.124 3.408 214 HD11 LEU 27 1HD1 LEU 27 3.434 9.944 1.145 215 HD12 LEU 27 2HD1 LEU 27 3.998 10.787 2.589 216 HD13 LEU 27 3HD1 LEU 27 2.543 11.337 1.757 217 HD21 LEU 27 3HD2 LEU 27 0.797 8.030 2.565 218 HD22 LEU 27 1HD2 LEU 27 2.347 7.717 1.784 219 HD23 LEU 27 2HD2 LEU 27 1.255 8.934 1.121 220 H GLU 28 H GLU 28 2.299 9.430 7.004 221 HA GLU 28 HA GLU 28 0.160 11.337 6.559 222 HB2 GLU 28 2HB GLU 28 1.039 10.238 9.236 223 HB3 GLU 28 1HB GLU 28 -0.600 10.571 8.678 224 HG2 GLU 28 2HG GLU 28 0.138 8.748 6.827 225 HG3 GLU 28 1HG GLU 28 1.127 8.213 8.186 226 H LYS 29 H LYS 29 3.151 11.284 8.487 227 HA LYS 29 HA LYS 29 2.756 13.945 9.597 228 HB2 LYS 29 2HB LYS 29 4.573 13.318 10.834 229 HB3 LYS 29 1HB LYS 29 4.285 11.739 10.116 230 HG2 LYS 29 2HG LYS 29 5.776 12.750 8.154 231 HG3 LYS 29 1HG LYS 29 6.394 13.749 9.472 232 HD2 LYS 29 2HD LYS 29 7.311 11.954 10.583 233 HD3 LYS 29 1HD LYS 29 6.089 10.832 9.978 234 HE2 LYS 29 2HE LYS 29 7.962 10.169 8.734 235 HE3 LYS 29 1HE LYS 29 7.235 11.362 7.639 236 HZ1 LYS 29 3HZ LYS 29 9.181 12.109 9.744 237 HZ2 LYS 29 1HZ LYS 29 8.656 13.045 8.431 238 HZ3 LYS 29 2HZ LYS 29 9.665 11.703 8.167 239 H ASN 30 H ASN 30 3.905 12.594 6.722 240 HA ASN 30 HA ASN 30 4.465 15.269 5.572 241 HB2 ASN 30 2HB ASN 30 6.326 12.876 5.691 242 HB3 ASN 30 1HB ASN 30 6.505 14.107 4.440 243 HD21 ASN 30 1HD2 ASN 30 6.643 16.455 5.351 244 HD22 ASN 30 2HD2 ASN 30 7.520 16.661 6.790 245 HA PRO 31 HA PRO 31 1.914 12.528 3.056 246 HB2 PRO 31 2HB PRO 31 -0.307 14.081 3.133 247 HB3 PRO 31 1HB PRO 31 0.127 12.938 4.411 248 HG2 PRO 31 2HG PRO 31 0.238 15.863 4.418 249 HG3 PRO 31 1HG PRO 31 0.078 14.724 5.761 250 HD2 PRO 31 2HD PRO 31 2.424 16.055 4.893 251 HD3 PRO 31 1HD PRO 31 2.275 14.826 6.169 252 H GLU 32 H GLU 32 3.669 15.125 2.492 253 HA GLU 32 HA GLU 32 2.455 15.618 -0.196 254 HB2 GLU 32 2HB GLU 32 4.068 17.816 0.871 255 HB3 GLU 32 1HB GLU 32 2.433 17.859 0.216 256 HG2 GLU 32 2HG GLU 32 1.501 17.150 2.345 257 HG3 GLU 32 1HG GLU 32 3.120 16.909 3.010 258 H ASP 33 H ASP 33 5.000 14.431 1.558 259 HA ASP 33 HA ASP 33 7.192 15.281 -0.145 260 HB2 ASP 33 2HB ASP 33 6.822 13.192 2.018 261 HB3 ASP 33 1HB ASP 33 8.375 13.503 1.242 262 H MET 34 H MET 34 7.577 14.353 -2.143 263 HA MET 34 HA MET 34 6.040 12.138 -3.132 264 HB2 MET 34 2HB MET 34 8.185 13.965 -4.002 265 HB3 MET 34 1HB MET 34 8.217 12.389 -4.795 266 HG2 MET 34 2HG MET 34 5.563 12.908 -4.918 267 HG3 MET 34 1HG MET 34 6.193 14.554 -4.971 268 HE1 MET 34 3HE MET 34 4.516 13.712 -6.883 269 HE2 MET 34 1HE MET 34 5.098 13.283 -8.498 270 HE3 MET 34 2HE MET 34 5.385 14.898 -7.854 271 H GLU 35 H GLU 35 8.612 12.127 -0.959 272 HA GLU 35 HA GLU 35 9.970 9.733 -1.939 273 HB2 GLU 35 2HB GLU 35 10.133 11.676 0.268 274 HB3 GLU 35 1HB GLU 35 10.551 10.032 0.756 275 HG2 GLU 35 2HG GLU 35 11.858 10.243 -1.645 276 HG3 GLU 35 1HG GLU 35 11.995 11.886 -1.020 277 H LEU 36 H LEU 36 7.937 10.385 0.954 278 HA LEU 36 HA LEU 36 7.493 7.606 1.519 279 HB2 LEU 36 2HB LEU 36 5.674 9.954 2.146 280 HB3 LEU 36 1HB LEU 36 5.832 8.460 3.065 281 HG LEU 36 HG LEU 36 7.712 10.792 2.909 282 HD11 LEU 36 1HD1 LEU 36 6.338 10.833 4.817 283 HD12 LEU 36 2HD1 LEU 36 7.843 10.119 5.397 284 HD13 LEU 36 3HD1 LEU 36 6.456 9.088 5.044 285 HD21 LEU 36 3HD2 LEU 36 9.366 9.196 4.120 286 HD22 LEU 36 1HD2 LEU 36 9.259 9.084 2.363 287 HD23 LEU 36 2HD2 LEU 36 8.435 7.898 3.374 288 H ILE 37 H ILE 37 6.088 9.897 -0.691 289 HA ILE 37 HA ILE 37 3.662 8.380 -1.246 290 HB ILE 37 HB ILE 37 5.192 10.619 -2.596 291 HG12 ILE 37 2HG1 ILE 37 2.667 10.519 -0.923 292 HG13 ILE 37 1HG1 ILE 37 4.213 11.224 -0.450 293 HG21 ILE 37 1HG2 ILE 37 3.517 10.846 -4.193 294 HG22 ILE 37 2HG2 ILE 37 2.341 9.946 -3.234 295 HG23 ILE 37 3HG2 ILE 37 3.641 9.091 -4.063 296 HD11 ILE 37 3HD1 ILE 37 2.368 12.177 -2.654 297 HD12 ILE 37 1HD1 ILE 37 4.006 12.787 -2.423 298 HD13 ILE 37 2HD1 ILE 37 2.789 13.034 -1.171 299 H ASN 38 H ASN 38 6.960 8.569 -2.530 300 HA ASN 38 HA ASN 38 6.303 6.720 -4.736 301 HB2 ASN 38 2HB ASN 38 7.780 8.608 -5.170 302 HB3 ASN 38 1HB ASN 38 8.826 8.131 -3.833 303 HD21 ASN 38 1HD2 ASN 38 7.339 6.084 -6.393 304 HD22 ASN 38 2HD2 ASN 38 8.814 5.490 -6.985 305 H GLU 39 H GLU 39 7.749 6.724 -1.601 306 HA GLU 39 HA GLU 39 9.095 4.164 -1.821 307 HB2 GLU 39 2HB GLU 39 8.236 6.020 0.392 308 HB3 GLU 39 1HB GLU 39 8.926 4.441 0.773 309 HG2 GLU 39 2HG GLU 39 10.348 6.221 -1.180 310 HG3 GLU 39 1HG GLU 39 10.502 6.542 0.547 311 H ALA 40 H ALA 40 5.934 5.277 -1.053 312 HA ALA 40 HA ALA 40 4.994 2.635 -0.116 313 HB1 ALA 40 1HB ALA 40 4.160 4.555 1.051 314 HB2 ALA 40 2HB ALA 40 2.825 4.001 0.045 315 HB3 ALA 40 3HB ALA 40 3.788 5.393 -0.455 316 H PHE 41 H PHE 41 4.378 4.919 -2.828 317 HA PHE 41 HA PHE 41 2.482 3.473 -4.292 318 HB2 PHE 41 2HB PHE 41 3.125 5.564 -5.148 319 HB3 PHE 41 1HB PHE 41 4.844 5.218 -4.963 320 HD1 PHE 41 2HD PHE 41 6.012 3.732 -6.564 321 HD2 PHE 41 1HD PHE 41 1.906 4.861 -7.120 322 HE1 PHE 41 2HE PHE 41 6.123 2.971 -8.922 323 HE2 PHE 41 1HE PHE 41 2.017 4.097 -9.478 324 HZ PHE 41 HZ PHE 41 4.126 3.154 -10.379 325 H ARG 42 H ARG 42 6.042 3.116 -4.418 326 HA ARG 42 HA ARG 42 6.121 0.900 -6.220 327 HB2 ARG 42 2HB ARG 42 7.931 1.874 -3.991 328 HB3 ARG 42 1HB ARG 42 8.397 0.608 -5.126 329 HG2 ARG 42 2HG ARG 42 7.815 2.278 -6.984 330 HG3 ARG 42 1HG ARG 42 7.790 3.506 -5.717 331 HD2 ARG 42 2HD ARG 42 10.048 3.621 -5.751 332 HD3 ARG 42 1HD ARG 42 10.158 1.879 -5.429 333 HE ARG 42 HE ARG 42 10.166 3.141 -8.104 334 HH11 ARG 42 1HH2 ARG 42 8.360 0.616 -7.658 335 HH12 ARG 42 2HH2 ARG 42 9.421 -0.610 -8.266 336 HH21 ARG 42 1HH1 ARG 42 12.224 1.433 -8.250 337 HH22 ARG 42 2HH1 ARG 42 11.606 -0.145 -8.609 338 H ALA 43 H ALA 43 6.760 0.797 -2.696 339 HA ALA 43 HA ALA 43 6.677 -1.908 -2.192 340 HB1 ALA 43 1HB ALA 43 6.383 0.506 -0.771 341 HB2 ALA 43 2HB ALA 43 6.654 -1.094 -0.081 342 HB3 ALA 43 3HB ALA 43 5.011 -0.490 -0.283 343 H LEU 44 H LEU 44 3.753 0.168 -2.357 344 HA LEU 44 HA LEU 44 1.880 -1.995 -2.079 345 HB2 LEU 44 2HB LEU 44 1.796 0.807 -3.220 346 HB3 LEU 44 1HB LEU 44 0.358 -0.215 -3.157 347 HG LEU 44 HG LEU 44 2.007 0.108 -0.677 348 HD11 LEU 44 1HD1 LEU 44 0.136 2.151 -1.880 349 HD12 LEU 44 2HD1 LEU 44 1.764 2.398 -1.249 350 HD13 LEU 44 3HD1 LEU 44 0.430 2.070 -0.143 351 HD21 LEU 44 3HD2 LEU 44 0.221 -1.448 -0.487 352 HD22 LEU 44 1HD2 LEU 44 -0.884 -0.408 -1.385 353 HD23 LEU 44 2HD2 LEU 44 -0.397 0.028 0.253 354 H HIS 45 H HIS 45 3.429 -0.452 -4.867 355 HA HIS 45 HA HIS 45 1.945 -1.881 -6.896 356 HB2 HIS 45 2HB HIS 45 3.378 0.269 -7.015 357 HB3 HIS 45 1HB HIS 45 4.771 -0.809 -7.076 358 HD1 HIS 45 1HD HIS 45 1.841 -2.261 -8.710 359 HD2 HIS 45 2HD HIS 45 4.971 0.243 -9.854 360 HE1 HIS 45 1HE HIS 45 1.881 -2.276 -11.241 361 H THR 46 H THR 46 4.862 -2.477 -5.020 362 HA THR 46 HA THR 46 5.600 -4.900 -6.495 363 HB THR 46 HB THR 46 6.604 -3.141 -4.353 364 HG1 THR 46 1HG THR 46 8.337 -3.309 -5.549 365 HG21 THR 46 3HG2 THR 46 6.463 -5.012 -2.889 366 HG22 THR 46 1HG2 THR 46 8.131 -4.992 -3.461 367 HG23 THR 46 2HG2 THR 46 6.978 -6.134 -4.150 368 H LEU 47 H LEU 47 3.932 -4.018 -3.499 369 HA LEU 47 HA LEU 47 3.598 -6.756 -2.557 370 HB2 LEU 47 2HB LEU 47 2.839 -3.987 -1.822 371 HB3 LEU 47 1HB LEU 47 1.714 -5.234 -1.284 372 HG LEU 47 HG LEU 47 4.701 -5.407 -0.832 373 HD11 LEU 47 1HD1 LEU 47 2.852 -3.631 0.391 374 HD12 LEU 47 2HD1 LEU 47 4.515 -3.960 0.880 375 HD13 LEU 47 3HD1 LEU 47 3.192 -4.906 1.563 376 HD21 LEU 47 3HD2 LEU 47 3.387 -7.518 -0.764 377 HD22 LEU 47 1HD2 LEU 47 2.336 -6.806 0.461 378 HD23 LEU 47 2HD2 LEU 47 4.037 -7.098 0.820 379 H LYS 48 H LYS 48 1.699 -4.434 -4.445 380 HA LYS 48 HA LYS 48 -0.783 -5.856 -4.507 381 HB2 LYS 48 2HB LYS 48 -0.488 -3.507 -5.137 382 HB3 LYS 48 1HB LYS 48 0.603 -3.971 -6.442 383 HG2 LYS 48 2HG LYS 48 -1.656 -5.505 -6.928 384 HG3 LYS 48 1HG LYS 48 -2.314 -3.960 -6.388 385 HD2 LYS 48 2HD LYS 48 -2.024 -3.490 -8.632 386 HD3 LYS 48 1HD LYS 48 -0.448 -2.995 -8.010 387 HE2 LYS 48 2HE LYS 48 0.437 -5.278 -8.534 388 HE3 LYS 48 1HE LYS 48 -1.122 -5.668 -9.287 389 HZ1 LYS 48 3HZ LYS 48 -0.356 -3.162 -10.229 390 HZ2 LYS 48 1HZ LYS 48 -0.444 -4.611 -11.105 391 HZ3 LYS 48 2HZ LYS 48 1.012 -4.159 -10.359 392 H GLY 49 H GLY 49 2.193 -6.066 -6.423 393 HA2 GLY 49 2HA GLY 49 1.099 -7.877 -8.407 394 HA3 GLY 49 1HA GLY 49 2.816 -7.562 -8.135 395 H MET 50 H MET 50 2.954 -8.266 -5.394 396 HA MET 50 HA MET 50 3.260 -11.124 -5.556 397 HB2 MET 50 2HB MET 50 3.169 -9.119 -3.277 398 HB3 MET 50 1HB MET 50 3.607 -10.812 -3.052 399 HG2 MET 50 2HG MET 50 5.285 -10.302 -5.041 400 HG3 MET 50 1HG MET 50 5.101 -8.641 -4.476 401 HE1 MET 50 3HE MET 50 4.393 -8.715 -1.890 402 HE2 MET 50 1HE MET 50 5.972 -7.968 -1.607 403 HE3 MET 50 2HE MET 50 5.462 -9.350 -0.640 404 H ALA 51 H ALA 51 0.641 -9.019 -4.512 405 HA ALA 51 HA ALA 51 -0.899 -11.238 -3.307 406 HB1 ALA 51 1HB ALA 51 -2.571 -9.321 -3.067 407 HB2 ALA 51 2HB ALA 51 -1.352 -8.283 -3.809 408 HB3 ALA 51 3HB ALA 51 -1.019 -9.071 -2.266 409 H GLY 52 H GLY 52 -0.346 -10.019 -6.409 410 HA2 GLY 52 2HA GLY 52 -3.024 -10.409 -7.485 411 HA3 GLY 52 1HA GLY 52 -1.554 -10.152 -8.430 412 H THR 53 H THR 53 -0.364 -12.415 -6.677 413 HA THR 53 HA THR 53 -1.641 -14.676 -8.131 414 HB THR 53 HB THR 53 1.037 -13.554 -8.227 415 HG1 THR 53 1HG THR 53 1.017 -14.582 -10.139 416 HG21 THR 53 3HG2 THR 53 2.089 -15.934 -8.360 417 HG22 THR 53 1HG2 THR 53 0.736 -16.413 -7.335 418 HG23 THR 53 2HG2 THR 53 1.878 -15.191 -6.775 419 H MET 54 H MET 54 0.101 -13.602 -5.330 420 HA MET 54 HA MET 54 -0.520 -16.152 -3.919 421 HB2 MET 54 2HB MET 54 1.369 -13.858 -3.385 422 HB3 MET 54 1HB MET 54 1.160 -15.219 -2.287 423 HG2 MET 54 2HG MET 54 1.640 -16.014 -5.079 424 HG3 MET 54 1HG MET 54 2.986 -15.138 -4.348 425 HE1 MET 54 3HE MET 54 2.355 -16.359 -0.997 426 HE2 MET 54 1HE MET 54 3.439 -15.362 -1.977 427 HE3 MET 54 2HE MET 54 3.999 -16.901 -1.326 428 H GLY 55 H GLY 55 -1.360 -12.878 -4.199 429 HA2 GLY 55 2HA GLY 55 -2.680 -12.784 -1.537 430 HA3 GLY 55 1HA GLY 55 -2.546 -11.425 -2.656 431 H PHE 56 H PHE 56 -3.265 -13.969 -4.552 432 HA PHE 56 HA PHE 56 -5.266 -14.856 -5.443 433 HB2 PHE 56 2HB PHE 56 -5.686 -14.460 -2.742 434 HB3 PHE 56 1HB PHE 56 -7.045 -13.622 -3.493 435 HD1 PHE 56 1HD PHE 56 -7.795 -15.094 -5.794 436 HD2 PHE 56 2HD PHE 56 -6.278 -16.609 -2.072 437 HE1 PHE 56 1HE PHE 56 -8.893 -17.275 -6.234 438 HE2 PHE 56 2HE PHE 56 -7.375 -18.788 -2.511 439 HZ PHE 56 HZ PHE 56 -8.683 -19.121 -4.591 440 H SER 57 H SER 57 -4.490 -11.691 -5.200 441 HA SER 57 HA SER 57 -5.084 -9.855 -6.533 442 HB2 SER 57 2HB SER 57 -7.321 -11.527 -7.613 443 HB3 SER 57 1HB SER 57 -6.384 -10.286 -8.433 444 HG SER 57 HG SER 57 -5.607 -12.237 -9.128 445 H SER 58 H SER 58 -7.038 -11.447 -4.320 446 HA SER 58 HA SER 58 -9.266 -9.556 -4.338 447 HB2 SER 58 2HB SER 58 -8.310 -11.703 -2.409 448 HB3 SER 58 1HB SER 58 -9.836 -10.836 -2.251 449 HG SER 58 HG SER 58 -10.648 -11.975 -3.841 450 H MET 59 H MET 59 -6.178 -10.137 -2.847 451 HA MET 59 HA MET 59 -6.511 -7.706 -1.122 452 HB2 MET 59 2HB MET 59 -5.913 -9.833 -0.019 453 HB3 MET 59 1HB MET 59 -4.518 -10.001 -1.083 454 HG2 MET 59 2HG MET 59 -3.859 -7.638 -0.167 455 HG3 MET 59 1HG MET 59 -4.970 -8.026 1.144 456 HE1 MET 59 3HE MET 59 -1.201 -9.318 -0.361 457 HE2 MET 59 1HE MET 59 -2.725 -9.598 -1.215 458 HE3 MET 59 2HE MET 59 -1.927 -10.924 -0.376 459 H ALA 60 H ALA 60 -5.203 -8.767 -4.065 460 HA ALA 60 HA ALA 60 -2.853 -6.980 -3.995 461 HB1 ALA 60 1HB ALA 60 -3.591 -8.017 -6.596 462 HB2 ALA 60 2HB ALA 60 -3.710 -9.295 -5.388 463 HB3 ALA 60 3HB ALA 60 -2.190 -8.430 -5.607 464 H LYS 61 H LYS 61 -6.133 -7.073 -5.337 465 HA LYS 61 HA LYS 61 -5.852 -4.719 -7.014 466 HB2 LYS 61 2HB LYS 61 -7.958 -6.501 -5.920 467 HB3 LYS 61 1HB LYS 61 -8.489 -4.852 -6.257 468 HG2 LYS 61 2HG LYS 61 -8.805 -5.765 -8.340 469 HG3 LYS 61 1HG LYS 61 -7.122 -5.268 -8.495 470 HD2 LYS 61 2HD LYS 61 -6.913 -7.464 -9.170 471 HD3 LYS 61 1HD LYS 61 -6.696 -7.674 -7.432 472 HE2 LYS 61 2HE LYS 61 -8.362 -9.287 -8.425 473 HE3 LYS 61 1HE LYS 61 -9.072 -8.248 -7.174 474 HZ1 LYS 61 3HZ LYS 61 -9.022 -7.189 -9.888 475 HZ2 LYS 61 1HZ LYS 61 -10.209 -7.032 -8.688 476 HZ3 LYS 61 2HZ LYS 61 -10.112 -8.461 -9.601 477 H LEU 62 H LEU 62 -6.613 -5.421 -3.715 478 HA LEU 62 HA LEU 62 -7.449 -2.830 -2.820 479 HB2 LEU 62 2HB LEU 62 -7.856 -4.854 -1.552 480 HB3 LEU 62 1HB LEU 62 -6.134 -5.250 -1.540 481 HG LEU 62 HG LEU 62 -5.632 -3.437 -0.075 482 HD11 LEU 62 1HD1 LEU 62 -6.841 -1.591 -0.836 483 HD12 LEU 62 2HD1 LEU 62 -7.689 -1.968 0.664 484 HD13 LEU 62 3HD1 LEU 62 -8.362 -2.483 -0.883 485 HD21 LEU 62 3HD2 LEU 62 -6.762 -4.110 1.869 486 HD22 LEU 62 1HD2 LEU 62 -6.989 -5.500 0.809 487 HD23 LEU 62 2HD2 LEU 62 -8.291 -4.329 1.018 488 H CYS 63 H CYS 63 -4.313 -4.477 -3.082 489 HA CYS 63 HA CYS 63 -2.744 -2.400 -1.838 490 HB2 CYS 63 2HB CYS 63 -2.317 -4.951 -2.457 491 HB3 CYS 63 1HB CYS 63 -1.682 -4.252 -3.945 492 HG CYS 63 HG CYS 63 -0.194 -2.700 -2.171 493 H HIS 64 H HIS 64 -3.886 -3.039 -5.105 494 HA HIS 64 HA HIS 64 -2.224 -1.086 -6.450 495 HB2 HIS 64 2HB HIS 64 -3.642 -3.099 -7.336 496 HB3 HIS 64 1HB HIS 64 -4.990 -1.965 -7.290 497 HD1 HIS 64 1HD HIS 64 -4.271 -2.879 -10.037 498 HD2 HIS 64 2HD HIS 64 -2.346 0.356 -8.245 499 HE1 HIS 64 1HE HIS 64 -3.300 -1.493 -11.921 500 H THR 65 H THR 65 -5.385 -1.083 -4.895 501 HA THR 65 HA THR 65 -6.284 1.509 -5.664 502 HB THR 65 HB THR 65 -6.807 -0.564 -3.604 503 HG1 THR 65 1HG THR 65 -7.865 -0.215 -5.688 504 HG21 THR 65 3HG2 THR 65 -7.458 2.343 -3.187 505 HG22 THR 65 1HG2 THR 65 -6.854 1.163 -2.025 506 HG23 THR 65 2HG2 THR 65 -8.531 1.087 -2.567 507 H LEU 66 H LEU 66 -4.628 0.503 -2.629 508 HA LEU 66 HA LEU 66 -4.270 3.041 -1.451 509 HB2 LEU 66 2HB LEU 66 -2.713 0.454 -1.548 510 HB3 LEU 66 1HB LEU 66 -2.092 1.828 -0.634 511 HG LEU 66 HG LEU 66 -4.522 1.896 0.352 512 HD11 LEU 66 1HD1 LEU 66 -5.418 -0.444 0.578 513 HD12 LEU 66 2HD1 LEU 66 -4.254 -0.943 -0.648 514 HD13 LEU 66 3HD1 LEU 66 -5.525 0.213 -1.055 515 HD21 LEU 66 3HD2 LEU 66 -3.339 -0.403 1.606 516 HD22 LEU 66 1HD2 LEU 66 -3.350 1.266 2.173 517 HD23 LEU 66 2HD2 LEU 66 -2.057 0.705 1.117 518 H GLU 67 H GLU 67 -2.131 1.273 -3.683 519 HA GLU 67 HA GLU 67 -0.132 3.268 -4.021 520 HB2 GLU 67 2HB GLU 67 0.304 1.032 -4.677 521 HB3 GLU 67 1HB GLU 67 -1.200 0.923 -5.591 522 HG2 GLU 67 2HG GLU 67 -0.268 2.680 -7.159 523 HG3 GLU 67 1HG GLU 67 1.273 2.519 -6.316 524 H ASN 68 H ASN 68 -3.312 2.856 -5.468 525 HA ASN 68 HA ASN 68 -2.959 4.539 -7.748 526 HB2 ASN 68 2HB ASN 68 -5.028 3.191 -6.281 527 HB3 ASN 68 1HB ASN 68 -5.565 4.822 -6.676 528 HD21 ASN 68 1HD2 ASN 68 -3.315 2.839 -8.620 529 HD22 ASN 68 2HD2 ASN 68 -4.331 2.720 -9.975 530 H ILE 69 H ILE 69 -3.911 5.156 -4.391 531 HA ILE 69 HA ILE 69 -4.362 7.972 -4.656 532 HB ILE 69 HB ILE 69 -3.627 6.077 -2.437 533 HG12 ILE 69 2HG1 ILE 69 -5.963 6.793 -1.721 534 HG13 ILE 69 1HG1 ILE 69 -6.090 7.593 -3.283 535 HG21 ILE 69 1HG2 ILE 69 -4.326 9.007 -2.104 536 HG22 ILE 69 2HG2 ILE 69 -2.682 8.376 -1.995 537 HG23 ILE 69 3HG2 ILE 69 -3.903 7.867 -0.828 538 HD11 ILE 69 3HD1 ILE 69 -7.031 5.243 -3.210 539 HD12 ILE 69 1HD1 ILE 69 -5.378 4.679 -2.981 540 HD13 ILE 69 2HD1 ILE 69 -5.822 5.529 -4.462 541 H LEU 70 H LEU 70 -1.667 5.969 -4.097 542 HA LEU 70 HA LEU 70 0.254 8.105 -3.640 543 HB2 LEU 70 2HB LEU 70 0.736 5.267 -4.577 544 HB3 LEU 70 1HB LEU 70 1.878 6.304 -3.723 545 HG LEU 70 HG LEU 70 -0.617 4.995 -2.662 546 HD11 LEU 70 1HD1 LEU 70 0.957 4.247 -0.916 547 HD12 LEU 70 2HD1 LEU 70 2.254 5.130 -1.724 548 HD13 LEU 70 3HD1 LEU 70 1.491 3.755 -2.523 549 HD21 LEU 70 3HD2 LEU 70 0.151 6.381 -0.527 550 HD22 LEU 70 1HD2 LEU 70 -0.964 7.080 -1.703 551 HD23 LEU 70 2HD2 LEU 70 0.750 7.498 -1.753 552 H ASP 71 H ASP 71 -1.246 6.655 -6.341 553 HA ASP 71 HA ASP 71 0.811 7.545 -8.252 554 HB2 ASP 71 2HB ASP 71 -1.730 6.001 -8.245 555 HB3 ASP 71 1HB ASP 71 -1.393 6.892 -9.731 556 H LYS 72 H LYS 72 -2.498 8.470 -7.281 557 HA LYS 72 HA LYS 72 -2.474 10.827 -9.003 558 HB2 LYS 72 2HB LYS 72 -4.315 11.141 -6.840 559 HB3 LYS 72 1HB LYS 72 -4.683 10.725 -8.506 560 HG2 LYS 72 2HG LYS 72 -4.222 8.330 -7.952 561 HG3 LYS 72 1HG LYS 72 -4.039 8.806 -6.262 562 HD2 LYS 72 2HD LYS 72 -6.402 9.994 -7.078 563 HD3 LYS 72 1HD LYS 72 -6.428 8.391 -7.807 564 HE2 LYS 72 2HE LYS 72 -5.871 7.403 -5.582 565 HE3 LYS 72 1HE LYS 72 -6.003 9.029 -4.877 566 HZ1 LYS 72 3HZ LYS 72 -8.138 8.023 -4.685 567 HZ2 LYS 72 1HZ LYS 72 -8.121 7.508 -6.301 568 HZ3 LYS 72 2HZ LYS 72 -8.247 9.163 -5.940 569 H ALA 73 H ALA 73 -1.537 9.947 -5.804 570 HA ALA 73 HA ALA 73 -1.120 12.548 -4.648 571 HB1 ALA 73 1HB ALA 73 0.533 11.197 -3.257 572 HB2 ALA 73 2HB ALA 73 0.214 9.834 -4.335 573 HB3 ALA 73 3HB ALA 73 -1.079 10.492 -3.334 574 H ARG 74 H ARG 74 0.659 10.470 -6.836 575 HA ARG 74 HA ARG 74 3.051 12.207 -6.898 576 HB2 ARG 74 2HB ARG 74 2.147 9.549 -7.895 577 HB3 ARG 74 1HB ARG 74 3.353 10.376 -8.880 578 HG2 ARG 74 2HG ARG 74 4.875 10.534 -7.019 579 HG3 ARG 74 1HG ARG 74 3.642 9.954 -5.899 580 HD2 ARG 74 2HD ARG 74 5.192 8.119 -6.485 581 HD3 ARG 74 1HD ARG 74 3.578 7.785 -7.144 582 HE ARG 74 HE ARG 74 4.405 8.263 -9.334 583 HH11 ARG 74 1HH2 ARG 74 5.950 10.730 -8.747 584 HH12 ARG 74 2HH2 ARG 74 7.587 10.216 -8.993 585 HH21 ARG 74 1HH1 ARG 74 6.826 6.837 -8.822 586 HH22 ARG 74 2HH1 ARG 74 8.082 8.011 -9.032 587 H ASN 75 H ASN 75 0.055 11.704 -8.570 588 HA ASN 75 HA ASN 75 0.974 13.198 -10.978 589 HB2 ASN 75 2HB ASN 75 -0.861 11.124 -10.395 590 HB3 ASN 75 1HB ASN 75 -1.831 12.505 -10.900 591 HD21 ASN 75 1HD2 ASN 75 0.335 10.027 -12.016 592 HD22 ASN 75 2HD2 ASN 75 0.394 10.522 -13.639 593 H SER 76 H SER 76 -0.023 14.034 -7.972 594 HA SER 76 HA SER 76 -0.784 16.095 -7.106 595 HB2 SER 76 2HB SER 76 0.486 16.790 -9.281 596 HB3 SER 76 1HB SER 76 -1.125 17.009 -9.959 597 HG SER 76 HG SER 76 -0.843 18.913 -9.047 598 H GLU 77 H GLU 77 -2.626 13.899 -7.672 599 HA GLU 77 HA GLU 77 -5.068 15.427 -8.445 600 HB2 GLU 77 2HB GLU 77 -5.234 12.492 -8.210 601 HB3 GLU 77 1HB GLU 77 -5.844 13.541 -9.482 602 HG2 GLU 77 2HG GLU 77 -2.910 12.876 -9.159 603 HG3 GLU 77 1HG GLU 77 -4.003 11.954 -10.188 604 H ILE 78 H ILE 78 -3.484 13.609 -6.000 605 HA ILE 78 HA ILE 78 -5.676 14.280 -4.092 606 HB ILE 78 HB ILE 78 -5.777 11.947 -3.370 607 HG12 ILE 78 2HG1 ILE 78 -4.441 10.311 -4.922 608 HG13 ILE 78 1HG1 ILE 78 -3.440 11.730 -5.240 609 HG21 ILE 78 1HG2 ILE 78 -6.727 10.938 -5.381 610 HG22 ILE 78 2HG2 ILE 78 -5.868 12.094 -6.398 611 HG23 ILE 78 3HG2 ILE 78 -7.160 12.647 -5.331 612 HD11 ILE 78 3HD1 ILE 78 -4.039 11.375 -2.403 613 HD12 ILE 78 1HD1 ILE 78 -2.498 11.664 -3.205 614 HD13 ILE 78 2HD1 ILE 78 -3.142 10.028 -3.093 615 H LYS 79 H LYS 79 -4.936 13.916 -1.823 616 HA LYS 79 HA LYS 79 -2.004 13.713 -1.460 617 HB2 LYS 79 2HB LYS 79 -3.838 16.021 -0.783 618 HB3 LYS 79 1HB LYS 79 -2.311 15.790 0.072 619 HG2 LYS 79 2HG LYS 79 -2.601 16.018 -2.935 620 HG3 LYS 79 1HG LYS 79 -2.053 17.315 -1.867 621 HD2 LYS 79 2HD LYS 79 0.030 16.466 -1.804 622 HD3 LYS 79 1HD LYS 79 -0.589 14.885 -1.329 623 HE2 LYS 79 2HE LYS 79 -0.286 14.067 -3.416 624 HE3 LYS 79 1HE LYS 79 -1.155 15.437 -4.134 625 HZ1 LYS 79 3HZ LYS 79 1.446 16.033 -2.976 626 HZ2 LYS 79 1HZ LYS 79 0.735 16.623 -4.399 627 HZ3 LYS 79 2HZ LYS 79 1.476 15.095 -4.392 628 H ILE 80 H ILE 80 -1.478 12.820 0.590 629 HA ILE 80 HA ILE 80 -3.432 11.288 1.980 630 HB ILE 80 HB ILE 80 -0.674 12.309 2.518 631 HG12 ILE 80 2HG1 ILE 80 -0.252 9.800 2.475 632 HG13 ILE 80 1HG1 ILE 80 -1.934 9.622 1.979 633 HG21 ILE 80 1HG2 ILE 80 -2.177 10.449 4.368 634 HG22 ILE 80 2HG2 ILE 80 -1.956 12.164 4.700 635 HG23 ILE 80 3HG2 ILE 80 -0.556 11.099 4.603 636 HD11 ILE 80 3HD1 ILE 80 -0.017 11.430 0.501 637 HD12 ILE 80 1HD1 ILE 80 -1.574 10.810 -0.049 638 HD13 ILE 80 2HD1 ILE 80 -0.194 9.722 0.094 639 H THR 81 H THR 81 -5.139 12.562 2.499 640 HA THR 81 HA THR 81 -4.777 14.974 4.213 641 HB THR 81 HB THR 81 -6.102 14.922 2.063 642 HG1 THR 81 1HG THR 81 -8.103 15.730 3.262 643 HG21 THR 81 3HG2 THR 81 -7.899 13.139 3.708 644 HG22 THR 81 1HG2 THR 81 -6.980 12.664 2.278 645 HG23 THR 81 2HG2 THR 81 -8.306 13.819 2.132 646 H SER 82 H SER 82 -4.580 12.078 5.178 647 HA SER 82 HA SER 82 -5.202 11.006 7.209 648 HB2 SER 82 2HB SER 82 -5.827 13.679 7.544 649 HB3 SER 82 1HB SER 82 -7.371 12.885 7.842 650 HG SER 82 HG SER 82 -6.231 11.509 9.319 651 H ASP 83 H ASP 83 -7.158 11.659 4.560 652 HA ASP 83 HA ASP 83 -9.296 9.787 5.490 653 HB2 ASP 83 2HB ASP 83 -9.591 12.325 4.657 654 HB3 ASP 83 1HB ASP 83 -9.558 11.539 3.078 655 H LEU 84 H LEU 84 -7.413 10.813 2.608 656 HA LEU 84 HA LEU 84 -8.000 8.431 1.077 657 HB2 LEU 84 2HB LEU 84 -5.680 10.395 0.993 658 HB3 LEU 84 1HB LEU 84 -6.111 9.279 -0.303 659 HG LEU 84 HG LEU 84 -7.781 11.571 0.765 660 HD11 LEU 84 1HD1 LEU 84 -6.090 12.293 -0.807 661 HD12 LEU 84 2HD1 LEU 84 -7.636 12.274 -1.654 662 HD13 LEU 84 3HD1 LEU 84 -6.478 10.969 -1.906 663 HD21 LEU 84 3HD2 LEU 84 -9.564 10.305 0.177 664 HD22 LEU 84 1HD2 LEU 84 -8.541 9.088 -0.586 665 HD23 LEU 84 2HD2 LEU 84 -9.033 10.521 -1.490 666 H LEU 85 H LEU 85 -5.704 9.246 3.576 667 HA LEU 85 HA LEU 85 -4.093 6.813 3.108 668 HB2 LEU 85 2HB LEU 85 -2.535 8.040 4.222 669 HB3 LEU 85 1HB LEU 85 -3.679 9.374 4.122 670 HG LEU 85 HG LEU 85 -4.696 8.324 6.290 671 HD11 LEU 85 1HD1 LEU 85 -3.353 6.267 6.237 672 HD12 LEU 85 2HD1 LEU 85 -2.976 7.205 7.683 673 HD13 LEU 85 3HD1 LEU 85 -1.870 7.221 6.308 674 HD21 LEU 85 3HD2 LEU 85 -1.975 9.574 6.630 675 HD22 LEU 85 1HD2 LEU 85 -3.447 9.868 7.556 676 HD23 LEU 85 2HD2 LEU 85 -3.297 10.496 5.916 677 H ASP 86 H ASP 86 -6.592 8.044 5.272 678 HA ASP 86 HA ASP 86 -6.480 6.030 7.300 679 HB2 ASP 86 2HB ASP 86 -7.759 8.077 7.553 680 HB3 ASP 86 1HB ASP 86 -8.734 7.698 6.132 681 H LYS 87 H LYS 87 -8.189 6.168 4.174 682 HA LYS 87 HA LYS 87 -9.454 3.561 4.518 683 HB2 LYS 87 2HB LYS 87 -8.897 5.211 2.025 684 HB3 LYS 87 1HB LYS 87 -10.098 3.929 2.180 685 HG2 LYS 87 2HG LYS 87 -10.096 6.651 3.488 686 HG3 LYS 87 1HG LYS 87 -11.332 5.937 2.453 687 HD2 LYS 87 2HD LYS 87 -11.857 4.279 4.181 688 HD3 LYS 87 1HD LYS 87 -10.582 4.927 5.213 689 HE2 LYS 87 2HE LYS 87 -12.909 5.777 5.775 690 HE3 LYS 87 1HE LYS 87 -11.744 7.063 5.397 691 HZ1 LYS 87 3HZ LYS 87 -14.003 7.036 4.169 692 HZ2 LYS 87 1HZ LYS 87 -13.304 5.800 3.241 693 HZ3 LYS 87 2HZ LYS 87 -12.587 7.340 3.283 694 H ILE 88 H ILE 88 -6.546 4.846 2.940 695 HA ILE 88 HA ILE 88 -5.693 2.435 1.653 696 HB ILE 88 HB ILE 88 -4.635 5.062 2.479 697 HG12 ILE 88 2HG1 ILE 88 -3.570 3.695 0.115 698 HG13 ILE 88 1HG1 ILE 88 -5.326 3.876 0.144 699 HG21 ILE 88 1HG2 ILE 88 -2.605 2.911 1.887 700 HG22 ILE 88 2HG2 ILE 88 -2.975 3.430 3.530 701 HG23 ILE 88 3HG2 ILE 88 -2.306 4.577 2.374 702 HD11 ILE 88 3HD1 ILE 88 -3.492 5.846 -0.590 703 HD12 ILE 88 1HD1 ILE 88 -3.962 6.291 1.052 704 HD13 ILE 88 2HD1 ILE 88 -5.191 6.104 -0.198 705 H PHE 89 H PHE 89 -4.799 3.838 4.815 706 HA PHE 89 HA PHE 89 -3.329 1.590 5.780 707 HB2 PHE 89 2HB PHE 89 -3.048 3.680 6.860 708 HB3 PHE 89 1HB PHE 89 -4.789 3.931 6.991 709 HD1 PHE 89 2HD PHE 89 -6.129 2.563 8.612 710 HD2 PHE 89 1HD PHE 89 -1.835 2.435 8.518 711 HE1 PHE 89 2HE PHE 89 -6.110 1.527 10.865 712 HE2 PHE 89 1HE PHE 89 -1.817 1.399 10.772 713 HZ PHE 89 HZ PHE 89 -3.954 0.945 11.945 714 H ALA 90 H ALA 90 -6.671 2.226 5.448 715 HA ALA 90 HA ALA 90 -7.589 0.203 7.351 716 HB1 ALA 90 1HB ALA 90 -9.061 2.035 6.936 717 HB2 ALA 90 2HB ALA 90 -9.771 0.701 6.027 718 HB3 ALA 90 3HB ALA 90 -8.822 1.930 5.193 719 H GLY 91 H GLY 91 -6.746 0.486 3.974 720 HA2 GLY 91 2HA GLY 91 -7.849 -2.074 3.153 721 HA3 GLY 91 1HA GLY 91 -6.677 -1.109 2.244 722 H VAL 92 H VAL 92 -4.681 -0.826 4.159 723 HA VAL 92 HA VAL 92 -3.223 -3.295 3.951 724 HB VAL 92 HB VAL 92 -2.993 -0.711 5.502 725 HG11 VAL 92 1HG1 VAL 92 -1.078 -3.066 5.612 726 HG12 VAL 92 2HG1 VAL 92 -2.062 -2.476 6.951 727 HG13 VAL 92 3HG1 VAL 92 -0.771 -1.469 6.295 728 HG21 VAL 92 3HG2 VAL 92 -1.894 -0.091 3.637 729 HG22 VAL 92 1HG2 VAL 92 -2.166 -1.689 2.942 730 HG23 VAL 92 2HG2 VAL 92 -0.720 -1.381 3.904 731 H ASP 93 H ASP 93 -5.524 -2.004 6.197 732 HA ASP 93 HA ASP 93 -4.926 -3.682 8.477 733 HB2 ASP 93 2HB ASP 93 -6.625 -1.535 7.732 734 HB3 ASP 93 1HB ASP 93 -7.691 -2.850 8.234 735 H MET 94 H MET 94 -7.240 -3.856 5.766 736 HA MET 94 HA MET 94 -8.320 -6.435 6.591 737 HB2 MET 94 2HB MET 94 -8.369 -5.070 3.878 738 HB3 MET 94 1HB MET 94 -9.522 -6.259 4.487 739 HG2 MET 94 2HG MET 94 -9.892 -4.526 6.415 740 HG3 MET 94 1HG MET 94 -9.185 -3.380 5.277 741 HE1 MET 94 3HE MET 94 -9.722 -3.448 2.853 742 HE2 MET 94 1HE MET 94 -11.351 -3.594 2.179 743 HE3 MET 94 2HE MET 94 -10.370 -5.034 2.445 744 H ILE 95 H ILE 95 -5.883 -5.215 4.359 745 HA ILE 95 HA ILE 95 -5.187 -7.578 2.963 746 HB ILE 95 HB ILE 95 -3.968 -4.985 3.781 747 HG12 ILE 95 2HG1 ILE 95 -3.666 -6.224 1.084 748 HG13 ILE 95 1HG1 ILE 95 -5.292 -5.772 1.600 749 HG21 ILE 95 1HG2 ILE 95 -1.768 -5.584 2.822 750 HG22 ILE 95 2HG2 ILE 95 -2.295 -7.263 2.691 751 HG23 ILE 95 3HG2 ILE 95 -2.122 -6.513 4.278 752 HD11 ILE 95 3HD1 ILE 95 -3.779 -4.002 0.372 753 HD12 ILE 95 1HD1 ILE 95 -3.040 -3.821 1.964 754 HD13 ILE 95 2HD1 ILE 95 -4.762 -3.507 1.751 755 H THR 96 H THR 96 -3.968 -6.278 6.058 756 HA THR 96 HA THR 96 -2.202 -8.477 6.639 757 HB THR 96 HB THR 96 -3.604 -6.383 8.339 758 HG1 THR 96 1HG THR 96 -0.975 -6.073 8.100 759 HG21 THR 96 3HG2 THR 96 -2.730 -7.349 10.173 760 HG22 THR 96 1HG2 THR 96 -1.126 -7.372 9.436 761 HG23 THR 96 2HG2 THR 96 -2.238 -8.717 9.173 762 H ARG 97 H ARG 97 -5.589 -7.729 7.406 763 HA ARG 97 HA ARG 97 -6.015 -10.009 9.134 764 HB2 ARG 97 2HB ARG 97 -7.683 -8.012 7.620 765 HB3 ARG 97 1HB ARG 97 -8.471 -9.395 8.382 766 HG2 ARG 97 2HG ARG 97 -8.028 -8.653 10.508 767 HG3 ARG 97 1HG ARG 97 -6.502 -7.904 10.041 768 HD2 ARG 97 2HD ARG 97 -7.502 -5.890 9.746 769 HD3 ARG 97 1HD ARG 97 -8.781 -6.607 8.745 770 HE ARG 97 HE ARG 97 -9.792 -7.391 10.970 771 HH11 ARG 97 1HH1 ARG 97 -8.689 -4.300 10.241 772 HH12 ARG 97 2HH1 ARG 97 -8.861 -3.672 11.845 773 HH21 ARG 97 1HH2 ARG 97 -9.583 -6.754 13.260 774 HH22 ARG 97 2HH2 ARG 97 -9.368 -5.060 13.554 775 H MET 98 H MET 98 -6.457 -9.396 5.662 776 HA MET 98 HA MET 98 -7.665 -11.972 5.080 777 HB2 MET 98 2HB MET 98 -6.161 -9.975 3.346 778 HB3 MET 98 1HB MET 98 -7.220 -11.255 2.752 779 HG2 MET 98 2HG MET 98 -9.139 -10.164 3.407 780 HG3 MET 98 1HG MET 98 -8.351 -9.379 4.775 781 HE1 MET 98 3HE MET 98 -9.904 -9.148 1.653 782 HE2 MET 98 1HE MET 98 -8.418 -9.380 0.723 783 HE3 MET 98 2HE MET 98 -9.237 -7.820 0.706 784 H VAL 99 H VAL 99 -4.456 -10.736 5.524 785 HA VAL 99 HA VAL 99 -3.133 -13.002 4.236 786 HB VAL 99 HB VAL 99 -2.357 -10.524 5.767 787 HG11 VAL 99 1HG1 VAL 99 0.062 -11.515 5.026 788 HG12 VAL 99 2HG1 VAL 99 -0.774 -13.016 5.422 789 HG13 VAL 99 3HG1 VAL 99 -0.622 -11.746 6.636 790 HG21 VAL 99 3HG2 VAL 99 -0.945 -11.104 3.301 791 HG22 VAL 99 1HG2 VAL 99 -1.981 -9.731 3.688 792 HG23 VAL 99 2HG2 VAL 99 -2.687 -11.218 3.054 793 H ASP 100 H ASP 100 -3.915 -11.888 7.530 794 HA ASP 100 HA ASP 100 -2.461 -13.920 8.957 795 HB2 ASP 100 2HB ASP 100 -4.699 -12.000 9.424 796 HB3 ASP 100 1HB ASP 100 -4.594 -13.358 10.544 797 H LYS 101 H LYS 101 -5.633 -13.740 7.451 798 HA LYS 101 HA LYS 101 -6.497 -16.374 8.341 799 HB2 LYS 101 2HB LYS 101 -8.474 -15.674 7.381 800 HB3 LYS 101 1HB LYS 101 -7.682 -14.100 7.383 801 HG2 LYS 101 2HG LYS 101 -8.358 -14.293 5.153 802 HG3 LYS 101 1HG LYS 101 -6.702 -14.899 5.094 803 HD2 LYS 101 2HD LYS 101 -7.574 -16.722 4.140 804 HD3 LYS 101 1HD LYS 101 -8.108 -17.152 5.759 805 HE2 LYS 101 2HE LYS 101 -9.866 -15.280 4.240 806 HE3 LYS 101 1HE LYS 101 -9.843 -16.972 3.703 807 HZ1 LYS 101 3HZ LYS 101 -10.281 -17.700 5.927 808 HZ2 LYS 101 1HZ LYS 101 -11.457 -16.550 5.516 809 HZ3 LYS 101 2HZ LYS 101 -10.166 -16.115 6.531 810 H ILE 102 H ILE 102 -4.486 -15.078 5.861 811 HA ILE 102 HA ILE 102 -4.721 -17.279 3.962 812 HB ILE 102 HB ILE 102 -3.381 -14.728 4.328 813 HG12 ILE 102 2HG1 ILE 102 -3.546 -16.149 1.712 814 HG13 ILE 102 1HG1 ILE 102 -5.048 -15.731 2.534 815 HG21 ILE 102 1HG2 ILE 102 -1.281 -15.801 4.458 816 HG22 ILE 102 2HG2 ILE 102 -1.451 -15.361 2.759 817 HG23 ILE 102 3HG2 ILE 102 -1.744 -17.024 3.271 818 HD11 ILE 102 3HD1 ILE 102 -4.017 -13.993 0.894 819 HD12 ILE 102 1HD1 ILE 102 -2.873 -13.680 2.200 820 HD13 ILE 102 2HD1 ILE 102 -4.598 -13.426 2.461 821 H VAL 103 H VAL 103 -2.273 -16.219 6.322 822 HA VAL 103 HA VAL 103 -0.615 -18.545 6.200 823 HB VAL 103 HB VAL 103 -1.252 -16.440 8.288 824 HG11 VAL 103 1HG1 VAL 103 1.192 -17.447 9.014 825 HG12 VAL 103 2HG1 VAL 103 0.354 -18.913 8.504 826 HG13 VAL 103 3HG1 VAL 103 -0.333 -17.903 9.777 827 HG21 VAL 103 3HG2 VAL 103 0.346 -16.510 5.933 828 HG22 VAL 103 1HG2 VAL 103 1.451 -16.463 7.307 829 HG23 VAL 103 2HG2 VAL 103 0.227 -15.208 7.117 830 H SER 104 H SER 104 -3.675 -17.806 7.669 831 HA SER 104 HA SER 104 -3.691 -20.143 9.446 832 HB2 SER 104 2HB SER 104 -4.730 -17.780 9.767 833 HB3 SER 104 1HB SER 104 -6.010 -18.378 8.715 834 HG SER 104 HG SER 104 -5.816 -20.279 10.337 835 H GLU 105 H GLU 105 -5.722 -19.000 6.808 836 HA GLU 105 HA GLU 105 -6.527 -21.829 6.230 837 HB2 GLU 105 2HB GLU 105 -7.803 -19.341 5.102 838 HB3 GLU 105 1HB GLU 105 -8.543 -20.906 5.434 839 HG2 GLU 105 2HG GLU 105 -7.745 -20.224 7.935 840 HG3 GLU 105 1HG GLU 105 -8.043 -18.623 7.259 841 H GLY 106 H GLY 106 -5.388 -18.836 4.672 842 HA2 GLY 106 2HA GLY 106 -3.692 -18.990 2.883 843 HA3 GLY 106 1HA GLY 106 -4.448 -20.501 2.375 844 H SER 107 H SER 107 -6.383 -17.737 3.291 845 HA SER 107 HA SER 107 -7.019 -17.240 0.395 846 HB2 SER 107 2HB SER 107 -9.338 -16.798 1.883 847 HB3 SER 107 1HB SER 107 -9.016 -18.164 0.823 848 HG SER 107 HG SER 107 -8.502 -19.376 2.519 849 H ASP 108 H ASP 108 -6.663 -15.169 -0.088 850 HA ASP 108 HA ASP 108 -6.401 -13.118 2.001 851 HB2 ASP 108 2HB ASP 108 -5.415 -13.601 -0.574 852 HB3 ASP 108 1HB ASP 108 -6.506 -12.231 -0.787 853 H ASP 109 H ASP 109 -9.024 -14.564 0.678 854 HA ASP 109 HA ASP 109 -10.599 -12.047 0.310 855 HB2 ASP 109 2HB ASP 109 -10.590 -13.913 -1.387 856 HB3 ASP 109 1HB ASP 109 -11.353 -14.945 -0.175 857 H ILE 110 H ILE 110 -11.186 -11.354 2.381 858 HA ILE 110 HA ILE 110 -12.306 -13.382 4.265 859 HB ILE 110 HB ILE 110 -11.880 -11.670 5.950 860 HG12 ILE 110 2HG1 ILE 110 -10.967 -9.884 3.678 861 HG13 ILE 110 1HG1 ILE 110 -12.565 -9.771 4.414 862 HG21 ILE 110 1HG2 ILE 110 -9.638 -11.990 3.935 863 HG22 ILE 110 2HG2 ILE 110 -9.947 -12.995 5.350 864 HG23 ILE 110 3HG2 ILE 110 -9.413 -11.328 5.554 865 HD11 ILE 110 3HD1 ILE 110 -11.756 -8.680 6.221 866 HD12 ILE 110 1HD1 ILE 110 -10.260 -8.483 5.308 867 HD13 ILE 110 2HD1 ILE 110 -10.443 -9.841 6.419 868 H GLY 111 H GLY 111 -13.702 -12.117 1.852 869 HA2 GLY 111 2HA GLY 111 -15.996 -11.652 1.489 870 HA3 GLY 111 1HA GLY 111 -16.220 -11.558 3.236 871 H GLU 112 H GLU 112 -13.613 -9.667 2.727 872 HA GLU 112 HA GLU 112 -14.972 -7.204 3.224 873 HB2 GLU 112 2HB GLU 112 -12.242 -8.146 2.487 874 HB3 GLU 112 1HB GLU 112 -12.574 -6.430 2.257 875 HG2 GLU 112 2HG GLU 112 -12.917 -8.001 4.825 876 HG3 GLU 112 1HG GLU 112 -11.699 -6.767 4.505 877 H ASN 113 H ASN 113 -13.831 -5.388 1.378 878 HA ASN 113 HA ASN 113 -15.116 -6.177 -1.215 879 HB2 ASN 113 2HB ASN 113 -15.691 -4.034 0.712 880 HB3 ASN 113 1HB ASN 113 -15.539 -3.466 -0.952 881 HD21 ASN 113 1HD2 ASN 113 -18.061 -3.580 0.536 882 HD22 ASN 113 2HD2 ASN 113 -19.069 -4.675 -0.279 883 H ILE 114 H ILE 114 -14.013 -5.528 -3.044 884 HA ILE 114 HA ILE 114 -11.470 -3.999 -2.616 885 HB ILE 114 HB ILE 114 -12.309 -6.356 -4.259 886 HG12 ILE 114 2HG1 ILE 114 -10.174 -7.210 -3.590 887 HG13 ILE 114 1HG1 ILE 114 -9.600 -5.605 -3.141 888 HG21 ILE 114 1HG2 ILE 114 -10.664 -4.099 -5.278 889 HG22 ILE 114 2HG2 ILE 114 -11.613 -5.295 -6.166 890 HG23 ILE 114 3HG2 ILE 114 -10.017 -5.719 -5.547 891 HD11 ILE 114 3HD1 ILE 114 -10.443 -7.261 -1.280 892 HD12 ILE 114 1HD1 ILE 114 -12.040 -6.715 -1.795 893 HD13 ILE 114 2HD1 ILE 114 -10.862 -5.551 -1.187 894 H ASP 115 H ASP 115 -13.336 -4.751 -5.563 895 HA ASP 115 HA ASP 115 -12.971 -2.288 -6.844 896 HB2 ASP 115 2HB ASP 115 -14.118 -4.580 -7.508 897 HB3 ASP 115 1HB ASP 115 -15.590 -3.741 -7.011 898 H VAL 116 H VAL 116 -14.979 -3.123 -4.199 899 HA VAL 116 HA VAL 116 -16.585 -0.662 -4.340 900 HB VAL 116 HB VAL 116 -16.486 -3.122 -2.606 901 HG11 VAL 116 1HG1 VAL 116 -17.730 -0.473 -2.039 902 HG12 VAL 116 2HG1 VAL 116 -17.126 -1.694 -0.919 903 HG13 VAL 116 3HG1 VAL 116 -18.699 -1.904 -1.688 904 HG21 VAL 116 3HG2 VAL 116 -17.886 -2.344 -4.952 905 HG22 VAL 116 1HG2 VAL 116 -19.068 -2.385 -3.643 906 HG23 VAL 116 2HG2 VAL 116 -18.106 -3.817 -4.008 907 H PHE 117 H PHE 117 -14.152 -2.148 -2.300 908 HA PHE 117 HA PHE 117 -13.991 0.130 -0.467 909 HB2 PHE 117 2HB PHE 117 -13.464 -2.316 0.009 910 HB3 PHE 117 1HB PHE 117 -12.004 -2.111 -0.958 911 HD1 PHE 117 1HD PHE 117 -13.833 -0.645 1.960 912 HD2 PHE 117 2HD PHE 117 -10.048 -1.256 0.023 913 HE1 PHE 117 1HE PHE 117 -12.671 0.326 3.924 914 HE2 PHE 117 2HE PHE 117 -8.886 -0.284 1.985 915 HZ PHE 117 HZ PHE 117 -10.197 0.506 3.937 916 H SER 118 H SER 118 -12.711 -0.699 -3.549 917 HA SER 118 HA SER 118 -10.460 1.171 -3.398 918 HB2 SER 118 2HB SER 118 -11.576 -0.701 -5.494 919 HB3 SER 118 1HB SER 118 -10.146 0.296 -5.751 920 HG SER 118 HG SER 118 -9.033 -0.954 -4.438 921 H ASP 119 H ASP 119 -13.613 0.726 -4.771 922 HA ASP 119 HA ASP 119 -13.601 3.142 -6.396 923 HB2 ASP 119 2HB ASP 119 -15.004 1.271 -7.018 924 HB3 ASP 119 1HB ASP 119 -15.730 1.225 -5.410 925 H THR 120 H THR 120 -14.491 2.199 -3.204 926 HA THR 120 HA THR 120 -15.982 4.527 -2.427 927 HB THR 120 HB THR 120 -14.552 2.229 -1.164 928 HG1 THR 120 1HG THR 120 -17.009 3.166 -0.296 929 HG21 THR 120 3HG2 THR 120 -15.436 4.684 0.372 930 HG22 THR 120 1HG2 THR 120 -13.788 4.073 0.228 931 HG23 THR 120 2HG2 THR 120 -15.000 3.140 1.105 932 H ILE 121 H ILE 121 -12.653 3.541 -2.154 933 HA ILE 121 HA ILE 121 -11.639 6.001 -1.033 934 HB ILE 121 HB ILE 121 -10.805 3.353 -1.794 935 HG12 ILE 121 2HG1 ILE 121 -9.473 5.529 -0.165 936 HG13 ILE 121 1HG1 ILE 121 -10.602 4.315 0.435 937 HG21 ILE 121 1HG2 ILE 121 -8.379 4.104 -2.364 938 HG22 ILE 121 2HG2 ILE 121 -9.142 5.600 -2.903 939 HG23 ILE 121 3HG2 ILE 121 -9.578 4.066 -3.655 940 HD11 ILE 121 3HD1 ILE 121 -7.734 4.057 -0.213 941 HD12 ILE 121 1HD1 ILE 121 -8.743 2.742 -0.816 942 HD13 ILE 121 2HD1 ILE 121 -8.723 3.121 0.906 943 H LYS 122 H LYS 122 -11.855 4.636 -4.316 944 HA LYS 122 HA LYS 122 -10.518 6.745 -5.704 945 HB2 LYS 122 2HB LYS 122 -12.075 4.326 -6.178 946 HB3 LYS 122 1HB LYS 122 -12.480 5.588 -7.346 947 HG2 LYS 122 2HG LYS 122 -10.544 5.233 -8.428 948 HG3 LYS 122 1HG LYS 122 -9.665 5.630 -6.952 949 HD2 LYS 122 2HD LYS 122 -10.803 2.975 -6.776 950 HD3 LYS 122 1HD LYS 122 -9.776 3.126 -8.201 951 HE2 LYS 122 2HE LYS 122 -8.251 4.430 -6.326 952 HE3 LYS 122 1HE LYS 122 -9.023 3.170 -5.342 953 HZ1 LYS 122 3HZ LYS 122 -6.891 2.747 -6.927 954 HZ2 LYS 122 1HZ LYS 122 -8.156 2.300 -7.961 955 HZ3 LYS 122 2HZ LYS 122 -7.986 1.538 -6.454 956 H SER 123 H SER 123 -13.827 6.205 -4.638 957 HA SER 123 HA SER 123 -14.869 8.584 -5.988 958 HB2 SER 123 2HB SER 123 -15.847 6.434 -4.156 959 HB3 SER 123 1HB SER 123 -16.817 7.892 -4.341 960 HG SER 123 HG SER 123 -17.265 6.131 -5.857 961 H PHE 124 H PHE 124 -13.316 7.794 -3.067 962 HA PHE 124 HA PHE 124 -14.346 10.034 -1.479 963 HB2 PHE 124 2HB PHE 124 -12.773 7.658 -1.167 964 HB3 PHE 124 1HB PHE 124 -11.851 9.021 -0.532 965 HD1 PHE 124 1HD PHE 124 -13.522 10.803 0.761 966 HD2 PHE 124 2HD PHE 124 -14.082 6.558 0.408 967 HE1 PHE 124 1HE PHE 124 -14.952 10.823 2.788 968 HE2 PHE 124 2HE PHE 124 -15.512 6.579 2.434 969 HZ PHE 124 HZ PHE 124 -15.947 8.710 3.623 970 H ALA 125 H ALA 125 -12.385 9.859 -4.109 971 HA ALA 125 HA ALA 125 -10.591 12.092 -3.236 972 HB1 ALA 125 1HB ALA 125 -9.963 9.722 -4.336 973 HB2 ALA 125 2HB ALA 125 -9.031 11.179 -4.678 974 HB3 ALA 125 3HB ALA 125 -10.258 10.630 -5.819 975 H SER 126 H SER 126 -10.631 14.043 -4.390 976 HA SER 126 HA SER 126 -12.570 14.253 -6.666 977 HB2 SER 126 2HB SER 126 -13.307 15.014 -4.277 978 HB3 SER 126 1HB SER 126 -12.229 16.378 -4.556 979 HG SER 126 HG SER 126 -13.880 17.174 -5.586 980 H SER 127 H SER 127 -12.003 17.234 -6.531 981 HA SER 127 HA SER 127 -9.163 17.246 -7.476 982 HB2 SER 127 2HB SER 127 -9.800 17.902 -9.576 983 HB3 SER 127 1HB SER 127 -11.325 17.138 -9.137 984 HG SER 127 HG SER 127 -11.605 19.288 -9.885 985 H GLY 128 H GLY 128 -12.004 19.183 -6.513 986 HA2 GLY 128 2HA GLY 128 -10.096 21.264 -5.513 987 HA3 GLY 128 1HA GLY 128 -11.670 21.671 -6.197 988 H LYS 129 H LYS 129 -11.069 22.547 -3.644 989 HA LYS 129 HA LYS 129 -12.359 20.642 -1.753 990 HB2 LYS 129 2HB LYS 129 -10.199 22.307 -1.576 991 HB3 LYS 129 1HB LYS 129 -11.460 23.325 -0.878 992 HG2 LYS 129 2HG LYS 129 -11.984 20.907 0.311 993 HG3 LYS 129 1HG LYS 129 -10.224 20.871 0.189 994 HD2 LYS 129 2HD LYS 129 -10.614 23.428 1.052 995 HD3 LYS 129 1HD LYS 129 -11.965 22.608 1.837 996 HE2 LYS 129 2HE LYS 129 -10.214 20.835 2.566 997 HE3 LYS 129 1HE LYS 129 -9.008 22.069 2.151 998 HZ1 LYS 129 3HZ LYS 129 -10.128 22.025 4.515 999 HZ2 LYS 129 1HZ LYS 129 -11.349 22.886 3.711 1000 HZ3 LYS 129 2HZ LYS 129 -9.763 23.494 3.743 1001 H GLU 130 H GLU 130 -14.417 21.019 -0.946 1002 HA GLU 130 HA GLU 130 -16.540 22.031 -0.713 1003 HB2 GLU 130 2HB GLU 130 -14.652 23.804 0.047 1004 HB3 GLU 130 1HB GLU 130 -15.354 24.701 -1.300 1005 HG2 GLU 130 2HG GLU 130 -17.499 23.569 0.210 1006 HG3 GLU 130 1HG GLU 130 -16.409 24.377 1.336 1007 H LYS 131 H LYS 131 -18.254 22.890 -2.053 1008 HA LYS 131 HA LYS 131 -19.327 23.107 -4.156 1009 HB2 LYS 131 2HB LYS 131 -17.304 25.098 -3.697 1010 HB3 LYS 131 1HB LYS 131 -17.379 24.750 -5.424 1011 HG2 LYS 131 2HG LYS 131 -19.207 26.060 -5.530 1012 HG3 LYS 131 1HG LYS 131 -20.057 24.838 -4.582 1013 HD2 LYS 131 2HD LYS 131 -20.225 26.308 -2.890 1014 HD3 LYS 131 1HD LYS 131 -18.466 26.325 -2.763 1015 HE2 LYS 131 2HE LYS 131 -18.427 28.449 -3.545 1016 HE3 LYS 131 1HE LYS 131 -19.246 27.923 -5.030 1017 HZ1 LYS 131 3HZ LYS 131 -20.711 29.423 -3.964 1018 HZ2 LYS 131 1HZ LYS 131 -20.490 28.693 -2.450 1019 HZ3 LYS 131 2HZ LYS 131 -21.339 27.872 -3.671 1020 H LEU 132 H LEU 132 -19.113 21.000 -5.058 1021 HA LEU 132 HA LEU 132 -17.128 20.782 -7.250 1022 HB2 LEU 132 2HB LEU 132 -16.569 18.446 -6.309 1023 HB3 LEU 132 1HB LEU 132 -15.895 19.829 -5.446 1024 HG LEU 132 HG LEU 132 -18.576 19.120 -4.512 1025 HD11 LEU 132 1HD1 LEU 132 -16.407 17.051 -4.624 1026 HD12 LEU 132 2HD1 LEU 132 -18.149 16.852 -4.811 1027 HD13 LEU 132 3HD1 LEU 132 -17.458 17.112 -3.209 1028 HD21 LEU 132 3HD2 LEU 132 -17.496 20.476 -3.007 1029 HD22 LEU 132 1HD2 LEU 132 -15.900 19.877 -3.459 1030 HD23 LEU 132 2HD2 LEU 132 -16.922 18.933 -2.376 1031 H GLU 133 H GLU 133 -17.647 18.821 -8.628 1032 HA GLU 133 HA GLU 133 -20.505 17.956 -8.342 1033 HB2 GLU 133 2HB GLU 133 -19.089 19.433 -10.490 1034 HB3 GLU 133 1HB GLU 133 -20.146 18.134 -11.041 1035 HG2 GLU 133 2HG GLU 133 -21.539 19.538 -8.996 1036 HG3 GLU 133 1HG GLU 133 -20.880 20.744 -10.101 Start of MODEL 10 1 H1 MET 1 1HT MET 1 3.104 -30.249 -0.933 2 H2 MET 1 2HT MET 1 3.988 -28.809 -0.768 3 H3 MET 1 3HT MET 1 4.797 -30.281 -1.023 4 HA MET 1 HA MET 1 4.457 -30.259 -3.244 5 HB2 MET 1 2HB MET 1 2.264 -29.553 -4.147 6 HB3 MET 1 1HB MET 1 2.054 -30.654 -2.784 7 HG2 MET 1 2HG MET 1 1.969 -28.477 -1.348 8 HG3 MET 1 1HG MET 1 1.633 -27.675 -2.882 9 HE1 MET 1 2HE MET 1 -0.533 -26.855 -2.856 10 HE2 MET 1 3HE MET 1 -1.936 -27.862 -3.206 11 HE3 MET 1 1HE MET 1 -0.521 -27.911 -4.266 12 H MET 2 H MET 2 6.176 -28.485 -2.358 13 HA MET 2 HA MET 2 7.152 -26.365 -2.736 14 HB2 MET 2 2HB MET 2 5.140 -26.600 -4.994 15 HB3 MET 2 1HB MET 2 6.412 -25.380 -4.935 16 HG2 MET 2 2HG MET 2 8.132 -27.092 -4.935 17 HG3 MET 2 1HG MET 2 6.918 -28.365 -4.809 18 HE1 MET 2 3HE MET 2 8.675 -28.727 -8.075 19 HE2 MET 2 1HE MET 2 7.294 -29.720 -7.586 20 HE3 MET 2 2HE MET 2 8.468 -29.184 -6.386 21 H GLU 3 H GLU 3 5.186 -26.307 -0.742 22 HA GLU 3 HA GLU 3 3.436 -23.975 -1.335 23 HB2 GLU 3 2HB GLU 3 2.518 -24.589 0.920 24 HB3 GLU 3 1HB GLU 3 2.442 -25.917 -0.242 25 HG2 GLU 3 2HG GLU 3 4.298 -27.018 0.736 26 HG3 GLU 3 1HG GLU 3 4.799 -25.566 1.610 27 H GLU 4 H GLU 4 6.476 -24.620 -0.064 28 HA GLU 4 HA GLU 4 6.516 -22.787 2.129 29 HB2 GLU 4 2HB GLU 4 8.135 -24.639 1.709 30 HB3 GLU 4 1HB GLU 4 8.763 -23.741 0.326 31 HG2 GLU 4 2HG GLU 4 10.126 -22.595 1.695 32 HG3 GLU 4 1HG GLU 4 8.719 -21.961 2.551 33 H TYR 5 H TYR 5 6.198 -22.229 -1.146 34 HA TYR 5 HA TYR 5 7.748 -19.754 -1.300 35 HB2 TYR 5 2HB TYR 5 5.745 -21.159 -3.085 36 HB3 TYR 5 1HB TYR 5 6.556 -19.662 -3.547 37 HD1 TYR 5 2HD TYR 5 9.255 -19.898 -2.661 38 HD2 TYR 5 1HD TYR 5 6.693 -22.971 -4.226 39 HE1 TYR 5 2HE TYR 5 11.246 -21.189 -3.378 40 HE2 TYR 5 1HE TYR 5 8.685 -24.263 -4.944 41 HH TYR 5 HH TYR 5 10.936 -24.441 -4.734 42 H LEU 6 H LEU 6 4.603 -20.720 -0.370 43 HA LEU 6 HA LEU 6 3.461 -17.996 -0.603 44 HB2 LEU 6 2HB LEU 6 1.400 -19.077 -0.191 45 HB3 LEU 6 1HB LEU 6 2.319 -20.302 -1.065 46 HG LEU 6 HG LEU 6 3.091 -21.005 1.365 47 HD11 LEU 6 1HD1 LEU 6 0.433 -20.443 2.349 48 HD12 LEU 6 2HD1 LEU 6 1.251 -18.938 1.932 49 HD13 LEU 6 3HD1 LEU 6 1.988 -20.052 3.082 50 HD21 LEU 6 3HD2 LEU 6 0.519 -22.095 1.329 51 HD22 LEU 6 1HD2 LEU 6 1.948 -22.772 0.549 52 HD23 LEU 6 2HD2 LEU 6 0.859 -21.728 -0.363 53 H GLY 7 H GLY 7 4.689 -20.241 1.832 54 HA2 GLY 7 2HA GLY 7 3.772 -18.738 4.127 55 HA3 GLY 7 1HA GLY 7 5.057 -19.949 4.141 56 H VAL 8 H VAL 8 6.715 -18.715 2.157 57 HA VAL 8 HA VAL 8 7.988 -16.665 3.825 58 HB VAL 8 HB VAL 8 8.616 -18.151 1.278 59 HG11 VAL 8 1HG1 VAL 8 10.789 -16.962 1.232 60 HG12 VAL 8 2HG1 VAL 8 10.240 -15.928 2.551 61 HG13 VAL 8 3HG1 VAL 8 9.439 -15.854 0.980 62 HG21 VAL 8 3HG2 VAL 8 8.987 -19.349 3.372 63 HG22 VAL 8 1HG2 VAL 8 9.900 -17.988 4.024 64 HG23 VAL 8 2HG2 VAL 8 10.549 -18.920 2.674 65 H PHE 9 H PHE 9 5.966 -16.844 1.062 66 HA PHE 9 HA PHE 9 6.550 -14.319 -0.171 67 HB2 PHE 9 2HB PHE 9 5.280 -15.785 -1.467 68 HB3 PHE 9 1HB PHE 9 4.303 -16.307 -0.098 69 HD1 PHE 9 1HD PHE 9 5.052 -12.808 -1.148 70 HD2 PHE 9 2HD PHE 9 2.097 -15.912 -0.871 71 HE1 PHE 9 1HE PHE 9 3.288 -11.184 -1.781 72 HE2 PHE 9 2HE PHE 9 0.334 -14.290 -1.504 73 HZ PHE 9 HZ PHE 9 0.928 -11.926 -1.959 74 H VAL 10 H VAL 10 4.383 -15.287 2.471 75 HA VAL 10 HA VAL 10 3.220 -12.620 2.783 76 HB VAL 10 HB VAL 10 3.248 -14.948 4.721 77 HG11 VAL 10 1HG1 VAL 10 0.747 -13.575 4.459 78 HG12 VAL 10 2HG1 VAL 10 2.021 -12.382 4.705 79 HG13 VAL 10 3HG1 VAL 10 1.794 -13.684 5.873 80 HG21 VAL 10 3HG2 VAL 10 2.335 -14.961 2.035 81 HG22 VAL 10 1HG2 VAL 10 0.899 -14.856 3.055 82 HG23 VAL 10 2HG2 VAL 10 2.041 -16.182 3.273 83 H ASP 11 H ASP 11 5.699 -14.574 4.455 84 HA ASP 11 HA ASP 11 6.241 -12.851 6.625 85 HB2 ASP 11 2HB ASP 11 7.127 -15.218 5.916 86 HB3 ASP 11 1HB ASP 11 8.396 -14.297 5.109 87 H GLU 12 H GLU 12 7.009 -12.593 3.288 88 HA GLU 12 HA GLU 12 8.941 -10.389 3.654 89 HB2 GLU 12 2HB GLU 12 7.671 -11.760 1.260 90 HB3 GLU 12 1HB GLU 12 8.889 -10.492 1.127 91 HG2 GLU 12 2HG GLU 12 9.578 -12.714 2.957 92 HG3 GLU 12 1HG GLU 12 9.488 -13.144 1.248 93 H THR 13 H THR 13 5.634 -10.911 2.460 94 HA THR 13 HA THR 13 5.081 -8.220 1.651 95 HB THR 13 HB THR 13 3.641 -10.745 2.285 96 HG1 THR 13 1HG THR 13 2.570 -9.699 0.270 97 HG21 THR 13 3HG2 THR 13 2.340 -8.033 2.480 98 HG22 THR 13 1HG2 THR 13 2.145 -9.430 3.540 99 HG23 THR 13 2HG2 THR 13 1.426 -9.438 1.930 100 H LYS 14 H LYS 14 4.982 -9.863 4.777 101 HA LYS 14 HA LYS 14 3.569 -7.749 6.188 102 HB2 LYS 14 2HB LYS 14 5.189 -10.196 6.880 103 HB3 LYS 14 1HB LYS 14 4.669 -9.090 8.152 104 HG2 LYS 14 2HG LYS 14 2.450 -9.628 7.905 105 HG3 LYS 14 1HG LYS 14 2.611 -9.944 6.175 106 HD2 LYS 14 2HD LYS 14 2.686 -12.140 6.654 107 HD3 LYS 14 1HD LYS 14 4.241 -11.856 7.434 108 HE2 LYS 14 2HE LYS 14 2.007 -11.059 9.148 109 HE3 LYS 14 1HE LYS 14 1.949 -12.781 8.719 110 HZ1 LYS 14 3HZ LYS 14 3.437 -12.801 10.458 111 HZ2 LYS 14 1HZ LYS 14 4.084 -11.280 10.079 112 HZ3 LYS 14 2HZ LYS 14 4.494 -12.635 9.137 113 H GLU 15 H GLU 15 6.997 -8.750 5.955 114 HA GLU 15 HA GLU 15 8.054 -6.688 7.607 115 HB2 GLU 15 2HB GLU 15 9.152 -8.290 5.285 116 HB3 GLU 15 1HB GLU 15 10.160 -7.228 6.271 117 HG2 GLU 15 2HG GLU 15 9.867 -8.534 8.203 118 HG3 GLU 15 1HG GLU 15 8.424 -9.321 7.565 119 H TYR 16 H TYR 16 6.695 -6.614 4.503 120 HA TYR 16 HA TYR 16 8.019 -4.115 3.686 121 HB2 TYR 16 2HB TYR 16 6.688 -6.342 2.461 122 HB3 TYR 16 1HB TYR 16 5.841 -4.867 1.995 123 HD1 TYR 16 2HD TYR 16 9.334 -6.191 2.373 124 HD2 TYR 16 1HD TYR 16 6.661 -3.620 0.202 125 HE1 TYR 16 2HE TYR 16 11.150 -5.653 0.773 126 HE2 TYR 16 1HE TYR 16 8.479 -3.083 -1.398 127 HH TYR 16 HH TYR 16 11.729 -4.514 -1.033 128 H LEU 17 H LEU 17 4.809 -5.267 4.733 129 HA LEU 17 HA LEU 17 3.376 -2.825 4.349 130 HB2 LEU 17 2HB LEU 17 3.138 -5.098 6.349 131 HB3 LEU 17 1HB LEU 17 1.920 -3.832 6.175 132 HG LEU 17 HG LEU 17 2.876 -5.459 3.828 133 HD11 LEU 17 1HD1 LEU 17 1.951 -7.199 5.044 134 HD12 LEU 17 2HD1 LEU 17 0.488 -6.557 4.298 135 HD13 LEU 17 3HD1 LEU 17 0.888 -6.130 5.962 136 HD21 LEU 17 3HD2 LEU 17 0.150 -4.598 3.716 137 HD22 LEU 17 1HD2 LEU 17 1.499 -4.071 2.709 138 HD23 LEU 17 2HD2 LEU 17 1.136 -3.223 4.213 139 H GLN 18 H GLN 18 5.367 -4.030 7.005 140 HA GLN 18 HA GLN 18 4.903 -1.799 8.774 141 HB2 GLN 18 2HB GLN 18 5.929 -3.307 10.087 142 HB3 GLN 18 1HB GLN 18 6.264 -4.289 8.670 143 HG2 GLN 18 2HG GLN 18 8.375 -3.202 8.312 144 HG3 GLN 18 1HG GLN 18 8.011 -1.970 9.522 145 HE21 GLN 18 1HE2 GLN 18 8.928 -5.374 9.096 146 HE22 GLN 18 2HE2 GLN 18 9.344 -5.645 10.719 147 H ASN 19 H ASN 19 7.415 -2.698 6.524 148 HA ASN 19 HA ASN 19 8.985 -0.308 6.726 149 HB2 ASN 19 2HB ASN 19 8.817 -2.747 5.175 150 HB3 ASN 19 1HB ASN 19 9.067 -1.378 4.087 151 HD21 ASN 19 1HD2 ASN 19 11.124 -0.341 4.107 152 HD22 ASN 19 2HD2 ASN 19 12.407 -0.839 5.100 153 H LEU 20 H LEU 20 6.031 -1.196 5.249 154 HA LEU 20 HA LEU 20 5.862 1.241 3.588 155 HB2 LEU 20 2HB LEU 20 5.099 -0.942 2.719 156 HB3 LEU 20 1HB LEU 20 3.970 -1.080 4.069 157 HG LEU 20 HG LEU 20 2.869 1.029 3.305 158 HD11 LEU 20 1HD1 LEU 20 3.965 2.332 1.833 159 HD12 LEU 20 2HD1 LEU 20 3.743 1.083 0.609 160 HD13 LEU 20 3HD1 LEU 20 5.197 1.090 1.606 161 HD21 LEU 20 3HD2 LEU 20 2.736 -1.571 2.175 162 HD22 LEU 20 1HD2 LEU 20 2.591 -0.433 0.836 163 HD23 LEU 20 2HD2 LEU 20 1.469 -0.345 2.195 164 H ASN 21 H ASN 21 5.157 0.241 6.744 165 HA ASN 21 HA ASN 21 2.934 2.154 7.083 166 HB2 ASN 21 2HB ASN 21 4.103 -0.156 8.500 167 HB3 ASN 21 1HB ASN 21 3.624 1.178 9.553 168 HD21 ASN 21 1HD2 ASN 21 1.306 2.006 9.190 169 HD22 ASN 21 2HD2 ASN 21 0.125 0.867 8.755 170 H ASP 22 H ASP 22 6.251 1.509 7.735 171 HA ASP 22 HA ASP 22 6.736 3.717 9.440 172 HB2 ASP 22 2HB ASP 22 8.142 1.541 8.414 173 HB3 ASP 22 1HB ASP 22 8.965 2.940 7.721 174 H THR 23 H THR 23 6.604 3.163 6.081 175 HA THR 23 HA THR 23 7.569 5.746 5.142 176 HB THR 23 HB THR 23 5.862 3.512 4.028 177 HG1 THR 23 1HG THR 23 7.749 2.616 3.915 178 HG21 THR 23 3HG2 THR 23 7.237 5.729 2.485 179 HG22 THR 23 1HG2 THR 23 5.516 5.719 2.872 180 HG23 THR 23 2HG2 THR 23 6.192 4.468 1.829 181 H LEU 24 H LEU 24 4.408 4.181 5.617 182 HA LEU 24 HA LEU 24 2.812 6.468 4.860 183 HB2 LEU 24 2HB LEU 24 2.460 3.803 6.189 184 HB3 LEU 24 1HB LEU 24 1.146 4.973 6.317 185 HG LEU 24 HG LEU 24 2.429 4.136 3.701 186 HD11 LEU 24 1HD1 LEU 24 0.471 2.769 3.325 187 HD12 LEU 24 2HD1 LEU 24 -0.274 3.339 4.819 188 HD13 LEU 24 3HD1 LEU 24 1.153 2.305 4.884 189 HD21 LEU 24 3HD2 LEU 24 1.032 5.629 2.684 190 HD22 LEU 24 1HD2 LEU 24 1.037 6.415 4.263 191 HD23 LEU 24 2HD2 LEU 24 -0.280 5.327 3.824 192 H LEU 25 H LEU 25 4.369 5.335 7.796 193 HA LEU 25 HA LEU 25 2.882 7.202 9.526 194 HB2 LEU 25 2HB LEU 25 5.285 5.399 9.889 195 HB3 LEU 25 1HB LEU 25 4.569 6.340 11.204 196 HG LEU 25 HG LEU 25 2.826 4.610 9.495 197 HD11 LEU 25 1HD1 LEU 25 4.319 3.649 11.954 198 HD12 LEU 25 2HD1 LEU 25 4.753 3.215 10.300 199 HD13 LEU 25 3HD1 LEU 25 3.200 2.711 10.965 200 HD21 LEU 25 3HD2 LEU 25 2.251 6.375 11.432 201 HD22 LEU 25 1HD2 LEU 25 2.540 4.958 12.444 202 HD23 LEU 25 2HD2 LEU 25 1.297 4.911 11.192 203 H GLU 26 H GLU 26 5.625 7.292 7.533 204 HA GLU 26 HA GLU 26 6.707 9.728 8.825 205 HB2 GLU 26 2HB GLU 26 7.606 7.905 6.569 206 HB3 GLU 26 1HB GLU 26 8.450 9.400 6.972 207 HG2 GLU 26 2HG GLU 26 9.148 8.600 9.060 208 HG3 GLU 26 1HG GLU 26 7.891 7.364 9.114 209 H LEU 27 H LEU 27 4.963 8.434 6.198 210 HA LEU 27 HA LEU 27 4.903 10.791 4.590 211 HB2 LEU 27 2HB LEU 27 4.590 8.631 3.582 212 HB3 LEU 27 1HB LEU 27 3.313 8.232 4.728 213 HG LEU 27 HG LEU 27 1.949 10.102 3.774 214 HD11 LEU 27 1HD1 LEU 27 2.671 11.364 1.967 215 HD12 LEU 27 2HD1 LEU 27 3.773 10.109 1.401 216 HD13 LEU 27 3HD1 LEU 27 4.208 11.103 2.792 217 HD21 LEU 27 3HD2 LEU 27 1.971 8.815 1.354 218 HD22 LEU 27 1HD2 LEU 27 1.151 8.205 2.791 219 HD23 LEU 27 2HD2 LEU 27 2.767 7.626 2.386 220 H GLU 28 H GLU 28 3.065 9.470 7.233 221 HA GLU 28 HA GLU 28 0.739 11.181 6.992 222 HB2 GLU 28 2HB GLU 28 2.049 9.471 9.110 223 HB3 GLU 28 1HB GLU 28 0.646 10.463 9.512 224 HG2 GLU 28 2HG GLU 28 0.249 9.010 7.024 225 HG3 GLU 28 1HG GLU 28 0.592 7.916 8.366 226 H LYS 29 H LYS 29 3.843 11.324 8.732 227 HA LYS 29 HA LYS 29 3.247 13.861 10.035 228 HB2 LYS 29 2HB LYS 29 5.233 13.416 11.088 229 HB3 LYS 29 1HB LYS 29 5.023 11.828 10.361 230 HG2 LYS 29 2HG LYS 29 6.237 12.995 8.299 231 HG3 LYS 29 1HG LYS 29 6.875 14.034 9.575 232 HD2 LYS 29 2HD LYS 29 8.042 12.320 10.578 233 HD3 LYS 29 1HD LYS 29 6.891 11.094 10.049 234 HE2 LYS 29 2HE LYS 29 8.563 10.584 8.546 235 HE3 LYS 29 1HE LYS 29 7.862 11.940 7.639 236 HZ1 LYS 29 3HZ LYS 29 10.145 12.441 7.909 237 HZ2 LYS 29 1HZ LYS 29 10.127 12.019 9.552 238 HZ3 LYS 29 2HZ LYS 29 9.317 13.417 9.027 239 H ASN 30 H ASN 30 4.368 12.786 7.030 240 HA ASN 30 HA ASN 30 4.573 15.570 6.019 241 HB2 ASN 30 2HB ASN 30 6.791 13.984 6.577 242 HB3 ASN 30 1HB ASN 30 6.519 13.678 4.862 243 HD21 ASN 30 1HD2 ASN 30 5.972 15.917 3.626 244 HD22 ASN 30 2HD2 ASN 30 7.027 17.194 3.997 245 HA PRO 31 HA PRO 31 2.052 12.792 3.517 246 HB2 PRO 31 2HB PRO 31 -0.296 14.075 3.954 247 HB3 PRO 31 1HB PRO 31 0.395 12.894 5.076 248 HG2 PRO 31 2HG PRO 31 0.183 15.798 5.345 249 HG3 PRO 31 1HG PRO 31 0.318 14.544 6.586 250 HD2 PRO 31 2HD PRO 31 2.378 16.216 5.552 251 HD3 PRO 31 1HD PRO 31 2.517 14.924 6.765 252 H GLU 32 H GLU 32 3.668 15.213 2.756 253 HA GLU 32 HA GLU 32 2.044 15.994 0.384 254 HB2 GLU 32 2HB GLU 32 3.354 18.324 0.989 255 HB3 GLU 32 1HB GLU 32 1.697 17.982 1.477 256 HG2 GLU 32 2HG GLU 32 2.455 17.156 3.639 257 HG3 GLU 32 1HG GLU 32 4.141 17.345 3.154 258 H ASP 33 H ASP 33 4.663 14.482 1.447 259 HA ASP 33 HA ASP 33 6.613 15.707 -0.410 260 HB2 ASP 33 2HB ASP 33 6.696 14.532 2.147 261 HB3 ASP 33 1HB ASP 33 7.493 13.378 1.076 262 H MET 34 H MET 34 6.914 14.747 -2.413 263 HA MET 34 HA MET 34 5.400 12.385 -3.124 264 HB2 MET 34 2HB MET 34 5.837 13.131 -5.228 265 HB3 MET 34 1HB MET 34 6.441 14.567 -4.410 266 HG2 MET 34 2HG MET 34 8.721 13.647 -4.440 267 HG3 MET 34 1HG MET 34 8.129 12.175 -5.211 268 HE1 MET 34 3HE MET 34 6.553 13.587 -8.489 269 HE2 MET 34 1HE MET 34 5.741 14.060 -6.990 270 HE3 MET 34 2HE MET 34 6.390 12.433 -7.168 271 H GLU 35 H GLU 35 8.117 12.586 -1.287 272 HA GLU 35 HA GLU 35 9.688 10.436 -2.506 273 HB2 GLU 35 2HB GLU 35 9.822 12.340 -0.274 274 HB3 GLU 35 1HB GLU 35 10.447 10.748 0.156 275 HG2 GLU 35 2HG GLU 35 11.865 10.806 -1.909 276 HG3 GLU 35 1HG GLU 35 11.325 12.463 -2.182 277 H LEU 36 H LEU 36 7.885 10.737 0.596 278 HA LEU 36 HA LEU 36 7.861 7.898 1.067 279 HB2 LEU 36 2HB LEU 36 5.852 9.970 2.010 280 HB3 LEU 36 1HB LEU 36 6.280 8.465 2.816 281 HG LEU 36 HG LEU 36 7.853 11.015 2.614 282 HD11 LEU 36 1HD1 LEU 36 6.799 10.905 4.675 283 HD12 LEU 36 2HD1 LEU 36 8.320 10.095 5.055 284 HD13 LEU 36 3HD1 LEU 36 6.871 9.143 4.732 285 HD21 LEU 36 3HD2 LEU 36 9.853 9.734 3.423 286 HD22 LEU 36 1HD2 LEU 36 9.406 9.331 1.765 287 HD23 LEU 36 2HD2 LEU 36 8.985 8.237 3.083 288 H ILE 37 H ILE 37 5.959 10.072 -0.860 289 HA ILE 37 HA ILE 37 3.680 8.304 -1.242 290 HB ILE 37 HB ILE 37 4.819 10.784 -2.532 291 HG12 ILE 37 2HG1 ILE 37 2.245 10.258 -1.019 292 HG13 ILE 37 1HG1 ILE 37 3.706 10.945 -0.310 293 HG21 ILE 37 1HG2 ILE 37 2.938 10.903 -4.015 294 HG22 ILE 37 2HG2 ILE 37 2.187 9.492 -3.270 295 HG23 ILE 37 3HG2 ILE 37 3.655 9.306 -4.229 296 HD11 ILE 37 3HD1 ILE 37 2.248 12.159 -2.672 297 HD12 ILE 37 1HD1 ILE 37 3.585 12.873 -1.770 298 HD13 ILE 37 2HD1 ILE 37 2.011 12.672 -1.002 299 H ASN 38 H ASN 38 6.837 8.795 -2.729 300 HA ASN 38 HA ASN 38 6.148 7.071 -5.021 301 HB2 ASN 38 2HB ASN 38 7.552 9.149 -5.196 302 HB3 ASN 38 1HB ASN 38 8.772 8.345 -4.207 303 HD21 ASN 38 1HD2 ASN 38 9.925 6.500 -5.163 304 HD22 ASN 38 2HD2 ASN 38 9.905 6.232 -6.839 305 H GLU 39 H GLU 39 8.007 6.963 -2.064 306 HA GLU 39 HA GLU 39 9.197 4.369 -2.618 307 HB2 GLU 39 2HB GLU 39 10.219 4.679 -0.544 308 HB3 GLU 39 1HB GLU 39 9.814 6.346 -0.940 309 HG2 GLU 39 2HG GLU 39 8.831 6.331 1.114 310 HG3 GLU 39 1HG GLU 39 7.503 5.539 0.264 311 H ALA 40 H ALA 40 6.181 5.519 -1.597 312 HA ALA 40 HA ALA 40 5.299 2.968 -0.384 313 HB1 ALA 40 1HB ALA 40 3.250 4.271 0.031 314 HB2 ALA 40 2HB ALA 40 3.852 5.571 -0.999 315 HB3 ALA 40 3HB ALA 40 4.660 5.207 0.525 316 H PHE 41 H PHE 41 4.289 5.120 -3.096 317 HA PHE 41 HA PHE 41 2.436 3.488 -4.379 318 HB2 PHE 41 2HB PHE 41 2.845 5.624 -5.279 319 HB3 PHE 41 1HB PHE 41 4.591 5.385 -5.296 320 HD1 PHE 41 2HD PHE 41 1.406 4.513 -6.984 321 HD2 PHE 41 1HD PHE 41 5.693 4.283 -7.128 322 HE1 PHE 41 2HE PHE 41 1.287 3.750 -9.342 323 HE2 PHE 41 1HE PHE 41 5.575 3.522 -9.484 324 HZ PHE 41 HZ PHE 41 3.372 3.253 -10.591 325 H ARG 42 H ARG 42 5.997 3.260 -4.523 326 HA ARG 42 HA ARG 42 6.042 1.075 -6.429 327 HB2 ARG 42 2HB ARG 42 8.378 1.146 -6.040 328 HB3 ARG 42 1HB ARG 42 7.852 2.802 -5.751 329 HG2 ARG 42 2HG ARG 42 7.785 2.376 -3.332 330 HG3 ARG 42 1HG ARG 42 8.282 0.704 -3.606 331 HD2 ARG 42 2HD ARG 42 9.966 2.959 -4.685 332 HD3 ARG 42 1HD ARG 42 10.133 2.445 -2.994 333 HE ARG 42 HE ARG 42 10.086 0.147 -4.727 334 HH11 ARG 42 1HH1 ARG 42 12.003 2.478 -3.117 335 HH12 ARG 42 2HH1 ARG 42 13.513 1.804 -3.631 336 HH21 ARG 42 1HH2 ARG 42 12.051 -0.603 -5.656 337 HH22 ARG 42 2HH2 ARG 42 13.540 0.058 -5.069 338 H ALA 43 H ALA 43 6.347 1.254 -2.871 339 HA ALA 43 HA ALA 43 6.752 -1.488 -2.306 340 HB1 ALA 43 1HB ALA 43 5.013 -0.468 -0.348 341 HB2 ALA 43 2HB ALA 43 5.856 0.946 -0.980 342 HB3 ALA 43 3HB ALA 43 6.775 -0.403 -0.313 343 H LEU 44 H LEU 44 3.638 0.264 -2.572 344 HA LEU 44 HA LEU 44 2.009 -2.095 -2.330 345 HB2 LEU 44 2HB LEU 44 1.481 0.566 -3.696 346 HB3 LEU 44 1HB LEU 44 0.252 -0.568 -3.131 347 HG LEU 44 HG LEU 44 2.319 0.458 -1.209 348 HD11 LEU 44 1HD1 LEU 44 0.106 1.986 -2.475 349 HD12 LEU 44 2HD1 LEU 44 1.606 2.568 -1.751 350 HD13 LEU 44 3HD1 LEU 44 0.245 2.123 -0.721 351 HD21 LEU 44 3HD2 LEU 44 -0.514 -0.592 -1.072 352 HD22 LEU 44 1HD2 LEU 44 0.249 0.214 0.299 353 HD23 LEU 44 2HD2 LEU 44 0.936 -1.280 -0.342 354 H HIS 45 H HIS 45 3.541 -0.432 -5.042 355 HA HIS 45 HA HIS 45 2.231 -1.908 -7.154 356 HB2 HIS 45 2HB HIS 45 3.524 0.303 -7.232 357 HB3 HIS 45 1HB HIS 45 4.997 -0.663 -7.140 358 HD1 HIS 45 1HD HIS 45 2.756 0.763 -9.555 359 HD2 HIS 45 2HD HIS 45 4.965 -2.767 -9.354 360 HE1 HIS 45 1HE HIS 45 2.918 -0.116 -11.925 361 H THR 46 H THR 46 5.117 -2.385 -5.173 362 HA THR 46 HA THR 46 6.008 -4.755 -6.645 363 HB THR 46 HB THR 46 6.953 -2.907 -4.642 364 HG1 THR 46 1HG THR 46 8.950 -4.086 -5.234 365 HG21 THR 46 3HG2 THR 46 8.233 -4.593 -3.248 366 HG22 THR 46 1HG2 THR 46 7.151 -5.833 -3.884 367 HG23 THR 46 2HG2 THR 46 6.504 -4.513 -2.909 368 H LEU 47 H LEU 47 4.187 -4.000 -3.713 369 HA LEU 47 HA LEU 47 3.937 -6.727 -2.770 370 HB2 LEU 47 2HB LEU 47 3.106 -3.995 -2.121 371 HB3 LEU 47 1HB LEU 47 1.838 -5.174 -1.767 372 HG LEU 47 HG LEU 47 4.715 -5.486 -0.876 373 HD11 LEU 47 1HD1 LEU 47 3.934 -4.768 1.345 374 HD12 LEU 47 2HD1 LEU 47 2.321 -4.478 0.694 375 HD13 LEU 47 3HD1 LEU 47 3.679 -3.487 0.160 376 HD21 LEU 47 3HD2 LEU 47 3.769 -7.611 -0.766 377 HD22 LEU 47 1HD2 LEU 47 2.146 -6.984 -0.477 378 HD23 LEU 47 2HD2 LEU 47 3.337 -6.982 0.824 379 H LYS 48 H LYS 48 1.864 -4.505 -4.657 380 HA LYS 48 HA LYS 48 -0.386 -6.242 -4.950 381 HB2 LYS 48 2HB LYS 48 -0.666 -3.960 -5.451 382 HB3 LYS 48 1HB LYS 48 0.817 -3.893 -6.401 383 HG2 LYS 48 2HG LYS 48 -0.328 -5.463 -8.059 384 HG3 LYS 48 1HG LYS 48 -1.825 -5.144 -7.178 385 HD2 LYS 48 2HD LYS 48 -1.966 -3.437 -8.708 386 HD3 LYS 48 1HD LYS 48 -0.988 -2.617 -7.489 387 HE2 LYS 48 2HE LYS 48 0.225 -2.243 -9.485 388 HE3 LYS 48 1HE LYS 48 1.041 -3.659 -8.792 389 HZ1 LYS 48 3HZ LYS 48 0.036 -3.651 -11.248 390 HZ2 LYS 48 1HZ LYS 48 -1.333 -4.177 -10.395 391 HZ3 LYS 48 2HZ LYS 48 0.119 -5.053 -10.293 392 H GLY 49 H GLY 49 2.717 -6.047 -6.591 393 HA2 GLY 49 2HA GLY 49 1.911 -7.783 -8.805 394 HA3 GLY 49 1HA GLY 49 3.554 -7.237 -8.462 395 H MET 50 H MET 50 3.767 -8.120 -5.788 396 HA MET 50 HA MET 50 4.681 -10.766 -6.042 397 HB2 MET 50 2HB MET 50 3.946 -8.868 -3.889 398 HB3 MET 50 1HB MET 50 3.993 -10.564 -3.404 399 HG2 MET 50 2HG MET 50 6.276 -10.481 -4.818 400 HG3 MET 50 1HG MET 50 6.208 -8.791 -4.319 401 HE1 MET 50 3HE MET 50 4.406 -9.616 -1.371 402 HE2 MET 50 1HE MET 50 5.259 -8.219 -2.042 403 HE3 MET 50 2HE MET 50 5.807 -8.951 -0.535 404 H ALA 51 H ALA 51 1.428 -9.567 -5.430 405 HA ALA 51 HA ALA 51 0.401 -12.266 -4.780 406 HB1 ALA 51 1HB ALA 51 -1.662 -10.361 -5.206 407 HB2 ALA 51 2HB ALA 51 -0.332 -9.503 -4.426 408 HB3 ALA 51 3HB ALA 51 -1.033 -10.928 -3.659 409 H GLY 52 H GLY 52 0.643 -10.071 -7.491 410 HA2 GLY 52 2HA GLY 52 -1.412 -11.250 -9.133 411 HA3 GLY 52 1HA GLY 52 -0.062 -10.273 -9.724 412 H THR 53 H THR 53 1.935 -11.983 -8.445 413 HA THR 53 HA THR 53 2.112 -14.053 -10.527 414 HB THR 53 HB THR 53 3.831 -12.546 -8.674 415 HG1 THR 53 1HG THR 53 5.287 -13.256 -10.540 416 HG21 THR 53 3HG2 THR 53 4.328 -15.483 -9.162 417 HG22 THR 53 1HG2 THR 53 4.363 -14.605 -7.632 418 HG23 THR 53 2HG2 THR 53 5.644 -14.359 -8.820 419 H MET 54 H MET 54 1.146 -13.735 -7.283 420 HA MET 54 HA MET 54 1.544 -16.588 -6.600 421 HB2 MET 54 2HB MET 54 1.869 -14.496 -5.097 422 HB3 MET 54 1HB MET 54 0.108 -14.478 -4.988 423 HG2 MET 54 2HG MET 54 0.884 -15.751 -3.112 424 HG3 MET 54 1HG MET 54 0.247 -16.917 -4.271 425 HE1 MET 54 3HE MET 54 3.972 -15.190 -4.937 426 HE2 MET 54 1HE MET 54 4.522 -15.761 -3.355 427 HE3 MET 54 2HE MET 54 3.082 -14.756 -3.480 428 H GLY 55 H GLY 55 -0.619 -15.016 -8.457 429 HA2 GLY 55 2HA GLY 55 -2.720 -15.694 -9.273 430 HA3 GLY 55 1HA GLY 55 -2.627 -17.090 -8.200 431 H PHE 56 H PHE 56 -2.049 -14.391 -6.335 432 HA PHE 56 HA PHE 56 -4.908 -14.343 -5.445 433 HB2 PHE 56 2HB PHE 56 -2.215 -14.084 -4.170 434 HB3 PHE 56 1HB PHE 56 -3.558 -13.215 -3.428 435 HD1 PHE 56 2HD PHE 56 -5.860 -14.868 -3.712 436 HD2 PHE 56 1HD PHE 56 -1.794 -16.066 -3.015 437 HE1 PHE 56 2HE PHE 56 -6.658 -16.976 -2.676 438 HE2 PHE 56 1HE PHE 56 -2.593 -18.172 -1.979 439 HZ PHE 56 HZ PHE 56 -5.025 -18.627 -1.808 440 H SER 57 H SER 57 -4.692 -12.785 -7.622 441 HA SER 57 HA SER 57 -3.648 -10.154 -7.246 442 HB2 SER 57 2HB SER 57 -6.066 -10.549 -8.909 443 HB3 SER 57 1HB SER 57 -4.524 -9.816 -9.333 444 HG SER 57 HG SER 57 -3.643 -11.853 -9.545 445 H SER 58 H SER 58 -6.308 -11.694 -5.839 446 HA SER 58 HA SER 58 -8.098 -9.450 -5.506 447 HB2 SER 58 2HB SER 58 -7.622 -11.903 -3.779 448 HB3 SER 58 1HB SER 58 -9.070 -10.899 -3.768 449 HG SER 58 HG SER 58 -8.164 -12.019 -6.180 450 H MET 59 H MET 59 -5.426 -10.830 -3.651 451 HA MET 59 HA MET 59 -5.594 -8.874 -1.498 452 HB2 MET 59 2HB MET 59 -4.726 -11.227 -1.309 453 HB3 MET 59 1HB MET 59 -3.378 -10.777 -2.352 454 HG2 MET 59 2HG MET 59 -3.575 -8.835 -0.255 455 HG3 MET 59 1HG MET 59 -3.599 -10.440 0.472 456 HE1 MET 59 3HE MET 59 -0.464 -9.108 -2.614 457 HE2 MET 59 1HE MET 59 -1.784 -8.077 -2.049 458 HE3 MET 59 2HE MET 59 -2.135 -9.546 -2.955 459 H ALA 60 H ALA 60 -4.028 -9.178 -4.608 460 HA ALA 60 HA ALA 60 -2.160 -6.955 -4.093 461 HB1 ALA 60 1HB ALA 60 -2.166 -7.521 -6.801 462 HB2 ALA 60 2HB ALA 60 -2.677 -9.054 -6.095 463 HB3 ALA 60 3HB ALA 60 -1.146 -8.328 -5.610 464 H LYS 61 H LYS 61 -5.299 -7.532 -5.557 465 HA LYS 61 HA LYS 61 -5.468 -5.066 -7.053 466 HB2 LYS 61 2HB LYS 61 -6.904 -7.010 -7.452 467 HB3 LYS 61 1HB LYS 61 -7.498 -6.946 -5.794 468 HG2 LYS 61 2HG LYS 61 -8.147 -4.463 -6.512 469 HG3 LYS 61 1HG LYS 61 -8.167 -5.200 -8.115 470 HD2 LYS 61 2HD LYS 61 -9.585 -6.438 -5.754 471 HD3 LYS 61 1HD LYS 61 -10.379 -5.284 -6.830 472 HE2 LYS 61 2HE LYS 61 -9.803 -6.770 -8.768 473 HE3 LYS 61 1HE LYS 61 -9.161 -7.956 -7.612 474 HZ1 LYS 61 3HZ LYS 61 -11.352 -8.605 -7.749 475 HZ2 LYS 61 1HZ LYS 61 -11.930 -7.026 -7.972 476 HZ3 LYS 61 2HZ LYS 61 -11.422 -7.534 -6.432 477 H LEU 62 H LEU 62 -5.767 -6.010 -3.744 478 HA LEU 62 HA LEU 62 -7.119 -3.588 -2.823 479 HB2 LEU 62 2HB LEU 62 -7.351 -5.732 -1.665 480 HB3 LEU 62 1HB LEU 62 -5.597 -5.869 -1.512 481 HG LEU 62 HG LEU 62 -5.481 -4.121 0.066 482 HD11 LEU 62 1HD1 LEU 62 -8.333 -3.425 -0.706 483 HD12 LEU 62 2HD1 LEU 62 -6.892 -2.504 -1.137 484 HD13 LEU 62 3HD1 LEU 62 -7.395 -2.615 0.549 485 HD21 LEU 62 3HD2 LEU 62 -6.913 -6.323 0.635 486 HD22 LEU 62 1HD2 LEU 62 -8.161 -5.112 0.909 487 HD23 LEU 62 2HD2 LEU 62 -6.657 -5.044 1.822 488 H CYS 63 H CYS 63 -3.859 -4.893 -3.156 489 HA CYS 63 HA CYS 63 -2.480 -2.755 -1.759 490 HB2 CYS 63 2HB CYS 63 -1.800 -5.007 -3.644 491 HB3 CYS 63 1HB CYS 63 -0.570 -3.811 -3.238 492 HG CYS 63 HG CYS 63 -1.912 -5.733 -1.178 493 H HIS 64 H HIS 64 -3.497 -3.358 -5.104 494 HA HIS 64 HA HIS 64 -2.041 -1.167 -6.305 495 HB2 HIS 64 2HB HIS 64 -3.222 -3.243 -7.341 496 HB3 HIS 64 1HB HIS 64 -4.701 -2.294 -7.208 497 HD1 HIS 64 1HD HIS 64 -4.548 -2.481 -9.946 498 HD2 HIS 64 2HD HIS 64 -1.748 -0.022 -8.076 499 HE1 HIS 64 1HE HIS 64 -3.610 -0.966 -11.745 500 H THR 65 H THR 65 -5.115 -1.570 -4.683 501 HA THR 65 HA THR 65 -6.426 0.858 -5.304 502 HB THR 65 HB THR 65 -6.617 -0.044 -2.515 503 HG1 THR 65 1HG THR 65 -7.216 -1.940 -4.515 504 HG21 THR 65 3HG2 THR 65 -8.260 1.142 -4.255 505 HG22 THR 65 1HG2 THR 65 -8.862 0.132 -2.941 506 HG23 THR 65 2HG2 THR 65 -8.710 -0.535 -4.567 507 H LEU 66 H LEU 66 -4.549 0.185 -2.331 508 HA LEU 66 HA LEU 66 -4.326 2.823 -1.363 509 HB2 LEU 66 2HB LEU 66 -2.570 0.356 -1.286 510 HB3 LEU 66 1HB LEU 66 -2.116 1.824 -0.424 511 HG LEU 66 HG LEU 66 -4.489 1.711 0.595 512 HD11 LEU 66 1HD1 LEU 66 -4.198 -1.006 -0.655 513 HD12 LEU 66 2HD1 LEU 66 -5.583 0.086 -0.702 514 HD13 LEU 66 3HD1 LEU 66 -5.183 -0.769 0.789 515 HD21 LEU 66 3HD2 LEU 66 -2.804 -0.602 1.467 516 HD22 LEU 66 1HD2 LEU 66 -3.579 0.642 2.444 517 HD23 LEU 66 2HD2 LEU 66 -2.113 1.019 1.543 518 H GLU 67 H GLU 67 -2.329 1.009 -3.646 519 HA GLU 67 HA GLU 67 -0.290 2.961 -4.083 520 HB2 GLU 67 2HB GLU 67 -0.277 0.516 -4.634 521 HB3 GLU 67 1HB GLU 67 -1.428 0.837 -5.926 522 HG2 GLU 67 2HG GLU 67 0.779 2.670 -6.156 523 HG3 GLU 67 1HG GLU 67 1.402 1.023 -6.050 524 H ASN 68 H ASN 68 -3.534 2.629 -5.332 525 HA ASN 68 HA ASN 68 -3.202 4.299 -7.659 526 HB2 ASN 68 2HB ASN 68 -5.228 2.878 -6.184 527 HB3 ASN 68 1HB ASN 68 -5.815 4.477 -6.630 528 HD21 ASN 68 1HD2 ASN 68 -5.777 1.367 -7.769 529 HD22 ASN 68 2HD2 ASN 68 -5.805 1.669 -9.440 530 H ILE 69 H ILE 69 -4.165 4.867 -4.290 531 HA ILE 69 HA ILE 69 -4.748 7.673 -4.680 532 HB ILE 69 HB ILE 69 -4.169 5.871 -2.322 533 HG12 ILE 69 2HG1 ILE 69 -6.584 6.351 -1.875 534 HG13 ILE 69 1HG1 ILE 69 -6.635 7.261 -3.385 535 HG21 ILE 69 1HG2 ILE 69 -3.909 7.646 -0.961 536 HG22 ILE 69 2HG2 ILE 69 -5.402 8.365 -1.563 537 HG23 ILE 69 3HG2 ILE 69 -3.874 8.691 -2.381 538 HD11 ILE 69 3HD1 ILE 69 -5.708 4.398 -3.265 539 HD12 ILE 69 1HD1 ILE 69 -6.190 5.326 -4.686 540 HD13 ILE 69 2HD1 ILE 69 -7.400 4.826 -3.504 541 H LEU 70 H LEU 70 -2.111 5.742 -3.684 542 HA LEU 70 HA LEU 70 -0.256 7.880 -3.095 543 HB2 LEU 70 2HB LEU 70 0.174 4.979 -3.883 544 HB3 LEU 70 1HB LEU 70 1.410 6.023 -3.192 545 HG LEU 70 HG LEU 70 -0.727 4.538 -1.854 546 HD11 LEU 70 1HD1 LEU 70 1.907 4.780 -1.549 547 HD12 LEU 70 2HD1 LEU 70 0.850 4.388 -0.193 548 HD13 LEU 70 3HD1 LEU 70 1.407 6.045 -0.425 549 HD21 LEU 70 3HD2 LEU 70 -1.049 6.360 -0.094 550 HD22 LEU 70 1HD2 LEU 70 -1.903 6.620 -1.615 551 HD23 LEU 70 2HD2 LEU 70 -0.410 7.497 -1.280 552 H ASP 71 H ASP 71 -1.563 6.530 -5.931 553 HA ASP 71 HA ASP 71 0.698 7.339 -7.637 554 HB2 ASP 71 2HB ASP 71 -1.005 5.380 -7.938 555 HB3 ASP 71 1HB ASP 71 -2.101 6.628 -8.530 556 H LYS 72 H LYS 72 -2.694 8.410 -7.062 557 HA LYS 72 HA LYS 72 -2.402 10.772 -8.695 558 HB2 LYS 72 2HB LYS 72 -4.461 11.429 -7.254 559 HB3 LYS 72 1HB LYS 72 -4.603 10.008 -8.288 560 HG2 LYS 72 2HG LYS 72 -4.361 8.523 -6.478 561 HG3 LYS 72 1HG LYS 72 -3.669 9.769 -5.440 562 HD2 LYS 72 2HD LYS 72 -6.031 10.879 -6.063 563 HD3 LYS 72 1HD LYS 72 -6.456 9.164 -6.076 564 HE2 LYS 72 2HE LYS 72 -4.976 9.216 -3.809 565 HE3 LYS 72 1HE LYS 72 -5.613 10.876 -3.793 566 HZ1 LYS 72 3HZ LYS 72 -7.793 10.147 -3.836 567 HZ2 LYS 72 1HZ LYS 72 -7.068 9.000 -2.818 568 HZ3 LYS 72 2HZ LYS 72 -7.386 8.611 -4.441 569 H ALA 73 H ALA 73 -1.539 9.879 -5.496 570 HA ALA 73 HA ALA 73 -1.179 12.485 -4.329 571 HB1 ALA 73 1HB ALA 73 -1.277 10.161 -3.249 572 HB2 ALA 73 2HB ALA 73 0.004 11.218 -2.656 573 HB3 ALA 73 3HB ALA 73 0.377 9.936 -3.816 574 H ARG 74 H ARG 74 0.905 10.275 -6.192 575 HA ARG 74 HA ARG 74 3.146 12.192 -6.116 576 HB2 ARG 74 2HB ARG 74 4.396 10.383 -6.946 577 HB3 ARG 74 1HB ARG 74 3.142 9.567 -6.019 578 HG2 ARG 74 2HG ARG 74 1.868 9.099 -8.016 579 HG3 ARG 74 1HG ARG 74 2.933 10.109 -8.994 580 HD2 ARG 74 2HD ARG 74 4.757 8.577 -8.778 581 HD3 ARG 74 1HD ARG 74 3.940 7.683 -7.481 582 HE ARG 74 HE ARG 74 2.326 6.863 -9.131 583 HH11 ARG 74 1HH2 ARG 74 4.329 9.227 -10.534 584 HH12 ARG 74 2HH2 ARG 74 4.439 8.443 -12.074 585 HH21 ARG 74 1HH1 ARG 74 2.735 5.602 -11.049 586 HH22 ARG 74 2HH1 ARG 74 3.531 6.394 -12.368 587 H ASN 75 H ASN 75 0.432 11.430 -8.090 588 HA ASN 75 HA ASN 75 1.552 12.476 -10.594 589 HB2 ASN 75 2HB ASN 75 -0.841 11.132 -9.590 590 HB3 ASN 75 1HB ASN 75 -1.231 12.394 -10.760 591 HD21 ASN 75 1HD2 ASN 75 0.352 12.322 -12.790 592 HD22 ASN 75 2HD2 ASN 75 0.662 10.773 -13.411 593 H SER 76 H SER 76 0.765 13.942 -7.771 594 HA SER 76 HA SER 76 0.514 16.235 -7.272 595 HB2 SER 76 2HB SER 76 1.344 16.117 -9.942 596 HB3 SER 76 1HB SER 76 -0.082 17.151 -9.972 597 HG SER 76 HG SER 76 0.892 18.361 -8.275 598 H GLU 77 H GLU 77 -1.795 14.190 -7.790 599 HA GLU 77 HA GLU 77 -3.937 16.169 -8.372 600 HB2 GLU 77 2HB GLU 77 -4.741 13.392 -7.897 601 HB3 GLU 77 1HB GLU 77 -5.070 14.416 -9.289 602 HG2 GLU 77 2HG GLU 77 -2.508 13.972 -9.808 603 HG3 GLU 77 1HG GLU 77 -2.785 12.551 -8.802 604 H ILE 78 H ILE 78 -2.549 14.165 -5.936 605 HA ILE 78 HA ILE 78 -4.246 15.485 -3.868 606 HB ILE 78 HB ILE 78 -4.951 13.262 -3.048 607 HG12 ILE 78 2HG1 ILE 78 -4.369 11.539 -5.089 608 HG13 ILE 78 1HG1 ILE 78 -2.905 12.495 -4.982 609 HG21 ILE 78 1HG2 ILE 78 -6.560 12.802 -4.735 610 HG22 ILE 78 2HG2 ILE 78 -5.484 13.359 -6.017 611 HG23 ILE 78 3HG2 ILE 78 -6.215 14.523 -4.910 612 HD11 ILE 78 3HD1 ILE 78 -4.055 11.638 -2.398 613 HD12 ILE 78 1HD1 ILE 78 -2.373 11.710 -2.912 614 HD13 ILE 78 2HD1 ILE 78 -3.386 10.350 -3.394 615 H LYS 79 H LYS 79 -3.657 13.733 -1.829 616 HA LYS 79 HA LYS 79 -0.885 12.995 -1.598 617 HB2 LYS 79 2HB LYS 79 -0.091 14.804 -0.270 618 HB3 LYS 79 1HB LYS 79 -0.967 15.579 -1.587 619 HG2 LYS 79 2HG LYS 79 -2.817 14.987 0.542 620 HG3 LYS 79 1HG LYS 79 -1.435 15.858 1.202 621 HD2 LYS 79 2HD LYS 79 -3.223 16.697 -1.082 622 HD3 LYS 79 1HD LYS 79 -3.021 17.499 0.475 623 HE2 LYS 79 2HE LYS 79 -0.438 17.449 -0.383 624 HE3 LYS 79 1HE LYS 79 -1.297 17.607 -1.927 625 HZ1 LYS 79 3HZ LYS 79 -0.813 19.704 -0.430 626 HZ2 LYS 79 1HZ LYS 79 -2.235 19.200 0.345 627 HZ3 LYS 79 2HZ LYS 79 -2.258 19.566 -1.313 628 H ILE 80 H ILE 80 -0.722 13.305 1.243 629 HA ILE 80 HA ILE 80 -2.809 11.349 2.006 630 HB ILE 80 HB ILE 80 -0.158 12.281 2.978 631 HG12 ILE 80 2HG1 ILE 80 0.358 9.961 2.778 632 HG13 ILE 80 1HG1 ILE 80 -1.349 9.532 2.693 633 HG21 ILE 80 1HG2 ILE 80 -0.540 10.773 5.003 634 HG22 ILE 80 2HG2 ILE 80 -2.259 10.864 4.626 635 HG23 ILE 80 3HG2 ILE 80 -1.375 12.323 5.052 636 HD11 ILE 80 3HD1 ILE 80 -0.281 9.455 0.453 637 HD12 ILE 80 1HD1 ILE 80 0.152 11.158 0.616 638 HD13 ILE 80 2HD1 ILE 80 -1.544 10.683 0.530 639 H THR 81 H THR 81 -4.550 12.586 2.216 640 HA THR 81 HA THR 81 -4.634 14.943 4.010 641 HB THR 81 HB THR 81 -6.858 15.154 3.103 642 HG1 THR 81 1HG THR 81 -7.976 13.483 2.424 643 HG21 THR 81 3HG2 THR 81 -4.989 15.578 1.502 644 HG22 THR 81 1HG2 THR 81 -6.470 15.049 0.700 645 HG23 THR 81 2HG2 THR 81 -5.142 13.912 0.942 646 H SER 82 H SER 82 -4.080 12.065 4.924 647 HA SER 82 HA SER 82 -4.652 10.798 6.842 648 HB2 SER 82 2HB SER 82 -5.218 13.235 7.600 649 HB3 SER 82 1HB SER 82 -6.891 12.771 7.303 650 HG SER 82 HG SER 82 -6.553 12.192 9.368 651 H ASP 83 H ASP 83 -7.595 12.195 5.340 652 HA ASP 83 HA ASP 83 -9.297 9.950 5.607 653 HB2 ASP 83 2HB ASP 83 -9.025 12.393 3.946 654 HB3 ASP 83 1HB ASP 83 -10.079 11.140 3.294 655 H LEU 84 H LEU 84 -7.000 10.836 2.978 656 HA LEU 84 HA LEU 84 -7.665 8.617 1.266 657 HB2 LEU 84 2HB LEU 84 -5.165 10.294 1.685 658 HB3 LEU 84 1HB LEU 84 -5.344 9.141 0.359 659 HG LEU 84 HG LEU 84 -7.051 11.579 0.903 660 HD11 LEU 84 1HD1 LEU 84 -4.768 10.999 -0.781 661 HD12 LEU 84 2HD1 LEU 84 -5.582 12.541 -0.509 662 HD13 LEU 84 3HD1 LEU 84 -6.161 11.445 -1.765 663 HD21 LEU 84 3HD2 LEU 84 -8.612 9.966 0.168 664 HD22 LEU 84 1HD2 LEU 84 -7.446 9.205 -0.914 665 HD23 LEU 84 2HD2 LEU 84 -8.130 10.778 -1.322 666 H LEU 85 H LEU 85 -5.531 9.096 3.988 667 HA LEU 85 HA LEU 85 -4.278 6.455 3.860 668 HB2 LEU 85 2HB LEU 85 -4.546 8.658 5.920 669 HB3 LEU 85 1HB LEU 85 -3.625 7.184 6.233 670 HG LEU 85 HG LEU 85 -3.108 9.310 4.164 671 HD11 LEU 85 1HD1 LEU 85 -1.683 8.157 6.554 672 HD12 LEU 85 2HD1 LEU 85 -2.004 9.849 6.171 673 HD13 LEU 85 3HD1 LEU 85 -0.765 8.960 5.281 674 HD21 LEU 85 3HD2 LEU 85 -2.637 7.483 2.822 675 HD22 LEU 85 1HD2 LEU 85 -2.332 6.422 4.196 676 HD23 LEU 85 2HD2 LEU 85 -1.108 7.589 3.694 677 H ASP 86 H ASP 86 -6.919 7.979 5.654 678 HA ASP 86 HA ASP 86 -7.587 5.982 7.496 679 HB2 ASP 86 2HB ASP 86 -8.623 8.247 7.190 680 HB3 ASP 86 1HB ASP 86 -9.488 7.619 5.785 681 H LYS 87 H LYS 87 -8.461 6.125 4.035 682 HA LYS 87 HA LYS 87 -9.895 3.555 4.220 683 HB2 LYS 87 2HB LYS 87 -9.093 5.180 1.786 684 HB3 LYS 87 1HB LYS 87 -10.407 4.009 1.904 685 HG2 LYS 87 2HG LYS 87 -10.232 6.656 3.372 686 HG3 LYS 87 1HG LYS 87 -11.325 6.268 2.043 687 HD2 LYS 87 2HD LYS 87 -11.281 4.767 4.673 688 HD3 LYS 87 1HD LYS 87 -12.388 6.093 4.321 689 HE2 LYS 87 2HE LYS 87 -13.610 4.848 2.790 690 HE3 LYS 87 1HE LYS 87 -12.220 3.832 2.355 691 HZ1 LYS 87 3HZ LYS 87 -14.002 2.838 3.893 692 HZ2 LYS 87 1HZ LYS 87 -13.311 3.811 5.097 693 HZ3 LYS 87 2HZ LYS 87 -12.370 2.632 4.317 694 H ILE 88 H ILE 88 -6.832 4.809 2.899 695 HA ILE 88 HA ILE 88 -5.968 2.331 1.713 696 HB ILE 88 HB ILE 88 -4.915 4.991 2.425 697 HG12 ILE 88 2HG1 ILE 88 -3.724 3.520 0.217 698 HG13 ILE 88 1HG1 ILE 88 -5.487 3.555 0.164 699 HG21 ILE 88 1HG2 ILE 88 -2.566 4.425 2.394 700 HG22 ILE 88 2HG2 ILE 88 -2.935 2.720 2.132 701 HG23 ILE 88 3HG2 ILE 88 -3.324 3.479 3.677 702 HD11 ILE 88 3HD1 ILE 88 -5.379 5.661 -0.621 703 HD12 ILE 88 1HD1 ILE 88 -3.626 5.673 -0.434 704 HD13 ILE 88 2HD1 ILE 88 -4.659 6.156 0.911 705 H PHE 89 H PHE 89 -5.319 3.864 4.860 706 HA PHE 89 HA PHE 89 -3.807 1.800 6.056 707 HB2 PHE 89 2HB PHE 89 -4.250 4.157 6.879 708 HB3 PHE 89 1HB PHE 89 -5.854 3.605 7.369 709 HD1 PHE 89 1HD PHE 89 -6.078 1.783 9.082 710 HD2 PHE 89 2HD PHE 89 -2.303 3.618 8.166 711 HE1 PHE 89 1HE PHE 89 -5.129 0.879 11.187 712 HE2 PHE 89 2HE PHE 89 -1.354 2.715 10.272 713 HZ PHE 89 HZ PHE 89 -2.767 1.345 11.782 714 H ALA 90 H ALA 90 -7.204 2.212 5.521 715 HA ALA 90 HA ALA 90 -8.063 -0.026 7.168 716 HB1 ALA 90 1HB ALA 90 -9.199 2.111 5.669 717 HB2 ALA 90 2HB ALA 90 -10.058 0.960 6.694 718 HB3 ALA 90 3HB ALA 90 -9.838 0.619 4.978 719 H GLY 91 H GLY 91 -7.090 0.572 3.858 720 HA2 GLY 91 2HA GLY 91 -7.775 -2.047 2.833 721 HA3 GLY 91 1HA GLY 91 -6.684 -0.886 2.065 722 H VAL 92 H VAL 92 -4.889 -0.497 4.182 723 HA VAL 92 HA VAL 92 -3.131 -2.770 3.910 724 HB VAL 92 HB VAL 92 -3.245 -0.178 5.418 725 HG11 VAL 92 1HG1 VAL 92 -0.777 -1.076 6.126 726 HG12 VAL 92 2HG1 VAL 92 -1.698 -2.576 6.227 727 HG13 VAL 92 3HG1 VAL 92 -2.185 -1.177 7.182 728 HG21 VAL 92 3HG2 VAL 92 -0.738 -0.690 4.192 729 HG22 VAL 92 1HG2 VAL 92 -2.000 0.410 3.635 730 HG23 VAL 92 2HG2 VAL 92 -1.973 -1.261 3.069 731 H ASP 93 H ASP 93 -5.719 -1.924 6.024 732 HA ASP 93 HA ASP 93 -4.936 -3.706 8.223 733 HB2 ASP 93 2HB ASP 93 -6.530 -1.481 7.902 734 HB3 ASP 93 1HB ASP 93 -7.728 -2.778 7.955 735 H MET 94 H MET 94 -6.836 -3.841 5.287 736 HA MET 94 HA MET 94 -8.287 -6.273 5.996 737 HB2 MET 94 2HB MET 94 -7.793 -4.687 3.460 738 HB3 MET 94 1HB MET 94 -8.816 -6.124 3.500 739 HG2 MET 94 2HG MET 94 -9.842 -4.768 5.610 740 HG3 MET 94 1HG MET 94 -9.317 -3.416 4.606 741 HE1 MET 94 3HE MET 94 -10.056 -5.148 1.398 742 HE2 MET 94 1HE MET 94 -9.290 -3.762 2.188 743 HE3 MET 94 2HE MET 94 -10.865 -3.585 1.418 744 H ILE 95 H ILE 95 -5.700 -5.555 3.581 745 HA ILE 95 HA ILE 95 -5.102 -8.182 2.869 746 HB ILE 95 HB ILE 95 -2.861 -7.182 2.371 747 HG12 ILE 95 2HG1 ILE 95 -4.059 -4.831 3.844 748 HG13 ILE 95 1HG1 ILE 95 -2.553 -5.670 4.214 749 HG21 ILE 95 1HG2 ILE 95 -3.702 -6.070 0.559 750 HG22 ILE 95 2HG2 ILE 95 -4.836 -5.139 1.536 751 HG23 ILE 95 3HG2 ILE 95 -5.192 -6.819 1.130 752 HD11 ILE 95 3HD1 ILE 95 -3.094 -3.592 2.191 753 HD12 ILE 95 1HD1 ILE 95 -2.162 -4.965 1.588 754 HD13 ILE 95 2HD1 ILE 95 -1.574 -4.039 2.969 755 H THR 96 H THR 96 -4.031 -6.293 5.677 756 HA THR 96 HA THR 96 -2.176 -8.253 6.704 757 HB THR 96 HB THR 96 -3.778 -5.961 7.865 758 HG1 THR 96 1HG THR 96 -1.734 -5.965 6.386 759 HG21 THR 96 3HG2 THR 96 -2.545 -6.181 9.925 760 HG22 THR 96 1HG2 THR 96 -1.576 -7.498 9.262 761 HG23 THR 96 2HG2 THR 96 -3.293 -7.741 9.585 762 H ARG 97 H ARG 97 -5.657 -7.700 7.020 763 HA ARG 97 HA ARG 97 -6.059 -9.665 9.123 764 HB2 ARG 97 2HB ARG 97 -7.636 -7.887 7.351 765 HB3 ARG 97 1HB ARG 97 -8.478 -9.346 7.874 766 HG2 ARG 97 2HG ARG 97 -8.604 -8.650 10.036 767 HG3 ARG 97 1HG ARG 97 -6.983 -7.955 10.010 768 HD2 ARG 97 2HD ARG 97 -8.002 -5.922 9.923 769 HD3 ARG 97 1HD ARG 97 -8.464 -6.335 8.260 770 HE ARG 97 HE ARG 97 -10.327 -7.661 9.852 771 HH11 ARG 97 1HH1 ARG 97 -9.193 -4.417 9.500 772 HH12 ARG 97 2HH1 ARG 97 -10.719 -3.704 9.898 773 HH21 ARG 97 1HH2 ARG 97 -12.328 -6.739 10.341 774 HH22 ARG 97 2HH2 ARG 97 -12.490 -5.015 10.376 775 H MET 98 H MET 98 -6.648 -9.692 5.574 776 HA MET 98 HA MET 98 -7.451 -12.465 5.526 777 HB2 MET 98 2HB MET 98 -6.934 -12.170 3.056 778 HB3 MET 98 1HB MET 98 -8.039 -10.970 3.718 779 HG2 MET 98 2HG MET 98 -6.480 -9.272 3.602 780 HG3 MET 98 1HG MET 98 -5.117 -10.372 3.784 781 HE1 MET 98 3HE MET 98 -8.251 -10.079 1.427 782 HE2 MET 98 1HE MET 98 -7.484 -9.349 0.010 783 HE3 MET 98 2HE MET 98 -7.479 -8.500 1.552 784 H VAL 99 H VAL 99 -4.399 -10.752 5.424 785 HA VAL 99 HA VAL 99 -2.729 -12.933 4.573 786 HB VAL 99 HB VAL 99 -2.456 -10.311 6.019 787 HG11 VAL 99 1HG1 VAL 99 -0.852 -11.663 7.215 788 HG12 VAL 99 2HG1 VAL 99 0.048 -10.709 6.035 789 HG13 VAL 99 3HG1 VAL 99 -0.288 -12.411 5.721 790 HG21 VAL 99 3HG2 VAL 99 -2.556 -10.844 3.421 791 HG22 VAL 99 1HG2 VAL 99 -0.847 -11.213 3.654 792 HG23 VAL 99 2HG2 VAL 99 -1.464 -9.606 4.041 793 H ASP 100 H ASP 100 -4.073 -11.896 7.687 794 HA ASP 100 HA ASP 100 -2.487 -13.738 9.291 795 HB2 ASP 100 2HB ASP 100 -4.763 -11.844 9.598 796 HB3 ASP 100 1HB ASP 100 -4.636 -13.116 10.815 797 H LYS 101 H LYS 101 -5.609 -13.861 7.645 798 HA LYS 101 HA LYS 101 -6.254 -16.485 8.813 799 HB2 LYS 101 2HB LYS 101 -8.335 -15.797 8.315 800 HB3 LYS 101 1HB LYS 101 -7.633 -14.284 7.760 801 HG2 LYS 101 2HG LYS 101 -7.254 -15.974 5.590 802 HG3 LYS 101 1HG LYS 101 -8.827 -16.457 6.213 803 HD2 LYS 101 2HD LYS 101 -8.768 -13.673 6.365 804 HD3 LYS 101 1HD LYS 101 -8.071 -14.084 4.794 805 HE2 LYS 101 2HE LYS 101 -10.390 -14.064 4.323 806 HE3 LYS 101 1HE LYS 101 -10.078 -15.779 4.662 807 HZ1 LYS 101 3HZ LYS 101 -10.419 -14.750 7.128 808 HZ2 LYS 101 1HZ LYS 101 -11.629 -15.539 6.240 809 HZ3 LYS 101 2HZ LYS 101 -11.540 -13.843 6.229 810 H ILE 102 H ILE 102 -5.074 -15.026 5.856 811 HA ILE 102 HA ILE 102 -5.126 -17.337 4.162 812 HB ILE 102 HB ILE 102 -3.639 -14.723 4.336 813 HG12 ILE 102 2HG1 ILE 102 -5.484 -15.974 2.277 814 HG13 ILE 102 1HG1 ILE 102 -5.943 -14.757 3.468 815 HG21 ILE 102 1HG2 ILE 102 -2.766 -17.115 2.891 816 HG22 ILE 102 2HG2 ILE 102 -1.891 -15.623 3.236 817 HG23 ILE 102 3HG2 ILE 102 -2.976 -15.708 1.849 818 HD11 ILE 102 3HD1 ILE 102 -3.751 -13.598 2.272 819 HD12 ILE 102 1HD1 ILE 102 -5.428 -13.251 1.853 820 HD13 ILE 102 2HD1 ILE 102 -4.512 -14.435 0.920 821 H VAL 103 H VAL 103 -2.921 -16.034 6.548 822 HA VAL 103 HA VAL 103 -0.779 -17.971 6.114 823 HB VAL 103 HB VAL 103 -1.553 -15.839 8.090 824 HG11 VAL 103 1HG1 VAL 103 -0.712 -17.249 9.725 825 HG12 VAL 103 2HG1 VAL 103 0.794 -16.529 9.154 826 HG13 VAL 103 3HG1 VAL 103 0.311 -18.128 8.588 827 HG21 VAL 103 3HG2 VAL 103 0.916 -16.400 6.417 828 HG22 VAL 103 1HG2 VAL 103 0.703 -14.991 7.456 829 HG23 VAL 103 2HG2 VAL 103 -0.342 -15.219 6.054 830 H SER 104 H SER 104 -3.667 -17.684 8.083 831 HA SER 104 HA SER 104 -3.089 -20.028 9.737 832 HB2 SER 104 2HB SER 104 -4.439 -17.856 10.237 833 HB3 SER 104 1HB SER 104 -5.742 -18.664 9.367 834 HG SER 104 HG SER 104 -5.534 -18.968 11.766 835 H GLU 105 H GLU 105 -4.750 -19.323 6.803 836 HA GLU 105 HA GLU 105 -5.399 -22.215 6.456 837 HB2 GLU 105 2HB GLU 105 -7.380 -20.028 5.804 838 HB3 GLU 105 1HB GLU 105 -7.684 -21.753 6.003 839 HG2 GLU 105 2HG GLU 105 -6.755 -19.942 8.247 840 HG3 GLU 105 1HG GLU 105 -8.445 -20.345 7.947 841 H GLY 106 H GLY 106 -5.132 -18.979 5.019 842 HA2 GLY 106 2HA GLY 106 -3.857 -18.652 2.949 843 HA3 GLY 106 1HA GLY 106 -4.313 -20.285 2.464 844 H SER 107 H SER 107 -6.729 -18.246 3.926 845 HA SER 107 HA SER 107 -8.036 -17.977 1.230 846 HB2 SER 107 2HB SER 107 -9.218 -18.100 4.014 847 HB3 SER 107 1HB SER 107 -10.125 -18.031 2.506 848 HG SER 107 HG SER 107 -8.939 -20.145 3.737 849 H ASP 108 H ASP 108 -8.277 -15.948 0.505 850 HA ASP 108 HA ASP 108 -7.735 -13.675 2.337 851 HB2 ASP 108 2HB ASP 108 -7.485 -12.444 0.275 852 HB3 ASP 108 1HB ASP 108 -6.712 -14.010 0.017 853 H ASP 109 H ASP 109 -10.295 -15.525 1.879 854 HA ASP 109 HA ASP 109 -12.395 -13.767 0.983 855 HB2 ASP 109 2HB ASP 109 -12.378 -16.290 1.151 856 HB3 ASP 109 1HB ASP 109 -12.547 -16.112 2.898 857 H ILE 110 H ILE 110 -11.101 -12.031 2.619 858 HA ILE 110 HA ILE 110 -12.382 -12.108 5.300 859 HB ILE 110 HB ILE 110 -10.900 -10.116 5.664 860 HG12 ILE 110 2HG1 ILE 110 -9.707 -10.732 2.963 861 HG13 ILE 110 1HG1 ILE 110 -11.010 -9.559 3.132 862 HG21 ILE 110 1HG2 ILE 110 -10.195 -12.598 5.909 863 HG22 ILE 110 2HG2 ILE 110 -8.927 -11.374 5.871 864 HG23 ILE 110 3HG2 ILE 110 -9.273 -12.330 4.429 865 HD11 ILE 110 3HD1 ILE 110 -9.704 -8.221 4.666 866 HD12 ILE 110 1HD1 ILE 110 -8.710 -8.539 3.244 867 HD13 ILE 110 2HD1 ILE 110 -8.440 -9.448 4.730 868 H GLY 111 H GLY 111 -13.818 -11.498 2.629 869 HA2 GLY 111 2HA GLY 111 -15.516 -10.017 1.942 870 HA3 GLY 111 1HA GLY 111 -15.518 -9.391 3.595 871 H GLU 112 H GLU 112 -12.491 -9.422 2.008 872 HA GLU 112 HA GLU 112 -11.713 -6.828 2.348 873 HB2 GLU 112 2HB GLU 112 -10.490 -7.238 0.060 874 HB3 GLU 112 1HB GLU 112 -10.142 -8.290 1.428 875 HG2 GLU 112 2HG GLU 112 -11.456 -10.044 0.570 876 HG3 GLU 112 1HG GLU 112 -12.330 -8.975 -0.525 877 H ASN 113 H ASN 113 -13.852 -7.930 -0.295 878 HA ASN 113 HA ASN 113 -15.002 -6.635 -1.931 879 HB2 ASN 113 2HB ASN 113 -15.095 -4.881 0.545 880 HB3 ASN 113 1HB ASN 113 -16.196 -4.758 -0.826 881 HD21 ASN 113 1HD2 ASN 113 -17.935 -5.281 0.832 882 HD22 ASN 113 2HD2 ASN 113 -18.200 -6.908 1.237 883 H ILE 114 H ILE 114 -12.567 -6.361 -2.764 884 HA ILE 114 HA ILE 114 -11.225 -3.856 -2.434 885 HB ILE 114 HB ILE 114 -11.233 -5.705 -4.836 886 HG12 ILE 114 2HG1 ILE 114 -10.877 -7.148 -2.981 887 HG13 ILE 114 1HG1 ILE 114 -9.254 -6.746 -3.544 888 HG21 ILE 114 1HG2 ILE 114 -9.296 -3.698 -3.684 889 HG22 ILE 114 2HG2 ILE 114 -9.961 -3.757 -5.314 890 HG23 ILE 114 3HG2 ILE 114 -8.774 -4.958 -4.801 891 HD11 ILE 114 3HD1 ILE 114 -10.736 -5.562 -1.186 892 HD12 ILE 114 1HD1 ILE 114 -9.262 -4.853 -1.847 893 HD13 ILE 114 2HD1 ILE 114 -9.225 -6.478 -1.163 894 H ASP 115 H ASP 115 -12.882 -4.934 -5.428 895 HA ASP 115 HA ASP 115 -13.079 -2.572 -6.811 896 HB2 ASP 115 2HB ASP 115 -15.360 -3.487 -7.535 897 HB3 ASP 115 1HB ASP 115 -14.004 -4.601 -7.693 898 H VAL 116 H VAL 116 -14.821 -3.510 -4.007 899 HA VAL 116 HA VAL 116 -16.590 -1.186 -3.948 900 HB VAL 116 HB VAL 116 -15.970 -3.558 -2.204 901 HG11 VAL 116 1HG1 VAL 116 -17.808 -1.227 -1.563 902 HG12 VAL 116 2HG1 VAL 116 -16.393 -1.741 -0.643 903 HG13 VAL 116 3HG1 VAL 116 -17.825 -2.768 -0.706 904 HG21 VAL 116 3HG2 VAL 116 -17.502 -4.337 -3.712 905 HG22 VAL 116 1HG2 VAL 116 -18.080 -2.719 -4.113 906 HG23 VAL 116 2HG2 VAL 116 -18.660 -3.527 -2.657 907 H PHE 117 H PHE 117 -14.056 -2.421 -1.830 908 HA PHE 117 HA PHE 117 -13.799 -0.085 -0.201 909 HB2 PHE 117 2HB PHE 117 -12.258 -2.539 -0.831 910 HB3 PHE 117 1HB PHE 117 -11.305 -1.202 -0.187 911 HD1 PHE 117 1HD PHE 117 -14.751 -2.552 0.441 912 HD2 PHE 117 2HD PHE 117 -10.981 -1.351 2.112 913 HE1 PHE 117 1HE PHE 117 -15.609 -3.035 2.717 914 HE2 PHE 117 2HE PHE 117 -11.837 -1.835 4.389 915 HZ PHE 117 HZ PHE 117 -14.151 -2.677 4.692 916 H SER 118 H SER 118 -12.825 -0.736 -3.434 917 HA SER 118 HA SER 118 -10.838 1.423 -3.528 918 HB2 SER 118 2HB SER 118 -10.633 -0.826 -4.681 919 HB3 SER 118 1HB SER 118 -11.989 -0.345 -5.697 920 HG SER 118 HG SER 118 -9.748 1.336 -5.414 921 H ASP 119 H ASP 119 -13.920 0.505 -4.904 922 HA ASP 119 HA ASP 119 -14.452 2.896 -6.362 923 HB2 ASP 119 2HB ASP 119 -15.738 0.889 -6.748 924 HB3 ASP 119 1HB ASP 119 -16.200 0.800 -5.049 925 H THR 120 H THR 120 -14.600 2.083 -3.046 926 HA THR 120 HA THR 120 -16.255 4.286 -2.157 927 HB THR 120 HB THR 120 -14.704 2.031 -1.102 928 HG1 THR 120 1HG THR 120 -16.939 3.492 -0.152 929 HG21 THR 120 3HG2 THR 120 -13.348 3.531 0.094 930 HG22 THR 120 1HG2 THR 120 -14.635 3.144 1.237 931 HG23 THR 120 2HG2 THR 120 -14.671 4.670 0.351 932 H ILE 121 H ILE 121 -12.837 3.571 -2.067 933 HA ILE 121 HA ILE 121 -11.928 6.170 -1.263 934 HB ILE 121 HB ILE 121 -10.966 3.555 -1.860 935 HG12 ILE 121 2HG1 ILE 121 -9.754 6.041 -0.655 936 HG13 ILE 121 1HG1 ILE 121 -10.453 4.655 0.179 937 HG21 ILE 121 1HG2 ILE 121 -8.966 3.913 -3.121 938 HG22 ILE 121 2HG2 ILE 121 -9.217 5.659 -3.147 939 HG23 ILE 121 3HG2 ILE 121 -10.286 4.599 -4.066 940 HD11 ILE 121 3HD1 ILE 121 -7.785 4.920 -1.147 941 HD12 ILE 121 1HD1 ILE 121 -8.569 3.340 -1.168 942 HD13 ILE 121 2HD1 ILE 121 -8.208 4.125 0.370 943 H LYS 122 H LYS 122 -12.431 4.606 -4.424 944 HA LYS 122 HA LYS 122 -11.339 6.663 -6.068 945 HB2 LYS 122 2HB LYS 122 -12.890 4.187 -6.203 946 HB3 LYS 122 1HB LYS 122 -13.406 5.355 -7.425 947 HG2 LYS 122 2HG LYS 122 -11.612 4.715 -8.633 948 HG3 LYS 122 1HG LYS 122 -10.641 5.561 -7.430 949 HD2 LYS 122 2HD LYS 122 -11.358 2.997 -6.378 950 HD3 LYS 122 1HD LYS 122 -10.662 2.777 -7.984 951 HE2 LYS 122 2HE LYS 122 -9.217 4.758 -6.342 952 HE3 LYS 122 1HE LYS 122 -9.167 3.106 -5.695 953 HZ1 LYS 122 3HZ LYS 122 -8.770 3.637 -8.574 954 HZ2 LYS 122 1HZ LYS 122 -8.325 2.266 -7.683 955 HZ3 LYS 122 2HZ LYS 122 -7.466 3.718 -7.488 956 H SER 123 H SER 123 -14.478 6.113 -4.586 957 HA SER 123 HA SER 123 -15.704 8.428 -5.916 958 HB2 SER 123 2HB SER 123 -16.476 6.241 -4.050 959 HB3 SER 123 1HB SER 123 -17.466 7.695 -4.047 960 HG SER 123 HG SER 123 -16.767 6.658 -6.528 961 H PHE 124 H PHE 124 -13.808 7.788 -3.190 962 HA PHE 124 HA PHE 124 -14.824 9.882 -1.435 963 HB2 PHE 124 2HB PHE 124 -12.759 7.824 -1.527 964 HB3 PHE 124 1HB PHE 124 -12.169 9.310 -0.782 965 HD1 PHE 124 2HD PHE 124 -15.462 7.494 -0.793 966 HD2 PHE 124 1HD PHE 124 -12.303 9.240 1.537 967 HE1 PHE 124 2HE PHE 124 -16.693 6.943 1.289 968 HE2 PHE 124 1HE PHE 124 -13.533 8.688 3.619 969 HZ PHE 124 HZ PHE 124 -15.728 7.540 3.495 970 H ALA 125 H ALA 125 -13.245 9.984 -4.340 971 HA ALA 125 HA ALA 125 -12.090 12.683 -3.732 972 HB1 ALA 125 1HB ALA 125 -10.226 11.211 -3.862 973 HB2 ALA 125 2HB ALA 125 -10.313 11.948 -5.462 974 HB3 ALA 125 3HB ALA 125 -10.928 10.315 -5.209 975 H SER 126 H SER 126 -12.082 10.881 -6.782 976 HA SER 126 HA SER 126 -14.398 12.280 -7.884 977 HB2 SER 126 2HB SER 126 -12.714 13.418 -9.587 978 HB3 SER 126 1HB SER 126 -13.057 14.177 -8.035 979 HG SER 126 HG SER 126 -10.982 14.017 -7.746 980 H SER 127 H SER 127 -13.787 12.159 -10.575 981 HA SER 127 HA SER 127 -13.516 10.664 -12.387 982 HB2 SER 127 2HB SER 127 -11.407 9.883 -12.162 983 HB3 SER 127 1HB SER 127 -11.493 10.097 -10.417 984 HG SER 127 HG SER 127 -12.068 7.845 -11.996 985 H GLY 128 H GLY 128 -13.636 8.584 -9.464 986 HA2 GLY 128 2HA GLY 128 -15.497 6.748 -10.744 987 HA3 GLY 128 1HA GLY 128 -14.966 6.675 -9.063 988 H LYS 129 H LYS 129 -17.655 7.104 -10.895 989 HA LYS 129 HA LYS 129 -18.983 8.720 -8.744 990 HB2 LYS 129 2HB LYS 129 -18.693 9.155 -11.625 991 HB3 LYS 129 1HB LYS 129 -20.379 9.187 -11.108 992 HG2 LYS 129 2HG LYS 129 -19.913 11.360 -10.593 993 HG3 LYS 129 1HG LYS 129 -19.235 10.655 -9.126 994 HD2 LYS 129 2HD LYS 129 -17.102 10.381 -10.743 995 HD3 LYS 129 1HD LYS 129 -17.842 11.794 -11.497 996 HE2 LYS 129 2HE LYS 129 -17.874 12.055 -8.602 997 HE3 LYS 129 1HE LYS 129 -16.222 11.806 -9.201 998 HZ1 LYS 129 3HZ LYS 129 -16.472 14.041 -9.573 999 HZ2 LYS 129 1HZ LYS 129 -18.138 13.930 -9.870 1000 HZ3 LYS 129 2HZ LYS 129 -17.030 13.430 -11.058 1001 H GLU 130 H GLU 130 -19.620 6.578 -7.871 1002 HA GLU 130 HA GLU 130 -21.494 4.996 -9.557 1003 HB2 GLU 130 2HB GLU 130 -19.875 4.619 -7.066 1004 HB3 GLU 130 1HB GLU 130 -21.309 3.614 -7.280 1005 HG2 GLU 130 2HG GLU 130 -19.902 3.687 -9.768 1006 HG3 GLU 130 1HG GLU 130 -18.744 3.296 -8.495 1007 H LYS 131 H LYS 131 -23.393 4.071 -8.045 1008 HA LYS 131 HA LYS 131 -24.484 6.115 -6.201 1009 HB2 LYS 131 2HB LYS 131 -25.172 5.836 -9.018 1010 HB3 LYS 131 1HB LYS 131 -26.587 5.618 -7.988 1011 HG2 LYS 131 2HG LYS 131 -24.901 7.836 -7.104 1012 HG3 LYS 131 1HG LYS 131 -25.500 8.060 -8.748 1013 HD2 LYS 131 2HD LYS 131 -27.579 7.014 -7.005 1014 HD3 LYS 131 1HD LYS 131 -26.926 8.530 -6.385 1015 HE2 LYS 131 2HE LYS 131 -27.211 9.481 -8.740 1016 HE3 LYS 131 1HE LYS 131 -28.160 8.026 -9.107 1017 HZ1 LYS 131 3HZ LYS 131 -29.731 8.534 -7.508 1018 HZ2 LYS 131 1HZ LYS 131 -29.372 10.068 -8.137 1019 HZ3 LYS 131 2HZ LYS 131 -28.694 9.577 -6.658 1020 H LEU 132 H LEU 132 -24.536 4.450 -4.603 1021 HA LEU 132 HA LEU 132 -26.183 2.033 -5.224 1022 HB2 LEU 132 2HB LEU 132 -23.748 2.556 -3.848 1023 HB3 LEU 132 1HB LEU 132 -24.918 2.026 -2.639 1024 HG LEU 132 HG LEU 132 -25.115 0.433 -5.063 1025 HD11 LEU 132 1HD1 LEU 132 -22.980 -0.231 -5.425 1026 HD12 LEU 132 2HD1 LEU 132 -22.626 -0.309 -3.699 1027 HD13 LEU 132 3HD1 LEU 132 -22.512 1.230 -4.553 1028 HD21 LEU 132 3HD2 LEU 132 -24.216 -0.513 -2.348 1029 HD22 LEU 132 1HD2 LEU 132 -25.263 -1.325 -3.511 1030 HD23 LEU 132 2HD2 LEU 132 -25.871 0.048 -2.587 1031 H GLU 133 H GLU 133 -28.303 2.865 -4.918 1032 HA GLU 133 HA GLU 133 -29.054 4.542 -2.681 1033 HB2 GLU 133 2HB GLU 133 -30.270 4.477 -4.801 1034 HB3 GLU 133 1HB GLU 133 -30.613 2.761 -4.580 1035 HG2 GLU 133 2HG GLU 133 -32.412 3.232 -3.312 1036 HG3 GLU 133 1HG GLU 133 -31.442 4.244 -2.242 Start of MODEL 11 1 H1 MET 1 1HT MET 1 8.545 -27.134 -9.172 2 H2 MET 1 2HT MET 1 8.134 -28.608 -8.432 3 H3 MET 1 3HT MET 1 9.018 -27.440 -7.571 4 HA MET 1 HA MET 1 6.916 -25.960 -8.100 5 HB2 MET 1 2HB MET 1 5.986 -27.773 -9.509 6 HB3 MET 1 1HB MET 1 5.978 -28.849 -8.111 7 HG2 MET 1 2HG MET 1 3.765 -28.018 -8.202 8 HG3 MET 1 1HG MET 1 4.542 -27.032 -6.963 9 HE1 MET 1 2HE MET 1 2.770 -27.192 -10.324 10 HE2 MET 1 3HE MET 1 4.456 -27.259 -10.835 11 HE3 MET 1 1HE MET 1 3.454 -25.864 -11.260 12 H MET 2 H MET 2 8.043 -25.469 -6.023 13 HA MET 2 HA MET 2 7.223 -27.200 -3.730 14 HB2 MET 2 2HB MET 2 9.577 -25.825 -4.505 15 HB3 MET 2 1HB MET 2 8.957 -24.979 -3.087 16 HG2 MET 2 2HG MET 2 8.931 -27.013 -1.792 17 HG3 MET 2 1HG MET 2 9.295 -27.987 -3.217 18 HE1 MET 2 3HE MET 2 10.504 -25.469 -0.587 19 HE2 MET 2 1HE MET 2 10.633 -24.513 -2.069 20 HE3 MET 2 2HE MET 2 12.084 -24.956 -1.175 21 H GLU 3 H GLU 3 6.543 -25.966 -1.726 22 HA GLU 3 HA GLU 3 4.795 -23.660 -2.477 23 HB2 GLU 3 2HB GLU 3 3.582 -24.370 -0.386 24 HB3 GLU 3 1HB GLU 3 3.618 -25.616 -1.639 25 HG2 GLU 3 2HG GLU 3 5.376 -26.801 -0.529 26 HG3 GLU 3 1HG GLU 3 5.685 -25.450 0.564 27 H GLU 4 H GLU 4 7.571 -24.512 -0.747 28 HA GLU 4 HA GLU 4 7.363 -22.754 1.481 29 HB2 GLU 4 2HB GLU 4 8.990 -24.588 1.298 30 HB3 GLU 4 1HB GLU 4 9.772 -23.771 -0.055 31 HG2 GLU 4 2HG GLU 4 10.883 -22.331 1.303 32 HG3 GLU 4 1HG GLU 4 9.479 -22.090 2.344 33 H TYR 5 H TYR 5 7.662 -22.099 -1.806 34 HA TYR 5 HA TYR 5 9.229 -19.669 -1.680 35 HB2 TYR 5 2HB TYR 5 7.330 -20.920 -3.665 36 HB3 TYR 5 1HB TYR 5 8.137 -19.386 -3.989 37 HD1 TYR 5 2HD TYR 5 10.791 -19.483 -3.307 38 HD2 TYR 5 1HD TYR 5 8.361 -22.802 -4.549 39 HE1 TYR 5 2HE TYR 5 12.827 -20.709 -4.021 40 HE2 TYR 5 1HE TYR 5 10.395 -24.025 -5.262 41 HH TYR 5 HH TYR 5 12.648 -23.648 -5.860 42 H LEU 6 H LEU 6 5.845 -20.467 -1.524 43 HA LEU 6 HA LEU 6 4.913 -17.698 -1.531 44 HB2 LEU 6 2HB LEU 6 2.778 -18.700 -1.426 45 HB3 LEU 6 1HB LEU 6 3.742 -19.927 -2.246 46 HG LEU 6 HG LEU 6 4.194 -20.769 0.222 47 HD11 LEU 6 1HD1 LEU 6 1.487 -20.180 0.965 48 HD12 LEU 6 2HD1 LEU 6 2.327 -18.664 0.635 49 HD13 LEU 6 3HD1 LEU 6 2.972 -19.788 1.832 50 HD21 LEU 6 3HD2 LEU 6 1.466 -21.541 -0.384 51 HD22 LEU 6 1HD2 LEU 6 2.943 -22.497 -0.515 52 HD23 LEU 6 2HD2 LEU 6 2.430 -21.476 -1.859 53 H GLY 7 H GLY 7 5.816 -20.102 0.876 54 HA2 GLY 7 2HA GLY 7 4.642 -18.868 3.169 55 HA3 GLY 7 1HA GLY 7 6.046 -19.934 3.206 56 H VAL 8 H VAL 8 7.758 -18.370 1.535 57 HA VAL 8 HA VAL 8 8.658 -16.401 3.498 58 HB VAL 8 HB VAL 8 9.609 -17.380 0.806 59 HG11 VAL 8 1HG1 VAL 8 11.654 -15.962 2.210 60 HG12 VAL 8 2HG1 VAL 8 10.247 -14.906 2.082 61 HG13 VAL 8 3HG1 VAL 8 10.965 -15.598 0.628 62 HG21 VAL 8 3HG2 VAL 8 11.010 -17.599 3.467 63 HG22 VAL 8 1HG2 VAL 8 11.211 -18.601 2.030 64 HG23 VAL 8 2HG2 VAL 8 9.754 -18.751 3.013 65 H PHE 9 H PHE 9 7.051 -16.380 0.426 66 HA PHE 9 HA PHE 9 7.395 -13.625 -0.266 67 HB2 PHE 9 2HB PHE 9 5.471 -15.841 -0.886 68 HB3 PHE 9 1HB PHE 9 5.051 -14.207 -1.397 69 HD1 PHE 9 2HD PHE 9 7.748 -13.082 -1.988 70 HD2 PHE 9 1HD PHE 9 6.063 -16.929 -2.899 71 HE1 PHE 9 2HE PHE 9 9.289 -13.302 -3.916 72 HE2 PHE 9 1HE PHE 9 7.604 -17.145 -4.830 73 HZ PHE 9 HZ PHE 9 9.218 -15.332 -5.338 74 H VAL 10 H VAL 10 5.142 -15.297 1.879 75 HA VAL 10 HA VAL 10 3.450 -12.969 2.355 76 HB VAL 10 HB VAL 10 3.873 -15.577 3.855 77 HG11 VAL 10 1HG1 VAL 10 1.646 -15.120 4.811 78 HG12 VAL 10 2HG1 VAL 10 1.590 -13.581 3.953 79 HG13 VAL 10 3HG1 VAL 10 2.780 -13.836 5.230 80 HG21 VAL 10 3HG2 VAL 10 2.910 -15.204 1.296 81 HG22 VAL 10 1HG2 VAL 10 1.433 -15.172 2.259 82 HG23 VAL 10 2HG2 VAL 10 2.505 -16.570 2.334 83 H ASP 11 H ASP 11 6.055 -14.631 4.174 84 HA ASP 11 HA ASP 11 6.068 -12.890 6.429 85 HB2 ASP 11 2HB ASP 11 7.775 -14.919 5.154 86 HB3 ASP 11 1HB ASP 11 8.677 -13.727 6.092 87 H GLU 12 H GLU 12 7.098 -12.472 3.208 88 HA GLU 12 HA GLU 12 8.901 -10.205 3.770 89 HB2 GLU 12 2HB GLU 12 7.863 -11.658 1.329 90 HB3 GLU 12 1HB GLU 12 8.802 -10.173 1.173 91 HG2 GLU 12 2HG GLU 12 10.025 -12.050 3.045 92 HG3 GLU 12 1HG GLU 12 9.846 -12.742 1.433 93 H THR 13 H THR 13 5.636 -10.803 2.500 94 HA THR 13 HA THR 13 5.021 -8.104 1.740 95 HB THR 13 HB THR 13 2.668 -8.988 1.941 96 HG1 THR 13 1HG THR 13 2.323 -10.867 2.891 97 HG21 THR 13 3HG2 THR 13 4.837 -10.003 0.328 98 HG22 THR 13 1HG2 THR 13 3.156 -9.721 -0.125 99 HG23 THR 13 2HG2 THR 13 3.630 -11.262 0.590 100 H LYS 14 H LYS 14 4.680 -9.898 4.789 101 HA LYS 14 HA LYS 14 3.263 -7.832 6.226 102 HB2 LYS 14 2HB LYS 14 4.934 -10.253 6.934 103 HB3 LYS 14 1HB LYS 14 4.252 -9.219 8.189 104 HG2 LYS 14 2HG LYS 14 2.268 -10.253 7.969 105 HG3 LYS 14 1HG LYS 14 2.195 -9.755 6.279 106 HD2 LYS 14 2HD LYS 14 2.451 -11.910 5.682 107 HD3 LYS 14 1HD LYS 14 4.064 -11.873 6.393 108 HE2 LYS 14 2HE LYS 14 1.712 -12.239 8.224 109 HE3 LYS 14 1HE LYS 14 2.285 -13.625 7.275 110 HZ1 LYS 14 3HZ LYS 14 4.156 -11.875 8.752 111 HZ2 LYS 14 1HZ LYS 14 4.428 -13.438 8.151 112 HZ3 LYS 14 2HZ LYS 14 3.420 -13.210 9.500 113 H GLU 15 H GLU 15 6.703 -8.742 5.966 114 HA GLU 15 HA GLU 15 7.694 -6.723 7.727 115 HB2 GLU 15 2HB GLU 15 9.537 -7.976 7.294 116 HB3 GLU 15 1HB GLU 15 8.612 -8.844 6.074 117 HG2 GLU 15 2HG GLU 15 9.331 -7.386 4.337 118 HG3 GLU 15 1HG GLU 15 9.950 -6.198 5.485 119 H TYR 16 H TYR 16 6.482 -6.675 4.556 120 HA TYR 16 HA TYR 16 7.708 -4.108 3.803 121 HB2 TYR 16 2HB TYR 16 6.325 -6.359 2.556 122 HB3 TYR 16 1HB TYR 16 5.720 -4.811 1.965 123 HD1 TYR 16 2HD TYR 16 7.978 -3.042 1.952 124 HD2 TYR 16 1HD TYR 16 7.851 -7.234 1.030 125 HE1 TYR 16 2HE TYR 16 9.997 -2.791 0.532 126 HE2 TYR 16 1HE TYR 16 9.868 -6.985 -0.390 127 HH TYR 16 HH TYR 16 11.000 -4.057 -1.471 128 H LEU 17 H LEU 17 4.580 -5.362 4.921 129 HA LEU 17 HA LEU 17 3.041 -2.991 4.391 130 HB2 LEU 17 2HB LEU 17 2.850 -5.225 6.440 131 HB3 LEU 17 1HB LEU 17 1.593 -4.005 6.229 132 HG LEU 17 HG LEU 17 2.625 -5.650 3.927 133 HD11 LEU 17 1HD1 LEU 17 1.563 -7.455 4.755 134 HD12 LEU 17 2HD1 LEU 17 0.053 -6.546 4.709 135 HD13 LEU 17 3HD1 LEU 17 1.044 -6.534 6.168 136 HD21 LEU 17 3HD2 LEU 17 -0.132 -4.876 3.788 137 HD22 LEU 17 1HD2 LEU 17 1.201 -4.360 2.754 138 HD23 LEU 17 2HD2 LEU 17 0.825 -3.459 4.223 139 H GLN 18 H GLN 18 5.015 -4.073 7.102 140 HA GLN 18 HA GLN 18 4.474 -1.795 8.800 141 HB2 GLN 18 2HB GLN 18 5.490 -3.250 10.185 142 HB3 GLN 18 1HB GLN 18 5.847 -4.277 8.805 143 HG2 GLN 18 2HG GLN 18 7.945 -3.108 8.416 144 HG3 GLN 18 1HG GLN 18 7.576 -1.953 9.696 145 HE21 GLN 18 1HE2 GLN 18 7.701 -2.713 11.934 146 HE22 GLN 18 2HE2 GLN 18 8.481 -4.167 12.328 147 H ASN 19 H ASN 19 7.071 -2.753 6.673 148 HA ASN 19 HA ASN 19 8.612 -0.345 6.838 149 HB2 ASN 19 2HB ASN 19 9.595 -2.336 5.919 150 HB3 ASN 19 1HB ASN 19 8.251 -2.559 4.799 151 HD21 ASN 19 1HD2 ASN 19 8.051 -0.850 3.033 152 HD22 ASN 19 2HD2 ASN 19 9.467 -0.097 2.476 153 H LEU 20 H LEU 20 5.733 -1.319 5.254 154 HA LEU 20 HA LEU 20 5.635 1.064 3.508 155 HB2 LEU 20 2HB LEU 20 4.893 -0.984 2.506 156 HB3 LEU 20 1HB LEU 20 3.922 -1.396 3.920 157 HG LEU 20 HG LEU 20 2.495 0.606 3.467 158 HD11 LEU 20 1HD1 LEU 20 2.736 1.509 1.070 159 HD12 LEU 20 2HD1 LEU 20 4.342 0.784 1.083 160 HD13 LEU 20 3HD1 LEU 20 3.935 2.046 2.246 161 HD21 LEU 20 3HD2 LEU 20 1.287 -0.388 1.600 162 HD22 LEU 20 1HD2 LEU 20 1.922 -1.684 2.614 163 HD23 LEU 20 2HD2 LEU 20 2.725 -1.277 1.098 164 H ASN 21 H ASN 21 4.771 0.155 6.651 165 HA ASN 21 HA ASN 21 2.522 2.064 6.809 166 HB2 ASN 21 2HB ASN 21 3.647 -0.178 8.390 167 HB3 ASN 21 1HB ASN 21 3.015 1.173 9.336 168 HD21 ASN 21 1HD2 ASN 21 2.096 -1.696 7.768 169 HD22 ASN 21 2HD2 ASN 21 0.427 -1.400 7.673 170 H ASP 22 H ASP 22 5.804 1.470 7.656 171 HA ASP 22 HA ASP 22 6.137 3.740 9.329 172 HB2 ASP 22 2HB ASP 22 7.632 1.528 8.476 173 HB3 ASP 22 1HB ASP 22 8.530 2.932 7.898 174 H THR 23 H THR 23 6.252 3.071 5.994 175 HA THR 23 HA THR 23 7.333 5.621 5.065 176 HB THR 23 HB THR 23 5.725 3.365 3.861 177 HG1 THR 23 1HG THR 23 7.602 2.451 4.135 178 HG21 THR 23 3HG2 THR 23 5.556 5.496 2.566 179 HG22 THR 23 1HG2 THR 23 6.385 4.220 1.674 180 HG23 THR 23 2HG2 THR 23 7.315 5.515 2.429 181 H LEU 24 H LEU 24 4.155 4.074 5.400 182 HA LEU 24 HA LEU 24 2.649 6.344 4.374 183 HB2 LEU 24 2HB LEU 24 2.074 3.740 5.791 184 HB3 LEU 24 1HB LEU 24 0.782 4.902 5.488 185 HG LEU 24 HG LEU 24 2.625 3.934 3.296 186 HD11 LEU 24 1HD1 LEU 24 -0.108 2.845 4.038 187 HD12 LEU 24 2HD1 LEU 24 1.418 2.012 4.336 188 HD13 LEU 24 3HD1 LEU 24 0.892 2.325 2.681 189 HD21 LEU 24 3HD2 LEU 24 0.541 5.891 3.519 190 HD22 LEU 24 1HD2 LEU 24 -0.021 4.599 2.460 191 HD23 LEU 24 2HD2 LEU 24 1.478 5.452 2.091 192 H LEU 25 H LEU 25 3.888 5.246 7.458 193 HA LEU 25 HA LEU 25 2.180 7.057 9.027 194 HB2 LEU 25 2HB LEU 25 4.575 5.302 9.581 195 HB3 LEU 25 1HB LEU 25 3.818 6.286 10.842 196 HG LEU 25 HG LEU 25 2.180 4.492 9.091 197 HD11 LEU 25 1HD1 LEU 25 2.369 2.742 10.831 198 HD12 LEU 25 2HD1 LEU 25 3.547 3.733 11.694 199 HD13 LEU 25 3HD1 LEU 25 3.935 3.086 10.099 200 HD21 LEU 25 3HD2 LEU 25 0.551 4.733 10.804 201 HD22 LEU 25 1HD2 LEU 25 1.263 6.341 10.640 202 HD23 LEU 25 2HD2 LEU 25 1.748 5.292 11.973 203 H GLU 26 H GLU 26 5.075 7.272 7.297 204 HA GLU 26 HA GLU 26 5.888 9.753 8.697 205 HB2 GLU 26 2HB GLU 26 7.115 7.927 6.617 206 HB3 GLU 26 1HB GLU 26 7.802 9.517 6.955 207 HG2 GLU 26 2HG GLU 26 7.390 7.291 8.974 208 HG3 GLU 26 1HG GLU 26 8.937 7.800 8.297 209 H LEU 27 H LEU 27 4.495 8.386 5.909 210 HA LEU 27 HA LEU 27 4.470 10.634 4.211 211 HB2 LEU 27 2HB LEU 27 4.139 8.334 3.448 212 HB3 LEU 27 1HB LEU 27 2.716 8.188 4.474 213 HG LEU 27 HG LEU 27 1.512 9.797 3.172 214 HD11 LEU 27 1HD1 LEU 27 4.055 10.156 1.561 215 HD12 LEU 27 2HD1 LEU 27 3.454 11.304 2.757 216 HD13 LEU 27 3HD1 LEU 27 2.524 10.989 1.292 217 HD21 LEU 27 3HD2 LEU 27 2.024 8.722 0.761 218 HD22 LEU 27 1HD2 LEU 27 1.194 7.820 2.029 219 HD23 LEU 27 2HD2 LEU 27 2.920 7.579 1.761 220 H GLU 28 H GLU 28 2.364 9.475 6.772 221 HA GLU 28 HA GLU 28 0.165 11.272 6.255 222 HB2 GLU 28 2HB GLU 28 -0.665 10.305 8.206 223 HB3 GLU 28 1HB GLU 28 0.498 9.091 7.690 224 HG2 GLU 28 2HG GLU 28 2.181 10.022 9.195 225 HG3 GLU 28 1HG GLU 28 1.060 11.283 9.695 226 H LYS 29 H LYS 29 3.079 11.388 8.280 227 HA LYS 29 HA LYS 29 2.438 14.011 9.373 228 HB2 LYS 29 2HB LYS 29 4.051 13.319 10.794 229 HB3 LYS 29 1HB LYS 29 4.197 11.863 9.821 230 HG2 LYS 29 2HG LYS 29 5.707 13.477 8.309 231 HG3 LYS 29 1HG LYS 29 5.930 14.287 9.863 232 HD2 LYS 29 2HD LYS 29 6.274 11.341 9.391 233 HD3 LYS 29 1HD LYS 29 7.608 12.491 9.426 234 HE2 LYS 29 2HE LYS 29 5.679 12.389 11.733 235 HE3 LYS 29 1HE LYS 29 6.986 11.193 11.628 236 HZ1 LYS 29 3HZ LYS 29 8.383 13.300 11.032 237 HZ2 LYS 29 1HZ LYS 29 8.078 12.913 12.654 238 HZ3 LYS 29 2HZ LYS 29 7.158 14.115 11.881 239 H ASN 30 H ASN 30 3.654 12.723 6.522 240 HA ASN 30 HA ASN 30 4.174 15.428 5.436 241 HB2 ASN 30 2HB ASN 30 6.214 13.373 6.068 242 HB3 ASN 30 1HB ASN 30 6.341 14.050 4.443 243 HD21 ASN 30 1HD2 ASN 30 8.060 15.532 4.660 244 HD22 ASN 30 2HD2 ASN 30 8.095 16.785 5.805 245 HA PRO 31 HA PRO 31 2.081 12.610 2.616 246 HB2 PRO 31 2HB PRO 31 -0.241 14.003 2.528 247 HB3 PRO 31 1HB PRO 31 0.142 12.840 3.804 248 HG2 PRO 31 2HG PRO 31 0.050 15.765 3.922 249 HG3 PRO 31 1HG PRO 31 -0.171 14.564 5.202 250 HD2 PRO 31 2HD PRO 31 2.157 16.078 4.636 251 HD3 PRO 31 1HD PRO 31 1.964 14.784 5.839 252 H GLU 32 H GLU 32 3.816 15.161 2.259 253 HA GLU 32 HA GLU 32 2.909 15.710 -0.515 254 HB2 GLU 32 2HB GLU 32 3.605 18.221 0.345 255 HB3 GLU 32 1HB GLU 32 1.950 17.626 0.282 256 HG2 GLU 32 2HG GLU 32 1.888 17.173 2.586 257 HG3 GLU 32 1HG GLU 32 3.648 17.132 2.719 258 H ASP 33 H ASP 33 5.285 14.608 1.320 259 HA ASP 33 HA ASP 33 7.539 16.229 0.468 260 HB2 ASP 33 2HB ASP 33 7.163 14.644 2.532 261 HB3 ASP 33 1HB ASP 33 7.715 13.395 1.419 262 H MET 34 H MET 34 5.661 13.799 -0.931 263 HA MET 34 HA MET 34 5.794 12.646 -2.967 264 HB2 MET 34 2HB MET 34 7.676 14.971 -3.210 265 HB3 MET 34 1HB MET 34 7.704 13.742 -4.474 266 HG2 MET 34 2HG MET 34 5.011 14.653 -3.645 267 HG3 MET 34 1HG MET 34 5.997 15.854 -4.480 268 HE1 MET 34 3HE MET 34 3.666 14.633 -7.296 269 HE2 MET 34 1HE MET 34 4.350 16.018 -6.433 270 HE3 MET 34 2HE MET 34 3.298 14.883 -5.591 271 H GLU 35 H GLU 35 7.867 12.329 -0.550 272 HA GLU 35 HA GLU 35 9.685 10.488 -2.026 273 HB2 GLU 35 2HB GLU 35 11.268 10.909 -0.295 274 HB3 GLU 35 1HB GLU 35 10.520 12.480 -0.568 275 HG2 GLU 35 2HG GLU 35 8.944 12.009 1.309 276 HG3 GLU 35 1HG GLU 35 9.818 10.509 1.620 277 H LEU 36 H LEU 36 7.559 10.926 0.735 278 HA LEU 36 HA LEU 36 7.634 8.091 1.502 279 HB2 LEU 36 2HB LEU 36 5.811 10.419 2.228 280 HB3 LEU 36 1HB LEU 36 5.818 8.855 3.041 281 HG LEU 36 HG LEU 36 8.379 10.352 2.773 282 HD11 LEU 36 1HD1 LEU 36 6.210 10.908 4.800 283 HD12 LEU 36 2HD1 LEU 36 6.913 12.054 3.659 284 HD13 LEU 36 3HD1 LEU 36 7.884 11.425 4.991 285 HD21 LEU 36 3HD2 LEU 36 8.646 9.238 5.070 286 HD22 LEU 36 1HD2 LEU 36 8.594 8.165 3.671 287 HD23 LEU 36 2HD2 LEU 36 7.164 8.364 4.681 288 H ILE 37 H ILE 37 5.993 10.142 -0.751 289 HA ILE 37 HA ILE 37 3.653 8.412 -1.119 290 HB ILE 37 HB ILE 37 4.889 10.734 -2.635 291 HG12 ILE 37 2HG1 ILE 37 2.443 10.489 -0.853 292 HG13 ILE 37 1HG1 ILE 37 3.954 11.299 -0.435 293 HG21 ILE 37 1HG2 ILE 37 3.444 9.004 -3.963 294 HG22 ILE 37 2HG2 ILE 37 3.075 10.722 -4.125 295 HG23 ILE 37 3HG2 ILE 37 2.094 9.705 -3.070 296 HD11 ILE 37 3HD1 ILE 37 3.580 12.774 -2.482 297 HD12 ILE 37 1HD1 ILE 37 2.457 13.026 -1.147 298 HD13 ILE 37 2HD1 ILE 37 1.953 12.098 -2.559 299 H ASN 38 H ASN 38 6.912 8.720 -2.407 300 HA ASN 38 HA ASN 38 6.317 6.912 -4.666 301 HB2 ASN 38 2HB ASN 38 7.885 8.992 -4.603 302 HB3 ASN 38 1HB ASN 38 9.023 7.914 -3.793 303 HD21 ASN 38 1HD2 ASN 38 6.963 8.019 -6.758 304 HD22 ASN 38 2HD2 ASN 38 8.058 7.151 -7.723 305 H GLU 39 H GLU 39 7.502 6.782 -1.456 306 HA GLU 39 HA GLU 39 8.893 4.222 -1.741 307 HB2 GLU 39 2HB GLU 39 8.100 6.090 0.479 308 HB3 GLU 39 1HB GLU 39 8.677 4.469 0.872 309 HG2 GLU 39 2HG GLU 39 10.778 4.858 -0.216 310 HG3 GLU 39 1HG GLU 39 10.195 6.358 -0.938 311 H ALA 40 H ALA 40 5.757 5.399 -1.033 312 HA ALA 40 HA ALA 40 4.722 2.784 -0.111 313 HB1 ALA 40 1HB ALA 40 3.985 4.841 0.980 314 HB2 ALA 40 2HB ALA 40 2.621 4.146 0.109 315 HB3 ALA 40 3HB ALA 40 3.490 5.523 -0.568 316 H PHE 41 H PHE 41 4.301 5.055 -2.862 317 HA PHE 41 HA PHE 41 2.361 3.649 -4.342 318 HB2 PHE 41 2HB PHE 41 3.071 5.808 -5.042 319 HB3 PHE 41 1HB PHE 41 4.769 5.330 -5.060 320 HD1 PHE 41 1HD PHE 41 5.629 3.812 -6.837 321 HD2 PHE 41 2HD PHE 41 1.618 5.346 -6.901 322 HE1 PHE 41 1HE PHE 41 5.427 3.182 -9.226 323 HE2 PHE 41 2HE PHE 41 1.415 4.716 -9.292 324 HZ PHE 41 HZ PHE 41 3.320 3.634 -10.454 325 H ARG 42 H ARG 42 5.906 3.177 -4.282 326 HA ARG 42 HA ARG 42 5.896 1.020 -6.228 327 HB2 ARG 42 2HB ARG 42 7.907 1.770 -4.080 328 HB3 ARG 42 1HB ARG 42 8.237 0.819 -5.527 329 HG2 ARG 42 2HG ARG 42 7.870 2.688 -6.962 330 HG3 ARG 42 1HG ARG 42 7.135 3.630 -5.664 331 HD2 ARG 42 2HD ARG 42 9.219 4.540 -5.419 332 HD3 ARG 42 1HD ARG 42 9.627 3.010 -4.617 333 HE ARG 42 HE ARG 42 10.005 2.269 -7.162 334 HH11 ARG 42 1HH2 ARG 42 12.063 3.727 -5.212 335 HH12 ARG 42 2HH2 ARG 42 12.861 4.730 -6.378 336 HH21 ARG 42 1HH1 ARG 42 10.481 4.216 -8.845 337 HH22 ARG 42 2HH1 ARG 42 11.965 5.007 -8.433 338 H ALA 43 H ALA 43 6.546 0.993 -2.691 339 HA ALA 43 HA ALA 43 6.642 -1.712 -2.157 340 HB1 ALA 43 1HB ALA 43 5.013 -0.682 -0.143 341 HB2 ALA 43 2HB ALA 43 5.825 0.743 -0.792 342 HB3 ALA 43 3HB ALA 43 6.775 -0.609 -0.177 343 H LEU 44 H LEU 44 3.584 0.167 -2.307 344 HA LEU 44 HA LEU 44 1.870 -2.110 -2.026 345 HB2 LEU 44 2HB LEU 44 1.634 0.695 -3.096 346 HB3 LEU 44 1HB LEU 44 0.262 -0.411 -3.196 347 HG LEU 44 HG LEU 44 1.730 -0.031 -0.597 348 HD11 LEU 44 1HD1 LEU 44 -0.302 1.772 -1.894 349 HD12 LEU 44 2HD1 LEU 44 1.157 2.207 -1.004 350 HD13 LEU 44 3HD1 LEU 44 -0.257 1.605 -0.139 351 HD21 LEU 44 3HD2 LEU 44 0.224 -1.838 -0.491 352 HD22 LEU 44 1HD2 LEU 44 -0.962 -1.028 -1.515 353 HD23 LEU 44 2HD2 LEU 44 -0.724 -0.497 0.150 354 H HIS 45 H HIS 45 3.377 -0.569 -4.830 355 HA HIS 45 HA HIS 45 1.945 -2.130 -6.824 356 HB2 HIS 45 2HB HIS 45 2.913 -0.091 -7.546 357 HB3 HIS 45 1HB HIS 45 4.422 -0.406 -6.690 358 HD1 HIS 45 1HD HIS 45 3.049 -0.492 -10.001 359 HD2 HIS 45 2HD HIS 45 5.762 -2.877 -7.920 360 HE1 HIS 45 1HE HIS 45 4.328 -1.809 -11.745 361 H THR 46 H THR 46 4.912 -2.436 -4.963 362 HA THR 46 HA THR 46 5.844 -4.845 -6.337 363 HB THR 46 HB THR 46 6.623 -3.018 -4.130 364 HG1 THR 46 1HG THR 46 7.477 -3.288 -6.366 365 HG21 THR 46 3HG2 THR 46 6.639 -5.017 -2.800 366 HG22 THR 46 1HG2 THR 46 8.309 -4.699 -3.268 367 HG23 THR 46 2HG2 THR 46 7.383 -5.948 -4.101 368 H LEU 47 H LEU 47 3.980 -3.994 -3.466 369 HA LEU 47 HA LEU 47 3.791 -6.697 -2.405 370 HB2 LEU 47 2HB LEU 47 2.873 -3.959 -1.848 371 HB3 LEU 47 1HB LEU 47 1.681 -5.185 -1.416 372 HG LEU 47 HG LEU 47 4.585 -5.194 -0.546 373 HD11 LEU 47 1HD1 LEU 47 3.791 -3.606 0.887 374 HD12 LEU 47 2HD1 LEU 47 3.088 -4.992 1.721 375 HD13 LEU 47 3HD1 LEU 47 2.107 -4.048 0.600 376 HD21 LEU 47 3HD2 LEU 47 2.674 -6.838 0.930 377 HD22 LEU 47 1HD2 LEU 47 4.230 -7.288 0.231 378 HD23 LEU 47 2HD2 LEU 47 2.776 -7.307 -0.767 379 H LYS 48 H LYS 48 1.906 -4.654 -4.600 380 HA LYS 48 HA LYS 48 -0.473 -6.248 -4.743 381 HB2 LYS 48 2HB LYS 48 -0.514 -4.029 -5.567 382 HB3 LYS 48 1HB LYS 48 0.975 -4.251 -6.480 383 HG2 LYS 48 2HG LYS 48 -0.261 -5.911 -7.927 384 HG3 LYS 48 1HG LYS 48 -1.744 -5.425 -7.102 385 HD2 LYS 48 2HD LYS 48 -1.804 -3.932 -8.856 386 HD3 LYS 48 1HD LYS 48 -0.833 -2.994 -7.717 387 HE2 LYS 48 2HE LYS 48 0.650 -2.878 -9.457 388 HE3 LYS 48 1HE LYS 48 1.093 -4.518 -8.944 389 HZ1 LYS 48 3HZ LYS 48 -0.954 -3.773 -10.966 390 HZ2 LYS 48 1HZ LYS 48 -0.743 -5.345 -10.368 391 HZ3 LYS 48 2HZ LYS 48 0.504 -4.600 -11.249 392 H GLY 49 H GLY 49 2.615 -6.310 -6.502 393 HA2 GLY 49 2HA GLY 49 1.822 -8.316 -8.418 394 HA3 GLY 49 1HA GLY 49 3.484 -7.865 -8.037 395 H MET 50 H MET 50 3.770 -8.516 -5.415 396 HA MET 50 HA MET 50 4.136 -11.339 -5.419 397 HB2 MET 50 2HB MET 50 3.927 -9.246 -3.236 398 HB3 MET 50 1HB MET 50 4.413 -10.912 -2.918 399 HG2 MET 50 2HG MET 50 6.467 -10.627 -3.857 400 HG3 MET 50 1HG MET 50 5.837 -9.618 -5.157 401 HE1 MET 50 3HE MET 50 4.628 -8.319 -1.604 402 HE2 MET 50 1HE MET 50 6.216 -8.192 -0.834 403 HE3 MET 50 2HE MET 50 5.652 -9.744 -1.448 404 H ALA 51 H ALA 51 1.329 -9.403 -4.724 405 HA ALA 51 HA ALA 51 -0.057 -11.583 -3.277 406 HB1 ALA 51 1HB ALA 51 -0.583 -9.478 -2.413 407 HB2 ALA 51 2HB ALA 51 -1.914 -9.709 -3.547 408 HB3 ALA 51 3HB ALA 51 -0.534 -8.707 -3.998 409 H GLY 52 H GLY 52 0.397 -10.495 -6.494 410 HA2 GLY 52 2HA GLY 52 -2.145 -11.616 -7.486 411 HA3 GLY 52 1HA GLY 52 -0.884 -10.870 -8.475 412 H THR 53 H THR 53 1.328 -12.305 -7.538 413 HA THR 53 HA THR 53 1.132 -14.743 -9.067 414 HB THR 53 HB THR 53 3.114 -13.302 -7.346 415 HG1 THR 53 1HG THR 53 2.918 -14.197 -10.011 416 HG21 THR 53 3HG2 THR 53 4.762 -15.118 -7.683 417 HG22 THR 53 1HG2 THR 53 3.491 -16.128 -8.373 418 HG23 THR 53 2HG2 THR 53 3.409 -15.640 -6.679 419 H MET 54 H MET 54 0.271 -13.915 -5.911 420 HA MET 54 HA MET 54 0.624 -16.644 -4.810 421 HB2 MET 54 2HB MET 54 0.904 -14.159 -3.756 422 HB3 MET 54 1HB MET 54 -0.768 -14.495 -3.306 423 HG2 MET 54 2HG MET 54 0.722 -15.265 -1.529 424 HG3 MET 54 1HG MET 54 -0.032 -16.656 -2.309 425 HE1 MET 54 3HE MET 54 2.962 -14.337 -2.051 426 HE2 MET 54 1HE MET 54 2.817 -14.365 -3.814 427 HE3 MET 54 2HE MET 54 4.224 -15.081 -3.032 428 H GLY 55 H GLY 55 -1.570 -15.197 -6.758 429 HA2 GLY 55 2HA GLY 55 -3.722 -15.918 -7.401 430 HA3 GLY 55 1HA GLY 55 -3.650 -17.134 -6.125 431 H PHE 56 H PHE 56 -2.838 -14.204 -4.764 432 HA PHE 56 HA PHE 56 -5.601 -13.901 -3.671 433 HB2 PHE 56 2HB PHE 56 -2.950 -12.763 -2.728 434 HB3 PHE 56 1HB PHE 56 -4.456 -12.826 -1.812 435 HD1 PHE 56 1HD PHE 56 -5.168 -15.673 -3.001 436 HD2 PHE 56 2HD PHE 56 -1.740 -14.035 -0.997 437 HE1 PHE 56 1HE PHE 56 -4.573 -17.933 -2.172 438 HE2 PHE 56 2HE PHE 56 -1.145 -16.295 -0.169 439 HZ PHE 56 HZ PHE 56 -2.560 -18.244 -0.755 440 H SER 57 H SER 57 -5.735 -12.815 -6.089 441 HA SER 57 HA SER 57 -4.685 -10.157 -6.384 442 HB2 SER 57 2HB SER 57 -6.839 -11.819 -7.637 443 HB3 SER 57 1HB SER 57 -6.687 -10.120 -8.072 444 HG SER 57 HG SER 57 -4.542 -10.532 -8.676 445 H SER 58 H SER 58 -7.436 -11.459 -4.776 446 HA SER 58 HA SER 58 -9.105 -9.149 -4.589 447 HB2 SER 58 2HB SER 58 -8.620 -11.637 -2.951 448 HB3 SER 58 1HB SER 58 -9.747 -10.410 -2.379 449 HG SER 58 HG SER 58 -11.014 -11.624 -3.618 450 H MET 59 H MET 59 -6.223 -10.208 -2.924 451 HA MET 59 HA MET 59 -6.350 -7.934 -1.024 452 HB2 MET 59 2HB MET 59 -5.788 -10.132 -0.141 453 HB3 MET 59 1HB MET 59 -4.538 -10.347 -1.366 454 HG2 MET 59 2HG MET 59 -3.572 -8.116 -0.352 455 HG3 MET 59 1HG MET 59 -4.528 -8.575 1.058 456 HE1 MET 59 3HE MET 59 -2.708 -11.480 -1.329 457 HE2 MET 59 1HE MET 59 -1.143 -10.712 -1.027 458 HE3 MET 59 2HE MET 59 -2.473 -9.773 -1.702 459 H ALA 60 H ALA 60 -4.822 -8.996 -3.969 460 HA ALA 60 HA ALA 60 -2.580 -7.114 -3.817 461 HB1 ALA 60 1HB ALA 60 -3.261 -8.074 -6.469 462 HB2 ALA 60 2HB ALA 60 -3.357 -9.393 -5.301 463 HB3 ALA 60 3HB ALA 60 -1.860 -8.479 -5.479 464 H LYS 61 H LYS 61 -5.849 -7.164 -5.151 465 HA LYS 61 HA LYS 61 -5.670 -4.918 -6.892 466 HB2 LYS 61 2HB LYS 61 -7.857 -6.034 -5.103 467 HB3 LYS 61 1HB LYS 61 -8.148 -4.736 -6.263 468 HG2 LYS 61 2HG LYS 61 -7.772 -6.127 -8.107 469 HG3 LYS 61 1HG LYS 61 -6.844 -7.291 -7.159 470 HD2 LYS 61 2HD LYS 61 -9.055 -7.635 -5.838 471 HD3 LYS 61 1HD LYS 61 -9.824 -6.879 -7.234 472 HE2 LYS 61 2HE LYS 61 -8.210 -9.441 -7.167 473 HE3 LYS 61 1HE LYS 61 -9.875 -9.208 -7.733 474 HZ1 LYS 61 3HZ LYS 61 -7.356 -8.492 -9.035 475 HZ2 LYS 61 1HZ LYS 61 -8.662 -7.427 -9.237 476 HZ3 LYS 61 2HZ LYS 61 -8.808 -9.050 -9.719 477 H LEU 62 H LEU 62 -6.169 -5.249 -3.425 478 HA LEU 62 HA LEU 62 -6.581 -2.495 -2.791 479 HB2 LEU 62 2HB LEU 62 -5.378 -4.858 -1.311 480 HB3 LEU 62 1HB LEU 62 -5.756 -3.320 -0.530 481 HG LEU 62 HG LEU 62 -7.813 -4.879 -2.099 482 HD11 LEU 62 1HD1 LEU 62 -7.855 -6.398 -0.434 483 HD12 LEU 62 2HD1 LEU 62 -8.354 -5.105 0.657 484 HD13 LEU 62 3HD1 LEU 62 -6.643 -5.500 0.478 485 HD21 LEU 62 3HD2 LEU 62 -8.236 -2.471 -1.659 486 HD22 LEU 62 1HD2 LEU 62 -8.021 -2.760 0.066 487 HD23 LEU 62 2HD2 LEU 62 -9.376 -3.497 -0.789 488 H CYS 63 H CYS 63 -3.701 -4.541 -3.091 489 HA CYS 63 HA CYS 63 -1.758 -2.610 -2.277 490 HB2 CYS 63 2HB CYS 63 -1.693 -4.961 -4.194 491 HB3 CYS 63 1HB CYS 63 -0.246 -4.122 -3.633 492 HG CYS 63 HG CYS 63 -0.629 -6.090 -1.979 493 H HIS 64 H HIS 64 -3.436 -3.243 -5.296 494 HA HIS 64 HA HIS 64 -1.853 -1.312 -6.840 495 HB2 HIS 64 2HB HIS 64 -3.079 -3.496 -7.579 496 HB3 HIS 64 1HB HIS 64 -4.531 -2.498 -7.571 497 HD1 HIS 64 1HD HIS 64 -4.168 -3.236 -10.283 498 HD2 HIS 64 2HD HIS 64 -1.744 -0.237 -8.698 499 HE1 HIS 64 1HE HIS 64 -3.257 -1.934 -12.254 500 H THR 65 H THR 65 -5.032 -1.517 -5.296 501 HA THR 65 HA THR 65 -6.048 1.022 -6.185 502 HB THR 65 HB THR 65 -6.614 -1.053 -4.105 503 HG1 THR 65 1HG THR 65 -8.034 -1.451 -5.571 504 HG21 THR 65 3HG2 THR 65 -7.308 1.805 -3.827 505 HG22 THR 65 1HG2 THR 65 -7.223 0.538 -2.604 506 HG23 THR 65 2HG2 THR 65 -8.653 0.682 -3.626 507 H LEU 66 H LEU 66 -4.633 0.028 -3.048 508 HA LEU 66 HA LEU 66 -4.503 2.502 -1.742 509 HB2 LEU 66 2HB LEU 66 -2.971 -0.073 -1.823 510 HB3 LEU 66 1HB LEU 66 -2.297 1.260 -0.884 511 HG LEU 66 HG LEU 66 -4.710 1.463 0.061 512 HD11 LEU 66 1HD1 LEU 66 -5.981 -0.579 0.130 513 HD12 LEU 66 2HD1 LEU 66 -4.715 -1.447 -0.734 514 HD13 LEU 66 3HD1 LEU 66 -5.650 -0.196 -1.557 515 HD21 LEU 66 3HD2 LEU 66 -2.502 -0.399 0.734 516 HD22 LEU 66 1HD2 LEU 66 -4.031 -0.685 1.562 517 HD23 LEU 66 2HD2 LEU 66 -3.226 0.875 1.712 518 H GLU 67 H GLU 67 -2.106 0.972 -3.892 519 HA GLU 67 HA GLU 67 -0.211 3.119 -3.930 520 HB2 GLU 67 2HB GLU 67 0.478 0.953 -4.586 521 HB3 GLU 67 1HB GLU 67 -0.917 0.739 -5.638 522 HG2 GLU 67 2HG GLU 67 0.741 3.042 -6.386 523 HG3 GLU 67 1HG GLU 67 1.616 1.512 -6.462 524 H ASN 68 H ASN 68 -3.175 2.539 -5.716 525 HA ASN 68 HA ASN 68 -2.681 4.298 -7.908 526 HB2 ASN 68 2HB ASN 68 -4.833 2.833 -6.682 527 HB3 ASN 68 1HB ASN 68 -5.386 4.460 -7.069 528 HD21 ASN 68 1HD2 ASN 68 -3.746 4.895 -9.410 529 HD22 ASN 68 2HD2 ASN 68 -4.285 3.843 -10.628 530 H ILE 69 H ILE 69 -4.099 4.816 -4.686 531 HA ILE 69 HA ILE 69 -4.610 7.604 -4.954 532 HB ILE 69 HB ILE 69 -3.911 5.805 -2.629 533 HG12 ILE 69 2HG1 ILE 69 -6.358 6.345 -2.129 534 HG13 ILE 69 1HG1 ILE 69 -6.427 7.040 -3.742 535 HG21 ILE 69 1HG2 ILE 69 -4.547 8.759 -2.705 536 HG22 ILE 69 2HG2 ILE 69 -3.221 7.952 -1.868 537 HG23 ILE 69 3HG2 ILE 69 -4.872 7.786 -1.274 538 HD11 ILE 69 3HD1 ILE 69 -5.395 4.252 -3.326 539 HD12 ILE 69 1HD1 ILE 69 -6.068 4.978 -4.787 540 HD13 ILE 69 2HD1 ILE 69 -7.126 4.560 -3.439 541 H LEU 70 H LEU 70 -1.828 5.748 -4.219 542 HA LEU 70 HA LEU 70 -0.076 7.937 -3.502 543 HB2 LEU 70 2HB LEU 70 0.659 5.245 -4.678 544 HB3 LEU 70 1HB LEU 70 1.658 6.254 -3.631 545 HG LEU 70 HG LEU 70 -0.788 4.653 -2.919 546 HD11 LEU 70 1HD1 LEU 70 1.238 3.464 -2.581 547 HD12 LEU 70 2HD1 LEU 70 0.789 4.071 -0.987 548 HD13 LEU 70 3HD1 LEU 70 2.046 4.884 -1.920 549 HD21 LEU 70 3HD2 LEU 70 -1.410 6.613 -1.828 550 HD22 LEU 70 1HD2 LEU 70 0.258 7.157 -1.645 551 HD23 LEU 70 2HD2 LEU 70 -0.370 5.878 -0.607 552 H ASP 71 H ASP 71 -1.209 6.523 -6.418 553 HA ASP 71 HA ASP 71 0.839 7.723 -8.132 554 HB2 ASP 71 2HB ASP 71 -0.474 5.653 -8.671 555 HB3 ASP 71 1HB ASP 71 -1.931 6.642 -8.771 556 H LYS 72 H LYS 72 -2.452 8.497 -7.101 557 HA LYS 72 HA LYS 72 -2.705 10.910 -8.700 558 HB2 LYS 72 2HB LYS 72 -4.032 9.670 -6.318 559 HB3 LYS 72 1HB LYS 72 -4.480 11.304 -6.800 560 HG2 LYS 72 2HG LYS 72 -5.994 10.173 -8.078 561 HG3 LYS 72 1HG LYS 72 -4.617 10.019 -9.177 562 HD2 LYS 72 2HD LYS 72 -5.332 7.800 -8.918 563 HD3 LYS 72 1HD LYS 72 -4.014 7.974 -7.772 564 HE2 LYS 72 2HE LYS 72 -5.606 6.977 -6.402 565 HE3 LYS 72 1HE LYS 72 -5.962 8.695 -6.123 566 HZ1 LYS 72 3HZ LYS 72 -7.879 7.159 -6.855 567 HZ2 LYS 72 1HZ LYS 72 -7.178 7.258 -8.396 568 HZ3 LYS 72 2HZ LYS 72 -7.715 8.669 -7.617 569 H ALA 73 H ALA 73 -1.638 10.009 -5.546 570 HA ALA 73 HA ALA 73 -1.194 12.564 -4.350 571 HB1 ALA 73 1HB ALA 73 0.122 9.839 -4.112 572 HB2 ALA 73 2HB ALA 73 -1.215 10.457 -3.137 573 HB3 ALA 73 3HB ALA 73 0.394 11.156 -2.967 574 H ARG 74 H ARG 74 0.653 10.543 -6.549 575 HA ARG 74 HA ARG 74 2.968 12.380 -6.516 576 HB2 ARG 74 2HB ARG 74 3.977 10.389 -6.932 577 HB3 ARG 74 1HB ARG 74 2.405 9.610 -7.063 578 HG2 ARG 74 2HG ARG 74 2.278 10.279 -9.443 579 HG3 ARG 74 1HG ARG 74 3.865 11.037 -9.309 580 HD2 ARG 74 2HD ARG 74 4.851 8.834 -8.695 581 HD3 ARG 74 1HD ARG 74 3.256 8.084 -8.915 582 HE ARG 74 HE ARG 74 4.008 9.686 -11.213 583 HH11 ARG 74 1HH1 ARG 74 2.570 7.000 -11.199 584 HH12 ARG 74 2HH1 ARG 74 3.754 5.982 -11.947 585 HH21 ARG 74 1HH2 ARG 74 6.354 8.235 -11.509 586 HH22 ARG 74 2HH2 ARG 74 5.897 6.684 -12.129 587 H ASN 75 H ASN 75 0.031 11.836 -8.197 588 HA ASN 75 HA ASN 75 0.939 13.348 -10.607 589 HB2 ASN 75 2HB ASN 75 -0.332 11.131 -10.674 590 HB3 ASN 75 1HB ASN 75 -1.722 12.012 -10.038 591 HD21 ASN 75 1HD2 ASN 75 -2.638 11.290 -12.271 592 HD22 ASN 75 2HD2 ASN 75 -2.354 12.326 -13.586 593 H SER 76 H SER 76 -0.332 13.938 -7.590 594 HA SER 76 HA SER 76 -1.194 15.934 -6.669 595 HB2 SER 76 2HB SER 76 0.024 16.728 -8.930 596 HB3 SER 76 1HB SER 76 -1.639 17.090 -9.383 597 HG SER 76 HG SER 76 -0.522 17.877 -6.904 598 H GLU 77 H GLU 77 -2.867 13.596 -7.870 599 HA GLU 77 HA GLU 77 -5.354 15.084 -8.482 600 HB2 GLU 77 2HB GLU 77 -4.961 12.098 -8.384 601 HB3 GLU 77 1HB GLU 77 -6.172 12.992 -9.291 602 HG2 GLU 77 2HG GLU 77 -3.421 13.773 -9.965 603 HG3 GLU 77 1HG GLU 77 -3.772 12.081 -10.314 604 H ILE 78 H ILE 78 -3.841 13.236 -5.979 605 HA ILE 78 HA ILE 78 -6.157 13.858 -4.188 606 HB ILE 78 HB ILE 78 -6.073 11.584 -3.297 607 HG12 ILE 78 2HG1 ILE 78 -4.590 9.954 -4.685 608 HG13 ILE 78 1HG1 ILE 78 -3.687 11.407 -5.115 609 HG21 ILE 78 1HG2 ILE 78 -6.664 10.317 -5.426 610 HG22 ILE 78 2HG2 ILE 78 -6.223 11.775 -6.315 611 HG23 ILE 78 3HG2 ILE 78 -7.560 11.813 -5.166 612 HD11 ILE 78 3HD1 ILE 78 -4.300 11.031 -2.252 613 HD12 ILE 78 1HD1 ILE 78 -2.846 11.656 -3.034 614 HD13 ILE 78 2HD1 ILE 78 -3.136 9.918 -2.973 615 H LYS 79 H LYS 79 -5.415 13.381 -1.816 616 HA LYS 79 HA LYS 79 -2.501 13.902 -1.522 617 HB2 LYS 79 2HB LYS 79 -4.886 15.416 -0.435 618 HB3 LYS 79 1HB LYS 79 -3.292 15.552 0.308 619 HG2 LYS 79 2HG LYS 79 -4.018 16.219 -2.559 620 HG3 LYS 79 1HG LYS 79 -3.535 17.355 -1.300 621 HD2 LYS 79 2HD LYS 79 -1.850 15.315 -2.744 622 HD3 LYS 79 1HD LYS 79 -1.544 17.036 -2.514 623 HE2 LYS 79 2HE LYS 79 -1.242 16.619 -0.064 624 HE3 LYS 79 1HE LYS 79 -1.426 14.882 -0.377 625 HZ1 LYS 79 3HZ LYS 79 0.445 14.868 -1.773 626 HZ2 LYS 79 1HZ LYS 79 0.930 15.779 -0.428 627 HZ3 LYS 79 2HZ LYS 79 0.501 16.563 -1.873 628 H ILE 80 H ILE 80 -1.926 13.640 0.920 629 HA ILE 80 HA ILE 80 -3.506 11.341 2.023 630 HB ILE 80 HB ILE 80 -0.575 12.036 2.149 631 HG12 ILE 80 2HG1 ILE 80 -2.247 10.073 0.582 632 HG13 ILE 80 1HG1 ILE 80 -1.148 11.302 -0.046 633 HG21 ILE 80 1HG2 ILE 80 -1.974 10.591 4.010 634 HG22 ILE 80 2HG2 ILE 80 -0.266 10.345 3.645 635 HG23 ILE 80 3HG2 ILE 80 -1.487 9.330 2.877 636 HD11 ILE 80 3HD1 ILE 80 0.765 10.101 0.832 637 HD12 ILE 80 1HD1 ILE 80 -0.201 9.002 -0.153 638 HD13 ILE 80 2HD1 ILE 80 -0.293 8.924 1.609 639 H THR 81 H THR 81 -4.785 12.868 3.064 640 HA THR 81 HA THR 81 -3.657 14.675 5.115 641 HB THR 81 HB THR 81 -5.560 15.076 3.429 642 HG1 THR 81 1HG THR 81 -6.849 16.094 5.199 643 HG21 THR 81 3HG2 THR 81 -7.803 14.335 4.234 644 HG22 THR 81 1HG2 THR 81 -6.996 13.325 5.433 645 HG23 THR 81 2HG2 THR 81 -6.768 13.004 3.715 646 H SER 82 H SER 82 -3.529 11.654 5.426 647 HA SER 82 HA SER 82 -3.667 10.221 7.326 648 HB2 SER 82 2HB SER 82 -5.448 12.239 8.658 649 HB3 SER 82 1HB SER 82 -4.242 11.180 9.383 650 HG SER 82 HG SER 82 -2.670 12.520 8.755 651 H ASP 83 H ASP 83 -6.175 11.490 5.471 652 HA ASP 83 HA ASP 83 -8.192 9.560 6.516 653 HB2 ASP 83 2HB ASP 83 -8.718 12.022 6.353 654 HB3 ASP 83 1HB ASP 83 -8.459 11.911 4.611 655 H LEU 84 H LEU 84 -6.830 10.887 3.458 656 HA LEU 84 HA LEU 84 -7.909 8.808 1.782 657 HB2 LEU 84 2HB LEU 84 -5.421 10.536 1.517 658 HB3 LEU 84 1HB LEU 84 -6.182 9.650 0.195 659 HG LEU 84 HG LEU 84 -7.224 12.042 1.707 660 HD11 LEU 84 1HD1 LEU 84 -6.200 11.466 -0.928 661 HD12 LEU 84 2HD1 LEU 84 -6.634 13.026 -0.229 662 HD13 LEU 84 3HD1 LEU 84 -7.858 12.056 -1.051 663 HD21 LEU 84 3HD2 LEU 84 -9.068 10.484 1.819 664 HD22 LEU 84 1HD2 LEU 84 -8.825 9.995 0.142 665 HD23 LEU 84 2HD2 LEU 84 -9.418 11.614 0.512 666 H LEU 85 H LEU 85 -5.064 9.103 3.799 667 HA LEU 85 HA LEU 85 -3.887 6.588 2.848 668 HB2 LEU 85 2HB LEU 85 -2.077 7.482 3.894 669 HB3 LEU 85 1HB LEU 85 -3.068 8.907 4.186 670 HG LEU 85 HG LEU 85 -3.907 7.667 6.285 671 HD11 LEU 85 1HD1 LEU 85 -1.295 6.211 6.176 672 HD12 LEU 85 2HD1 LEU 85 -2.668 5.527 5.305 673 HD13 LEU 85 3HD1 LEU 85 -2.772 5.796 7.045 674 HD21 LEU 85 3HD2 LEU 85 -1.947 9.499 5.898 675 HD22 LEU 85 1HD2 LEU 85 -1.001 8.196 6.620 676 HD23 LEU 85 2HD2 LEU 85 -2.375 8.876 7.492 677 H ASP 86 H ASP 86 -5.968 7.740 5.434 678 HA ASP 86 HA ASP 86 -5.893 5.488 7.184 679 HB2 ASP 86 2HB ASP 86 -6.942 7.473 7.937 680 HB3 ASP 86 1HB ASP 86 -7.908 7.622 6.469 681 H LYS 87 H LYS 87 -7.636 6.093 4.170 682 HA LYS 87 HA LYS 87 -9.264 3.658 4.374 683 HB2 LYS 87 2HB LYS 87 -8.601 5.524 2.061 684 HB3 LYS 87 1HB LYS 87 -9.889 4.319 2.061 685 HG2 LYS 87 2HG LYS 87 -9.679 6.796 3.785 686 HG3 LYS 87 1HG LYS 87 -10.933 6.404 2.609 687 HD2 LYS 87 2HD LYS 87 -11.317 4.290 4.103 688 HD3 LYS 87 1HD LYS 87 -10.473 5.226 5.338 689 HE2 LYS 87 2HE LYS 87 -12.419 6.925 4.062 690 HE3 LYS 87 1HE LYS 87 -13.210 5.434 4.609 691 HZ1 LYS 87 3HZ LYS 87 -11.305 6.987 6.273 692 HZ2 LYS 87 1HZ LYS 87 -12.278 5.688 6.767 693 HZ3 LYS 87 2HZ LYS 87 -12.991 7.176 6.364 694 H ILE 88 H ILE 88 -6.450 4.773 2.487 695 HA ILE 88 HA ILE 88 -5.892 2.307 1.164 696 HB ILE 88 HB ILE 88 -4.384 4.734 2.072 697 HG12 ILE 88 2HG1 ILE 88 -4.032 3.848 -0.655 698 HG13 ILE 88 1HG1 ILE 88 -5.741 3.971 -0.231 699 HG21 ILE 88 1HG2 ILE 88 -3.018 2.409 0.721 700 HG22 ILE 88 2HG2 ILE 88 -2.867 2.764 2.443 701 HG23 ILE 88 3HG2 ILE 88 -2.283 3.922 1.250 702 HD11 ILE 88 3HD1 ILE 88 -5.591 6.207 -0.436 703 HD12 ILE 88 1HD1 ILE 88 -3.860 6.082 -0.750 704 HD13 ILE 88 2HD1 ILE 88 -4.445 6.222 0.907 705 H PHE 89 H PHE 89 -4.784 3.628 4.277 706 HA PHE 89 HA PHE 89 -3.283 1.366 5.150 707 HB2 PHE 89 2HB PHE 89 -2.959 3.434 6.261 708 HB3 PHE 89 1HB PHE 89 -4.693 3.689 6.452 709 HD1 PHE 89 1HD PHE 89 -2.241 0.966 7.304 710 HD2 PHE 89 2HD PHE 89 -5.452 3.490 8.636 711 HE1 PHE 89 1HE PHE 89 -2.160 -0.109 9.538 712 HE2 PHE 89 2HE PHE 89 -5.370 2.416 10.869 713 HZ PHE 89 HZ PHE 89 -3.724 0.616 11.320 714 H ALA 90 H ALA 90 -6.635 1.993 4.935 715 HA ALA 90 HA ALA 90 -7.524 -0.000 6.871 716 HB1 ALA 90 1HB ALA 90 -9.063 1.133 4.520 717 HB2 ALA 90 2HB ALA 90 -8.744 2.101 5.958 718 HB3 ALA 90 3HB ALA 90 -9.695 0.623 6.085 719 H GLY 91 H GLY 91 -6.841 0.236 3.439 720 HA2 GLY 91 2HA GLY 91 -7.853 -2.358 2.688 721 HA3 GLY 91 1HA GLY 91 -6.677 -1.407 1.769 722 H VAL 92 H VAL 92 -4.701 -1.092 3.710 723 HA VAL 92 HA VAL 92 -3.250 -3.571 3.546 724 HB VAL 92 HB VAL 92 -2.991 -0.872 4.820 725 HG11 VAL 92 1HG1 VAL 92 -0.635 -2.012 5.593 726 HG12 VAL 92 2HG1 VAL 92 -1.750 -3.350 5.876 727 HG13 VAL 92 3HG1 VAL 92 -2.015 -1.797 6.670 728 HG21 VAL 92 3HG2 VAL 92 -1.395 -2.614 2.938 729 HG22 VAL 92 1HG2 VAL 92 -0.704 -1.157 3.650 730 HG23 VAL 92 2HG2 VAL 92 -2.128 -1.044 2.619 731 H ASP 93 H ASP 93 -5.480 -2.166 5.820 732 HA ASP 93 HA ASP 93 -4.877 -3.792 8.125 733 HB2 ASP 93 2HB ASP 93 -6.457 -1.615 7.464 734 HB3 ASP 93 1HB ASP 93 -7.653 -2.892 7.706 735 H MET 94 H MET 94 -7.177 -4.050 5.418 736 HA MET 94 HA MET 94 -8.295 -6.585 6.314 737 HB2 MET 94 2HB MET 94 -8.264 -5.265 3.576 738 HB3 MET 94 1HB MET 94 -9.407 -6.489 4.132 739 HG2 MET 94 2HG MET 94 -9.996 -4.839 6.015 740 HG3 MET 94 1HG MET 94 -9.138 -3.629 5.062 741 HE1 MET 94 3HE MET 94 -10.678 -3.330 1.851 742 HE2 MET 94 1HE MET 94 -10.391 -5.075 1.817 743 HE3 MET 94 2HE MET 94 -9.224 -4.003 2.584 744 H ILE 95 H ILE 95 -5.767 -5.487 4.123 745 HA ILE 95 HA ILE 95 -5.089 -7.935 2.848 746 HB ILE 95 HB ILE 95 -3.897 -5.289 3.481 747 HG12 ILE 95 2HG1 ILE 95 -3.491 -6.773 0.922 748 HG13 ILE 95 1HG1 ILE 95 -5.133 -6.281 1.337 749 HG21 ILE 95 1HG2 ILE 95 -2.239 -7.739 3.213 750 HG22 ILE 95 2HG2 ILE 95 -1.878 -6.214 4.022 751 HG23 ILE 95 3HG2 ILE 95 -1.732 -6.338 2.269 752 HD11 ILE 95 3HD1 ILE 95 -2.764 -4.392 1.344 753 HD12 ILE 95 1HD1 ILE 95 -4.466 -3.965 1.517 754 HD13 ILE 95 2HD1 ILE 95 -3.862 -4.577 -0.023 755 H THR 96 H THR 96 -4.219 -6.570 6.002 756 HA THR 96 HA THR 96 -2.327 -8.663 6.710 757 HB THR 96 HB THR 96 -3.882 -6.531 8.210 758 HG1 THR 96 1HG THR 96 -2.260 -5.731 6.926 759 HG21 THR 96 3HG2 THR 96 -2.743 -7.079 10.202 760 HG22 THR 96 1HG2 THR 96 -1.576 -8.097 9.358 761 HG23 THR 96 2HG2 THR 96 -3.239 -8.646 9.564 762 H ARG 97 H ARG 97 -5.705 -7.906 7.651 763 HA ARG 97 HA ARG 97 -6.234 -10.130 9.279 764 HB2 ARG 97 2HB ARG 97 -7.707 -8.241 7.516 765 HB3 ARG 97 1HB ARG 97 -8.579 -9.706 7.962 766 HG2 ARG 97 2HG ARG 97 -8.830 -7.678 9.515 767 HG3 ARG 97 1HG ARG 97 -8.442 -9.217 10.274 768 HD2 ARG 97 2HD ARG 97 -6.078 -7.650 9.454 769 HD3 ARG 97 1HD ARG 97 -7.055 -6.898 10.723 770 HE ARG 97 HE ARG 97 -6.524 -9.773 11.086 771 HH11 ARG 97 1HH2 ARG 97 -7.223 -8.067 13.382 772 HH12 ARG 97 2HH2 ARG 97 -5.688 -7.753 14.121 773 HH21 ARG 97 1HH1 ARG 97 -3.857 -8.696 11.331 774 HH22 ARG 97 2HH1 ARG 97 -3.782 -8.107 12.958 775 H MET 98 H MET 98 -6.408 -9.809 5.738 776 HA MET 98 HA MET 98 -7.347 -12.481 5.210 777 HB2 MET 98 2HB MET 98 -5.702 -10.505 3.585 778 HB3 MET 98 1HB MET 98 -6.500 -11.931 2.920 779 HG2 MET 98 2HG MET 98 -8.627 -11.050 3.217 780 HG3 MET 98 1HG MET 98 -8.111 -9.974 4.516 781 HE1 MET 98 3HE MET 98 -9.528 -10.304 1.640 782 HE2 MET 98 1HE MET 98 -8.339 -10.124 0.343 783 HE3 MET 98 2HE MET 98 -9.391 -8.776 0.772 784 H VAL 99 H VAL 99 -4.201 -10.971 5.626 785 HA VAL 99 HA VAL 99 -2.594 -13.237 4.855 786 HB VAL 99 HB VAL 99 -2.268 -10.634 6.329 787 HG11 VAL 99 1HG1 VAL 99 0.115 -11.078 6.640 788 HG12 VAL 99 2HG1 VAL 99 -0.059 -12.679 5.920 789 HG13 VAL 99 3HG1 VAL 99 -0.814 -12.324 7.475 790 HG21 VAL 99 3HG2 VAL 99 -0.590 -11.533 4.028 791 HG22 VAL 99 1HG2 VAL 99 -1.246 -9.935 4.382 792 HG23 VAL 99 2HG2 VAL 99 -2.289 -11.188 3.708 793 H ASP 100 H ASP 100 -3.953 -12.063 7.939 794 HA ASP 100 HA ASP 100 -2.565 -13.981 9.600 795 HB2 ASP 100 2HB ASP 100 -4.002 -11.725 10.005 796 HB3 ASP 100 1HB ASP 100 -5.249 -12.923 10.354 797 H LYS 101 H LYS 101 -5.502 -14.027 7.688 798 HA LYS 101 HA LYS 101 -6.326 -16.634 8.791 799 HB2 LYS 101 2HB LYS 101 -8.333 -15.787 8.243 800 HB3 LYS 101 1HB LYS 101 -7.531 -14.348 7.630 801 HG2 LYS 101 2HG LYS 101 -7.168 -16.100 5.550 802 HG3 LYS 101 1HG LYS 101 -8.745 -16.587 6.162 803 HD2 LYS 101 2HD LYS 101 -8.832 -13.832 6.237 804 HD3 LYS 101 1HD LYS 101 -7.939 -14.182 4.755 805 HE2 LYS 101 2HE LYS 101 -10.115 -14.353 3.943 806 HE3 LYS 101 1HE LYS 101 -9.867 -16.023 4.487 807 HZ1 LYS 101 3HZ LYS 101 -11.848 -14.449 5.380 808 HZ2 LYS 101 1HZ LYS 101 -10.664 -14.167 6.560 809 HZ3 LYS 101 2HZ LYS 101 -11.196 -15.750 6.255 810 H ILE 102 H ILE 102 -5.014 -15.150 5.871 811 HA ILE 102 HA ILE 102 -5.010 -17.465 4.180 812 HB ILE 102 HB ILE 102 -3.518 -14.855 4.388 813 HG12 ILE 102 2HG1 ILE 102 -5.238 -16.112 2.227 814 HG13 ILE 102 1HG1 ILE 102 -5.799 -14.939 3.419 815 HG21 ILE 102 1HG2 ILE 102 -2.598 -15.647 2.030 816 HG22 ILE 102 2HG2 ILE 102 -2.738 -17.241 2.769 817 HG23 ILE 102 3HG2 ILE 102 -1.721 -16.010 3.515 818 HD11 ILE 102 3HD1 ILE 102 -4.588 -14.402 0.917 819 HD12 ILE 102 1HD1 ILE 102 -3.416 -13.944 2.152 820 HD13 ILE 102 2HD1 ILE 102 -5.032 -13.239 2.166 821 H VAL 103 H VAL 103 -2.859 -16.136 6.593 822 HA VAL 103 HA VAL 103 -0.708 -18.065 6.257 823 HB VAL 103 HB VAL 103 -1.607 -16.028 8.298 824 HG11 VAL 103 1HG1 VAL 103 -0.644 -17.874 9.596 825 HG12 VAL 103 2HG1 VAL 103 0.474 -16.510 9.573 826 HG13 VAL 103 3HG1 VAL 103 0.765 -17.908 8.537 827 HG21 VAL 103 3HG2 VAL 103 -0.389 -15.507 6.076 828 HG22 VAL 103 1HG2 VAL 103 1.030 -16.228 6.835 829 HG23 VAL 103 2HG2 VAL 103 0.279 -14.800 7.547 830 H SER 104 H SER 104 -3.692 -17.829 8.086 831 HA SER 104 HA SER 104 -3.164 -20.164 9.764 832 HB2 SER 104 2HB SER 104 -4.985 -17.960 9.575 833 HB3 SER 104 1HB SER 104 -5.912 -19.454 9.671 834 HG SER 104 HG SER 104 -5.502 -19.124 11.741 835 H GLU 105 H GLU 105 -4.899 -19.442 6.840 836 HA GLU 105 HA GLU 105 -5.375 -22.370 6.422 837 HB2 GLU 105 2HB GLU 105 -7.348 -20.197 5.688 838 HB3 GLU 105 1HB GLU 105 -7.638 -21.931 5.799 839 HG2 GLU 105 2HG GLU 105 -6.787 -20.344 8.219 840 HG3 GLU 105 1HG GLU 105 -8.479 -20.438 7.739 841 H GLY 106 H GLY 106 -5.075 -19.132 5.002 842 HA2 GLY 106 2HA GLY 106 -3.665 -18.826 3.005 843 HA3 GLY 106 1HA GLY 106 -4.160 -20.433 2.472 844 H SER 107 H SER 107 -6.582 -18.368 3.874 845 HA SER 107 HA SER 107 -7.751 -17.963 1.127 846 HB2 SER 107 2HB SER 107 -9.196 -17.976 3.773 847 HB3 SER 107 1HB SER 107 -9.865 -18.234 2.164 848 HG SER 107 HG SER 107 -8.119 -19.928 3.630 849 H ASP 108 H ASP 108 -8.022 -15.884 0.494 850 HA ASP 108 HA ASP 108 -7.452 -13.722 2.458 851 HB2 ASP 108 2HB ASP 108 -7.410 -12.364 0.323 852 HB3 ASP 108 1HB ASP 108 -6.252 -13.694 0.334 853 H ASP 109 H ASP 109 -10.044 -15.484 1.786 854 HA ASP 109 HA ASP 109 -12.030 -13.461 1.053 855 HB2 ASP 109 2HB ASP 109 -11.843 -16.159 0.931 856 HB3 ASP 109 1HB ASP 109 -12.806 -15.991 2.399 857 H ILE 110 H ILE 110 -11.535 -11.862 2.840 858 HA ILE 110 HA ILE 110 -12.546 -12.731 5.516 859 HB ILE 110 HB ILE 110 -11.479 -10.589 6.253 860 HG12 ILE 110 2HG1 ILE 110 -10.334 -10.400 3.470 861 HG13 ILE 110 1HG1 ILE 110 -11.837 -9.582 3.895 862 HG21 ILE 110 1HG2 ILE 110 -9.078 -11.296 5.532 863 HG22 ILE 110 2HG2 ILE 110 -9.881 -12.654 4.747 864 HG23 ILE 110 3HG2 ILE 110 -10.030 -12.429 6.490 865 HD11 ILE 110 3HD1 ILE 110 -9.464 -8.389 4.202 866 HD12 ILE 110 1HD1 ILE 110 -9.519 -9.245 5.743 867 HD13 ILE 110 2HD1 ILE 110 -10.795 -8.103 5.323 868 H GLY 111 H GLY 111 -14.137 -11.998 2.993 869 HA2 GLY 111 2HA GLY 111 -16.266 -11.018 2.705 870 HA3 GLY 111 1HA GLY 111 -16.163 -10.405 4.357 871 H GLU 112 H GLU 112 -13.362 -9.648 2.662 872 HA GLU 112 HA GLU 112 -13.675 -6.844 2.805 873 HB2 GLU 112 2HB GLU 112 -11.728 -6.866 1.241 874 HB3 GLU 112 1HB GLU 112 -11.546 -8.020 2.566 875 HG2 GLU 112 2HG GLU 112 -11.171 -9.563 0.956 876 HG3 GLU 112 1HG GLU 112 -12.909 -9.485 0.672 877 H ASN 113 H ASN 113 -13.713 -5.332 0.896 878 HA ASN 113 HA ASN 113 -15.354 -6.301 -1.404 879 HB2 ASN 113 2HB ASN 113 -15.888 -3.802 0.222 880 HB3 ASN 113 1HB ASN 113 -16.900 -4.469 -1.062 881 HD21 ASN 113 1HD2 ASN 113 -17.425 -4.054 1.947 882 HD22 ASN 113 2HD2 ASN 113 -17.964 -5.573 2.481 883 H ILE 114 H ILE 114 -13.235 -6.094 -2.509 884 HA ILE 114 HA ILE 114 -11.679 -3.734 -2.608 885 HB ILE 114 HB ILE 114 -12.201 -5.631 -4.908 886 HG12 ILE 114 2HG1 ILE 114 -11.851 -7.152 -3.148 887 HG13 ILE 114 1HG1 ILE 114 -10.219 -6.896 -3.761 888 HG21 ILE 114 1HG2 ILE 114 -9.590 -4.416 -4.005 889 HG22 ILE 114 2HG2 ILE 114 -10.675 -3.566 -5.104 890 HG23 ILE 114 3HG2 ILE 114 -9.986 -5.120 -5.572 891 HD11 ILE 114 3HD1 ILE 114 -9.971 -5.066 -2.013 892 HD12 ILE 114 1HD1 ILE 114 -10.082 -6.707 -1.375 893 HD13 ILE 114 2HD1 ILE 114 -11.486 -5.639 -1.314 894 H ASP 115 H ASP 115 -13.904 -4.739 -5.247 895 HA ASP 115 HA ASP 115 -13.989 -2.390 -6.691 896 HB2 ASP 115 2HB ASP 115 -15.430 -4.752 -6.533 897 HB3 ASP 115 1HB ASP 115 -16.653 -3.519 -6.223 898 H VAL 116 H VAL 116 -15.351 -3.004 -3.590 899 HA VAL 116 HA VAL 116 -16.852 -0.477 -3.504 900 HB VAL 116 HB VAL 116 -16.371 -2.687 -1.497 901 HG11 VAL 116 1HG1 VAL 116 -18.681 -0.764 -1.409 902 HG12 VAL 116 2HG1 VAL 116 -17.118 -0.259 -0.764 903 HG13 VAL 116 3HG1 VAL 116 -17.934 -1.670 -0.093 904 HG21 VAL 116 3HG2 VAL 116 -18.260 -2.307 -3.751 905 HG22 VAL 116 1HG2 VAL 116 -18.996 -2.849 -2.242 906 HG23 VAL 116 2HG2 VAL 116 -17.707 -3.797 -2.985 907 H PHE 117 H PHE 117 -14.298 -2.019 -1.631 908 HA PHE 117 HA PHE 117 -13.640 0.236 0.002 909 HB2 PHE 117 2HB PHE 117 -12.884 -2.385 -0.226 910 HB3 PHE 117 1HB PHE 117 -11.445 -1.568 -0.835 911 HD1 PHE 117 1HD PHE 117 -13.934 -1.260 1.964 912 HD2 PHE 117 2HD PHE 117 -9.841 -0.892 0.710 913 HE1 PHE 117 1HE PHE 117 -13.273 -0.690 4.286 914 HE2 PHE 117 2HE PHE 117 -9.181 -0.324 3.031 915 HZ PHE 117 HZ PHE 117 -10.896 -0.222 4.819 916 H SER 118 H SER 118 -12.831 -0.559 -3.306 917 HA SER 118 HA SER 118 -10.765 1.513 -3.472 918 HB2 SER 118 2HB SER 118 -10.129 -0.254 -4.807 919 HB3 SER 118 1HB SER 118 -11.794 -0.775 -5.052 920 HG SER 118 HG SER 118 -10.831 0.114 -6.951 921 H ASP 119 H ASP 119 -14.006 0.803 -4.559 922 HA ASP 119 HA ASP 119 -14.352 3.143 -6.199 923 HB2 ASP 119 2HB ASP 119 -15.790 1.214 -6.452 924 HB3 ASP 119 1HB ASP 119 -16.248 1.281 -4.751 925 H THR 120 H THR 120 -14.804 2.386 -2.860 926 HA THR 120 HA THR 120 -16.151 4.768 -2.019 927 HB THR 120 HB THR 120 -14.639 2.477 -0.882 928 HG1 THR 120 1HG THR 120 -16.850 2.382 -0.991 929 HG21 THR 120 3HG2 THR 120 -14.679 5.163 0.386 930 HG22 THR 120 1HG2 THR 120 -13.514 3.849 0.554 931 HG23 THR 120 2HG2 THR 120 -15.045 3.788 1.429 932 H ILE 121 H ILE 121 -12.811 3.773 -2.117 933 HA ILE 121 HA ILE 121 -11.703 6.310 -1.267 934 HB ILE 121 HB ILE 121 -10.934 3.602 -1.867 935 HG12 ILE 121 2HG1 ILE 121 -10.586 4.801 0.255 936 HG13 ILE 121 1HG1 ILE 121 -9.070 4.155 -0.373 937 HG21 ILE 121 1HG2 ILE 121 -9.994 4.619 -3.955 938 HG22 ILE 121 2HG2 ILE 121 -8.772 3.914 -2.897 939 HG23 ILE 121 3HG2 ILE 121 -8.995 5.663 -2.941 940 HD11 ILE 121 3HD1 ILE 121 -8.479 6.342 -1.296 941 HD12 ILE 121 1HD1 ILE 121 -8.831 6.503 0.424 942 HD13 ILE 121 2HD1 ILE 121 -10.027 7.004 -0.771 943 H LYS 122 H LYS 122 -12.175 4.681 -4.408 944 HA LYS 122 HA LYS 122 -10.935 6.709 -6.021 945 HB2 LYS 122 2HB LYS 122 -12.573 4.268 -6.288 946 HB3 LYS 122 1HB LYS 122 -12.851 5.449 -7.569 947 HG2 LYS 122 2HG LYS 122 -10.909 4.863 -8.536 948 HG3 LYS 122 1HG LYS 122 -10.053 5.365 -7.079 949 HD2 LYS 122 2HD LYS 122 -11.312 2.835 -6.585 950 HD3 LYS 122 1HD LYS 122 -10.368 2.728 -8.072 951 HE2 LYS 122 2HE LYS 122 -8.470 3.892 -6.742 952 HE3 LYS 122 1HE LYS 122 -9.406 3.454 -5.298 953 HZ1 LYS 122 3HZ LYS 122 -9.148 1.375 -7.308 954 HZ2 LYS 122 1HZ LYS 122 -9.063 1.263 -5.618 955 HZ3 LYS 122 2HZ LYS 122 -7.710 1.783 -6.503 956 H SER 123 H SER 123 -14.145 6.194 -4.699 957 HA SER 123 HA SER 123 -15.353 8.440 -6.133 958 HB2 SER 123 2HB SER 123 -16.139 6.591 -3.885 959 HB3 SER 123 1HB SER 123 -17.191 7.894 -4.425 960 HG SER 123 HG SER 123 -16.756 6.888 -6.610 961 H PHE 124 H PHE 124 -13.358 8.007 -3.448 962 HA PHE 124 HA PHE 124 -14.314 10.188 -1.778 963 HB2 PHE 124 2HB PHE 124 -12.571 8.040 -1.594 964 HB3 PHE 124 1HB PHE 124 -11.487 9.431 -1.603 965 HD1 PHE 124 2HD PHE 124 -12.084 11.400 -0.012 966 HD2 PHE 124 1HD PHE 124 -13.690 7.435 0.381 967 HE1 PHE 124 2HE PHE 124 -12.664 11.869 2.354 968 HE2 PHE 124 1HE PHE 124 -14.270 7.902 2.746 969 HZ PHE 124 HZ PHE 124 -13.756 10.120 3.733 970 H ALA 125 H ALA 125 -12.923 10.159 -4.773 971 HA ALA 125 HA ALA 125 -11.543 12.790 -4.341 972 HB1 ALA 125 1HB ALA 125 -10.243 12.091 -6.381 973 HB2 ALA 125 2HB ALA 125 -11.104 10.551 -6.341 974 HB3 ALA 125 3HB ALA 125 -10.037 10.999 -5.010 975 H SER 126 H SER 126 -14.461 11.993 -5.076 976 HA SER 126 HA SER 126 -14.634 13.777 -7.479 977 HB2 SER 126 2HB SER 126 -14.984 11.590 -8.319 978 HB3 SER 126 1HB SER 126 -15.888 11.095 -6.891 979 HG SER 126 HG SER 126 -16.669 12.834 -8.983 980 H SER 127 H SER 127 -16.276 12.431 -4.619 981 HA SER 127 HA SER 127 -18.397 14.499 -4.791 982 HB2 SER 127 2HB SER 127 -17.900 12.258 -2.807 983 HB3 SER 127 1HB SER 127 -19.394 13.175 -2.989 984 HG SER 127 HG SER 127 -19.380 11.132 -4.101 985 H GLY 128 H GLY 128 -18.763 15.988 -3.025 986 HA2 GLY 128 2HA GLY 128 -16.309 16.982 -1.807 987 HA3 GLY 128 1HA GLY 128 -17.924 17.659 -1.582 988 H LYS 129 H LYS 129 -19.372 16.512 -0.062 989 HA LYS 129 HA LYS 129 -19.801 15.428 1.996 990 HB2 LYS 129 2HB LYS 129 -18.461 13.685 0.499 991 HB3 LYS 129 1HB LYS 129 -17.200 13.964 1.701 992 HG2 LYS 129 2HG LYS 129 -18.411 12.166 2.615 993 HG3 LYS 129 1HG LYS 129 -19.093 13.565 3.444 994 HD2 LYS 129 2HD LYS 129 -21.053 12.556 2.758 995 HD3 LYS 129 1HD LYS 129 -20.733 13.547 1.334 996 HE2 LYS 129 2HE LYS 129 -19.499 11.573 0.336 997 HE3 LYS 129 1HE LYS 129 -20.099 10.599 1.694 998 HZ1 LYS 129 3HZ LYS 129 -22.240 10.767 1.001 999 HZ2 LYS 129 1HZ LYS 129 -21.500 10.915 -0.518 1000 HZ3 LYS 129 2HZ LYS 129 -22.024 12.304 0.309 1001 H GLU 130 H GLU 130 -17.361 14.474 3.614 1002 HA GLU 130 HA GLU 130 -16.148 15.402 5.426 1003 HB2 GLU 130 2HB GLU 130 -15.294 16.358 2.874 1004 HB3 GLU 130 1HB GLU 130 -15.151 17.696 4.016 1005 HG2 GLU 130 2HG GLU 130 -14.238 15.190 5.187 1006 HG3 GLU 130 1HG GLU 130 -13.344 15.587 3.719 1007 H LYS 131 H LYS 131 -15.531 18.132 5.945 1008 HA LYS 131 HA LYS 131 -18.197 19.467 6.149 1009 HB2 LYS 131 2HB LYS 131 -16.707 18.115 8.214 1010 HB3 LYS 131 1HB LYS 131 -16.800 19.835 8.596 1011 HG2 LYS 131 2HG LYS 131 -19.172 18.090 7.866 1012 HG3 LYS 131 1HG LYS 131 -18.742 18.577 9.506 1013 HD2 LYS 131 2HD LYS 131 -18.752 21.000 8.298 1014 HD3 LYS 131 1HD LYS 131 -19.962 20.170 7.318 1015 HE2 LYS 131 2HE LYS 131 -21.181 21.142 9.142 1016 HE3 LYS 131 1HE LYS 131 -21.013 19.426 9.564 1017 HZ1 LYS 131 3HZ LYS 131 -20.293 20.660 11.441 1018 HZ2 LYS 131 1HZ LYS 131 -19.333 21.689 10.495 1019 HZ3 LYS 131 2HZ LYS 131 -18.889 20.061 10.695 1020 H LEU 132 H LEU 132 -18.008 21.785 6.523 1021 HA LEU 132 HA LEU 132 -15.361 22.881 5.660 1022 HB2 LEU 132 2HB LEU 132 -17.990 23.225 4.791 1023 HB3 LEU 132 1HB LEU 132 -17.659 24.688 5.719 1024 HG LEU 132 HG LEU 132 -15.369 24.608 4.369 1025 HD11 LEU 132 1HD1 LEU 132 -15.305 23.191 2.618 1026 HD12 LEU 132 2HD1 LEU 132 -16.866 23.770 2.036 1027 HD13 LEU 132 3HD1 LEU 132 -16.796 22.466 3.222 1028 HD21 LEU 132 3HD2 LEU 132 -18.043 25.539 3.279 1029 HD22 LEU 132 1HD2 LEU 132 -16.484 26.029 2.615 1030 HD23 LEU 132 2HD2 LEU 132 -16.919 26.475 4.264 1031 H GLU 133 H GLU 133 -14.164 23.873 7.233 1032 HA GLU 133 HA GLU 133 -15.594 25.283 9.449 1033 HB2 GLU 133 2HB GLU 133 -14.789 22.859 9.921 1034 HB3 GLU 133 1HB GLU 133 -13.164 23.546 9.893 1035 HG2 GLU 133 2HG GLU 133 -13.680 23.760 12.149 1036 HG3 GLU 133 1HG GLU 133 -14.225 25.322 11.539 Start of MODEL 12 1 H1 MET 1 1HT MET 1 6.669 -30.638 0.699 2 H2 MET 1 2HT MET 1 6.922 -31.484 -0.753 3 H3 MET 1 3HT MET 1 6.824 -29.788 -0.760 4 HA MET 1 HA MET 1 8.944 -31.261 0.711 5 HB2 MET 1 2HB MET 1 9.036 -31.885 -1.630 6 HB3 MET 1 1HB MET 1 8.792 -30.211 -2.132 7 HG2 MET 1 2HG MET 1 10.940 -29.625 -0.948 8 HG3 MET 1 1HG MET 1 11.204 -31.350 -0.693 9 HE1 MET 1 2HE MET 1 13.352 -32.110 -3.467 10 HE2 MET 1 3HE MET 1 12.569 -32.591 -1.965 11 HE3 MET 1 1HE MET 1 13.578 -31.139 -2.015 12 H MET 2 H MET 2 9.177 -29.685 2.325 13 HA MET 2 HA MET 2 9.872 -27.621 3.246 14 HB2 MET 2 2HB MET 2 11.535 -28.038 1.323 15 HB3 MET 2 1HB MET 2 10.568 -26.890 0.394 16 HG2 MET 2 2HG MET 2 11.900 -25.310 1.335 17 HG3 MET 2 1HG MET 2 10.904 -25.551 2.771 18 HE1 MET 2 3HE MET 2 12.877 -27.501 5.210 19 HE2 MET 2 1HE MET 2 11.478 -27.977 4.236 20 HE3 MET 2 2HE MET 2 11.595 -26.339 4.873 21 H GLU 3 H GLU 3 8.147 -26.381 3.893 22 HA GLU 3 HA GLU 3 6.303 -25.241 1.851 23 HB2 GLU 3 2HB GLU 3 4.960 -24.726 3.900 24 HB3 GLU 3 1HB GLU 3 5.337 -26.445 3.750 25 HG2 GLU 3 2HG GLU 3 7.363 -24.840 5.189 26 HG3 GLU 3 1HG GLU 3 5.799 -24.962 5.999 27 H GLU 4 H GLU 4 9.071 -24.345 3.456 28 HA GLU 4 HA GLU 4 8.384 -21.717 4.319 29 HB2 GLU 4 2HB GLU 4 10.384 -23.121 4.965 30 HB3 GLU 4 1HB GLU 4 11.073 -22.751 3.383 31 HG2 GLU 4 2HG GLU 4 11.993 -20.976 4.481 32 HG3 GLU 4 1HG GLU 4 10.405 -20.252 4.229 33 H TYR 5 H TYR 5 8.538 -22.983 1.232 34 HA TYR 5 HA TYR 5 9.753 -20.977 -0.341 35 HB2 TYR 5 2HB TYR 5 7.791 -23.141 -0.631 36 HB3 TYR 5 1HB TYR 5 7.581 -21.844 -1.807 37 HD1 TYR 5 2HD TYR 5 10.775 -22.888 -0.221 38 HD2 TYR 5 1HD TYR 5 8.386 -22.909 -3.791 39 HE1 TYR 5 2HE TYR 5 12.711 -23.746 -1.512 40 HE2 TYR 5 1HE TYR 5 10.323 -23.766 -5.082 41 HH TYR 5 HH TYR 5 13.437 -23.657 -4.013 42 H LEU 6 H LEU 6 6.417 -21.287 0.680 43 HA LEU 6 HA LEU 6 5.725 -18.577 -0.235 44 HB2 LEU 6 2HB LEU 6 3.497 -19.236 0.679 45 HB3 LEU 6 1HB LEU 6 4.147 -20.453 -0.419 46 HG LEU 6 HG LEU 6 5.176 -21.180 2.069 47 HD11 LEU 6 1HD1 LEU 6 3.436 -19.488 2.947 48 HD12 LEU 6 2HD1 LEU 6 3.402 -21.109 3.641 49 HD13 LEU 6 3HD1 LEU 6 2.223 -20.651 2.412 50 HD21 LEU 6 3HD2 LEU 6 4.147 -23.166 1.563 51 HD22 LEU 6 1HD2 LEU 6 3.873 -22.374 0.010 52 HD23 LEU 6 2HD2 LEU 6 2.597 -22.394 1.227 53 H GLY 7 H GLY 7 6.633 -20.220 2.733 54 HA2 GLY 7 2HA GLY 7 5.695 -18.350 4.649 55 HA3 GLY 7 1HA GLY 7 7.129 -19.358 4.861 56 H VAL 8 H VAL 8 8.673 -18.367 2.694 57 HA VAL 8 HA VAL 8 9.707 -15.925 3.875 58 HB VAL 8 HB VAL 8 10.334 -17.668 1.504 59 HG11 VAL 8 1HG1 VAL 8 11.113 -15.783 0.473 60 HG12 VAL 8 2HG1 VAL 8 12.464 -15.975 1.592 61 HG13 VAL 8 3HG1 VAL 8 11.154 -14.857 1.974 62 HG21 VAL 8 3HG2 VAL 8 11.181 -18.549 3.536 63 HG22 VAL 8 1HG2 VAL 8 11.647 -16.954 4.130 64 HG23 VAL 8 2HG2 VAL 8 12.559 -17.709 2.823 65 H PHE 9 H PHE 9 8.105 -16.741 0.859 66 HA PHE 9 HA PHE 9 8.023 -14.170 -0.336 67 HB2 PHE 9 2HB PHE 9 6.435 -16.701 -0.427 68 HB3 PHE 9 1HB PHE 9 5.707 -15.272 -1.161 69 HD1 PHE 9 2HD PHE 9 9.099 -16.887 -0.991 70 HD2 PHE 9 1HD PHE 9 6.126 -14.963 -3.423 71 HE1 PHE 9 2HE PHE 9 10.545 -17.172 -2.985 72 HE2 PHE 9 1HE PHE 9 7.572 -15.248 -5.417 73 HZ PHE 9 HZ PHE 9 9.781 -16.354 -5.199 74 H VAL 10 H VAL 10 5.989 -15.661 2.144 75 HA VAL 10 HA VAL 10 4.113 -13.407 2.275 76 HB VAL 10 HB VAL 10 4.642 -15.894 3.929 77 HG11 VAL 10 1HG1 VAL 10 2.197 -14.144 4.162 78 HG12 VAL 10 2HG1 VAL 10 3.618 -13.861 5.167 79 HG13 VAL 10 3HG1 VAL 10 2.761 -15.398 5.266 80 HG21 VAL 10 3HG2 VAL 10 3.442 -16.860 2.284 81 HG22 VAL 10 1HG2 VAL 10 3.155 -15.299 1.516 82 HG23 VAL 10 2HG2 VAL 10 2.067 -15.874 2.779 83 H ASP 11 H ASP 11 6.828 -14.671 4.224 84 HA ASP 11 HA ASP 11 6.691 -12.842 6.380 85 HB2 ASP 11 2HB ASP 11 8.127 -14.844 6.278 86 HB3 ASP 11 1HB ASP 11 9.073 -14.101 4.989 87 H GLU 12 H GLU 12 7.528 -12.386 3.110 88 HA GLU 12 HA GLU 12 9.011 -9.867 3.543 89 HB2 GLU 12 2HB GLU 12 8.158 -11.550 1.181 90 HB3 GLU 12 1HB GLU 12 8.909 -9.970 0.962 91 HG2 GLU 12 2HG GLU 12 10.919 -10.664 2.041 92 HG3 GLU 12 1HG GLU 12 10.160 -12.125 2.672 93 H THR 13 H THR 13 5.851 -10.961 2.310 94 HA THR 13 HA THR 13 4.909 -8.413 1.408 95 HB THR 13 HB THR 13 4.077 -10.915 1.146 96 HG1 THR 13 1HG THR 13 2.267 -8.749 1.391 97 HG21 THR 13 3HG2 THR 13 2.416 -11.647 2.612 98 HG22 THR 13 1HG2 THR 13 2.078 -10.020 3.202 99 HG23 THR 13 2HG2 THR 13 3.539 -10.859 3.718 100 H LYS 14 H LYS 14 4.890 -9.958 4.601 101 HA LYS 14 HA LYS 14 3.181 -7.900 5.807 102 HB2 LYS 14 2HB LYS 14 4.888 -10.190 6.818 103 HB3 LYS 14 1HB LYS 14 3.961 -9.151 7.903 104 HG2 LYS 14 2HG LYS 14 2.103 -10.336 7.466 105 HG3 LYS 14 1HG LYS 14 2.254 -9.957 5.750 106 HD2 LYS 14 2HD LYS 14 2.810 -12.092 5.331 107 HD3 LYS 14 1HD LYS 14 4.222 -11.921 6.374 108 HE2 LYS 14 2HE LYS 14 2.203 -12.172 8.228 109 HE3 LYS 14 1HE LYS 14 1.646 -13.245 6.928 110 HZ1 LYS 14 3HZ LYS 14 3.450 -14.576 7.117 111 HZ2 LYS 14 1HZ LYS 14 3.449 -14.002 8.712 112 HZ3 LYS 14 2HZ LYS 14 4.491 -13.311 7.564 113 H GLU 15 H GLU 15 6.666 -8.689 5.834 114 HA GLU 15 HA GLU 15 7.490 -6.621 7.598 115 HB2 GLU 15 2HB GLU 15 9.541 -7.504 7.082 116 HB3 GLU 15 1HB GLU 15 8.595 -8.711 6.219 117 HG2 GLU 15 2HG GLU 15 8.851 -7.530 4.131 118 HG3 GLU 15 1HG GLU 15 9.596 -6.153 4.944 119 H TYR 16 H TYR 16 6.481 -6.630 4.338 120 HA TYR 16 HA TYR 16 7.544 -3.980 3.687 121 HB2 TYR 16 2HB TYR 16 6.666 -6.268 2.317 122 HB3 TYR 16 1HB TYR 16 5.482 -5.022 1.923 123 HD1 TYR 16 2HD TYR 16 7.181 -2.580 2.085 124 HD2 TYR 16 1HD TYR 16 7.967 -6.425 0.343 125 HE1 TYR 16 2HE TYR 16 8.799 -1.539 0.520 126 HE2 TYR 16 1HE TYR 16 9.585 -5.386 -1.222 127 HH TYR 16 HH TYR 16 10.489 -3.494 -1.938 128 H LEU 17 H LEU 17 4.431 -5.366 4.694 129 HA LEU 17 HA LEU 17 2.823 -3.047 4.139 130 HB2 LEU 17 2HB LEU 17 2.669 -5.308 6.158 131 HB3 LEU 17 1HB LEU 17 1.385 -4.110 5.975 132 HG LEU 17 HG LEU 17 2.458 -5.761 3.686 133 HD11 LEU 17 1HD1 LEU 17 1.042 -7.454 4.213 134 HD12 LEU 17 2HD1 LEU 17 -0.253 -6.340 4.649 135 HD13 LEU 17 3HD1 LEU 17 1.000 -6.740 5.824 136 HD21 LEU 17 3HD2 LEU 17 0.468 -3.610 4.031 137 HD22 LEU 17 1HD2 LEU 17 -0.111 -4.992 3.100 138 HD23 LEU 17 2HD2 LEU 17 1.330 -4.119 2.580 139 H GLN 18 H GLN 18 4.737 -4.073 6.915 140 HA GLN 18 HA GLN 18 4.091 -1.802 8.584 141 HB2 GLN 18 2HB GLN 18 5.105 -3.223 10.005 142 HB3 GLN 18 1HB GLN 18 5.547 -4.242 8.642 143 HG2 GLN 18 2HG GLN 18 7.631 -3.084 8.344 144 HG3 GLN 18 1HG GLN 18 7.165 -1.829 9.494 145 HE21 GLN 18 1HE2 GLN 18 6.584 -2.811 11.797 146 HE22 GLN 18 2HE2 GLN 18 7.631 -4.024 12.358 147 H ASN 19 H ASN 19 6.796 -2.690 6.556 148 HA ASN 19 HA ASN 19 8.246 -0.236 6.747 149 HB2 ASN 19 2HB ASN 19 9.337 -2.166 5.848 150 HB3 ASN 19 1HB ASN 19 8.012 -2.475 4.723 151 HD21 ASN 19 1HD2 ASN 19 10.326 0.214 5.456 152 HD22 ASN 19 2HD2 ASN 19 10.609 0.600 3.827 153 H LEU 20 H LEU 20 5.405 -1.264 5.142 154 HA LEU 20 HA LEU 20 5.292 1.081 3.348 155 HB2 LEU 20 2HB LEU 20 4.568 -0.960 2.363 156 HB3 LEU 20 1HB LEU 20 3.662 -1.417 3.805 157 HG LEU 20 HG LEU 20 2.121 0.508 3.398 158 HD11 LEU 20 1HD1 LEU 20 2.875 2.128 2.020 159 HD12 LEU 20 2HD1 LEU 20 2.559 1.026 0.680 160 HD13 LEU 20 3HD1 LEU 20 4.164 1.090 1.410 161 HD21 LEU 20 3HD2 LEU 20 1.593 -0.625 0.890 162 HD22 LEU 20 1HD2 LEU 20 0.952 -1.174 2.438 163 HD23 LEU 20 2HD2 LEU 20 2.419 -1.900 1.785 164 H ASN 21 H ASN 21 4.373 0.179 6.492 165 HA ASN 21 HA ASN 21 2.147 2.122 6.617 166 HB2 ASN 21 2HB ASN 21 3.139 -0.196 8.133 167 HB3 ASN 21 1HB ASN 21 2.691 1.173 9.158 168 HD21 ASN 21 1HD2 ASN 21 0.987 -0.799 9.618 169 HD22 ASN 21 2HD2 ASN 21 -0.468 -0.652 8.756 170 H ASP 22 H ASP 22 5.418 1.493 7.439 171 HA ASP 22 HA ASP 22 5.814 3.714 9.166 172 HB2 ASP 22 2HB ASP 22 7.352 1.602 7.872 173 HB3 ASP 22 1HB ASP 22 8.254 3.116 7.957 174 H THR 23 H THR 23 5.862 3.110 5.813 175 HA THR 23 HA THR 23 6.988 5.636 4.904 176 HB THR 23 HB THR 23 5.257 3.471 3.693 177 HG1 THR 23 1HG THR 23 7.163 2.561 4.071 178 HG21 THR 23 3HG2 THR 23 4.945 5.198 2.177 179 HG22 THR 23 1HG2 THR 23 6.427 4.483 1.541 180 HG23 THR 23 2HG2 THR 23 6.505 5.937 2.538 181 H LEU 24 H LEU 24 3.749 4.209 5.269 182 HA LEU 24 HA LEU 24 2.319 6.576 4.373 183 HB2 LEU 24 2HB LEU 24 1.620 4.021 5.847 184 HB3 LEU 24 1HB LEU 24 0.406 5.238 5.459 185 HG LEU 24 HG LEU 24 2.222 4.000 3.377 186 HD11 LEU 24 1HD1 LEU 24 0.932 2.169 4.184 187 HD12 LEU 24 2HD1 LEU 24 0.060 2.747 2.763 188 HD13 LEU 24 3HD1 LEU 24 -0.507 3.170 4.379 189 HD21 LEU 24 3HD2 LEU 24 1.258 6.139 2.725 190 HD22 LEU 24 1HD2 LEU 24 -0.341 5.621 3.261 191 HD23 LEU 24 2HD2 LEU 24 0.409 4.856 1.861 192 H LEU 25 H LEU 25 3.607 5.320 7.381 193 HA LEU 25 HA LEU 25 2.104 7.235 9.045 194 HB2 LEU 25 2HB LEU 25 4.322 5.241 9.496 195 HB3 LEU 25 1HB LEU 25 3.668 6.244 10.799 196 HG LEU 25 HG LEU 25 1.873 4.662 8.993 197 HD11 LEU 25 1HD1 LEU 25 3.503 3.738 11.328 198 HD12 LEU 25 2HD1 LEU 25 3.080 2.877 9.848 199 HD13 LEU 25 3HD1 LEU 25 1.878 3.085 11.123 200 HD21 LEU 25 3HD2 LEU 25 1.162 6.586 10.586 201 HD22 LEU 25 1HD2 LEU 25 1.462 5.425 11.881 202 HD23 LEU 25 2HD2 LEU 25 0.246 5.077 10.650 203 H GLU 26 H GLU 26 5.014 7.170 7.306 204 HA GLU 26 HA GLU 26 6.103 9.533 8.719 205 HB2 GLU 26 2HB GLU 26 7.110 7.705 6.509 206 HB3 GLU 26 1HB GLU 26 8.009 9.111 7.083 207 HG2 GLU 26 2HG GLU 26 7.087 7.332 9.239 208 HG3 GLU 26 1HG GLU 26 8.235 6.578 8.131 209 H LEU 27 H LEU 27 4.404 8.395 6.006 210 HA LEU 27 HA LEU 27 4.681 10.708 4.358 211 HB2 LEU 27 2HB LEU 27 4.147 8.580 3.374 212 HB3 LEU 27 1HB LEU 27 2.792 8.356 4.480 213 HG LEU 27 HG LEU 27 1.639 10.284 3.451 214 HD11 LEU 27 1HD1 LEU 27 3.916 10.247 1.450 215 HD12 LEU 27 2HD1 LEU 27 3.752 11.438 2.737 216 HD13 LEU 27 3HD1 LEU 27 2.538 11.348 1.464 217 HD21 LEU 27 3HD2 LEU 27 1.567 9.171 1.036 218 HD22 LEU 27 1HD2 LEU 27 0.898 8.332 2.436 219 HD23 LEU 27 2HD2 LEU 27 2.505 7.911 1.840 220 H GLU 28 H GLU 28 2.616 9.690 6.986 221 HA GLU 28 HA GLU 28 0.505 11.640 6.600 222 HB2 GLU 28 2HB GLU 28 1.566 10.182 9.053 223 HB3 GLU 28 1HB GLU 28 0.025 11.037 8.983 224 HG2 GLU 28 2HG GLU 28 0.235 9.228 6.748 225 HG3 GLU 28 1HG GLU 28 0.528 8.354 8.249 226 H LYS 29 H LYS 29 3.568 11.528 8.418 227 HA LYS 29 HA LYS 29 3.247 14.176 9.568 228 HB2 LYS 29 2HB LYS 29 4.973 13.393 10.797 229 HB3 LYS 29 1HB LYS 29 4.862 11.913 9.855 230 HG2 LYS 29 2HG LYS 29 6.330 13.398 8.143 231 HG3 LYS 29 1HG LYS 29 6.833 14.129 9.670 232 HD2 LYS 29 2HD LYS 29 6.768 11.163 9.160 233 HD3 LYS 29 1HD LYS 29 8.213 12.149 8.948 234 HE2 LYS 29 2HE LYS 29 6.660 12.119 11.548 235 HE3 LYS 29 1HE LYS 29 7.991 10.990 11.226 236 HZ1 LYS 29 3HZ LYS 29 9.023 13.320 10.381 237 HZ2 LYS 29 1HZ LYS 29 9.280 12.679 11.929 238 HZ3 LYS 29 2HZ LYS 29 8.073 13.850 11.685 239 H ASN 30 H ASN 30 4.284 12.844 6.632 240 HA ASN 30 HA ASN 30 4.752 15.534 5.485 241 HB2 ASN 30 2HB ASN 30 6.840 13.774 6.227 242 HB3 ASN 30 1HB ASN 30 6.685 13.596 4.478 243 HD21 ASN 30 1HD2 ASN 30 6.113 16.532 6.471 244 HD22 ASN 30 2HD2 ASN 30 7.297 17.471 5.698 245 HA PRO 31 HA PRO 31 2.247 12.722 3.003 246 HB2 PRO 31 2HB PRO 31 -0.006 14.236 3.090 247 HB3 PRO 31 1HB PRO 31 0.461 13.103 4.367 248 HG2 PRO 31 2HG PRO 31 0.517 16.029 4.370 249 HG3 PRO 31 1HG PRO 31 0.386 14.889 5.715 250 HD2 PRO 31 2HD PRO 31 2.698 16.264 4.839 251 HD3 PRO 31 1HD PRO 31 2.581 15.026 6.108 252 H GLU 32 H GLU 32 4.032 15.187 2.346 253 HA GLU 32 HA GLU 32 2.755 15.746 -0.297 254 HB2 GLU 32 2HB GLU 32 4.433 17.915 0.678 255 HB3 GLU 32 1HB GLU 32 2.750 17.974 0.162 256 HG2 GLU 32 2HG GLU 32 1.986 17.302 2.359 257 HG3 GLU 32 1HG GLU 32 3.644 17.005 2.888 258 H ASP 33 H ASP 33 5.266 14.401 1.352 259 HA ASP 33 HA ASP 33 7.453 15.233 -0.394 260 HB2 ASP 33 2HB ASP 33 7.524 14.601 2.101 261 HB3 ASP 33 1HB ASP 33 7.382 12.929 1.558 262 H MET 34 H MET 34 7.978 14.186 -2.288 263 HA MET 34 HA MET 34 6.327 12.013 -3.267 264 HB2 MET 34 2HB MET 34 8.691 13.622 -4.179 265 HB3 MET 34 1HB MET 34 8.249 12.172 -5.080 266 HG2 MET 34 2HG MET 34 5.823 13.193 -4.962 267 HG3 MET 34 1HG MET 34 6.689 14.705 -4.692 268 HE1 MET 34 3HE MET 34 5.600 12.803 -8.437 269 HE2 MET 34 1HE MET 34 4.823 14.117 -7.544 270 HE3 MET 34 2HE MET 34 5.081 12.555 -6.772 271 H GLU 35 H GLU 35 8.795 11.942 -1.043 272 HA GLU 35 HA GLU 35 10.174 9.546 -2.033 273 HB2 GLU 35 2HB GLU 35 10.360 11.504 0.153 274 HB3 GLU 35 1HB GLU 35 10.729 9.860 0.673 275 HG2 GLU 35 2HG GLU 35 12.267 9.702 -1.359 276 HG3 GLU 35 1HG GLU 35 12.061 11.447 -1.530 277 H LEU 36 H LEU 36 8.144 10.232 0.852 278 HA LEU 36 HA LEU 36 7.654 7.453 1.415 279 HB2 LEU 36 2HB LEU 36 5.819 9.770 2.070 280 HB3 LEU 36 1HB LEU 36 6.114 8.321 3.025 281 HG LEU 36 HG LEU 36 7.788 10.784 2.749 282 HD11 LEU 36 1HD1 LEU 36 8.180 9.631 5.218 283 HD12 LEU 36 2HD1 LEU 36 6.528 9.153 4.831 284 HD13 LEU 36 3HD1 LEU 36 6.970 10.861 4.854 285 HD21 LEU 36 3HD2 LEU 36 9.593 9.471 2.201 286 HD22 LEU 36 1HD2 LEU 36 8.822 7.995 2.780 287 HD23 LEU 36 2HD2 LEU 36 9.568 9.107 3.927 288 H ILE 37 H ILE 37 6.298 9.785 -0.794 289 HA ILE 37 HA ILE 37 3.828 8.338 -1.338 290 HB ILE 37 HB ILE 37 5.428 10.593 -2.539 291 HG12 ILE 37 2HG1 ILE 37 2.611 10.401 -1.433 292 HG13 ILE 37 1HG1 ILE 37 4.015 10.975 -0.534 293 HG21 ILE 37 1HG2 ILE 37 3.098 10.699 -3.941 294 HG22 ILE 37 2HG2 ILE 37 3.337 8.954 -3.846 295 HG23 ILE 37 3HG2 ILE 37 4.581 9.976 -4.566 296 HD11 ILE 37 3HD1 ILE 37 2.877 12.220 -3.054 297 HD12 ILE 37 1HD1 ILE 37 4.337 12.766 -2.229 298 HD13 ILE 37 2HD1 ILE 37 2.772 12.886 -1.424 299 H ASN 38 H ASN 38 7.126 8.429 -2.644 300 HA ASN 38 HA ASN 38 6.393 6.551 -4.808 301 HB2 ASN 38 2HB ASN 38 8.799 8.162 -4.002 302 HB3 ASN 38 1HB ASN 38 8.986 6.842 -5.157 303 HD21 ASN 38 1HD2 ASN 38 9.531 8.698 -6.707 304 HD22 ASN 38 2HD2 ASN 38 8.243 9.496 -7.472 305 H GLU 39 H GLU 39 7.800 6.544 -1.666 306 HA GLU 39 HA GLU 39 9.132 3.974 -1.872 307 HB2 GLU 39 2HB GLU 39 8.227 5.801 0.352 308 HB3 GLU 39 1HB GLU 39 8.921 4.221 0.714 309 HG2 GLU 39 2HG GLU 39 10.705 5.201 -1.128 310 HG3 GLU 39 1HG GLU 39 10.239 6.666 -0.262 311 H ALA 40 H ALA 40 5.945 5.084 -1.383 312 HA ALA 40 HA ALA 40 4.925 2.496 -0.374 313 HB1 ALA 40 1HB ALA 40 4.244 5.054 0.104 314 HB2 ALA 40 2HB ALA 40 3.062 3.748 0.187 315 HB3 ALA 40 3HB ALA 40 3.175 4.747 -1.263 316 H PHE 41 H PHE 41 4.230 4.673 -3.164 317 HA PHE 41 HA PHE 41 2.663 2.941 -4.711 318 HB2 PHE 41 2HB PHE 41 3.035 5.221 -5.357 319 HB3 PHE 41 1HB PHE 41 4.783 4.990 -5.403 320 HD1 PHE 41 1HD PHE 41 5.751 3.363 -7.127 321 HD2 PHE 41 2HD PHE 41 1.712 4.818 -7.277 322 HE1 PHE 41 1HE PHE 41 5.608 2.723 -9.519 323 HE2 PHE 41 2HE PHE 41 1.571 4.178 -9.667 324 HZ PHE 41 HZ PHE 41 3.519 3.132 -10.789 325 H ARG 42 H ARG 42 6.164 2.933 -4.214 326 HA ARG 42 HA ARG 42 6.674 0.928 -6.286 327 HB2 ARG 42 2HB ARG 42 8.888 1.401 -5.795 328 HB3 ARG 42 1HB ARG 42 8.133 2.856 -5.161 329 HG2 ARG 42 2HG ARG 42 9.560 2.178 -3.418 330 HG3 ARG 42 1HG ARG 42 7.989 1.557 -2.921 331 HD2 ARG 42 2HD ARG 42 8.894 -0.519 -2.837 332 HD3 ARG 42 1HD ARG 42 9.172 -0.429 -4.589 333 HE ARG 42 HE ARG 42 11.181 1.128 -3.334 334 HH11 ARG 42 1HH1 ARG 42 10.632 -1.851 -4.732 335 HH12 ARG 42 2HH1 ARG 42 11.971 -2.656 -3.984 336 HH21 ARG 42 1HH2 ARG 42 12.694 -0.025 -1.843 337 HH22 ARG 42 2HH2 ARG 42 13.138 -1.621 -2.345 338 H ALA 43 H ALA 43 6.285 0.984 -2.768 339 HA ALA 43 HA ALA 43 6.938 -1.829 -2.361 340 HB1 ALA 43 1HB ALA 43 5.690 0.426 -0.810 341 HB2 ALA 43 2HB ALA 43 7.181 -0.453 -0.475 342 HB3 ALA 43 3HB ALA 43 5.621 -1.214 -0.164 343 H LEU 44 H LEU 44 3.939 0.013 -2.846 344 HA LEU 44 HA LEU 44 2.223 -2.295 -2.439 345 HB2 LEU 44 2HB LEU 44 1.958 0.504 -3.521 346 HB3 LEU 44 1HB LEU 44 0.614 -0.634 -3.655 347 HG LEU 44 HG LEU 44 1.951 -0.429 -1.003 348 HD11 LEU 44 1HD1 LEU 44 0.102 1.690 -2.137 349 HD12 LEU 44 2HD1 LEU 44 1.767 1.924 -1.603 350 HD13 LEU 44 3HD1 LEU 44 0.511 1.533 -0.428 351 HD21 LEU 44 3HD2 LEU 44 0.081 -1.982 -1.412 352 HD22 LEU 44 1HD2 LEU 44 -0.930 -0.637 -1.938 353 HD23 LEU 44 2HD2 LEU 44 -0.395 -0.735 -0.260 354 H HIS 45 H HIS 45 3.338 -0.522 -5.361 355 HA HIS 45 HA HIS 45 2.091 -2.117 -7.321 356 HB2 HIS 45 2HB HIS 45 3.531 0.033 -7.469 357 HB3 HIS 45 1HB HIS 45 4.919 -1.055 -7.505 358 HD1 HIS 45 1HD HIS 45 5.419 -2.237 -9.692 359 HD2 HIS 45 2HD HIS 45 1.704 -0.344 -9.724 360 HE1 HIS 45 1HE HIS 45 4.559 -2.386 -12.069 361 H THR 46 H THR 46 4.991 -2.682 -5.391 362 HA THR 46 HA THR 46 5.741 -5.091 -6.835 363 HB THR 46 HB THR 46 6.820 -3.301 -4.909 364 HG1 THR 46 1HG THR 46 7.880 -5.673 -6.035 365 HG21 THR 46 3HG2 THR 46 7.857 -5.000 -3.331 366 HG22 THR 46 1HG2 THR 46 6.646 -6.148 -3.899 367 HG23 THR 46 2HG2 THR 46 6.143 -4.678 -3.065 368 H LEU 47 H LEU 47 4.123 -4.311 -3.785 369 HA LEU 47 HA LEU 47 3.617 -7.029 -2.959 370 HB2 LEU 47 2HB LEU 47 3.134 -4.260 -2.169 371 HB3 LEU 47 1HB LEU 47 1.747 -5.296 -1.798 372 HG LEU 47 HG LEU 47 4.583 -6.062 -1.093 373 HD11 LEU 47 1HD1 LEU 47 3.693 -5.361 1.280 374 HD12 LEU 47 2HD1 LEU 47 2.605 -4.326 0.356 375 HD13 LEU 47 3HD1 LEU 47 4.351 -4.130 0.200 376 HD21 LEU 47 3HD2 LEU 47 2.106 -7.415 -1.047 377 HD22 LEU 47 1HD2 LEU 47 2.453 -7.003 0.632 378 HD23 LEU 47 2HD2 LEU 47 3.616 -7.942 -0.304 379 H LYS 48 H LYS 48 1.968 -4.734 -5.034 380 HA LYS 48 HA LYS 48 -0.621 -5.990 -5.116 381 HB2 LYS 48 2HB LYS 48 0.442 -3.624 -5.822 382 HB3 LYS 48 1HB LYS 48 0.547 -4.425 -7.387 383 HG2 LYS 48 2HG LYS 48 -1.937 -4.032 -5.708 384 HG3 LYS 48 1HG LYS 48 -1.572 -3.269 -7.257 385 HD2 LYS 48 2HD LYS 48 -1.883 -6.243 -6.803 386 HD3 LYS 48 1HD LYS 48 -3.086 -5.195 -7.562 387 HE2 LYS 48 2HE LYS 48 -0.745 -4.613 -8.959 388 HE3 LYS 48 1HE LYS 48 -0.678 -6.370 -8.732 389 HZ1 LYS 48 3HZ LYS 48 -2.958 -4.802 -9.816 390 HZ2 LYS 48 1HZ LYS 48 -3.035 -6.455 -9.437 391 HZ3 LYS 48 2HZ LYS 48 -1.995 -5.914 -10.666 392 H GLY 49 H GLY 49 2.407 -6.323 -6.926 393 HA2 GLY 49 2HA GLY 49 1.297 -8.028 -8.996 394 HA3 GLY 49 1HA GLY 49 3.013 -7.778 -8.677 395 H MET 50 H MET 50 3.735 -8.848 -6.494 396 HA MET 50 HA MET 50 3.533 -11.641 -6.686 397 HB2 MET 50 2HB MET 50 4.536 -11.616 -4.455 398 HB3 MET 50 1HB MET 50 5.214 -10.300 -5.415 399 HG2 MET 50 2HG MET 50 4.318 -8.714 -4.075 400 HG3 MET 50 1HG MET 50 2.767 -9.548 -3.994 401 HE1 MET 50 3HE MET 50 5.268 -8.660 -0.783 402 HE2 MET 50 1HE MET 50 5.256 -8.099 -2.462 403 HE3 MET 50 2HE MET 50 6.423 -9.313 -1.941 404 H ALA 51 H ALA 51 1.193 -9.423 -5.424 405 HA ALA 51 HA ALA 51 -0.166 -11.475 -3.782 406 HB1 ALA 51 1HB ALA 51 -0.168 -9.272 -2.885 407 HB2 ALA 51 2HB ALA 51 -1.787 -9.471 -3.554 408 HB3 ALA 51 3HB ALA 51 -0.572 -8.555 -4.444 409 H GLY 52 H GLY 52 -0.300 -10.121 -6.985 410 HA2 GLY 52 2HA GLY 52 -3.046 -11.046 -7.469 411 HA3 GLY 52 1HA GLY 52 -1.994 -10.265 -8.649 412 H THR 53 H THR 53 -1.327 -13.130 -6.663 413 HA THR 53 HA THR 53 -1.855 -15.173 -8.476 414 HB THR 53 HB THR 53 0.469 -13.466 -9.149 415 HG1 THR 53 1HG THR 53 -1.610 -14.312 -10.335 416 HG21 THR 53 3HG2 THR 53 1.917 -15.197 -8.623 417 HG22 THR 53 1HG2 THR 53 1.486 -15.637 -10.276 418 HG23 THR 53 2HG2 THR 53 0.702 -16.443 -8.916 419 H MET 54 H MET 54 0.328 -13.825 -6.199 420 HA MET 54 HA MET 54 0.843 -16.522 -5.009 421 HB2 MET 54 2HB MET 54 2.462 -14.272 -5.745 422 HB3 MET 54 1HB MET 54 2.571 -14.520 -4.006 423 HG2 MET 54 2HG MET 54 3.015 -16.663 -6.105 424 HG3 MET 54 1HG MET 54 4.292 -15.843 -5.207 425 HE1 MET 54 3HE MET 54 3.857 -15.331 -2.816 426 HE2 MET 54 1HE MET 54 4.914 -16.698 -2.436 427 HE3 MET 54 2HE MET 54 3.377 -16.508 -1.596 428 H GLY 55 H GLY 55 -0.646 -13.519 -4.655 429 HA2 GLY 55 2HA GLY 55 -1.212 -14.080 -1.780 430 HA3 GLY 55 1HA GLY 55 -0.815 -12.440 -2.313 431 H PHE 56 H PHE 56 -2.456 -14.297 -4.617 432 HA PHE 56 HA PHE 56 -4.657 -14.215 -5.472 433 HB2 PHE 56 2HB PHE 56 -4.997 -13.725 -2.520 434 HB3 PHE 56 1HB PHE 56 -6.391 -13.618 -3.591 435 HD1 PHE 56 2HD PHE 56 -6.353 -15.639 -5.457 436 HD2 PHE 56 1HD PHE 56 -4.695 -15.784 -1.497 437 HE1 PHE 56 2HE PHE 56 -6.520 -18.113 -5.478 438 HE2 PHE 56 1HE PHE 56 -4.862 -18.258 -1.518 439 HZ PHE 56 HZ PHE 56 -5.774 -19.423 -3.507 440 H SER 57 H SER 57 -5.215 -12.597 -6.838 441 HA SER 57 HA SER 57 -4.453 -9.908 -6.589 442 HB2 SER 57 2HB SER 57 -6.745 -11.173 -8.104 443 HB3 SER 57 1HB SER 57 -6.083 -9.578 -8.441 444 HG SER 57 HG SER 57 -5.281 -11.722 -9.526 445 H SER 58 H SER 58 -7.029 -11.557 -5.085 446 HA SER 58 HA SER 58 -8.921 -9.468 -4.728 447 HB2 SER 58 2HB SER 58 -8.142 -11.674 -2.795 448 HB3 SER 58 1HB SER 58 -9.695 -10.844 -2.868 449 HG SER 58 HG SER 58 -10.077 -11.778 -4.849 450 H MET 59 H MET 59 -5.986 -10.369 -2.987 451 HA MET 59 HA MET 59 -6.286 -8.068 -1.153 452 HB2 MET 59 2HB MET 59 -5.578 -10.184 -0.200 453 HB3 MET 59 1HB MET 59 -4.316 -10.361 -1.420 454 HG2 MET 59 2HG MET 59 -3.520 -8.022 -0.448 455 HG3 MET 59 1HG MET 59 -4.399 -8.570 0.978 456 HE1 MET 59 3HE MET 59 -1.954 -11.362 -1.341 457 HE2 MET 59 1HE MET 59 -0.927 -9.923 -1.285 458 HE3 MET 59 2HE MET 59 -2.586 -9.805 -1.869 459 H ALA 60 H ALA 60 -4.802 -8.952 -4.114 460 HA ALA 60 HA ALA 60 -2.630 -6.983 -3.955 461 HB1 ALA 60 1HB ALA 60 -3.435 -8.095 -6.566 462 HB2 ALA 60 2HB ALA 60 -3.125 -9.317 -5.331 463 HB3 ALA 60 3HB ALA 60 -1.870 -8.155 -5.757 464 H LYS 61 H LYS 61 -5.915 -7.192 -5.321 465 HA LYS 61 HA LYS 61 -5.715 -4.788 -6.928 466 HB2 LYS 61 2HB LYS 61 -8.001 -6.258 -5.564 467 HB3 LYS 61 1HB LYS 61 -8.245 -4.905 -6.671 468 HG2 LYS 61 2HG LYS 61 -7.696 -6.141 -8.515 469 HG3 LYS 61 1HG LYS 61 -6.482 -7.084 -7.645 470 HD2 LYS 61 2HD LYS 61 -8.273 -8.598 -8.137 471 HD3 LYS 61 1HD LYS 61 -8.409 -8.204 -6.421 472 HE2 LYS 61 2HE LYS 61 -10.627 -7.993 -7.294 473 HE3 LYS 61 1HE LYS 61 -10.020 -6.331 -7.152 474 HZ1 LYS 61 3HZ LYS 61 -11.014 -7.130 -9.401 475 HZ2 LYS 61 1HZ LYS 61 -9.501 -7.869 -9.607 476 HZ3 LYS 61 2HZ LYS 61 -9.601 -6.187 -9.397 477 H LEU 62 H LEU 62 -6.287 -5.559 -3.591 478 HA LEU 62 HA LEU 62 -7.178 -2.965 -2.699 479 HB2 LEU 62 2HB LEU 62 -7.515 -5.101 -1.504 480 HB3 LEU 62 1HB LEU 62 -5.765 -5.289 -1.340 481 HG LEU 62 HG LEU 62 -5.643 -3.253 -0.008 482 HD11 LEU 62 1HD1 LEU 62 -7.361 -1.887 -0.928 483 HD12 LEU 62 2HD1 LEU 62 -7.891 -2.238 0.717 484 HD13 LEU 62 3HD1 LEU 62 -8.594 -3.115 -0.642 485 HD21 LEU 62 3HD2 LEU 62 -6.051 -4.604 1.748 486 HD22 LEU 62 1HD2 LEU 62 -7.060 -5.638 0.738 487 HD23 LEU 62 2HD2 LEU 62 -7.774 -4.266 1.584 488 H CYS 63 H CYS 63 -4.042 -4.573 -3.104 489 HA CYS 63 HA CYS 63 -2.452 -2.512 -1.829 490 HB2 CYS 63 2HB CYS 63 -1.797 -4.651 -3.886 491 HB3 CYS 63 1HB CYS 63 -0.606 -3.761 -2.939 492 HG CYS 63 HG CYS 63 -2.683 -5.727 -1.664 493 H HIS 64 H HIS 64 -3.703 -3.064 -5.080 494 HA HIS 64 HA HIS 64 -2.052 -1.045 -6.378 495 HB2 HIS 64 2HB HIS 64 -3.423 -3.076 -7.325 496 HB3 HIS 64 1HB HIS 64 -4.786 -1.958 -7.279 497 HD1 HIS 64 1HD HIS 64 -1.459 -2.503 -8.963 498 HD2 HIS 64 2HD HIS 64 -4.683 0.131 -9.190 499 HE1 HIS 64 1HE HIS 64 -1.119 -1.134 -11.066 500 H THR 65 H THR 65 -5.120 -1.172 -4.700 501 HA THR 65 HA THR 65 -6.166 1.392 -5.441 502 HB THR 65 HB THR 65 -6.767 0.532 -2.726 503 HG1 THR 65 1HG THR 65 -7.014 -1.378 -4.801 504 HG21 THR 65 3HG2 THR 65 -8.439 1.728 -3.806 505 HG22 THR 65 1HG2 THR 65 -8.995 0.070 -4.024 506 HG23 THR 65 2HG2 THR 65 -8.172 0.905 -5.342 507 H LEU 66 H LEU 66 -4.424 0.411 -2.450 508 HA LEU 66 HA LEU 66 -4.152 3.022 -1.332 509 HB2 LEU 66 2HB LEU 66 -2.048 0.844 -1.178 510 HB3 LEU 66 1HB LEU 66 -2.532 1.979 0.076 511 HG LEU 66 HG LEU 66 -3.939 -0.498 -0.877 512 HD11 LEU 66 1HD1 LEU 66 -4.259 -0.654 1.662 513 HD12 LEU 66 2HD1 LEU 66 -3.149 0.712 1.775 514 HD13 LEU 66 3HD1 LEU 66 -2.606 -0.809 1.067 515 HD21 LEU 66 3HD2 LEU 66 -5.894 0.661 -0.918 516 HD22 LEU 66 1HD2 LEU 66 -5.184 2.058 -0.108 517 HD23 LEU 66 2HD2 LEU 66 -5.741 0.678 0.839 518 H GLU 67 H GLU 67 -2.273 1.256 -3.747 519 HA GLU 67 HA GLU 67 -0.096 3.161 -3.960 520 HB2 GLU 67 2HB GLU 67 0.137 0.859 -4.658 521 HB3 GLU 67 1HB GLU 67 -1.247 0.993 -5.740 522 HG2 GLU 67 2HG GLU 67 0.756 3.034 -6.300 523 HG3 GLU 67 1HG GLU 67 1.433 1.410 -6.424 524 H ASN 68 H ASN 68 -3.121 2.608 -5.752 525 HA ASN 68 HA ASN 68 -2.885 4.481 -7.821 526 HB2 ASN 68 2HB ASN 68 -4.916 3.065 -6.332 527 HB3 ASN 68 1HB ASN 68 -5.477 4.684 -6.743 528 HD21 ASN 68 1HD2 ASN 68 -3.270 2.549 -8.615 529 HD22 ASN 68 2HD2 ASN 68 -4.258 2.480 -9.994 530 H ILE 69 H ILE 69 -3.809 4.967 -4.437 531 HA ILE 69 HA ILE 69 -4.348 7.791 -4.649 532 HB ILE 69 HB ILE 69 -3.376 6.268 -2.232 533 HG12 ILE 69 2HG1 ILE 69 -5.301 5.161 -3.606 534 HG13 ILE 69 1HG1 ILE 69 -5.510 5.358 -1.873 535 HG21 ILE 69 1HG2 ILE 69 -4.768 8.841 -2.745 536 HG22 ILE 69 2HG2 ILE 69 -3.644 8.405 -1.457 537 HG23 ILE 69 3HG2 ILE 69 -5.335 7.913 -1.359 538 HD11 ILE 69 3HD1 ILE 69 -7.297 6.192 -3.768 539 HD12 ILE 69 1HD1 ILE 69 -6.373 7.667 -3.477 540 HD13 ILE 69 2HD1 ILE 69 -7.187 6.856 -2.138 541 H LEU 70 H LEU 70 -1.678 5.807 -3.899 542 HA LEU 70 HA LEU 70 0.190 7.967 -3.362 543 HB2 LEU 70 2HB LEU 70 0.636 5.056 -4.099 544 HB3 LEU 70 1HB LEU 70 1.833 6.125 -3.364 545 HG LEU 70 HG LEU 70 -0.840 5.658 -2.067 546 HD11 LEU 70 1HD1 LEU 70 -0.273 3.529 -1.631 547 HD12 LEU 70 2HD1 LEU 70 1.085 4.149 -0.693 548 HD13 LEU 70 3HD1 LEU 70 1.302 3.744 -2.395 549 HD21 LEU 70 3HD2 LEU 70 1.226 7.402 -1.545 550 HD22 LEU 70 1HD2 LEU 70 1.575 6.061 -0.453 551 HD23 LEU 70 2HD2 LEU 70 0.017 6.883 -0.370 552 H ASP 71 H ASP 71 -1.248 6.638 -6.103 553 HA ASP 71 HA ASP 71 0.954 7.377 -7.930 554 HB2 ASP 71 2HB ASP 71 -0.477 5.369 -8.326 555 HB3 ASP 71 1HB ASP 71 -1.896 6.415 -8.408 556 H LYS 72 H LYS 72 -2.376 8.389 -7.134 557 HA LYS 72 HA LYS 72 -2.183 10.782 -8.798 558 HB2 LYS 72 2HB LYS 72 -4.092 11.117 -6.693 559 HB3 LYS 72 1HB LYS 72 -4.409 10.778 -8.390 560 HG2 LYS 72 2HG LYS 72 -4.075 8.348 -7.910 561 HG3 LYS 72 1HG LYS 72 -3.935 8.749 -6.195 562 HD2 LYS 72 2HD LYS 72 -6.214 10.067 -7.021 563 HD3 LYS 72 1HD LYS 72 -6.284 8.512 -7.849 564 HE2 LYS 72 2HE LYS 72 -5.835 7.365 -5.676 565 HE3 LYS 72 1HE LYS 72 -5.911 8.947 -4.873 566 HZ1 LYS 72 3HZ LYS 72 -8.117 9.029 -6.377 567 HZ2 LYS 72 1HZ LYS 72 -8.108 8.497 -4.768 568 HZ3 LYS 72 2HZ LYS 72 -8.056 7.366 -6.034 569 H ALA 73 H ALA 73 -1.399 9.812 -5.597 570 HA ALA 73 HA ALA 73 -1.022 12.334 -4.312 571 HB1 ALA 73 1HB ALA 73 -1.018 10.180 -3.148 572 HB2 ALA 73 2HB ALA 73 0.546 10.956 -2.906 573 HB3 ALA 73 3HB ALA 73 0.379 9.655 -4.085 574 H ARG 74 H ARG 74 0.997 10.343 -6.413 575 HA ARG 74 HA ARG 74 3.201 12.312 -6.286 576 HB2 ARG 74 2HB ARG 74 4.413 10.629 -7.548 577 HB3 ARG 74 1HB ARG 74 3.518 9.800 -6.277 578 HG2 ARG 74 2HG ARG 74 1.980 8.894 -7.762 579 HG3 ARG 74 1HG ARG 74 2.222 10.165 -8.958 580 HD2 ARG 74 2HD ARG 74 4.654 9.199 -9.132 581 HD3 ARG 74 1HD ARG 74 3.931 7.746 -8.413 582 HE ARG 74 HE ARG 74 2.122 8.322 -10.361 583 HH11 ARG 74 1HH1 ARG 74 4.277 9.908 -11.751 584 HH12 ARG 74 2HH1 ARG 74 4.976 8.715 -12.795 585 HH21 ARG 74 1HH2 ARG 74 3.572 6.031 -11.103 586 HH22 ARG 74 2HH2 ARG 74 4.580 6.518 -12.426 587 H ASN 75 H ASN 75 0.389 11.617 -8.115 588 HA ASN 75 HA ASN 75 1.390 12.982 -10.564 589 HB2 ASN 75 2HB ASN 75 -0.671 11.096 -9.833 590 HB3 ASN 75 1HB ASN 75 -1.394 12.463 -10.677 591 HD21 ASN 75 1HD2 ASN 75 -0.405 13.029 -12.842 592 HD22 ASN 75 2HD2 ASN 75 0.314 11.795 -13.758 593 H SER 76 H SER 76 0.292 13.966 -7.611 594 HA SER 76 HA SER 76 -0.396 16.106 -6.871 595 HB2 SER 76 2HB SER 76 0.882 16.607 -9.142 596 HB3 SER 76 1HB SER 76 -0.741 16.954 -9.729 597 HG SER 76 HG SER 76 0.860 18.430 -8.150 598 H GLU 77 H GLU 77 -2.280 13.892 -7.441 599 HA GLU 77 HA GLU 77 -4.677 15.465 -8.262 600 HB2 GLU 77 2HB GLU 77 -4.891 12.536 -8.008 601 HB3 GLU 77 1HB GLU 77 -5.479 13.585 -9.289 602 HG2 GLU 77 2HG GLU 77 -2.547 12.906 -8.959 603 HG3 GLU 77 1HG GLU 77 -3.643 11.950 -9.950 604 H ILE 78 H ILE 78 -3.240 13.516 -5.782 605 HA ILE 78 HA ILE 78 -5.486 14.276 -3.949 606 HB ILE 78 HB ILE 78 -5.592 11.938 -3.205 607 HG12 ILE 78 2HG1 ILE 78 -4.204 10.393 -4.912 608 HG13 ILE 78 1HG1 ILE 78 -3.163 11.820 -4.907 609 HG21 ILE 78 1HG2 ILE 78 -6.935 12.677 -5.201 610 HG22 ILE 78 2HG2 ILE 78 -6.551 10.956 -5.212 611 HG23 ILE 78 3HG2 ILE 78 -5.642 12.068 -6.236 612 HD11 ILE 78 3HD1 ILE 78 -2.407 11.371 -2.852 613 HD12 ILE 78 1HD1 ILE 78 -3.204 9.802 -2.977 614 HD13 ILE 78 2HD1 ILE 78 -4.043 11.158 -2.226 615 H LYS 79 H LYS 79 -4.778 14.600 -1.801 616 HA LYS 79 HA LYS 79 -1.857 14.161 -1.321 617 HB2 LYS 79 2HB LYS 79 -3.686 16.310 -0.195 618 HB3 LYS 79 1HB LYS 79 -1.935 16.223 -0.009 619 HG2 LYS 79 2HG LYS 79 -3.456 16.631 -2.600 620 HG3 LYS 79 1HG LYS 79 -2.463 17.825 -1.767 621 HD2 LYS 79 2HD LYS 79 -1.571 15.316 -3.185 622 HD3 LYS 79 1HD LYS 79 -1.052 16.974 -3.470 623 HE2 LYS 79 2HE LYS 79 0.082 17.016 -1.285 624 HE3 LYS 79 1HE LYS 79 -0.473 15.360 -0.962 625 HZ1 LYS 79 3HZ LYS 79 1.512 14.896 -1.956 626 HZ2 LYS 79 1HZ LYS 79 1.513 16.307 -2.897 627 HZ3 LYS 79 2HZ LYS 79 0.541 14.987 -3.348 628 H ILE 80 H ILE 80 -1.316 13.189 0.677 629 HA ILE 80 HA ILE 80 -3.270 11.577 1.986 630 HB ILE 80 HB ILE 80 -0.497 12.519 2.526 631 HG12 ILE 80 2HG1 ILE 80 -0.030 10.133 2.282 632 HG13 ILE 80 1HG1 ILE 80 -1.760 9.789 2.247 633 HG21 ILE 80 1HG2 ILE 80 -2.274 11.046 4.465 634 HG22 ILE 80 2HG2 ILE 80 -1.315 12.495 4.765 635 HG23 ILE 80 3HG2 ILE 80 -0.515 10.942 4.536 636 HD11 ILE 80 3HD1 ILE 80 -0.680 9.866 -0.034 637 HD12 ILE 80 1HD1 ILE 80 -0.371 11.582 0.240 638 HD13 ILE 80 2HD1 ILE 80 -2.029 10.984 0.169 639 H THR 81 H THR 81 -4.975 12.730 2.639 640 HA THR 81 HA THR 81 -4.689 15.025 4.506 641 HB THR 81 HB THR 81 -7.019 15.348 3.985 642 HG1 THR 81 1HG THR 81 -8.094 13.653 2.765 643 HG21 THR 81 3HG2 THR 81 -5.102 15.302 2.031 644 HG22 THR 81 1HG2 THR 81 -6.752 15.878 1.787 645 HG23 THR 81 2HG2 THR 81 -6.321 14.223 1.352 646 H SER 82 H SER 82 -4.018 12.162 5.226 647 HA SER 82 HA SER 82 -4.316 10.829 7.172 648 HB2 SER 82 2HB SER 82 -5.180 11.959 8.985 649 HB3 SER 82 1HB SER 82 -5.105 13.343 7.896 650 HG SER 82 HG SER 82 -7.206 13.343 7.788 651 H ASP 83 H ASP 83 -7.451 12.155 6.045 652 HA ASP 83 HA ASP 83 -8.991 9.786 6.412 653 HB2 ASP 83 2HB ASP 83 -9.166 12.211 4.617 654 HB3 ASP 83 1HB ASP 83 -10.451 11.005 4.703 655 H LEU 84 H LEU 84 -7.205 11.053 3.550 656 HA LEU 84 HA LEU 84 -8.032 8.996 1.724 657 HB2 LEU 84 2HB LEU 84 -5.424 10.553 1.951 658 HB3 LEU 84 1HB LEU 84 -5.956 9.679 0.516 659 HG LEU 84 HG LEU 84 -7.086 12.195 1.720 660 HD11 LEU 84 1HD1 LEU 84 -5.360 12.054 -0.196 661 HD12 LEU 84 2HD1 LEU 84 -6.784 13.061 -0.463 662 HD13 LEU 84 3HD1 LEU 84 -6.695 11.452 -1.179 663 HD21 LEU 84 3HD2 LEU 84 -9.072 11.920 0.251 664 HD22 LEU 84 1HD2 LEU 84 -9.006 10.668 1.491 665 HD23 LEU 84 2HD2 LEU 84 -8.524 10.295 -0.165 666 H LEU 85 H LEU 85 -5.620 9.225 4.221 667 HA LEU 85 HA LEU 85 -4.350 6.651 3.625 668 HB2 LEU 85 2HB LEU 85 -4.320 8.659 5.889 669 HB3 LEU 85 1HB LEU 85 -3.343 7.188 5.926 670 HG LEU 85 HG LEU 85 -3.182 9.495 3.989 671 HD11 LEU 85 1HD1 LEU 85 -0.692 9.108 4.689 672 HD12 LEU 85 2HD1 LEU 85 -1.387 8.189 6.021 673 HD13 LEU 85 3HD1 LEU 85 -1.781 9.897 5.831 674 HD21 LEU 85 3HD2 LEU 85 -2.407 6.633 3.641 675 HD22 LEU 85 1HD2 LEU 85 -1.246 7.846 3.102 676 HD23 LEU 85 2HD2 LEU 85 -2.875 7.825 2.427 677 H ASP 86 H ASP 86 -6.584 7.943 6.075 678 HA ASP 86 HA ASP 86 -6.990 5.723 7.711 679 HB2 ASP 86 2HB ASP 86 -8.057 8.175 7.477 680 HB3 ASP 86 1HB ASP 86 -9.378 7.251 6.761 681 H LYS 87 H LYS 87 -8.104 6.206 4.402 682 HA LYS 87 HA LYS 87 -9.783 3.764 4.494 683 HB2 LYS 87 2HB LYS 87 -9.066 5.629 2.205 684 HB3 LYS 87 1HB LYS 87 -10.406 4.480 2.248 685 HG2 LYS 87 2HG LYS 87 -10.071 6.920 4.015 686 HG3 LYS 87 1HG LYS 87 -11.264 6.708 2.734 687 HD2 LYS 87 2HD LYS 87 -11.592 4.458 4.354 688 HD3 LYS 87 1HD LYS 87 -11.339 5.779 5.493 689 HE2 LYS 87 2HE LYS 87 -13.135 6.500 3.275 690 HE3 LYS 87 1HE LYS 87 -13.760 5.196 4.304 691 HZ1 LYS 87 3HZ LYS 87 -12.780 7.862 5.161 692 HZ2 LYS 87 1HZ LYS 87 -13.047 6.584 6.244 693 HZ3 LYS 87 2HZ LYS 87 -14.344 7.224 5.354 694 H ILE 88 H ILE 88 -6.893 5.028 2.840 695 HA ILE 88 HA ILE 88 -6.204 2.615 1.454 696 HB ILE 88 HB ILE 88 -4.695 5.017 2.496 697 HG12 ILE 88 2HG1 ILE 88 -5.040 4.320 -0.379 698 HG13 ILE 88 1HG1 ILE 88 -6.444 4.927 0.499 699 HG21 ILE 88 1HG2 ILE 88 -3.645 2.501 1.511 700 HG22 ILE 88 2HG2 ILE 88 -2.793 3.871 2.224 701 HG23 ILE 88 3HG2 ILE 88 -3.156 3.859 0.498 702 HD11 ILE 88 3HD1 ILE 88 -4.300 6.576 1.276 703 HD12 ILE 88 1HD1 ILE 88 -5.642 7.007 0.216 704 HD13 ILE 88 2HD1 ILE 88 -4.140 6.383 -0.468 705 H PHE 89 H PHE 89 -5.904 3.666 4.750 706 HA PHE 89 HA PHE 89 -3.963 1.594 5.521 707 HB2 PHE 89 2HB PHE 89 -4.278 4.006 6.443 708 HB3 PHE 89 1HB PHE 89 -5.644 3.329 7.327 709 HD1 PHE 89 2HD PHE 89 -5.104 1.026 8.576 710 HD2 PHE 89 1HD PHE 89 -2.192 3.987 7.478 711 HE1 PHE 89 2HE PHE 89 -3.553 0.136 10.294 712 HE2 PHE 89 1HE PHE 89 -0.641 3.098 9.197 713 HZ PHE 89 HZ PHE 89 -1.321 1.173 10.605 714 H ALA 90 H ALA 90 -7.359 2.139 5.467 715 HA ALA 90 HA ALA 90 -8.138 -0.025 7.244 716 HB1 ALA 90 1HB ALA 90 -9.519 1.590 5.068 717 HB2 ALA 90 2HB ALA 90 -9.642 1.835 6.809 718 HB3 ALA 90 3HB ALA 90 -10.364 0.407 6.068 719 H GLY 91 H GLY 91 -7.278 0.402 3.905 720 HA2 GLY 91 2HA GLY 91 -8.272 -2.147 2.948 721 HA3 GLY 91 1HA GLY 91 -7.089 -1.118 2.128 722 H VAL 92 H VAL 92 -5.104 -0.876 3.968 723 HA VAL 92 HA VAL 92 -3.627 -3.317 3.774 724 HB VAL 92 HB VAL 92 -3.467 -0.739 5.333 725 HG11 VAL 92 1HG1 VAL 92 -1.952 -3.269 5.841 726 HG12 VAL 92 2HG1 VAL 92 -2.433 -2.004 6.972 727 HG13 VAL 92 3HG1 VAL 92 -1.058 -1.749 5.898 728 HG21 VAL 92 3HG2 VAL 92 -2.119 -0.132 3.626 729 HG22 VAL 92 1HG2 VAL 92 -2.619 -1.614 2.811 730 HG23 VAL 92 2HG2 VAL 92 -1.151 -1.598 3.788 731 H ASP 93 H ASP 93 -5.981 -2.101 6.023 732 HA ASP 93 HA ASP 93 -5.398 -3.771 8.292 733 HB2 ASP 93 2HB ASP 93 -7.091 -1.697 7.653 734 HB3 ASP 93 1HB ASP 93 -8.211 -3.062 7.682 735 H MET 94 H MET 94 -7.518 -4.122 5.452 736 HA MET 94 HA MET 94 -8.444 -6.772 6.211 737 HB2 MET 94 2HB MET 94 -8.407 -5.411 3.497 738 HB3 MET 94 1HB MET 94 -9.501 -6.692 4.023 739 HG2 MET 94 2HG MET 94 -10.136 -5.011 5.928 740 HG3 MET 94 1HG MET 94 -9.447 -3.801 4.846 741 HE1 MET 94 3HE MET 94 -9.758 -3.956 2.420 742 HE2 MET 94 1HE MET 94 -11.351 -4.015 1.654 743 HE3 MET 94 2HE MET 94 -10.420 -5.494 1.873 744 H ILE 95 H ILE 95 -6.029 -5.444 3.960 745 HA ILE 95 HA ILE 95 -5.098 -7.828 2.769 746 HB ILE 95 HB ILE 95 -4.190 -5.071 3.307 747 HG12 ILE 95 2HG1 ILE 95 -3.487 -6.743 0.915 748 HG13 ILE 95 1HG1 ILE 95 -5.160 -6.245 1.167 749 HG21 ILE 95 1HG2 ILE 95 -2.218 -6.117 4.221 750 HG22 ILE 95 2HG2 ILE 95 -1.826 -5.579 2.588 751 HG23 ILE 95 3HG2 ILE 95 -2.161 -7.283 2.898 752 HD11 ILE 95 3HD1 ILE 95 -2.730 -4.472 0.855 753 HD12 ILE 95 1HD1 ILE 95 -4.280 -3.870 1.441 754 HD13 ILE 95 2HD1 ILE 95 -4.153 -4.542 -0.184 755 H THR 96 H THR 96 -4.345 -6.368 5.913 756 HA THR 96 HA THR 96 -2.301 -8.293 6.648 757 HB THR 96 HB THR 96 -3.998 -6.214 8.034 758 HG1 THR 96 1HG THR 96 -1.374 -6.523 7.149 759 HG21 THR 96 3HG2 THR 96 -2.170 -6.819 9.930 760 HG22 THR 96 1HG2 THR 96 -2.427 -8.423 9.243 761 HG23 THR 96 2HG2 THR 96 -3.789 -7.516 9.903 762 H ARG 97 H ARG 97 -5.774 -7.894 7.377 763 HA ARG 97 HA ARG 97 -5.968 -10.282 9.002 764 HB2 ARG 97 2HB ARG 97 -7.988 -8.595 7.488 765 HB3 ARG 97 1HB ARG 97 -8.428 -9.860 8.635 766 HG2 ARG 97 2HG ARG 97 -7.748 -8.637 10.461 767 HG3 ARG 97 1HG ARG 97 -6.473 -7.812 9.563 768 HD2 ARG 97 2HD ARG 97 -7.843 -6.029 9.312 769 HD3 ARG 97 1HD ARG 97 -8.975 -7.049 8.402 770 HE ARG 97 HE ARG 97 -9.162 -6.406 11.269 771 HH11 ARG 97 1HH2 ARG 97 -11.180 -6.839 8.825 772 HH12 ARG 97 2HH2 ARG 97 -12.126 -8.124 9.500 773 HH21 ARG 97 1HH1 ARG 97 -9.902 -8.766 12.078 774 HH22 ARG 97 2HH1 ARG 97 -11.404 -9.213 11.339 775 H MET 98 H MET 98 -6.173 -9.602 5.562 776 HA MET 98 HA MET 98 -7.417 -12.112 4.788 777 HB2 MET 98 2HB MET 98 -5.778 -9.967 3.404 778 HB3 MET 98 1HB MET 98 -6.442 -11.350 2.538 779 HG2 MET 98 2HG MET 98 -8.619 -10.626 2.766 780 HG3 MET 98 1HG MET 98 -8.292 -9.775 4.277 781 HE1 MET 98 3HE MET 98 -9.501 -7.797 0.906 782 HE2 MET 98 1HE MET 98 -9.757 -9.411 1.583 783 HE3 MET 98 2HE MET 98 -8.607 -9.176 0.270 784 H VAL 99 H VAL 99 -4.168 -10.920 5.336 785 HA VAL 99 HA VAL 99 -2.890 -13.331 4.279 786 HB VAL 99 HB VAL 99 -2.062 -10.726 5.550 787 HG11 VAL 99 1HG1 VAL 99 -0.375 -12.058 6.461 788 HG12 VAL 99 2HG1 VAL 99 0.327 -11.644 4.897 789 HG13 VAL 99 3HG1 VAL 99 -0.434 -13.218 5.133 790 HG21 VAL 99 3HG2 VAL 99 -2.692 -11.286 3.005 791 HG22 VAL 99 1HG2 VAL 99 -1.002 -11.790 2.968 792 HG23 VAL 99 2HG2 VAL 99 -1.419 -10.136 3.413 793 H ASP 100 H ASP 100 -3.700 -11.914 7.430 794 HA ASP 100 HA ASP 100 -2.160 -13.762 9.034 795 HB2 ASP 100 2HB ASP 100 -4.173 -11.654 9.331 796 HB3 ASP 100 1HB ASP 100 -4.416 -12.963 10.489 797 H LYS 101 H LYS 101 -5.306 -13.813 7.515 798 HA LYS 101 HA LYS 101 -6.061 -16.363 8.781 799 HB2 LYS 101 2HB LYS 101 -8.164 -15.760 8.072 800 HB3 LYS 101 1HB LYS 101 -7.425 -14.171 7.892 801 HG2 LYS 101 2HG LYS 101 -8.472 -14.571 5.802 802 HG3 LYS 101 1HG LYS 101 -6.770 -14.954 5.530 803 HD2 LYS 101 2HD LYS 101 -7.378 -16.973 4.861 804 HD3 LYS 101 1HD LYS 101 -7.902 -17.315 6.506 805 HE2 LYS 101 2HE LYS 101 -9.696 -15.886 4.523 806 HE3 LYS 101 1HE LYS 101 -9.696 -17.652 4.706 807 HZ1 LYS 101 3HZ LYS 101 -10.053 -17.366 7.085 808 HZ2 LYS 101 1HZ LYS 101 -11.307 -16.644 6.202 809 HZ3 LYS 101 2HZ LYS 101 -10.092 -15.678 6.894 810 H ILE 102 H ILE 102 -4.439 -15.184 5.972 811 HA ILE 102 HA ILE 102 -4.896 -17.516 4.281 812 HB ILE 102 HB ILE 102 -3.420 -14.972 4.305 813 HG12 ILE 102 2HG1 ILE 102 -4.524 -16.467 1.940 814 HG13 ILE 102 1HG1 ILE 102 -5.587 -15.646 3.082 815 HG21 ILE 102 1HG2 ILE 102 -1.574 -16.652 3.952 816 HG22 ILE 102 2HG2 ILE 102 -1.811 -15.540 2.604 817 HG23 ILE 102 3HG2 ILE 102 -2.430 -17.189 2.505 818 HD11 ILE 102 3HD1 ILE 102 -4.350 -14.470 0.896 819 HD12 ILE 102 1HD1 ILE 102 -3.338 -13.974 2.252 820 HD13 ILE 102 2HD1 ILE 102 -5.064 -13.611 2.259 821 H VAL 103 H VAL 103 -2.151 -16.269 6.204 822 HA VAL 103 HA VAL 103 -0.488 -18.586 5.981 823 HB VAL 103 HB VAL 103 -0.855 -16.301 7.925 824 HG11 VAL 103 1HG1 VAL 103 -0.068 -17.776 9.513 825 HG12 VAL 103 2HG1 VAL 103 1.473 -17.301 8.798 826 HG13 VAL 103 3HG1 VAL 103 0.707 -18.816 8.318 827 HG21 VAL 103 3HG2 VAL 103 1.714 -16.973 6.561 828 HG22 VAL 103 1HG2 VAL 103 0.989 -15.396 6.876 829 HG23 VAL 103 2HG2 VAL 103 0.392 -16.392 5.548 830 H SER 104 H SER 104 -3.288 -17.739 7.875 831 HA SER 104 HA SER 104 -3.107 -19.982 9.737 832 HB2 SER 104 2HB SER 104 -4.735 -17.606 9.213 833 HB3 SER 104 1HB SER 104 -5.676 -18.979 9.788 834 HG SER 104 HG SER 104 -3.260 -18.435 11.069 835 H GLU 105 H GLU 105 -5.506 -19.061 7.326 836 HA GLU 105 HA GLU 105 -6.243 -21.941 6.977 837 HB2 GLU 105 2HB GLU 105 -7.661 -19.533 5.832 838 HB3 GLU 105 1HB GLU 105 -8.342 -21.101 6.261 839 HG2 GLU 105 2HG GLU 105 -7.213 -19.119 8.257 840 HG3 GLU 105 1HG GLU 105 -8.929 -19.313 7.902 841 H GLY 106 H GLY 106 -5.330 -19.042 5.149 842 HA2 GLY 106 2HA GLY 106 -3.789 -19.237 3.238 843 HA3 GLY 106 1HA GLY 106 -4.501 -20.816 2.894 844 H SER 107 H SER 107 -6.555 -18.142 3.798 845 HA SER 107 HA SER 107 -7.388 -17.833 0.923 846 HB2 SER 107 2HB SER 107 -9.661 -17.570 2.534 847 HB3 SER 107 1HB SER 107 -9.263 -18.926 1.486 848 HG SER 107 HG SER 107 -8.301 -19.951 3.196 849 H ASP 108 H ASP 108 -7.467 -15.756 0.308 850 HA ASP 108 HA ASP 108 -7.227 -13.592 2.307 851 HB2 ASP 108 2HB ASP 108 -6.949 -12.220 0.296 852 HB3 ASP 108 1HB ASP 108 -5.993 -13.691 0.110 853 H ASP 109 H ASP 109 -9.730 -15.446 1.504 854 HA ASP 109 HA ASP 109 -11.723 -13.408 0.773 855 HB2 ASP 109 2HB ASP 109 -11.477 -16.336 1.051 856 HB3 ASP 109 1HB ASP 109 -13.071 -15.699 1.453 857 H ILE 110 H ILE 110 -11.593 -11.981 2.648 858 HA ILE 110 HA ILE 110 -12.697 -13.162 5.180 859 HB ILE 110 HB ILE 110 -11.566 -11.262 6.269 860 HG12 ILE 110 2HG1 ILE 110 -10.126 -10.429 3.837 861 HG13 ILE 110 1HG1 ILE 110 -11.840 -10.030 3.831 862 HG21 ILE 110 1HG2 ILE 110 -9.737 -12.658 4.289 863 HG22 ILE 110 2HG2 ILE 110 -10.266 -13.335 5.828 864 HG23 ILE 110 3HG2 ILE 110 -9.240 -11.901 5.803 865 HD11 ILE 110 3HD1 ILE 110 -11.319 -8.245 5.110 866 HD12 ILE 110 1HD1 ILE 110 -9.679 -8.837 5.377 867 HD13 ILE 110 2HD1 ILE 110 -10.995 -9.385 6.416 868 H GLY 111 H GLY 111 -14.227 -12.232 2.775 869 HA2 GLY 111 2HA GLY 111 -16.258 -11.072 2.467 870 HA3 GLY 111 1HA GLY 111 -16.168 -10.565 4.157 871 H GLU 112 H GLU 112 -13.265 -9.898 2.639 872 HA GLU 112 HA GLU 112 -13.232 -7.146 2.948 873 HB2 GLU 112 2HB GLU 112 -11.508 -7.278 1.075 874 HB3 GLU 112 1HB GLU 112 -11.271 -8.421 2.399 875 HG2 GLU 112 2HG GLU 112 -11.322 -10.084 0.879 876 HG3 GLU 112 1HG GLU 112 -13.023 -9.704 0.617 877 H ASN 113 H ASN 113 -13.035 -5.567 0.963 878 HA ASN 113 HA ASN 113 -15.039 -6.066 -1.163 879 HB2 ASN 113 2HB ASN 113 -15.222 -3.680 0.691 880 HB3 ASN 113 1HB ASN 113 -16.407 -4.206 -0.505 881 HD21 ASN 113 1HD2 ASN 113 -15.065 -4.936 2.701 882 HD22 ASN 113 2HD2 ASN 113 -16.283 -6.031 3.151 883 H ILE 114 H ILE 114 -12.754 -5.951 -2.181 884 HA ILE 114 HA ILE 114 -11.297 -3.481 -2.256 885 HB ILE 114 HB ILE 114 -11.464 -6.040 -3.799 886 HG12 ILE 114 2HG1 ILE 114 -9.164 -6.231 -3.095 887 HG13 ILE 114 1HG1 ILE 114 -9.120 -4.535 -2.611 888 HG21 ILE 114 1HG2 ILE 114 -9.778 -5.279 -5.405 889 HG22 ILE 114 2HG2 ILE 114 -9.835 -3.652 -4.721 890 HG23 ILE 114 3HG2 ILE 114 -11.241 -4.306 -5.563 891 HD11 ILE 114 3HD1 ILE 114 -10.763 -6.743 -1.349 892 HD12 ILE 114 1HD1 ILE 114 -10.937 -5.035 -0.945 893 HD13 ILE 114 2HD1 ILE 114 -9.417 -5.871 -0.618 894 H ASP 115 H ASP 115 -13.360 -4.901 -4.847 895 HA ASP 115 HA ASP 115 -13.488 -2.754 -6.587 896 HB2 ASP 115 2HB ASP 115 -15.156 -5.029 -5.817 897 HB3 ASP 115 1HB ASP 115 -16.109 -3.691 -6.459 898 H VAL 116 H VAL 116 -14.940 -3.082 -3.485 899 HA VAL 116 HA VAL 116 -16.525 -0.612 -3.720 900 HB VAL 116 HB VAL 116 -16.097 -2.697 -1.574 901 HG11 VAL 116 1HG1 VAL 116 -17.980 -0.314 -1.599 902 HG12 VAL 116 2HG1 VAL 116 -16.591 -0.523 -0.531 903 HG13 VAL 116 3HG1 VAL 116 -17.984 -1.598 -0.390 904 HG21 VAL 116 3HG2 VAL 116 -18.161 -2.165 -3.687 905 HG22 VAL 116 1HG2 VAL 116 -18.670 -2.915 -2.174 906 HG23 VAL 116 2HG2 VAL 116 -17.451 -3.697 -3.180 907 H PHE 117 H PHE 117 -14.022 -1.879 -1.606 908 HA PHE 117 HA PHE 117 -13.479 0.565 -0.210 909 HB2 PHE 117 2HB PHE 117 -12.085 -2.043 -0.729 910 HB3 PHE 117 1HB PHE 117 -11.180 -0.741 0.041 911 HD1 PHE 117 2HD PHE 117 -14.824 -1.464 0.368 912 HD2 PHE 117 1HD PHE 117 -10.974 -1.519 2.273 913 HE1 PHE 117 2HE PHE 117 -15.904 -1.984 2.540 914 HE2 PHE 117 1HE PHE 117 -12.054 -2.040 4.442 915 HZ PHE 117 HZ PHE 117 -14.519 -2.272 4.576 916 H SER 118 H SER 118 -12.726 -0.447 -3.406 917 HA SER 118 HA SER 118 -10.463 1.383 -3.715 918 HB2 SER 118 2HB SER 118 -10.434 -0.875 -4.719 919 HB3 SER 118 1HB SER 118 -11.921 -0.504 -5.584 920 HG SER 118 HG SER 118 -10.696 0.340 -7.055 921 H ASP 119 H ASP 119 -13.770 0.901 -4.693 922 HA ASP 119 HA ASP 119 -13.888 3.329 -6.319 923 HB2 ASP 119 2HB ASP 119 -15.214 1.177 -6.647 924 HB3 ASP 119 1HB ASP 119 -16.142 1.636 -5.219 925 H THR 120 H THR 120 -14.522 2.329 -3.095 926 HA THR 120 HA THR 120 -16.068 4.598 -2.215 927 HB THR 120 HB THR 120 -14.481 2.351 -1.027 928 HG1 THR 120 1HG THR 120 -16.697 2.430 0.133 929 HG21 THR 120 3HG2 THR 120 -14.951 4.942 0.262 930 HG22 THR 120 1HG2 THR 120 -13.862 3.633 0.722 931 HG23 THR 120 2HG2 THR 120 -15.562 3.572 1.190 932 H ILE 121 H ILE 121 -12.706 3.706 -2.174 933 HA ILE 121 HA ILE 121 -11.707 6.161 -0.992 934 HB ILE 121 HB ILE 121 -10.847 3.551 -1.872 935 HG12 ILE 121 2HG1 ILE 121 -9.564 5.668 -0.133 936 HG13 ILE 121 1HG1 ILE 121 -10.649 4.387 0.404 937 HG21 ILE 121 1HG2 ILE 121 -8.536 4.151 -2.573 938 HG22 ILE 121 2HG2 ILE 121 -9.034 5.841 -2.666 939 HG23 ILE 121 3HG2 ILE 121 -9.757 4.646 -3.746 940 HD11 ILE 121 3HD1 ILE 121 -8.533 3.486 0.870 941 HD12 ILE 121 1HD1 ILE 121 -7.820 4.161 -0.596 942 HD13 ILE 121 2HD1 ILE 121 -8.915 2.782 -0.701 943 H LYS 122 H LYS 122 -11.926 4.841 -4.301 944 HA LYS 122 HA LYS 122 -10.672 7.019 -5.657 945 HB2 LYS 122 2HB LYS 122 -12.206 4.583 -6.186 946 HB3 LYS 122 1HB LYS 122 -12.595 5.866 -7.334 947 HG2 LYS 122 2HG LYS 122 -10.616 5.615 -8.376 948 HG3 LYS 122 1HG LYS 122 -9.761 5.831 -6.850 949 HD2 LYS 122 2HD LYS 122 -11.017 3.220 -6.969 950 HD3 LYS 122 1HD LYS 122 -9.933 3.466 -8.337 951 HE2 LYS 122 2HE LYS 122 -8.406 4.495 -6.317 952 HE3 LYS 122 1HE LYS 122 -9.284 3.213 -5.457 953 HZ1 LYS 122 3HZ LYS 122 -7.204 2.498 -6.674 954 HZ2 LYS 122 1HZ LYS 122 -8.047 2.788 -8.116 955 HZ3 LYS 122 2HZ LYS 122 -8.611 1.615 -7.025 956 H SER 123 H SER 123 -13.938 6.364 -4.560 957 HA SER 123 HA SER 123 -15.104 8.715 -5.840 958 HB2 SER 123 2HB SER 123 -15.943 6.608 -3.872 959 HB3 SER 123 1HB SER 123 -16.994 7.976 -4.223 960 HG SER 123 HG SER 123 -16.321 5.790 -5.770 961 H PHE 124 H PHE 124 -13.268 8.084 -3.081 962 HA PHE 124 HA PHE 124 -14.385 10.138 -1.330 963 HB2 PHE 124 2HB PHE 124 -12.657 7.954 -1.165 964 HB3 PHE 124 1HB PHE 124 -11.611 9.347 -0.897 965 HD1 PHE 124 1HD PHE 124 -14.726 7.671 0.256 966 HD2 PHE 124 2HD PHE 124 -11.721 10.615 1.123 967 HE1 PHE 124 1HE PHE 124 -15.611 7.894 2.562 968 HE2 PHE 124 2HE PHE 124 -12.606 10.838 3.431 969 HZ PHE 124 HZ PHE 124 -14.551 9.478 4.150 970 H ALA 125 H ALA 125 -12.746 10.317 -4.175 971 HA ALA 125 HA ALA 125 -11.813 13.075 -3.593 972 HB1 ALA 125 1HB ALA 125 -9.630 12.491 -3.569 973 HB2 ALA 125 2HB ALA 125 -9.807 11.636 -5.102 974 HB3 ALA 125 3HB ALA 125 -10.136 10.801 -3.584 975 H SER 126 H SER 126 -12.078 14.395 -5.391 976 HA SER 126 HA SER 126 -12.312 13.164 -8.088 977 HB2 SER 126 2HB SER 126 -14.546 13.256 -6.780 978 HB3 SER 126 1HB SER 126 -14.451 15.001 -6.998 979 HG SER 126 HG SER 126 -15.608 13.786 -8.666 980 H SER 127 H SER 127 -13.542 15.651 -9.106 981 HA SER 127 HA SER 127 -11.158 17.456 -8.861 982 HB2 SER 127 2HB SER 127 -13.153 17.079 -11.118 983 HB3 SER 127 1HB SER 127 -11.711 18.090 -11.172 984 HG SER 127 HG SER 127 -11.085 16.189 -12.041 985 H GLY 128 H GLY 128 -13.507 17.516 -7.074 986 HA2 GLY 128 2HA GLY 128 -14.003 20.278 -6.923 987 HA3 GLY 128 1HA GLY 128 -15.322 19.598 -7.878 988 H LYS 129 H LYS 129 -15.435 20.771 -5.160 989 HA LYS 129 HA LYS 129 -15.687 18.726 -3.165 990 HB2 LYS 129 2HB LYS 129 -16.381 21.566 -3.588 991 HB3 LYS 129 1HB LYS 129 -17.421 20.731 -2.434 992 HG2 LYS 129 2HG LYS 129 -15.792 20.700 -0.877 993 HG3 LYS 129 1HG LYS 129 -14.638 20.017 -2.022 994 HD2 LYS 129 2HD LYS 129 -13.977 22.153 -2.807 995 HD3 LYS 129 1HD LYS 129 -15.388 22.940 -2.098 996 HE2 LYS 129 2HE LYS 129 -13.701 23.487 -0.551 997 HE3 LYS 129 1HE LYS 129 -14.382 22.016 0.172 998 HZ1 LYS 129 3HZ LYS 129 -12.011 22.208 -1.606 999 HZ2 LYS 129 1HZ LYS 129 -12.744 20.741 -1.173 1000 HZ3 LYS 129 2HZ LYS 129 -12.033 21.719 0.020 1001 H GLU 130 H GLU 130 -17.579 17.621 -2.436 1002 HA GLU 130 HA GLU 130 -20.199 18.007 -3.600 1003 HB2 GLU 130 2HB GLU 130 -20.136 15.857 -4.935 1004 HB3 GLU 130 1HB GLU 130 -19.114 17.141 -5.583 1005 HG2 GLU 130 2HG GLU 130 -17.150 16.155 -4.469 1006 HG3 GLU 130 1HG GLU 130 -18.165 14.877 -3.800 1007 H LYS 131 H LYS 131 -21.337 15.556 -3.322 1008 HA LYS 131 HA LYS 131 -21.995 13.910 -1.751 1009 HB2 LYS 131 2HB LYS 131 -19.209 14.052 -1.752 1010 HB3 LYS 131 1HB LYS 131 -19.635 14.177 -0.045 1011 HG2 LYS 131 2HG LYS 131 -21.275 12.164 -1.293 1012 HG3 LYS 131 1HG LYS 131 -19.577 11.831 -1.632 1013 HD2 LYS 131 2HD LYS 131 -20.064 12.666 1.140 1014 HD3 LYS 131 1HD LYS 131 -20.883 11.165 0.708 1015 HE2 LYS 131 2HE LYS 131 -18.498 10.622 -0.395 1016 HE3 LYS 131 1HE LYS 131 -17.956 11.740 0.873 1017 HZ1 LYS 131 3HZ LYS 131 -18.108 9.472 1.721 1018 HZ2 LYS 131 1HZ LYS 131 -19.744 9.400 1.281 1019 HZ3 LYS 131 2HZ LYS 131 -19.238 10.483 2.489 1020 H LEU 132 H LEU 132 -23.038 16.427 -1.326 1021 HA LEU 132 HA LEU 132 -22.852 16.746 1.655 1022 HB2 LEU 132 2HB LEU 132 -21.769 18.532 0.213 1023 HB3 LEU 132 1HB LEU 132 -23.375 18.902 -0.411 1024 HG LEU 132 HG LEU 132 -24.063 19.125 2.080 1025 HD11 LEU 132 1HD1 LEU 132 -21.053 19.080 2.211 1026 HD12 LEU 132 2HD1 LEU 132 -22.215 18.258 3.252 1027 HD13 LEU 132 3HD1 LEU 132 -21.988 20.002 3.388 1028 HD21 LEU 132 3HD2 LEU 132 -22.966 21.484 2.113 1029 HD22 LEU 132 1HD2 LEU 132 -24.064 21.101 0.788 1030 HD23 LEU 132 2HD2 LEU 132 -22.320 21.041 0.533 1031 H GLU 133 H GLU 133 -24.747 15.381 1.913 1032 HA GLU 133 HA GLU 133 -27.288 16.672 0.970 1033 HB2 GLU 133 2HB GLU 133 -28.153 14.296 0.924 1034 HB3 GLU 133 1HB GLU 133 -26.872 14.616 -0.246 1035 HG2 GLU 133 2HG GLU 133 -25.744 13.817 2.300 1036 HG3 GLU 133 1HG GLU 133 -26.891 12.608 1.724 Start of MODEL 13 1 H1 MET 1 1HT MET 1 4.025 -26.287 -8.625 2 H2 MET 1 2HT MET 1 3.938 -25.845 -6.987 3 H3 MET 1 3HT MET 1 4.283 -27.452 -7.420 4 HA MET 1 HA MET 1 6.441 -26.964 -8.097 5 HB2 MET 1 2HB MET 1 7.033 -24.559 -8.565 6 HB3 MET 1 1HB MET 1 5.750 -25.182 -9.603 7 HG2 MET 1 2HG MET 1 4.138 -23.871 -8.631 8 HG3 MET 1 1HG MET 1 4.894 -23.940 -7.040 9 HE1 MET 1 2HE MET 1 3.522 -21.571 -8.319 10 HE2 MET 1 3HE MET 1 4.577 -20.164 -8.204 11 HE3 MET 1 1HE MET 1 4.336 -21.211 -6.799 12 H MET 2 H MET 2 5.950 -27.650 -5.630 13 HA MET 2 HA MET 2 6.741 -27.425 -3.411 14 HB2 MET 2 2HB MET 2 8.420 -25.871 -5.166 15 HB3 MET 2 1HB MET 2 8.262 -25.036 -3.620 16 HG2 MET 2 2HG MET 2 9.776 -26.467 -2.771 17 HG3 MET 2 1HG MET 2 8.588 -27.755 -2.972 18 HE1 MET 2 3HE MET 2 11.861 -29.093 -3.748 19 HE2 MET 2 1HE MET 2 10.460 -30.051 -4.247 20 HE3 MET 2 2HE MET 2 10.384 -29.064 -2.789 21 H GLU 3 H GLU 3 6.318 -26.111 -1.506 22 HA GLU 3 HA GLU 3 4.375 -23.884 -2.003 23 HB2 GLU 3 2HB GLU 3 3.519 -24.610 0.268 24 HB3 GLU 3 1HB GLU 3 3.344 -25.834 -0.996 25 HG2 GLU 3 2HG GLU 3 5.295 -27.013 -0.229 26 HG3 GLU 3 1HG GLU 3 5.731 -25.693 0.862 27 H GLU 4 H GLU 4 7.391 -24.707 -0.726 28 HA GLU 4 HA GLU 4 7.496 -22.931 1.503 29 HB2 GLU 4 2HB GLU 4 9.042 -24.817 1.093 30 HB3 GLU 4 1HB GLU 4 9.686 -23.972 -0.317 31 HG2 GLU 4 2HG GLU 4 10.501 -22.156 1.080 32 HG3 GLU 4 1HG GLU 4 9.748 -22.871 2.506 33 H TYR 5 H TYR 5 7.294 -22.305 -1.785 34 HA TYR 5 HA TYR 5 8.930 -19.909 -1.917 35 HB2 TYR 5 2HB TYR 5 7.595 -21.639 -3.667 36 HB3 TYR 5 1HB TYR 5 6.755 -20.098 -3.839 37 HD1 TYR 5 2HD TYR 5 8.856 -18.128 -3.363 38 HD2 TYR 5 1HD TYR 5 9.022 -21.835 -5.526 39 HE1 TYR 5 2HE TYR 5 10.737 -17.251 -4.721 40 HE2 TYR 5 1HE TYR 5 10.904 -20.959 -6.883 41 HH TYR 5 HH TYR 5 12.135 -19.167 -7.376 42 H LEU 6 H LEU 6 5.689 -20.683 -1.045 43 HA LEU 6 HA LEU 6 4.789 -17.868 -1.039 44 HB2 LEU 6 2HB LEU 6 2.649 -18.829 -0.568 45 HB3 LEU 6 1HB LEU 6 3.426 -19.954 -1.682 46 HG LEU 6 HG LEU 6 4.303 -20.885 0.748 47 HD11 LEU 6 1HD1 LEU 6 1.457 -19.892 1.071 48 HD12 LEU 6 2HD1 LEU 6 2.861 -19.359 1.996 49 HD13 LEU 6 3HD1 LEU 6 2.263 -21.008 2.172 50 HD21 LEU 6 3HD2 LEU 6 1.689 -21.969 -0.077 51 HD22 LEU 6 1HD2 LEU 6 3.253 -22.773 0.037 52 HD23 LEU 6 2HD2 LEU 6 2.855 -21.820 -1.391 53 H GLY 7 H GLY 7 6.026 -20.297 1.155 54 HA2 GLY 7 2HA GLY 7 5.136 -19.126 3.620 55 HA3 GLY 7 1HA GLY 7 6.526 -20.202 3.449 56 H VAL 8 H VAL 8 8.096 -18.667 1.678 57 HA VAL 8 HA VAL 8 9.119 -16.642 3.541 58 HB VAL 8 HB VAL 8 9.966 -17.865 0.922 59 HG11 VAL 8 1HG1 VAL 8 12.045 -16.461 1.110 60 HG12 VAL 8 2HG1 VAL 8 11.234 -15.515 2.359 61 HG13 VAL 8 3HG1 VAL 8 10.599 -15.533 0.713 62 HG21 VAL 8 3HG2 VAL 8 11.750 -18.780 2.216 63 HG22 VAL 8 1HG2 VAL 8 10.308 -18.964 3.214 64 HG23 VAL 8 2HG2 VAL 8 11.452 -17.664 3.548 65 H PHE 9 H PHE 9 7.255 -16.755 0.644 66 HA PHE 9 HA PHE 9 7.639 -14.000 -0.173 67 HB2 PHE 9 2HB PHE 9 6.094 -16.361 -0.909 68 HB3 PHE 9 1HB PHE 9 5.126 -14.892 -1.045 69 HD1 PHE 9 1HD PHE 9 8.468 -16.309 -1.955 70 HD2 PHE 9 2HD PHE 9 5.389 -13.465 -2.895 71 HE1 PHE 9 1HE PHE 9 9.656 -15.717 -4.050 72 HE2 PHE 9 2HE PHE 9 6.577 -12.874 -4.991 73 HZ PHE 9 HZ PHE 9 8.710 -13.998 -5.568 74 H VAL 10 H VAL 10 5.799 -15.581 2.287 75 HA VAL 10 HA VAL 10 3.903 -13.343 2.650 76 HB VAL 10 HB VAL 10 4.423 -16.054 3.864 77 HG11 VAL 10 1HG1 VAL 10 2.366 -15.477 5.331 78 HG12 VAL 10 2HG1 VAL 10 2.784 -13.794 5.012 79 HG13 VAL 10 3HG1 VAL 10 3.934 -14.847 5.838 80 HG21 VAL 10 3HG2 VAL 10 2.674 -14.938 1.898 81 HG22 VAL 10 1HG2 VAL 10 1.687 -15.458 3.264 82 HG23 VAL 10 2HG2 VAL 10 2.754 -16.608 2.459 83 H ASP 11 H ASP 11 6.622 -14.868 4.416 84 HA ASP 11 HA ASP 11 6.646 -13.126 6.658 85 HB2 ASP 11 2HB ASP 11 8.612 -14.849 5.192 86 HB3 ASP 11 1HB ASP 11 9.211 -13.790 6.470 87 H GLU 12 H GLU 12 7.563 -12.663 3.399 88 HA GLU 12 HA GLU 12 9.172 -10.238 3.929 89 HB2 GLU 12 2HB GLU 12 8.287 -11.766 1.468 90 HB3 GLU 12 1HB GLU 12 9.223 -10.272 1.372 91 HG2 GLU 12 2HG GLU 12 10.413 -12.065 3.302 92 HG3 GLU 12 1HG GLU 12 10.225 -12.880 1.750 93 H THR 13 H THR 13 5.946 -11.132 2.767 94 HA THR 13 HA THR 13 5.211 -8.482 1.859 95 HB THR 13 HB THR 13 4.247 -10.978 1.533 96 HG1 THR 13 1HG THR 13 2.624 -9.995 0.486 97 HG21 THR 13 3HG2 THR 13 2.496 -9.742 3.678 98 HG22 THR 13 1HG2 THR 13 3.423 -11.235 3.817 99 HG23 THR 13 2HG2 THR 13 2.055 -11.149 2.710 100 H LYS 14 H LYS 14 5.209 -10.106 4.966 101 HA LYS 14 HA LYS 14 3.469 -8.146 6.281 102 HB2 LYS 14 2HB LYS 14 5.364 -10.237 7.408 103 HB3 LYS 14 1HB LYS 14 4.008 -9.488 8.252 104 HG2 LYS 14 2HG LYS 14 2.414 -10.642 6.996 105 HG3 LYS 14 1HG LYS 14 3.529 -10.922 5.658 106 HD2 LYS 14 2HD LYS 14 3.922 -12.965 6.517 107 HD3 LYS 14 1HD LYS 14 4.723 -12.169 7.872 108 HE2 LYS 14 2HE LYS 14 2.341 -11.898 8.869 109 HE3 LYS 14 1HE LYS 14 1.868 -13.137 7.690 110 HZ1 LYS 14 3HZ LYS 14 4.134 -14.174 8.607 111 HZ2 LYS 14 1HZ LYS 14 2.621 -14.528 9.285 112 HZ3 LYS 14 2HZ LYS 14 3.618 -13.357 10.005 113 H GLU 15 H GLU 15 6.979 -8.923 6.375 114 HA GLU 15 HA GLU 15 7.683 -6.717 8.064 115 HB2 GLU 15 2HB GLU 15 9.153 -8.383 6.010 116 HB3 GLU 15 1HB GLU 15 9.970 -7.169 6.995 117 HG2 GLU 15 2HG GLU 15 9.029 -8.335 9.036 118 HG3 GLU 15 1HG GLU 15 8.496 -9.629 7.963 119 H TYR 16 H TYR 16 6.656 -6.890 4.853 120 HA TYR 16 HA TYR 16 7.932 -4.378 3.980 121 HB2 TYR 16 2HB TYR 16 6.348 -6.621 2.802 122 HB3 TYR 16 1HB TYR 16 6.282 -5.065 1.976 123 HD1 TYR 16 1HD TYR 16 9.064 -6.712 3.865 124 HD2 TYR 16 2HD TYR 16 7.661 -5.234 0.084 125 HE1 TYR 16 1HE TYR 16 11.293 -7.144 2.869 126 HE2 TYR 16 2HE TYR 16 9.890 -5.667 -0.913 127 HH TYR 16 HH TYR 16 12.144 -5.995 -0.297 128 H LEU 17 H LEU 17 4.691 -5.638 4.815 129 HA LEU 17 HA LEU 17 3.232 -3.265 4.143 130 HB2 LEU 17 2HB LEU 17 1.450 -4.377 5.198 131 HB3 LEU 17 1HB LEU 17 2.515 -5.721 4.795 132 HG LEU 17 HG LEU 17 3.541 -5.265 7.167 133 HD11 LEU 17 1HD1 LEU 17 0.816 -4.475 7.985 134 HD12 LEU 17 2HD1 LEU 17 1.725 -3.218 7.145 135 HD13 LEU 17 3HD1 LEU 17 2.378 -3.946 8.613 136 HD21 LEU 17 3HD2 LEU 17 0.813 -6.390 7.450 137 HD22 LEU 17 1HD2 LEU 17 2.373 -7.114 7.839 138 HD23 LEU 17 2HD2 LEU 17 1.798 -7.101 6.171 139 H GLN 18 H GLN 18 5.049 -4.243 6.994 140 HA GLN 18 HA GLN 18 4.265 -1.966 8.612 141 HB2 GLN 18 2HB GLN 18 5.146 -3.376 10.124 142 HB3 GLN 18 1HB GLN 18 5.650 -4.430 8.814 143 HG2 GLN 18 2HG GLN 18 7.745 -3.101 8.590 144 HG3 GLN 18 1HG GLN 18 7.246 -2.129 9.977 145 HE21 GLN 18 1HE2 GLN 18 8.074 -2.869 11.936 146 HE22 GLN 18 2HE2 GLN 18 8.520 -4.473 12.265 147 H ASN 19 H ASN 19 7.024 -2.906 6.688 148 HA ASN 19 HA ASN 19 8.519 -0.468 6.980 149 HB2 ASN 19 2HB ASN 19 8.539 -2.953 5.425 150 HB3 ASN 19 1HB ASN 19 9.061 -1.570 4.459 151 HD21 ASN 19 1HD2 ASN 19 10.915 -0.267 5.347 152 HD22 ASN 19 2HD2 ASN 19 12.034 -1.016 6.380 153 H LEU 20 H LEU 20 5.768 -1.497 5.237 154 HA LEU 20 HA LEU 20 5.753 0.835 3.423 155 HB2 LEU 20 2HB LEU 20 5.027 -1.148 2.373 156 HB3 LEU 20 1HB LEU 20 4.168 -1.692 3.811 157 HG LEU 20 HG LEU 20 2.539 0.177 3.496 158 HD11 LEU 20 1HD1 LEU 20 3.780 0.512 0.761 159 HD12 LEU 20 2HD1 LEU 20 4.248 1.528 2.124 160 HD13 LEU 20 3HD1 LEU 20 2.581 1.538 1.549 161 HD21 LEU 20 3HD2 LEU 20 2.308 -2.194 2.513 162 HD22 LEU 20 1HD2 LEU 20 2.745 -1.466 0.968 163 HD23 LEU 20 2HD2 LEU 20 1.288 -0.938 1.810 164 H ASN 21 H ASN 21 4.784 0.038 6.557 165 HA ASN 21 HA ASN 21 2.501 1.912 6.580 166 HB2 ASN 21 2HB ASN 21 3.608 -0.275 8.233 167 HB3 ASN 21 1HB ASN 21 2.986 1.102 9.151 168 HD21 ASN 21 1HD2 ASN 21 1.293 -0.629 9.815 169 HD22 ASN 21 2HD2 ASN 21 -0.057 -0.816 8.804 170 H ASP 22 H ASP 22 5.761 1.387 7.539 171 HA ASP 22 HA ASP 22 6.074 3.699 9.147 172 HB2 ASP 22 2HB ASP 22 7.577 1.689 9.099 173 HB3 ASP 22 1HB ASP 22 8.121 2.202 7.501 174 H THR 23 H THR 23 6.257 2.952 5.822 175 HA THR 23 HA THR 23 7.358 5.449 4.827 176 HB THR 23 HB THR 23 5.688 3.186 3.726 177 HG1 THR 23 1HG THR 23 7.563 2.292 3.502 178 HG21 THR 23 3HG2 THR 23 5.209 5.017 2.283 179 HG22 THR 23 1HG2 THR 23 6.477 4.105 1.468 180 HG23 THR 23 2HG2 THR 23 6.877 5.590 2.332 181 H LEU 24 H LEU 24 4.104 4.038 5.112 182 HA LEU 24 HA LEU 24 2.718 6.397 4.142 183 HB2 LEU 24 2HB LEU 24 2.062 3.767 5.447 184 HB3 LEU 24 1HB LEU 24 0.808 5.005 5.348 185 HG LEU 24 HG LEU 24 2.421 4.128 2.946 186 HD11 LEU 24 1HD1 LEU 24 0.083 2.980 2.455 187 HD12 LEU 24 2HD1 LEU 24 -0.022 2.947 4.216 188 HD13 LEU 24 3HD1 LEU 24 1.314 2.137 3.396 189 HD21 LEU 24 3HD2 LEU 24 0.369 6.117 3.507 190 HD22 LEU 24 1HD2 LEU 24 -0.141 5.005 2.235 191 HD23 LEU 24 2HD2 LEU 24 1.360 5.915 2.061 192 H LEU 25 H LEU 25 3.878 5.192 7.227 193 HA LEU 25 HA LEU 25 2.287 7.117 8.785 194 HB2 LEU 25 2HB LEU 25 4.541 5.196 9.380 195 HB3 LEU 25 1HB LEU 25 3.785 6.201 10.625 196 HG LEU 25 HG LEU 25 2.112 4.556 8.769 197 HD11 LEU 25 1HD1 LEU 25 2.219 2.670 10.237 198 HD12 LEU 25 2HD1 LEU 25 3.131 3.578 11.444 199 HD13 LEU 25 3HD1 LEU 25 3.889 3.135 9.914 200 HD21 LEU 25 3HD2 LEU 25 0.426 4.946 10.338 201 HD22 LEU 25 1HD2 LEU 25 1.362 6.439 10.450 202 HD23 LEU 25 2HD2 LEU 25 1.573 5.170 11.660 203 H GLU 26 H GLU 26 5.201 7.144 7.078 204 HA GLU 26 HA GLU 26 6.220 9.513 8.540 205 HB2 GLU 26 2HB GLU 26 7.262 7.739 6.309 206 HB3 GLU 26 1HB GLU 26 8.113 9.189 6.848 207 HG2 GLU 26 2HG GLU 26 7.313 7.388 9.035 208 HG3 GLU 26 1HG GLU 26 8.478 6.683 7.914 209 H LEU 27 H LEU 27 4.668 8.347 5.744 210 HA LEU 27 HA LEU 27 4.825 10.672 4.139 211 HB2 LEU 27 2HB LEU 27 4.364 8.562 3.122 212 HB3 LEU 27 1HB LEU 27 3.061 8.234 4.260 213 HG LEU 27 HG LEU 27 1.804 10.170 3.286 214 HD11 LEU 27 1HD1 LEU 27 2.560 11.210 1.267 215 HD12 LEU 27 2HD1 LEU 27 3.870 10.044 1.078 216 HD13 LEU 27 3HD1 LEU 27 3.933 11.240 2.372 217 HD21 LEU 27 3HD2 LEU 27 1.279 8.980 1.126 218 HD22 LEU 27 1HD2 LEU 27 1.274 7.923 2.538 219 HD23 LEU 27 2HD2 LEU 27 2.653 7.919 1.437 220 H GLU 28 H GLU 28 2.789 9.655 6.771 221 HA GLU 28 HA GLU 28 0.648 11.563 6.293 222 HB2 GLU 28 2HB GLU 28 -0.195 10.635 8.256 223 HB3 GLU 28 1HB GLU 28 0.892 9.356 7.730 224 HG2 GLU 28 2HG GLU 28 2.642 10.200 9.198 225 HG3 GLU 28 1HG GLU 28 1.607 11.530 9.703 226 H LYS 29 H LYS 29 3.608 11.463 8.262 227 HA LYS 29 HA LYS 29 3.238 14.179 9.310 228 HB2 LYS 29 2HB LYS 29 5.794 12.569 9.080 229 HB3 LYS 29 1HB LYS 29 5.427 13.826 10.261 230 HG2 LYS 29 2HG LYS 29 4.123 12.433 11.543 231 HG3 LYS 29 1HG LYS 29 3.614 11.462 10.160 232 HD2 LYS 29 2HD LYS 29 6.016 10.642 10.014 233 HD3 LYS 29 1HD LYS 29 6.269 11.380 11.598 234 HE2 LYS 29 2HE LYS 29 3.853 9.683 11.389 235 HE3 LYS 29 1HE LYS 29 5.397 8.819 11.271 236 HZ1 LYS 29 3HZ LYS 29 6.100 10.289 13.220 237 HZ2 LYS 29 1HZ LYS 29 5.042 9.007 13.559 238 HZ3 LYS 29 2HZ LYS 29 4.443 10.593 13.438 239 H ASN 30 H ASN 30 4.260 12.681 6.478 240 HA ASN 30 HA ASN 30 5.012 15.288 5.278 241 HB2 ASN 30 2HB ASN 30 6.804 12.933 5.754 242 HB3 ASN 30 1HB ASN 30 7.001 13.806 4.234 243 HD21 ASN 30 1HD2 ASN 30 8.764 13.705 6.740 244 HD22 ASN 30 2HD2 ASN 30 8.995 15.336 7.152 245 HA PRO 31 HA PRO 31 2.478 12.615 2.684 246 HB2 PRO 31 2HB PRO 31 0.321 14.257 2.636 247 HB3 PRO 31 1HB PRO 31 0.643 13.115 3.948 248 HG2 PRO 31 2HG PRO 31 0.882 16.034 3.921 249 HG3 PRO 31 1HG PRO 31 0.597 14.926 5.269 250 HD2 PRO 31 2HD PRO 31 3.044 16.138 4.517 251 HD3 PRO 31 1HD PRO 31 2.773 14.928 5.792 252 H GLU 32 H GLU 32 4.273 15.269 2.252 253 HA GLU 32 HA GLU 32 3.414 15.554 -0.589 254 HB2 GLU 32 2HB GLU 32 4.268 18.109 0.274 255 HB3 GLU 32 1HB GLU 32 2.628 17.631 -0.154 256 HG2 GLU 32 2HG GLU 32 2.149 17.003 2.140 257 HG3 GLU 32 1HG GLU 32 3.831 17.272 2.605 258 H ASP 33 H ASP 33 5.805 14.751 1.472 259 HA ASP 33 HA ASP 33 8.097 16.159 0.574 260 HB2 ASP 33 2HB ASP 33 7.395 13.758 2.073 261 HB3 ASP 33 1HB ASP 33 8.896 13.561 1.166 262 H MET 34 H MET 34 6.123 13.851 -0.934 263 HA MET 34 HA MET 34 6.156 12.904 -3.081 264 HB2 MET 34 2HB MET 34 7.921 15.253 -3.120 265 HB3 MET 34 1HB MET 34 8.367 14.045 -4.327 266 HG2 MET 34 2HG MET 34 5.468 14.557 -4.110 267 HG3 MET 34 1HG MET 34 6.417 15.926 -4.689 268 HE1 MET 34 3HE MET 34 4.275 14.874 -6.147 269 HE2 MET 34 1HE MET 34 4.657 14.105 -7.694 270 HE3 MET 34 2HE MET 34 5.239 15.732 -7.347 271 H GLU 35 H GLU 35 8.355 12.385 -0.730 272 HA GLU 35 HA GLU 35 9.974 10.495 -2.356 273 HB2 GLU 35 2HB GLU 35 11.620 10.734 -0.668 274 HB3 GLU 35 1HB GLU 35 10.911 12.344 -0.737 275 HG2 GLU 35 2HG GLU 35 9.428 11.774 1.155 276 HG3 GLU 35 1HG GLU 35 10.153 10.169 1.233 277 H LEU 36 H LEU 36 7.932 10.858 0.496 278 HA LEU 36 HA LEU 36 7.857 7.985 1.051 279 HB2 LEU 36 2HB LEU 36 6.053 10.273 1.931 280 HB3 LEU 36 1HB LEU 36 6.136 8.680 2.678 281 HG LEU 36 HG LEU 36 8.226 10.844 2.672 282 HD11 LEU 36 1HD1 LEU 36 6.873 9.181 4.803 283 HD12 LEU 36 2HD1 LEU 36 6.645 10.903 4.502 284 HD13 LEU 36 3HD1 LEU 36 8.187 10.313 5.118 285 HD21 LEU 36 3HD2 LEU 36 9.801 9.214 3.629 286 HD22 LEU 36 1HD2 LEU 36 9.309 8.702 2.015 287 HD23 LEU 36 2HD2 LEU 36 8.606 7.932 3.435 288 H ILE 37 H ILE 37 6.174 10.289 -0.969 289 HA ILE 37 HA ILE 37 3.821 8.622 -1.432 290 HB ILE 37 HB ILE 37 5.076 11.024 -2.800 291 HG12 ILE 37 2HG1 ILE 37 2.601 10.703 -1.071 292 HG13 ILE 37 1HG1 ILE 37 4.137 11.381 -0.531 293 HG21 ILE 37 1HG2 ILE 37 3.475 9.318 -4.133 294 HG22 ILE 37 2HG2 ILE 37 3.395 11.063 -4.370 295 HG23 ILE 37 3HG2 ILE 37 2.240 10.265 -3.305 296 HD11 ILE 37 3HD1 ILE 37 3.943 13.168 -2.229 297 HD12 ILE 37 1HD1 ILE 37 2.558 13.175 -1.137 298 HD13 ILE 37 2HD1 ILE 37 2.400 12.494 -2.755 299 H ASN 38 H ASN 38 7.048 8.992 -2.820 300 HA ASN 38 HA ASN 38 6.355 7.269 -5.114 301 HB2 ASN 38 2HB ASN 38 7.797 9.234 -5.424 302 HB3 ASN 38 1HB ASN 38 8.916 8.611 -4.211 303 HD21 ASN 38 1HD2 ASN 38 7.423 6.273 -6.341 304 HD22 ASN 38 2HD2 ASN 38 8.789 5.989 -7.308 305 H GLU 39 H GLU 39 8.080 7.131 -2.093 306 HA GLU 39 HA GLU 39 9.185 4.476 -2.606 307 HB2 GLU 39 2HB GLU 39 10.337 4.872 -0.650 308 HB3 GLU 39 1HB GLU 39 9.830 6.530 -0.952 309 HG2 GLU 39 2HG GLU 39 7.876 6.221 0.500 310 HG3 GLU 39 1HG GLU 39 8.320 4.534 0.763 311 H ALA 40 H ALA 40 6.223 5.781 -1.637 312 HA ALA 40 HA ALA 40 5.266 3.353 -0.250 313 HB1 ALA 40 1HB ALA 40 3.958 5.983 -1.034 314 HB2 ALA 40 2HB ALA 40 4.664 5.615 0.539 315 HB3 ALA 40 3HB ALA 40 3.222 4.757 -0.002 316 H PHE 41 H PHE 41 4.534 5.255 -3.216 317 HA PHE 41 HA PHE 41 2.544 3.590 -4.327 318 HB2 PHE 41 2HB PHE 41 3.090 5.685 -5.343 319 HB3 PHE 41 1HB PHE 41 4.794 5.252 -5.488 320 HD1 PHE 41 1HD PHE 41 5.529 3.559 -7.151 321 HD2 PHE 41 2HD PHE 41 1.462 4.924 -6.950 322 HE1 PHE 41 1HE PHE 41 5.102 2.615 -9.405 323 HE2 PHE 41 2HE PHE 41 1.034 3.981 -9.202 324 HZ PHE 41 HZ PHE 41 2.854 2.826 -10.430 325 H ARG 42 H ARG 42 6.045 3.180 -4.160 326 HA ARG 42 HA ARG 42 6.187 0.931 -6.001 327 HB2 ARG 42 2HB ARG 42 7.984 2.074 -3.844 328 HB3 ARG 42 1HB ARG 42 8.469 0.738 -4.888 329 HG2 ARG 42 2HG ARG 42 8.079 2.154 -6.876 330 HG3 ARG 42 1HG ARG 42 7.621 3.495 -5.825 331 HD2 ARG 42 2HD ARG 42 9.803 4.061 -5.625 332 HD3 ARG 42 1HD ARG 42 10.139 2.471 -4.908 333 HE ARG 42 HE ARG 42 9.919 1.880 -7.581 334 HH11 ARG 42 1HH2 ARG 42 11.039 4.915 -6.794 335 HH12 ARG 42 2HH2 ARG 42 12.618 4.717 -7.475 336 HH21 ARG 42 1HH1 ARG 42 12.241 1.317 -8.034 337 HH22 ARG 42 2HH1 ARG 42 13.299 2.681 -8.176 338 H ALA 43 H ALA 43 6.732 1.060 -2.455 339 HA ALA 43 HA ALA 43 6.750 -1.625 -1.812 340 HB1 ALA 43 1HB ALA 43 5.256 -0.627 0.216 341 HB2 ALA 43 2HB ALA 43 5.777 0.878 -0.539 342 HB3 ALA 43 3HB ALA 43 6.976 -0.280 0.037 343 H LEU 44 H LEU 44 3.730 0.317 -2.006 344 HA LEU 44 HA LEU 44 1.983 -1.941 -1.701 345 HB2 LEU 44 2HB LEU 44 1.751 0.865 -2.791 346 HB3 LEU 44 1HB LEU 44 0.364 -0.228 -2.793 347 HG LEU 44 HG LEU 44 1.909 0.026 -0.255 348 HD11 LEU 44 1HD1 LEU 44 0.354 2.012 0.288 349 HD12 LEU 44 2HD1 LEU 44 0.161 2.176 -1.458 350 HD13 LEU 44 3HD1 LEU 44 1.757 2.345 -0.727 351 HD21 LEU 44 3HD2 LEU 44 -0.768 -0.759 -1.212 352 HD22 LEU 44 1HD2 LEU 44 -0.786 0.196 0.270 353 HD23 LEU 44 2HD2 LEU 44 0.125 -1.313 0.205 354 H HIS 45 H HIS 45 3.372 -0.327 -4.542 355 HA HIS 45 HA HIS 45 1.910 -1.842 -6.519 356 HB2 HIS 45 2HB HIS 45 2.956 0.235 -7.110 357 HB3 HIS 45 1HB HIS 45 4.507 -0.283 -6.448 358 HD1 HIS 45 1HD HIS 45 6.001 -0.492 -8.461 359 HD2 HIS 45 2HD HIS 45 2.275 -2.250 -9.101 360 HE1 HIS 45 1HE HIS 45 6.130 -1.644 -10.713 361 H THR 46 H THR 46 4.913 -2.304 -4.729 362 HA THR 46 HA THR 46 5.716 -4.690 -6.220 363 HB THR 46 HB THR 46 6.778 -2.817 -4.317 364 HG1 THR 46 1HG THR 46 7.668 -4.809 -6.035 365 HG21 THR 46 3HG2 THR 46 7.941 -4.251 -2.748 366 HG22 THR 46 1HG2 THR 46 7.260 -5.695 -3.495 367 HG23 THR 46 2HG2 THR 46 6.213 -4.581 -2.616 368 H LEU 47 H LEU 47 4.058 -3.905 -3.199 369 HA LEU 47 HA LEU 47 3.831 -6.649 -2.266 370 HB2 LEU 47 2HB LEU 47 3.005 -3.909 -1.540 371 HB3 LEU 47 1HB LEU 47 1.873 -5.161 -1.024 372 HG LEU 47 HG LEU 47 4.794 -5.612 -0.571 373 HD11 LEU 47 1HD1 LEU 47 3.911 -4.469 1.795 374 HD12 LEU 47 2HD1 LEU 47 3.225 -3.410 0.563 375 HD13 LEU 47 3HD1 LEU 47 4.965 -3.690 0.615 376 HD21 LEU 47 3HD2 LEU 47 2.190 -6.608 0.379 377 HD22 LEU 47 1HD2 LEU 47 3.366 -6.348 1.667 378 HD23 LEU 47 2HD2 LEU 47 3.752 -7.424 0.324 379 H LYS 48 H LYS 48 1.730 -4.370 -4.028 380 HA LYS 48 HA LYS 48 -0.637 -5.940 -4.149 381 HB2 LYS 48 2HB LYS 48 -0.554 -3.601 -4.769 382 HB3 LYS 48 1HB LYS 48 0.649 -3.925 -6.018 383 HG2 LYS 48 2HG LYS 48 -1.491 -5.652 -6.593 384 HG3 LYS 48 1HG LYS 48 -2.236 -4.109 -6.176 385 HD2 LYS 48 2HD LYS 48 -1.815 -3.714 -8.406 386 HD3 LYS 48 1HD LYS 48 -0.279 -3.171 -7.726 387 HE2 LYS 48 2HE LYS 48 0.711 -5.396 -8.144 388 HE3 LYS 48 1HE LYS 48 -0.830 -5.949 -8.833 389 HZ1 LYS 48 3HZ LYS 48 1.121 -4.082 -9.926 390 HZ2 LYS 48 1HZ LYS 48 -0.509 -3.670 -10.147 391 HZ3 LYS 48 2HZ LYS 48 0.077 -5.154 -10.729 392 H GLY 49 H GLY 49 2.356 -6.004 -6.033 393 HA2 GLY 49 2HA GLY 49 1.343 -7.863 -8.034 394 HA3 GLY 49 1HA GLY 49 3.035 -7.416 -7.801 395 H MET 50 H MET 50 3.185 -8.100 -5.016 396 HA MET 50 HA MET 50 3.801 -10.906 -5.197 397 HB2 MET 50 2HB MET 50 3.718 -8.740 -3.144 398 HB3 MET 50 1HB MET 50 3.746 -10.399 -2.546 399 HG2 MET 50 2HG MET 50 5.883 -10.758 -3.257 400 HG3 MET 50 1HG MET 50 5.654 -9.820 -4.732 401 HE1 MET 50 3HE MET 50 6.007 -7.856 -0.593 402 HE2 MET 50 1HE MET 50 5.657 -9.563 -0.896 403 HE3 MET 50 2HE MET 50 4.490 -8.325 -1.358 404 H ALA 51 H ALA 51 0.894 -9.172 -4.575 405 HA ALA 51 HA ALA 51 -0.427 -11.402 -3.146 406 HB1 ALA 51 1HB ALA 51 -2.359 -9.690 -3.378 407 HB2 ALA 51 2HB ALA 51 -1.135 -8.601 -4.032 408 HB3 ALA 51 3HB ALA 51 -0.980 -9.217 -2.386 409 H GLY 52 H GLY 52 -0.135 -10.055 -6.349 410 HA2 GLY 52 2HA GLY 52 -2.430 -11.596 -7.384 411 HA3 GLY 52 1HA GLY 52 -1.387 -10.525 -8.329 412 H THR 53 H THR 53 1.005 -11.758 -7.040 413 HA THR 53 HA THR 53 1.369 -13.954 -8.950 414 HB THR 53 HB THR 53 3.020 -12.361 -7.006 415 HG1 THR 53 1HG THR 53 4.237 -12.186 -9.053 416 HG21 THR 53 3HG2 THR 53 3.967 -14.829 -8.484 417 HG22 THR 53 1HG2 THR 53 3.732 -14.712 -6.740 418 HG23 THR 53 2HG2 THR 53 4.976 -13.744 -7.529 419 H MET 54 H MET 54 0.308 -13.578 -5.771 420 HA MET 54 HA MET 54 1.176 -16.265 -4.873 421 HB2 MET 54 2HB MET 54 1.108 -13.977 -3.559 422 HB3 MET 54 1HB MET 54 -0.593 -14.388 -3.339 423 HG2 MET 54 2HG MET 54 -0.047 -15.831 -1.703 424 HG3 MET 54 1HG MET 54 0.971 -16.731 -2.826 425 HE1 MET 54 3HE MET 54 4.099 -16.368 -2.464 426 HE2 MET 54 1HE MET 54 4.020 -14.721 -3.108 427 HE3 MET 54 2HE MET 54 2.919 -15.959 -3.708 428 H GLY 55 H GLY 55 -1.214 -15.117 -6.773 429 HA2 GLY 55 2HA GLY 55 -3.087 -16.363 -7.570 430 HA3 GLY 55 1HA GLY 55 -2.960 -17.410 -6.155 431 H PHE 56 H PHE 56 -2.696 -14.396 -4.902 432 HA PHE 56 HA PHE 56 -5.651 -14.255 -4.410 433 HB2 PHE 56 2HB PHE 56 -3.319 -13.224 -2.763 434 HB3 PHE 56 1HB PHE 56 -5.007 -13.298 -2.257 435 HD1 PHE 56 1HD PHE 56 -5.511 -16.026 -3.708 436 HD2 PHE 56 2HD PHE 56 -2.522 -14.659 -0.943 437 HE1 PHE 56 1HE PHE 56 -5.174 -18.353 -2.921 438 HE2 PHE 56 2HE PHE 56 -2.187 -16.988 -0.155 439 HZ PHE 56 HZ PHE 56 -3.513 -18.835 -1.145 440 H SER 57 H SER 57 -5.145 -13.031 -6.721 441 HA SER 57 HA SER 57 -4.094 -10.377 -6.618 442 HB2 SER 57 2HB SER 57 -6.321 -11.108 -8.463 443 HB3 SER 57 1HB SER 57 -4.803 -10.292 -8.821 444 HG SER 57 HG SER 57 -5.161 -12.642 -9.444 445 H SER 58 H SER 58 -6.954 -11.701 -5.387 446 HA SER 58 HA SER 58 -8.750 -9.468 -5.557 447 HB2 SER 58 2HB SER 58 -8.453 -11.688 -3.499 448 HB3 SER 58 1HB SER 58 -9.884 -10.683 -3.705 449 HG SER 58 HG SER 58 -10.449 -11.960 -5.264 450 H MET 59 H MET 59 -6.286 -10.497 -3.241 451 HA MET 59 HA MET 59 -6.719 -8.180 -1.498 452 HB2 MET 59 2HB MET 59 -6.053 -10.396 -0.641 453 HB3 MET 59 1HB MET 59 -4.596 -10.351 -1.631 454 HG2 MET 59 2HG MET 59 -4.123 -8.104 -0.377 455 HG3 MET 59 1HG MET 59 -5.285 -8.714 0.802 456 HE1 MET 59 3HE MET 59 -1.383 -10.529 -0.611 457 HE2 MET 59 1HE MET 59 -2.611 -9.613 -1.497 458 HE3 MET 59 2HE MET 59 -2.829 -11.338 -1.217 459 H ALA 60 H ALA 60 -4.901 -9.006 -4.309 460 HA ALA 60 HA ALA 60 -2.767 -7.044 -3.951 461 HB1 ALA 60 1HB ALA 60 -2.511 -9.054 -5.345 462 HB2 ALA 60 2HB ALA 60 -2.375 -7.622 -6.363 463 HB3 ALA 60 3HB ALA 60 -3.869 -8.554 -6.348 464 H LYS 61 H LYS 61 -5.923 -7.189 -5.581 465 HA LYS 61 HA LYS 61 -5.757 -4.661 -6.939 466 HB2 LYS 61 2HB LYS 61 -8.007 -6.366 -5.819 467 HB3 LYS 61 1HB LYS 61 -8.308 -4.911 -6.775 468 HG2 LYS 61 2HG LYS 61 -7.728 -5.928 -8.716 469 HG3 LYS 61 1HG LYS 61 -6.353 -6.754 -7.977 470 HD2 LYS 61 2HD LYS 61 -7.830 -8.516 -8.503 471 HD3 LYS 61 1HD LYS 61 -8.135 -8.211 -6.791 472 HE2 LYS 61 2HE LYS 61 -10.253 -7.467 -7.181 473 HE3 LYS 61 1HE LYS 61 -9.764 -6.564 -8.629 474 HZ1 LYS 61 3HZ LYS 61 -9.609 -8.601 -9.860 475 HZ2 LYS 61 1HZ LYS 61 -11.147 -8.530 -9.150 476 HZ3 LYS 61 2HZ LYS 61 -9.948 -9.525 -8.475 477 H LEU 62 H LEU 62 -6.417 -5.652 -3.672 478 HA LEU 62 HA LEU 62 -7.539 -3.184 -2.682 479 HB2 LEU 62 2HB LEU 62 -7.832 -5.236 -1.473 480 HB3 LEU 62 1HB LEU 62 -6.099 -5.572 -1.499 481 HG LEU 62 HG LEU 62 -5.644 -3.771 0.022 482 HD11 LEU 62 1HD1 LEU 62 -8.387 -2.937 -0.782 483 HD12 LEU 62 2HD1 LEU 62 -6.961 -1.950 -0.457 484 HD13 LEU 62 3HD1 LEU 62 -7.912 -2.595 0.882 485 HD21 LEU 62 3HD2 LEU 62 -8.115 -4.701 1.352 486 HD22 LEU 62 1HD2 LEU 62 -6.438 -4.833 1.879 487 HD23 LEU 62 2HD2 LEU 62 -7.091 -5.989 0.718 488 H CYS 63 H CYS 63 -4.267 -4.510 -3.005 489 HA CYS 63 HA CYS 63 -2.961 -2.306 -1.613 490 HB2 CYS 63 2HB CYS 63 -1.989 -4.497 -3.477 491 HB3 CYS 63 1HB CYS 63 -0.930 -3.452 -2.532 492 HG CYS 63 HG CYS 63 -1.241 -5.145 -0.745 493 H HIS 64 H HIS 64 -3.723 -3.126 -4.971 494 HA HIS 64 HA HIS 64 -2.114 -1.130 -6.262 495 HB2 HIS 64 2HB HIS 64 -3.224 -3.070 -7.361 496 HB3 HIS 64 1HB HIS 64 -4.796 -2.349 -7.023 497 HD1 HIS 64 1HD HIS 64 -1.560 -1.365 -8.805 498 HD2 HIS 64 2HD HIS 64 -5.669 -0.712 -9.064 499 HE1 HIS 64 1HE HIS 64 -1.934 0.036 -10.882 500 H THR 65 H THR 65 -5.231 -1.101 -4.678 501 HA THR 65 HA THR 65 -6.109 1.487 -5.611 502 HB THR 65 HB THR 65 -6.902 -0.655 -3.774 503 HG1 THR 65 1HG THR 65 -8.008 1.121 -5.602 504 HG21 THR 65 3HG2 THR 65 -7.329 2.210 -2.987 505 HG22 THR 65 1HG2 THR 65 -6.922 0.826 -1.974 506 HG23 THR 65 2HG2 THR 65 -8.557 0.999 -2.613 507 H LEU 66 H LEU 66 -4.667 0.437 -2.482 508 HA LEU 66 HA LEU 66 -4.447 2.999 -1.254 509 HB2 LEU 66 2HB LEU 66 -2.272 0.900 -1.092 510 HB3 LEU 66 1HB LEU 66 -2.890 1.938 0.185 511 HG LEU 66 HG LEU 66 -4.202 -0.502 -1.022 512 HD11 LEU 66 1HD1 LEU 66 -4.374 -0.563 1.735 513 HD12 LEU 66 2HD1 LEU 66 -2.809 0.201 1.453 514 HD13 LEU 66 3HD1 LEU 66 -3.150 -1.388 0.768 515 HD21 LEU 66 3HD2 LEU 66 -6.267 0.162 -0.342 516 HD22 LEU 66 1HD2 LEU 66 -5.602 1.795 -0.375 517 HD23 LEU 66 2HD2 LEU 66 -5.636 0.884 1.135 518 H GLU 67 H GLU 67 -2.132 1.224 -3.308 519 HA GLU 67 HA GLU 67 -0.142 3.242 -3.496 520 HB2 GLU 67 2HB GLU 67 0.454 1.083 -4.207 521 HB3 GLU 67 1HB GLU 67 -1.053 0.860 -5.093 522 HG2 GLU 67 2HG GLU 67 0.787 3.033 -6.003 523 HG3 GLU 67 1HG GLU 67 1.252 1.368 -6.353 524 H ASN 68 H ASN 68 -3.052 2.595 -5.409 525 HA ASN 68 HA ASN 68 -2.690 4.423 -7.490 526 HB2 ASN 68 2HB ASN 68 -4.687 2.829 -6.532 527 HB3 ASN 68 1HB ASN 68 -5.327 4.427 -6.147 528 HD21 ASN 68 1HD2 ASN 68 -3.334 3.363 -8.952 529 HD22 ASN 68 2HD2 ASN 68 -4.454 3.860 -10.126 530 H ILE 69 H ILE 69 -4.044 5.034 -4.245 531 HA ILE 69 HA ILE 69 -4.420 7.837 -4.505 532 HB ILE 69 HB ILE 69 -3.371 6.755 -1.921 533 HG12 ILE 69 2HG1 ILE 69 -4.655 4.848 -2.622 534 HG13 ILE 69 1HG1 ILE 69 -5.637 5.742 -1.474 535 HG21 ILE 69 1HG2 ILE 69 -5.828 7.924 -1.503 536 HG22 ILE 69 2HG2 ILE 69 -5.217 8.817 -2.896 537 HG23 ILE 69 3HG2 ILE 69 -4.278 8.760 -1.404 538 HD11 ILE 69 3HD1 ILE 69 -6.643 4.917 -3.789 539 HD12 ILE 69 1HD1 ILE 69 -5.928 6.426 -4.363 540 HD13 ILE 69 2HD1 ILE 69 -7.127 6.451 -3.067 541 H LEU 70 H LEU 70 -1.628 5.914 -4.231 542 HA LEU 70 HA LEU 70 0.154 8.152 -3.550 543 HB2 LEU 70 2HB LEU 70 0.891 5.377 -4.513 544 HB3 LEU 70 1HB LEU 70 1.866 6.461 -3.523 545 HG LEU 70 HG LEU 70 -0.647 4.993 -2.716 546 HD11 LEU 70 1HD1 LEU 70 1.361 3.671 -2.490 547 HD12 LEU 70 2HD1 LEU 70 0.902 4.220 -0.878 548 HD13 LEU 70 3HD1 LEU 70 2.217 5.017 -1.740 549 HD21 LEU 70 3HD2 LEU 70 -0.641 7.391 -1.939 550 HD22 LEU 70 1HD2 LEU 70 0.883 7.064 -1.114 551 HD23 LEU 70 2HD2 LEU 70 -0.585 6.219 -0.621 552 H ASP 71 H ASP 71 -1.052 6.355 -6.200 553 HA ASP 71 HA ASP 71 0.777 7.484 -8.176 554 HB2 ASP 71 2HB ASP 71 -0.182 5.305 -8.592 555 HB3 ASP 71 1HB ASP 71 -1.811 5.896 -8.257 556 H LYS 72 H LYS 72 -2.490 8.133 -6.863 557 HA LYS 72 HA LYS 72 -3.164 10.170 -8.760 558 HB2 LYS 72 2HB LYS 72 -3.899 9.820 -5.855 559 HB3 LYS 72 1HB LYS 72 -4.833 10.713 -7.053 560 HG2 LYS 72 2HG LYS 72 -4.474 7.746 -6.757 561 HG3 LYS 72 1HG LYS 72 -5.964 8.670 -6.840 562 HD2 LYS 72 2HD LYS 72 -5.858 7.823 -8.972 563 HD3 LYS 72 1HD LYS 72 -5.041 9.372 -9.172 564 HE2 LYS 72 2HE LYS 72 -3.007 8.420 -9.503 565 HE3 LYS 72 1HE LYS 72 -3.319 7.121 -8.333 566 HZ1 LYS 72 3HZ LYS 72 -4.986 6.240 -9.957 567 HZ2 LYS 72 1HZ LYS 72 -3.379 6.135 -10.491 568 HZ3 LYS 72 2HZ LYS 72 -4.396 7.354 -11.098 569 H ALA 73 H ALA 73 -1.548 10.018 -5.697 570 HA ALA 73 HA ALA 73 -1.052 12.783 -5.215 571 HB1 ALA 73 1HB ALA 73 -0.795 11.146 -3.480 572 HB2 ALA 73 2HB ALA 73 0.837 11.715 -3.830 573 HB3 ALA 73 3HB ALA 73 0.283 10.168 -4.482 574 H ARG 74 H ARG 74 0.693 10.288 -7.033 575 HA ARG 74 HA ARG 74 2.916 12.096 -7.643 576 HB2 ARG 74 2HB ARG 74 3.956 10.157 -8.351 577 HB3 ARG 74 1HB ARG 74 2.712 9.433 -7.337 578 HG2 ARG 74 2HG ARG 74 1.336 8.924 -9.234 579 HG3 ARG 74 1HG ARG 74 2.321 9.920 -10.303 580 HD2 ARG 74 2HD ARG 74 4.268 8.309 -9.578 581 HD3 ARG 74 1HD ARG 74 2.937 7.212 -9.153 582 HE ARG 74 HE ARG 74 2.089 7.807 -11.562 583 HH11 ARG 74 1HH1 ARG 74 4.878 6.274 -10.628 584 HH12 ARG 74 2HH1 ARG 74 5.704 6.431 -12.142 585 HH21 ARG 74 1HH2 ARG 74 3.361 8.600 -13.497 586 HH22 ARG 74 2HH2 ARG 74 4.846 7.750 -13.767 587 H ASN 75 H ASN 75 -0.184 11.421 -8.957 588 HA ASN 75 HA ASN 75 0.587 12.299 -11.695 589 HB2 ASN 75 2HB ASN 75 -1.490 10.730 -10.415 590 HB3 ASN 75 1HB ASN 75 -2.205 11.974 -11.438 591 HD21 ASN 75 1HD2 ASN 75 -1.553 11.989 -13.760 592 HD22 ASN 75 2HD2 ASN 75 -0.963 10.570 -14.479 593 H SER 76 H SER 76 0.208 13.924 -8.950 594 HA SER 76 HA SER 76 -0.342 16.179 -8.496 595 HB2 SER 76 2HB SER 76 0.037 17.503 -10.319 596 HB3 SER 76 1HB SER 76 0.360 15.991 -11.162 597 HG SER 76 HG SER 76 -1.207 16.988 -12.326 598 H GLU 77 H GLU 77 -2.315 13.930 -8.472 599 HA GLU 77 HA GLU 77 -4.829 15.357 -9.159 600 HB2 GLU 77 2HB GLU 77 -4.201 12.477 -8.487 601 HB3 GLU 77 1HB GLU 77 -5.802 13.075 -8.925 602 HG2 GLU 77 2HG GLU 77 -3.330 13.246 -10.672 603 HG3 GLU 77 1HG GLU 77 -4.650 12.094 -10.880 604 H ILE 78 H ILE 78 -3.436 13.422 -6.569 605 HA ILE 78 HA ILE 78 -4.985 15.074 -4.592 606 HB ILE 78 HB ILE 78 -5.507 12.888 -3.421 607 HG12 ILE 78 2HG1 ILE 78 -5.420 11.048 -5.360 608 HG13 ILE 78 1HG1 ILE 78 -3.945 11.933 -5.725 609 HG21 ILE 78 1HG2 ILE 78 -6.696 12.276 -5.965 610 HG22 ILE 78 2HG2 ILE 78 -6.688 14.030 -5.735 611 HG23 ILE 78 3HG2 ILE 78 -7.466 12.985 -4.542 612 HD11 ILE 78 3HD1 ILE 78 -4.424 11.173 -2.890 613 HD12 ILE 78 1HD1 ILE 78 -2.912 11.258 -3.802 614 HD13 ILE 78 2HD1 ILE 78 -4.000 9.886 -4.030 615 H LYS 79 H LYS 79 -4.256 13.623 -2.334 616 HA LYS 79 HA LYS 79 -1.464 13.039 -2.146 617 HB2 LYS 79 2HB LYS 79 -1.017 15.183 -0.769 618 HB3 LYS 79 1HB LYS 79 -1.115 15.359 -2.516 619 HG2 LYS 79 2HG LYS 79 -2.463 17.116 -1.674 620 HG3 LYS 79 1HG LYS 79 -3.614 15.876 -2.162 621 HD2 LYS 79 2HD LYS 79 -4.052 16.886 0.116 622 HD3 LYS 79 1HD LYS 79 -3.889 15.130 0.109 623 HE2 LYS 79 2HE LYS 79 -2.006 15.191 1.382 624 HE3 LYS 79 1HE LYS 79 -1.330 16.548 0.461 625 HZ1 LYS 79 3HZ LYS 79 -3.115 16.586 2.777 626 HZ2 LYS 79 1HZ LYS 79 -3.360 17.774 1.592 627 HZ3 LYS 79 2HZ LYS 79 -1.852 17.646 2.365 628 H ILE 80 H ILE 80 -0.881 12.856 0.295 629 HA ILE 80 HA ILE 80 -2.981 11.422 1.628 630 HB ILE 80 HB ILE 80 -0.258 12.438 2.257 631 HG12 ILE 80 2HG1 ILE 80 0.200 10.030 2.386 632 HG13 ILE 80 1HG1 ILE 80 -1.515 9.695 2.161 633 HG21 ILE 80 1HG2 ILE 80 -2.188 11.160 4.196 634 HG22 ILE 80 2HG2 ILE 80 -1.315 12.678 4.400 635 HG23 ILE 80 3HG2 ILE 80 -0.442 11.148 4.442 636 HD11 ILE 80 3HD1 ILE 80 0.174 11.235 0.175 637 HD12 ILE 80 1HD1 ILE 80 -1.485 10.678 -0.047 638 HD13 ILE 80 2HD1 ILE 80 -0.167 9.509 0.045 639 H THR 81 H THR 81 -4.722 12.656 2.002 640 HA THR 81 HA THR 81 -4.589 15.260 3.399 641 HB THR 81 HB THR 81 -6.997 15.218 2.978 642 HG1 THR 81 1HG THR 81 -7.967 13.343 2.219 643 HG21 THR 81 3HG2 THR 81 -7.007 15.027 0.578 644 HG22 THR 81 1HG2 THR 81 -5.636 13.921 0.612 645 HG23 THR 81 2HG2 THR 81 -5.414 15.616 1.048 646 H SER 82 H SER 82 -4.078 12.263 4.462 647 HA SER 82 HA SER 82 -4.164 11.356 6.662 648 HB2 SER 82 2HB SER 82 -4.803 14.055 6.983 649 HB3 SER 82 1HB SER 82 -6.154 13.208 7.730 650 HG SER 82 HG SER 82 -4.869 12.539 9.262 651 H ASP 83 H ASP 83 -6.709 11.962 4.524 652 HA ASP 83 HA ASP 83 -8.572 10.099 5.930 653 HB2 ASP 83 2HB ASP 83 -9.343 12.418 5.314 654 HB3 ASP 83 1HB ASP 83 -9.013 12.028 3.625 655 H LEU 84 H LEU 84 -7.023 10.906 2.809 656 HA LEU 84 HA LEU 84 -7.953 8.625 1.347 657 HB2 LEU 84 2HB LEU 84 -5.270 10.057 1.200 658 HB3 LEU 84 1HB LEU 84 -6.042 9.152 -0.102 659 HG LEU 84 HG LEU 84 -6.899 11.783 1.106 660 HD11 LEU 84 1HD1 LEU 84 -7.032 11.414 -1.783 661 HD12 LEU 84 2HD1 LEU 84 -5.419 11.084 -1.151 662 HD13 LEU 84 3HD1 LEU 84 -6.181 12.646 -0.851 663 HD21 LEU 84 3HD2 LEU 84 -8.522 9.999 -0.738 664 HD22 LEU 84 1HD2 LEU 84 -8.988 11.599 -0.163 665 HD23 LEU 84 2HD2 LEU 84 -8.867 10.253 0.972 666 H LEU 85 H LEU 85 -5.508 9.176 3.753 667 HA LEU 85 HA LEU 85 -4.121 6.628 3.533 668 HB2 LEU 85 2HB LEU 85 -4.423 8.821 5.598 669 HB3 LEU 85 1HB LEU 85 -3.456 7.383 5.925 670 HG LEU 85 HG LEU 85 -3.036 9.433 3.749 671 HD11 LEU 85 1HD1 LEU 85 -2.032 10.172 5.761 672 HD12 LEU 85 2HD1 LEU 85 -0.714 9.371 4.902 673 HD13 LEU 85 3HD1 LEU 85 -1.545 8.538 6.214 674 HD21 LEU 85 3HD2 LEU 85 -2.267 6.594 3.910 675 HD22 LEU 85 1HD2 LEU 85 -0.912 7.685 3.618 676 HD23 LEU 85 2HD2 LEU 85 -2.288 7.673 2.514 677 H ASP 86 H ASP 86 -6.501 7.992 5.795 678 HA ASP 86 HA ASP 86 -7.035 5.920 7.525 679 HB2 ASP 86 2HB ASP 86 -8.707 7.961 6.112 680 HB3 ASP 86 1HB ASP 86 -9.542 6.736 7.067 681 H LYS 87 H LYS 87 -8.453 6.192 4.240 682 HA LYS 87 HA LYS 87 -9.677 3.540 4.422 683 HB2 LYS 87 2HB LYS 87 -9.107 5.226 1.965 684 HB3 LYS 87 1HB LYS 87 -10.392 4.034 2.176 685 HG2 LYS 87 2HG LYS 87 -10.136 6.732 3.522 686 HG3 LYS 87 1HG LYS 87 -11.424 6.178 2.451 687 HD2 LYS 87 2HD LYS 87 -10.803 5.068 5.206 688 HD3 LYS 87 1HD LYS 87 -12.175 6.096 4.788 689 HE2 LYS 87 2HE LYS 87 -12.212 3.941 2.941 690 HE3 LYS 87 1HE LYS 87 -11.962 3.233 4.549 691 HZ1 LYS 87 3HZ LYS 87 -13.888 4.114 5.353 692 HZ2 LYS 87 1HZ LYS 87 -14.355 3.910 3.735 693 HZ3 LYS 87 2HZ LYS 87 -13.870 5.441 4.291 694 H ILE 88 H ILE 88 -6.730 4.954 3.075 695 HA ILE 88 HA ILE 88 -5.822 2.662 1.609 696 HB ILE 88 HB ILE 88 -4.942 5.276 2.473 697 HG12 ILE 88 2HG1 ILE 88 -3.684 3.628 0.323 698 HG13 ILE 88 1HG1 ILE 88 -5.322 4.267 0.148 699 HG21 ILE 88 1HG2 ILE 88 -2.431 4.618 2.268 700 HG22 ILE 88 2HG2 ILE 88 -2.979 3.022 2.780 701 HG23 ILE 88 3HG2 ILE 88 -3.229 4.419 3.829 702 HD11 ILE 88 3HD1 ILE 88 -3.030 5.667 -0.464 703 HD12 ILE 88 1HD1 ILE 88 -3.385 6.230 1.170 704 HD13 ILE 88 2HD1 ILE 88 -4.591 6.405 -0.102 705 H PHE 89 H PHE 89 -5.137 3.819 4.899 706 HA PHE 89 HA PHE 89 -3.555 1.584 5.735 707 HB2 PHE 89 2HB PHE 89 -4.122 4.065 6.651 708 HB3 PHE 89 1HB PHE 89 -5.193 3.118 7.683 709 HD1 PHE 89 1HD PHE 89 -1.650 3.287 6.488 710 HD2 PHE 89 2HD PHE 89 -4.350 2.011 9.575 711 HE1 PHE 89 1HE PHE 89 0.278 2.636 7.906 712 HE2 PHE 89 2HE PHE 89 -2.422 1.360 10.991 713 HZ PHE 89 HZ PHE 89 -0.108 1.673 10.157 714 H ALA 90 H ALA 90 -6.945 2.172 5.518 715 HA ALA 90 HA ALA 90 -7.797 0.009 7.274 716 HB1 ALA 90 1HB ALA 90 -9.961 0.470 5.838 717 HB2 ALA 90 2HB ALA 90 -9.034 1.834 5.212 718 HB3 ALA 90 3HB ALA 90 -9.387 1.724 6.938 719 H GLY 91 H GLY 91 -7.018 0.485 3.892 720 HA2 GLY 91 2HA GLY 91 -7.960 -2.088 2.967 721 HA3 GLY 91 1HA GLY 91 -6.825 -1.032 2.114 722 H VAL 92 H VAL 92 -4.865 -0.746 4.066 723 HA VAL 92 HA VAL 92 -3.301 -3.136 3.756 724 HB VAL 92 HB VAL 92 -3.189 -0.574 5.334 725 HG11 VAL 92 1HG1 VAL 92 -0.744 -1.566 5.865 726 HG12 VAL 92 2HG1 VAL 92 -1.654 -3.076 5.871 727 HG13 VAL 92 3HG1 VAL 92 -2.100 -1.774 6.973 728 HG21 VAL 92 3HG2 VAL 92 -1.843 -1.835 2.993 729 HG22 VAL 92 1HG2 VAL 92 -0.862 -0.765 3.995 730 HG23 VAL 92 2HG2 VAL 92 -2.335 -0.159 3.237 731 H ASP 93 H ASP 93 -5.678 -2.058 6.031 732 HA ASP 93 HA ASP 93 -4.976 -3.891 8.196 733 HB2 ASP 93 2HB ASP 93 -6.586 -1.622 7.750 734 HB3 ASP 93 1HB ASP 93 -7.724 -2.926 8.107 735 H MET 94 H MET 94 -6.833 -4.030 5.256 736 HA MET 94 HA MET 94 -8.371 -6.400 6.075 737 HB2 MET 94 2HB MET 94 -7.964 -4.925 3.451 738 HB3 MET 94 1HB MET 94 -9.103 -6.253 3.670 739 HG2 MET 94 2HG MET 94 -9.832 -4.701 5.756 740 HG3 MET 94 1HG MET 94 -9.250 -3.452 4.654 741 HE1 MET 94 3HE MET 94 -9.530 -3.598 2.329 742 HE2 MET 94 1HE MET 94 -11.164 -3.438 1.669 743 HE3 MET 94 2HE MET 94 -10.315 -4.979 1.564 744 H ILE 95 H ILE 95 -5.660 -5.660 3.841 745 HA ILE 95 HA ILE 95 -5.198 -8.306 2.934 746 HB ILE 95 HB ILE 95 -2.959 -7.325 2.439 747 HG12 ILE 95 2HG1 ILE 95 -3.992 -4.856 3.839 748 HG13 ILE 95 1HG1 ILE 95 -2.875 -5.991 4.597 749 HG21 ILE 95 1HG2 ILE 95 -3.915 -6.307 0.679 750 HG22 ILE 95 2HG2 ILE 95 -4.590 -5.047 1.711 751 HG23 ILE 95 3HG2 ILE 95 -5.462 -6.562 1.484 752 HD11 ILE 95 3HD1 ILE 95 -1.566 -4.210 3.618 753 HD12 ILE 95 1HD1 ILE 95 -2.398 -4.385 2.074 754 HD13 ILE 95 2HD1 ILE 95 -1.322 -5.660 2.645 755 H THR 96 H THR 96 -4.154 -6.549 5.834 756 HA THR 96 HA THR 96 -2.283 -8.502 6.806 757 HB THR 96 HB THR 96 -4.001 -6.310 7.985 758 HG1 THR 96 1HG THR 96 -1.200 -6.636 8.034 759 HG21 THR 96 3HG2 THR 96 -3.937 -7.890 9.778 760 HG22 THR 96 1HG2 THR 96 -2.675 -6.708 10.125 761 HG23 THR 96 2HG2 THR 96 -2.248 -8.284 9.458 762 H ARG 97 H ARG 97 -5.775 -7.984 7.191 763 HA ARG 97 HA ARG 97 -6.208 -10.254 8.944 764 HB2 ARG 97 2HB ARG 97 -7.855 -8.410 7.219 765 HB3 ARG 97 1HB ARG 97 -8.617 -9.801 7.985 766 HG2 ARG 97 2HG ARG 97 -8.516 -7.449 9.216 767 HG3 ARG 97 1HG ARG 97 -8.346 -8.950 10.121 768 HD2 ARG 97 2HD ARG 97 -5.875 -8.739 10.002 769 HD3 ARG 97 1HD ARG 97 -6.059 -7.211 9.124 770 HE ARG 97 HE ARG 97 -7.668 -6.973 11.411 771 HH11 ARG 97 1HH1 ARG 97 -4.672 -6.104 10.312 772 HH12 ARG 97 2HH1 ARG 97 -3.925 -5.950 11.868 773 HH21 ARG 97 1HH2 ARG 97 -6.581 -7.387 13.576 774 HH22 ARG 97 2HH2 ARG 97 -5.007 -6.678 13.718 775 H MET 98 H MET 98 -6.441 -9.706 5.433 776 HA MET 98 HA MET 98 -7.414 -12.330 4.752 777 HB2 MET 98 2HB MET 98 -5.832 -10.187 3.288 778 HB3 MET 98 1HB MET 98 -6.490 -11.617 2.492 779 HG2 MET 98 2HG MET 98 -8.634 -10.843 2.586 780 HG3 MET 98 1HG MET 98 -8.405 -10.111 4.173 781 HE1 MET 98 3HE MET 98 -9.274 -8.014 0.658 782 HE2 MET 98 1HE MET 98 -9.530 -9.679 1.196 783 HE3 MET 98 2HE MET 98 -8.168 -9.286 0.149 784 H VAL 99 H VAL 99 -4.249 -10.886 5.275 785 HA VAL 99 HA VAL 99 -2.655 -13.091 4.319 786 HB VAL 99 HB VAL 99 -2.335 -10.639 6.030 787 HG11 VAL 99 1HG1 VAL 99 -0.642 -13.040 6.134 788 HG12 VAL 99 2HG1 VAL 99 -0.678 -11.645 7.213 789 HG13 VAL 99 3HG1 VAL 99 0.250 -11.577 5.715 790 HG21 VAL 99 3HG2 VAL 99 -1.784 -11.509 3.299 791 HG22 VAL 99 1HG2 VAL 99 -0.364 -10.789 4.056 792 HG23 VAL 99 2HG2 VAL 99 -1.868 -9.873 3.955 793 H ASP 100 H ASP 100 -4.037 -12.200 7.485 794 HA ASP 100 HA ASP 100 -2.719 -14.276 8.991 795 HB2 ASP 100 2HB ASP 100 -4.442 -12.092 9.417 796 HB3 ASP 100 1HB ASP 100 -5.353 -13.502 9.960 797 H LYS 101 H LYS 101 -5.630 -14.114 7.041 798 HA LYS 101 HA LYS 101 -6.467 -16.826 7.848 799 HB2 LYS 101 2HB LYS 101 -8.480 -16.022 7.247 800 HB3 LYS 101 1HB LYS 101 -7.699 -14.473 6.972 801 HG2 LYS 101 2HG LYS 101 -7.139 -15.796 4.620 802 HG3 LYS 101 1HG LYS 101 -8.732 -16.423 5.026 803 HD2 LYS 101 2HD LYS 101 -8.588 -13.607 5.557 804 HD3 LYS 101 1HD LYS 101 -8.110 -13.944 3.895 805 HE2 LYS 101 2HE LYS 101 -10.515 -13.737 3.847 806 HE3 LYS 101 1HE LYS 101 -10.181 -15.479 3.790 807 HZ1 LYS 101 3HZ LYS 101 -11.503 -14.010 5.820 808 HZ2 LYS 101 1HZ LYS 101 -10.120 -14.754 6.463 809 HZ3 LYS 101 2HZ LYS 101 -11.301 -15.689 5.678 810 H ILE 102 H ILE 102 -5.035 -15.074 5.158 811 HA ILE 102 HA ILE 102 -5.040 -17.205 3.237 812 HB ILE 102 HB ILE 102 -3.553 -14.634 3.730 813 HG12 ILE 102 2HG1 ILE 102 -5.250 -15.707 1.455 814 HG13 ILE 102 1HG1 ILE 102 -5.776 -14.567 2.692 815 HG21 ILE 102 1HG2 ILE 102 -2.697 -16.873 1.956 816 HG22 ILE 102 2HG2 ILE 102 -1.722 -15.663 2.791 817 HG23 ILE 102 3HG2 ILE 102 -2.583 -15.235 1.313 818 HD11 ILE 102 3HD1 ILE 102 -5.148 -12.985 1.188 819 HD12 ILE 102 1HD1 ILE 102 -4.121 -14.107 0.296 820 HD13 ILE 102 2HD1 ILE 102 -3.518 -13.336 1.764 821 H VAL 103 H VAL 103 -2.962 -16.180 5.850 822 HA VAL 103 HA VAL 103 -0.810 -18.090 5.327 823 HB VAL 103 HB VAL 103 -1.672 -16.193 7.507 824 HG11 VAL 103 1HG1 VAL 103 0.154 -18.526 7.769 825 HG12 VAL 103 2HG1 VAL 103 -0.787 -17.689 9.003 826 HG13 VAL 103 3HG1 VAL 103 0.735 -17.000 8.437 827 HG21 VAL 103 3HG2 VAL 103 0.800 -16.486 5.772 828 HG22 VAL 103 1HG2 VAL 103 0.607 -15.257 7.022 829 HG23 VAL 103 2HG2 VAL 103 -0.457 -15.260 5.616 830 H SER 104 H SER 104 -3.810 -17.982 7.129 831 HA SER 104 HA SER 104 -3.313 -20.481 8.579 832 HB2 SER 104 2HB SER 104 -4.666 -18.341 9.231 833 HB3 SER 104 1HB SER 104 -5.945 -19.072 8.262 834 HG SER 104 HG SER 104 -5.330 -19.599 10.754 835 H GLU 105 H GLU 105 -5.099 -19.404 5.792 836 HA GLU 105 HA GLU 105 -5.717 -22.259 5.118 837 HB2 GLU 105 2HB GLU 105 -7.574 -19.974 4.475 838 HB3 GLU 105 1HB GLU 105 -7.952 -21.688 4.635 839 HG2 GLU 105 2HG GLU 105 -7.011 -21.147 7.136 840 HG3 GLU 105 1HG GLU 105 -7.745 -19.597 6.718 841 H GLY 106 H GLY 106 -5.174 -18.946 3.947 842 HA2 GLY 106 2HA GLY 106 -3.768 -18.571 1.971 843 HA3 GLY 106 1HA GLY 106 -4.322 -20.125 1.340 844 H SER 107 H SER 107 -6.649 -18.037 2.853 845 HA SER 107 HA SER 107 -7.819 -17.453 0.143 846 HB2 SER 107 2HB SER 107 -9.418 -17.289 2.639 847 HB3 SER 107 1HB SER 107 -9.864 -17.924 1.059 848 HG SER 107 HG SER 107 -9.015 -19.824 1.571 849 H ASP 108 H ASP 108 -7.905 -15.362 -0.415 850 HA ASP 108 HA ASP 108 -7.273 -13.274 1.618 851 HB2 ASP 108 2HB ASP 108 -7.076 -11.894 -0.482 852 HB3 ASP 108 1HB ASP 108 -6.021 -13.306 -0.487 853 H ASP 109 H ASP 109 -9.954 -14.862 0.770 854 HA ASP 109 HA ASP 109 -11.724 -12.550 0.209 855 HB2 ASP 109 2HB ASP 109 -11.925 -15.544 0.359 856 HB3 ASP 109 1HB ASP 109 -13.401 -14.578 0.402 857 H ILE 110 H ILE 110 -11.375 -11.423 2.312 858 HA ILE 110 HA ILE 110 -12.392 -12.828 4.716 859 HB ILE 110 HB ILE 110 -11.673 -10.623 5.789 860 HG12 ILE 110 2HG1 ILE 110 -10.312 -10.124 3.140 861 HG13 ILE 110 1HG1 ILE 110 -11.890 -9.425 3.507 862 HG21 ILE 110 1HG2 ILE 110 -10.227 -12.656 5.715 863 HG22 ILE 110 2HG2 ILE 110 -9.291 -11.165 5.644 864 HG23 ILE 110 3HG2 ILE 110 -9.567 -12.101 4.176 865 HD11 ILE 110 3HD1 ILE 110 -9.908 -7.943 4.074 866 HD12 ILE 110 1HD1 ILE 110 -9.487 -9.115 5.321 867 HD13 ILE 110 2HD1 ILE 110 -11.018 -8.246 5.411 868 H GLY 111 H GLY 111 -14.141 -12.004 2.398 869 HA2 GLY 111 2HA GLY 111 -16.413 -11.365 2.321 870 HA3 GLY 111 1HA GLY 111 -16.300 -10.884 4.013 871 H GLU 112 H GLU 112 -13.737 -9.423 2.529 872 HA GLU 112 HA GLU 112 -15.115 -6.819 2.528 873 HB2 GLU 112 2HB GLU 112 -12.268 -7.737 2.041 874 HB3 GLU 112 1HB GLU 112 -12.756 -6.042 2.085 875 HG2 GLU 112 2HG GLU 112 -13.281 -7.988 4.345 876 HG3 GLU 112 1HG GLU 112 -11.876 -6.926 4.282 877 H ASN 113 H ASN 113 -14.730 -5.300 0.650 878 HA ASN 113 HA ASN 113 -14.756 -6.742 -1.976 879 HB2 ASN 113 2HB ASN 113 -16.406 -4.785 -2.534 880 HB3 ASN 113 1HB ASN 113 -16.996 -6.169 -1.620 881 HD21 ASN 113 1HD2 ASN 113 -15.023 -3.345 -0.522 882 HD22 ASN 113 2HD2 ASN 113 -16.118 -2.870 0.681 883 H ILE 114 H ILE 114 -12.995 -6.113 -3.127 884 HA ILE 114 HA ILE 114 -11.552 -3.651 -2.532 885 HB ILE 114 HB ILE 114 -11.285 -5.464 -4.940 886 HG12 ILE 114 2HG1 ILE 114 -11.354 -7.000 -3.123 887 HG13 ILE 114 1HG1 ILE 114 -9.639 -6.703 -3.394 888 HG21 ILE 114 1HG2 ILE 114 -9.064 -4.222 -3.343 889 HG22 ILE 114 2HG2 ILE 114 -9.949 -3.241 -4.511 890 HG23 ILE 114 3HG2 ILE 114 -9.087 -4.683 -5.044 891 HD11 ILE 114 3HD1 ILE 114 -10.123 -6.574 -1.000 892 HD12 ILE 114 1HD1 ILE 114 -11.372 -5.363 -1.298 893 HD13 ILE 114 2HD1 ILE 114 -9.676 -4.979 -1.605 894 H ASP 115 H ASP 115 -13.156 -4.796 -5.550 895 HA ASP 115 HA ASP 115 -13.089 -2.429 -7.007 896 HB2 ASP 115 2HB ASP 115 -15.093 -4.654 -6.704 897 HB3 ASP 115 1HB ASP 115 -15.427 -3.317 -7.808 898 H VAL 116 H VAL 116 -14.945 -3.245 -4.237 899 HA VAL 116 HA VAL 116 -16.615 -0.820 -4.350 900 HB VAL 116 HB VAL 116 -16.377 -2.982 -2.253 901 HG11 VAL 116 1HG1 VAL 116 -17.945 -1.804 -1.153 902 HG12 VAL 116 2HG1 VAL 116 -19.008 -1.891 -2.559 903 HG13 VAL 116 3HG1 VAL 116 -17.869 -0.555 -2.396 904 HG21 VAL 116 3HG2 VAL 116 -16.922 -3.763 -4.634 905 HG22 VAL 116 1HG2 VAL 116 -18.419 -2.844 -4.484 906 HG23 VAL 116 2HG2 VAL 116 -18.096 -4.191 -3.391 907 H PHE 117 H PHE 117 -14.403 -2.330 -2.059 908 HA PHE 117 HA PHE 117 -14.129 -0.074 -0.313 909 HB2 PHE 117 2HB PHE 117 -13.460 -2.460 0.123 910 HB3 PHE 117 1HB PHE 117 -12.094 -2.232 -0.969 911 HD1 PHE 117 1HD PHE 117 -13.632 -1.077 2.210 912 HD2 PHE 117 2HD PHE 117 -10.130 -1.054 -0.277 913 HE1 PHE 117 1HE PHE 117 -12.322 -0.080 4.064 914 HE2 PHE 117 2HE PHE 117 -8.820 -0.056 1.577 915 HZ PHE 117 HZ PHE 117 -9.915 0.430 3.748 916 H SER 118 H SER 118 -12.849 -0.708 -3.456 917 HA SER 118 HA SER 118 -10.716 1.292 -3.227 918 HB2 SER 118 2HB SER 118 -10.211 -0.701 -4.471 919 HB3 SER 118 1HB SER 118 -11.734 -0.599 -5.350 920 HG SER 118 HG SER 118 -10.753 0.629 -6.732 921 H ASP 119 H ASP 119 -13.750 0.703 -4.856 922 HA ASP 119 HA ASP 119 -13.905 3.186 -6.283 923 HB2 ASP 119 2HB ASP 119 -15.310 1.347 -6.922 924 HB3 ASP 119 1HB ASP 119 -15.920 1.168 -5.276 925 H THR 120 H THR 120 -14.550 2.180 -3.066 926 HA THR 120 HA THR 120 -16.075 4.444 -2.160 927 HB THR 120 HB THR 120 -14.646 2.085 -1.107 928 HG1 THR 120 1HG THR 120 -16.549 2.183 0.277 929 HG21 THR 120 3HG2 THR 120 -14.715 4.664 0.416 930 HG22 THR 120 1HG2 THR 120 -13.462 3.424 0.369 931 HG23 THR 120 2HG2 THR 120 -14.943 3.147 1.287 932 H ILE 121 H ILE 121 -12.710 3.537 -1.985 933 HA ILE 121 HA ILE 121 -11.723 6.044 -0.957 934 HB ILE 121 HB ILE 121 -10.852 3.401 -1.643 935 HG12 ILE 121 2HG1 ILE 121 -10.605 4.783 0.480 936 HG13 ILE 121 1HG1 ILE 121 -9.199 3.830 0.005 937 HG21 ILE 121 1HG2 ILE 121 -8.485 4.134 -2.398 938 HG22 ILE 121 2HG2 ILE 121 -9.273 5.617 -2.938 939 HG23 ILE 121 3HG2 ILE 121 -9.758 4.062 -3.617 940 HD11 ILE 121 3HD1 ILE 121 -9.109 6.502 0.591 941 HD12 ILE 121 1HD1 ILE 121 -9.300 6.542 -1.161 942 HD13 ILE 121 2HD1 ILE 121 -7.942 5.677 -0.442 943 H LYS 122 H LYS 122 -11.891 4.590 -4.207 944 HA LYS 122 HA LYS 122 -10.673 6.718 -5.657 945 HB2 LYS 122 2HB LYS 122 -12.231 4.253 -6.069 946 HB3 LYS 122 1HB LYS 122 -12.506 5.467 -7.321 947 HG2 LYS 122 2HG LYS 122 -10.562 4.807 -8.252 948 HG3 LYS 122 1HG LYS 122 -9.758 5.549 -6.871 949 HD2 LYS 122 2HD LYS 122 -10.778 2.960 -6.122 950 HD3 LYS 122 1HD LYS 122 -9.768 2.814 -7.560 951 HE2 LYS 122 2HE LYS 122 -8.743 4.567 -5.365 952 HE3 LYS 122 1HE LYS 122 -8.683 2.811 -5.109 953 HZ1 LYS 122 3HZ LYS 122 -7.363 4.435 -7.157 954 HZ2 LYS 122 1HZ LYS 122 -7.883 2.882 -7.600 955 HZ3 LYS 122 2HZ LYS 122 -6.787 3.075 -6.317 956 H SER 123 H SER 123 -13.949 6.087 -4.535 957 HA SER 123 HA SER 123 -15.078 8.404 -5.932 958 HB2 SER 123 2HB SER 123 -16.259 6.237 -5.478 959 HB3 SER 123 1HB SER 123 -16.186 6.624 -3.762 960 HG SER 123 HG SER 123 -17.522 8.027 -5.834 961 H PHE 124 H PHE 124 -13.472 7.715 -3.029 962 HA PHE 124 HA PHE 124 -14.627 9.794 -1.358 963 HB2 PHE 124 2HB PHE 124 -12.883 7.615 -1.124 964 HB3 PHE 124 1HB PHE 124 -11.878 9.022 -0.778 965 HD1 PHE 124 1HD PHE 124 -13.407 10.903 0.620 966 HD2 PHE 124 2HD PHE 124 -13.744 6.624 0.798 967 HE1 PHE 124 1HE PHE 124 -14.423 11.077 2.876 968 HE2 PHE 124 2HE PHE 124 -14.760 6.799 3.053 969 HZ PHE 124 HZ PHE 124 -15.099 9.024 4.093 970 H ALA 125 H ALA 125 -12.786 9.906 -4.112 971 HA ALA 125 HA ALA 125 -11.376 12.429 -3.311 972 HB1 ALA 125 1HB ALA 125 -10.566 10.074 -4.614 973 HB2 ALA 125 2HB ALA 125 -9.642 11.570 -4.485 974 HB3 ALA 125 3HB ALA 125 -10.669 11.286 -5.891 975 H SER 126 H SER 126 -14.262 12.198 -4.088 976 HA SER 126 HA SER 126 -14.237 14.285 -6.182 977 HB2 SER 126 2HB SER 126 -14.366 12.536 -7.695 978 HB3 SER 126 1HB SER 126 -15.102 11.445 -6.525 979 HG SER 126 HG SER 126 -16.288 13.555 -7.991 980 H SER 127 H SER 127 -16.503 12.000 -4.586 981 HA SER 127 HA SER 127 -18.466 14.184 -4.234 982 HB2 SER 127 2HB SER 127 -18.569 11.469 -4.751 983 HB3 SER 127 1HB SER 127 -18.983 11.543 -3.041 984 HG SER 127 HG SER 127 -20.588 13.071 -3.578 985 H GLY 128 H GLY 128 -19.085 14.985 -2.188 986 HA2 GLY 128 2HA GLY 128 -18.741 14.066 0.347 987 HA3 GLY 128 1HA GLY 128 -17.113 14.631 -0.037 988 H LYS 129 H LYS 129 -18.040 16.004 1.966 989 HA LYS 129 HA LYS 129 -18.632 18.670 0.843 990 HB2 LYS 129 2HB LYS 129 -20.672 18.906 2.207 991 HB3 LYS 129 1HB LYS 129 -20.825 17.534 1.111 992 HG2 LYS 129 2HG LYS 129 -19.682 16.328 3.274 993 HG3 LYS 129 1HG LYS 129 -20.652 17.575 4.061 994 HD2 LYS 129 2HD LYS 129 -22.403 16.634 2.171 995 HD3 LYS 129 1HD LYS 129 -21.520 15.168 2.597 996 HE2 LYS 129 2HE LYS 129 -21.915 15.997 5.077 997 HE3 LYS 129 1HE LYS 129 -23.254 16.898 4.336 998 HZ1 LYS 129 3HZ LYS 129 -22.825 14.004 4.490 999 HZ2 LYS 129 1HZ LYS 129 -23.585 14.617 3.103 1000 HZ3 LYS 129 2HZ LYS 129 -24.268 14.890 4.635 1001 H GLU 130 H GLU 130 -18.043 20.344 2.315 1002 HA GLU 130 HA GLU 130 -16.992 21.302 4.209 1003 HB2 GLU 130 2HB GLU 130 -18.794 19.538 5.141 1004 HB3 GLU 130 1HB GLU 130 -17.325 18.751 5.721 1005 HG2 GLU 130 2HG GLU 130 -16.658 20.720 6.935 1006 HG3 GLU 130 1HG GLU 130 -17.938 21.679 6.195 1007 H LYS 131 H LYS 131 -14.862 21.346 3.351 1008 HA LYS 131 HA LYS 131 -13.177 18.910 3.727 1009 HB2 LYS 131 2HB LYS 131 -13.451 20.323 1.550 1010 HB3 LYS 131 1HB LYS 131 -12.394 21.482 2.359 1011 HG2 LYS 131 2HG LYS 131 -10.670 20.248 1.576 1012 HG3 LYS 131 1HG LYS 131 -11.125 19.046 2.786 1013 HD2 LYS 131 2HD LYS 131 -12.749 18.099 1.084 1014 HD3 LYS 131 1HD LYS 131 -12.005 19.164 -0.109 1015 HE2 LYS 131 2HE LYS 131 -9.759 18.066 0.840 1016 HE3 LYS 131 1HE LYS 131 -10.874 16.738 1.222 1017 HZ1 LYS 131 3HZ LYS 131 -9.912 16.737 -1.103 1018 HZ2 LYS 131 1HZ LYS 131 -10.873 18.101 -1.408 1019 HZ3 LYS 131 2HZ LYS 131 -11.603 16.624 -0.994 1020 H LEU 132 H LEU 132 -12.898 19.171 6.054 1021 HA LEU 132 HA LEU 132 -11.811 20.001 7.982 1022 HB2 LEU 132 2HB LEU 132 -10.120 20.284 5.620 1023 HB3 LEU 132 1HB LEU 132 -9.709 21.470 6.861 1024 HG LEU 132 HG LEU 132 -9.865 19.419 8.491 1025 HD11 LEU 132 1HD1 LEU 132 -10.569 18.132 6.170 1026 HD12 LEU 132 2HD1 LEU 132 -9.908 17.331 7.595 1027 HD13 LEU 132 3HD1 LEU 132 -8.843 17.781 6.262 1028 HD21 LEU 132 3HD2 LEU 132 -7.741 20.330 8.376 1029 HD22 LEU 132 1HD2 LEU 132 -7.686 20.241 6.615 1030 HD23 LEU 132 2HD2 LEU 132 -7.427 18.788 7.580 1031 H GLU 133 H GLU 133 -13.291 21.527 8.807 1032 HA GLU 133 HA GLU 133 -13.038 24.334 7.784 1033 HB2 GLU 133 2HB GLU 133 -15.234 22.838 7.840 1034 HB3 GLU 133 1HB GLU 133 -15.275 23.358 9.525 1035 HG2 GLU 133 2HG GLU 133 -15.132 25.721 8.786 1036 HG3 GLU 133 1HG GLU 133 -15.149 25.182 7.107 Start of MODEL 14 1 H1 MET 1 1HT MET 1 5.618 -27.021 -6.262 2 H2 MET 1 2HT MET 1 4.919 -27.861 -4.961 3 H3 MET 1 3HT MET 1 4.784 -28.471 -6.541 4 HA MET 1 HA MET 1 6.488 -29.785 -5.782 5 HB2 MET 1 2HB MET 1 7.000 -27.759 -7.578 6 HB3 MET 1 1HB MET 1 8.317 -27.563 -6.420 7 HG2 MET 1 2HG MET 1 9.374 -29.335 -7.310 8 HG3 MET 1 1HG MET 1 7.990 -30.358 -6.923 9 HE1 MET 1 2HE MET 1 5.874 -30.364 -8.182 10 HE2 MET 1 3HE MET 1 6.826 -31.690 -8.846 11 HE3 MET 1 1HE MET 1 5.887 -30.644 -9.922 12 H MET 2 H MET 2 6.222 -26.732 -4.162 13 HA MET 2 HA MET 2 7.537 -27.809 -1.778 14 HB2 MET 2 2HB MET 2 9.241 -25.917 -1.814 15 HB3 MET 2 1HB MET 2 9.490 -27.172 -3.030 16 HG2 MET 2 2HG MET 2 8.771 -25.818 -4.775 17 HG3 MET 2 1HG MET 2 7.784 -24.809 -3.717 18 HE1 MET 2 3HE MET 2 12.124 -25.086 -4.513 19 HE2 MET 2 1HE MET 2 11.035 -26.335 -3.890 20 HE3 MET 2 2HE MET 2 11.965 -25.336 -2.776 21 H GLU 3 H GLU 3 6.634 -26.825 0.003 22 HA GLU 3 HA GLU 3 4.680 -24.662 -0.422 23 HB2 GLU 3 2HB GLU 3 4.226 -25.109 1.987 24 HB3 GLU 3 1HB GLU 3 4.170 -26.584 1.017 25 HG2 GLU 3 2HG GLU 3 6.346 -27.254 1.760 26 HG3 GLU 3 1HG GLU 3 6.669 -25.662 2.455 27 H GLU 4 H GLU 4 7.954 -24.779 0.157 28 HA GLU 4 HA GLU 4 8.091 -22.671 2.142 29 HB2 GLU 4 2HB GLU 4 10.155 -23.865 0.268 30 HB3 GLU 4 1HB GLU 4 10.523 -22.846 1.662 31 HG2 GLU 4 2HG GLU 4 10.213 -24.546 3.126 32 HG3 GLU 4 1HG GLU 4 8.753 -25.096 2.304 33 H TYR 5 H TYR 5 7.347 -22.679 -1.099 34 HA TYR 5 HA TYR 5 8.744 -20.273 -1.934 35 HB2 TYR 5 2HB TYR 5 7.628 -22.316 -3.234 36 HB3 TYR 5 1HB TYR 5 6.229 -21.239 -3.224 37 HD1 TYR 5 2HD TYR 5 9.765 -21.585 -4.289 38 HD2 TYR 5 1HD TYR 5 6.182 -19.229 -4.545 39 HE1 TYR 5 2HE TYR 5 10.760 -20.275 -6.146 40 HE2 TYR 5 1HE TYR 5 7.176 -17.921 -6.401 41 HH TYR 5 HH TYR 5 10.508 -18.532 -7.506 42 H LEU 6 H LEU 6 5.656 -21.045 -0.551 43 HA LEU 6 HA LEU 6 4.684 -18.256 -0.762 44 HB2 LEU 6 2HB LEU 6 2.643 -19.244 0.229 45 HB3 LEU 6 1HB LEU 6 3.193 -20.204 -1.144 46 HG LEU 6 HG LEU 6 4.572 -21.346 0.946 47 HD11 LEU 6 1HD1 LEU 6 1.794 -21.146 2.024 48 HD12 LEU 6 2HD1 LEU 6 2.886 -19.794 2.321 49 HD13 LEU 6 3HD1 LEU 6 3.313 -21.411 2.881 50 HD21 LEU 6 3HD2 LEU 6 2.103 -21.963 -0.604 51 HD22 LEU 6 1HD2 LEU 6 2.414 -22.958 0.819 52 HD23 LEU 6 2HD2 LEU 6 3.606 -22.876 -0.479 53 H GLY 7 H GLY 7 6.094 -20.465 1.581 54 HA2 GLY 7 2HA GLY 7 5.407 -19.009 3.957 55 HA3 GLY 7 1HA GLY 7 6.761 -20.131 3.808 56 H VAL 8 H VAL 8 8.013 -18.671 1.592 57 HA VAL 8 HA VAL 8 9.367 -16.608 3.198 58 HB VAL 8 HB VAL 8 9.799 -17.751 0.428 59 HG11 VAL 8 1HG1 VAL 8 11.992 -16.628 0.519 60 HG12 VAL 8 2HG1 VAL 8 11.567 -15.914 2.074 61 HG13 VAL 8 3HG1 VAL 8 10.684 -15.450 0.620 62 HG21 VAL 8 3HG2 VAL 8 11.947 -18.434 2.013 63 HG22 VAL 8 1HG2 VAL 8 10.565 -19.481 1.692 64 HG23 VAL 8 2HG2 VAL 8 10.609 -18.504 3.160 65 H PHE 9 H PHE 9 7.285 -16.853 0.431 66 HA PHE 9 HA PHE 9 7.472 -14.101 -0.429 67 HB2 PHE 9 2HB PHE 9 6.007 -16.537 -1.035 68 HB3 PHE 9 1HB PHE 9 4.930 -15.139 -1.072 69 HD1 PHE 9 1HD PHE 9 7.902 -16.712 -2.573 70 HD2 PHE 9 2HD PHE 9 5.281 -13.311 -2.654 71 HE1 PHE 9 1HE PHE 9 8.841 -16.042 -4.768 72 HE2 PHE 9 2HE PHE 9 6.219 -12.639 -4.850 73 HZ PHE 9 HZ PHE 9 7.999 -14.006 -5.906 74 H VAL 10 H VAL 10 5.664 -15.810 2.033 75 HA VAL 10 HA VAL 10 3.813 -13.595 2.577 76 HB VAL 10 HB VAL 10 4.516 -16.235 3.899 77 HG11 VAL 10 1HG1 VAL 10 2.379 -14.219 4.658 78 HG12 VAL 10 2HG1 VAL 10 3.777 -14.670 5.633 79 HG13 VAL 10 3HG1 VAL 10 2.507 -15.850 5.315 80 HG21 VAL 10 3HG2 VAL 10 2.900 -17.105 2.577 81 HG22 VAL 10 1HG2 VAL 10 2.963 -15.595 1.668 82 HG23 VAL 10 2HG2 VAL 10 1.785 -15.796 2.965 83 H ASP 11 H ASP 11 6.849 -14.893 3.858 84 HA ASP 11 HA ASP 11 6.935 -13.248 6.226 85 HB2 ASP 11 2HB ASP 11 8.269 -15.404 5.328 86 HB3 ASP 11 1HB ASP 11 9.415 -14.155 4.839 87 H GLU 12 H GLU 12 7.575 -12.749 2.906 88 HA GLU 12 HA GLU 12 9.174 -10.295 3.306 89 HB2 GLU 12 2HB GLU 12 8.139 -11.890 0.954 90 HB3 GLU 12 1HB GLU 12 8.941 -10.336 0.733 91 HG2 GLU 12 2HG GLU 12 10.748 -11.455 2.348 92 HG3 GLU 12 1HG GLU 12 10.074 -12.938 1.670 93 H THR 13 H THR 13 5.887 -11.254 2.375 94 HA THR 13 HA THR 13 5.012 -8.628 1.548 95 HB THR 13 HB THR 13 4.060 -11.040 1.156 96 HG1 THR 13 1HG THR 13 2.143 -9.090 1.815 97 HG21 THR 13 3HG2 THR 13 2.665 -11.960 2.735 98 HG22 THR 13 1HG2 THR 13 2.190 -10.389 3.382 99 HG23 THR 13 2HG2 THR 13 3.746 -11.088 3.822 100 H LYS 14 H LYS 14 5.223 -10.271 4.659 101 HA LYS 14 HA LYS 14 3.561 -8.308 6.066 102 HB2 LYS 14 2HB LYS 14 5.359 -10.619 6.831 103 HB3 LYS 14 1HB LYS 14 4.577 -9.611 8.050 104 HG2 LYS 14 2HG LYS 14 2.588 -10.621 7.730 105 HG3 LYS 14 1HG LYS 14 2.701 -10.429 5.980 106 HD2 LYS 14 2HD LYS 14 3.141 -12.626 5.786 107 HD3 LYS 14 1HD LYS 14 4.615 -12.392 6.728 108 HE2 LYS 14 2HE LYS 14 1.877 -12.786 7.982 109 HE3 LYS 14 1HE LYS 14 3.053 -14.093 7.740 110 HZ1 LYS 14 3HZ LYS 14 4.647 -12.318 8.813 111 HZ2 LYS 14 1HZ LYS 14 3.722 -13.362 9.778 112 HZ3 LYS 14 2HZ LYS 14 3.201 -11.766 9.513 113 H GLU 15 H GLU 15 7.068 -9.078 5.940 114 HA GLU 15 HA GLU 15 7.875 -6.892 7.613 115 HB2 GLU 15 2HB GLU 15 9.256 -8.487 5.438 116 HB3 GLU 15 1HB GLU 15 10.101 -7.359 6.499 117 HG2 GLU 15 2HG GLU 15 9.345 -8.641 8.469 118 HG3 GLU 15 1HG GLU 15 8.511 -9.776 7.409 119 H TYR 16 H TYR 16 6.618 -6.987 4.490 120 HA TYR 16 HA TYR 16 7.915 -4.514 3.550 121 HB2 TYR 16 2HB TYR 16 6.128 -6.667 2.484 122 HB3 TYR 16 1HB TYR 16 6.088 -5.101 1.675 123 HD1 TYR 16 2HD TYR 16 9.177 -6.067 3.354 124 HD2 TYR 16 1HD TYR 16 7.031 -6.202 -0.364 125 HE1 TYR 16 2HE TYR 16 11.278 -6.629 2.162 126 HE2 TYR 16 1HE TYR 16 9.133 -6.762 -1.557 127 HH TYR 16 HH TYR 16 11.280 -7.512 -1.243 128 H LEU 17 H LEU 17 4.652 -5.672 4.451 129 HA LEU 17 HA LEU 17 3.261 -3.224 4.018 130 HB2 LEU 17 2HB LEU 17 2.892 -5.482 6.018 131 HB3 LEU 17 1HB LEU 17 1.674 -4.244 5.696 132 HG LEU 17 HG LEU 17 2.868 -5.867 3.460 133 HD11 LEU 17 1HD1 LEU 17 1.072 -6.772 5.581 134 HD12 LEU 17 2HD1 LEU 17 1.896 -7.711 4.337 135 HD13 LEU 17 3HD1 LEU 17 0.351 -6.938 3.981 136 HD21 LEU 17 3HD2 LEU 17 1.239 -4.884 2.188 137 HD22 LEU 17 1HD2 LEU 17 1.265 -3.668 3.464 138 HD23 LEU 17 2HD2 LEU 17 0.050 -4.947 3.490 139 H GLN 18 H GLN 18 5.141 -4.431 6.749 140 HA GLN 18 HA GLN 18 4.554 -2.218 8.513 141 HB2 GLN 18 2HB GLN 18 5.498 -3.756 9.855 142 HB3 GLN 18 1HB GLN 18 5.958 -4.692 8.442 143 HG2 GLN 18 2HG GLN 18 8.058 -3.554 8.255 144 HG3 GLN 18 1HG GLN 18 7.582 -2.352 9.455 145 HE21 GLN 18 1HE2 GLN 18 7.269 -3.178 11.733 146 HE22 GLN 18 2HE2 GLN 18 8.156 -4.531 12.243 147 H ASN 19 H ASN 19 7.214 -3.098 6.425 148 HA ASN 19 HA ASN 19 8.762 -0.713 6.745 149 HB2 ASN 19 2HB ASN 19 9.844 -2.561 5.740 150 HB3 ASN 19 1HB ASN 19 8.455 -2.920 4.714 151 HD21 ASN 19 1HD2 ASN 19 8.282 -1.799 2.684 152 HD22 ASN 19 2HD2 ASN 19 9.497 -0.766 2.102 153 H LEU 20 H LEU 20 5.952 -1.607 4.993 154 HA LEU 20 HA LEU 20 5.917 0.876 3.389 155 HB2 LEU 20 2HB LEU 20 5.220 -1.039 2.182 156 HB3 LEU 20 1HB LEU 20 4.305 -1.667 3.551 157 HG LEU 20 HG LEU 20 2.707 0.223 3.329 158 HD11 LEU 20 1HD1 LEU 20 3.476 0.982 0.634 159 HD12 LEU 20 2HD1 LEU 20 4.773 1.329 1.779 160 HD13 LEU 20 3HD1 LEU 20 3.165 2.009 2.033 161 HD21 LEU 20 3HD2 LEU 20 2.670 -2.061 1.976 162 HD22 LEU 20 1HD2 LEU 20 2.896 -0.989 0.593 163 HD23 LEU 20 2HD2 LEU 20 1.487 -0.798 1.637 164 H ASN 21 H ASN 21 4.918 -0.198 6.437 165 HA ASN 21 HA ASN 21 2.621 1.652 6.563 166 HB2 ASN 21 2HB ASN 21 3.767 -0.586 8.160 167 HB3 ASN 21 1HB ASN 21 2.941 0.686 9.060 168 HD21 ASN 21 1HD2 ASN 21 1.060 -0.593 9.582 169 HD22 ASN 21 2HD2 ASN 21 -0.041 -1.107 8.397 170 H ASP 22 H ASP 22 5.869 1.100 7.555 171 HA ASP 22 HA ASP 22 6.050 3.308 9.332 172 HB2 ASP 22 2HB ASP 22 7.617 1.382 9.321 173 HB3 ASP 22 1HB ASP 22 8.177 1.882 7.724 174 H THR 23 H THR 23 6.414 2.769 5.992 175 HA THR 23 HA THR 23 7.483 5.369 5.231 176 HB THR 23 HB THR 23 5.945 3.177 3.840 177 HG1 THR 23 1HG THR 23 8.729 3.722 3.834 178 HG21 THR 23 3HG2 THR 23 6.390 4.167 1.790 179 HG22 THR 23 1HG2 THR 23 7.800 5.033 2.400 180 HG23 THR 23 2HG2 THR 23 6.178 5.602 2.796 181 H LEU 24 H LEU 24 4.284 3.814 5.312 182 HA LEU 24 HA LEU 24 2.928 6.203 4.321 183 HB2 LEU 24 2HB LEU 24 1.239 4.708 3.989 184 HB3 LEU 24 1HB LEU 24 2.451 3.491 4.364 185 HG LEU 24 HG LEU 24 1.754 3.929 6.847 186 HD11 LEU 24 1HD1 LEU 24 0.260 5.893 5.867 187 HD12 LEU 24 2HD1 LEU 24 -0.306 4.932 7.236 188 HD13 LEU 24 3HD1 LEU 24 -0.897 4.585 5.611 189 HD21 LEU 24 3HD2 LEU 24 0.448 2.017 6.710 190 HD22 LEU 24 1HD2 LEU 24 1.234 1.954 5.133 191 HD23 LEU 24 2HD2 LEU 24 -0.408 2.580 5.276 192 H LEU 25 H LEU 25 3.870 4.827 7.387 193 HA LEU 25 HA LEU 25 1.981 6.420 8.969 194 HB2 LEU 25 2HB LEU 25 4.400 4.708 9.532 195 HB3 LEU 25 1HB LEU 25 3.571 5.591 10.823 196 HG LEU 25 HG LEU 25 2.042 3.907 8.880 197 HD11 LEU 25 1HD1 LEU 25 2.237 1.993 10.346 198 HD12 LEU 25 2HD1 LEU 25 3.154 2.930 11.526 199 HD13 LEU 25 3HD1 LEU 25 3.869 2.540 9.961 200 HD21 LEU 25 3HD2 LEU 25 1.325 4.200 11.750 201 HD22 LEU 25 1HD2 LEU 25 0.289 4.245 10.322 202 HD23 LEU 25 2HD2 LEU 25 1.236 5.667 10.769 203 H GLU 26 H GLU 26 4.928 6.939 7.425 204 HA GLU 26 HA GLU 26 5.559 9.319 9.084 205 HB2 GLU 26 2HB GLU 26 6.935 7.762 6.882 206 HB3 GLU 26 1HB GLU 26 7.515 9.358 7.362 207 HG2 GLU 26 2HG GLU 26 7.383 8.325 9.793 208 HG3 GLU 26 1HG GLU 26 7.513 6.799 8.919 209 H LEU 27 H LEU 27 4.340 8.146 6.124 210 HA LEU 27 HA LEU 27 4.193 10.560 4.672 211 HB2 LEU 27 2HB LEU 27 3.961 8.455 3.544 212 HB3 LEU 27 1HB LEU 27 2.680 7.959 4.648 213 HG LEU 27 HG LEU 27 1.256 9.799 3.778 214 HD11 LEU 27 1HD1 LEU 27 3.278 10.068 1.556 215 HD12 LEU 27 2HD1 LEU 27 3.371 11.084 2.994 216 HD13 LEU 27 3HD1 LEU 27 1.944 11.147 1.960 217 HD21 LEU 27 3HD2 LEU 27 1.304 8.735 1.294 218 HD22 LEU 27 1HD2 LEU 27 0.632 7.881 2.683 219 HD23 LEU 27 2HD2 LEU 27 2.274 7.531 2.143 220 H GLU 28 H GLU 28 2.207 9.119 7.161 221 HA GLU 28 HA GLU 28 -0.121 10.787 6.728 222 HB2 GLU 28 2HB GLU 28 -0.902 9.636 8.597 223 HB3 GLU 28 1HB GLU 28 0.360 8.543 8.042 224 HG2 GLU 28 2HG GLU 28 1.941 9.557 9.625 225 HG3 GLU 28 1HG GLU 28 0.676 10.642 10.195 226 H LYS 29 H LYS 29 2.779 10.949 8.763 227 HA LYS 29 HA LYS 29 2.036 13.452 10.029 228 HB2 LYS 29 2HB LYS 29 3.806 12.848 11.302 229 HB3 LYS 29 1HB LYS 29 3.940 11.420 10.285 230 HG2 LYS 29 2HG LYS 29 5.261 13.156 8.712 231 HG3 LYS 29 1HG LYS 29 5.579 13.904 10.281 232 HD2 LYS 29 2HD LYS 29 5.971 10.979 9.689 233 HD3 LYS 29 1HD LYS 29 7.269 12.171 9.600 234 HE2 LYS 29 2HE LYS 29 5.663 12.184 12.103 235 HE3 LYS 29 1HE LYS 29 6.726 10.783 11.864 236 HZ1 LYS 29 3HZ LYS 29 7.593 13.132 12.791 237 HZ2 LYS 29 1HZ LYS 29 7.843 13.362 11.129 238 HZ3 LYS 29 2HZ LYS 29 8.574 12.049 11.924 239 H ASN 30 H ASN 30 3.242 12.413 7.060 240 HA ASN 30 HA ASN 30 3.465 15.216 6.098 241 HB2 ASN 30 2HB ASN 30 5.700 13.626 6.782 242 HB3 ASN 30 1HB ASN 30 5.612 13.572 5.021 243 HD21 ASN 30 1HD2 ASN 30 7.407 15.135 7.056 244 HD22 ASN 30 2HD2 ASN 30 7.360 16.725 6.463 245 HA PRO 31 HA PRO 31 1.353 12.388 3.291 246 HB2 PRO 31 2HB PRO 31 -1.088 13.554 3.505 247 HB3 PRO 31 1HB PRO 31 -0.477 12.363 4.663 248 HG2 PRO 31 2HG PRO 31 -0.846 15.247 4.987 249 HG3 PRO 31 1HG PRO 31 -0.781 13.962 6.202 250 HD2 PRO 31 2HD PRO 31 1.294 15.758 5.437 251 HD3 PRO 31 1HD PRO 31 1.368 14.437 6.625 252 H GLU 32 H GLU 32 2.813 15.095 2.915 253 HA GLU 32 HA GLU 32 1.406 15.847 0.387 254 HB2 GLU 32 2HB GLU 32 2.908 18.024 1.617 255 HB3 GLU 32 1HB GLU 32 1.219 17.995 1.118 256 HG2 GLU 32 2HG GLU 32 0.548 16.985 3.212 257 HG3 GLU 32 1HG GLU 32 2.234 16.762 3.692 258 H ASP 33 H ASP 33 4.089 14.570 1.803 259 HA ASP 33 HA ASP 33 6.092 15.794 0.049 260 HB2 ASP 33 2HB ASP 33 5.977 13.927 2.366 261 HB3 ASP 33 1HB ASP 33 7.366 13.772 1.288 262 H MET 34 H MET 34 7.281 14.485 -1.537 263 HA MET 34 HA MET 34 5.578 12.383 -2.751 264 HB2 MET 34 2HB MET 34 8.114 13.699 -3.766 265 HB3 MET 34 1HB MET 34 6.907 12.834 -4.721 266 HG2 MET 34 2HG MET 34 6.233 15.303 -3.109 267 HG3 MET 34 1HG MET 34 6.761 15.385 -4.788 268 HE1 MET 34 3HE MET 34 3.898 15.291 -6.702 269 HE2 MET 34 1HE MET 34 5.046 13.961 -6.909 270 HE3 MET 34 2HE MET 34 5.616 15.555 -6.418 271 H GLU 35 H GLU 35 8.210 12.550 -0.636 272 HA GLU 35 HA GLU 35 9.638 10.208 -1.668 273 HB2 GLU 35 2HB GLU 35 10.969 10.511 0.388 274 HB3 GLU 35 1HB GLU 35 10.741 12.057 -0.426 275 HG2 GLU 35 2HG GLU 35 8.795 12.498 1.106 276 HG3 GLU 35 1HG GLU 35 9.218 11.026 1.982 277 H LEU 36 H LEU 36 7.510 10.881 1.140 278 HA LEU 36 HA LEU 36 7.391 8.048 1.864 279 HB2 LEU 36 2HB LEU 36 5.603 10.385 2.634 280 HB3 LEU 36 1HB LEU 36 5.745 8.856 3.495 281 HG LEU 36 HG LEU 36 7.764 11.071 3.275 282 HD11 LEU 36 1HD1 LEU 36 6.569 9.474 5.543 283 HD12 LEU 36 2HD1 LEU 36 6.243 11.163 5.158 284 HD13 LEU 36 3HD1 LEU 36 7.836 10.684 5.743 285 HD21 LEU 36 3HD2 LEU 36 9.279 9.371 2.898 286 HD22 LEU 36 1HD2 LEU 36 8.220 8.140 3.586 287 HD23 LEU 36 2HD2 LEU 36 9.137 9.210 4.648 288 H ILE 37 H ILE 37 5.793 10.220 -0.300 289 HA ILE 37 HA ILE 37 3.378 8.603 -0.657 290 HB ILE 37 HB ILE 37 4.685 11.009 -1.921 291 HG12 ILE 37 2HG1 ILE 37 2.112 10.474 -0.423 292 HG13 ILE 37 1HG1 ILE 37 3.486 11.440 0.113 293 HG21 ILE 37 1HG2 ILE 37 2.911 9.166 -3.244 294 HG22 ILE 37 2HG2 ILE 37 3.624 10.655 -3.868 295 HG23 ILE 37 3HG2 ILE 37 2.088 10.707 -3.004 296 HD11 ILE 37 3HD1 ILE 37 3.008 12.832 -2.058 297 HD12 ILE 37 1HD1 ILE 37 2.010 13.089 -0.628 298 HD13 ILE 37 2HD1 ILE 37 1.408 12.096 -1.955 299 H ASN 38 H ASN 38 6.588 8.923 -2.107 300 HA ASN 38 HA ASN 38 5.857 7.109 -4.324 301 HB2 ASN 38 2HB ASN 38 7.334 9.181 -4.513 302 HB3 ASN 38 1HB ASN 38 8.552 8.284 -3.604 303 HD21 ASN 38 1HD2 ASN 38 9.616 6.482 -4.668 304 HD22 ASN 38 2HD2 ASN 38 9.459 6.208 -6.336 305 H GLU 39 H GLU 39 7.238 6.981 -1.200 306 HA GLU 39 HA GLU 39 8.657 4.448 -1.621 307 HB2 GLU 39 2HB GLU 39 7.949 6.145 0.789 308 HB3 GLU 39 1HB GLU 39 8.877 4.649 0.911 309 HG2 GLU 39 2HG GLU 39 9.869 6.493 -1.155 310 HG3 GLU 39 1HG GLU 39 9.971 7.136 0.484 311 H ALA 40 H ALA 40 5.577 5.588 -0.650 312 HA ALA 40 HA ALA 40 4.641 2.984 0.383 313 HB1 ALA 40 1HB ALA 40 3.388 5.706 -0.090 314 HB2 ALA 40 2HB ALA 40 3.867 5.009 1.456 315 HB3 ALA 40 3HB ALA 40 2.497 4.337 0.574 316 H PHE 41 H PHE 41 4.026 5.173 -2.393 317 HA PHE 41 HA PHE 41 2.128 3.594 -3.783 318 HB2 PHE 41 2HB PHE 41 2.479 5.735 -4.636 319 HB3 PHE 41 1HB PHE 41 4.223 5.646 -4.411 320 HD1 PHE 41 1HD PHE 41 5.528 3.998 -5.940 321 HD2 PHE 41 2HD PHE 41 1.539 5.363 -6.756 322 HE1 PHE 41 1HE PHE 41 5.807 3.380 -8.324 323 HE2 PHE 41 2HE PHE 41 1.816 4.745 -9.142 324 HZ PHE 41 HZ PHE 41 3.950 3.752 -9.926 325 H ARG 42 H ARG 42 5.629 3.316 -3.493 326 HA ARG 42 HA ARG 42 6.030 1.377 -5.600 327 HB2 ARG 42 2HB ARG 42 7.497 2.551 -3.277 328 HB3 ARG 42 1HB ARG 42 8.134 1.056 -3.965 329 HG2 ARG 42 2HG ARG 42 7.366 3.280 -5.821 330 HG3 ARG 42 1HG ARG 42 8.890 3.398 -4.938 331 HD2 ARG 42 2HD ARG 42 8.942 0.787 -5.822 332 HD3 ARG 42 1HD ARG 42 8.176 1.636 -7.179 333 HE ARG 42 HE ARG 42 10.779 2.498 -5.967 334 HH11 ARG 42 1HH1 ARG 42 10.670 0.885 -8.550 335 HH12 ARG 42 2HH1 ARG 42 10.799 2.141 -9.736 336 HH21 ARG 42 1HH2 ARG 42 10.031 4.687 -7.509 337 HH22 ARG 42 2HH2 ARG 42 10.438 4.294 -9.145 338 H ALA 43 H ALA 43 6.525 0.852 -2.105 339 HA ALA 43 HA ALA 43 6.508 -1.883 -1.927 340 HB1 ALA 43 1HB ALA 43 6.738 -0.762 0.091 341 HB2 ALA 43 2HB ALA 43 5.080 -1.337 0.253 342 HB3 ALA 43 3HB ALA 43 5.393 0.326 -0.245 343 H LEU 44 H LEU 44 3.547 0.114 -2.167 344 HA LEU 44 HA LEU 44 1.712 -2.091 -2.016 345 HB2 LEU 44 2HB LEU 44 1.681 0.753 -2.993 346 HB3 LEU 44 1HB LEU 44 0.274 -0.278 -3.263 347 HG LEU 44 HG LEU 44 1.524 -0.103 -0.532 348 HD11 LEU 44 1HD1 LEU 44 -0.220 1.905 -1.922 349 HD12 LEU 44 2HD1 LEU 44 1.106 2.171 -0.790 350 HD13 LEU 44 3HD1 LEU 44 -0.458 1.611 -0.198 351 HD21 LEU 44 3HD2 LEU 44 -0.154 -1.860 -1.032 352 HD22 LEU 44 1HD2 LEU 44 -1.301 -0.614 -1.523 353 HD23 LEU 44 2HD2 LEU 44 -0.762 -0.705 0.154 354 H HIS 45 H HIS 45 3.268 -0.428 -4.756 355 HA HIS 45 HA HIS 45 1.942 -1.957 -6.820 356 HB2 HIS 45 2HB HIS 45 2.946 0.092 -7.452 357 HB3 HIS 45 1HB HIS 45 4.425 -0.259 -6.556 358 HD1 HIS 45 1HD HIS 45 3.137 -0.270 -9.912 359 HD2 HIS 45 2HD HIS 45 5.811 -2.674 -7.803 360 HE1 HIS 45 1HE HIS 45 4.478 -1.540 -11.644 361 H THR 46 H THR 46 4.827 -2.376 -4.850 362 HA THR 46 HA THR 46 5.783 -4.734 -6.306 363 HB THR 46 HB THR 46 6.593 -2.906 -4.152 364 HG1 THR 46 1HG THR 46 8.329 -2.951 -5.329 365 HG21 THR 46 3HG2 THR 46 7.186 -5.861 -3.873 366 HG22 THR 46 1HG2 THR 46 6.465 -4.788 -2.672 367 HG23 THR 46 2HG2 THR 46 8.163 -4.606 -3.112 368 H LEU 47 H LEU 47 3.873 -4.005 -3.425 369 HA LEU 47 HA LEU 47 3.750 -6.777 -2.495 370 HB2 LEU 47 2HB LEU 47 2.681 -4.088 -1.774 371 HB3 LEU 47 1HB LEU 47 1.758 -5.480 -1.206 372 HG LEU 47 HG LEU 47 4.747 -5.241 -0.811 373 HD11 LEU 47 1HD1 LEU 47 4.211 -3.517 0.582 374 HD12 LEU 47 2HD1 LEU 47 3.661 -4.803 1.656 375 HD13 LEU 47 3HD1 LEU 47 2.503 -3.958 0.629 376 HD21 LEU 47 3HD2 LEU 47 4.542 -7.278 0.136 377 HD22 LEU 47 1HD2 LEU 47 2.877 -7.323 -0.442 378 HD23 LEU 47 2HD2 LEU 47 3.232 -6.712 1.173 379 H LYS 48 H LYS 48 1.755 -4.596 -4.449 380 HA LYS 48 HA LYS 48 -0.620 -6.206 -4.584 381 HB2 LYS 48 2HB LYS 48 -0.741 -3.937 -5.213 382 HB3 LYS 48 1HB LYS 48 0.709 -4.042 -6.207 383 HG2 LYS 48 2HG LYS 48 -0.677 -5.700 -7.662 384 HG3 LYS 48 1HG LYS 48 -2.072 -5.011 -6.831 385 HD2 LYS 48 2HD LYS 48 -1.897 -3.577 -8.651 386 HD3 LYS 48 1HD LYS 48 -0.923 -2.724 -7.452 387 HE2 LYS 48 2HE LYS 48 0.779 -2.794 -8.944 388 HE3 LYS 48 1HE LYS 48 0.847 -4.545 -8.660 389 HZ1 LYS 48 3HZ LYS 48 -1.136 -3.334 -10.493 390 HZ2 LYS 48 1HZ LYS 48 -0.655 -4.957 -10.390 391 HZ3 LYS 48 2HZ LYS 48 0.406 -3.797 -11.035 392 H GLY 49 H GLY 49 2.385 -6.126 -6.480 393 HA2 GLY 49 2HA GLY 49 1.525 -7.915 -8.555 394 HA3 GLY 49 1HA GLY 49 3.204 -7.575 -8.136 395 H MET 50 H MET 50 3.579 -8.528 -5.681 396 HA MET 50 HA MET 50 3.690 -11.362 -5.972 397 HB2 MET 50 2HB MET 50 4.394 -11.263 -3.611 398 HB3 MET 50 1HB MET 50 5.138 -9.953 -4.533 399 HG2 MET 50 2HG MET 50 3.882 -8.333 -3.507 400 HG3 MET 50 1HG MET 50 2.490 -9.395 -3.304 401 HE1 MET 50 3HE MET 50 6.415 -9.399 -1.921 402 HE2 MET 50 1HE MET 50 5.870 -8.395 -0.571 403 HE3 MET 50 2HE MET 50 5.535 -7.903 -2.230 404 H ALA 51 H ALA 51 1.063 -9.334 -5.142 405 HA ALA 51 HA ALA 51 -0.351 -11.356 -3.516 406 HB1 ALA 51 1HB ALA 51 -0.556 -8.994 -2.964 407 HB2 ALA 51 2HB ALA 51 -2.115 -9.545 -3.577 408 HB3 ALA 51 3HB ALA 51 -1.038 -8.611 -4.617 409 H GLY 52 H GLY 52 -0.075 -10.328 -6.814 410 HA2 GLY 52 2HA GLY 52 -2.580 -11.685 -7.612 411 HA3 GLY 52 1HA GLY 52 -1.508 -10.775 -8.683 412 H THR 53 H THR 53 0.882 -12.078 -7.584 413 HA THR 53 HA THR 53 0.879 -14.446 -9.305 414 HB THR 53 HB THR 53 2.873 -12.940 -7.612 415 HG1 THR 53 1HG THR 53 2.587 -13.418 -10.393 416 HG21 THR 53 3HG2 THR 53 4.360 -14.645 -9.178 417 HG22 THR 53 1HG2 THR 53 3.024 -15.674 -8.659 418 HG23 THR 53 2HG2 THR 53 4.034 -14.869 -7.459 419 H MET 54 H MET 54 0.157 -13.791 -6.088 420 HA MET 54 HA MET 54 0.941 -16.498 -5.121 421 HB2 MET 54 2HB MET 54 1.421 -14.261 -3.920 422 HB3 MET 54 1HB MET 54 -0.303 -14.237 -3.549 423 HG2 MET 54 2HG MET 54 0.003 -15.694 -1.863 424 HG3 MET 54 1HG MET 54 0.754 -16.849 -2.964 425 HE1 MET 54 3HE MET 54 2.965 -16.467 -3.966 426 HE2 MET 54 1HE MET 54 4.398 -15.904 -3.096 427 HE3 MET 54 2HE MET 54 3.352 -14.749 -3.920 428 H GLY 55 H GLY 55 -1.563 -15.262 -6.768 429 HA2 GLY 55 2HA GLY 55 -3.699 -16.198 -7.152 430 HA3 GLY 55 1HA GLY 55 -3.418 -17.303 -5.807 431 H PHE 56 H PHE 56 -2.658 -14.319 -4.630 432 HA PHE 56 HA PHE 56 -5.348 -14.064 -3.369 433 HB2 PHE 56 2HB PHE 56 -2.641 -12.849 -2.717 434 HB3 PHE 56 1HB PHE 56 -4.084 -12.727 -1.713 435 HD1 PHE 56 2HD PHE 56 -4.915 -15.704 -2.610 436 HD2 PHE 56 1HD PHE 56 -1.448 -13.922 -0.802 437 HE1 PHE 56 2HE PHE 56 -4.357 -17.870 -1.542 438 HE2 PHE 56 1HE PHE 56 -0.892 -16.090 0.266 439 HZ PHE 56 HZ PHE 56 -2.346 -18.064 -0.103 440 H SER 57 H SER 57 -5.608 -13.160 -5.887 441 HA SER 57 HA SER 57 -4.772 -10.464 -6.378 442 HB2 SER 57 2HB SER 57 -7.330 -11.460 -7.503 443 HB3 SER 57 1HB SER 57 -5.936 -10.776 -8.335 444 HG SER 57 HG SER 57 -6.547 -13.381 -7.743 445 H SER 58 H SER 58 -7.300 -11.834 -4.508 446 HA SER 58 HA SER 58 -9.128 -9.637 -4.375 447 HB2 SER 58 2HB SER 58 -8.351 -11.782 -2.368 448 HB3 SER 58 1HB SER 58 -9.787 -10.771 -2.237 449 HG SER 58 HG SER 58 -10.231 -12.778 -3.246 450 H MET 59 H MET 59 -6.021 -10.276 -2.978 451 HA MET 59 HA MET 59 -6.229 -7.895 -1.198 452 HB2 MET 59 2HB MET 59 -5.536 -9.920 -0.097 453 HB3 MET 59 1HB MET 59 -4.387 -10.295 -1.382 454 HG2 MET 59 2HG MET 59 -3.313 -7.992 -0.732 455 HG3 MET 59 1HG MET 59 -4.196 -8.210 0.779 456 HE1 MET 59 3HE MET 59 -1.658 -11.417 -1.117 457 HE2 MET 59 1HE MET 59 -0.965 -9.804 -1.339 458 HE3 MET 59 2HE MET 59 -2.612 -10.139 -1.868 459 H ALA 60 H ALA 60 -4.841 -9.067 -4.137 460 HA ALA 60 HA ALA 60 -2.594 -7.212 -4.213 461 HB1 ALA 60 1HB ALA 60 -3.969 -8.570 -6.545 462 HB2 ALA 60 2HB ALA 60 -2.938 -9.469 -5.431 463 HB3 ALA 60 3HB ALA 60 -2.264 -8.150 -6.390 464 H LYS 61 H LYS 61 -5.927 -7.270 -5.421 465 HA LYS 61 HA LYS 61 -5.767 -4.815 -6.955 466 HB2 LYS 61 2HB LYS 61 -7.840 -6.633 -5.786 467 HB3 LYS 61 1HB LYS 61 -8.359 -5.008 -6.244 468 HG2 LYS 61 2HG LYS 61 -8.562 -5.832 -8.332 469 HG3 LYS 61 1HG LYS 61 -6.799 -5.789 -8.379 470 HD2 LYS 61 2HD LYS 61 -7.501 -8.024 -8.989 471 HD3 LYS 61 1HD LYS 61 -6.783 -8.086 -7.379 472 HE2 LYS 61 2HE LYS 61 -8.720 -9.211 -6.848 473 HE3 LYS 61 1HE LYS 61 -9.408 -7.576 -6.760 474 HZ1 LYS 61 3HZ LYS 61 -10.765 -8.466 -8.341 475 HZ2 LYS 61 1HZ LYS 61 -9.597 -9.558 -8.908 476 HZ3 LYS 61 2HZ LYS 61 -9.514 -7.919 -9.353 477 H LEU 62 H LEU 62 -6.342 -5.734 -3.676 478 HA LEU 62 HA LEU 62 -7.254 -3.243 -2.595 479 HB2 LEU 62 2HB LEU 62 -7.475 -5.458 -1.534 480 HB3 LEU 62 1HB LEU 62 -5.717 -5.601 -1.446 481 HG LEU 62 HG LEU 62 -5.552 -3.850 0.140 482 HD11 LEU 62 1HD1 LEU 62 -8.217 -3.109 -0.939 483 HD12 LEU 62 2HD1 LEU 62 -6.888 -2.074 -0.419 484 HD13 LEU 62 3HD1 LEU 62 -7.964 -2.796 0.778 485 HD21 LEU 62 3HD2 LEU 62 -6.810 -6.125 0.763 486 HD22 LEU 62 1HD2 LEU 62 -8.131 -5.010 1.106 487 HD23 LEU 62 2HD2 LEU 62 -6.595 -4.842 1.952 488 H CYS 63 H CYS 63 -4.063 -4.712 -3.101 489 HA CYS 63 HA CYS 63 -2.562 -2.603 -1.792 490 HB2 CYS 63 2HB CYS 63 -1.817 -4.725 -3.836 491 HB3 CYS 63 1HB CYS 63 -0.660 -3.782 -2.897 492 HG CYS 63 HG CYS 63 -2.072 -6.232 -1.898 493 H HIS 64 H HIS 64 -3.663 -3.267 -5.074 494 HA HIS 64 HA HIS 64 -2.131 -1.162 -6.371 495 HB2 HIS 64 2HB HIS 64 -3.186 -3.306 -7.328 496 HB3 HIS 64 1HB HIS 64 -4.723 -2.448 -7.261 497 HD1 HIS 64 1HD HIS 64 -5.021 -2.193 -9.795 498 HD2 HIS 64 2HD HIS 64 -1.422 -0.609 -8.411 499 HE1 HIS 64 1HE HIS 64 -4.034 -0.875 -11.717 500 H THR 65 H THR 65 -5.145 -1.393 -4.657 501 HA THR 65 HA THR 65 -6.392 1.006 -5.666 502 HB THR 65 HB THR 65 -6.717 -1.028 -3.529 503 HG1 THR 65 1HG THR 65 -8.189 -1.434 -4.937 504 HG21 THR 65 3HG2 THR 65 -8.157 1.625 -3.332 505 HG22 THR 65 1HG2 THR 65 -6.850 1.120 -2.262 506 HG23 THR 65 2HG2 THR 65 -8.368 0.224 -2.282 507 H LEU 66 H LEU 66 -4.744 0.326 -2.551 508 HA LEU 66 HA LEU 66 -4.680 3.003 -1.563 509 HB2 LEU 66 2HB LEU 66 -2.400 1.066 -1.177 510 HB3 LEU 66 1HB LEU 66 -3.121 2.161 -0.006 511 HG LEU 66 HG LEU 66 -4.221 -0.456 -1.033 512 HD11 LEU 66 1HD1 LEU 66 -4.490 -0.282 1.716 513 HD12 LEU 66 2HD1 LEU 66 -2.956 0.528 1.402 514 HD13 LEU 66 3HD1 LEU 66 -3.207 -1.130 0.856 515 HD21 LEU 66 3HD2 LEU 66 -5.774 1.820 -0.575 516 HD22 LEU 66 1HD2 LEU 66 -5.864 0.930 0.944 517 HD23 LEU 66 2HD2 LEU 66 -6.352 0.155 -0.561 518 H GLU 67 H GLU 67 -2.286 1.178 -3.465 519 HA GLU 67 HA GLU 67 -0.350 3.220 -3.785 520 HB2 GLU 67 2HB GLU 67 0.620 1.418 -4.759 521 HB3 GLU 67 1HB GLU 67 -0.906 0.562 -4.583 522 HG2 GLU 67 2HG GLU 67 -0.461 0.393 -6.885 523 HG3 GLU 67 1HG GLU 67 -1.577 1.753 -6.799 524 H ASN 68 H ASN 68 -3.421 2.709 -5.338 525 HA ASN 68 HA ASN 68 -2.980 4.272 -7.693 526 HB2 ASN 68 2HB ASN 68 -4.989 2.778 -6.502 527 HB3 ASN 68 1HB ASN 68 -5.629 4.420 -6.479 528 HD21 ASN 68 1HD2 ASN 68 -3.831 2.315 -8.810 529 HD22 ASN 68 2HD2 ASN 68 -4.752 2.778 -10.158 530 H ILE 69 H ILE 69 -4.188 5.049 -4.453 531 HA ILE 69 HA ILE 69 -4.639 7.854 -4.963 532 HB ILE 69 HB ILE 69 -4.269 6.115 -2.525 533 HG12 ILE 69 2HG1 ILE 69 -6.719 6.775 -2.297 534 HG13 ILE 69 1HG1 ILE 69 -6.580 7.452 -3.918 535 HG21 ILE 69 1HG2 ILE 69 -3.543 8.227 -1.721 536 HG22 ILE 69 2HG2 ILE 69 -5.259 8.188 -1.322 537 HG23 ILE 69 3HG2 ILE 69 -4.704 9.098 -2.718 538 HD11 ILE 69 3HD1 ILE 69 -6.171 5.356 -4.899 539 HD12 ILE 69 1HD1 ILE 69 -7.418 5.010 -3.700 540 HD13 ILE 69 2HD1 ILE 69 -5.736 4.622 -3.352 541 H LEU 70 H LEU 70 -2.050 5.892 -3.913 542 HA LEU 70 HA LEU 70 -0.262 8.114 -3.283 543 HB2 LEU 70 2HB LEU 70 0.348 5.192 -3.839 544 HB3 LEU 70 1HB LEU 70 1.390 6.329 -2.990 545 HG LEU 70 HG LEU 70 -1.169 5.059 -2.056 546 HD11 LEU 70 1HD1 LEU 70 1.074 4.120 -1.479 547 HD12 LEU 70 2HD1 LEU 70 0.147 4.624 -0.066 548 HD13 LEU 70 3HD1 LEU 70 1.455 5.639 -0.672 549 HD21 LEU 70 3HD2 LEU 70 -0.099 7.774 -1.342 550 HD22 LEU 70 1HD2 LEU 70 -0.871 6.796 -0.092 551 HD23 LEU 70 2HD2 LEU 70 -1.773 7.256 -1.537 552 H ASP 71 H ASP 71 -1.460 6.612 -6.053 553 HA ASP 71 HA ASP 71 0.882 7.227 -7.723 554 HB2 ASP 71 2HB ASP 71 -0.764 5.276 -8.020 555 HB3 ASP 71 1HB ASP 71 -1.943 6.477 -8.547 556 H LYS 72 H LYS 72 -2.559 8.319 -7.516 557 HA LYS 72 HA LYS 72 -2.163 10.613 -9.174 558 HB2 LYS 72 2HB LYS 72 -4.012 9.857 -6.935 559 HB3 LYS 72 1HB LYS 72 -4.307 11.228 -7.993 560 HG2 LYS 72 2HG LYS 72 -4.606 9.873 -9.881 561 HG3 LYS 72 1HG LYS 72 -3.738 8.522 -9.154 562 HD2 LYS 72 2HD LYS 72 -6.524 9.478 -8.590 563 HD3 LYS 72 1HD LYS 72 -5.984 7.873 -9.069 564 HE2 LYS 72 2HE LYS 72 -4.625 8.168 -6.742 565 HE3 LYS 72 1HE LYS 72 -6.103 9.078 -6.384 566 HZ1 LYS 72 3HZ LYS 72 -7.235 7.088 -7.570 567 HZ2 LYS 72 1HZ LYS 72 -6.773 6.930 -5.945 568 HZ3 LYS 72 2HZ LYS 72 -5.809 6.255 -7.171 569 H ALA 73 H ALA 73 -1.612 9.902 -5.828 570 HA ALA 73 HA ALA 73 -1.238 12.581 -4.851 571 HB1 ALA 73 1HB ALA 73 0.151 11.149 -3.134 572 HB2 ALA 73 2HB ALA 73 -0.444 9.777 -4.074 573 HB3 ALA 73 3HB ALA 73 -1.583 10.853 -3.261 574 H ARG 74 H ARG 74 0.762 10.233 -6.500 575 HA ARG 74 HA ARG 74 3.193 11.902 -6.188 576 HB2 ARG 74 2HB ARG 74 4.317 9.949 -6.656 577 HB3 ARG 74 1HB ARG 74 2.786 9.217 -6.195 578 HG2 ARG 74 2HG ARG 74 2.127 8.935 -8.481 579 HG3 ARG 74 1HG ARG 74 3.422 9.983 -9.058 580 HD2 ARG 74 2HD ARG 74 4.558 7.853 -7.475 581 HD3 ARG 74 1HD ARG 74 3.534 7.175 -8.759 582 HE ARG 74 HE ARG 74 5.878 8.955 -9.183 583 HH11 ARG 74 1HH2 ARG 74 2.985 7.646 -10.487 584 HH12 ARG 74 2HH2 ARG 74 3.638 7.423 -12.076 585 HH21 ARG 74 1HH1 ARG 74 6.830 8.454 -11.206 586 HH22 ARG 74 2HH1 ARG 74 5.809 7.883 -12.484 587 H ASN 75 H ASN 75 0.626 11.266 -8.412 588 HA ASN 75 HA ASN 75 2.039 12.276 -10.780 589 HB2 ASN 75 2HB ASN 75 0.281 10.537 -10.871 590 HB3 ASN 75 1HB ASN 75 -0.878 11.675 -10.182 591 HD21 ASN 75 1HD2 ASN 75 -1.236 10.473 -12.789 592 HD22 ASN 75 2HD2 ASN 75 -1.146 11.711 -13.947 593 H SER 76 H SER 76 -0.888 13.334 -9.052 594 HA SER 76 HA SER 76 -0.411 15.876 -8.230 595 HB2 SER 76 2HB SER 76 -0.222 15.698 -11.192 596 HB3 SER 76 1HB SER 76 -1.096 17.088 -10.557 597 HG SER 76 HG SER 76 1.573 16.279 -10.075 598 H GLU 77 H GLU 77 -2.598 13.592 -8.714 599 HA GLU 77 HA GLU 77 -4.860 15.433 -9.283 600 HB2 GLU 77 2HB GLU 77 -4.578 12.434 -9.197 601 HB3 GLU 77 1HB GLU 77 -6.103 13.250 -9.511 602 HG2 GLU 77 2HG GLU 77 -3.567 13.509 -11.147 603 HG3 GLU 77 1HG GLU 77 -5.003 12.591 -11.606 604 H ILE 78 H ILE 78 -3.400 13.564 -6.749 605 HA ILE 78 HA ILE 78 -5.321 14.739 -4.821 606 HB ILE 78 HB ILE 78 -5.933 12.441 -4.013 607 HG12 ILE 78 2HG1 ILE 78 -5.404 10.770 -6.059 608 HG13 ILE 78 1HG1 ILE 78 -3.965 11.792 -6.111 609 HG21 ILE 78 1HG2 ILE 78 -7.255 13.744 -5.788 610 HG22 ILE 78 2HG2 ILE 78 -7.522 12.001 -5.733 611 HG23 ILE 78 3HG2 ILE 78 -6.475 12.691 -6.971 612 HD11 ILE 78 3HD1 ILE 78 -4.722 11.002 -3.396 613 HD12 ILE 78 1HD1 ILE 78 -3.153 10.931 -4.195 614 HD13 ILE 78 2HD1 ILE 78 -4.321 9.636 -4.435 615 H LYS 79 H LYS 79 -4.648 12.754 -2.799 616 HA LYS 79 HA LYS 79 -1.793 12.501 -2.461 617 HB2 LYS 79 2HB LYS 79 -1.482 14.279 -0.837 618 HB3 LYS 79 1HB LYS 79 -2.209 14.990 -2.278 619 HG2 LYS 79 2HG LYS 79 -4.275 14.011 -0.506 620 HG3 LYS 79 1HG LYS 79 -3.202 15.108 0.361 621 HD2 LYS 79 2HD LYS 79 -4.727 15.660 -2.192 622 HD3 LYS 79 1HD LYS 79 -4.922 16.459 -0.632 623 HE2 LYS 79 2HE LYS 79 -2.378 17.070 -0.932 624 HE3 LYS 79 1HE LYS 79 -2.716 16.774 -2.649 625 HZ1 LYS 79 3HZ LYS 79 -4.551 18.392 -0.996 626 HZ2 LYS 79 1HZ LYS 79 -4.388 18.367 -2.684 627 HZ3 LYS 79 2HZ LYS 79 -3.193 19.103 -1.727 628 H ILE 80 H ILE 80 -2.028 12.864 0.491 629 HA ILE 80 HA ILE 80 -4.007 10.718 1.123 630 HB ILE 80 HB ILE 80 -1.947 10.389 2.883 631 HG12 ILE 80 2HG1 ILE 80 -0.691 12.046 1.471 632 HG13 ILE 80 1HG1 ILE 80 0.118 10.528 1.832 633 HG21 ILE 80 1HG2 ILE 80 -1.616 8.307 1.825 634 HG22 ILE 80 2HG2 ILE 80 -1.974 8.971 0.231 635 HG23 ILE 80 3HG2 ILE 80 -3.269 8.743 1.400 636 HD11 ILE 80 3HD1 ILE 80 0.225 9.966 -0.357 637 HD12 ILE 80 1HD1 ILE 80 -0.276 11.618 -0.713 638 HD13 ILE 80 2HD1 ILE 80 -1.483 10.337 -0.592 639 H THR 81 H THR 81 -4.945 13.070 1.490 640 HA THR 81 HA THR 81 -4.197 14.678 3.711 641 HB THR 81 HB THR 81 -6.694 15.306 3.480 642 HG1 THR 81 1HG THR 81 -7.499 14.399 1.438 643 HG21 THR 81 3HG2 THR 81 -5.678 15.464 0.755 644 HG22 THR 81 1HG2 THR 81 -4.444 15.877 1.944 645 HG23 THR 81 2HG2 THR 81 -5.970 16.762 1.914 646 H SER 82 H SER 82 -3.879 12.230 4.909 647 HA SER 82 HA SER 82 -4.521 11.092 6.891 648 HB2 SER 82 2HB SER 82 -6.889 12.911 7.138 649 HB3 SER 82 1HB SER 82 -5.766 12.371 8.383 650 HG SER 82 HG SER 82 -5.730 14.641 7.086 651 H ASP 83 H ASP 83 -7.491 12.242 5.269 652 HA ASP 83 HA ASP 83 -9.023 9.852 5.671 653 HB2 ASP 83 2HB ASP 83 -9.072 12.312 3.969 654 HB3 ASP 83 1HB ASP 83 -10.220 11.021 3.619 655 H LEU 84 H LEU 84 -7.451 11.143 2.703 656 HA LEU 84 HA LEU 84 -7.957 8.845 1.082 657 HB2 LEU 84 2HB LEU 84 -5.785 10.970 1.111 658 HB3 LEU 84 1HB LEU 84 -5.992 9.823 -0.213 659 HG LEU 84 HG LEU 84 -8.133 11.728 0.773 660 HD11 LEU 84 1HD1 LEU 84 -6.300 12.955 -0.296 661 HD12 LEU 84 2HD1 LEU 84 -7.700 12.922 -1.367 662 HD13 LEU 84 3HD1 LEU 84 -6.335 11.848 -1.668 663 HD21 LEU 84 3HD2 LEU 84 -8.248 9.365 -0.803 664 HD22 LEU 84 1HD2 LEU 84 -8.477 10.726 -1.902 665 HD23 LEU 84 2HD2 LEU 84 -9.542 10.528 -0.511 666 H LEU 85 H LEU 85 -5.098 9.826 2.993 667 HA LEU 85 HA LEU 85 -3.694 7.366 2.601 668 HB2 LEU 85 2HB LEU 85 -2.174 8.626 3.733 669 HB3 LEU 85 1HB LEU 85 -3.419 9.869 3.846 670 HG LEU 85 HG LEU 85 -4.245 8.719 5.935 671 HD11 LEU 85 1HD1 LEU 85 -1.842 7.452 6.715 672 HD12 LEU 85 2HD1 LEU 85 -2.214 6.840 5.103 673 HD13 LEU 85 3HD1 LEU 85 -3.398 6.683 6.402 674 HD21 LEU 85 3HD2 LEU 85 -2.490 10.684 5.676 675 HD22 LEU 85 1HD2 LEU 85 -1.374 9.484 6.326 676 HD23 LEU 85 2HD2 LEU 85 -2.790 9.967 7.259 677 H ASP 86 H ASP 86 -6.286 8.342 4.758 678 HA ASP 86 HA ASP 86 -6.074 6.237 6.699 679 HB2 ASP 86 2HB ASP 86 -8.002 8.288 5.803 680 HB3 ASP 86 1HB ASP 86 -8.743 6.877 6.557 681 H LYS 87 H LYS 87 -7.838 6.478 3.615 682 HA LYS 87 HA LYS 87 -9.085 3.864 3.874 683 HB2 LYS 87 2HB LYS 87 -8.508 5.601 1.446 684 HB3 LYS 87 1HB LYS 87 -9.680 4.285 1.524 685 HG2 LYS 87 2HG LYS 87 -9.757 6.866 3.112 686 HG3 LYS 87 1HG LYS 87 -10.861 6.389 1.821 687 HD2 LYS 87 2HD LYS 87 -10.523 4.997 4.494 688 HD3 LYS 87 1HD LYS 87 -11.912 5.960 3.987 689 HE2 LYS 87 2HE LYS 87 -12.285 4.345 2.100 690 HE3 LYS 87 1HE LYS 87 -10.983 3.337 2.765 691 HZ1 LYS 87 3HZ LYS 87 -12.136 3.082 4.788 692 HZ2 LYS 87 1HZ LYS 87 -13.293 2.799 3.580 693 HZ3 LYS 87 2HZ LYS 87 -13.266 4.288 4.400 694 H ILE 88 H ILE 88 -6.127 5.184 2.481 695 HA ILE 88 HA ILE 88 -5.274 2.813 1.088 696 HB ILE 88 HB ILE 88 -4.204 5.394 2.063 697 HG12 ILE 88 2HG1 ILE 88 -3.263 4.294 -0.467 698 HG13 ILE 88 1HG1 ILE 88 -5.022 4.320 -0.323 699 HG21 ILE 88 1HG2 ILE 88 -1.878 4.447 1.155 700 HG22 ILE 88 2HG2 ILE 88 -2.520 2.950 1.832 701 HG23 ILE 88 3HG2 ILE 88 -2.310 4.366 2.863 702 HD11 ILE 88 3HD1 ILE 88 -3.366 6.501 -0.939 703 HD12 ILE 88 1HD1 ILE 88 -3.882 6.763 0.727 704 HD13 ILE 88 2HD1 ILE 88 -5.083 6.551 -0.545 705 H PHE 89 H PHE 89 -4.637 4.098 4.339 706 HA PHE 89 HA PHE 89 -3.054 1.849 5.218 707 HB2 PHE 89 2HB PHE 89 -2.925 4.098 6.201 708 HB3 PHE 89 1HB PHE 89 -4.618 3.994 6.683 709 HD1 PHE 89 1HD PHE 89 -2.150 1.219 6.828 710 HD2 PHE 89 2HD PHE 89 -4.367 4.140 9.067 711 HE1 PHE 89 1HE PHE 89 -1.476 0.111 8.941 712 HE2 PHE 89 2HE PHE 89 -3.693 3.030 11.180 713 HZ PHE 89 HZ PHE 89 -2.247 1.016 11.117 714 H ALA 90 H ALA 90 -6.394 2.411 4.850 715 HA ALA 90 HA ALA 90 -7.283 0.385 6.777 716 HB1 ALA 90 1HB ALA 90 -8.622 2.394 6.166 717 HB2 ALA 90 2HB ALA 90 -9.491 0.908 5.782 718 HB3 ALA 90 3HB ALA 90 -8.699 1.823 4.499 719 H GLY 91 H GLY 91 -6.411 0.637 3.403 720 HA2 GLY 91 2HA GLY 91 -7.519 -1.933 2.611 721 HA3 GLY 91 1HA GLY 91 -6.353 -0.979 1.688 722 H VAL 92 H VAL 92 -4.339 -0.686 3.609 723 HA VAL 92 HA VAL 92 -2.929 -3.200 3.410 724 HB VAL 92 HB VAL 92 -2.582 -0.524 4.752 725 HG11 VAL 92 1HG1 VAL 92 -1.590 -1.824 6.441 726 HG12 VAL 92 2HG1 VAL 92 -0.229 -1.472 5.376 727 HG13 VAL 92 3HG1 VAL 92 -1.023 -3.044 5.300 728 HG21 VAL 92 3HG2 VAL 92 -2.004 -1.420 2.257 729 HG22 VAL 92 1HG2 VAL 92 -0.489 -1.799 3.076 730 HG23 VAL 92 2HG2 VAL 92 -1.090 -0.140 3.057 731 H ASP 93 H ASP 93 -5.139 -1.794 5.684 732 HA ASP 93 HA ASP 93 -4.440 -3.359 8.016 733 HB2 ASP 93 2HB ASP 93 -6.071 -1.214 7.355 734 HB3 ASP 93 1HB ASP 93 -7.237 -2.503 7.673 735 H MET 94 H MET 94 -6.774 -3.717 5.354 736 HA MET 94 HA MET 94 -7.835 -6.247 6.351 737 HB2 MET 94 2HB MET 94 -8.041 -4.523 3.897 738 HB3 MET 94 1HB MET 94 -8.640 -6.181 3.820 739 HG2 MET 94 2HG MET 94 -9.842 -5.548 6.074 740 HG3 MET 94 1HG MET 94 -9.612 -3.895 5.506 741 HE1 MET 94 3HE MET 94 -9.913 -4.943 2.024 742 HE2 MET 94 1HE MET 94 -9.693 -3.502 3.027 743 HE3 MET 94 2HE MET 94 -11.192 -3.737 2.130 744 H ILE 95 H ILE 95 -5.475 -5.176 3.939 745 HA ILE 95 HA ILE 95 -4.784 -7.628 2.722 746 HB ILE 95 HB ILE 95 -3.597 -4.961 3.280 747 HG12 ILE 95 2HG1 ILE 95 -3.299 -6.565 0.757 748 HG13 ILE 95 1HG1 ILE 95 -4.876 -5.904 1.190 749 HG21 ILE 95 1HG2 ILE 95 -1.433 -5.946 2.078 750 HG22 ILE 95 2HG2 ILE 95 -1.912 -7.404 2.949 751 HG23 ILE 95 3HG2 ILE 95 -1.578 -5.914 3.835 752 HD11 ILE 95 3HD1 ILE 95 -3.812 -3.649 1.424 753 HD12 ILE 95 1HD1 ILE 95 -3.714 -4.292 -0.216 754 HD13 ILE 95 2HD1 ILE 95 -2.301 -4.343 0.837 755 H THR 96 H THR 96 -3.623 -6.158 5.755 756 HA THR 96 HA THR 96 -1.823 -8.336 6.430 757 HB THR 96 HB THR 96 -3.111 -6.042 7.943 758 HG1 THR 96 1HG THR 96 -0.653 -5.608 7.852 759 HG21 THR 96 3HG2 THR 96 -1.707 -8.366 8.956 760 HG22 THR 96 1HG2 THR 96 -2.465 -7.049 9.851 761 HG23 THR 96 2HG2 THR 96 -0.798 -6.893 9.296 762 H ARG 97 H ARG 97 -5.173 -7.458 7.250 763 HA ARG 97 HA ARG 97 -5.606 -9.528 9.200 764 HB2 ARG 97 2HB ARG 97 -7.242 -7.701 7.473 765 HB3 ARG 97 1HB ARG 97 -8.065 -9.020 8.307 766 HG2 ARG 97 2HG ARG 97 -7.687 -8.127 10.389 767 HG3 ARG 97 1HG ARG 97 -6.148 -7.404 9.915 768 HD2 ARG 97 2HD ARG 97 -7.196 -5.417 9.640 769 HD3 ARG 97 1HD ARG 97 -8.214 -6.147 8.382 770 HE ARG 97 HE ARG 97 -8.880 -6.397 11.291 771 HH11 ARG 97 1HH1 ARG 97 -10.203 -7.665 8.684 772 HH12 ARG 97 2HH1 ARG 97 -11.669 -6.745 8.662 773 HH21 ARG 97 1HH2 ARG 97 -10.558 -4.416 10.976 774 HH22 ARG 97 2HH2 ARG 97 -11.869 -4.905 9.956 775 H MET 98 H MET 98 -6.003 -9.409 5.658 776 HA MET 98 HA MET 98 -7.255 -12.004 5.405 777 HB2 MET 98 2HB MET 98 -5.554 -10.340 3.505 778 HB3 MET 98 1HB MET 98 -6.586 -11.689 3.026 779 HG2 MET 98 2HG MET 98 -8.498 -10.467 3.224 780 HG3 MET 98 1HG MET 98 -7.914 -9.591 4.639 781 HE1 MET 98 3HE MET 98 -9.506 -8.155 1.923 782 HE2 MET 98 1HE MET 98 -8.884 -9.690 1.303 783 HE3 MET 98 2HE MET 98 -8.413 -8.172 0.541 784 H VAL 99 H VAL 99 -3.956 -10.773 5.435 785 HA VAL 99 HA VAL 99 -2.648 -13.252 4.741 786 HB VAL 99 HB VAL 99 -1.924 -10.587 5.943 787 HG11 VAL 99 1HG1 VAL 99 -0.034 -12.930 5.544 788 HG12 VAL 99 2HG1 VAL 99 -0.505 -12.243 7.099 789 HG13 VAL 99 3HG1 VAL 99 0.450 -11.287 5.965 790 HG21 VAL 99 3HG2 VAL 99 -1.849 -11.910 3.334 791 HG22 VAL 99 1HG2 VAL 99 -0.304 -11.172 3.758 792 HG23 VAL 99 2HG2 VAL 99 -1.770 -10.192 3.721 793 H ASP 100 H ASP 100 -3.765 -11.787 7.764 794 HA ASP 100 HA ASP 100 -2.305 -13.568 9.525 795 HB2 ASP 100 2HB ASP 100 -3.538 -11.253 9.884 796 HB3 ASP 100 1HB ASP 100 -4.934 -12.280 10.207 797 H LYS 101 H LYS 101 -5.418 -13.686 7.879 798 HA LYS 101 HA LYS 101 -6.134 -16.199 9.247 799 HB2 LYS 101 2HB LYS 101 -8.199 -15.415 8.818 800 HB3 LYS 101 1HB LYS 101 -7.466 -14.002 8.075 801 HG2 LYS 101 2HG LYS 101 -7.274 -15.849 6.046 802 HG3 LYS 101 1HG LYS 101 -8.788 -16.310 6.815 803 HD2 LYS 101 2HD LYS 101 -8.987 -13.606 6.797 804 HD3 LYS 101 1HD LYS 101 -8.070 -13.899 5.316 805 HE2 LYS 101 2HE LYS 101 -10.177 -14.253 4.432 806 HE3 LYS 101 1HE LYS 101 -9.943 -15.869 5.133 807 HZ1 LYS 101 3HZ LYS 101 -12.017 -14.870 5.910 808 HZ2 LYS 101 1HZ LYS 101 -11.159 -13.545 6.533 809 HZ3 LYS 101 2HZ LYS 101 -10.925 -15.093 7.193 810 H ILE 102 H ILE 102 -5.109 -14.951 6.105 811 HA ILE 102 HA ILE 102 -5.314 -17.334 4.571 812 HB ILE 102 HB ILE 102 -3.663 -14.822 4.566 813 HG12 ILE 102 2HG1 ILE 102 -5.603 -16.160 2.658 814 HG13 ILE 102 1HG1 ILE 102 -5.872 -14.697 3.605 815 HG21 ILE 102 1HG2 ILE 102 -2.058 -16.559 3.895 816 HG22 ILE 102 2HG2 ILE 102 -2.507 -15.574 2.504 817 HG23 ILE 102 3HG2 ILE 102 -3.207 -17.180 2.710 818 HD11 ILE 102 3HD1 ILE 102 -4.438 -15.042 1.055 819 HD12 ILE 102 1HD1 ILE 102 -3.587 -14.049 2.239 820 HD13 ILE 102 2HD1 ILE 102 -5.214 -13.607 1.729 821 H VAL 103 H VAL 103 -3.039 -16.113 6.897 822 HA VAL 103 HA VAL 103 -1.058 -18.241 6.556 823 HB VAL 103 HB VAL 103 -1.611 -15.909 8.375 824 HG11 VAL 103 1HG1 VAL 103 0.474 -16.561 9.665 825 HG12 VAL 103 2HG1 VAL 103 0.361 -18.152 8.913 826 HG13 VAL 103 3HG1 VAL 103 -0.928 -17.587 9.976 827 HG21 VAL 103 3HG2 VAL 103 1.091 -16.451 7.304 828 HG22 VAL 103 1HG2 VAL 103 0.142 -14.964 7.267 829 HG23 VAL 103 2HG2 VAL 103 -0.153 -16.229 6.073 830 H SER 104 H SER 104 -3.830 -17.504 8.585 831 HA SER 104 HA SER 104 -3.459 -19.782 10.378 832 HB2 SER 104 2HB SER 104 -4.507 -17.560 10.930 833 HB3 SER 104 1HB SER 104 -5.848 -18.000 9.873 834 HG SER 104 HG SER 104 -5.905 -19.981 11.266 835 H GLU 105 H GLU 105 -4.828 -19.312 7.304 836 HA GLU 105 HA GLU 105 -5.836 -22.081 7.254 837 HB2 GLU 105 2HB GLU 105 -8.113 -21.534 6.987 838 HB3 GLU 105 1HB GLU 105 -7.581 -20.397 8.225 839 HG2 GLU 105 2HG GLU 105 -7.312 -18.643 6.564 840 HG3 GLU 105 1HG GLU 105 -7.690 -19.772 5.265 841 H GLY 106 H GLY 106 -5.402 -18.984 5.577 842 HA2 GLY 106 2HA GLY 106 -4.174 -18.979 3.431 843 HA3 GLY 106 1HA GLY 106 -4.899 -20.545 3.076 844 H SER 107 H SER 107 -6.954 -18.158 4.520 845 HA SER 107 HA SER 107 -8.329 -17.817 1.873 846 HB2 SER 107 2HB SER 107 -9.293 -17.665 4.739 847 HB3 SER 107 1HB SER 107 -10.304 -17.389 3.324 848 HG SER 107 HG SER 107 -10.097 -19.490 2.761 849 H ASP 108 H ASP 108 -8.353 -15.807 1.033 850 HA ASP 108 HA ASP 108 -7.385 -13.533 2.705 851 HB2 ASP 108 2HB ASP 108 -6.434 -14.142 0.411 852 HB3 ASP 108 1HB ASP 108 -7.991 -13.674 -0.269 853 H ASP 109 H ASP 109 -10.190 -15.002 2.404 854 HA ASP 109 HA ASP 109 -11.868 -12.676 1.620 855 HB2 ASP 109 2HB ASP 109 -12.019 -15.433 1.350 856 HB3 ASP 109 1HB ASP 109 -13.179 -15.091 2.633 857 H ILE 110 H ILE 110 -11.581 -11.237 3.408 858 HA ILE 110 HA ILE 110 -12.508 -12.255 6.069 859 HB ILE 110 HB ILE 110 -11.335 -10.159 6.868 860 HG12 ILE 110 2HG1 ILE 110 -10.029 -10.020 4.175 861 HG13 ILE 110 1HG1 ILE 110 -11.583 -9.218 4.402 862 HG21 ILE 110 1HG2 ILE 110 -9.968 -12.399 5.419 863 HG22 ILE 110 2HG2 ILE 110 -9.971 -12.024 7.142 864 HG23 ILE 110 3HG2 ILE 110 -8.988 -11.068 6.033 865 HD11 ILE 110 3HD1 ILE 110 -9.452 -8.792 6.460 866 HD12 ILE 110 1HD1 ILE 110 -10.734 -7.700 5.935 867 HD13 ILE 110 2HD1 ILE 110 -9.311 -7.943 4.921 868 H GLY 111 H GLY 111 -14.257 -11.458 3.779 869 HA2 GLY 111 2HA GLY 111 -16.346 -10.358 3.668 870 HA3 GLY 111 1HA GLY 111 -16.022 -9.665 5.258 871 H GLU 112 H GLU 112 -13.357 -9.152 3.301 872 HA GLU 112 HA GLU 112 -13.662 -6.313 3.245 873 HB2 GLU 112 2HB GLU 112 -11.683 -6.493 1.709 874 HB3 GLU 112 1HB GLU 112 -11.515 -7.452 3.182 875 HG2 GLU 112 2HG GLU 112 -11.113 -9.217 1.834 876 HG3 GLU 112 1HG GLU 112 -12.828 -9.160 1.432 877 H ASN 113 H ASN 113 -13.651 -4.997 1.199 878 HA ASN 113 HA ASN 113 -15.217 -6.196 -1.050 879 HB2 ASN 113 2HB ASN 113 -15.810 -3.478 0.124 880 HB3 ASN 113 1HB ASN 113 -16.839 -4.467 -0.912 881 HD21 ASN 113 1HD2 ASN 113 -16.774 -6.948 0.386 882 HD22 ASN 113 2HD2 ASN 113 -17.431 -6.798 1.944 883 H ILE 114 H ILE 114 -13.348 -6.059 -2.415 884 HA ILE 114 HA ILE 114 -11.669 -3.720 -2.515 885 HB ILE 114 HB ILE 114 -12.112 -5.801 -4.665 886 HG12 ILE 114 2HG1 ILE 114 -11.820 -7.147 -2.753 887 HG13 ILE 114 1HG1 ILE 114 -10.173 -6.956 -3.350 888 HG21 ILE 114 1HG2 ILE 114 -10.470 -3.607 -4.598 889 HG22 ILE 114 2HG2 ILE 114 -10.146 -5.067 -5.537 890 HG23 ILE 114 3HG2 ILE 114 -9.412 -4.860 -3.946 891 HD11 ILE 114 3HD1 ILE 114 -11.479 -5.394 -1.099 892 HD12 ILE 114 1HD1 ILE 114 -9.887 -5.027 -1.764 893 HD13 ILE 114 2HD1 ILE 114 -10.169 -6.567 -0.951 894 H ASP 115 H ASP 115 -13.781 -4.928 -5.163 895 HA ASP 115 HA ASP 115 -13.808 -2.678 -6.763 896 HB2 ASP 115 2HB ASP 115 -15.061 -4.996 -6.844 897 HB3 ASP 115 1HB ASP 115 -16.387 -4.078 -6.128 898 H VAL 116 H VAL 116 -15.299 -3.109 -3.694 899 HA VAL 116 HA VAL 116 -16.814 -0.590 -3.826 900 HB VAL 116 HB VAL 116 -16.439 -2.718 -1.710 901 HG11 VAL 116 1HG1 VAL 116 -18.203 -1.676 -0.479 902 HG12 VAL 116 2HG1 VAL 116 -18.596 -0.594 -1.815 903 HG13 VAL 116 3HG1 VAL 116 -17.098 -0.372 -0.911 904 HG21 VAL 116 3HG2 VAL 116 -18.518 -3.611 -2.450 905 HG22 VAL 116 1HG2 VAL 116 -17.619 -3.279 -3.929 906 HG23 VAL 116 2HG2 VAL 116 -18.888 -2.173 -3.402 907 H PHE 117 H PHE 117 -14.355 -2.009 -1.746 908 HA PHE 117 HA PHE 117 -13.784 0.283 -0.165 909 HB2 PHE 117 2HB PHE 117 -13.045 -2.058 0.244 910 HB3 PHE 117 1HB PHE 117 -11.932 -1.929 -1.117 911 HD1 PHE 117 1HD PHE 117 -10.140 -0.088 -1.036 912 HD2 PHE 117 2HD PHE 117 -12.439 -1.299 2.384 913 HE1 PHE 117 1HE PHE 117 -8.443 0.924 0.463 914 HE2 PHE 117 2HE PHE 117 -10.745 -0.285 3.884 915 HZ PHE 117 HZ PHE 117 -8.749 0.824 2.923 916 H SER 118 H SER 118 -12.923 -0.492 -3.444 917 HA SER 118 HA SER 118 -10.869 1.592 -3.598 918 HB2 SER 118 2HB SER 118 -10.196 -0.106 -4.977 919 HB3 SER 118 1HB SER 118 -11.833 -0.738 -5.122 920 HG SER 118 HG SER 118 -10.980 0.177 -7.083 921 H ASP 119 H ASP 119 -14.007 0.772 -4.911 922 HA ASP 119 HA ASP 119 -14.396 3.162 -6.440 923 HB2 ASP 119 2HB ASP 119 -15.684 1.039 -6.677 924 HB3 ASP 119 1HB ASP 119 -16.417 1.336 -5.100 925 H THR 120 H THR 120 -14.710 2.378 -3.121 926 HA THR 120 HA THR 120 -16.297 4.652 -2.302 927 HB THR 120 HB THR 120 -14.788 2.391 -1.164 928 HG1 THR 120 1HG THR 120 -16.629 2.183 -0.033 929 HG21 THR 120 3HG2 THR 120 -14.863 3.498 1.156 930 HG22 THR 120 1HG2 THR 120 -14.931 5.030 0.283 931 HG23 THR 120 2HG2 THR 120 -13.544 3.958 0.079 932 H ILE 121 H ILE 121 -12.903 3.839 -2.182 933 HA ILE 121 HA ILE 121 -11.958 6.441 -1.366 934 HB ILE 121 HB ILE 121 -11.051 3.774 -1.860 935 HG12 ILE 121 2HG1 ILE 121 -10.787 5.215 0.175 936 HG13 ILE 121 1HG1 ILE 121 -9.309 4.395 -0.324 937 HG21 ILE 121 1HG2 ILE 121 -8.902 4.110 -2.907 938 HG22 ILE 121 2HG2 ILE 121 -9.183 5.848 -3.029 939 HG23 ILE 121 3HG2 ILE 121 -10.145 4.727 -3.994 940 HD11 ILE 121 3HD1 ILE 121 -8.321 6.353 -1.107 941 HD12 ILE 121 1HD1 ILE 121 -9.256 6.972 0.255 942 HD13 ILE 121 2HD1 ILE 121 -9.873 7.143 -1.388 943 H LYS 122 H LYS 122 -12.347 4.785 -4.498 944 HA LYS 122 HA LYS 122 -11.103 6.841 -6.089 945 HB2 LYS 122 2HB LYS 122 -12.636 4.332 -6.381 946 HB3 LYS 122 1HB LYS 122 -12.893 5.485 -7.693 947 HG2 LYS 122 2HG LYS 122 -10.903 4.888 -8.561 948 HG3 LYS 122 1HG LYS 122 -10.134 5.548 -7.118 949 HD2 LYS 122 2HD LYS 122 -11.246 2.984 -6.476 950 HD3 LYS 122 1HD LYS 122 -10.249 2.829 -7.922 951 HE2 LYS 122 2HE LYS 122 -8.830 4.542 -6.142 952 HE3 LYS 122 1HE LYS 122 -9.372 3.138 -5.199 953 HZ1 LYS 122 3HZ LYS 122 -8.355 1.662 -6.641 954 HZ2 LYS 122 1HZ LYS 122 -7.227 2.926 -6.586 955 HZ3 LYS 122 2HZ LYS 122 -8.277 2.784 -7.915 956 H SER 123 H SER 123 -14.325 6.208 -4.857 957 HA SER 123 HA SER 123 -15.565 8.407 -6.353 958 HB2 SER 123 2HB SER 123 -16.400 6.533 -4.139 959 HB3 SER 123 1HB SER 123 -17.478 7.756 -4.800 960 HG SER 123 HG SER 123 -16.155 6.122 -6.620 961 H PHE 124 H PHE 124 -13.717 8.009 -3.552 962 HA PHE 124 HA PHE 124 -14.863 10.164 -1.952 963 HB2 PHE 124 2HB PHE 124 -13.124 8.035 -1.609 964 HB3 PHE 124 1HB PHE 124 -12.052 9.434 -1.532 965 HD1 PHE 124 1HD PHE 124 -14.235 11.374 -0.495 966 HD2 PHE 124 2HD PHE 124 -12.964 7.466 0.756 967 HE1 PHE 124 1HE PHE 124 -15.024 11.853 1.805 968 HE2 PHE 124 2HE PHE 124 -13.753 7.947 3.057 969 HZ PHE 124 HZ PHE 124 -14.783 10.140 3.581 970 H ALA 125 H ALA 125 -13.253 10.174 -4.821 971 HA ALA 125 HA ALA 125 -12.195 12.936 -4.354 972 HB1 ALA 125 1HB ALA 125 -10.508 10.950 -4.342 973 HB2 ALA 125 2HB ALA 125 -10.131 12.352 -5.344 974 HB3 ALA 125 3HB ALA 125 -10.798 10.895 -6.081 975 H SER 126 H SER 126 -13.044 10.470 -6.805 976 HA SER 126 HA SER 126 -13.534 12.583 -8.823 977 HB2 SER 126 2HB SER 126 -13.300 9.596 -8.717 978 HB3 SER 126 1HB SER 126 -14.141 10.324 -10.083 979 HG SER 126 HG SER 126 -11.478 10.288 -9.458 980 H SER 127 H SER 127 -15.344 13.019 -6.849 981 HA SER 127 HA SER 127 -17.892 12.664 -8.139 982 HB2 SER 127 2HB SER 127 -17.109 10.344 -7.151 983 HB3 SER 127 1HB SER 127 -17.652 11.036 -5.625 984 HG SER 127 HG SER 127 -19.592 11.609 -7.086 985 H GLY 128 H GLY 128 -18.125 14.887 -7.567 986 HA2 GLY 128 2HA GLY 128 -19.335 15.442 -5.040 987 HA3 GLY 128 1HA GLY 128 -17.664 16.009 -5.005 988 H LYS 129 H LYS 129 -18.989 18.122 -4.755 989 HA LYS 129 HA LYS 129 -18.841 19.584 -7.254 990 HB2 LYS 129 2HB LYS 129 -21.238 19.969 -7.537 991 HB3 LYS 129 1HB LYS 129 -20.937 18.230 -7.513 992 HG2 LYS 129 2HG LYS 129 -21.605 18.094 -5.180 993 HG3 LYS 129 1HG LYS 129 -21.764 19.849 -5.087 994 HD2 LYS 129 2HD LYS 129 -23.620 19.842 -6.617 995 HD3 LYS 129 1HD LYS 129 -23.368 18.139 -7.003 996 HE2 LYS 129 2HE LYS 129 -23.906 17.529 -4.659 997 HE3 LYS 129 1HE LYS 129 -24.201 19.241 -4.295 998 HZ1 LYS 129 3HZ LYS 129 -25.722 19.162 -6.329 999 HZ2 LYS 129 1HZ LYS 129 -26.290 18.441 -4.903 1000 HZ3 LYS 129 2HZ LYS 129 -25.671 17.472 -6.153 1001 H GLU 130 H GLU 130 -19.281 21.890 -6.904 1002 HA GLU 130 HA GLU 130 -19.200 23.856 -5.591 1003 HB2 GLU 130 2HB GLU 130 -21.209 22.018 -4.541 1004 HB3 GLU 130 1HB GLU 130 -20.579 23.080 -3.283 1005 HG2 GLU 130 2HG GLU 130 -21.689 24.849 -4.123 1006 HG3 GLU 130 1HG GLU 130 -21.029 24.560 -5.734 1007 H LYS 131 H LYS 131 -18.350 24.697 -3.448 1008 HA LYS 131 HA LYS 131 -16.751 24.670 -1.703 1009 HB2 LYS 131 2HB LYS 131 -18.292 22.420 -1.471 1010 HB3 LYS 131 1HB LYS 131 -16.683 21.712 -1.622 1011 HG2 LYS 131 2HG LYS 131 -15.863 22.995 0.250 1012 HG3 LYS 131 1HG LYS 131 -17.355 23.935 0.324 1013 HD2 LYS 131 2HD LYS 131 -18.440 21.511 0.566 1014 HD3 LYS 131 1HD LYS 131 -16.838 21.124 1.195 1015 HE2 LYS 131 2HE LYS 131 -18.754 23.236 2.239 1016 HE3 LYS 131 1HE LYS 131 -18.142 21.807 3.097 1017 HZ1 LYS 131 3HZ LYS 131 -15.858 22.879 2.343 1018 HZ2 LYS 131 1HZ LYS 131 -16.608 23.302 3.806 1019 HZ3 LYS 131 2HZ LYS 131 -16.776 24.305 2.444 1020 H LEU 132 H LEU 132 -16.213 23.805 -4.745 1021 HA LEU 132 HA LEU 132 -14.302 23.237 -6.021 1022 HB2 LEU 132 2HB LEU 132 -13.490 24.816 -3.627 1023 HB3 LEU 132 1HB LEU 132 -12.192 24.079 -4.569 1024 HG LEU 132 HG LEU 132 -13.480 25.074 -6.622 1025 HD11 LEU 132 1HD1 LEU 132 -14.235 27.399 -5.098 1026 HD12 LEU 132 2HD1 LEU 132 -15.083 25.986 -4.472 1027 HD13 LEU 132 3HD1 LEU 132 -15.228 26.418 -6.175 1028 HD21 LEU 132 3HD2 LEU 132 -12.150 27.114 -4.852 1029 HD22 LEU 132 1HD2 LEU 132 -12.001 26.899 -6.595 1030 HD23 LEU 132 2HD2 LEU 132 -11.222 25.760 -5.496 1031 H GLU 133 H GLU 133 -14.315 20.944 -6.015 1032 HA GLU 133 HA GLU 133 -13.743 19.181 -3.912 1033 HB2 GLU 133 2HB GLU 133 -14.065 19.151 -6.718 1034 HB3 GLU 133 1HB GLU 133 -12.541 18.320 -6.402 1035 HG2 GLU 133 2HG GLU 133 -13.605 16.774 -4.894 1036 HG3 GLU 133 1HG GLU 133 -15.109 17.697 -4.924 Start of MODEL 15 1 H1 MET 1 1HT MET 1 2.249 -29.656 2.848 2 H2 MET 1 2HT MET 1 2.316 -27.982 2.567 3 H3 MET 1 3HT MET 1 2.230 -28.576 4.156 4 HA MET 1 HA MET 1 4.425 -29.262 4.186 5 HB2 MET 1 2HB MET 1 3.659 -30.197 1.702 6 HB3 MET 1 1HB MET 1 4.909 -29.022 1.293 7 HG2 MET 1 2HG MET 1 5.253 -31.201 3.371 8 HG3 MET 1 1HG MET 1 5.802 -31.335 1.701 9 HE1 MET 1 2HE MET 1 9.117 -30.963 3.424 10 HE2 MET 1 3HE MET 1 8.552 -31.281 1.786 11 HE3 MET 1 1HE MET 1 7.752 -32.046 3.165 12 H MET 2 H MET 2 3.506 -26.688 4.587 13 HA MET 2 HA MET 2 4.296 -24.546 3.032 14 HB2 MET 2 2HB MET 2 3.391 -24.844 5.519 15 HB3 MET 2 1HB MET 2 5.087 -24.573 5.922 16 HG2 MET 2 2HG MET 2 4.825 -22.573 4.194 17 HG3 MET 2 1HG MET 2 3.124 -22.713 4.640 18 HE1 MET 2 3HE MET 2 6.354 -20.601 6.096 19 HE2 MET 2 1HE MET 2 4.835 -19.696 6.079 20 HE3 MET 2 2HE MET 2 5.292 -20.683 4.693 21 H GLU 3 H GLU 3 6.194 -24.394 1.879 22 HA GLU 3 HA GLU 3 8.726 -25.395 3.095 23 HB2 GLU 3 2HB GLU 3 9.535 -25.332 0.832 24 HB3 GLU 3 1HB GLU 3 7.919 -26.048 0.785 25 HG2 GLU 3 2HG GLU 3 6.948 -23.920 0.115 26 HG3 GLU 3 1HG GLU 3 8.504 -23.101 0.322 27 H GLU 4 H GLU 4 10.377 -23.779 1.398 28 HA GLU 4 HA GLU 4 10.310 -21.325 2.952 29 HB2 GLU 4 2HB GLU 4 12.332 -22.529 1.076 30 HB3 GLU 4 1HB GLU 4 12.601 -21.030 1.965 31 HG2 GLU 4 2HG GLU 4 11.661 -23.123 3.740 32 HG3 GLU 4 1HG GLU 4 13.113 -23.635 2.878 33 H TYR 5 H TYR 5 10.013 -22.325 -0.354 34 HA TYR 5 HA TYR 5 10.283 -19.997 -1.798 35 HB2 TYR 5 2HB TYR 5 9.311 -22.453 -2.290 36 HB3 TYR 5 1HB TYR 5 7.797 -21.548 -2.278 37 HD1 TYR 5 2HD TYR 5 8.723 -18.916 -3.317 38 HD2 TYR 5 1HD TYR 5 9.664 -22.910 -4.587 39 HE1 TYR 5 2HE TYR 5 9.214 -18.074 -5.596 40 HE2 TYR 5 1HE TYR 5 10.157 -22.068 -6.867 41 HH TYR 5 HH TYR 5 10.240 -18.625 -7.576 42 H LEU 6 H LEU 6 7.422 -20.937 0.009 43 HA LEU 6 HA LEU 6 6.258 -18.243 -0.357 44 HB2 LEU 6 2HB LEU 6 4.250 -19.235 0.426 45 HB3 LEU 6 1HB LEU 6 5.023 -20.501 -0.519 46 HG LEU 6 HG LEU 6 5.798 -20.492 2.331 47 HD11 LEU 6 1HD1 LEU 6 2.947 -21.071 1.480 48 HD12 LEU 6 2HD1 LEU 6 3.466 -19.813 2.601 49 HD13 LEU 6 3HD1 LEU 6 3.638 -21.511 3.041 50 HD21 LEU 6 3HD2 LEU 6 6.464 -22.441 1.325 51 HD22 LEU 6 1HD2 LEU 6 5.174 -22.378 0.123 52 HD23 LEU 6 2HD2 LEU 6 4.830 -22.951 1.754 53 H GLY 7 H GLY 7 7.922 -20.150 2.078 54 HA2 GLY 7 2HA GLY 7 7.167 -18.662 4.393 55 HA3 GLY 7 1HA GLY 7 8.678 -19.558 4.219 56 H VAL 8 H VAL 8 9.677 -18.101 1.935 57 HA VAL 8 HA VAL 8 10.628 -15.691 3.340 58 HB VAL 8 HB VAL 8 11.338 -17.001 0.704 59 HG11 VAL 8 1HG1 VAL 8 13.299 -15.538 0.705 60 HG12 VAL 8 2HG1 VAL 8 12.780 -14.807 2.224 61 HG13 VAL 8 3HG1 VAL 8 11.831 -14.560 0.757 62 HG21 VAL 8 3HG2 VAL 8 12.988 -16.902 3.232 63 HG22 VAL 8 1HG2 VAL 8 13.166 -17.985 1.851 64 HG23 VAL 8 2HG2 VAL 8 11.806 -18.182 2.958 65 H PHE 9 H PHE 9 8.716 -16.564 0.577 66 HA PHE 9 HA PHE 9 8.483 -13.921 -0.575 67 HB2 PHE 9 2HB PHE 9 7.288 -16.620 -0.850 68 HB3 PHE 9 1HB PHE 9 6.251 -15.290 -1.366 69 HD1 PHE 9 2HD PHE 9 9.832 -16.385 -1.641 70 HD2 PHE 9 1HD PHE 9 6.467 -14.520 -3.552 71 HE1 PHE 9 2HE PHE 9 11.141 -16.170 -3.736 72 HE2 PHE 9 1HE PHE 9 7.776 -14.306 -5.648 73 HZ PHE 9 HZ PHE 9 10.113 -15.132 -5.739 74 H VAL 10 H VAL 10 6.776 -15.706 1.928 75 HA VAL 10 HA VAL 10 4.634 -13.692 2.174 76 HB VAL 10 HB VAL 10 5.444 -16.214 3.653 77 HG11 VAL 10 1HG1 VAL 10 3.559 -15.992 5.063 78 HG12 VAL 10 2HG1 VAL 10 2.854 -14.724 4.062 79 HG13 VAL 10 3HG1 VAL 10 4.270 -14.378 5.054 80 HG21 VAL 10 3HG2 VAL 10 3.323 -17.058 2.639 81 HG22 VAL 10 1HG2 VAL 10 4.503 -16.570 1.422 82 HG23 VAL 10 2HG2 VAL 10 3.141 -15.516 1.803 83 H ASP 11 H ASP 11 7.633 -14.646 3.805 84 HA ASP 11 HA ASP 11 7.302 -12.960 6.116 85 HB2 ASP 11 2HB ASP 11 9.492 -14.454 4.731 86 HB3 ASP 11 1HB ASP 11 9.953 -13.258 5.942 87 H GLU 12 H GLU 12 8.061 -12.368 2.857 88 HA GLU 12 HA GLU 12 9.434 -9.796 3.323 89 HB2 GLU 12 2HB GLU 12 8.685 -11.574 1.034 90 HB3 GLU 12 1HB GLU 12 8.969 -9.868 0.685 91 HG2 GLU 12 2HG GLU 12 11.190 -9.970 1.602 92 HG3 GLU 12 1HG GLU 12 10.912 -11.592 2.235 93 H THR 13 H THR 13 6.337 -10.986 2.040 94 HA THR 13 HA THR 13 5.118 -8.552 1.329 95 HB THR 13 HB THR 13 3.043 -9.806 1.633 96 HG1 THR 13 1HG THR 13 3.220 -11.860 2.725 97 HG21 THR 13 3HG2 THR 13 4.441 -12.175 0.904 98 HG22 THR 13 1HG2 THR 13 5.360 -10.805 0.282 99 HG23 THR 13 2HG2 THR 13 3.664 -11.002 -0.160 100 H LYS 14 H LYS 14 5.007 -10.204 4.513 101 HA LYS 14 HA LYS 14 3.598 -8.044 5.827 102 HB2 LYS 14 2HB LYS 14 5.332 -10.294 6.909 103 HB3 LYS 14 1HB LYS 14 4.157 -9.363 7.840 104 HG2 LYS 14 2HG LYS 14 2.359 -10.432 6.904 105 HG3 LYS 14 1HG LYS 14 3.153 -10.615 5.340 106 HD2 LYS 14 2HD LYS 14 4.538 -12.428 6.215 107 HD3 LYS 14 1HD LYS 14 3.841 -12.215 7.821 108 HE2 LYS 14 2HE LYS 14 2.786 -14.104 6.529 109 HE3 LYS 14 1HE LYS 14 1.621 -12.840 6.970 110 HZ1 LYS 14 3HZ LYS 14 1.549 -13.493 4.579 111 HZ2 LYS 14 1HZ LYS 14 3.121 -12.879 4.407 112 HZ3 LYS 14 2HZ LYS 14 1.846 -11.841 4.837 113 H GLU 15 H GLU 15 7.024 -8.946 5.502 114 HA GLU 15 HA GLU 15 8.069 -7.002 7.321 115 HB2 GLU 15 2HB GLU 15 9.047 -8.649 5.025 116 HB3 GLU 15 1HB GLU 15 10.088 -7.353 5.619 117 HG2 GLU 15 2HG GLU 15 9.695 -8.319 7.956 118 HG3 GLU 15 1HG GLU 15 9.034 -9.734 7.143 119 H TYR 16 H TYR 16 6.841 -6.846 4.148 120 HA TYR 16 HA TYR 16 7.988 -4.208 3.531 121 HB2 TYR 16 2HB TYR 16 6.407 -6.344 2.174 122 HB3 TYR 16 1HB TYR 16 6.229 -4.703 1.550 123 HD1 TYR 16 1HD TYR 16 8.809 -3.478 1.832 124 HD2 TYR 16 2HD TYR 16 7.873 -7.542 0.800 125 HE1 TYR 16 1HE TYR 16 10.986 -3.682 0.663 126 HE2 TYR 16 2HE TYR 16 10.052 -7.747 -0.368 127 HH TYR 16 HH TYR 16 11.830 -6.613 -1.149 128 H LEU 17 H LEU 17 4.959 -5.611 4.681 129 HA LEU 17 HA LEU 17 3.277 -3.312 4.259 130 HB2 LEU 17 2HB LEU 17 3.285 -5.606 6.248 131 HB3 LEU 17 1HB LEU 17 1.964 -4.439 6.136 132 HG LEU 17 HG LEU 17 2.963 -5.993 3.752 133 HD11 LEU 17 1HD1 LEU 17 0.434 -6.961 4.579 134 HD12 LEU 17 2HD1 LEU 17 1.450 -6.943 6.021 135 HD13 LEU 17 3HD1 LEU 17 1.967 -7.834 4.590 136 HD21 LEU 17 3HD2 LEU 17 0.283 -4.685 4.280 137 HD22 LEU 17 1HD2 LEU 17 0.903 -5.281 2.739 138 HD23 LEU 17 2HD2 LEU 17 1.618 -3.851 3.484 139 H GLN 18 H GLN 18 5.385 -4.368 6.885 140 HA GLN 18 HA GLN 18 4.819 -2.169 8.664 141 HB2 GLN 18 2HB GLN 18 5.984 -3.601 9.954 142 HB3 GLN 18 1HB GLN 18 6.334 -4.567 8.529 143 HG2 GLN 18 2HG GLN 18 8.392 -3.478 8.144 144 HG3 GLN 18 1HG GLN 18 7.964 -2.115 9.179 145 HE21 GLN 18 1HE2 GLN 18 7.434 -2.927 11.591 146 HE22 GLN 18 2HE2 GLN 18 8.555 -4.031 12.227 147 H ASN 19 H ASN 19 7.374 -2.923 6.408 148 HA ASN 19 HA ASN 19 8.773 -0.436 6.550 149 HB2 ASN 19 2HB ASN 19 8.627 -2.858 4.879 150 HB3 ASN 19 1HB ASN 19 9.063 -1.414 3.961 151 HD21 ASN 19 1HD2 ASN 19 11.269 -2.495 3.775 152 HD22 ASN 19 2HD2 ASN 19 12.361 -2.327 5.063 153 H LEU 20 H LEU 20 5.860 -1.517 5.117 154 HA LEU 20 HA LEU 20 5.532 0.883 3.424 155 HB2 LEU 20 2HB LEU 20 4.865 -1.256 2.506 156 HB3 LEU 20 1HB LEU 20 3.901 -1.612 3.938 157 HG LEU 20 HG LEU 20 2.434 0.313 3.423 158 HD11 LEU 20 1HD1 LEU 20 3.653 1.875 2.225 159 HD12 LEU 20 2HD1 LEU 20 2.791 1.090 0.903 160 HD13 LEU 20 3HD1 LEU 20 4.463 0.650 1.249 161 HD21 LEU 20 3HD2 LEU 20 1.899 -1.954 2.554 162 HD22 LEU 20 1HD2 LEU 20 2.801 -1.587 1.084 163 HD23 LEU 20 2HD2 LEU 20 1.332 -0.687 1.466 164 H ASN 21 H ASN 21 4.923 -0.114 6.600 165 HA ASN 21 HA ASN 21 2.599 1.673 6.963 166 HB2 ASN 21 2HB ASN 21 3.965 -0.539 8.407 167 HB3 ASN 21 1HB ASN 21 3.277 0.731 9.423 168 HD21 ASN 21 1HD2 ASN 21 2.184 -0.912 6.390 169 HD22 ASN 21 2HD2 ASN 21 0.632 -1.269 6.974 170 H ASP 22 H ASP 22 5.966 1.253 7.485 171 HA ASP 22 HA ASP 22 6.331 3.527 9.170 172 HB2 ASP 22 2HB ASP 22 7.958 1.496 7.795 173 HB3 ASP 22 1HB ASP 22 8.772 3.041 8.040 174 H THR 23 H THR 23 6.160 2.853 5.868 175 HA THR 23 HA THR 23 7.168 5.424 4.876 176 HB THR 23 HB THR 23 5.577 3.128 3.737 177 HG1 THR 23 1HG THR 23 7.844 2.853 2.777 178 HG21 THR 23 3HG2 THR 23 7.139 4.429 1.747 179 HG22 THR 23 1HG2 THR 23 6.258 5.682 2.622 180 HG23 THR 23 2HG2 THR 23 5.381 4.353 1.863 181 H LEU 24 H LEU 24 4.095 3.760 5.424 182 HA LEU 24 HA LEU 24 2.468 5.970 4.394 183 HB2 LEU 24 2HB LEU 24 1.965 3.322 5.776 184 HB3 LEU 24 1HB LEU 24 0.650 4.423 5.363 185 HG LEU 24 HG LEU 24 2.661 3.285 3.397 186 HD11 LEU 24 1HD1 LEU 24 0.971 1.659 4.328 187 HD12 LEU 24 2HD1 LEU 24 0.836 1.918 2.589 188 HD13 LEU 24 3HD1 LEU 24 -0.300 2.702 3.688 189 HD21 LEU 24 3HD2 LEU 24 0.845 4.243 1.793 190 HD22 LEU 24 1HD2 LEU 24 1.987 5.370 2.526 191 HD23 LEU 24 2HD2 LEU 24 0.356 5.217 3.179 192 H LEU 25 H LEU 25 3.692 4.818 7.501 193 HA LEU 25 HA LEU 25 1.883 6.674 8.924 194 HB2 LEU 25 2HB LEU 25 2.665 5.651 10.874 195 HB3 LEU 25 1HB LEU 25 2.753 4.365 9.676 196 HG LEU 25 HG LEU 25 5.124 5.256 9.247 197 HD11 LEU 25 1HD1 LEU 25 5.541 7.121 10.492 198 HD12 LEU 25 2HD1 LEU 25 5.855 5.968 11.789 199 HD13 LEU 25 3HD1 LEU 25 4.272 6.736 11.656 200 HD21 LEU 25 3HD2 LEU 25 4.730 3.056 10.167 201 HD22 LEU 25 1HD2 LEU 25 4.286 3.737 11.733 202 HD23 LEU 25 2HD2 LEU 25 5.957 3.822 11.178 203 H GLU 26 H GLU 26 4.897 6.728 7.476 204 HA GLU 26 HA GLU 26 5.760 9.156 8.926 205 HB2 GLU 26 2HB GLU 26 6.999 7.369 6.825 206 HB3 GLU 26 1HB GLU 26 7.749 8.877 7.355 207 HG2 GLU 26 2HG GLU 26 7.031 6.551 9.164 208 HG3 GLU 26 1HG GLU 26 8.655 6.937 8.595 209 H LEU 27 H LEU 27 4.326 7.928 6.094 210 HA LEU 27 HA LEU 27 4.607 10.136 4.379 211 HB2 LEU 27 2HB LEU 27 3.909 8.038 3.481 212 HB3 LEU 27 1HB LEU 27 2.625 7.883 4.677 213 HG LEU 27 HG LEU 27 1.629 10.003 3.608 214 HD11 LEU 27 1HD1 LEU 27 3.416 9.128 1.325 215 HD12 LEU 27 2HD1 LEU 27 3.755 10.521 2.350 216 HD13 LEU 27 3HD1 LEU 27 2.306 10.499 1.343 217 HD21 LEU 27 3HD2 LEU 27 0.842 8.536 1.570 218 HD22 LEU 27 1HD2 LEU 27 0.426 8.033 3.209 219 HD23 LEU 27 2HD2 LEU 27 1.773 7.268 2.367 220 H GLU 28 H GLU 28 2.404 9.359 6.997 221 HA GLU 28 HA GLU 28 0.468 11.430 6.504 222 HB2 GLU 28 2HB GLU 28 -0.391 10.662 8.514 223 HB3 GLU 28 1HB GLU 28 0.624 9.299 8.063 224 HG2 GLU 28 2HG GLU 28 2.440 10.160 9.461 225 HG3 GLU 28 1HG GLU 28 1.452 11.550 9.904 226 H LYS 29 H LYS 29 3.466 11.271 8.384 227 HA LYS 29 HA LYS 29 3.266 14.049 9.276 228 HB2 LYS 29 2HB LYS 29 5.620 12.134 9.246 229 HB3 LYS 29 1HB LYS 29 5.469 13.581 10.242 230 HG2 LYS 29 2HG LYS 29 4.088 12.561 11.740 231 HG3 LYS 29 1HG LYS 29 3.255 11.642 10.487 232 HD2 LYS 29 2HD LYS 29 4.520 10.108 11.890 233 HD3 LYS 29 1HD LYS 29 5.240 10.178 10.284 234 HE2 LYS 29 2HE LYS 29 7.210 10.708 11.270 235 HE3 LYS 29 1HE LYS 29 6.476 12.244 11.771 236 HZ1 LYS 29 3HZ LYS 29 7.299 10.701 13.608 237 HZ2 LYS 29 1HZ LYS 29 5.958 9.731 13.238 238 HZ3 LYS 29 2HZ LYS 29 5.729 11.329 13.765 239 H ASN 30 H ASN 30 4.176 12.338 6.535 240 HA ASN 30 HA ASN 30 5.197 14.810 5.254 241 HB2 ASN 30 2HB ASN 30 6.738 12.292 5.799 242 HB3 ASN 30 1HB ASN 30 7.048 13.140 4.283 243 HD21 ASN 30 1HD2 ASN 30 8.822 12.888 6.725 244 HD22 ASN 30 2HD2 ASN 30 9.170 14.486 7.182 245 HA PRO 31 HA PRO 31 2.404 12.325 2.739 246 HB2 PRO 31 2HB PRO 31 0.430 14.180 2.639 247 HB3 PRO 31 1HB PRO 31 0.634 13.053 3.987 248 HG2 PRO 31 2HG PRO 31 1.175 15.929 3.868 249 HG3 PRO 31 1HG PRO 31 0.778 14.899 5.251 250 HD2 PRO 31 2HD PRO 31 3.337 15.826 4.463 251 HD3 PRO 31 1HD PRO 31 2.945 14.692 5.774 252 H GLU 32 H GLU 32 4.475 14.741 2.199 253 HA GLU 32 HA GLU 32 3.680 14.978 -0.653 254 HB2 GLU 32 2HB GLU 32 4.473 17.546 -0.091 255 HB3 GLU 32 1HB GLU 32 2.794 17.020 -0.149 256 HG2 GLU 32 2HG GLU 32 2.618 16.883 2.182 257 HG3 GLU 32 1HG GLU 32 4.365 16.751 2.402 258 H ASP 33 H ASP 33 5.958 14.026 1.386 259 HA ASP 33 HA ASP 33 8.323 15.417 0.519 260 HB2 ASP 33 2HB ASP 33 7.568 13.008 2.064 261 HB3 ASP 33 1HB ASP 33 9.200 13.009 1.393 262 H MET 34 H MET 34 6.308 13.180 -0.980 263 HA MET 34 HA MET 34 6.427 12.088 -3.048 264 HB2 MET 34 2HB MET 34 8.370 14.278 -3.068 265 HB3 MET 34 1HB MET 34 8.849 12.957 -4.135 266 HG2 MET 34 2HG MET 34 6.004 13.506 -4.351 267 HG3 MET 34 1HG MET 34 6.961 14.945 -4.699 268 HE1 MET 34 3HE MET 34 5.201 12.620 -7.023 269 HE2 MET 34 1HE MET 34 5.984 13.770 -8.115 270 HE3 MET 34 2HE MET 34 5.314 14.323 -6.582 271 H GLU 35 H GLU 35 8.326 11.501 -0.490 272 HA GLU 35 HA GLU 35 9.891 9.376 -1.868 273 HB2 GLU 35 2HB GLU 35 10.179 10.967 0.679 274 HB3 GLU 35 1HB GLU 35 10.989 9.405 0.529 275 HG2 GLU 35 2HG GLU 35 11.783 10.377 -1.788 276 HG3 GLU 35 1HG GLU 35 11.446 11.930 -1.024 277 H LEU 36 H LEU 36 7.706 10.129 0.818 278 HA LEU 36 HA LEU 36 7.314 7.288 1.477 279 HB2 LEU 36 2HB LEU 36 5.750 9.790 2.230 280 HB3 LEU 36 1HB LEU 36 5.651 8.224 3.034 281 HG LEU 36 HG LEU 36 8.393 9.082 2.839 282 HD11 LEU 36 1HD1 LEU 36 7.586 11.344 2.872 283 HD12 LEU 36 2HD1 LEU 36 8.148 10.969 4.500 284 HD13 LEU 36 3HD1 LEU 36 6.420 10.966 4.139 285 HD21 LEU 36 3HD2 LEU 36 7.051 7.442 4.424 286 HD22 LEU 36 1HD2 LEU 36 6.848 8.900 5.394 287 HD23 LEU 36 2HD2 LEU 36 8.466 8.305 5.026 288 H ILE 37 H ILE 37 6.046 9.700 -0.677 289 HA ILE 37 HA ILE 37 3.517 8.341 -1.239 290 HB ILE 37 HB ILE 37 5.164 10.499 -2.604 291 HG12 ILE 37 2HG1 ILE 37 2.700 10.534 -0.832 292 HG13 ILE 37 1HG1 ILE 37 4.293 11.183 -0.445 293 HG21 ILE 37 1HG2 ILE 37 3.843 9.627 -4.355 294 HG22 ILE 37 2HG2 ILE 37 2.869 10.955 -3.728 295 HG23 ILE 37 3HG2 ILE 37 2.483 9.293 -3.283 296 HD11 ILE 37 3HD1 ILE 37 4.083 12.942 -2.019 297 HD12 ILE 37 1HD1 ILE 37 2.509 12.864 -1.229 298 HD13 ILE 37 2HD1 ILE 37 2.726 12.161 -2.832 299 H ASN 38 H ASN 38 6.819 8.387 -2.512 300 HA ASN 38 HA ASN 38 6.092 6.565 -4.720 301 HB2 ASN 38 2HB ASN 38 7.778 8.598 -4.663 302 HB3 ASN 38 1HB ASN 38 8.880 7.398 -3.988 303 HD21 ASN 38 1HD2 ASN 38 10.207 6.714 -5.685 304 HD22 ASN 38 2HD2 ASN 38 9.657 6.281 -7.231 305 H GLU 39 H GLU 39 7.767 6.566 -1.660 306 HA GLU 39 HA GLU 39 8.911 3.935 -1.850 307 HB2 GLU 39 2HB GLU 39 8.116 5.796 0.390 308 HB3 GLU 39 1HB GLU 39 8.795 4.205 0.733 309 HG2 GLU 39 2HG GLU 39 10.230 5.912 -1.250 310 HG3 GLU 39 1HG GLU 39 10.356 6.360 0.452 311 H ALA 40 H ALA 40 5.773 5.148 -1.261 312 HA ALA 40 HA ALA 40 4.724 2.598 -0.192 313 HB1 ALA 40 1HB ALA 40 3.298 5.165 -0.951 314 HB2 ALA 40 2HB ALA 40 4.065 4.905 0.616 315 HB3 ALA 40 3HB ALA 40 2.704 3.897 0.123 316 H PHE 41 H PHE 41 3.958 4.777 -2.970 317 HA PHE 41 HA PHE 41 2.225 3.163 -4.422 318 HB2 PHE 41 2HB PHE 41 2.836 5.351 -5.187 319 HB3 PHE 41 1HB PHE 41 4.543 4.919 -5.268 320 HD1 PHE 41 1HD PHE 41 5.353 3.324 -7.018 321 HD2 PHE 41 2HD PHE 41 1.323 4.812 -6.970 322 HE1 PHE 41 1HE PHE 41 5.058 2.603 -9.373 323 HE2 PHE 41 2HE PHE 41 1.030 4.090 -9.325 324 HZ PHE 41 HZ PHE 41 2.897 2.987 -10.526 325 H ARG 42 H ARG 42 5.694 2.727 -3.965 326 HA ARG 42 HA ARG 42 5.949 0.618 -5.983 327 HB2 ARG 42 2HB ARG 42 7.718 1.517 -3.682 328 HB3 ARG 42 1HB ARG 42 8.223 0.462 -5.003 329 HG2 ARG 42 2HG ARG 42 7.998 2.195 -6.615 330 HG3 ARG 42 1HG ARG 42 7.074 3.209 -5.508 331 HD2 ARG 42 2HD ARG 42 9.058 4.220 -5.026 332 HD3 ARG 42 1HD ARG 42 9.464 2.740 -4.136 333 HE ARG 42 HE ARG 42 9.924 2.409 -6.974 334 HH11 ARG 42 1HH2 ARG 42 11.311 5.011 -6.075 335 HH12 ARG 42 2HH2 ARG 42 12.895 4.415 -5.707 336 HH21 ARG 42 1HH1 ARG 42 11.921 1.089 -5.643 337 HH22 ARG 42 2HH1 ARG 42 13.240 2.197 -5.464 338 H ALA 43 H ALA 43 6.429 0.572 -2.423 339 HA ALA 43 HA ALA 43 6.443 -2.159 -1.943 340 HB1 ALA 43 1HB ALA 43 4.871 -1.151 0.097 341 HB2 ALA 43 2HB ALA 43 5.649 0.300 -0.536 342 HB3 ALA 43 3HB ALA 43 6.631 -1.049 0.038 343 H LEU 44 H LEU 44 3.490 -0.132 -2.114 344 HA LEU 44 HA LEU 44 1.638 -2.310 -1.890 345 HB2 LEU 44 2HB LEU 44 1.549 0.486 -3.050 346 HB3 LEU 44 1HB LEU 44 0.115 -0.540 -2.963 347 HG LEU 44 HG LEU 44 1.770 -0.196 -0.494 348 HD11 LEU 44 1HD1 LEU 44 0.223 1.806 0.013 349 HD12 LEU 44 2HD1 LEU 44 -0.045 1.877 -1.729 350 HD13 LEU 44 3HD1 LEU 44 1.579 2.094 -1.078 351 HD21 LEU 44 3HD2 LEU 44 0.009 -1.615 -0.038 352 HD22 LEU 44 1HD2 LEU 44 -1.024 -0.898 -1.275 353 HD23 LEU 44 2HD2 LEU 44 -0.801 -0.080 0.272 354 H HIS 45 H HIS 45 3.095 -0.670 -4.695 355 HA HIS 45 HA HIS 45 1.699 -2.165 -6.722 356 HB2 HIS 45 2HB HIS 45 2.776 -0.176 -7.398 357 HB3 HIS 45 1HB HIS 45 4.237 -0.552 -6.487 358 HD1 HIS 45 1HD HIS 45 6.045 -0.849 -8.188 359 HD2 HIS 45 2HD HIS 45 2.517 -2.738 -9.352 360 HE1 HIS 45 1HE HIS 45 6.575 -2.099 -10.326 361 H THR 46 H THR 46 4.623 -2.681 -4.832 362 HA THR 46 HA THR 46 5.463 -5.070 -6.272 363 HB THR 46 HB THR 46 6.302 -3.326 -4.060 364 HG1 THR 46 1HG THR 46 8.358 -4.432 -4.922 365 HG21 THR 46 3HG2 THR 46 7.750 -5.106 -2.999 366 HG22 THR 46 1HG2 THR 46 6.770 -6.309 -3.838 367 HG23 THR 46 2HG2 THR 46 6.029 -5.248 -2.640 368 H LEU 47 H LEU 47 3.763 -4.356 -3.220 369 HA LEU 47 HA LEU 47 3.393 -7.116 -2.441 370 HB2 LEU 47 2HB LEU 47 2.711 -4.399 -1.595 371 HB3 LEU 47 1HB LEU 47 1.410 -5.545 -1.260 372 HG LEU 47 HG LEU 47 4.285 -6.136 -0.556 373 HD11 LEU 47 1HD1 LEU 47 2.481 -4.210 0.657 374 HD12 LEU 47 2HD1 LEU 47 4.168 -4.552 1.044 375 HD13 LEU 47 3HD1 LEU 47 2.883 -5.499 1.793 376 HD21 LEU 47 3HD2 LEU 47 3.250 -7.745 0.972 377 HD22 LEU 47 1HD2 LEU 47 2.625 -8.003 -0.657 378 HD23 LEU 47 2HD2 LEU 47 1.643 -7.158 0.540 379 H LYS 48 H LYS 48 1.428 -4.728 -4.209 380 HA LYS 48 HA LYS 48 -0.997 -6.174 -4.416 381 HB2 LYS 48 2HB LYS 48 -0.982 -3.934 -5.102 382 HB3 LYS 48 1HB LYS 48 0.505 -4.126 -6.025 383 HG2 LYS 48 2HG LYS 48 -0.829 -5.645 -7.596 384 HG3 LYS 48 1HG LYS 48 -2.274 -5.054 -6.772 385 HD2 LYS 48 2HD LYS 48 -2.125 -3.480 -8.459 386 HD3 LYS 48 1HD LYS 48 -1.126 -2.698 -7.230 387 HE2 LYS 48 2HE LYS 48 0.848 -3.155 -8.342 388 HE3 LYS 48 1HE LYS 48 0.200 -4.624 -9.100 389 HZ1 LYS 48 3HZ LYS 48 0.075 -3.178 -10.853 390 HZ2 LYS 48 1HZ LYS 48 -0.172 -1.817 -9.872 391 HZ3 LYS 48 2HZ LYS 48 -1.448 -2.903 -10.151 392 H GLY 49 H GLY 49 2.008 -6.374 -6.299 393 HA2 GLY 49 2HA GLY 49 0.939 -8.229 -8.263 394 HA3 GLY 49 1HA GLY 49 2.646 -7.855 -8.020 395 H MET 50 H MET 50 3.272 -8.666 -5.565 396 HA MET 50 HA MET 50 3.514 -11.462 -5.659 397 HB2 MET 50 2HB MET 50 3.538 -9.399 -3.458 398 HB3 MET 50 1HB MET 50 3.822 -11.101 -3.095 399 HG2 MET 50 2HG MET 50 5.887 -11.085 -4.044 400 HG3 MET 50 1HG MET 50 5.357 -10.087 -5.397 401 HE1 MET 50 3HE MET 50 4.396 -8.859 -1.842 402 HE2 MET 50 1HE MET 50 5.966 -8.379 -1.178 403 HE3 MET 50 2HE MET 50 5.655 -10.064 -1.584 404 H ALA 51 H ALA 51 0.886 -9.492 -4.352 405 HA ALA 51 HA ALA 51 -0.498 -11.854 -3.220 406 HB1 ALA 51 1HB ALA 51 -0.722 -8.878 -3.191 407 HB2 ALA 51 2HB ALA 51 -0.811 -10.021 -1.851 408 HB3 ALA 51 3HB ALA 51 -2.201 -9.796 -2.914 409 H GLY 52 H GLY 52 -0.250 -10.350 -6.239 410 HA2 GLY 52 2HA GLY 52 -3.050 -10.836 -7.012 411 HA3 GLY 52 1HA GLY 52 -1.797 -10.155 -8.048 412 H THR 53 H THR 53 -1.385 -13.112 -6.193 413 HA THR 53 HA THR 53 -2.114 -14.968 -8.218 414 HB THR 53 HB THR 53 0.247 -13.463 -8.707 415 HG1 THR 53 1HG THR 53 -0.926 -15.740 -9.898 416 HG21 THR 53 3HG2 THR 53 1.584 -14.938 -7.362 417 HG22 THR 53 1HG2 THR 53 1.860 -15.394 -9.044 418 HG23 THR 53 2HG2 THR 53 0.790 -16.364 -8.032 419 H MET 54 H MET 54 -0.003 -14.186 -5.607 420 HA MET 54 HA MET 54 -0.196 -16.980 -4.562 421 HB2 MET 54 2HB MET 54 1.984 -15.453 -5.116 422 HB3 MET 54 1HB MET 54 1.704 -15.027 -3.429 423 HG2 MET 54 2HG MET 54 1.386 -17.756 -3.374 424 HG3 MET 54 1HG MET 54 2.651 -17.567 -4.588 425 HE1 MET 54 3HE MET 54 4.444 -14.998 -3.602 426 HE2 MET 54 1HE MET 54 4.641 -16.537 -4.450 427 HE3 MET 54 2HE MET 54 5.612 -16.183 -3.023 428 H GLY 55 H GLY 55 -1.128 -13.761 -4.175 429 HA2 GLY 55 2HA GLY 55 -2.064 -14.310 -1.385 430 HA3 GLY 55 1HA GLY 55 -1.540 -12.703 -1.906 431 H PHE 56 H PHE 56 -3.003 -14.235 -4.463 432 HA PHE 56 HA PHE 56 -5.158 -14.079 -5.439 433 HB2 PHE 56 2HB PHE 56 -5.501 -14.348 -2.623 434 HB3 PHE 56 1HB PHE 56 -6.645 -13.123 -3.175 435 HD1 PHE 56 1HD PHE 56 -5.568 -16.639 -3.535 436 HD2 PHE 56 2HD PHE 56 -8.442 -13.673 -4.714 437 HE1 PHE 56 1HE PHE 56 -7.007 -18.415 -4.497 438 HE2 PHE 56 2HE PHE 56 -9.882 -15.449 -5.674 439 HZ PHE 56 HZ PHE 56 -9.163 -17.820 -5.567 440 H SER 57 H SER 57 -5.393 -12.341 -6.780 441 HA SER 57 HA SER 57 -4.630 -9.687 -6.218 442 HB2 SER 57 2HB SER 57 -6.865 -10.279 -8.110 443 HB3 SER 57 1HB SER 57 -5.434 -9.284 -8.360 444 HG SER 57 HG SER 57 -5.810 -12.009 -8.671 445 H SER 58 H SER 58 -7.410 -11.411 -5.270 446 HA SER 58 HA SER 58 -9.353 -9.361 -5.012 447 HB2 SER 58 2HB SER 58 -8.753 -11.822 -3.341 448 HB3 SER 58 1HB SER 58 -10.246 -10.894 -3.230 449 HG SER 58 HG SER 58 -10.235 -11.277 -5.657 450 H MET 59 H MET 59 -6.435 -10.038 -3.302 451 HA MET 59 HA MET 59 -7.113 -8.005 -1.224 452 HB2 MET 59 2HB MET 59 -6.583 -10.181 -0.309 453 HB3 MET 59 1HB MET 59 -5.165 -10.325 -1.349 454 HG2 MET 59 2HG MET 59 -4.432 -8.095 -0.148 455 HG3 MET 59 1HG MET 59 -5.555 -8.635 1.101 456 HE1 MET 59 3HE MET 59 -2.593 -9.367 -1.102 457 HE2 MET 59 1HE MET 59 -3.403 -10.921 -1.345 458 HE3 MET 59 2HE MET 59 -1.868 -10.849 -0.486 459 H ALA 60 H ALA 60 -5.025 -8.873 -3.860 460 HA ALA 60 HA ALA 60 -2.999 -6.837 -3.279 461 HB1 ALA 60 1HB ALA 60 -2.956 -7.770 -5.985 462 HB2 ALA 60 2HB ALA 60 -3.373 -9.135 -4.950 463 HB3 ALA 60 3HB ALA 60 -1.884 -8.233 -4.664 464 H LYS 61 H LYS 61 -5.944 -7.117 -5.231 465 HA LYS 61 HA LYS 61 -5.544 -4.802 -6.892 466 HB2 LYS 61 2HB LYS 61 -8.043 -6.049 -5.681 467 HB3 LYS 61 1HB LYS 61 -8.047 -4.886 -7.007 468 HG2 LYS 61 2HG LYS 61 -7.155 -6.401 -8.522 469 HG3 LYS 61 1HG LYS 61 -6.379 -7.363 -7.261 470 HD2 LYS 61 2HD LYS 61 -8.327 -8.560 -8.181 471 HD3 LYS 61 1HD LYS 61 -8.604 -8.129 -6.492 472 HE2 LYS 61 2HE LYS 61 -10.542 -7.189 -7.216 473 HE3 LYS 61 1HE LYS 61 -9.521 -5.898 -7.878 474 HZ1 LYS 61 3HZ LYS 61 -9.558 -6.792 -9.955 475 HZ2 LYS 61 1HZ LYS 61 -11.073 -7.342 -9.428 476 HZ3 LYS 61 2HZ LYS 61 -9.735 -8.389 -9.399 477 H LEU 62 H LEU 62 -6.749 -5.347 -3.640 478 HA LEU 62 HA LEU 62 -7.594 -2.681 -3.035 479 HB2 LEU 62 2HB LEU 62 -8.224 -4.608 -1.698 480 HB3 LEU 62 1HB LEU 62 -6.530 -5.020 -1.415 481 HG LEU 62 HG LEU 62 -6.207 -2.984 -0.129 482 HD11 LEU 62 1HD1 LEU 62 -8.565 -2.165 -1.529 483 HD12 LEU 62 2HD1 LEU 62 -7.526 -1.196 -0.484 484 HD13 LEU 62 3HD1 LEU 62 -8.892 -2.076 0.200 485 HD21 LEU 62 3HD2 LEU 62 -7.477 -5.145 0.768 486 HD22 LEU 62 1HD2 LEU 62 -8.807 -4.001 0.948 487 HD23 LEU 62 2HD2 LEU 62 -7.283 -3.720 1.788 488 H CYS 63 H CYS 63 -4.499 -4.416 -2.828 489 HA CYS 63 HA CYS 63 -2.989 -2.364 -1.514 490 HB2 CYS 63 2HB CYS 63 -2.461 -4.744 -3.274 491 HB3 CYS 63 1HB CYS 63 -1.127 -3.650 -2.907 492 HG CYS 63 HG CYS 63 -1.963 -4.102 -0.279 493 H HIS 64 H HIS 64 -3.798 -3.041 -4.884 494 HA HIS 64 HA HIS 64 -2.160 -1.021 -6.105 495 HB2 HIS 64 2HB HIS 64 -3.364 -3.028 -7.143 496 HB3 HIS 64 1HB HIS 64 -4.850 -2.092 -7.011 497 HD1 HIS 64 1HD HIS 64 -5.004 -2.017 -9.645 498 HD2 HIS 64 2HD HIS 64 -1.657 -0.110 -8.051 499 HE1 HIS 64 1HE HIS 64 -4.035 -0.599 -11.506 500 H THR 65 H THR 65 -5.436 -1.114 -4.803 501 HA THR 65 HA THR 65 -6.383 1.426 -5.600 502 HB THR 65 HB THR 65 -6.901 -0.652 -3.569 503 HG1 THR 65 1HG THR 65 -8.617 1.064 -5.028 504 HG21 THR 65 3HG2 THR 65 -7.950 2.150 -3.093 505 HG22 THR 65 1HG2 THR 65 -6.732 1.347 -2.102 506 HG23 THR 65 2HG2 THR 65 -8.373 0.705 -2.176 507 H LEU 66 H LEU 66 -4.711 0.539 -2.543 508 HA LEU 66 HA LEU 66 -4.464 3.142 -1.424 509 HB2 LEU 66 2HB LEU 66 -2.821 0.594 -1.359 510 HB3 LEU 66 1HB LEU 66 -2.357 2.006 -0.410 511 HG LEU 66 HG LEU 66 -4.865 1.938 0.371 512 HD11 LEU 66 1HD1 LEU 66 -5.543 -0.525 0.569 513 HD12 LEU 66 2HD1 LEU 66 -4.347 -0.839 -0.689 514 HD13 LEU 66 3HD1 LEU 66 -5.723 0.214 -1.022 515 HD21 LEU 66 3HD2 LEU 66 -3.971 -0.078 1.970 516 HD22 LEU 66 1HD2 LEU 66 -3.466 1.600 2.149 517 HD23 LEU 66 2HD2 LEU 66 -2.452 0.468 1.258 518 H GLU 67 H GLU 67 -2.148 1.293 -3.417 519 HA GLU 67 HA GLU 67 -0.193 3.310 -3.766 520 HB2 GLU 67 2HB GLU 67 0.321 1.067 -4.340 521 HB3 GLU 67 1HB GLU 67 -1.144 0.896 -5.306 522 HG2 GLU 67 2HG GLU 67 0.744 3.017 -6.170 523 HG3 GLU 67 1HG GLU 67 1.296 1.358 -6.394 524 H ASN 68 H ASN 68 -3.342 2.929 -5.138 525 HA ASN 68 HA ASN 68 -2.958 4.491 -7.526 526 HB2 ASN 68 2HB ASN 68 -4.910 2.953 -6.404 527 HB3 ASN 68 1HB ASN 68 -5.531 4.572 -6.081 528 HD21 ASN 68 1HD2 ASN 68 -4.928 2.215 -8.607 529 HD22 ASN 68 2HD2 ASN 68 -5.563 3.133 -9.886 530 H ILE 69 H ILE 69 -4.095 5.205 -4.237 531 HA ILE 69 HA ILE 69 -4.536 8.011 -4.620 532 HB ILE 69 HB ILE 69 -3.966 6.177 -2.294 533 HG12 ILE 69 2HG1 ILE 69 -6.313 6.802 -1.755 534 HG13 ILE 69 1HG1 ILE 69 -6.351 7.777 -3.223 535 HG21 ILE 69 1HG2 ILE 69 -4.648 9.125 -2.081 536 HG22 ILE 69 2HG2 ILE 69 -3.022 8.482 -1.848 537 HG23 ILE 69 3HG2 ILE 69 -4.322 8.013 -0.753 538 HD11 ILE 69 3HD1 ILE 69 -7.330 5.457 -3.468 539 HD12 ILE 69 1HD1 ILE 69 -5.703 4.832 -3.211 540 HD13 ILE 69 2HD1 ILE 69 -6.045 5.848 -4.612 541 H LEU 70 H LEU 70 -1.866 6.068 -3.704 542 HA LEU 70 HA LEU 70 -0.017 8.271 -3.231 543 HB2 LEU 70 2HB LEU 70 0.538 5.343 -3.789 544 HB3 LEU 70 1HB LEU 70 1.588 6.472 -2.928 545 HG LEU 70 HG LEU 70 -1.087 5.380 -2.034 546 HD11 LEU 70 1HD1 LEU 70 1.378 4.374 -1.628 547 HD12 LEU 70 2HD1 LEU 70 0.085 4.243 -0.435 548 HD13 LEU 70 3HD1 LEU 70 1.302 5.511 -0.282 549 HD21 LEU 70 3HD2 LEU 70 0.508 7.706 -0.923 550 HD22 LEU 70 1HD2 LEU 70 -0.801 6.904 -0.053 551 HD23 LEU 70 2HD2 LEU 70 -1.137 7.756 -1.560 552 H ASP 71 H ASP 71 -1.368 6.776 -5.926 553 HA ASP 71 HA ASP 71 0.890 7.324 -7.738 554 HB2 ASP 71 2HB ASP 71 -0.796 5.384 -7.887 555 HB3 ASP 71 1HB ASP 71 -1.980 6.586 -8.398 556 H LYS 72 H LYS 72 -2.350 8.607 -6.956 557 HA LYS 72 HA LYS 72 -2.187 10.788 -8.869 558 HB2 LYS 72 2HB LYS 72 -3.848 9.986 -6.510 559 HB3 LYS 72 1HB LYS 72 -4.044 11.604 -7.191 560 HG2 LYS 72 2HG LYS 72 -5.587 10.439 -8.441 561 HG3 LYS 72 1HG LYS 72 -4.150 10.263 -9.451 562 HD2 LYS 72 2HD LYS 72 -5.022 8.077 -9.244 563 HD3 LYS 72 1HD LYS 72 -3.657 8.166 -8.139 564 HE2 LYS 72 2HE LYS 72 -5.009 7.654 -6.384 565 HE3 LYS 72 1HE LYS 72 -6.021 9.061 -6.755 566 HZ1 LYS 72 3HZ LYS 72 -6.564 6.338 -7.255 567 HZ2 LYS 72 1HZ LYS 72 -6.490 7.157 -8.737 568 HZ3 LYS 72 2HZ LYS 72 -7.560 7.685 -7.531 569 H ALA 73 H ALA 73 -1.384 10.166 -5.586 570 HA ALA 73 HA ALA 73 -0.734 12.757 -4.621 571 HB1 ALA 73 1HB ALA 73 0.281 9.952 -4.100 572 HB2 ALA 73 2HB ALA 73 -0.886 10.872 -3.143 573 HB3 ALA 73 3HB ALA 73 0.816 11.336 -3.141 574 H ARG 74 H ARG 74 1.118 10.334 -6.442 575 HA ARG 74 HA ARG 74 3.437 12.155 -6.624 576 HB2 ARG 74 2HB ARG 74 4.527 10.224 -7.602 577 HB3 ARG 74 1HB ARG 74 3.575 9.654 -6.231 578 HG2 ARG 74 2HG ARG 74 1.795 8.922 -7.690 579 HG3 ARG 74 1HG ARG 74 2.582 9.645 -9.092 580 HD2 ARG 74 2HD ARG 74 4.153 7.653 -7.498 581 HD3 ARG 74 1HD ARG 74 2.871 7.044 -8.563 582 HE ARG 74 HE ARG 74 4.298 8.978 -10.044 583 HH11 ARG 74 1HH2 ARG 74 3.887 5.854 -10.363 584 HH12 ARG 74 2HH2 ARG 74 5.531 5.392 -10.651 585 HH21 ARG 74 1HH1 ARG 74 6.845 8.429 -9.617 586 HH22 ARG 74 2HH1 ARG 74 7.205 6.850 -10.229 587 H ASN 75 H ASN 75 0.545 11.473 -8.295 588 HA ASN 75 HA ASN 75 1.627 12.360 -10.931 589 HB2 ASN 75 2HB ASN 75 0.026 10.387 -10.559 590 HB3 ASN 75 1HB ASN 75 -1.205 11.594 -10.189 591 HD21 ASN 75 1HD2 ASN 75 -2.376 10.877 -12.175 592 HD22 ASN 75 2HD2 ASN 75 -1.848 11.406 -13.699 593 H SER 76 H SER 76 0.543 13.760 -8.139 594 HA SER 76 HA SER 76 0.037 16.021 -7.680 595 HB2 SER 76 2HB SER 76 1.220 16.143 -10.067 596 HB3 SER 76 1HB SER 76 -0.412 16.555 -10.589 597 HG SER 76 HG SER 76 1.399 18.061 -9.295 598 H GLU 77 H GLU 77 -1.989 13.720 -8.313 599 HA GLU 77 HA GLU 77 -4.309 15.404 -9.066 600 HB2 GLU 77 2HB GLU 77 -3.816 12.447 -8.771 601 HB3 GLU 77 1HB GLU 77 -5.414 13.107 -9.112 602 HG2 GLU 77 2HG GLU 77 -2.917 13.498 -10.788 603 HG3 GLU 77 1HG GLU 77 -4.293 12.473 -11.202 604 H ILE 78 H ILE 78 -3.002 13.548 -6.414 605 HA ILE 78 HA ILE 78 -4.824 14.977 -4.539 606 HB ILE 78 HB ILE 78 -5.512 12.801 -3.540 607 HG12 ILE 78 2HG1 ILE 78 -4.986 10.918 -5.432 608 HG13 ILE 78 1HG1 ILE 78 -3.511 11.888 -5.488 609 HG21 ILE 78 1HG2 ILE 78 -6.095 12.563 -6.470 610 HG22 ILE 78 2HG2 ILE 78 -6.664 13.987 -5.598 611 HG23 ILE 78 3HG2 ILE 78 -7.188 12.379 -5.098 612 HD11 ILE 78 3HD1 ILE 78 -2.797 11.108 -3.516 613 HD12 ILE 78 1HD1 ILE 78 -4.049 9.875 -3.673 614 HD13 ILE 78 2HD1 ILE 78 -4.376 11.348 -2.759 615 H LYS 79 H LYS 79 -4.189 13.151 -2.386 616 HA LYS 79 HA LYS 79 -1.417 12.633 -2.055 617 HB2 LYS 79 2HB LYS 79 -0.638 14.579 -0.938 618 HB3 LYS 79 1HB LYS 79 -1.555 15.209 -2.301 619 HG2 LYS 79 2HG LYS 79 -3.261 14.781 0.030 620 HG3 LYS 79 1HG LYS 79 -1.933 15.883 0.376 621 HD2 LYS 79 2HD LYS 79 -3.418 17.391 -0.517 622 HD3 LYS 79 1HD LYS 79 -2.643 16.858 -2.010 623 HE2 LYS 79 2HE LYS 79 -4.552 15.881 -2.755 624 HE3 LYS 79 1HE LYS 79 -4.832 15.088 -1.192 625 HZ1 LYS 79 3HZ LYS 79 -5.113 17.990 -1.278 626 HZ2 LYS 79 1HZ LYS 79 -5.997 16.845 -0.395 627 HZ3 LYS 79 2HZ LYS 79 -6.336 17.091 -2.041 628 H ILE 80 H ILE 80 -1.232 13.272 0.721 629 HA ILE 80 HA ILE 80 -3.197 11.329 1.789 630 HB ILE 80 HB ILE 80 -0.613 12.569 2.608 631 HG12 ILE 80 2HG1 ILE 80 0.016 10.157 2.712 632 HG13 ILE 80 1HG1 ILE 80 -1.613 9.766 2.172 633 HG21 ILE 80 1HG2 ILE 80 -1.352 12.491 4.764 634 HG22 ILE 80 2HG2 ILE 80 -1.108 10.753 4.592 635 HG23 ILE 80 3HG2 ILE 80 -2.711 11.447 4.349 636 HD11 ILE 80 3HD1 ILE 80 0.168 11.631 0.610 637 HD12 ILE 80 1HD1 ILE 80 -1.284 10.791 0.064 638 HD13 ILE 80 2HD1 ILE 80 0.202 9.886 0.356 639 H THR 81 H THR 81 -4.979 12.675 1.795 640 HA THR 81 HA THR 81 -5.042 15.228 3.251 641 HB THR 81 HB THR 81 -7.364 15.199 2.474 642 HG1 THR 81 1HG THR 81 -8.130 13.232 2.703 643 HG21 THR 81 3HG2 THR 81 -6.905 15.342 0.209 644 HG22 THR 81 1HG2 THR 81 -5.935 13.869 0.210 645 HG23 THR 81 2HG2 THR 81 -5.263 15.368 0.853 646 H SER 82 H SER 82 -4.590 12.388 4.553 647 HA SER 82 HA SER 82 -5.032 11.581 6.748 648 HB2 SER 82 2HB SER 82 -5.793 14.223 6.815 649 HB3 SER 82 1HB SER 82 -7.298 13.406 7.222 650 HG SER 82 HG SER 82 -6.335 12.492 8.960 651 H ASP 83 H ASP 83 -7.226 11.880 4.180 652 HA ASP 83 HA ASP 83 -9.102 9.891 5.390 653 HB2 ASP 83 2HB ASP 83 -9.375 12.347 3.822 654 HB3 ASP 83 1HB ASP 83 -10.230 10.992 3.084 655 H LEU 84 H LEU 84 -7.368 10.908 2.440 656 HA LEU 84 HA LEU 84 -7.947 8.544 0.893 657 HB2 LEU 84 2HB LEU 84 -5.643 10.531 0.872 658 HB3 LEU 84 1HB LEU 84 -5.985 9.385 -0.426 659 HG LEU 84 HG LEU 84 -7.797 11.609 0.548 660 HD11 LEU 84 1HD1 LEU 84 -7.093 11.408 -2.298 661 HD12 LEU 84 2HD1 LEU 84 -5.698 11.679 -1.253 662 HD13 LEU 84 3HD1 LEU 84 -7.052 12.809 -1.227 663 HD21 LEU 84 3HD2 LEU 84 -8.238 9.429 -1.517 664 HD22 LEU 84 1HD2 LEU 84 -9.282 10.837 -1.323 665 HD23 LEU 84 2HD2 LEU 84 -9.140 9.657 -0.019 666 H LEU 85 H LEU 85 -5.684 9.351 3.413 667 HA LEU 85 HA LEU 85 -4.076 6.905 2.999 668 HB2 LEU 85 2HB LEU 85 -2.548 8.213 4.052 669 HB3 LEU 85 1HB LEU 85 -3.757 9.488 4.145 670 HG LEU 85 HG LEU 85 -4.609 8.279 6.252 671 HD11 LEU 85 1HD1 LEU 85 -3.468 6.502 7.081 672 HD12 LEU 85 2HD1 LEU 85 -1.902 7.237 6.731 673 HD13 LEU 85 3HD1 LEU 85 -2.775 6.374 5.464 674 HD21 LEU 85 3HD2 LEU 85 -2.446 9.184 7.526 675 HD22 LEU 85 1HD2 LEU 85 -3.577 10.291 6.750 676 HD23 LEU 85 2HD2 LEU 85 -2.078 9.844 5.932 677 H ASP 86 H ASP 86 -6.551 8.214 5.176 678 HA ASP 86 HA ASP 86 -6.568 6.152 7.148 679 HB2 ASP 86 2HB ASP 86 -7.771 8.189 7.508 680 HB3 ASP 86 1HB ASP 86 -8.644 8.024 5.983 681 H LYS 87 H LYS 87 -8.447 6.474 4.109 682 HA LYS 87 HA LYS 87 -9.713 3.881 4.361 683 HB2 LYS 87 2HB LYS 87 -9.158 5.741 2.017 684 HB3 LYS 87 1HB LYS 87 -10.210 4.328 1.925 685 HG2 LYS 87 2HG LYS 87 -10.589 6.785 3.654 686 HG3 LYS 87 1HG LYS 87 -11.623 6.238 2.335 687 HD2 LYS 87 2HD LYS 87 -12.014 4.111 3.666 688 HD3 LYS 87 1HD LYS 87 -11.204 4.903 5.019 689 HE2 LYS 87 2HE LYS 87 -12.897 6.837 4.651 690 HE3 LYS 87 1HE LYS 87 -13.819 5.651 3.705 691 HZ1 LYS 87 3HZ LYS 87 -14.588 5.180 5.793 692 HZ2 LYS 87 1HZ LYS 87 -13.141 5.625 6.559 693 HZ3 LYS 87 2HZ LYS 87 -13.248 4.137 5.746 694 H ILE 88 H ILE 88 -6.702 5.105 3.044 695 HA ILE 88 HA ILE 88 -5.940 2.729 1.596 696 HB ILE 88 HB ILE 88 -4.899 5.338 2.391 697 HG12 ILE 88 2HG1 ILE 88 -3.773 3.726 0.174 698 HG13 ILE 88 1HG1 ILE 88 -5.477 4.181 0.100 699 HG21 ILE 88 1HG2 ILE 88 -3.283 3.731 3.619 700 HG22 ILE 88 2HG2 ILE 88 -2.581 4.927 2.539 701 HG23 ILE 88 3HG2 ILE 88 -2.754 3.260 2.005 702 HD11 ILE 88 3HD1 ILE 88 -3.988 6.460 0.971 703 HD12 ILE 88 1HD1 ILE 88 -4.905 6.262 -0.524 704 HD13 ILE 88 2HD1 ILE 88 -3.202 5.809 -0.471 705 H PHE 89 H PHE 89 -5.172 3.997 4.832 706 HA PHE 89 HA PHE 89 -3.683 1.716 5.728 707 HB2 PHE 89 2HB PHE 89 -3.837 4.125 6.642 708 HB3 PHE 89 1HB PHE 89 -5.322 3.597 7.430 709 HD1 PHE 89 1HD PHE 89 -1.836 2.288 6.915 710 HD2 PHE 89 2HD PHE 89 -5.108 2.883 9.632 711 HE1 PHE 89 1HE PHE 89 -0.508 1.258 8.739 712 HE2 PHE 89 2HE PHE 89 -3.781 1.854 11.457 713 HZ PHE 89 HZ PHE 89 -1.481 1.041 11.010 714 H ALA 90 H ALA 90 -7.017 2.332 5.322 715 HA ALA 90 HA ALA 90 -7.977 0.278 7.176 716 HB1 ALA 90 1HB ALA 90 -9.419 2.145 6.699 717 HB2 ALA 90 2HB ALA 90 -10.129 0.775 5.844 718 HB3 ALA 90 3HB ALA 90 -9.178 1.969 4.961 719 H GLY 91 H GLY 91 -7.098 0.607 3.801 720 HA2 GLY 91 2HA GLY 91 -8.137 -1.972 2.963 721 HA3 GLY 91 1HA GLY 91 -6.976 -0.981 2.068 722 H VAL 92 H VAL 92 -4.987 -0.678 3.981 723 HA VAL 92 HA VAL 92 -3.517 -3.143 3.765 724 HB VAL 92 HB VAL 92 -3.275 -0.522 5.238 725 HG11 VAL 92 1HG1 VAL 92 -0.896 -1.407 5.810 726 HG12 VAL 92 2HG1 VAL 92 -1.606 -3.008 5.603 727 HG13 VAL 92 3HG1 VAL 92 -2.239 -1.914 6.835 728 HG21 VAL 92 3HG2 VAL 92 -2.514 -1.530 2.703 729 HG22 VAL 92 1HG2 VAL 92 -1.025 -1.343 3.629 730 HG23 VAL 92 2HG2 VAL 92 -2.099 0.036 3.400 731 H ASP 93 H ASP 93 -5.844 -1.895 6.007 732 HA ASP 93 HA ASP 93 -5.130 -3.560 8.290 733 HB2 ASP 93 2HB ASP 93 -6.773 -1.372 7.706 734 HB3 ASP 93 1HB ASP 93 -7.911 -2.675 8.054 735 H MET 94 H MET 94 -7.494 -3.737 5.635 736 HA MET 94 HA MET 94 -8.576 -6.307 6.519 737 HB2 MET 94 2HB MET 94 -8.753 -4.737 3.921 738 HB3 MET 94 1HB MET 94 -9.766 -6.121 4.333 739 HG2 MET 94 2HG MET 94 -10.182 -4.643 6.536 740 HG3 MET 94 1HG MET 94 -9.832 -3.341 5.401 741 HE1 MET 94 3HE MET 94 -11.648 -4.269 2.427 742 HE2 MET 94 1HE MET 94 -10.508 -3.220 3.283 743 HE3 MET 94 2HE MET 94 -12.214 -2.786 3.191 744 H ILE 95 H ILE 95 -6.171 -5.123 4.234 745 HA ILE 95 HA ILE 95 -5.639 -7.574 2.849 746 HB ILE 95 HB ILE 95 -4.430 -4.902 3.311 747 HG12 ILE 95 2HG1 ILE 95 -4.293 -6.492 0.772 748 HG13 ILE 95 1HG1 ILE 95 -5.859 -5.899 1.326 749 HG21 ILE 95 1HG2 ILE 95 -2.371 -5.941 1.924 750 HG22 ILE 95 2HG2 ILE 95 -2.766 -7.336 2.927 751 HG23 ILE 95 3HG2 ILE 95 -2.354 -5.796 3.681 752 HD11 ILE 95 3HD1 ILE 95 -4.659 -4.319 -0.228 753 HD12 ILE 95 1HD1 ILE 95 -3.412 -4.139 1.006 754 HD13 ILE 95 2HD1 ILE 95 -5.063 -3.615 1.338 755 H THR 96 H THR 96 -4.476 -6.206 5.906 756 HA THR 96 HA THR 96 -2.483 -8.262 6.405 757 HB THR 96 HB THR 96 -3.933 -6.151 8.015 758 HG1 THR 96 1HG THR 96 -1.705 -5.417 8.139 759 HG21 THR 96 3HG2 THR 96 -3.487 -8.139 9.461 760 HG22 THR 96 1HG2 THR 96 -2.556 -6.721 9.940 761 HG23 THR 96 2HG2 THR 96 -1.780 -8.022 9.039 762 H ARG 97 H ARG 97 -5.838 -7.667 7.493 763 HA ARG 97 HA ARG 97 -6.107 -9.986 9.131 764 HB2 ARG 97 2HB ARG 97 -7.964 -8.225 7.528 765 HB3 ARG 97 1HB ARG 97 -8.595 -9.614 8.415 766 HG2 ARG 97 2HG ARG 97 -8.093 -8.704 10.483 767 HG3 ARG 97 1HG ARG 97 -6.757 -7.740 9.850 768 HD2 ARG 97 2HD ARG 97 -8.134 -5.954 9.668 769 HD3 ARG 97 1HD ARG 97 -9.193 -6.876 8.581 770 HE ARG 97 HE ARG 97 -9.578 -6.541 11.473 771 HH11 ARG 97 1HH2 ARG 97 -11.174 -7.138 8.662 772 HH12 ARG 97 2HH2 ARG 97 -12.191 -8.405 9.263 773 HH21 ARG 97 1HH1 ARG 97 -10.467 -8.729 12.257 774 HH22 ARG 97 2HH1 ARG 97 -11.787 -9.309 11.297 775 H MET 98 H MET 98 -6.306 -9.501 5.643 776 HA MET 98 HA MET 98 -7.413 -12.102 4.995 777 HB2 MET 98 2HB MET 98 -5.860 -9.945 3.539 778 HB3 MET 98 1HB MET 98 -6.359 -11.430 2.728 779 HG2 MET 98 2HG MET 98 -8.614 -10.907 2.856 780 HG3 MET 98 1HG MET 98 -8.400 -9.891 4.281 781 HE1 MET 98 3HE MET 98 -9.256 -8.480 0.317 782 HE2 MET 98 1HE MET 98 -9.798 -9.810 1.352 783 HE3 MET 98 2HE MET 98 -8.383 -10.010 0.320 784 H VAL 99 H VAL 99 -4.188 -10.713 5.357 785 HA VAL 99 HA VAL 99 -2.682 -13.011 4.490 786 HB VAL 99 HB VAL 99 -2.221 -10.527 6.134 787 HG11 VAL 99 1HG1 VAL 99 -0.485 -12.946 5.928 788 HG12 VAL 99 2HG1 VAL 99 -0.621 -11.773 7.237 789 HG13 VAL 99 3HG1 VAL 99 0.304 -11.375 5.789 790 HG21 VAL 99 3HG2 VAL 99 -2.325 -10.892 3.472 791 HG22 VAL 99 1HG2 VAL 99 -0.628 -11.297 3.734 792 HG23 VAL 99 2HG2 VAL 99 -1.242 -9.715 4.215 793 H ASP 100 H ASP 100 -4.106 -12.000 7.568 794 HA ASP 100 HA ASP 100 -2.762 -13.942 9.227 795 HB2 ASP 100 2HB ASP 100 -3.906 -11.872 10.012 796 HB3 ASP 100 1HB ASP 100 -5.453 -12.562 9.518 797 H LYS 101 H LYS 101 -5.752 -13.952 7.333 798 HA LYS 101 HA LYS 101 -6.448 -16.660 8.227 799 HB2 LYS 101 2HB LYS 101 -8.484 -15.932 7.629 800 HB3 LYS 101 1HB LYS 101 -7.750 -14.389 7.220 801 HG2 LYS 101 2HG LYS 101 -7.183 -15.902 4.986 802 HG3 LYS 101 1HG LYS 101 -8.768 -16.500 5.458 803 HD2 LYS 101 2HD LYS 101 -8.764 -13.695 5.787 804 HD3 LYS 101 1HD LYS 101 -8.084 -14.048 4.197 805 HE2 LYS 101 2HE LYS 101 -10.487 -13.957 3.901 806 HE3 LYS 101 1HE LYS 101 -10.039 -15.671 3.878 807 HZ1 LYS 101 3HZ LYS 101 -10.560 -14.432 6.475 808 HZ2 LYS 101 1HZ LYS 101 -10.843 -16.023 5.959 809 HZ3 LYS 101 2HZ LYS 101 -11.902 -14.780 5.492 810 H ILE 102 H ILE 102 -5.069 -14.988 5.464 811 HA ILE 102 HA ILE 102 -4.974 -17.197 3.643 812 HB ILE 102 HB ILE 102 -3.613 -14.559 4.063 813 HG12 ILE 102 2HG1 ILE 102 -4.999 -15.840 1.687 814 HG13 ILE 102 1HG1 ILE 102 -5.759 -14.741 2.841 815 HG21 ILE 102 1HG2 ILE 102 -2.659 -16.646 2.080 816 HG22 ILE 102 2HG2 ILE 102 -1.741 -16.023 3.452 817 HG23 ILE 102 3HG2 ILE 102 -2.145 -14.959 2.105 818 HD11 ILE 102 3HD1 ILE 102 -4.285 -14.059 0.511 819 HD12 ILE 102 1HD1 ILE 102 -3.318 -13.559 1.898 820 HD13 ILE 102 2HD1 ILE 102 -4.967 -12.966 1.715 821 H VAL 103 H VAL 103 -2.946 -15.981 6.212 822 HA VAL 103 HA VAL 103 -0.769 -17.880 5.881 823 HB VAL 103 HB VAL 103 -1.774 -15.967 7.993 824 HG11 VAL 103 1HG1 VAL 103 0.327 -16.486 9.263 825 HG12 VAL 103 2HG1 VAL 103 0.594 -17.856 8.184 826 HG13 VAL 103 3HG1 VAL 103 -0.818 -17.828 9.241 827 HG21 VAL 103 3HG2 VAL 103 -0.495 -15.312 5.831 828 HG22 VAL 103 1HG2 VAL 103 0.914 -16.024 6.617 829 HG23 VAL 103 2HG2 VAL 103 0.086 -14.653 7.359 830 H SER 104 H SER 104 -3.831 -17.756 7.587 831 HA SER 104 HA SER 104 -3.349 -20.173 9.160 832 HB2 SER 104 2HB SER 104 -4.773 -18.090 9.701 833 HB3 SER 104 1HB SER 104 -5.968 -18.793 8.611 834 HG SER 104 HG SER 104 -6.202 -19.375 10.872 835 H GLU 105 H GLU 105 -5.000 -19.301 6.227 836 HA GLU 105 HA GLU 105 -5.482 -22.207 5.666 837 HB2 GLU 105 2HB GLU 105 -7.382 -20.007 4.850 838 HB3 GLU 105 1HB GLU 105 -7.707 -21.732 5.018 839 HG2 GLU 105 2HG GLU 105 -7.028 -19.887 7.327 840 HG3 GLU 105 1HG GLU 105 -8.666 -20.372 6.886 841 H GLY 106 H GLY 106 -5.055 -18.924 4.359 842 HA2 GLY 106 2HA GLY 106 -3.492 -18.618 2.465 843 HA3 GLY 106 1HA GLY 106 -4.017 -20.186 1.856 844 H SER 107 H SER 107 -6.477 -18.072 3.144 845 HA SER 107 HA SER 107 -7.287 -17.385 0.320 846 HB2 SER 107 2HB SER 107 -9.634 -17.559 1.402 847 HB3 SER 107 1HB SER 107 -8.781 -19.056 1.035 848 HG SER 107 HG SER 107 -9.227 -19.385 3.093 849 H ASP 108 H ASP 108 -7.515 -15.244 -0.006 850 HA ASP 108 HA ASP 108 -7.428 -13.400 2.318 851 HB2 ASP 108 2HB ASP 108 -6.829 -11.787 0.672 852 HB3 ASP 108 1HB ASP 108 -6.088 -13.277 0.090 853 H ASP 109 H ASP 109 -9.783 -15.160 1.046 854 HA ASP 109 HA ASP 109 -11.799 -13.228 0.267 855 HB2 ASP 109 2HB ASP 109 -11.440 -16.081 0.595 856 HB3 ASP 109 1HB ASP 109 -13.010 -15.585 1.228 857 H ILE 110 H ILE 110 -11.246 -11.803 2.340 858 HA ILE 110 HA ILE 110 -12.677 -12.778 4.761 859 HB ILE 110 HB ILE 110 -11.711 -10.746 5.779 860 HG12 ILE 110 2HG1 ILE 110 -10.306 -10.177 3.180 861 HG13 ILE 110 1HG1 ILE 110 -11.908 -9.507 3.493 862 HG21 ILE 110 1HG2 ILE 110 -10.329 -12.785 5.665 863 HG22 ILE 110 2HG2 ILE 110 -9.336 -11.335 5.550 864 HG23 ILE 110 3HG2 ILE 110 -9.697 -12.269 4.101 865 HD11 ILE 110 3HD1 ILE 110 -11.108 -8.005 4.986 866 HD12 ILE 110 1HD1 ILE 110 -9.517 -8.378 4.320 867 HD13 ILE 110 2HD1 ILE 110 -10.085 -9.209 5.767 868 H GLY 111 H GLY 111 -14.059 -11.993 2.179 869 HA2 GLY 111 2HA GLY 111 -16.106 -10.928 1.695 870 HA3 GLY 111 1HA GLY 111 -16.177 -10.414 3.382 871 H GLU 112 H GLU 112 -13.207 -9.630 1.993 872 HA GLU 112 HA GLU 112 -13.381 -6.855 2.328 873 HB2 GLU 112 2HB GLU 112 -11.699 -8.830 0.945 874 HB3 GLU 112 1HB GLU 112 -11.625 -7.223 0.225 875 HG2 GLU 112 2HG GLU 112 -11.563 -6.981 3.092 876 HG3 GLU 112 1HG GLU 112 -10.321 -8.121 2.573 877 H ASN 113 H ASN 113 -14.014 -5.147 1.007 878 HA ASN 113 HA ASN 113 -15.493 -5.849 -1.505 879 HB2 ASN 113 2HB ASN 113 -16.109 -4.348 0.829 880 HB3 ASN 113 1HB ASN 113 -15.960 -3.191 -0.493 881 HD21 ASN 113 1HD2 ASN 113 -18.190 -5.187 1.014 882 HD22 ASN 113 2HD2 ASN 113 -19.283 -5.386 -0.270 883 H ILE 114 H ILE 114 -13.235 -5.836 -2.517 884 HA ILE 114 HA ILE 114 -11.616 -3.490 -2.581 885 HB ILE 114 HB ILE 114 -11.950 -5.548 -4.773 886 HG12 ILE 114 2HG1 ILE 114 -11.755 -6.956 -2.916 887 HG13 ILE 114 1HG1 ILE 114 -10.065 -6.698 -3.344 888 HG21 ILE 114 1HG2 ILE 114 -9.300 -4.597 -3.859 889 HG22 ILE 114 2HG2 ILE 114 -10.312 -3.385 -4.648 890 HG23 ILE 114 3HG2 ILE 114 -9.897 -4.876 -5.496 891 HD11 ILE 114 3HD1 ILE 114 -10.219 -4.669 -1.701 892 HD12 ILE 114 1HD1 ILE 114 -10.065 -6.293 -1.033 893 HD13 ILE 114 2HD1 ILE 114 -11.642 -5.502 -1.077 894 H ASP 115 H ASP 115 -13.552 -4.680 -5.358 895 HA ASP 115 HA ASP 115 -13.491 -2.417 -6.935 896 HB2 ASP 115 2HB ASP 115 -14.735 -4.758 -7.076 897 HB3 ASP 115 1HB ASP 115 -16.110 -3.805 -6.516 898 H VAL 116 H VAL 116 -15.173 -2.876 -3.967 899 HA VAL 116 HA VAL 116 -16.718 -0.388 -4.214 900 HB VAL 116 HB VAL 116 -16.464 -2.606 -2.191 901 HG11 VAL 116 1HG1 VAL 116 -16.822 -0.579 -0.908 902 HG12 VAL 116 2HG1 VAL 116 -18.352 -1.452 -0.988 903 HG13 VAL 116 3HG1 VAL 116 -18.085 -0.047 -2.020 904 HG21 VAL 116 3HG2 VAL 116 -17.921 -3.421 -3.770 905 HG22 VAL 116 1HG2 VAL 116 -18.367 -1.813 -4.340 906 HG23 VAL 116 2HG2 VAL 116 -19.081 -2.453 -2.861 907 H PHE 117 H PHE 117 -14.331 -1.714 -1.979 908 HA PHE 117 HA PHE 117 -13.928 0.780 -0.568 909 HB2 PHE 117 2HB PHE 117 -13.331 -1.811 -0.112 910 HB3 PHE 117 1HB PHE 117 -11.764 -1.266 -0.709 911 HD1 PHE 117 1HD PHE 117 -14.469 -0.325 1.709 912 HD2 PHE 117 2HD PHE 117 -10.285 -0.172 0.746 913 HE1 PHE 117 1HE PHE 117 -14.000 0.718 3.909 914 HE2 PHE 117 2HE PHE 117 -9.818 0.872 2.946 915 HZ PHE 117 HZ PHE 117 -11.675 1.318 4.527 916 H SER 118 H SER 118 -12.871 -0.359 -3.624 917 HA SER 118 HA SER 118 -10.534 1.417 -3.733 918 HB2 SER 118 2HB SER 118 -10.218 -0.722 -4.757 919 HB3 SER 118 1HB SER 118 -11.805 -0.661 -5.518 920 HG SER 118 HG SER 118 -9.696 -0.076 -6.723 921 H ASP 119 H ASP 119 -13.770 0.992 -4.898 922 HA ASP 119 HA ASP 119 -13.716 3.374 -6.616 923 HB2 ASP 119 2HB ASP 119 -15.055 1.437 -7.252 924 HB3 ASP 119 1HB ASP 119 -15.879 1.459 -5.693 925 H THR 120 H THR 120 -14.681 2.403 -3.458 926 HA THR 120 HA THR 120 -16.239 4.705 -2.725 927 HB THR 120 HB THR 120 -14.744 2.494 -1.339 928 HG1 THR 120 1HG THR 120 -16.893 2.058 -0.639 929 HG21 THR 120 3HG2 THR 120 -14.474 3.769 0.491 930 HG22 THR 120 1HG2 THR 120 -16.229 3.756 0.647 931 HG23 THR 120 2HG2 THR 120 -15.427 5.083 -0.196 932 H ILE 121 H ILE 121 -12.896 3.794 -2.487 933 HA ILE 121 HA ILE 121 -11.963 6.232 -1.210 934 HB ILE 121 HB ILE 121 -11.046 3.630 -2.053 935 HG12 ILE 121 2HG1 ILE 121 -9.970 5.790 -0.238 936 HG13 ILE 121 1HG1 ILE 121 -10.884 4.351 0.213 937 HG21 ILE 121 1HG2 ILE 121 -9.896 4.733 -3.894 938 HG22 ILE 121 2HG2 ILE 121 -8.718 4.229 -2.683 939 HG23 ILE 121 3HG2 ILE 121 -9.205 5.921 -2.788 940 HD11 ILE 121 3HD1 ILE 121 -8.014 4.589 -0.617 941 HD12 ILE 121 1HD1 ILE 121 -8.881 3.095 -0.976 942 HD13 ILE 121 2HD1 ILE 121 -8.722 3.644 0.692 943 H LYS 122 H LYS 122 -12.032 4.934 -4.521 944 HA LYS 122 HA LYS 122 -10.703 7.056 -5.847 945 HB2 LYS 122 2HB LYS 122 -12.245 4.653 -6.361 946 HB3 LYS 122 1HB LYS 122 -12.710 5.930 -7.492 947 HG2 LYS 122 2HG LYS 122 -10.788 5.668 -8.629 948 HG3 LYS 122 1HG LYS 122 -9.876 6.001 -7.158 949 HD2 LYS 122 2HD LYS 122 -11.034 3.313 -7.201 950 HD3 LYS 122 1HD LYS 122 -9.882 3.593 -8.505 951 HE2 LYS 122 2HE LYS 122 -8.559 4.748 -6.394 952 HE3 LYS 122 1HE LYS 122 -9.389 3.395 -5.597 953 HZ1 LYS 122 3HZ LYS 122 -7.855 3.161 -8.130 954 HZ2 LYS 122 1HZ LYS 122 -8.552 1.892 -7.248 955 HZ3 LYS 122 2HZ LYS 122 -7.236 2.752 -6.603 956 H SER 123 H SER 123 -14.056 6.540 -4.866 957 HA SER 123 HA SER 123 -15.008 8.983 -6.157 958 HB2 SER 123 2HB SER 123 -16.047 6.700 -4.598 959 HB3 SER 123 1HB SER 123 -16.951 8.200 -4.433 960 HG SER 123 HG SER 123 -16.862 6.467 -6.499 961 H PHE 124 H PHE 124 -13.466 8.140 -3.266 962 HA PHE 124 HA PHE 124 -14.586 10.255 -1.579 963 HB2 PHE 124 2HB PHE 124 -13.315 7.917 -1.140 964 HB3 PHE 124 1HB PHE 124 -11.935 9.010 -1.051 965 HD1 PHE 124 2HD PHE 124 -11.897 10.857 0.621 966 HD2 PHE 124 1HD PHE 124 -15.032 7.920 0.553 967 HE1 PHE 124 2HE PHE 124 -12.579 11.531 2.908 968 HE2 PHE 124 1HE PHE 124 -15.714 8.595 2.840 969 HZ PHE 124 HZ PHE 124 -14.488 10.400 4.017 970 H ALA 125 H ALA 125 -12.668 10.347 -4.234 971 HA ALA 125 HA ALA 125 -10.954 12.592 -3.231 972 HB1 ALA 125 1HB ALA 125 -10.395 11.659 -5.914 973 HB2 ALA 125 2HB ALA 125 -10.502 10.291 -4.806 974 HB3 ALA 125 3HB ALA 125 -9.361 11.597 -4.487 975 H SER 126 H SER 126 -13.361 11.695 -5.661 976 HA SER 126 HA SER 126 -13.297 13.823 -7.449 977 HB2 SER 126 2HB SER 126 -15.895 12.913 -6.250 978 HB3 SER 126 1HB SER 126 -15.486 13.171 -7.943 979 HG SER 126 HG SER 126 -15.121 11.105 -7.962 980 H SER 127 H SER 127 -12.881 15.916 -6.733 981 HA SER 127 HA SER 127 -14.414 16.992 -4.420 982 HB2 SER 127 2HB SER 127 -12.050 17.926 -6.065 983 HB3 SER 127 1HB SER 127 -12.778 18.909 -4.798 984 HG SER 127 HG SER 127 -10.986 17.575 -4.108 985 H GLY 128 H GLY 128 -16.334 17.982 -4.918 986 HA2 GLY 128 2HA GLY 128 -16.525 19.386 -7.553 987 HA3 GLY 128 1HA GLY 128 -17.901 18.609 -6.768 988 H LYS 129 H LYS 129 -18.979 19.706 -5.102 989 HA LYS 129 HA LYS 129 -18.041 22.514 -4.601 990 HB2 LYS 129 2HB LYS 129 -20.895 21.514 -4.560 991 HB3 LYS 129 1HB LYS 129 -20.326 23.175 -4.732 992 HG2 LYS 129 2HG LYS 129 -19.225 22.455 -6.908 993 HG3 LYS 129 1HG LYS 129 -20.107 20.936 -6.757 994 HD2 LYS 129 2HD LYS 129 -22.162 21.926 -7.139 995 HD3 LYS 129 1HD LYS 129 -21.647 23.487 -6.498 996 HE2 LYS 129 2HE LYS 129 -19.973 23.244 -8.651 997 HE3 LYS 129 1HE LYS 129 -21.432 22.433 -9.253 998 HZ1 LYS 129 3HZ LYS 129 -21.234 25.145 -8.067 999 HZ2 LYS 129 1HZ LYS 129 -22.710 24.349 -8.317 1000 HZ3 LYS 129 2HZ LYS 129 -21.723 24.742 -9.642 1001 H GLU 130 H GLU 130 -18.642 23.379 -2.465 1002 HA GLU 130 HA GLU 130 -18.068 21.641 -0.286 1003 HB2 GLU 130 2HB GLU 130 -18.441 23.582 1.019 1004 HB3 GLU 130 1HB GLU 130 -17.956 24.216 -0.553 1005 HG2 GLU 130 2HG GLU 130 -20.812 23.905 0.430 1006 HG3 GLU 130 1HG GLU 130 -19.926 25.424 0.296 1007 H LYS 131 H LYS 131 -19.333 20.191 0.747 1008 HA LYS 131 HA LYS 131 -21.269 18.861 1.132 1009 HB2 LYS 131 2HB LYS 131 -22.690 20.084 2.634 1010 HB3 LYS 131 1HB LYS 131 -21.071 20.760 2.803 1011 HG2 LYS 131 2HG LYS 131 -21.661 22.764 1.866 1012 HG3 LYS 131 1HG LYS 131 -22.808 22.030 0.749 1013 HD2 LYS 131 2HD LYS 131 -23.916 23.416 2.507 1014 HD3 LYS 131 1HD LYS 131 -24.435 21.731 2.525 1015 HE2 LYS 131 2HE LYS 131 -22.336 21.569 4.237 1016 HE3 LYS 131 1HE LYS 131 -22.861 23.236 4.547 1017 HZ1 LYS 131 3HZ LYS 131 -25.205 22.213 4.500 1018 HZ2 LYS 131 1HZ LYS 131 -24.266 22.003 5.896 1019 HZ3 LYS 131 2HZ LYS 131 -24.414 20.736 4.774 1020 H LEU 132 H LEU 132 -21.162 19.746 -1.653 1021 HA LEU 132 HA LEU 132 -22.631 19.710 -3.509 1022 HB2 LEU 132 2HB LEU 132 -23.789 18.260 -1.441 1023 HB3 LEU 132 1HB LEU 132 -25.062 19.391 -1.901 1024 HG LEU 132 HG LEU 132 -23.854 18.405 -4.295 1025 HD11 LEU 132 1HD1 LEU 132 -23.096 16.405 -3.375 1026 HD12 LEU 132 2HD1 LEU 132 -24.743 15.961 -3.823 1027 HD13 LEU 132 3HD1 LEU 132 -24.363 16.369 -2.149 1028 HD21 LEU 132 3HD2 LEU 132 -26.213 19.243 -3.837 1029 HD22 LEU 132 1HD2 LEU 132 -26.541 17.677 -3.096 1030 HD23 LEU 132 2HD2 LEU 132 -26.117 17.772 -4.806 1031 H GLU 133 H GLU 133 -24.966 20.808 -4.084 1032 HA GLU 133 HA GLU 133 -24.612 23.663 -3.473 1033 HB2 GLU 133 2HB GLU 133 -25.519 22.110 -5.596 1034 HB3 GLU 133 1HB GLU 133 -26.996 22.836 -4.961 1035 HG2 GLU 133 2HG GLU 133 -25.421 25.010 -4.908 1036 HG3 GLU 133 1HG GLU 133 -24.634 24.142 -6.225 Start of MODEL 16 1 H1 MET 1 1HT MET 1 8.008 -29.723 -5.264 2 H2 MET 1 2HT MET 1 7.119 -31.167 -5.349 3 H3 MET 1 3HT MET 1 8.751 -31.198 -4.880 4 HA MET 1 HA MET 1 6.392 -30.346 -3.332 5 HB2 MET 1 2HB MET 1 8.125 -32.527 -3.475 6 HB3 MET 1 1HB MET 1 8.707 -31.620 -2.080 7 HG2 MET 1 2HG MET 1 5.834 -32.480 -2.529 8 HG3 MET 1 1HG MET 1 6.971 -33.256 -1.426 9 HE1 MET 1 2HE MET 1 5.117 -33.147 -0.085 10 HE2 MET 1 3HE MET 1 4.324 -31.747 0.634 11 HE3 MET 1 1HE MET 1 5.801 -32.401 1.357 12 H MET 2 H MET 2 6.801 -28.025 -3.343 13 HA MET 2 HA MET 2 8.875 -27.221 -1.398 14 HB2 MET 2 2HB MET 2 9.446 -27.244 -4.105 15 HB3 MET 2 1HB MET 2 8.937 -25.576 -3.834 16 HG2 MET 2 2HG MET 2 10.783 -25.090 -2.608 17 HG3 MET 2 1HG MET 2 10.712 -26.621 -1.736 18 HE1 MET 2 3HE MET 2 13.250 -25.279 -2.383 19 HE2 MET 2 1HE MET 2 14.311 -26.425 -3.213 20 HE3 MET 2 2HE MET 2 13.397 -26.934 -1.796 21 H GLU 3 H GLU 3 7.192 -26.408 -0.078 22 HA GLU 3 HA GLU 3 5.367 -24.362 -1.254 23 HB2 GLU 3 2HB GLU 3 4.196 -24.694 0.944 24 HB3 GLU 3 1HB GLU 3 4.329 -26.178 -0.007 25 HG2 GLU 3 2HG GLU 3 6.138 -26.979 1.333 26 HG3 GLU 3 1HG GLU 3 6.373 -25.397 2.083 27 H GLU 4 H GLU 4 8.275 -24.533 0.365 28 HA GLU 4 HA GLU 4 7.937 -22.479 2.319 29 HB2 GLU 4 2HB GLU 4 9.766 -24.213 2.163 30 HB3 GLU 4 1HB GLU 4 10.447 -23.287 0.824 31 HG2 GLU 4 2HG GLU 4 11.310 -21.711 2.205 32 HG3 GLU 4 1HG GLU 4 9.851 -21.654 3.193 33 H TYR 5 H TYR 5 7.844 -22.297 -1.011 34 HA TYR 5 HA TYR 5 9.207 -19.780 -1.438 35 HB2 TYR 5 2HB TYR 5 7.886 -21.836 -2.925 36 HB3 TYR 5 1HB TYR 5 7.191 -20.284 -3.392 37 HD1 TYR 5 2HD TYR 5 10.583 -21.670 -2.559 38 HD2 TYR 5 1HD TYR 5 8.231 -19.197 -5.166 39 HE1 TYR 5 2HE TYR 5 12.604 -21.173 -3.910 40 HE2 TYR 5 1HE TYR 5 10.251 -18.699 -6.516 41 HH TYR 5 HH TYR 5 12.829 -20.363 -6.648 42 H LEU 6 H LEU 6 5.993 -20.759 -0.603 43 HA LEU 6 HA LEU 6 4.899 -18.019 -0.857 44 HB2 LEU 6 2HB LEU 6 2.798 -19.108 -0.471 45 HB3 LEU 6 1HB LEU 6 3.729 -20.216 -1.479 46 HG LEU 6 HG LEU 6 4.526 -21.067 0.954 47 HD11 LEU 6 1HD1 LEU 6 2.153 -21.171 2.168 48 HD12 LEU 6 2HD1 LEU 6 1.922 -19.644 1.318 49 HD13 LEU 6 3HD1 LEU 6 3.266 -19.831 2.445 50 HD21 LEU 6 3HD2 LEU 6 2.004 -22.327 0.469 51 HD22 LEU 6 1HD2 LEU 6 3.612 -22.920 0.055 52 HD23 LEU 6 2HD2 LEU 6 2.717 -21.922 -1.092 53 H GLY 7 H GLY 7 6.067 -20.248 1.594 54 HA2 GLY 7 2HA GLY 7 4.917 -18.957 3.884 55 HA3 GLY 7 1HA GLY 7 6.359 -19.975 3.910 56 H VAL 8 H VAL 8 7.917 -18.421 2.066 57 HA VAL 8 HA VAL 8 8.802 -16.304 3.890 58 HB VAL 8 HB VAL 8 9.772 -17.275 1.190 59 HG11 VAL 8 1HG1 VAL 8 11.842 -16.075 1.719 60 HG12 VAL 8 2HG1 VAL 8 11.157 -15.531 3.250 61 HG13 VAL 8 3HG1 VAL 8 10.481 -14.954 1.727 62 HG21 VAL 8 3HG2 VAL 8 11.216 -17.774 3.759 63 HG22 VAL 8 1HG2 VAL 8 11.118 -18.780 2.314 64 HG23 VAL 8 2HG2 VAL 8 9.765 -18.724 3.442 65 H PHE 9 H PHE 9 7.223 -16.595 0.811 66 HA PHE 9 HA PHE 9 7.397 -13.898 -0.092 67 HB2 PHE 9 2HB PHE 9 5.977 -16.343 -0.687 68 HB3 PHE 9 1HB PHE 9 4.866 -14.977 -0.788 69 HD1 PHE 9 1HD PHE 9 6.516 -12.771 -1.696 70 HD2 PHE 9 2HD PHE 9 6.623 -16.903 -2.871 71 HE1 PHE 9 1HE PHE 9 7.504 -12.126 -3.879 72 HE2 PHE 9 2HE PHE 9 7.610 -16.257 -5.054 73 HZ PHE 9 HZ PHE 9 8.049 -13.869 -5.557 74 H VAL 10 H VAL 10 5.490 -15.420 2.405 75 HA VAL 10 HA VAL 10 3.612 -13.172 2.691 76 HB VAL 10 HB VAL 10 4.204 -15.758 4.143 77 HG11 VAL 10 1HG1 VAL 10 2.293 -13.539 4.914 78 HG12 VAL 10 2HG1 VAL 10 3.574 -14.243 5.901 79 HG13 VAL 10 3HG1 VAL 10 2.140 -15.192 5.510 80 HG21 VAL 10 3HG2 VAL 10 1.599 -14.853 2.926 81 HG22 VAL 10 1HG2 VAL 10 2.171 -16.497 3.209 82 HG23 VAL 10 2HG2 VAL 10 2.873 -15.530 1.911 83 H ASP 11 H ASP 11 6.270 -14.601 4.639 84 HA ASP 11 HA ASP 11 6.308 -12.723 6.735 85 HB2 ASP 11 2HB ASP 11 7.840 -14.875 5.781 86 HB3 ASP 11 1HB ASP 11 8.965 -13.518 5.863 87 H GLU 12 H GLU 12 7.196 -12.403 3.453 88 HA GLU 12 HA GLU 12 8.841 -9.990 3.801 89 HB2 GLU 12 2HB GLU 12 7.654 -11.447 1.415 90 HB3 GLU 12 1HB GLU 12 8.741 -10.063 1.281 91 HG2 GLU 12 2HG GLU 12 9.772 -12.111 3.092 92 HG3 GLU 12 1HG GLU 12 9.522 -12.724 1.458 93 H THR 13 H THR 13 5.557 -10.818 2.697 94 HA THR 13 HA THR 13 4.767 -8.158 1.950 95 HB THR 13 HB THR 13 2.538 -9.160 1.956 96 HG1 THR 13 1HG THR 13 3.810 -11.158 3.512 97 HG21 THR 13 3HG2 THR 13 3.328 -10.145 0.086 98 HG22 THR 13 1HG2 THR 13 3.512 -11.601 1.062 99 HG23 THR 13 2HG2 THR 13 4.879 -10.509 0.843 100 H LYS 14 H LYS 14 4.687 -9.948 5.012 101 HA LYS 14 HA LYS 14 3.125 -7.978 6.460 102 HB2 LYS 14 2HB LYS 14 4.836 -10.375 7.063 103 HB3 LYS 14 1HB LYS 14 4.354 -9.324 8.394 104 HG2 LYS 14 2HG LYS 14 2.356 -10.351 8.433 105 HG3 LYS 14 1HG LYS 14 2.040 -9.732 6.811 106 HD2 LYS 14 2HD LYS 14 2.299 -11.780 5.911 107 HD3 LYS 14 1HD LYS 14 3.865 -11.978 6.700 108 HE2 LYS 14 2HE LYS 14 1.239 -12.365 8.173 109 HE3 LYS 14 1HE LYS 14 2.118 -13.696 7.394 110 HZ1 LYS 14 3HZ LYS 14 3.197 -11.836 9.446 111 HZ2 LYS 14 1HZ LYS 14 4.109 -13.014 8.637 112 HZ3 LYS 14 2HZ LYS 14 2.846 -13.482 9.672 113 H GLU 15 H GLU 15 6.598 -8.585 5.999 114 HA GLU 15 HA GLU 15 7.415 -6.460 7.810 115 HB2 GLU 15 2HB GLU 15 8.835 -8.022 5.633 116 HB3 GLU 15 1HB GLU 15 9.650 -6.963 6.785 117 HG2 GLU 15 2HG GLU 15 7.845 -8.880 8.074 118 HG3 GLU 15 1HG GLU 15 9.147 -9.657 7.170 119 H TYR 16 H TYR 16 6.232 -6.587 4.647 120 HA TYR 16 HA TYR 16 7.545 -4.103 3.744 121 HB2 TYR 16 2HB TYR 16 5.836 -6.278 2.603 122 HB3 TYR 16 1HB TYR 16 5.817 -4.712 1.789 123 HD1 TYR 16 1HD TYR 16 8.550 -3.739 2.191 124 HD2 TYR 16 2HD TYR 16 7.153 -7.691 1.260 125 HE1 TYR 16 1HE TYR 16 10.731 -4.258 1.128 126 HE2 TYR 16 2HE TYR 16 9.334 -8.212 0.198 127 HH TYR 16 HH TYR 16 12.083 -6.237 0.581 128 H LEU 17 H LEU 17 4.231 -5.270 4.484 129 HA LEU 17 HA LEU 17 2.903 -2.797 3.974 130 HB2 LEU 17 2HB LEU 17 1.070 -3.850 5.051 131 HB3 LEU 17 1HB LEU 17 2.014 -5.196 4.421 132 HG LEU 17 HG LEU 17 3.195 -5.146 6.746 133 HD11 LEU 17 1HD1 LEU 17 0.975 -4.422 8.261 134 HD12 LEU 17 2HD1 LEU 17 1.074 -3.155 7.040 135 HD13 LEU 17 3HD1 LEU 17 2.455 -3.479 8.087 136 HD21 LEU 17 3HD2 LEU 17 1.859 -6.920 7.326 137 HD22 LEU 17 1HD2 LEU 17 1.246 -6.690 5.690 138 HD23 LEU 17 2HD2 LEU 17 0.369 -6.016 7.062 139 H GLN 18 H GLN 18 4.646 -4.004 6.800 140 HA GLN 18 HA GLN 18 3.923 -1.774 8.508 141 HB2 GLN 18 2HB GLN 18 4.629 -3.370 9.916 142 HB3 GLN 18 1HB GLN 18 5.301 -4.283 8.573 143 HG2 GLN 18 2HG GLN 18 7.116 -3.811 10.066 144 HG3 GLN 18 1HG GLN 18 7.303 -2.754 8.668 145 HE21 GLN 18 1HE2 GLN 18 5.336 -2.553 11.700 146 HE22 GLN 18 2HE2 GLN 18 5.842 -0.980 12.091 147 H ASN 19 H ASN 19 6.635 -2.720 6.531 148 HA ASN 19 HA ASN 19 8.234 -0.366 7.006 149 HB2 ASN 19 2HB ASN 19 9.337 -2.270 6.091 150 HB3 ASN 19 1HB ASN 19 8.057 -2.534 4.904 151 HD21 ASN 19 1HD2 ASN 19 11.182 -1.346 5.201 152 HD22 ASN 19 2HD2 ASN 19 11.210 -0.328 3.842 153 H LEU 20 H LEU 20 5.465 -1.172 5.192 154 HA LEU 20 HA LEU 20 5.582 1.247 3.502 155 HB2 LEU 20 2HB LEU 20 4.786 -0.729 2.414 156 HB3 LEU 20 1HB LEU 20 3.758 -1.148 3.784 157 HG LEU 20 HG LEU 20 2.395 0.887 3.348 158 HD11 LEU 20 1HD1 LEU 20 4.347 1.139 1.054 159 HD12 LEU 20 2HD1 LEU 20 3.936 2.348 2.271 160 HD13 LEU 20 3HD1 LEU 20 2.765 1.917 1.025 161 HD21 LEU 20 3HD2 LEU 20 1.134 -0.109 1.651 162 HD22 LEU 20 1HD2 LEU 20 2.090 -1.476 2.223 163 HD23 LEU 20 2HD2 LEU 20 2.563 -0.623 0.753 164 H ASN 21 H ASN 21 4.589 0.342 6.594 165 HA ASN 21 HA ASN 21 2.393 2.311 6.744 166 HB2 ASN 21 2HB ASN 21 3.348 -0.056 8.197 167 HB3 ASN 21 1HB ASN 21 2.933 1.287 9.268 168 HD21 ASN 21 1HD2 ASN 21 1.312 -1.015 9.331 169 HD22 ASN 21 2HD2 ASN 21 -0.194 -0.667 8.631 170 H ASP 22 H ASP 22 5.686 1.696 7.450 171 HA ASP 22 HA ASP 22 6.084 3.864 9.254 172 HB2 ASP 22 2HB ASP 22 7.523 1.807 9.034 173 HB3 ASP 22 1HB ASP 22 8.080 2.452 7.490 174 H THR 23 H THR 23 6.255 3.300 5.914 175 HA THR 23 HA THR 23 7.301 5.903 5.088 176 HB THR 23 HB THR 23 5.704 3.727 3.750 177 HG1 THR 23 1HG THR 23 8.515 4.129 3.796 178 HG21 THR 23 3HG2 THR 23 7.224 6.105 2.721 179 HG22 THR 23 1HG2 THR 23 5.638 5.505 2.238 180 HG23 THR 23 2HG2 THR 23 7.096 4.656 1.722 181 H LEU 24 H LEU 24 4.168 4.287 5.369 182 HA LEU 24 HA LEU 24 2.632 6.511 4.268 183 HB2 LEU 24 2HB LEU 24 2.173 3.800 5.442 184 HB3 LEU 24 1HB LEU 24 0.811 4.917 5.412 185 HG LEU 24 HG LEU 24 2.501 4.256 2.986 186 HD11 LEU 24 1HD1 LEU 24 0.736 2.778 2.288 187 HD12 LEU 24 2HD1 LEU 24 -0.289 3.270 3.637 188 HD13 LEU 24 3HD1 LEU 24 1.163 2.315 3.935 189 HD21 LEU 24 3HD2 LEU 24 -0.125 5.162 2.373 190 HD22 LEU 24 1HD2 LEU 24 1.398 6.000 2.074 191 HD23 LEU 24 2HD2 LEU 24 0.527 6.264 3.585 192 H LEU 25 H LEU 25 3.633 5.379 7.475 193 HA LEU 25 HA LEU 25 1.739 7.249 8.748 194 HB2 LEU 25 2HB LEU 25 2.576 6.405 10.801 195 HB3 LEU 25 1HB LEU 25 2.493 5.045 9.689 196 HG LEU 25 HG LEU 25 4.903 5.663 9.103 197 HD11 LEU 25 1HD1 LEU 25 4.335 7.388 11.446 198 HD12 LEU 25 2HD1 LEU 25 5.511 7.608 10.150 199 HD13 LEU 25 3HD1 LEU 25 5.870 6.521 11.492 200 HD21 LEU 25 3HD2 LEU 25 5.675 4.369 11.192 201 HD22 LEU 25 1HD2 LEU 25 4.428 3.600 10.209 202 HD23 LEU 25 2HD2 LEU 25 3.987 4.426 11.704 203 H GLU 26 H GLU 26 4.808 7.348 7.451 204 HA GLU 26 HA GLU 26 5.585 9.826 8.876 205 HB2 GLU 26 2HB GLU 26 6.885 7.890 6.945 206 HB3 GLU 26 1HB GLU 26 7.608 9.468 7.260 207 HG2 GLU 26 2HG GLU 26 7.440 8.872 9.750 208 HG3 GLU 26 1HG GLU 26 7.123 7.220 9.217 209 H LEU 27 H LEU 27 4.205 8.531 6.054 210 HA LEU 27 HA LEU 27 4.537 10.739 4.313 211 HB2 LEU 27 2HB LEU 27 3.992 8.532 3.483 212 HB3 LEU 27 1HB LEU 27 2.553 8.466 4.499 213 HG LEU 27 HG LEU 27 1.658 10.443 3.242 214 HD11 LEU 27 1HD1 LEU 27 4.070 11.030 2.447 215 HD12 LEU 27 2HD1 LEU 27 2.735 11.272 1.321 216 HD13 LEU 27 3HD1 LEU 27 3.766 9.849 1.174 217 HD21 LEU 27 3HD2 LEU 27 1.245 9.102 1.102 218 HD22 LEU 27 1HD2 LEU 27 0.822 8.291 2.609 219 HD23 LEU 27 2HD2 LEU 27 2.321 7.880 1.776 220 H GLU 28 H GLU 28 2.261 9.875 6.834 221 HA GLU 28 HA GLU 28 0.207 11.804 6.236 222 HB2 GLU 28 2HB GLU 28 1.091 10.705 8.922 223 HB3 GLU 28 1HB GLU 28 -0.529 11.246 8.478 224 HG2 GLU 28 2HG GLU 28 0.170 9.316 6.551 225 HG3 GLU 28 1HG GLU 28 0.688 8.646 8.098 226 H LYS 29 H LYS 29 3.177 11.885 8.194 227 HA LYS 29 HA LYS 29 2.725 14.594 9.144 228 HB2 LYS 29 2HB LYS 29 4.535 14.098 10.459 229 HB3 LYS 29 1HB LYS 29 4.232 12.459 9.898 230 HG2 LYS 29 2HG LYS 29 5.763 13.265 7.863 231 HG3 LYS 29 1HG LYS 29 6.383 14.365 9.096 232 HD2 LYS 29 2HD LYS 29 7.198 12.643 10.416 233 HD3 LYS 29 1HD LYS 29 6.034 11.475 9.784 234 HE2 LYS 29 2HE LYS 29 7.872 10.747 8.595 235 HE3 LYS 29 1HE LYS 29 7.401 12.068 7.506 236 HZ1 LYS 29 3HZ LYS 29 8.729 13.474 9.254 237 HZ2 LYS 29 1HZ LYS 29 9.534 12.693 7.981 238 HZ3 LYS 29 2HZ LYS 29 9.522 11.997 9.531 239 H ASN 30 H ASN 30 4.060 13.042 6.448 240 HA ASN 30 HA ASN 30 4.631 15.649 5.138 241 HB2 ASN 30 2HB ASN 30 6.493 13.359 5.685 242 HB3 ASN 30 1HB ASN 30 6.662 14.192 4.139 243 HD21 ASN 30 1HD2 ASN 30 8.229 14.202 6.902 244 HD22 ASN 30 2HD2 ASN 30 8.498 15.859 7.154 245 HA PRO 31 HA PRO 31 2.157 12.789 2.698 246 HB2 PRO 31 2HB PRO 31 -0.069 14.342 2.645 247 HB3 PRO 31 1HB PRO 31 0.341 13.264 3.987 248 HG2 PRO 31 2HG PRO 31 0.410 16.181 3.869 249 HG3 PRO 31 1HG PRO 31 0.288 15.099 5.262 250 HD2 PRO 31 2HD PRO 31 2.607 16.430 4.267 251 HD3 PRO 31 1HD PRO 31 2.477 15.332 5.659 252 H GLU 32 H GLU 32 3.921 15.350 2.024 253 HA GLU 32 HA GLU 32 2.742 15.711 -0.701 254 HB2 GLU 32 2HB GLU 32 4.408 17.919 0.278 255 HB3 GLU 32 1HB GLU 32 2.793 17.975 -0.427 256 HG2 GLU 32 2HG GLU 32 1.800 17.356 1.724 257 HG3 GLU 32 1HG GLU 32 3.408 17.201 2.438 258 H ASP 33 H ASP 33 5.248 14.571 1.146 259 HA ASP 33 HA ASP 33 7.472 15.266 -0.580 260 HB2 ASP 33 2HB ASP 33 8.643 13.622 0.902 261 HB3 ASP 33 1HB ASP 33 7.750 14.840 1.815 262 H MET 34 H MET 34 8.167 14.068 -2.362 263 HA MET 34 HA MET 34 6.454 11.896 -3.308 264 HB2 MET 34 2HB MET 34 9.077 12.967 -4.389 265 HB3 MET 34 1HB MET 34 7.848 12.079 -5.292 266 HG2 MET 34 2HG MET 34 6.635 14.338 -3.974 267 HG3 MET 34 1HG MET 34 8.016 14.881 -4.925 268 HE1 MET 34 3HE MET 34 4.203 13.374 -5.323 269 HE2 MET 34 1HE MET 34 4.111 14.831 -6.321 270 HE3 MET 34 2HE MET 34 4.835 14.903 -4.716 271 H GLU 35 H GLU 35 8.691 11.821 -0.952 272 HA GLU 35 HA GLU 35 10.141 9.418 -1.885 273 HB2 GLU 35 2HB GLU 35 11.446 9.734 0.114 274 HB3 GLU 35 1HB GLU 35 11.154 11.340 -0.546 275 HG2 GLU 35 2HG GLU 35 9.257 11.625 1.022 276 HG3 GLU 35 1HG GLU 35 9.604 10.036 1.708 277 H LEU 36 H LEU 36 7.862 10.303 0.736 278 HA LEU 36 HA LEU 36 7.468 7.489 1.463 279 HB2 LEU 36 2HB LEU 36 5.894 10.012 2.117 280 HB3 LEU 36 1HB LEU 36 5.751 8.467 2.952 281 HG LEU 36 HG LEU 36 8.091 10.364 2.936 282 HD11 LEU 36 1HD1 LEU 36 6.381 10.733 4.636 283 HD12 LEU 36 2HD1 LEU 36 7.846 10.102 5.388 284 HD13 LEU 36 3HD1 LEU 36 6.465 9.038 5.116 285 HD21 LEU 36 3HD2 LEU 36 8.051 7.499 3.936 286 HD22 LEU 36 1HD2 LEU 36 9.391 8.634 4.096 287 HD23 LEU 36 2HD2 LEU 36 8.914 8.054 2.501 288 H ILE 37 H ILE 37 6.201 9.822 -0.758 289 HA ILE 37 HA ILE 37 3.690 8.433 -1.312 290 HB ILE 37 HB ILE 37 5.318 10.688 -2.489 291 HG12 ILE 37 2HG1 ILE 37 2.597 10.472 -1.171 292 HG13 ILE 37 1HG1 ILE 37 4.045 11.219 -0.496 293 HG21 ILE 37 1HG2 ILE 37 4.299 9.519 -4.388 294 HG22 ILE 37 2HG2 ILE 37 3.476 11.052 -4.106 295 HG23 ILE 37 3HG2 ILE 37 2.732 9.543 -3.580 296 HD11 ILE 37 3HD1 ILE 37 2.270 12.202 -2.712 297 HD12 ILE 37 1HD1 ILE 37 3.963 12.696 -2.665 298 HD13 ILE 37 2HD1 ILE 37 2.893 13.080 -1.316 299 H ASN 38 H ASN 38 7.001 8.518 -2.590 300 HA ASN 38 HA ASN 38 6.257 6.734 -4.826 301 HB2 ASN 38 2HB ASN 38 7.809 8.590 -5.209 302 HB3 ASN 38 1HB ASN 38 8.858 8.002 -3.919 303 HD21 ASN 38 1HD2 ASN 38 7.916 7.518 -7.268 304 HD22 ASN 38 2HD2 ASN 38 9.050 6.302 -7.610 305 H GLU 39 H GLU 39 7.577 6.589 -1.660 306 HA GLU 39 HA GLU 39 8.850 3.983 -1.956 307 HB2 GLU 39 2HB GLU 39 8.112 5.847 0.290 308 HB3 GLU 39 1HB GLU 39 8.674 4.214 0.653 309 HG2 GLU 39 2HG GLU 39 10.735 4.611 -0.608 310 HG3 GLU 39 1HG GLU 39 10.173 6.220 -1.056 311 H ALA 40 H ALA 40 5.752 5.248 -1.232 312 HA ALA 40 HA ALA 40 4.639 2.648 -0.348 313 HB1 ALA 40 1HB ALA 40 4.125 5.029 0.564 314 HB2 ALA 40 2HB ALA 40 2.755 3.960 0.264 315 HB3 ALA 40 3HB ALA 40 3.159 5.225 -0.897 316 H PHE 41 H PHE 41 4.121 5.061 -2.965 317 HA PHE 41 HA PHE 41 2.229 3.775 -4.541 318 HB2 PHE 41 2HB PHE 41 3.068 5.915 -5.158 319 HB3 PHE 41 1HB PHE 41 4.737 5.348 -5.155 320 HD1 PHE 41 2HD PHE 41 5.385 3.540 -6.892 321 HD2 PHE 41 1HD PHE 41 1.821 5.924 -7.153 322 HE1 PHE 41 2HE PHE 41 5.216 3.023 -9.311 323 HE2 PHE 41 1HE PHE 41 1.656 5.407 -9.572 324 HZ PHE 41 HZ PHE 41 3.352 3.958 -10.652 325 H ARG 42 H ARG 42 5.703 3.033 -4.281 326 HA ARG 42 HA ARG 42 5.552 0.919 -6.316 327 HB2 ARG 42 2HB ARG 42 7.884 0.901 -6.086 328 HB3 ARG 42 1HB ARG 42 7.487 2.558 -5.641 329 HG2 ARG 42 2HG ARG 42 7.579 1.978 -3.266 330 HG3 ARG 42 1HG ARG 42 7.880 0.285 -3.669 331 HD2 ARG 42 2HD ARG 42 9.971 1.012 -4.875 332 HD3 ARG 42 1HD ARG 42 9.704 2.645 -4.234 333 HE ARG 42 HE ARG 42 9.584 1.361 -1.936 334 HH11 ARG 42 1HH1 ARG 42 10.907 -0.545 -4.334 335 HH12 ARG 42 2HH1 ARG 42 12.430 -0.800 -3.549 336 HH21 ARG 42 1HH2 ARG 42 11.829 1.518 -1.043 337 HH22 ARG 42 2HH2 ARG 42 12.953 0.368 -1.687 338 H ALA 43 H ALA 43 6.031 1.064 -2.772 339 HA ALA 43 HA ALA 43 6.350 -1.635 -2.150 340 HB1 ALA 43 1HB ALA 43 6.419 0.022 -0.435 341 HB2 ALA 43 2HB ALA 43 5.001 -0.956 -0.059 342 HB3 ALA 43 3HB ALA 43 4.809 0.613 -0.840 343 H LEU 44 H LEU 44 3.190 0.043 -2.366 344 HA LEU 44 HA LEU 44 1.642 -2.373 -2.197 345 HB2 LEU 44 2HB LEU 44 0.981 0.323 -3.427 346 HB3 LEU 44 1HB LEU 44 -0.180 -0.864 -2.828 347 HG LEU 44 HG LEU 44 1.963 0.037 -0.956 348 HD11 LEU 44 1HD1 LEU 44 -0.041 1.803 -2.186 349 HD12 LEU 44 2HD1 LEU 44 1.422 2.214 -1.290 350 HD13 LEU 44 3HD1 LEU 44 -0.061 1.814 -0.422 351 HD21 LEU 44 3HD2 LEU 44 -0.334 0.015 0.441 352 HD22 LEU 44 1HD2 LEU 44 0.583 -1.457 0.123 353 HD23 LEU 44 2HD2 LEU 44 -0.812 -1.054 -0.879 354 H HIS 45 H HIS 45 3.034 -0.552 -4.897 355 HA HIS 45 HA HIS 45 1.695 -1.966 -7.023 356 HB2 HIS 45 2HB HIS 45 2.803 0.159 -7.388 357 HB3 HIS 45 1HB HIS 45 4.328 -0.475 -6.768 358 HD1 HIS 45 1HD HIS 45 5.471 -2.409 -8.257 359 HD2 HIS 45 2HD HIS 45 2.394 -0.292 -10.110 360 HE1 HIS 45 1HE HIS 45 5.663 -2.888 -10.738 361 H THR 46 H THR 46 4.639 -2.497 -5.148 362 HA THR 46 HA THR 46 5.446 -4.855 -6.689 363 HB THR 46 HB THR 46 6.483 -3.025 -4.684 364 HG1 THR 46 1HG THR 46 7.590 -4.954 -6.425 365 HG21 THR 46 3HG2 THR 46 6.731 -5.974 -4.104 366 HG22 THR 46 1HG2 THR 46 6.363 -4.661 -2.985 367 HG23 THR 46 2HG2 THR 46 7.997 -4.845 -3.624 368 H LEU 47 H LEU 47 3.737 -4.098 -3.704 369 HA LEU 47 HA LEU 47 3.621 -6.829 -2.711 370 HB2 LEU 47 2HB LEU 47 2.721 -4.110 -2.025 371 HB3 LEU 47 1HB LEU 47 1.607 -5.376 -1.505 372 HG LEU 47 HG LEU 47 4.546 -5.708 -1.014 373 HD11 LEU 47 1HD1 LEU 47 2.963 -3.540 -0.002 374 HD12 LEU 47 2HD1 LEU 47 4.634 -3.950 0.386 375 HD13 LEU 47 3HD1 LEU 47 3.315 -4.648 1.324 376 HD21 LEU 47 3HD2 LEU 47 2.656 -7.453 -0.621 377 HD22 LEU 47 1HD2 LEU 47 2.221 -6.447 0.761 378 HD23 LEU 47 2HD2 LEU 47 3.820 -7.186 0.678 379 H LYS 48 H LYS 48 1.421 -4.691 -4.535 380 HA LYS 48 HA LYS 48 -0.789 -6.572 -4.563 381 HB2 LYS 48 2HB LYS 48 -1.725 -4.960 -6.130 382 HB3 LYS 48 1HB LYS 48 -0.905 -4.083 -4.837 383 HG2 LYS 48 2HG LYS 48 0.267 -3.027 -6.439 384 HG3 LYS 48 1HG LYS 48 1.089 -4.560 -6.734 385 HD2 LYS 48 2HD LYS 48 -0.640 -5.188 -8.366 386 HD3 LYS 48 1HD LYS 48 -1.485 -3.669 -8.062 387 HE2 LYS 48 2HE LYS 48 0.208 -2.379 -9.054 388 HE3 LYS 48 1HE LYS 48 1.409 -3.677 -8.898 389 HZ1 LYS 48 3HZ LYS 48 0.122 -5.018 -10.435 390 HZ2 LYS 48 1HZ LYS 48 0.543 -3.548 -11.167 391 HZ3 LYS 48 2HZ LYS 48 -1.037 -3.785 -10.588 392 H GLY 49 H GLY 49 2.113 -6.126 -6.452 393 HA2 GLY 49 2HA GLY 49 1.180 -7.620 -8.775 394 HA3 GLY 49 1HA GLY 49 2.848 -7.149 -8.452 395 H MET 50 H MET 50 3.310 -8.359 -5.994 396 HA MET 50 HA MET 50 3.667 -11.138 -6.788 397 HB2 MET 50 2HB MET 50 4.750 -11.246 -4.541 398 HB3 MET 50 1HB MET 50 5.332 -9.889 -5.507 399 HG2 MET 50 2HG MET 50 4.657 -8.454 -3.918 400 HG3 MET 50 1HG MET 50 3.004 -9.042 -4.088 401 HE1 MET 50 3HE MET 50 5.073 -7.936 -2.069 402 HE2 MET 50 1HE MET 50 6.070 -9.148 -1.252 403 HE3 MET 50 2HE MET 50 4.576 -8.586 -0.508 404 H ALA 51 H ALA 51 1.121 -9.437 -5.277 405 HA ALA 51 HA ALA 51 0.193 -11.741 -3.662 406 HB1 ALA 51 1HB ALA 51 -0.335 -9.798 -2.545 407 HB2 ALA 51 2HB ALA 51 -1.780 -9.881 -3.553 408 HB3 ALA 51 3HB ALA 51 -0.427 -8.853 -4.031 409 H GLY 52 H GLY 52 -0.364 -10.246 -6.765 410 HA2 GLY 52 2HA GLY 52 -2.894 -11.666 -7.212 411 HA3 GLY 52 1HA GLY 52 -2.042 -10.667 -8.395 412 H THR 53 H THR 53 0.510 -11.975 -7.946 413 HA THR 53 HA THR 53 0.205 -14.218 -9.777 414 HB THR 53 HB THR 53 2.369 -12.667 -8.420 415 HG1 THR 53 1HG THR 53 3.090 -12.880 -10.730 416 HG21 THR 53 3HG2 THR 53 2.870 -15.322 -9.789 417 HG22 THR 53 1HG2 THR 53 3.008 -15.037 -8.054 418 HG23 THR 53 2HG2 THR 53 4.099 -14.217 -9.172 419 H MET 54 H MET 54 0.094 -13.791 -6.422 420 HA MET 54 HA MET 54 0.967 -16.533 -5.754 421 HB2 MET 54 2HB MET 54 1.413 -14.354 -4.435 422 HB3 MET 54 1HB MET 54 -0.273 -14.476 -3.927 423 HG2 MET 54 2HG MET 54 0.100 -16.366 -2.653 424 HG3 MET 54 1HG MET 54 1.430 -16.916 -3.672 425 HE1 MET 54 3HE MET 54 3.096 -15.179 -4.252 426 HE2 MET 54 1HE MET 54 4.359 -15.271 -3.015 427 HE3 MET 54 2HE MET 54 3.499 -13.759 -3.290 428 H GLY 55 H GLY 55 -1.750 -15.264 -7.045 429 HA2 GLY 55 2HA GLY 55 -3.797 -16.466 -7.386 430 HA3 GLY 55 1HA GLY 55 -3.410 -17.470 -5.986 431 H PHE 56 H PHE 56 -2.712 -14.529 -4.859 432 HA PHE 56 HA PHE 56 -5.472 -14.159 -3.761 433 HB2 PHE 56 2HB PHE 56 -2.718 -13.324 -2.786 434 HB3 PHE 56 1HB PHE 56 -4.225 -13.037 -1.915 435 HD1 PHE 56 2HD PHE 56 -5.639 -15.623 -2.596 436 HD2 PHE 56 1HD PHE 56 -1.620 -14.839 -1.296 437 HE1 PHE 56 2HE PHE 56 -5.509 -17.899 -1.621 438 HE2 PHE 56 1HE PHE 56 -1.493 -17.115 -0.321 439 HZ PHE 56 HZ PHE 56 -3.437 -18.645 -0.482 440 H SER 57 H SER 57 -5.138 -13.100 -6.314 441 HA SER 57 HA SER 57 -4.110 -10.452 -6.451 442 HB2 SER 57 2HB SER 57 -6.108 -12.106 -7.930 443 HB3 SER 57 1HB SER 57 -6.028 -10.382 -8.281 444 HG SER 57 HG SER 57 -4.341 -10.837 -9.433 445 H SER 58 H SER 58 -6.966 -11.742 -5.068 446 HA SER 58 HA SER 58 -8.674 -9.465 -5.041 447 HB2 SER 58 2HB SER 58 -8.426 -11.427 -2.766 448 HB3 SER 58 1HB SER 58 -9.888 -10.729 -3.462 449 HG SER 58 HG SER 58 -9.870 -12.210 -4.976 450 H MET 59 H MET 59 -6.029 -10.529 -2.970 451 HA MET 59 HA MET 59 -6.320 -8.253 -1.145 452 HB2 MET 59 2HB MET 59 -5.626 -10.444 -0.325 453 HB3 MET 59 1HB MET 59 -4.297 -10.492 -1.485 454 HG2 MET 59 2HG MET 59 -3.615 -8.217 -0.311 455 HG3 MET 59 1HG MET 59 -4.570 -8.867 1.022 456 HE1 MET 59 3HE MET 59 -2.120 -9.599 -1.662 457 HE2 MET 59 1HE MET 59 -2.572 -11.304 -1.518 458 HE3 MET 59 2HE MET 59 -0.966 -10.770 -1.028 459 H ALA 60 H ALA 60 -4.600 -9.074 -4.057 460 HA ALA 60 HA ALA 60 -2.507 -7.053 -3.733 461 HB1 ALA 60 1HB ALA 60 -3.180 -9.254 -5.432 462 HB2 ALA 60 2HB ALA 60 -1.658 -8.375 -5.346 463 HB3 ALA 60 3HB ALA 60 -2.924 -7.836 -6.449 464 H LYS 61 H LYS 61 -5.709 -7.265 -5.245 465 HA LYS 61 HA LYS 61 -5.537 -4.822 -6.760 466 HB2 LYS 61 2HB LYS 61 -7.806 -6.403 -5.506 467 HB3 LYS 61 1HB LYS 61 -8.078 -5.019 -6.569 468 HG2 LYS 61 2HG LYS 61 -7.511 -6.187 -8.435 469 HG3 LYS 61 1HG LYS 61 -6.187 -7.026 -7.622 470 HD2 LYS 61 2HD LYS 61 -7.779 -8.728 -8.070 471 HD3 LYS 61 1HD LYS 61 -8.018 -8.328 -6.368 472 HE2 LYS 61 2HE LYS 61 -10.070 -7.369 -6.740 473 HE3 LYS 61 1HE LYS 61 -9.604 -6.748 -8.336 474 HZ1 LYS 61 3HZ LYS 61 -9.842 -8.832 -9.309 475 HZ2 LYS 61 1HZ LYS 61 -11.175 -8.751 -8.265 476 HZ3 LYS 61 2HZ LYS 61 -9.804 -9.651 -7.822 477 H LEU 62 H LEU 62 -6.225 -5.618 -3.432 478 HA LEU 62 HA LEU 62 -7.278 -3.135 -2.525 479 HB2 LEU 62 2HB LEU 62 -7.352 -5.202 -1.264 480 HB3 LEU 62 1HB LEU 62 -5.602 -5.374 -1.352 481 HG LEU 62 HG LEU 62 -6.541 -4.535 0.830 482 HD11 LEU 62 1HD1 LEU 62 -4.180 -3.985 -0.445 483 HD12 LEU 62 2HD1 LEU 62 -4.526 -3.595 1.240 484 HD13 LEU 62 3HD1 LEU 62 -4.750 -2.373 -0.013 485 HD21 LEU 62 3HD2 LEU 62 -7.629 -2.533 0.987 486 HD22 LEU 62 1HD2 LEU 62 -7.998 -2.844 -0.709 487 HD23 LEU 62 2HD2 LEU 62 -6.647 -1.795 -0.278 488 H CYS 63 H CYS 63 -4.002 -4.481 -2.714 489 HA CYS 63 HA CYS 63 -2.668 -2.094 -1.754 490 HB2 CYS 63 2HB CYS 63 -1.976 -4.746 -2.935 491 HB3 CYS 63 1HB CYS 63 -0.732 -3.496 -2.978 492 HG CYS 63 HG CYS 63 -1.429 -5.059 -0.547 493 H HIS 64 H HIS 64 -3.531 -3.337 -4.951 494 HA HIS 64 HA HIS 64 -1.893 -1.624 -6.539 495 HB2 HIS 64 2HB HIS 64 -3.204 -3.645 -7.269 496 HB3 HIS 64 1HB HIS 64 -4.681 -2.699 -7.091 497 HD1 HIS 64 1HD HIS 64 -1.387 -1.515 -8.577 498 HD2 HIS 64 2HD HIS 64 -5.315 -2.250 -9.768 499 HE1 HIS 64 1HE HIS 64 -1.580 -0.682 -10.961 500 H THR 65 H THR 65 -4.878 -1.129 -4.790 501 HA THR 65 HA THR 65 -5.457 1.428 -6.088 502 HB THR 65 HB THR 65 -6.682 -0.455 -4.224 503 HG1 THR 65 1HG THR 65 -7.715 -0.161 -6.072 504 HG21 THR 65 3HG2 THR 65 -7.255 2.474 -3.767 505 HG22 THR 65 1HG2 THR 65 -6.313 1.465 -2.672 506 HG23 THR 65 2HG2 THR 65 -8.014 1.103 -2.955 507 H LEU 66 H LEU 66 -4.357 0.415 -2.807 508 HA LEU 66 HA LEU 66 -3.995 2.920 -1.597 509 HB2 LEU 66 2HB LEU 66 -1.873 0.764 -1.521 510 HB3 LEU 66 1HB LEU 66 -2.393 1.820 -0.214 511 HG LEU 66 HG LEU 66 -3.738 -0.619 -1.325 512 HD11 LEU 66 1HD1 LEU 66 -2.458 0.228 1.130 513 HD12 LEU 66 2HD1 LEU 66 -2.936 -1.393 0.625 514 HD13 LEU 66 3HD1 LEU 66 -4.096 -0.345 1.442 515 HD21 LEU 66 3HD2 LEU 66 -5.537 0.492 0.492 516 HD22 LEU 66 1HD2 LEU 66 -5.748 0.411 -1.255 517 HD23 LEU 66 2HD2 LEU 66 -5.059 1.857 -0.516 518 H GLU 67 H GLU 67 -1.974 1.236 -3.941 519 HA GLU 67 HA GLU 67 0.105 3.239 -4.089 520 HB2 GLU 67 2HB GLU 67 1.027 1.462 -5.159 521 HB3 GLU 67 1HB GLU 67 -0.506 0.614 -4.972 522 HG2 GLU 67 2HG GLU 67 0.061 0.590 -7.319 523 HG3 GLU 67 1HG GLU 67 -1.279 1.718 -7.114 524 H ASN 68 H ASN 68 -2.810 2.501 -6.020 525 HA ASN 68 HA ASN 68 -2.478 4.410 -8.076 526 HB2 ASN 68 2HB ASN 68 -4.656 2.970 -6.693 527 HB3 ASN 68 1HB ASN 68 -5.151 4.401 -7.591 528 HD21 ASN 68 1HD2 ASN 68 -6.204 2.349 -8.834 529 HD22 ASN 68 2HD2 ASN 68 -5.285 1.780 -10.141 530 H ILE 69 H ILE 69 -3.774 4.760 -4.793 531 HA ILE 69 HA ILE 69 -4.596 7.508 -5.059 532 HB ILE 69 HB ILE 69 -3.554 6.221 -2.531 533 HG12 ILE 69 2HG1 ILE 69 -5.179 4.734 -3.898 534 HG13 ILE 69 1HG1 ILE 69 -5.547 5.019 -2.212 535 HG21 ILE 69 1HG2 ILE 69 -5.843 7.564 -1.904 536 HG22 ILE 69 2HG2 ILE 69 -5.254 8.526 -3.258 537 HG23 ILE 69 3HG2 ILE 69 -4.233 8.281 -1.843 538 HD11 ILE 69 3HD1 ILE 69 -7.187 6.674 -2.788 539 HD12 ILE 69 1HD1 ILE 69 -7.492 5.251 -3.786 540 HD13 ILE 69 2HD1 ILE 69 -6.681 6.657 -4.481 541 H LEU 70 H LEU 70 -1.715 5.834 -4.223 542 HA LEU 70 HA LEU 70 -0.112 8.179 -3.597 543 HB2 LEU 70 2HB LEU 70 0.635 5.338 -4.361 544 HB3 LEU 70 1HB LEU 70 1.713 6.511 -3.598 545 HG LEU 70 HG LEU 70 -0.924 5.771 -2.344 546 HD11 LEU 70 1HD1 LEU 70 1.640 4.244 -2.400 547 HD12 LEU 70 2HD1 LEU 70 -0.017 3.653 -2.272 548 HD13 LEU 70 3HD1 LEU 70 0.782 4.343 -0.862 549 HD21 LEU 70 3HD2 LEU 70 0.579 7.803 -1.710 550 HD22 LEU 70 1HD2 LEU 70 1.624 6.590 -0.973 551 HD23 LEU 70 2HD2 LEU 70 -0.041 6.772 -0.419 552 H ASP 71 H ASP 71 -1.236 6.574 -6.365 553 HA ASP 71 HA ASP 71 0.822 7.546 -8.200 554 HB2 ASP 71 2HB ASP 71 -0.680 5.462 -8.434 555 HB3 ASP 71 1HB ASP 71 -1.984 6.582 -8.835 556 H LYS 72 H LYS 72 -2.616 8.361 -7.426 557 HA LYS 72 HA LYS 72 -2.692 10.695 -9.102 558 HB2 LYS 72 2HB LYS 72 -4.098 9.633 -6.689 559 HB3 LYS 72 1HB LYS 72 -4.492 11.248 -7.271 560 HG2 LYS 72 2HG LYS 72 -5.532 10.442 -9.142 561 HG3 LYS 72 1HG LYS 72 -4.395 9.096 -9.307 562 HD2 LYS 72 2HD LYS 72 -6.119 9.093 -6.907 563 HD3 LYS 72 1HD LYS 72 -6.917 8.739 -8.440 564 HE2 LYS 72 2HE LYS 72 -4.536 7.261 -8.507 565 HE3 LYS 72 1HE LYS 72 -5.151 7.064 -6.853 566 HZ1 LYS 72 3HZ LYS 72 -6.086 5.610 -8.830 567 HZ2 LYS 72 1HZ LYS 72 -7.076 6.968 -9.063 568 HZ3 LYS 72 2HZ LYS 72 -7.098 6.148 -7.575 569 H ALA 73 H ALA 73 -1.578 9.999 -5.903 570 HA ALA 73 HA ALA 73 -1.135 12.637 -4.886 571 HB1 ALA 73 1HB ALA 73 -0.823 11.064 -3.240 572 HB2 ALA 73 2HB ALA 73 0.844 11.062 -3.818 573 HB3 ALA 73 3HB ALA 73 -0.293 9.842 -4.398 574 H ARG 74 H ARG 74 0.756 10.443 -6.886 575 HA ARG 74 HA ARG 74 2.949 12.406 -7.134 576 HB2 ARG 74 2HB ARG 74 4.189 10.576 -7.792 577 HB3 ARG 74 1HB ARG 74 2.890 9.697 -6.994 578 HG2 ARG 74 2HG ARG 74 1.761 9.325 -9.104 579 HG3 ARG 74 1HG ARG 74 2.894 10.377 -9.949 580 HD2 ARG 74 2HD ARG 74 4.670 8.665 -8.882 581 HD3 ARG 74 1HD ARG 74 3.269 7.578 -8.986 582 HE ARG 74 HE ARG 74 3.247 8.857 -11.430 583 HH11 ARG 74 1HH1 ARG 74 3.898 5.971 -11.291 584 HH12 ARG 74 2HH1 ARG 74 5.509 5.912 -11.924 585 HH21 ARG 74 1HH2 ARG 74 6.075 9.310 -11.523 586 HH22 ARG 74 2HH2 ARG 74 6.744 7.803 -12.054 587 H ASN 75 H ASN 75 -0.014 11.637 -8.597 588 HA ASN 75 HA ASN 75 0.779 12.746 -11.255 589 HB2 ASN 75 2HB ASN 75 -0.685 10.596 -10.654 590 HB3 ASN 75 1HB ASN 75 -1.974 11.795 -10.538 591 HD21 ASN 75 1HD2 ASN 75 -2.117 9.892 -12.596 592 HD22 ASN 75 2HD2 ASN 75 -1.810 10.641 -14.088 593 H SER 76 H SER 76 -0.355 13.780 -8.282 594 HA SER 76 HA SER 76 -1.079 15.924 -7.603 595 HB2 SER 76 2HB SER 76 -0.081 16.257 -10.170 596 HB3 SER 76 1HB SER 76 -1.716 16.901 -10.295 597 HG SER 76 HG SER 76 0.379 17.661 -8.550 598 H GLU 77 H GLU 77 -2.865 13.603 -8.010 599 HA GLU 77 HA GLU 77 -5.376 15.018 -8.770 600 HB2 GLU 77 2HB GLU 77 -4.465 12.155 -8.847 601 HB3 GLU 77 1HB GLU 77 -6.173 12.573 -8.987 602 HG2 GLU 77 2HG GLU 77 -4.044 13.824 -10.729 603 HG3 GLU 77 1HG GLU 77 -4.877 12.336 -11.183 604 H ILE 78 H ILE 78 -3.943 12.833 -6.408 605 HA ILE 78 HA ILE 78 -6.026 13.756 -4.441 606 HB ILE 78 HB ILE 78 -6.069 11.492 -3.556 607 HG12 ILE 78 2HG1 ILE 78 -4.723 9.757 -4.975 608 HG13 ILE 78 1HG1 ILE 78 -3.740 11.155 -5.419 609 HG21 ILE 78 1HG2 ILE 78 -6.140 10.912 -6.477 610 HG22 ILE 78 2HG2 ILE 78 -7.181 12.209 -5.894 611 HG23 ILE 78 3HG2 ILE 78 -7.348 10.581 -5.237 612 HD11 ILE 78 3HD1 ILE 78 -2.656 11.028 -3.476 613 HD12 ILE 78 1HD1 ILE 78 -3.604 9.605 -3.047 614 HD13 ILE 78 2HD1 ILE 78 -4.174 11.213 -2.596 615 H LYS 79 H LYS 79 -5.228 13.617 -2.152 616 HA LYS 79 HA LYS 79 -2.268 13.501 -1.904 617 HB2 LYS 79 2HB LYS 79 -2.261 15.686 -0.834 618 HB3 LYS 79 1HB LYS 79 -3.065 15.828 -2.398 619 HG2 LYS 79 2HG LYS 79 -5.029 16.398 -1.443 620 HG3 LYS 79 1HG LYS 79 -4.919 15.088 -0.265 621 HD2 LYS 79 2HD LYS 79 -3.081 17.407 0.050 622 HD3 LYS 79 1HD LYS 79 -4.775 17.631 0.489 623 HE2 LYS 79 2HE LYS 79 -4.655 16.118 2.250 624 HE3 LYS 79 1HE LYS 79 -3.355 15.184 1.482 625 HZ1 LYS 79 3HZ LYS 79 -3.165 17.849 2.762 626 HZ2 LYS 79 1HZ LYS 79 -1.966 17.255 1.721 627 HZ3 LYS 79 2HZ LYS 79 -2.315 16.434 3.166 628 H ILE 80 H ILE 80 -1.589 13.233 0.371 629 HA ILE 80 HA ILE 80 -3.413 11.520 1.837 630 HB ILE 80 HB ILE 80 -0.676 12.649 2.172 631 HG12 ILE 80 2HG1 ILE 80 -0.072 10.288 2.032 632 HG13 ILE 80 1HG1 ILE 80 -1.778 9.838 2.092 633 HG21 ILE 80 1HG2 ILE 80 -0.535 11.191 4.264 634 HG22 ILE 80 2HG2 ILE 80 -2.299 11.173 4.240 635 HG23 ILE 80 3HG2 ILE 80 -1.437 12.696 4.436 636 HD11 ILE 80 3HD1 ILE 80 -2.208 10.781 -0.051 637 HD12 ILE 80 1HD1 ILE 80 -0.699 9.886 -0.235 638 HD13 ILE 80 2HD1 ILE 80 -0.669 11.642 -0.064 639 H THR 81 H THR 81 -5.139 12.688 2.453 640 HA THR 81 HA THR 81 -4.915 15.195 3.997 641 HB THR 81 HB THR 81 -7.340 15.110 3.860 642 HG1 THR 81 1HG THR 81 -8.348 13.286 3.789 643 HG21 THR 81 3HG2 THR 81 -7.550 14.357 1.327 644 HG22 THR 81 1HG2 THR 81 -5.791 14.317 1.430 645 HG23 THR 81 2HG2 THR 81 -6.661 15.813 1.764 646 H SER 82 H SER 82 -4.215 12.130 4.756 647 HA SER 82 HA SER 82 -3.945 11.086 6.874 648 HB2 SER 82 2HB SER 82 -4.168 13.569 7.631 649 HB3 SER 82 1HB SER 82 -5.829 13.137 8.025 650 HG SER 82 HG SER 82 -4.744 12.658 9.837 651 H ASP 83 H ASP 83 -6.843 11.819 5.249 652 HA ASP 83 HA ASP 83 -8.399 9.755 6.734 653 HB2 ASP 83 2HB ASP 83 -8.990 12.320 5.837 654 HB3 ASP 83 1HB ASP 83 -9.682 11.291 4.584 655 H LEU 84 H LEU 84 -7.248 10.804 3.527 656 HA LEU 84 HA LEU 84 -8.336 8.611 2.017 657 HB2 LEU 84 2HB LEU 84 -5.729 10.142 1.636 658 HB3 LEU 84 1HB LEU 84 -6.624 9.284 0.382 659 HG LEU 84 HG LEU 84 -7.425 11.797 1.853 660 HD11 LEU 84 1HD1 LEU 84 -7.911 11.749 -0.980 661 HD12 LEU 84 2HD1 LEU 84 -6.255 11.226 -0.669 662 HD13 LEU 84 3HD1 LEU 84 -6.813 12.788 -0.069 663 HD21 LEU 84 3HD2 LEU 84 -9.107 9.686 0.606 664 HD22 LEU 84 1HD2 LEU 84 -9.514 11.352 0.195 665 HD23 LEU 84 2HD2 LEU 84 -9.509 10.834 1.882 666 H LEU 85 H LEU 85 -5.585 9.078 4.095 667 HA LEU 85 HA LEU 85 -4.251 6.543 3.501 668 HB2 LEU 85 2HB LEU 85 -4.115 8.634 5.691 669 HB3 LEU 85 1HB LEU 85 -3.056 7.224 5.664 670 HG LEU 85 HG LEU 85 -3.207 9.489 3.678 671 HD11 LEU 85 1HD1 LEU 85 -1.099 8.271 5.469 672 HD12 LEU 85 2HD1 LEU 85 -1.697 9.931 5.467 673 HD13 LEU 85 3HD1 LEU 85 -0.682 9.353 4.142 674 HD21 LEU 85 3HD2 LEU 85 -3.000 7.762 2.145 675 HD22 LEU 85 1HD2 LEU 85 -2.278 6.666 3.322 676 HD23 LEU 85 2HD2 LEU 85 -1.306 7.949 2.599 677 H ASP 86 H ASP 86 -6.220 7.826 6.193 678 HA ASP 86 HA ASP 86 -6.313 5.611 7.890 679 HB2 ASP 86 2HB ASP 86 -7.733 8.021 7.442 680 HB3 ASP 86 1HB ASP 86 -8.950 6.750 7.558 681 H LYS 87 H LYS 87 -7.882 6.028 4.773 682 HA LYS 87 HA LYS 87 -9.438 3.529 5.104 683 HB2 LYS 87 2HB LYS 87 -9.133 5.435 2.758 684 HB3 LYS 87 1HB LYS 87 -10.381 4.203 2.951 685 HG2 LYS 87 2HG LYS 87 -9.975 6.666 4.662 686 HG3 LYS 87 1HG LYS 87 -11.345 6.316 3.606 687 HD2 LYS 87 2HD LYS 87 -11.936 4.372 4.999 688 HD3 LYS 87 1HD LYS 87 -10.561 4.703 6.053 689 HE2 LYS 87 2HE LYS 87 -11.566 6.566 7.008 690 HE3 LYS 87 1HE LYS 87 -12.536 6.909 5.561 691 HZ1 LYS 87 3HZ LYS 87 -13.644 4.699 6.012 692 HZ2 LYS 87 1HZ LYS 87 -14.027 5.952 7.087 693 HZ3 LYS 87 2HZ LYS 87 -12.923 4.745 7.549 694 H ILE 88 H ILE 88 -6.906 4.819 2.897 695 HA ILE 88 HA ILE 88 -6.386 2.370 1.529 696 HB ILE 88 HB ILE 88 -4.885 4.892 2.189 697 HG12 ILE 88 2HG1 ILE 88 -4.978 4.000 -0.563 698 HG13 ILE 88 1HG1 ILE 88 -6.586 4.044 0.160 699 HG21 ILE 88 1HG2 ILE 88 -3.025 3.509 2.263 700 HG22 ILE 88 2HG2 ILE 88 -3.113 3.889 0.543 701 HG23 ILE 88 3HG2 ILE 88 -3.722 2.344 1.138 702 HD11 ILE 88 3HD1 ILE 88 -6.610 6.292 0.090 703 HD12 ILE 88 1HD1 ILE 88 -5.084 6.234 -0.793 704 HD13 ILE 88 2HD1 ILE 88 -5.079 6.368 0.963 705 H PHE 89 H PHE 89 -5.361 3.679 4.608 706 HA PHE 89 HA PHE 89 -3.412 1.647 5.271 707 HB2 PHE 89 2HB PHE 89 -3.503 3.913 6.270 708 HB3 PHE 89 1HB PHE 89 -5.077 3.531 6.966 709 HD1 PHE 89 2HD PHE 89 -5.274 1.763 8.726 710 HD2 PHE 89 1HD PHE 89 -1.469 3.121 7.268 711 HE1 PHE 89 2HE PHE 89 -4.159 0.760 10.702 712 HE2 PHE 89 1HE PHE 89 -0.354 2.119 9.244 713 HZ PHE 89 HZ PHE 89 -1.699 0.940 10.961 714 H ALA 90 H ALA 90 -6.824 2.047 5.638 715 HA ALA 90 HA ALA 90 -7.285 -0.212 7.403 716 HB1 ALA 90 1HB ALA 90 -9.634 0.211 6.089 717 HB2 ALA 90 2HB ALA 90 -8.820 1.740 5.755 718 HB3 ALA 90 3HB ALA 90 -9.092 1.232 7.421 719 H GLY 91 H GLY 91 -6.842 0.358 4.008 720 HA2 GLY 91 2HA GLY 91 -7.889 -2.177 3.067 721 HA3 GLY 91 1HA GLY 91 -6.838 -1.082 2.156 722 H VAL 92 H VAL 92 -4.664 -0.868 3.818 723 HA VAL 92 HA VAL 92 -3.188 -3.285 3.318 724 HB VAL 92 HB VAL 92 -2.836 -0.743 4.904 725 HG11 VAL 92 1HG1 VAL 92 -1.401 -3.280 5.297 726 HG12 VAL 92 2HG1 VAL 92 -1.422 -1.835 6.308 727 HG13 VAL 92 3HG1 VAL 92 -0.335 -1.926 4.921 728 HG21 VAL 92 3HG2 VAL 92 -0.697 -1.276 3.133 729 HG22 VAL 92 1HG2 VAL 92 -2.003 -0.112 2.907 730 HG23 VAL 92 2HG2 VAL 92 -2.164 -1.752 2.280 731 H ASP 93 H ASP 93 -5.236 -2.156 5.883 732 HA ASP 93 HA ASP 93 -4.311 -4.033 7.924 733 HB2 ASP 93 2HB ASP 93 -6.129 -1.810 7.600 734 HB3 ASP 93 1HB ASP 93 -6.981 -3.152 8.371 735 H MET 94 H MET 94 -6.605 -4.053 5.275 736 HA MET 94 HA MET 94 -8.085 -6.401 6.164 737 HB2 MET 94 2HB MET 94 -7.765 -4.829 3.600 738 HB3 MET 94 1HB MET 94 -8.743 -6.296 3.654 739 HG2 MET 94 2HG MET 94 -9.742 -5.067 5.822 740 HG3 MET 94 1HG MET 94 -9.239 -3.641 4.915 741 HE1 MET 94 3HE MET 94 -10.347 -5.010 1.471 742 HE2 MET 94 1HE MET 94 -9.151 -4.105 2.409 743 HE3 MET 94 2HE MET 94 -10.667 -3.340 1.937 744 H ILE 95 H ILE 95 -5.487 -5.804 3.751 745 HA ILE 95 HA ILE 95 -5.121 -8.482 2.923 746 HB ILE 95 HB ILE 95 -2.898 -7.572 2.272 747 HG12 ILE 95 2HG1 ILE 95 -3.774 -5.058 3.697 748 HG13 ILE 95 1HG1 ILE 95 -2.639 -6.212 4.395 749 HG21 ILE 95 1HG2 ILE 95 -5.170 -7.026 1.129 750 HG22 ILE 95 2HG2 ILE 95 -3.747 -6.086 0.676 751 HG23 ILE 95 3HG2 ILE 95 -4.927 -5.416 1.804 752 HD11 ILE 95 3HD1 ILE 95 -2.292 -4.517 1.921 753 HD12 ILE 95 1HD1 ILE 95 -1.292 -5.939 2.216 754 HD13 ILE 95 2HD1 ILE 95 -1.262 -4.589 3.351 755 H THR 96 H THR 96 -3.939 -6.665 5.719 756 HA THR 96 HA THR 96 -2.052 -8.607 6.692 757 HB THR 96 HB THR 96 -3.778 -6.477 8.013 758 HG1 THR 96 1HG THR 96 -1.553 -5.528 8.061 759 HG21 THR 96 3HG2 THR 96 -2.129 -6.633 9.888 760 HG22 THR 96 1HG2 THR 96 -1.454 -8.072 9.124 761 HG23 THR 96 2HG2 THR 96 -3.117 -8.083 9.713 762 H ARG 97 H ARG 97 -5.518 -8.050 7.140 763 HA ARG 97 HA ARG 97 -5.910 -10.287 8.966 764 HB2 ARG 97 2HB ARG 97 -7.540 -8.284 7.454 765 HB3 ARG 97 1HB ARG 97 -8.366 -9.736 8.021 766 HG2 ARG 97 2HG ARG 97 -8.128 -9.175 10.236 767 HG3 ARG 97 1HG ARG 97 -6.590 -8.352 9.970 768 HD2 ARG 97 2HD ARG 97 -7.756 -6.443 8.947 769 HD3 ARG 97 1HD ARG 97 -9.312 -7.272 9.149 770 HE ARG 97 HE ARG 97 -9.245 -6.484 11.369 771 HH11 ARG 97 1HH1 ARG 97 -7.219 -8.540 12.136 772 HH12 ARG 97 2HH1 ARG 97 -5.932 -7.569 12.772 773 HH21 ARG 97 1HH2 ARG 97 -7.095 -4.627 11.357 774 HH22 ARG 97 2HH2 ARG 97 -5.867 -5.354 12.336 775 H MET 98 H MET 98 -6.062 -9.750 5.477 776 HA MET 98 HA MET 98 -7.278 -12.314 4.825 777 HB2 MET 98 2HB MET 98 -5.644 -10.277 3.267 778 HB3 MET 98 1HB MET 98 -6.483 -11.644 2.530 779 HG2 MET 98 2HG MET 98 -8.583 -10.754 2.944 780 HG3 MET 98 1HG MET 98 -8.024 -9.803 4.320 781 HE1 MET 98 3HE MET 98 -7.473 -9.879 0.160 782 HE2 MET 98 1HE MET 98 -8.771 -8.676 0.172 783 HE3 MET 98 2HE MET 98 -8.975 -10.206 1.021 784 H VAL 99 H VAL 99 -4.048 -11.007 5.236 785 HA VAL 99 HA VAL 99 -2.696 -13.387 4.251 786 HB VAL 99 HB VAL 99 -1.952 -10.826 5.667 787 HG11 VAL 99 1HG1 VAL 99 -0.147 -13.163 4.973 788 HG12 VAL 99 2HG1 VAL 99 -0.427 -12.480 6.575 789 HG13 VAL 99 3HG1 VAL 99 0.443 -11.546 5.357 790 HG21 VAL 99 3HG2 VAL 99 -0.867 -11.849 3.056 791 HG22 VAL 99 1HG2 VAL 99 -1.081 -10.184 3.594 792 HG23 VAL 99 2HG2 VAL 99 -2.481 -11.142 3.112 793 H ASP 100 H ASP 100 -3.721 -12.089 7.390 794 HA ASP 100 HA ASP 100 -2.265 -14.000 9.016 795 HB2 ASP 100 2HB ASP 100 -3.404 -11.754 9.638 796 HB3 ASP 100 1HB ASP 100 -4.910 -12.672 9.669 797 H LYS 101 H LYS 101 -5.316 -13.959 7.308 798 HA LYS 101 HA LYS 101 -6.184 -16.539 8.433 799 HB2 LYS 101 2HB LYS 101 -8.218 -15.904 7.560 800 HB3 LYS 101 1HB LYS 101 -7.459 -14.317 7.478 801 HG2 LYS 101 2HG LYS 101 -8.321 -14.655 5.303 802 HG3 LYS 101 1HG LYS 101 -6.611 -15.064 5.164 803 HD2 LYS 101 2HD LYS 101 -7.188 -17.062 4.412 804 HD3 LYS 101 1HD LYS 101 -7.873 -17.420 5.994 805 HE2 LYS 101 2HE LYS 101 -9.876 -15.898 4.902 806 HE3 LYS 101 1HE LYS 101 -9.260 -16.743 3.468 807 HZ1 LYS 101 3HZ LYS 101 -9.758 -18.771 4.320 808 HZ2 LYS 101 1HZ LYS 101 -10.960 -17.885 5.124 809 HZ3 LYS 101 2HZ LYS 101 -9.522 -18.289 5.933 810 H ILE 102 H ILE 102 -4.270 -15.323 5.838 811 HA ILE 102 HA ILE 102 -4.596 -17.604 4.039 812 HB ILE 102 HB ILE 102 -3.173 -15.055 4.234 813 HG12 ILE 102 2HG1 ILE 102 -3.753 -16.577 1.716 814 HG13 ILE 102 1HG1 ILE 102 -5.077 -15.913 2.670 815 HG21 ILE 102 1HG2 ILE 102 -1.219 -16.632 4.216 816 HG22 ILE 102 2HG2 ILE 102 -1.298 -15.580 2.804 817 HG23 ILE 102 3HG2 ILE 102 -1.811 -17.263 2.679 818 HD11 ILE 102 3HD1 ILE 102 -3.515 -14.536 0.786 819 HD12 ILE 102 1HD1 ILE 102 -2.966 -13.954 2.359 820 HD13 ILE 102 2HD1 ILE 102 -4.669 -13.832 1.919 821 H VAL 103 H VAL 103 -2.059 -16.448 6.273 822 HA VAL 103 HA VAL 103 -0.395 -18.776 6.148 823 HB VAL 103 HB VAL 103 -0.943 -16.559 8.132 824 HG11 VAL 103 1HG1 VAL 103 1.353 -17.591 9.092 825 HG12 VAL 103 2HG1 VAL 103 0.587 -19.080 8.537 826 HG13 VAL 103 3HG1 VAL 103 -0.229 -18.055 9.717 827 HG21 VAL 103 3HG2 VAL 103 1.078 -15.648 7.358 828 HG22 VAL 103 1HG2 VAL 103 0.404 -16.365 5.893 829 HG23 VAL 103 2HG2 VAL 103 1.672 -17.208 6.785 830 H SER 104 H SER 104 -3.373 -17.958 7.753 831 HA SER 104 HA SER 104 -3.372 -20.264 9.565 832 HB2 SER 104 2HB SER 104 -4.371 -18.064 10.121 833 HB3 SER 104 1HB SER 104 -5.498 -18.261 8.779 834 HG SER 104 HG SER 104 -5.356 -19.600 11.242 835 H GLU 105 H GLU 105 -5.526 -19.189 6.985 836 HA GLU 105 HA GLU 105 -6.320 -22.034 6.493 837 HB2 GLU 105 2HB GLU 105 -7.580 -19.541 5.341 838 HB3 GLU 105 1HB GLU 105 -8.328 -21.111 5.624 839 HG2 GLU 105 2HG GLU 105 -7.338 -20.188 8.129 840 HG3 GLU 105 1HG GLU 105 -8.216 -18.852 7.382 841 H GLY 106 H GLY 106 -5.060 -19.141 4.884 842 HA2 GLY 106 2HA GLY 106 -3.451 -19.307 3.059 843 HA3 GLY 106 1HA GLY 106 -4.148 -20.872 2.639 844 H SER 107 H SER 107 -6.239 -18.197 3.421 845 HA SER 107 HA SER 107 -6.856 -17.836 0.502 846 HB2 SER 107 2HB SER 107 -8.655 -18.396 2.850 847 HB3 SER 107 1HB SER 107 -9.266 -17.681 1.358 848 HG SER 107 HG SER 107 -9.450 -19.857 1.099 849 H ASP 108 H ASP 108 -6.786 -15.743 -0.073 850 HA ASP 108 HA ASP 108 -6.606 -13.620 1.957 851 HB2 ASP 108 2HB ASP 108 -6.269 -12.220 -0.048 852 HB3 ASP 108 1HB ASP 108 -5.289 -13.682 -0.169 853 H ASP 109 H ASP 109 -9.141 -15.381 0.881 854 HA ASP 109 HA ASP 109 -11.042 -13.215 0.278 855 HB2 ASP 109 2HB ASP 109 -11.090 -16.216 0.570 856 HB3 ASP 109 1HB ASP 109 -12.600 -15.311 0.455 857 H ILE 110 H ILE 110 -11.545 -11.933 2.045 858 HA ILE 110 HA ILE 110 -12.431 -13.345 4.540 859 HB ILE 110 HB ILE 110 -11.442 -11.483 5.786 860 HG12 ILE 110 2HG1 ILE 110 -10.387 -10.395 3.175 861 HG13 ILE 110 1HG1 ILE 110 -11.930 -9.860 3.837 862 HG21 ILE 110 1HG2 ILE 110 -9.580 -12.655 3.699 863 HG22 ILE 110 2HG2 ILE 110 -9.925 -13.318 5.297 864 HG23 ILE 110 3HG2 ILE 110 -9.038 -11.802 5.145 865 HD11 ILE 110 3HD1 ILE 110 -9.525 -9.883 5.624 866 HD12 ILE 110 1HD1 ILE 110 -10.947 -8.844 5.680 867 HD13 ILE 110 2HD1 ILE 110 -9.708 -8.574 4.456 868 H GLY 111 H GLY 111 -13.898 -12.261 2.101 869 HA2 GLY 111 2HA GLY 111 -16.056 -11.314 1.875 870 HA3 GLY 111 1HA GLY 111 -16.005 -10.876 3.583 871 H GLU 112 H GLU 112 -13.147 -9.838 2.299 872 HA GLU 112 HA GLU 112 -13.633 -7.083 2.596 873 HB2 GLU 112 2HB GLU 112 -11.523 -6.906 1.225 874 HB3 GLU 112 1HB GLU 112 -11.422 -8.066 2.551 875 HG2 GLU 112 2HG GLU 112 -10.689 -9.483 0.929 876 HG3 GLU 112 1HG GLU 112 -12.408 -9.651 0.578 877 H ASN 113 H ASN 113 -13.502 -5.434 0.801 878 HA ASN 113 HA ASN 113 -14.848 -6.283 -1.734 879 HB2 ASN 113 2HB ASN 113 -15.694 -4.304 0.369 880 HB3 ASN 113 1HB ASN 113 -16.175 -4.056 -1.307 881 HD21 ASN 113 1HD2 ASN 113 -17.612 -5.661 -2.298 882 HD22 ASN 113 2HD2 ASN 113 -18.486 -6.757 -1.340 883 H ILE 114 H ILE 114 -12.676 -5.954 -2.652 884 HA ILE 114 HA ILE 114 -11.247 -3.473 -2.378 885 HB ILE 114 HB ILE 114 -11.124 -5.467 -4.647 886 HG12 ILE 114 2HG1 ILE 114 -11.026 -6.860 -2.743 887 HG13 ILE 114 1HG1 ILE 114 -9.331 -6.510 -3.070 888 HG21 ILE 114 1HG2 ILE 114 -9.773 -3.389 -4.846 889 HG22 ILE 114 2HG2 ILE 114 -8.759 -4.823 -4.680 890 HG23 ILE 114 3HG2 ILE 114 -9.012 -3.756 -3.298 891 HD11 ILE 114 3HD1 ILE 114 -9.952 -6.264 -0.649 892 HD12 ILE 114 1HD1 ILE 114 -11.038 -4.950 -1.103 893 HD13 ILE 114 2HD1 ILE 114 -9.299 -4.787 -1.358 894 H ASP 115 H ASP 115 -12.754 -4.703 -5.404 895 HA ASP 115 HA ASP 115 -12.706 -2.468 -6.972 896 HB2 ASP 115 2HB ASP 115 -14.783 -4.568 -6.466 897 HB3 ASP 115 1HB ASP 115 -15.158 -3.263 -7.592 898 H VAL 116 H VAL 116 -14.661 -2.964 -4.177 899 HA VAL 116 HA VAL 116 -16.093 -0.407 -4.456 900 HB VAL 116 HB VAL 116 -16.082 -2.667 -2.459 901 HG11 VAL 116 1HG1 VAL 116 -18.272 -1.508 -1.716 902 HG12 VAL 116 2HG1 VAL 116 -17.647 -0.084 -2.548 903 HG13 VAL 116 3HG1 VAL 116 -16.755 -0.779 -1.194 904 HG21 VAL 116 3HG2 VAL 116 -17.418 -3.627 -4.007 905 HG22 VAL 116 1HG2 VAL 116 -17.437 -2.157 -4.980 906 HG23 VAL 116 2HG2 VAL 116 -18.601 -2.364 -3.671 907 H PHE 117 H PHE 117 -14.093 -1.990 -2.030 908 HA PHE 117 HA PHE 117 -13.677 0.231 -0.310 909 HB2 PHE 117 2HB PHE 117 -13.082 -1.997 0.356 910 HB3 PHE 117 1HB PHE 117 -12.011 -2.193 -1.032 911 HD1 PHE 117 1HD PHE 117 -12.427 -0.595 2.269 912 HD2 PHE 117 2HD PHE 117 -9.804 -1.192 -1.081 913 HE1 PHE 117 1HE PHE 117 -10.524 0.279 3.601 914 HE2 PHE 117 2HE PHE 117 -7.904 -0.317 0.250 915 HZ PHE 117 HZ PHE 117 -8.264 0.415 2.589 916 H SER 118 H SER 118 -12.411 -0.390 -3.466 917 HA SER 118 HA SER 118 -10.172 1.472 -3.182 918 HB2 SER 118 2HB SER 118 -9.428 -0.009 -4.731 919 HB3 SER 118 1HB SER 118 -11.032 -0.714 -4.871 920 HG SER 118 HG SER 118 -11.509 0.653 -6.478 921 H ASP 119 H ASP 119 -13.212 1.114 -4.854 922 HA ASP 119 HA ASP 119 -13.169 3.722 -6.106 923 HB2 ASP 119 2HB ASP 119 -15.057 1.450 -5.716 924 HB3 ASP 119 1HB ASP 119 -15.761 3.012 -6.134 925 H THR 120 H THR 120 -14.496 2.349 -3.203 926 HA THR 120 HA THR 120 -16.011 4.564 -2.272 927 HB THR 120 HB THR 120 -14.658 2.142 -1.176 928 HG1 THR 120 1HG THR 120 -16.662 1.530 -1.020 929 HG21 THR 120 3HG2 THR 120 -15.661 2.915 1.122 930 HG22 THR 120 1HG2 THR 120 -15.429 4.531 0.457 931 HG23 THR 120 2HG2 THR 120 -14.050 3.446 0.638 932 H ILE 121 H ILE 121 -12.674 3.646 -1.950 933 HA ILE 121 HA ILE 121 -11.925 6.019 -0.417 934 HB ILE 121 HB ILE 121 -10.945 3.401 -1.175 935 HG12 ILE 121 2HG1 ILE 121 -10.167 5.370 0.982 936 HG13 ILE 121 1HG1 ILE 121 -11.345 4.063 1.119 937 HG21 ILE 121 1HG2 ILE 121 -8.811 5.531 -1.084 938 HG22 ILE 121 2HG2 ILE 121 -9.411 4.822 -2.580 939 HG23 ILE 121 3HG2 ILE 121 -8.607 3.807 -1.391 940 HD11 ILE 121 3HD1 ILE 121 -9.641 2.760 1.830 941 HD12 ILE 121 1HD1 ILE 121 -8.437 3.954 1.343 942 HD13 ILE 121 2HD1 ILE 121 -9.055 2.793 0.168 943 H LYS 122 H LYS 122 -11.327 4.758 -3.701 944 HA LYS 122 HA LYS 122 -9.783 7.035 -4.564 945 HB2 LYS 122 2HB LYS 122 -11.228 4.698 -5.841 946 HB3 LYS 122 1HB LYS 122 -10.264 5.845 -6.787 947 HG2 LYS 122 2HG LYS 122 -8.259 5.223 -5.743 948 HG3 LYS 122 1HG LYS 122 -9.090 4.585 -4.329 949 HD2 LYS 122 2HD LYS 122 -8.340 2.676 -5.529 950 HD3 LYS 122 1HD LYS 122 -10.062 2.812 -5.883 951 HE2 LYS 122 2HE LYS 122 -9.590 3.948 -7.975 952 HE3 LYS 122 1HE LYS 122 -7.844 3.895 -7.632 953 HZ1 LYS 122 3HZ LYS 122 -8.246 1.404 -7.291 954 HZ2 LYS 122 1HZ LYS 122 -8.205 1.978 -8.887 955 HZ3 LYS 122 2HZ LYS 122 -9.696 1.644 -8.144 956 H SER 123 H SER 123 -13.191 6.209 -4.546 957 HA SER 123 HA SER 123 -13.852 8.560 -6.224 958 HB2 SER 123 2HB SER 123 -14.945 6.138 -6.090 959 HB3 SER 123 1HB SER 123 -15.859 6.889 -4.785 960 HG SER 123 HG SER 123 -17.030 7.387 -6.531 961 H PHE 124 H PHE 124 -13.299 7.728 -3.007 962 HA PHE 124 HA PHE 124 -15.124 9.326 -1.547 963 HB2 PHE 124 2HB PHE 124 -12.911 7.745 -1.064 964 HB3 PHE 124 1HB PHE 124 -12.329 9.350 -0.624 965 HD1 PHE 124 2HD PHE 124 -15.809 8.024 -0.378 966 HD2 PHE 124 1HD PHE 124 -12.289 9.274 1.743 967 HE1 PHE 124 2HE PHE 124 -17.052 7.892 1.765 968 HE2 PHE 124 1HE PHE 124 -13.532 9.142 3.884 969 HZ PHE 124 HZ PHE 124 -15.913 8.451 3.896 970 H ALA 125 H ALA 125 -12.621 10.169 -3.695 971 HA ALA 125 HA ALA 125 -11.879 12.279 -4.479 972 HB1 ALA 125 1HB ALA 125 -13.805 13.430 -4.753 973 HB2 ALA 125 2HB ALA 125 -13.634 14.031 -3.104 974 HB3 ALA 125 3HB ALA 125 -14.551 12.556 -3.415 975 H SER 126 H SER 126 -13.131 13.405 -1.354 976 HA SER 126 HA SER 126 -10.608 13.277 0.042 977 HB2 SER 126 2HB SER 126 -10.405 15.901 -0.106 978 HB3 SER 126 1HB SER 126 -9.770 14.905 -1.412 979 HG SER 126 HG SER 126 -11.050 16.145 -2.554 980 H SER 127 H SER 127 -13.250 15.700 -0.256 981 HA SER 127 HA SER 127 -14.548 14.883 2.199 982 HB2 SER 127 2HB SER 127 -12.185 16.075 2.666 983 HB3 SER 127 1HB SER 127 -13.182 17.518 2.514 984 HG SER 127 HG SER 127 -13.557 17.047 4.554 985 H GLY 128 H GLY 128 -16.406 15.203 0.808 986 HA2 GLY 128 2HA GLY 128 -17.452 17.919 0.872 987 HA3 GLY 128 1HA GLY 128 -17.088 17.371 -0.764 988 H LYS 129 H LYS 129 -18.913 16.454 2.158 989 HA LYS 129 HA LYS 129 -20.844 15.086 2.359 990 HB2 LYS 129 2HB LYS 129 -21.378 16.579 -0.232 991 HB3 LYS 129 1HB LYS 129 -22.599 15.907 0.849 992 HG2 LYS 129 2HG LYS 129 -21.088 17.446 2.565 993 HG3 LYS 129 1HG LYS 129 -21.065 18.402 1.084 994 HD2 LYS 129 2HD LYS 129 -23.012 19.112 2.260 995 HD3 LYS 129 1HD LYS 129 -23.597 18.042 0.985 996 HE2 LYS 129 2HE LYS 129 -23.359 16.159 2.794 997 HE3 LYS 129 1HE LYS 129 -23.394 17.511 3.944 998 HZ1 LYS 129 3HZ LYS 129 -25.329 18.227 2.261 999 HZ2 LYS 129 1HZ LYS 129 -25.611 17.326 3.669 1000 HZ3 LYS 129 2HZ LYS 129 -25.482 16.537 2.169 1001 H GLU 130 H GLU 130 -22.430 14.218 0.008 1002 HA GLU 130 HA GLU 130 -21.172 11.674 -0.481 1003 HB2 GLU 130 2HB GLU 130 -23.677 12.777 -0.660 1004 HB3 GLU 130 1HB GLU 130 -23.237 12.643 -2.364 1005 HG2 GLU 130 2HG GLU 130 -23.528 10.410 -2.326 1006 HG3 GLU 130 1HG GLU 130 -22.462 10.249 -0.930 1007 H LYS 131 H LYS 131 -21.975 11.729 -3.406 1008 HA LYS 131 HA LYS 131 -19.726 13.351 -4.532 1009 HB2 LYS 131 2HB LYS 131 -18.944 11.377 -5.727 1010 HB3 LYS 131 1HB LYS 131 -19.062 10.981 -4.012 1011 HG2 LYS 131 2HG LYS 131 -20.267 9.192 -4.733 1012 HG3 LYS 131 1HG LYS 131 -21.584 10.359 -4.879 1013 HD2 LYS 131 2HD LYS 131 -21.540 9.354 -7.003 1014 HD3 LYS 131 1HD LYS 131 -20.598 10.826 -7.244 1015 HE2 LYS 131 2HE LYS 131 -18.956 9.463 -8.037 1016 HE3 LYS 131 1HE LYS 131 -18.714 8.960 -6.350 1017 HZ1 LYS 131 3HZ LYS 131 -19.278 7.132 -7.994 1018 HZ2 LYS 131 1HZ LYS 131 -20.837 7.795 -8.055 1019 HZ3 LYS 131 2HZ LYS 131 -20.225 7.200 -6.585 1020 H LEU 132 H LEU 132 -19.891 13.271 -7.044 1021 HA LEU 132 HA LEU 132 -22.785 13.276 -7.847 1022 HB2 LEU 132 2HB LEU 132 -20.540 15.220 -8.147 1023 HB3 LEU 132 1HB LEU 132 -21.685 15.101 -9.483 1024 HG LEU 132 HG LEU 132 -22.446 15.566 -6.584 1025 HD11 LEU 132 1HD1 LEU 132 -21.701 17.367 -8.796 1026 HD12 LEU 132 2HD1 LEU 132 -21.759 17.680 -7.060 1027 HD13 LEU 132 3HD1 LEU 132 -23.235 17.769 -8.023 1028 HD21 LEU 132 3HD2 LEU 132 -24.625 16.257 -7.909 1029 HD22 LEU 132 1HD2 LEU 132 -24.321 14.559 -7.539 1030 HD23 LEU 132 2HD2 LEU 132 -23.964 15.190 -9.148 1031 H GLU 133 H GLU 133 -23.242 12.409 -9.907 1032 HA GLU 133 HA GLU 133 -21.280 11.826 -11.923 1033 HB2 GLU 133 2HB GLU 133 -20.950 10.261 -9.734 1034 HB3 GLU 133 1HB GLU 133 -22.120 9.285 -10.623 1035 HG2 GLU 133 2HG GLU 133 -20.591 8.689 -12.181 1036 HG3 GLU 133 1HG GLU 133 -20.000 10.344 -12.342 Start of MODEL 17 1 H1 MET 1 1HT MET 1 3.852 -26.687 -5.943 2 H2 MET 1 2HT MET 1 4.238 -28.230 -5.346 3 H3 MET 1 3HT MET 1 5.050 -27.615 -6.705 4 HA MET 1 HA MET 1 6.645 -27.013 -5.252 5 HB2 MET 1 2HB MET 1 6.284 -24.741 -4.575 6 HB3 MET 1 1HB MET 1 5.298 -24.971 -6.020 7 HG2 MET 1 2HG MET 1 3.353 -25.510 -4.500 8 HG3 MET 1 1HG MET 1 4.360 -25.019 -3.140 9 HE1 MET 1 2HE MET 1 1.487 -22.390 -4.611 10 HE2 MET 1 3HE MET 1 1.644 -23.832 -3.612 11 HE3 MET 1 1HE MET 1 1.678 -23.964 -5.377 12 H MET 2 H MET 2 7.080 -26.291 -2.832 13 HA MET 2 HA MET 2 5.639 -28.234 -1.098 14 HB2 MET 2 2HB MET 2 8.168 -26.597 -0.698 15 HB3 MET 2 1HB MET 2 7.603 -27.888 0.361 16 HG2 MET 2 2HG MET 2 7.704 -28.785 -2.398 17 HG3 MET 2 1HG MET 2 9.273 -28.175 -1.874 18 HE1 MET 2 3HE MET 2 10.735 -29.086 -1.016 19 HE2 MET 2 1HE MET 2 10.841 -30.849 -0.950 20 HE3 MET 2 2HE MET 2 10.705 -29.915 0.537 21 H GLU 3 H GLU 3 6.655 -26.544 1.247 22 HA GLU 3 HA GLU 3 4.416 -24.553 1.227 23 HB2 GLU 3 2HB GLU 3 4.472 -24.931 3.701 24 HB3 GLU 3 1HB GLU 3 4.112 -26.405 2.796 25 HG2 GLU 3 2HG GLU 3 6.360 -27.199 3.037 26 HG3 GLU 3 1HG GLU 3 6.916 -25.632 3.633 27 H GLU 4 H GLU 4 7.767 -24.919 1.342 28 HA GLU 4 HA GLU 4 8.340 -22.685 3.086 29 HB2 GLU 4 2HB GLU 4 9.787 -24.723 2.541 30 HB3 GLU 4 1HB GLU 4 10.148 -23.926 1.007 31 HG2 GLU 4 2HG GLU 4 11.156 -22.055 2.110 32 HG3 GLU 4 1HG GLU 4 10.555 -22.576 3.684 33 H TYR 5 H TYR 5 7.320 -22.946 -0.119 34 HA TYR 5 HA TYR 5 8.651 -20.648 -1.258 35 HB2 TYR 5 2HB TYR 5 7.337 -22.706 -2.285 36 HB3 TYR 5 1HB TYR 5 5.956 -21.619 -2.135 37 HD1 TYR 5 1HD TYR 5 9.354 -21.967 -3.614 38 HD2 TYR 5 2HD TYR 5 5.658 -19.777 -3.617 39 HE1 TYR 5 1HE TYR 5 10.058 -20.783 -5.676 40 HE2 TYR 5 2HE TYR 5 6.363 -18.593 -5.679 41 HH TYR 5 HH TYR 5 7.999 -19.139 -7.643 42 H LEU 6 H LEU 6 5.894 -21.143 0.722 43 HA LEU 6 HA LEU 6 4.822 -18.417 0.299 44 HB2 LEU 6 2HB LEU 6 3.981 -20.560 2.272 45 HB3 LEU 6 1HB LEU 6 2.999 -19.235 1.643 46 HG LEU 6 HG LEU 6 3.973 -20.628 -0.614 47 HD11 LEU 6 1HD1 LEU 6 3.069 -22.910 -0.166 48 HD12 LEU 6 2HD1 LEU 6 2.870 -22.470 1.529 49 HD13 LEU 6 3HD1 LEU 6 4.483 -22.539 0.819 50 HD21 LEU 6 3HD2 LEU 6 1.494 -21.269 -0.765 51 HD22 LEU 6 1HD2 LEU 6 1.843 -19.545 -0.629 52 HD23 LEU 6 2HD2 LEU 6 1.295 -20.448 0.784 53 H GLY 7 H GLY 7 6.333 -20.368 2.874 54 HA2 GLY 7 2HA GLY 7 6.269 -18.582 5.012 55 HA3 GLY 7 1HA GLY 7 7.644 -19.647 4.698 56 H VAL 8 H VAL 8 8.492 -18.574 2.229 57 HA VAL 8 HA VAL 8 9.946 -16.228 3.145 58 HB VAL 8 HB VAL 8 9.760 -17.841 0.610 59 HG11 VAL 8 1HG1 VAL 8 11.089 -15.195 1.082 60 HG12 VAL 8 2HG1 VAL 8 10.273 -15.793 -0.363 61 HG13 VAL 8 3HG1 VAL 8 11.887 -16.376 0.045 62 HG21 VAL 8 3HG2 VAL 8 12.123 -17.310 2.427 63 HG22 VAL 8 1HG2 VAL 8 11.963 -18.573 1.207 64 HG23 VAL 8 2HG2 VAL 8 11.006 -18.650 2.685 65 H PHE 9 H PHE 9 7.556 -16.841 0.647 66 HA PHE 9 HA PHE 9 7.257 -14.185 -0.326 67 HB2 PHE 9 2HB PHE 9 6.236 -15.890 -1.581 68 HB3 PHE 9 1HB PHE 9 5.547 -16.659 -0.152 69 HD1 PHE 9 2HD PHE 9 5.375 -13.427 -2.059 70 HD2 PHE 9 1HD PHE 9 3.290 -16.328 0.328 71 HE1 PHE 9 2HE PHE 9 3.253 -12.192 -2.410 72 HE2 PHE 9 1HE PHE 9 1.169 -15.090 -0.022 73 HZ PHE 9 HZ PHE 9 1.150 -13.022 -1.391 74 H VAL 10 H VAL 10 5.874 -15.838 2.473 75 HA VAL 10 HA VAL 10 4.048 -13.677 3.180 76 HB VAL 10 HB VAL 10 4.977 -16.317 4.222 77 HG11 VAL 10 1HG1 VAL 10 5.200 -15.254 6.302 78 HG12 VAL 10 2HG1 VAL 10 3.518 -15.783 6.322 79 HG13 VAL 10 3HG1 VAL 10 3.910 -14.104 5.959 80 HG21 VAL 10 3HG2 VAL 10 2.482 -14.964 3.365 81 HG22 VAL 10 1HG2 VAL 10 2.304 -16.143 4.663 82 HG23 VAL 10 2HG2 VAL 10 3.001 -16.631 3.119 83 H ASP 11 H ASP 11 7.281 -14.757 4.280 84 HA ASP 11 HA ASP 11 7.548 -12.834 6.392 85 HB2 ASP 11 2HB ASP 11 8.923 -14.999 5.479 86 HB3 ASP 11 1HB ASP 11 9.948 -13.695 4.876 87 H GLU 12 H GLU 12 7.798 -12.650 2.988 88 HA GLU 12 HA GLU 12 9.259 -10.078 2.989 89 HB2 GLU 12 2HB GLU 12 8.132 -11.943 0.884 90 HB3 GLU 12 1HB GLU 12 8.906 -10.410 0.478 91 HG2 GLU 12 2HG GLU 12 10.591 -11.772 2.339 92 HG3 GLU 12 1HG GLU 12 10.157 -12.915 1.068 93 H THR 13 H THR 13 6.014 -11.344 2.209 94 HA THR 13 HA THR 13 4.900 -8.863 1.298 95 HB THR 13 HB THR 13 4.149 -11.583 1.722 96 HG1 THR 13 1HG THR 13 3.677 -10.720 -0.175 97 HG21 THR 13 3HG2 THR 13 1.915 -11.426 2.625 98 HG22 THR 13 1HG2 THR 13 2.038 -9.673 2.760 99 HG23 THR 13 2HG2 THR 13 3.016 -10.708 3.801 100 H LYS 14 H LYS 14 5.085 -10.365 4.513 101 HA LYS 14 HA LYS 14 3.495 -8.315 5.834 102 HB2 LYS 14 2HB LYS 14 5.219 -10.653 6.575 103 HB3 LYS 14 1HB LYS 14 4.814 -9.488 7.835 104 HG2 LYS 14 2HG LYS 14 2.824 -10.517 8.057 105 HG3 LYS 14 1HG LYS 14 2.414 -9.955 6.435 106 HD2 LYS 14 2HD LYS 14 3.083 -11.958 5.428 107 HD3 LYS 14 1HD LYS 14 4.112 -12.409 6.788 108 HE2 LYS 14 2HE LYS 14 2.395 -13.451 7.859 109 HE3 LYS 14 1HE LYS 14 1.285 -12.102 7.547 110 HZ1 LYS 14 3HZ LYS 14 1.422 -12.901 5.126 111 HZ2 LYS 14 1HZ LYS 14 0.449 -13.778 6.203 112 HZ3 LYS 14 2HZ LYS 14 1.988 -14.362 5.783 113 H GLU 15 H GLU 15 6.999 -9.000 5.561 114 HA GLU 15 HA GLU 15 7.866 -6.780 7.146 115 HB2 GLU 15 2HB GLU 15 9.133 -8.366 4.896 116 HB3 GLU 15 1HB GLU 15 10.024 -7.212 5.889 117 HG2 GLU 15 2HG GLU 15 8.460 -9.525 7.057 118 HG3 GLU 15 1HG GLU 15 10.175 -9.629 6.656 119 H TYR 16 H TYR 16 6.415 -6.929 4.112 120 HA TYR 16 HA TYR 16 7.597 -4.439 3.069 121 HB2 TYR 16 2HB TYR 16 6.267 -6.781 2.075 122 HB3 TYR 16 1HB TYR 16 5.341 -5.366 1.578 123 HD1 TYR 16 2HD TYR 16 6.934 -3.303 0.815 124 HD2 TYR 16 1HD TYR 16 7.950 -7.472 0.633 125 HE1 TYR 16 2HE TYR 16 8.613 -2.817 -0.945 126 HE2 TYR 16 1HE TYR 16 9.627 -6.987 -1.129 127 HH TYR 16 HH TYR 16 10.940 -4.236 -1.707 128 H LEU 17 H LEU 17 4.407 -5.640 4.171 129 HA LEU 17 HA LEU 17 2.976 -3.204 3.795 130 HB2 LEU 17 2HB LEU 17 2.693 -5.437 5.837 131 HB3 LEU 17 1HB LEU 17 1.451 -4.230 5.503 132 HG LEU 17 HG LEU 17 2.607 -6.164 3.472 133 HD11 LEU 17 1HD1 LEU 17 0.723 -6.645 5.472 134 HD12 LEU 17 2HD1 LEU 17 0.943 -7.599 4.004 135 HD13 LEU 17 3HD1 LEU 17 -0.255 -6.305 4.044 136 HD21 LEU 17 3HD2 LEU 17 0.784 -5.292 2.031 137 HD22 LEU 17 1HD2 LEU 17 1.918 -4.020 2.483 138 HD23 LEU 17 2HD2 LEU 17 0.355 -4.136 3.292 139 H GLN 18 H GLN 18 5.022 -4.375 6.425 140 HA GLN 18 HA GLN 18 4.480 -2.152 8.202 141 HB2 GLN 18 2HB GLN 18 5.459 -3.677 9.531 142 HB3 GLN 18 1HB GLN 18 5.871 -4.634 8.116 143 HG2 GLN 18 2HG GLN 18 7.966 -3.481 7.848 144 HG3 GLN 18 1HG GLN 18 7.536 -2.300 9.086 145 HE21 GLN 18 1HE2 GLN 18 8.087 -2.813 11.231 146 HE22 GLN 18 2HE2 GLN 18 8.652 -4.332 11.737 147 H ASN 19 H ASN 19 7.030 -3.032 5.972 148 HA ASN 19 HA ASN 19 8.572 -0.618 6.249 149 HB2 ASN 19 2HB ASN 19 8.375 -2.995 4.490 150 HB3 ASN 19 1HB ASN 19 9.008 -1.552 3.692 151 HD21 ASN 19 1HD2 ASN 19 10.717 -3.771 4.137 152 HD22 ASN 19 2HD2 ASN 19 11.872 -3.353 5.310 153 H LEU 20 H LEU 20 5.680 -1.551 4.690 154 HA LEU 20 HA LEU 20 5.548 0.857 2.985 155 HB2 LEU 20 2HB LEU 20 4.728 -1.082 1.914 156 HB3 LEU 20 1HB LEU 20 3.959 -1.669 3.388 157 HG LEU 20 HG LEU 20 2.370 0.275 3.250 158 HD11 LEU 20 1HD1 LEU 20 3.345 1.916 1.938 159 HD12 LEU 20 2HD1 LEU 20 2.308 1.143 0.740 160 HD13 LEU 20 3HD1 LEU 20 4.025 0.750 0.804 161 HD21 LEU 20 3HD2 LEU 20 2.466 -1.595 0.862 162 HD22 LEU 20 1HD2 LEU 20 1.045 -0.688 1.383 163 HD23 LEU 20 2HD2 LEU 20 1.720 -1.943 2.423 164 H ASN 21 H ASN 21 4.750 -0.142 6.126 165 HA ASN 21 HA ASN 21 2.545 1.801 6.405 166 HB2 ASN 21 2HB ASN 21 3.704 -0.493 7.901 167 HB3 ASN 21 1HB ASN 21 3.047 0.822 8.881 168 HD21 ASN 21 1HD2 ASN 21 1.728 0.063 5.683 169 HD22 ASN 21 2HD2 ASN 21 0.245 -0.543 6.243 170 H ASP 22 H ASP 22 5.854 1.151 7.070 171 HA ASP 22 HA ASP 22 6.300 3.323 8.844 172 HB2 ASP 22 2HB ASP 22 7.984 1.542 7.113 173 HB3 ASP 22 1HB ASP 22 8.737 2.901 7.948 174 H THR 23 H THR 23 6.238 2.838 5.471 175 HA THR 23 HA THR 23 7.298 5.411 4.616 176 HB THR 23 HB THR 23 5.562 3.255 3.408 177 HG1 THR 23 1HG THR 23 7.475 2.354 3.535 178 HG21 THR 23 3HG2 THR 23 7.076 4.908 1.535 179 HG22 THR 23 1HG2 THR 23 5.893 5.845 2.447 180 HG23 THR 23 2HG2 THR 23 5.373 4.450 1.501 181 H LEU 24 H LEU 24 4.076 3.952 5.017 182 HA LEU 24 HA LEU 24 2.627 6.366 4.264 183 HB2 LEU 24 2HB LEU 24 2.101 3.594 5.216 184 HB3 LEU 24 1HB LEU 24 0.843 4.780 5.559 185 HG LEU 24 HG LEU 24 2.055 4.474 2.807 186 HD11 LEU 24 1HD1 LEU 24 -0.488 3.187 3.847 187 HD12 LEU 24 2HD1 LEU 24 1.026 2.322 3.587 188 HD13 LEU 24 3HD1 LEU 24 0.178 3.045 2.220 189 HD21 LEU 24 3HD2 LEU 24 0.561 6.483 3.795 190 HD22 LEU 24 1HD2 LEU 24 -0.738 5.376 3.348 191 HD23 LEU 24 2HD2 LEU 24 0.405 5.934 2.126 192 H LEU 25 H LEU 25 3.944 4.949 7.183 193 HA LEU 25 HA LEU 25 2.381 6.713 8.952 194 HB2 LEU 25 2HB LEU 25 4.648 4.750 9.303 195 HB3 LEU 25 1HB LEU 25 3.952 5.648 10.659 196 HG LEU 25 HG LEU 25 2.242 4.104 8.735 197 HD11 LEU 25 1HD1 LEU 25 3.626 3.135 11.249 198 HD12 LEU 25 2HD1 LEU 25 3.730 2.446 9.629 199 HD13 LEU 25 3HD1 LEU 25 2.230 2.317 10.546 200 HD21 LEU 25 3HD2 LEU 25 1.594 5.943 10.614 201 HD22 LEU 25 1HD2 LEU 25 1.568 4.482 11.604 202 HD23 LEU 25 2HD2 LEU 25 0.535 4.600 10.179 203 H GLU 26 H GLU 26 5.241 6.886 7.160 204 HA GLU 26 HA GLU 26 6.293 9.141 8.765 205 HB2 GLU 26 2HB GLU 26 7.315 7.455 6.465 206 HB3 GLU 26 1HB GLU 26 8.151 8.921 6.978 207 HG2 GLU 26 2HG GLU 26 7.435 6.953 9.099 208 HG3 GLU 26 1HG GLU 26 8.751 6.520 8.007 209 H LEU 27 H LEU 27 4.733 8.187 5.882 210 HA LEU 27 HA LEU 27 4.891 10.652 4.493 211 HB2 LEU 27 2HB LEU 27 4.445 8.556 3.355 212 HB3 LEU 27 1HB LEU 27 3.023 8.279 4.360 213 HG LEU 27 HG LEU 27 2.094 10.450 3.416 214 HD11 LEU 27 1HD1 LEU 27 4.186 9.997 1.277 215 HD12 LEU 27 2HD1 LEU 27 4.389 11.176 2.573 216 HD13 LEU 27 3HD1 LEU 27 3.065 11.352 1.422 217 HD21 LEU 27 3HD2 LEU 27 2.640 8.103 1.572 218 HD22 LEU 27 1HD2 LEU 27 1.432 9.350 1.258 219 HD23 LEU 27 2HD2 LEU 27 1.263 8.289 2.658 220 H GLU 28 H GLU 28 2.797 9.344 6.964 221 HA GLU 28 HA GLU 28 0.688 11.319 6.649 222 HB2 GLU 28 2HB GLU 28 0.185 10.525 9.030 223 HB3 GLU 28 1HB GLU 28 0.122 9.310 7.762 224 HG2 GLU 28 2HG GLU 28 2.239 8.424 8.390 225 HG3 GLU 28 1HG GLU 28 2.592 9.806 9.420 226 H LYS 29 H LYS 29 3.628 11.031 8.594 227 HA LYS 29 HA LYS 29 3.144 13.526 10.029 228 HB2 LYS 29 2HB LYS 29 4.708 12.556 11.336 229 HB3 LYS 29 1HB LYS 29 4.763 11.229 10.186 230 HG2 LYS 29 2HG LYS 29 6.371 12.951 8.890 231 HG3 LYS 29 1HG LYS 29 6.655 13.495 10.547 232 HD2 LYS 29 2HD LYS 29 6.784 10.632 9.637 233 HD3 LYS 29 1HD LYS 29 8.199 11.670 9.808 234 HE2 LYS 29 2HE LYS 29 6.354 11.515 12.148 235 HE3 LYS 29 1HE LYS 29 7.356 10.089 11.817 236 HZ1 LYS 29 3HZ LYS 29 9.271 11.229 12.143 237 HZ2 LYS 29 1HZ LYS 29 8.284 12.167 13.154 238 HZ3 LYS 29 2HZ LYS 29 8.635 12.700 11.579 239 H ASN 30 H ASN 30 4.234 12.516 7.032 240 HA ASN 30 HA ASN 30 4.807 15.267 6.163 241 HB2 ASN 30 2HB ASN 30 6.903 13.738 7.135 242 HB3 ASN 30 1HB ASN 30 6.978 13.418 5.402 243 HD21 ASN 30 1HD2 ASN 30 5.785 16.149 4.805 244 HD22 ASN 30 2HD2 ASN 30 7.062 17.241 5.047 245 HA PRO 31 HA PRO 31 2.850 12.590 3.111 246 HB2 PRO 31 2HB PRO 31 0.555 14.025 2.966 247 HB3 PRO 31 1HB PRO 31 0.863 12.813 4.218 248 HG2 PRO 31 2HG PRO 31 0.812 15.736 4.422 249 HG3 PRO 31 1HG PRO 31 0.510 14.504 5.653 250 HD2 PRO 31 2HD PRO 31 2.883 15.993 5.250 251 HD3 PRO 31 1HD PRO 31 2.618 14.659 6.396 252 H GLU 32 H GLU 32 4.664 15.071 2.797 253 HA GLU 32 HA GLU 32 3.700 15.767 0.064 254 HB2 GLU 32 2HB GLU 32 4.773 18.113 1.359 255 HB3 GLU 32 1HB GLU 32 3.166 17.882 0.675 256 HG2 GLU 32 2HG GLU 32 2.333 16.958 2.740 257 HG3 GLU 32 1HG GLU 32 3.963 16.887 3.420 258 H ASP 33 H ASP 33 6.129 14.629 1.925 259 HA ASP 33 HA ASP 33 8.439 16.031 1.008 260 HB2 ASP 33 2HB ASP 33 9.547 13.836 1.696 261 HB3 ASP 33 1HB ASP 33 8.555 14.606 2.934 262 H MET 34 H MET 34 6.328 13.867 -0.511 263 HA MET 34 HA MET 34 6.260 12.951 -2.665 264 HB2 MET 34 2HB MET 34 8.239 15.182 -2.775 265 HB3 MET 34 1HB MET 34 8.243 14.051 -4.128 266 HG2 MET 34 2HG MET 34 5.621 15.126 -3.153 267 HG3 MET 34 1HG MET 34 6.642 16.155 -4.157 268 HE1 MET 34 3HE MET 34 5.327 16.508 -5.942 269 HE2 MET 34 1HE MET 34 3.875 15.575 -5.552 270 HE3 MET 34 2HE MET 34 4.664 15.370 -7.113 271 H GLU 35 H GLU 35 8.468 12.270 -0.426 272 HA GLU 35 HA GLU 35 10.015 10.422 -2.177 273 HB2 GLU 35 2HB GLU 35 11.695 10.501 -0.466 274 HB3 GLU 35 1HB GLU 35 11.124 12.162 -0.607 275 HG2 GLU 35 2HG GLU 35 9.598 11.801 1.297 276 HG3 GLU 35 1HG GLU 35 10.181 10.143 1.448 277 H LEU 36 H LEU 36 8.140 10.739 0.801 278 HA LEU 36 HA LEU 36 7.993 7.872 1.310 279 HB2 LEU 36 2HB LEU 36 6.266 10.224 2.179 280 HB3 LEU 36 1HB LEU 36 6.216 8.615 2.896 281 HG LEU 36 HG LEU 36 8.477 10.602 2.960 282 HD11 LEU 36 1HD1 LEU 36 7.018 9.070 5.120 283 HD12 LEU 36 2HD1 LEU 36 6.728 10.757 4.701 284 HD13 LEU 36 3HD1 LEU 36 8.280 10.273 5.380 285 HD21 LEU 36 3HD2 LEU 36 8.491 7.620 3.312 286 HD22 LEU 36 1HD2 LEU 36 9.567 8.606 4.300 287 HD23 LEU 36 2HD2 LEU 36 9.696 8.652 2.542 288 H ILE 37 H ILE 37 6.391 10.208 -0.714 289 HA ILE 37 HA ILE 37 3.938 8.749 -1.186 290 HB ILE 37 HB ILE 37 5.513 10.859 -2.690 291 HG12 ILE 37 2HG1 ILE 37 3.009 10.957 -0.978 292 HG13 ILE 37 1HG1 ILE 37 4.601 11.557 -0.516 293 HG21 ILE 37 1HG2 ILE 37 3.596 11.171 -4.114 294 HG22 ILE 37 2HG2 ILE 37 2.652 10.003 -3.190 295 HG23 ILE 37 3HG2 ILE 37 4.011 9.459 -4.172 296 HD11 ILE 37 3HD1 ILE 37 3.568 13.506 -1.280 297 HD12 ILE 37 1HD1 ILE 37 2.683 12.655 -2.546 298 HD13 ILE 37 2HD1 ILE 37 4.409 12.956 -2.729 299 H ASN 38 H ASN 38 7.162 8.791 -2.720 300 HA ASN 38 HA ASN 38 6.260 6.857 -4.763 301 HB2 ASN 38 2HB ASN 38 7.779 8.607 -5.449 302 HB3 ASN 38 1HB ASN 38 8.879 8.239 -4.120 303 HD21 ASN 38 1HD2 ASN 38 7.266 6.234 -6.664 304 HD22 ASN 38 2HD2 ASN 38 8.691 5.451 -7.150 305 H GLU 39 H GLU 39 7.578 6.828 -1.643 306 HA GLU 39 HA GLU 39 8.935 4.245 -1.862 307 HB2 GLU 39 2HB GLU 39 8.130 6.087 0.401 308 HB3 GLU 39 1HB GLU 39 8.964 4.558 0.681 309 HG2 GLU 39 2HG GLU 39 10.062 6.577 -1.268 310 HG3 GLU 39 1HG GLU 39 10.405 6.707 0.457 311 H ALA 40 H ALA 40 5.816 5.482 -1.202 312 HA ALA 40 HA ALA 40 4.773 2.935 -0.110 313 HB1 ALA 40 1HB ALA 40 2.985 5.192 -0.835 314 HB2 ALA 40 2HB ALA 40 4.232 5.564 0.354 315 HB3 ALA 40 3HB ALA 40 3.074 4.271 0.666 316 H PHE 41 H PHE 41 4.165 5.110 -2.901 317 HA PHE 41 HA PHE 41 2.305 3.506 -4.294 318 HB2 PHE 41 2HB PHE 41 2.679 5.704 -5.056 319 HB3 PHE 41 1HB PHE 41 4.431 5.512 -5.034 320 HD1 PHE 41 1HD PHE 41 1.330 4.394 -6.786 321 HD2 PHE 41 2HD PHE 41 5.603 4.793 -6.959 322 HE1 PHE 41 1HE PHE 41 1.294 3.756 -9.183 323 HE2 PHE 41 2HE PHE 41 5.567 4.155 -9.355 324 HZ PHE 41 HZ PHE 41 3.412 3.638 -10.467 325 H ARG 42 H ARG 42 5.803 3.174 -3.977 326 HA ARG 42 HA ARG 42 5.988 1.178 -6.131 327 HB2 ARG 42 2HB ARG 42 8.295 1.379 -5.763 328 HB3 ARG 42 1HB ARG 42 7.707 2.960 -5.258 329 HG2 ARG 42 2HG ARG 42 7.728 2.262 -2.917 330 HG3 ARG 42 1HG ARG 42 8.213 0.630 -3.382 331 HD2 ARG 42 2HD ARG 42 10.030 2.506 -4.591 332 HD3 ARG 42 1HD ARG 42 9.920 2.840 -2.853 333 HE ARG 42 HE ARG 42 10.059 0.085 -2.954 334 HH11 ARG 42 1HH1 ARG 42 11.565 0.638 -5.557 335 HH12 ARG 42 2HH1 ARG 42 13.202 0.659 -4.994 336 HH21 ARG 42 1HH2 ARG 42 12.327 0.978 -1.654 337 HH22 ARG 42 2HH2 ARG 42 13.634 0.850 -2.784 338 H ALA 43 H ALA 43 6.249 1.179 -2.563 339 HA ALA 43 HA ALA 43 6.695 -1.601 -2.178 340 HB1 ALA 43 1HB ALA 43 5.202 -0.852 -0.023 341 HB2 ALA 43 2HB ALA 43 5.661 0.728 -0.658 342 HB3 ALA 43 3HB ALA 43 6.906 -0.438 -0.210 343 H LEU 44 H LEU 44 3.647 0.205 -2.538 344 HA LEU 44 HA LEU 44 1.981 -2.136 -2.156 345 HB2 LEU 44 2HB LEU 44 1.643 0.667 -3.219 346 HB3 LEU 44 1HB LEU 44 0.306 -0.487 -3.269 347 HG LEU 44 HG LEU 44 1.796 -0.207 -0.699 348 HD11 LEU 44 1HD1 LEU 44 0.373 1.711 -0.053 349 HD12 LEU 44 2HD1 LEU 44 -0.254 1.793 -1.699 350 HD13 LEU 44 3HD1 LEU 44 1.449 2.130 -1.385 351 HD21 LEU 44 3HD2 LEU 44 -0.979 -0.866 -1.649 352 HD22 LEU 44 1HD2 LEU 44 -0.732 -0.334 0.014 353 HD23 LEU 44 2HD2 LEU 44 0.075 -1.786 -0.576 354 H HIS 45 H HIS 45 3.224 -0.389 -5.016 355 HA HIS 45 HA HIS 45 1.902 -1.999 -6.992 356 HB2 HIS 45 2HB HIS 45 3.147 0.252 -7.187 357 HB3 HIS 45 1HB HIS 45 4.631 -0.699 -7.210 358 HD1 HIS 45 1HD HIS 45 2.658 0.897 -9.552 359 HD2 HIS 45 2HD HIS 45 3.947 -3.059 -9.275 360 HE1 HIS 45 1HE HIS 45 2.500 -0.075 -11.887 361 H THR 46 H THR 46 4.922 -2.322 -5.189 362 HA THR 46 HA THR 46 5.849 -4.661 -6.637 363 HB THR 46 HB THR 46 6.654 -2.885 -4.472 364 HG1 THR 46 1HG THR 46 8.375 -4.717 -5.660 365 HG21 THR 46 3HG2 THR 46 8.006 -4.538 -3.197 366 HG22 THR 46 1HG2 THR 46 7.199 -5.843 -4.069 367 HG23 THR 46 2HG2 THR 46 6.273 -4.796 -2.992 368 H LEU 47 H LEU 47 3.989 -4.021 -3.704 369 HA LEU 47 HA LEU 47 3.718 -6.797 -2.894 370 HB2 LEU 47 2HB LEU 47 2.957 -4.092 -2.084 371 HB3 LEU 47 1HB LEU 47 1.663 -5.258 -1.784 372 HG LEU 47 HG LEU 47 4.541 -5.512 -0.874 373 HD11 LEU 47 1HD1 LEU 47 1.971 -4.694 0.452 374 HD12 LEU 47 2HD1 LEU 47 3.577 -3.982 0.606 375 HD13 LEU 47 3HD1 LEU 47 3.212 -5.514 1.399 376 HD21 LEU 47 3HD2 LEU 47 4.005 -7.731 -0.979 377 HD22 LEU 47 1HD2 LEU 47 2.273 -7.409 -1.052 378 HD23 LEU 47 2HD2 LEU 47 3.109 -7.388 0.500 379 H LYS 48 H LYS 48 1.837 -4.518 -4.856 380 HA LYS 48 HA LYS 48 -0.601 -5.942 -5.104 381 HB2 LYS 48 2HB LYS 48 0.402 -3.593 -5.960 382 HB3 LYS 48 1HB LYS 48 0.603 -4.517 -7.445 383 HG2 LYS 48 2HG LYS 48 -1.945 -3.907 -5.945 384 HG3 LYS 48 1HG LYS 48 -1.555 -3.563 -7.630 385 HD2 LYS 48 2HD LYS 48 -1.881 -6.331 -6.446 386 HD3 LYS 48 1HD LYS 48 -3.085 -5.499 -7.434 387 HE2 LYS 48 2HE LYS 48 -0.306 -5.746 -8.528 388 HE3 LYS 48 1HE LYS 48 -1.355 -7.178 -8.565 389 HZ1 LYS 48 3HZ LYS 48 -2.123 -6.172 -10.434 390 HZ2 LYS 48 1HZ LYS 48 -1.667 -4.618 -9.930 391 HZ3 LYS 48 2HZ LYS 48 -3.084 -5.327 -9.316 392 H GLY 49 H GLY 49 2.496 -6.228 -6.820 393 HA2 GLY 49 2HA GLY 49 1.550 -8.158 -8.760 394 HA3 GLY 49 1HA GLY 49 3.242 -7.813 -8.395 395 H MET 50 H MET 50 3.715 -8.565 -5.922 396 HA MET 50 HA MET 50 3.792 -11.386 -5.902 397 HB2 MET 50 2HB MET 50 3.765 -9.410 -3.595 398 HB3 MET 50 1HB MET 50 4.372 -11.062 -3.509 399 HG2 MET 50 2HG MET 50 5.908 -10.387 -5.481 400 HG3 MET 50 1HG MET 50 5.504 -8.727 -5.044 401 HE1 MET 50 3HE MET 50 5.138 -10.047 -1.635 402 HE2 MET 50 1HE MET 50 5.076 -8.442 -2.377 403 HE3 MET 50 2HE MET 50 6.328 -8.825 -1.196 404 H ALA 51 H ALA 51 1.183 -9.239 -5.033 405 HA ALA 51 HA ALA 51 -0.258 -11.316 -3.501 406 HB1 ALA 51 1HB ALA 51 -0.626 -8.419 -4.223 407 HB2 ALA 51 2HB ALA 51 -0.516 -9.153 -2.623 408 HB3 ALA 51 3HB ALA 51 -1.985 -9.344 -3.583 409 H GLY 52 H GLY 52 -0.017 -10.207 -6.749 410 HA2 GLY 52 2HA GLY 52 -2.712 -11.163 -7.463 411 HA3 GLY 52 1HA GLY 52 -1.563 -10.399 -8.564 412 H THR 53 H THR 53 -0.634 -13.012 -6.441 413 HA THR 53 HA THR 53 -0.915 -15.051 -8.513 414 HB THR 53 HB THR 53 1.590 -13.569 -7.889 415 HG1 THR 53 1HG THR 53 0.299 -13.517 -9.887 416 HG21 THR 53 3HG2 THR 53 2.660 -15.776 -9.030 417 HG22 THR 53 1HG2 THR 53 1.393 -16.523 -8.057 418 HG23 THR 53 2HG2 THR 53 2.617 -15.513 -7.286 419 H MET 54 H MET 54 0.944 -14.283 -5.660 420 HA MET 54 HA MET 54 0.235 -16.939 -4.490 421 HB2 MET 54 2HB MET 54 2.541 -15.108 -4.500 422 HB3 MET 54 1HB MET 54 2.213 -15.893 -2.958 423 HG2 MET 54 2HG MET 54 1.970 -18.041 -4.529 424 HG3 MET 54 1HG MET 54 3.050 -17.103 -5.559 425 HE1 MET 54 3HE MET 54 6.186 -16.550 -3.761 426 HE2 MET 54 1HE MET 54 4.909 -15.483 -3.162 427 HE3 MET 54 2HE MET 54 4.955 -15.938 -4.863 428 H GLY 55 H GLY 55 -0.613 -13.728 -4.383 429 HA2 GLY 55 2HA GLY 55 -1.482 -13.981 -1.522 430 HA3 GLY 55 1HA GLY 55 -1.015 -12.431 -2.235 431 H PHE 56 H PHE 56 -2.465 -14.305 -4.556 432 HA PHE 56 HA PHE 56 -4.641 -14.294 -5.514 433 HB2 PHE 56 2HB PHE 56 -4.930 -14.276 -2.665 434 HB3 PHE 56 1HB PHE 56 -6.137 -13.177 -3.336 435 HD1 PHE 56 2HD PHE 56 -4.643 -16.542 -4.095 436 HD2 PHE 56 1HD PHE 56 -8.172 -14.095 -3.984 437 HE1 PHE 56 2HE PHE 56 -6.010 -18.480 -4.820 438 HE2 PHE 56 1HE PHE 56 -9.538 -16.033 -4.708 439 HZ PHE 56 HZ PHE 56 -8.458 -18.225 -5.126 440 H SER 57 H SER 57 -5.077 -12.699 -6.974 441 HA SER 57 HA SER 57 -4.299 -10.011 -6.753 442 HB2 SER 57 2HB SER 57 -6.659 -10.931 -8.362 443 HB3 SER 57 1HB SER 57 -5.432 -9.748 -8.797 444 HG SER 57 HG SER 57 -3.945 -11.412 -8.993 445 H SER 58 H SER 58 -6.936 -11.571 -5.274 446 HA SER 58 HA SER 58 -8.803 -9.409 -5.132 447 HB2 SER 58 2HB SER 58 -8.207 -11.691 -3.218 448 HB3 SER 58 1HB SER 58 -9.670 -10.708 -3.190 449 HG SER 58 HG SER 58 -10.367 -12.144 -4.565 450 H MET 59 H MET 59 -6.163 -10.492 -2.992 451 HA MET 59 HA MET 59 -6.438 -8.124 -1.286 452 HB2 MET 59 2HB MET 59 -5.800 -10.299 -0.352 453 HB3 MET 59 1HB MET 59 -4.424 -10.389 -1.453 454 HG2 MET 59 2HG MET 59 -3.874 -8.021 -0.318 455 HG3 MET 59 1HG MET 59 -4.775 -8.748 1.011 456 HE1 MET 59 3HE MET 59 -2.515 -9.399 -1.758 457 HE2 MET 59 1HE MET 59 -2.399 -11.142 -1.481 458 HE3 MET 59 2HE MET 59 -1.034 -10.095 -1.105 459 H ALA 60 H ALA 60 -4.783 -9.032 -4.177 460 HA ALA 60 HA ALA 60 -2.582 -7.115 -3.907 461 HB1 ALA 60 1HB ALA 60 -3.166 -9.353 -5.426 462 HB2 ALA 60 2HB ALA 60 -1.836 -8.243 -5.745 463 HB3 ALA 60 3HB ALA 60 -3.371 -8.044 -6.590 464 H LYS 61 H LYS 61 -5.791 -7.228 -5.401 465 HA LYS 61 HA LYS 61 -5.651 -4.747 -6.857 466 HB2 LYS 61 2HB LYS 61 -7.558 -6.773 -6.046 467 HB3 LYS 61 1HB LYS 61 -8.258 -5.171 -5.809 468 HG2 LYS 61 2HG LYS 61 -8.757 -5.828 -8.059 469 HG3 LYS 61 1HG LYS 61 -7.490 -4.602 -8.141 470 HD2 LYS 61 2HD LYS 61 -6.114 -6.048 -9.172 471 HD3 LYS 61 1HD LYS 61 -6.267 -7.172 -7.818 472 HE2 LYS 61 2HE LYS 61 -7.703 -8.512 -8.972 473 HE3 LYS 61 1HE LYS 61 -8.644 -7.126 -9.561 474 HZ1 LYS 61 3HZ LYS 61 -6.587 -6.644 -10.975 475 HZ2 LYS 61 1HZ LYS 61 -7.593 -7.918 -11.465 476 HZ3 LYS 61 2HZ LYS 61 -6.138 -8.251 -10.653 477 H LEU 62 H LEU 62 -6.388 -5.675 -3.594 478 HA LEU 62 HA LEU 62 -7.279 -3.191 -2.523 479 HB2 LEU 62 2HB LEU 62 -7.508 -5.424 -1.482 480 HB3 LEU 62 1HB LEU 62 -5.754 -5.535 -1.328 481 HG LEU 62 HG LEU 62 -5.695 -3.704 0.210 482 HD11 LEU 62 1HD1 LEU 62 -7.361 -2.256 -0.825 483 HD12 LEU 62 2HD1 LEU 62 -7.804 -2.518 0.862 484 HD13 LEU 62 3HD1 LEU 62 -8.646 -3.393 -0.418 485 HD21 LEU 62 3HD2 LEU 62 -6.604 -4.800 2.026 486 HD22 LEU 62 1HD2 LEU 62 -6.761 -6.089 0.832 487 HD23 LEU 62 2HD2 LEU 62 -8.147 -5.071 1.216 488 H CYS 63 H CYS 63 -4.090 -4.622 -3.082 489 HA CYS 63 HA CYS 63 -2.623 -2.490 -1.726 490 HB2 CYS 63 2HB CYS 63 -2.166 -5.071 -3.005 491 HB3 CYS 63 1HB CYS 63 -0.936 -3.900 -3.475 492 HG CYS 63 HG CYS 63 -1.490 -4.802 -0.539 493 H HIS 64 H HIS 64 -3.787 -3.185 -4.960 494 HA HIS 64 HA HIS 64 -2.142 -1.246 -6.366 495 HB2 HIS 64 2HB HIS 64 -3.513 -3.299 -7.201 496 HB3 HIS 64 1HB HIS 64 -4.900 -2.214 -7.145 497 HD1 HIS 64 1HD HIS 64 -1.316 -1.722 -8.392 498 HD2 HIS 64 2HD HIS 64 -5.246 -1.239 -9.695 499 HE1 HIS 64 1HE HIS 64 -1.182 -0.713 -10.712 500 H THR 65 H THR 65 -5.103 -1.208 -4.541 501 HA THR 65 HA THR 65 -6.162 1.323 -5.440 502 HB THR 65 HB THR 65 -6.692 0.480 -2.671 503 HG1 THR 65 1HG THR 65 -7.439 -1.309 -4.708 504 HG21 THR 65 3HG2 THR 65 -8.989 0.498 -3.502 505 HG22 THR 65 1HG2 THR 65 -8.399 0.655 -5.155 506 HG23 THR 65 2HG2 THR 65 -8.143 1.962 -3.999 507 H LEU 66 H LEU 66 -4.605 0.482 -2.332 508 HA LEU 66 HA LEU 66 -4.264 3.092 -1.312 509 HB2 LEU 66 2HB LEU 66 -2.269 0.818 -1.047 510 HB3 LEU 66 1HB LEU 66 -2.664 2.047 0.151 511 HG LEU 66 HG LEU 66 -4.310 -0.325 -0.722 512 HD11 LEU 66 1HD1 LEU 66 -4.573 -0.325 1.869 513 HD12 LEU 66 2HD1 LEU 66 -3.203 0.785 1.842 514 HD13 LEU 66 3HD1 LEU 66 -3.037 -0.839 1.173 515 HD21 LEU 66 3HD2 LEU 66 -5.243 2.352 0.159 516 HD22 LEU 66 1HD2 LEU 66 -5.964 0.978 0.998 517 HD23 LEU 66 2HD2 LEU 66 -6.097 1.110 -0.756 518 H GLU 67 H GLU 67 -2.346 1.269 -3.646 519 HA GLU 67 HA GLU 67 -0.119 3.111 -3.810 520 HB2 GLU 67 2HB GLU 67 0.211 0.894 -4.567 521 HB3 GLU 67 1HB GLU 67 -1.315 0.873 -5.442 522 HG2 GLU 67 2HG GLU 67 -0.319 2.654 -6.971 523 HG3 GLU 67 1HG GLU 67 1.231 2.330 -6.195 524 H ASN 68 H ASN 68 -3.067 2.608 -5.746 525 HA ASN 68 HA ASN 68 -2.708 4.534 -7.740 526 HB2 ASN 68 2HB ASN 68 -5.043 3.519 -6.146 527 HB3 ASN 68 1HB ASN 68 -5.282 4.719 -7.415 528 HD21 ASN 68 1HD2 ASN 68 -3.406 3.847 -9.336 529 HD22 ASN 68 2HD2 ASN 68 -3.848 2.307 -9.895 530 H ILE 69 H ILE 69 -3.870 4.940 -4.415 531 HA ILE 69 HA ILE 69 -4.446 7.754 -4.641 532 HB ILE 69 HB ILE 69 -3.624 6.246 -2.154 533 HG12 ILE 69 2HG1 ILE 69 -5.407 5.099 -3.693 534 HG13 ILE 69 1HG1 ILE 69 -5.753 5.273 -1.980 535 HG21 ILE 69 1HG2 ILE 69 -5.567 7.814 -1.318 536 HG22 ILE 69 2HG2 ILE 69 -5.217 8.711 -2.789 537 HG23 ILE 69 3HG2 ILE 69 -3.958 8.484 -1.575 538 HD11 ILE 69 3HD1 ILE 69 -7.237 7.052 -2.346 539 HD12 ILE 69 1HD1 ILE 69 -7.576 5.960 -3.689 540 HD13 ILE 69 2HD1 ILE 69 -6.576 7.389 -3.950 541 H LEU 70 H LEU 70 -1.704 5.837 -3.866 542 HA LEU 70 HA LEU 70 -0.008 8.112 -3.149 543 HB2 LEU 70 2HB LEU 70 0.656 5.230 -3.849 544 HB3 LEU 70 1HB LEU 70 1.734 6.368 -3.034 545 HG LEU 70 HG LEU 70 -0.989 5.736 -1.926 546 HD11 LEU 70 1HD1 LEU 70 0.961 4.336 -0.445 547 HD12 LEU 70 2HD1 LEU 70 1.244 3.933 -2.139 548 HD13 LEU 70 3HD1 LEU 70 -0.341 3.651 -1.417 549 HD21 LEU 70 3HD2 LEU 70 1.208 6.241 -0.085 550 HD22 LEU 70 1HD2 LEU 70 -0.339 7.075 -0.236 551 HD23 LEU 70 2HD2 LEU 70 1.022 7.550 -1.253 552 H ASP 71 H ASP 71 -1.224 6.689 -5.942 553 HA ASP 71 HA ASP 71 1.008 7.435 -7.695 554 HB2 ASP 71 2HB ASP 71 -0.635 5.488 -7.998 555 HB3 ASP 71 1HB ASP 71 -1.851 6.700 -8.402 556 H LYS 72 H LYS 72 -2.262 8.591 -6.855 557 HA LYS 72 HA LYS 72 -2.194 10.904 -8.594 558 HB2 LYS 72 2HB LYS 72 -3.709 9.932 -6.210 559 HB3 LYS 72 1HB LYS 72 -3.934 11.604 -6.735 560 HG2 LYS 72 2HG LYS 72 -5.543 10.595 -8.019 561 HG3 LYS 72 1HG LYS 72 -4.155 10.414 -9.097 562 HD2 LYS 72 2HD LYS 72 -5.160 8.258 -8.935 563 HD3 LYS 72 1HD LYS 72 -3.691 8.238 -7.967 564 HE2 LYS 72 2HE LYS 72 -5.094 7.351 -6.368 565 HE3 LYS 72 1HE LYS 72 -5.488 9.061 -6.095 566 HZ1 LYS 72 3HZ LYS 72 -6.878 7.215 -7.966 567 HZ2 LYS 72 1HZ LYS 72 -7.205 8.873 -7.819 568 HZ3 LYS 72 2HZ LYS 72 -7.508 7.829 -6.513 569 H ALA 73 H ALA 73 -1.290 10.181 -5.346 570 HA ALA 73 HA ALA 73 -0.653 12.731 -4.304 571 HB1 ALA 73 1HB ALA 73 0.392 9.916 -3.957 572 HB2 ALA 73 2HB ALA 73 -0.656 10.834 -2.872 573 HB3 ALA 73 3HB ALA 73 1.053 11.249 -3.007 574 H ARG 74 H ARG 74 1.182 10.457 -6.318 575 HA ARG 74 HA ARG 74 3.446 12.351 -6.496 576 HB2 ARG 74 2HB ARG 74 4.498 10.497 -7.722 577 HB3 ARG 74 1HB ARG 74 3.759 9.885 -6.241 578 HG2 ARG 74 2HG ARG 74 1.924 8.965 -7.399 579 HG3 ARG 74 1HG ARG 74 2.247 9.912 -8.849 580 HD2 ARG 74 2HD ARG 74 4.603 8.540 -8.608 581 HD3 ARG 74 1HD ARG 74 3.443 7.347 -7.986 582 HE ARG 74 HE ARG 74 2.097 7.848 -10.110 583 HH11 ARG 74 1HH1 ARG 74 4.447 9.909 -10.695 584 HH12 ARG 74 2HH1 ARG 74 5.185 9.092 -12.032 585 HH21 ARG 74 1HH2 ARG 74 3.498 6.114 -11.487 586 HH22 ARG 74 2HH2 ARG 74 4.650 6.944 -12.479 587 H ASN 75 H ASN 75 0.541 11.541 -8.138 588 HA ASN 75 HA ASN 75 1.457 12.642 -10.745 589 HB2 ASN 75 2HB ASN 75 -0.100 10.599 -10.295 590 HB3 ASN 75 1HB ASN 75 -1.343 11.811 -9.978 591 HD21 ASN 75 1HD2 ASN 75 -1.005 13.730 -11.870 592 HD22 ASN 75 2HD2 ASN 75 -1.070 13.085 -13.438 593 H SER 76 H SER 76 0.461 13.873 -7.842 594 HA SER 76 HA SER 76 -0.128 16.079 -7.246 595 HB2 SER 76 2HB SER 76 0.785 16.198 -9.897 596 HB3 SER 76 1HB SER 76 -0.756 17.052 -9.914 597 HG SER 76 HG SER 76 0.216 18.621 -8.925 598 H GLU 77 H GLU 77 -2.084 13.770 -7.864 599 HA GLU 77 HA GLU 77 -4.474 15.371 -8.580 600 HB2 GLU 77 2HB GLU 77 -3.845 12.443 -8.355 601 HB3 GLU 77 1HB GLU 77 -5.490 13.017 -8.613 602 HG2 GLU 77 2HG GLU 77 -3.103 13.638 -10.378 603 HG3 GLU 77 1HG GLU 77 -4.369 12.465 -10.752 604 H ILE 78 H ILE 78 -3.087 13.541 -5.930 605 HA ILE 78 HA ILE 78 -5.102 14.820 -4.116 606 HB ILE 78 HB ILE 78 -5.318 12.581 -2.963 607 HG12 ILE 78 2HG1 ILE 78 -4.716 10.836 -5.007 608 HG13 ILE 78 1HG1 ILE 78 -3.354 11.960 -5.027 609 HG21 ILE 78 1HG2 ILE 78 -6.255 13.127 -5.761 610 HG22 ILE 78 2HG2 ILE 78 -7.188 13.060 -4.267 611 HG23 ILE 78 3HG2 ILE 78 -6.626 11.570 -5.024 612 HD11 ILE 78 3HD1 ILE 78 -3.834 9.820 -3.227 613 HD12 ILE 78 1HD1 ILE 78 -3.940 11.327 -2.315 614 HD13 ILE 78 2HD1 ILE 78 -2.485 10.955 -3.245 615 H LYS 79 H LYS 79 -4.431 14.074 -1.740 616 HA LYS 79 HA LYS 79 -1.522 13.833 -1.377 617 HB2 LYS 79 2HB LYS 79 -3.224 16.255 -0.726 618 HB3 LYS 79 1HB LYS 79 -1.666 15.975 0.054 619 HG2 LYS 79 2HG LYS 79 -2.137 16.191 -2.932 620 HG3 LYS 79 1HG LYS 79 -1.401 17.431 -1.917 621 HD2 LYS 79 2HD LYS 79 -0.276 14.791 -2.799 622 HD3 LYS 79 1HD LYS 79 0.500 16.372 -2.744 623 HE2 LYS 79 2HE LYS 79 0.629 16.265 -0.297 624 HE3 LYS 79 1HE LYS 79 -0.244 14.717 -0.303 625 HZ1 LYS 79 3HZ LYS 79 1.517 13.909 -1.865 626 HZ2 LYS 79 1HZ LYS 79 2.050 14.191 -0.281 627 HZ3 LYS 79 2HZ LYS 79 2.402 15.314 -1.507 628 H ILE 80 H ILE 80 -1.045 13.057 0.788 629 HA ILE 80 HA ILE 80 -3.153 11.644 2.112 630 HB ILE 80 HB ILE 80 -0.344 12.439 2.687 631 HG12 ILE 80 2HG1 ILE 80 0.011 10.044 2.547 632 HG13 ILE 80 1HG1 ILE 80 -1.732 9.763 2.546 633 HG21 ILE 80 1HG2 ILE 80 -0.514 10.992 4.777 634 HG22 ILE 80 2HG2 ILE 80 -2.265 11.155 4.628 635 HG23 ILE 80 3HG2 ILE 80 -1.264 12.583 4.893 636 HD11 ILE 80 3HD1 ILE 80 -0.805 9.622 0.259 637 HD12 ILE 80 1HD1 ILE 80 -0.195 11.269 0.409 638 HD13 ILE 80 2HD1 ILE 80 -1.933 10.968 0.408 639 H THR 81 H THR 81 -4.789 12.955 2.624 640 HA THR 81 HA THR 81 -4.481 15.450 4.161 641 HB THR 81 HB THR 81 -6.874 15.568 3.769 642 HG1 THR 81 1HG THR 81 -8.040 13.832 3.545 643 HG21 THR 81 3HG2 THR 81 -6.655 15.893 1.538 644 HG22 THR 81 1HG2 THR 81 -6.264 14.197 1.255 645 HG23 THR 81 2HG2 THR 81 -4.999 15.322 1.749 646 H SER 82 H SER 82 -4.043 12.426 5.112 647 HA SER 82 HA SER 82 -4.101 11.457 7.283 648 HB2 SER 82 2HB SER 82 -6.031 13.544 8.221 649 HB3 SER 82 1HB SER 82 -4.658 12.833 9.065 650 HG SER 82 HG SER 82 -4.518 15.104 8.190 651 H ASP 83 H ASP 83 -6.741 12.233 5.279 652 HA ASP 83 HA ASP 83 -8.543 10.290 6.655 653 HB2 ASP 83 2HB ASP 83 -8.849 12.732 4.955 654 HB3 ASP 83 1HB ASP 83 -10.072 11.474 4.779 655 H LEU 84 H LEU 84 -7.121 11.258 3.524 656 HA LEU 84 HA LEU 84 -8.156 9.108 1.951 657 HB2 LEU 84 2HB LEU 84 -5.426 10.453 1.837 658 HB3 LEU 84 1HB LEU 84 -6.233 9.629 0.503 659 HG LEU 84 HG LEU 84 -6.917 12.265 1.784 660 HD11 LEU 84 1HD1 LEU 84 -6.588 11.234 -1.043 661 HD12 LEU 84 2HD1 LEU 84 -5.547 12.375 -0.191 662 HD13 LEU 84 3HD1 LEU 84 -7.178 12.852 -0.666 663 HD21 LEU 84 3HD2 LEU 84 -8.782 10.334 0.404 664 HD22 LEU 84 1HD2 LEU 84 -9.056 12.074 0.315 665 HD23 LEU 84 2HD2 LEU 84 -9.053 11.261 1.881 666 H LEU 85 H LEU 85 -5.667 9.388 4.351 667 HA LEU 85 HA LEU 85 -4.414 6.792 3.912 668 HB2 LEU 85 2HB LEU 85 -4.474 8.891 6.093 669 HB3 LEU 85 1HB LEU 85 -3.548 7.399 6.274 670 HG LEU 85 HG LEU 85 -3.182 9.578 4.218 671 HD11 LEU 85 1HD1 LEU 85 -0.760 9.192 5.169 672 HD12 LEU 85 2HD1 LEU 85 -1.611 8.426 6.509 673 HD13 LEU 85 3HD1 LEU 85 -1.923 10.117 6.120 674 HD21 LEU 85 3HD2 LEU 85 -2.417 6.690 4.164 675 HD22 LEU 85 1HD2 LEU 85 -1.217 7.856 3.604 676 HD23 LEU 85 2HD2 LEU 85 -2.797 7.773 2.824 677 H ASP 86 H ASP 86 -6.595 8.159 6.386 678 HA ASP 86 HA ASP 86 -7.113 5.924 7.963 679 HB2 ASP 86 2HB ASP 86 -8.027 8.382 7.940 680 HB3 ASP 86 1HB ASP 86 -9.346 7.699 6.990 681 H LYS 87 H LYS 87 -8.171 6.524 4.667 682 HA LYS 87 HA LYS 87 -10.035 4.215 4.695 683 HB2 LYS 87 2HB LYS 87 -9.129 6.046 2.447 684 HB3 LYS 87 1HB LYS 87 -10.559 5.014 2.448 685 HG2 LYS 87 2HG LYS 87 -10.048 7.399 4.249 686 HG3 LYS 87 1HG LYS 87 -11.248 7.290 2.962 687 HD2 LYS 87 2HD LYS 87 -12.201 5.278 4.247 688 HD3 LYS 87 1HD LYS 87 -11.201 5.815 5.598 689 HE2 LYS 87 2HE LYS 87 -12.960 7.162 6.139 690 HE3 LYS 87 1HE LYS 87 -12.458 8.158 4.758 691 HZ1 LYS 87 3HZ LYS 87 -14.251 5.794 4.587 692 HZ2 LYS 87 1HZ LYS 87 -13.809 6.813 3.304 693 HZ3 LYS 87 2HZ LYS 87 -14.780 7.409 4.566 694 H ILE 88 H ILE 88 -7.071 5.225 2.970 695 HA ILE 88 HA ILE 88 -6.624 2.721 1.649 696 HB ILE 88 HB ILE 88 -4.959 5.085 2.507 697 HG12 ILE 88 2HG1 ILE 88 -5.181 4.268 -0.308 698 HG13 ILE 88 1HG1 ILE 88 -6.704 4.725 0.452 699 HG21 ILE 88 1HG2 ILE 88 -3.377 3.804 0.701 700 HG22 ILE 88 2HG2 ILE 88 -4.041 2.443 1.606 701 HG23 ILE 88 3HG2 ILE 88 -3.164 3.719 2.449 702 HD11 ILE 88 3HD1 ILE 88 -6.125 6.879 0.171 703 HD12 ILE 88 1HD1 ILE 88 -4.520 6.419 -0.396 704 HD13 ILE 88 2HD1 ILE 88 -4.820 6.623 1.329 705 H PHE 89 H PHE 89 -5.948 3.958 4.847 706 HA PHE 89 HA PHE 89 -4.152 1.862 5.699 707 HB2 PHE 89 2HB PHE 89 -4.296 4.088 6.759 708 HB3 PHE 89 1HB PHE 89 -5.967 3.758 7.215 709 HD1 PHE 89 1HD PHE 89 -2.575 2.162 7.499 710 HD2 PHE 89 2HD PHE 89 -6.366 2.953 9.356 711 HE1 PHE 89 1HE PHE 89 -1.799 1.030 9.564 712 HE2 PHE 89 2HE PHE 89 -5.592 1.821 11.421 713 HZ PHE 89 HZ PHE 89 -3.308 0.858 11.526 714 H ALA 90 H ALA 90 -7.590 2.394 5.734 715 HA ALA 90 HA ALA 90 -8.335 0.092 7.320 716 HB1 ALA 90 1HB ALA 90 -9.558 2.188 5.650 717 HB2 ALA 90 2HB ALA 90 -10.191 1.420 7.105 718 HB3 ALA 90 3HB ALA 90 -10.406 0.647 5.536 719 H GLY 91 H GLY 91 -7.612 0.790 3.971 720 HA2 GLY 91 2HA GLY 91 -8.424 -1.750 2.874 721 HA3 GLY 91 1HA GLY 91 -7.307 -0.605 2.116 722 H VAL 92 H VAL 92 -5.365 -0.380 4.063 723 HA VAL 92 HA VAL 92 -3.755 -2.723 3.661 724 HB VAL 92 HB VAL 92 -3.680 -0.165 5.209 725 HG11 VAL 92 1HG1 VAL 92 -1.740 -2.446 5.726 726 HG12 VAL 92 2HG1 VAL 92 -2.929 -1.841 6.880 727 HG13 VAL 92 3HG1 VAL 92 -1.600 -0.807 6.361 728 HG21 VAL 92 3HG2 VAL 92 -2.374 0.332 3.447 729 HG22 VAL 92 1HG2 VAL 92 -2.486 -1.331 2.871 730 HG23 VAL 92 2HG2 VAL 92 -1.208 -0.872 3.995 731 H ASP 93 H ASP 93 -6.169 -1.807 5.964 732 HA ASP 93 HA ASP 93 -5.425 -3.564 8.137 733 HB2 ASP 93 2HB ASP 93 -7.101 -1.486 7.818 734 HB3 ASP 93 1HB ASP 93 -8.260 -2.794 7.572 735 H MET 94 H MET 94 -7.235 -3.947 5.144 736 HA MET 94 HA MET 94 -8.436 -6.500 5.867 737 HB2 MET 94 2HB MET 94 -8.130 -4.741 3.467 738 HB3 MET 94 1HB MET 94 -8.551 -6.431 3.187 739 HG2 MET 94 2HG MET 94 -10.684 -5.957 3.714 740 HG3 MET 94 1HG MET 94 -10.158 -5.543 5.345 741 HE1 MET 94 3HE MET 94 -9.604 -3.404 1.721 742 HE2 MET 94 1HE MET 94 -11.343 -3.095 1.831 743 HE3 MET 94 2HE MET 94 -10.732 -4.746 1.902 744 H ILE 95 H ILE 95 -5.702 -5.527 3.739 745 HA ILE 95 HA ILE 95 -4.801 -8.101 3.041 746 HB ILE 95 HB ILE 95 -2.686 -6.848 2.662 747 HG12 ILE 95 2HG1 ILE 95 -4.154 -4.499 3.857 748 HG13 ILE 95 1HG1 ILE 95 -2.974 -5.446 4.765 749 HG21 ILE 95 1HG2 ILE 95 -3.575 -5.822 0.834 750 HG22 ILE 95 2HG2 ILE 95 -4.754 -4.929 1.797 751 HG23 ILE 95 3HG2 ILE 95 -5.054 -6.617 1.378 752 HD11 ILE 95 3HD1 ILE 95 -1.297 -4.974 2.954 753 HD12 ILE 95 1HD1 ILE 95 -1.832 -3.529 3.810 754 HD13 ILE 95 2HD1 ILE 95 -2.474 -3.894 2.208 755 H THR 96 H THR 96 -4.334 -6.189 5.962 756 HA THR 96 HA THR 96 -2.259 -7.918 7.062 757 HB THR 96 HB THR 96 -4.129 -5.833 8.236 758 HG1 THR 96 1HG THR 96 -2.717 -4.499 7.482 759 HG21 THR 96 3HG2 THR 96 -1.566 -6.530 9.563 760 HG22 THR 96 1HG2 THR 96 -2.871 -7.706 9.716 761 HG23 THR 96 2HG2 THR 96 -3.108 -6.049 10.270 762 H ARG 97 H ARG 97 -5.787 -7.696 7.213 763 HA ARG 97 HA ARG 97 -5.938 -9.834 9.253 764 HB2 ARG 97 2HB ARG 97 -7.967 -8.159 7.749 765 HB3 ARG 97 1HB ARG 97 -8.406 -9.356 8.969 766 HG2 ARG 97 2HG ARG 97 -7.558 -8.099 10.710 767 HG3 ARG 97 1HG ARG 97 -6.333 -7.333 9.697 768 HD2 ARG 97 2HD ARG 97 -7.702 -5.521 9.633 769 HD3 ARG 97 1HD ARG 97 -8.781 -6.489 8.607 770 HE ARG 97 HE ARG 97 -8.975 -6.810 11.560 771 HH11 ARG 97 1HH2 ARG 97 -10.104 -4.762 9.155 772 HH12 ARG 97 2HH2 ARG 97 -11.786 -5.043 9.458 773 HH21 ARG 97 1HH1 ARG 97 -11.221 -7.624 11.702 774 HH22 ARG 97 2HH1 ARG 97 -12.418 -6.663 10.900 775 H MET 98 H MET 98 -6.550 -9.450 5.752 776 HA MET 98 HA MET 98 -7.760 -12.105 5.553 777 HB2 MET 98 2HB MET 98 -7.680 -11.642 3.134 778 HB3 MET 98 1HB MET 98 -8.303 -10.247 4.007 779 HG2 MET 98 2HG MET 98 -5.715 -9.579 4.025 780 HG3 MET 98 1HG MET 98 -5.707 -10.589 2.580 781 HE1 MET 98 3HE MET 98 -9.017 -9.773 1.442 782 HE2 MET 98 1HE MET 98 -7.530 -10.645 1.043 783 HE3 MET 98 2HE MET 98 -7.982 -9.205 0.134 784 H VAL 99 H VAL 99 -4.562 -10.752 5.470 785 HA VAL 99 HA VAL 99 -3.341 -13.117 4.261 786 HB VAL 99 HB VAL 99 -2.411 -10.581 5.619 787 HG11 VAL 99 1HG1 VAL 99 -0.088 -11.477 4.680 788 HG12 VAL 99 2HG1 VAL 99 -0.847 -13.045 4.965 789 HG13 VAL 99 3HG1 VAL 99 -0.641 -11.909 6.299 790 HG21 VAL 99 3HG2 VAL 99 -3.232 -10.537 3.248 791 HG22 VAL 99 1HG2 VAL 99 -1.945 -11.666 2.825 792 HG23 VAL 99 2HG2 VAL 99 -1.545 -10.049 3.405 793 H ASP 100 H ASP 100 -3.882 -11.773 7.521 794 HA ASP 100 HA ASP 100 -2.293 -13.698 8.964 795 HB2 ASP 100 2HB ASP 100 -3.980 -11.473 9.461 796 HB3 ASP 100 1HB ASP 100 -4.676 -12.819 10.364 797 H LYS 101 H LYS 101 -5.597 -13.616 7.759 798 HA LYS 101 HA LYS 101 -6.365 -16.166 8.934 799 HB2 LYS 101 2HB LYS 101 -8.428 -15.560 8.095 800 HB3 LYS 101 1HB LYS 101 -7.658 -13.985 7.931 801 HG2 LYS 101 2HG LYS 101 -8.477 -14.289 5.783 802 HG3 LYS 101 1HG LYS 101 -6.857 -14.966 5.625 803 HD2 LYS 101 2HD LYS 101 -7.970 -16.744 4.785 804 HD3 LYS 101 1HD LYS 101 -8.154 -17.148 6.484 805 HE2 LYS 101 2HE LYS 101 -10.355 -17.305 5.436 806 HE3 LYS 101 1HE LYS 101 -10.349 -15.858 6.460 807 HZ1 LYS 101 3HZ LYS 101 -9.836 -14.506 4.572 808 HZ2 LYS 101 1HZ LYS 101 -11.186 -15.451 4.178 809 HZ3 LYS 101 2HZ LYS 101 -9.659 -15.865 3.574 810 H ILE 102 H ILE 102 -4.611 -15.075 6.181 811 HA ILE 102 HA ILE 102 -5.001 -17.406 4.477 812 HB ILE 102 HB ILE 102 -3.576 -14.846 4.568 813 HG12 ILE 102 2HG1 ILE 102 -4.241 -16.355 2.072 814 HG13 ILE 102 1HG1 ILE 102 -5.554 -15.789 3.101 815 HG21 ILE 102 1HG2 ILE 102 -2.286 -17.151 3.094 816 HG22 ILE 102 2HG2 ILE 102 -1.595 -16.290 4.470 817 HG23 ILE 102 3HG2 ILE 102 -1.835 -15.453 2.938 818 HD11 ILE 102 3HD1 ILE 102 -3.397 -13.830 2.495 819 HD12 ILE 102 1HD1 ILE 102 -5.136 -13.574 2.657 820 HD13 ILE 102 2HD1 ILE 102 -4.480 -14.253 1.167 821 H VAL 103 H VAL 103 -2.416 -16.201 6.609 822 HA VAL 103 HA VAL 103 -0.740 -18.536 6.456 823 HB VAL 103 HB VAL 103 -1.178 -16.244 8.384 824 HG11 VAL 103 1HG1 VAL 103 -0.270 -17.578 9.989 825 HG12 VAL 103 2HG1 VAL 103 1.241 -17.299 9.124 826 HG13 VAL 103 3HG1 VAL 103 0.305 -18.760 8.813 827 HG21 VAL 103 3HG2 VAL 103 0.025 -16.186 6.027 828 HG22 VAL 103 1HG2 VAL 103 1.369 -16.878 6.933 829 HG23 VAL 103 2HG2 VAL 103 0.709 -15.309 7.396 830 H SER 104 H SER 104 -3.636 -17.667 8.156 831 HA SER 104 HA SER 104 -3.530 -19.855 10.104 832 HB2 SER 104 2HB SER 104 -4.590 -17.436 10.179 833 HB3 SER 104 1HB SER 104 -5.948 -18.241 9.393 834 HG SER 104 HG SER 104 -4.706 -19.031 11.831 835 H GLU 105 H GLU 105 -5.808 -18.902 7.630 836 HA GLU 105 HA GLU 105 -6.627 -21.750 7.271 837 HB2 GLU 105 2HB GLU 105 -8.677 -20.790 7.367 838 HB3 GLU 105 1HB GLU 105 -7.922 -19.209 7.534 839 HG2 GLU 105 2HG GLU 105 -8.068 -18.750 5.256 840 HG3 GLU 105 1HG GLU 105 -8.189 -20.452 4.809 841 H GLY 106 H GLY 106 -5.707 -18.835 5.424 842 HA2 GLY 106 2HA GLY 106 -4.124 -19.079 3.542 843 HA3 GLY 106 1HA GLY 106 -4.857 -20.645 3.201 844 H SER 107 H SER 107 -6.709 -17.738 3.964 845 HA SER 107 HA SER 107 -7.558 -17.550 1.094 846 HB2 SER 107 2HB SER 107 -9.308 -17.688 3.556 847 HB3 SER 107 1HB SER 107 -9.884 -17.377 1.920 848 HG SER 107 HG SER 107 -9.922 -19.636 2.718 849 H ASP 108 H ASP 108 -7.406 -15.489 0.406 850 HA ASP 108 HA ASP 108 -7.036 -13.311 2.351 851 HB2 ASP 108 2HB ASP 108 -6.370 -12.071 0.443 852 HB3 ASP 108 1HB ASP 108 -5.879 -13.717 0.045 853 H ASP 109 H ASP 109 -9.694 -14.940 1.524 854 HA ASP 109 HA ASP 109 -11.450 -12.659 0.825 855 HB2 ASP 109 2HB ASP 109 -11.876 -14.769 -0.236 856 HB3 ASP 109 1HB ASP 109 -11.820 -15.627 1.305 857 H ILE 110 H ILE 110 -11.785 -11.299 2.578 858 HA ILE 110 HA ILE 110 -12.756 -12.580 5.113 859 HB ILE 110 HB ILE 110 -11.590 -10.639 6.236 860 HG12 ILE 110 2HG1 ILE 110 -10.147 -10.279 3.611 861 HG13 ILE 110 1HG1 ILE 110 -11.588 -9.335 3.989 862 HG21 ILE 110 1HG2 ILE 110 -9.488 -11.711 6.245 863 HG22 ILE 110 2HG2 ILE 110 -9.630 -12.198 4.555 864 HG23 ILE 110 3HG2 ILE 110 -10.603 -12.999 5.788 865 HD11 ILE 110 3HD1 ILE 110 -9.017 -9.439 5.591 866 HD12 ILE 110 1HD1 ILE 110 -10.484 -8.620 6.128 867 HD13 ILE 110 2HD1 ILE 110 -9.641 -8.064 4.682 868 H GLY 111 H GLY 111 -14.334 -11.550 2.845 869 HA2 GLY 111 2HA GLY 111 -16.408 -10.397 2.783 870 HA3 GLY 111 1HA GLY 111 -16.033 -9.694 4.358 871 H GLU 112 H GLU 112 -13.297 -9.226 2.651 872 HA GLU 112 HA GLU 112 -13.422 -6.445 2.446 873 HB2 GLU 112 2HB GLU 112 -11.530 -6.737 0.897 874 HB3 GLU 112 1HB GLU 112 -11.423 -7.903 2.218 875 HG2 GLU 112 2HG GLU 112 -12.288 -9.665 0.851 876 HG3 GLU 112 1HG GLU 112 -12.735 -8.536 -0.427 877 H ASN 113 H ASN 113 -13.172 -5.356 0.095 878 HA ASN 113 HA ASN 113 -15.033 -6.421 -1.919 879 HB2 ASN 113 2HB ASN 113 -16.075 -5.015 0.199 880 HB3 ASN 113 1HB ASN 113 -15.818 -3.734 -0.987 881 HD21 ASN 113 1HD2 ASN 113 -16.231 -5.520 -3.327 882 HD22 ASN 113 2HD2 ASN 113 -17.893 -5.858 -3.374 883 H ILE 114 H ILE 114 -12.219 -5.531 -1.800 884 HA ILE 114 HA ILE 114 -11.248 -3.197 -2.592 885 HB ILE 114 HB ILE 114 -10.900 -5.063 -4.852 886 HG12 ILE 114 2HG1 ILE 114 -9.528 -6.625 -3.352 887 HG13 ILE 114 1HG1 ILE 114 -10.440 -5.955 -1.997 888 HG21 ILE 114 1HG2 ILE 114 -9.052 -3.797 -4.832 889 HG22 ILE 114 2HG2 ILE 114 -8.533 -4.705 -3.411 890 HG23 ILE 114 3HG2 ILE 114 -9.415 -3.188 -3.217 891 HD11 ILE 114 3HD1 ILE 114 -11.322 -7.785 -4.141 892 HD12 ILE 114 1HD1 ILE 114 -12.450 -6.481 -3.765 893 HD13 ILE 114 2HD1 ILE 114 -11.936 -7.598 -2.497 894 H ASP 115 H ASP 115 -12.972 -5.031 -5.164 895 HA ASP 115 HA ASP 115 -13.150 -3.102 -7.115 896 HB2 ASP 115 2HB ASP 115 -14.986 -5.222 -6.086 897 HB3 ASP 115 1HB ASP 115 -15.598 -4.136 -7.334 898 H VAL 116 H VAL 116 -15.244 -3.416 -4.347 899 HA VAL 116 HA VAL 116 -16.529 -0.809 -4.853 900 HB VAL 116 HB VAL 116 -16.922 -3.095 -2.920 901 HG11 VAL 116 1HG1 VAL 116 -18.730 -1.932 -1.891 902 HG12 VAL 116 2HG1 VAL 116 -18.704 -0.657 -3.110 903 HG13 VAL 116 3HG1 VAL 116 -17.403 -0.771 -1.926 904 HG21 VAL 116 3HG2 VAL 116 -17.786 -3.590 -5.092 905 HG22 VAL 116 1HG2 VAL 116 -18.457 -1.969 -5.272 906 HG23 VAL 116 2HG2 VAL 116 -19.181 -3.101 -4.128 907 H PHE 117 H PHE 117 -14.257 -2.303 -2.695 908 HA PHE 117 HA PHE 117 -14.229 -0.151 -0.723 909 HB2 PHE 117 2HB PHE 117 -13.118 -2.768 -1.133 910 HB3 PHE 117 1HB PHE 117 -11.801 -1.660 -0.746 911 HD1 PHE 117 1HD PHE 117 -12.209 -0.032 1.264 912 HD2 PHE 117 2HD PHE 117 -14.438 -3.641 0.593 913 HE1 PHE 117 1HE PHE 117 -12.884 -0.059 3.651 914 HE2 PHE 117 2HE PHE 117 -15.115 -3.668 2.979 915 HZ PHE 117 HZ PHE 117 -14.338 -1.877 4.507 916 H SER 118 H SER 118 -12.737 -0.770 -3.779 917 HA SER 118 HA SER 118 -10.655 1.270 -3.440 918 HB2 SER 118 2HB SER 118 -11.525 -0.578 -5.677 919 HB3 SER 118 1HB SER 118 -10.134 0.498 -5.787 920 HG SER 118 HG SER 118 -9.578 -1.638 -5.118 921 H ASP 119 H ASP 119 -13.568 0.576 -5.213 922 HA ASP 119 HA ASP 119 -13.712 3.023 -6.713 923 HB2 ASP 119 2HB ASP 119 -15.431 0.718 -6.006 924 HB3 ASP 119 1HB ASP 119 -16.303 2.197 -6.405 925 H THR 120 H THR 120 -14.505 2.075 -3.516 926 HA THR 120 HA THR 120 -16.157 4.328 -2.786 927 HB THR 120 HB THR 120 -14.833 1.984 -1.579 928 HG1 THR 120 1HG THR 120 -16.814 1.741 -0.729 929 HG21 THR 120 3HG2 THR 120 -13.775 3.341 -0.022 930 HG22 THR 120 1HG2 THR 120 -15.329 3.073 0.769 931 HG23 THR 120 2HG2 THR 120 -15.027 4.581 -0.095 932 H ILE 121 H ILE 121 -12.820 3.451 -2.217 933 HA ILE 121 HA ILE 121 -11.942 5.950 -1.134 934 HB ILE 121 HB ILE 121 -10.976 3.340 -1.789 935 HG12 ILE 121 2HG1 ILE 121 -10.824 4.697 0.346 936 HG13 ILE 121 1HG1 ILE 121 -9.363 3.816 -0.100 937 HG21 ILE 121 1HG2 ILE 121 -9.147 5.542 -2.786 938 HG22 ILE 121 2HG2 ILE 121 -9.937 4.327 -3.794 939 HG23 ILE 121 3HG2 ILE 121 -8.714 3.839 -2.620 940 HD11 ILE 121 3HD1 ILE 121 -9.786 6.675 -0.969 941 HD12 ILE 121 1HD1 ILE 121 -8.275 5.773 -0.861 942 HD13 ILE 121 2HD1 ILE 121 -9.096 6.295 0.608 943 H LYS 122 H LYS 122 -12.081 4.603 -4.413 944 HA LYS 122 HA LYS 122 -10.764 6.772 -5.759 945 HB2 LYS 122 2HB LYS 122 -12.269 4.301 -6.300 946 HB3 LYS 122 1HB LYS 122 -12.558 5.556 -7.511 947 HG2 LYS 122 2HG LYS 122 -10.548 5.128 -8.424 948 HG3 LYS 122 1HG LYS 122 -9.786 5.581 -6.900 949 HD2 LYS 122 2HD LYS 122 -10.935 2.963 -6.634 950 HD3 LYS 122 1HD LYS 122 -9.898 3.003 -8.059 951 HE2 LYS 122 2HE LYS 122 -8.556 4.444 -5.979 952 HE3 LYS 122 1HE LYS 122 -9.087 2.883 -5.321 953 HZ1 LYS 122 3HZ LYS 122 -8.138 1.756 -7.193 954 HZ2 LYS 122 1HZ LYS 122 -6.940 2.750 -6.520 955 HZ3 LYS 122 2HZ LYS 122 -7.735 3.225 -7.944 956 H SER 123 H SER 123 -14.062 6.068 -4.785 957 HA SER 123 HA SER 123 -15.123 8.498 -6.077 958 HB2 SER 123 2HB SER 123 -16.185 6.188 -4.476 959 HB3 SER 123 1HB SER 123 -17.200 7.589 -4.806 960 HG SER 123 HG SER 123 -17.256 5.783 -6.373 961 H PHE 124 H PHE 124 -13.626 7.600 -3.202 962 HA PHE 124 HA PHE 124 -14.974 9.394 -1.360 963 HB2 PHE 124 2HB PHE 124 -13.670 7.321 -0.785 964 HB3 PHE 124 1HB PHE 124 -12.203 8.160 -1.285 965 HD1 PHE 124 1HD PHE 124 -15.214 9.213 0.699 966 HD2 PHE 124 2HD PHE 124 -10.944 8.758 0.583 967 HE1 PHE 124 1HE PHE 124 -15.041 10.248 2.947 968 HE2 PHE 124 2HE PHE 124 -10.772 9.792 2.830 969 HZ PHE 124 HZ PHE 124 -12.821 10.537 4.013 970 H ALA 125 H ALA 125 -13.045 9.930 -4.008 971 HA ALA 125 HA ALA 125 -12.322 12.654 -3.025 972 HB1 ALA 125 1HB ALA 125 -10.155 11.819 -4.578 973 HB2 ALA 125 2HB ALA 125 -10.558 10.403 -3.608 974 HB3 ALA 125 3HB ALA 125 -10.185 11.935 -2.818 975 H SER 126 H SER 126 -12.648 10.418 -5.775 976 HA SER 126 HA SER 126 -12.665 12.669 -7.699 977 HB2 SER 126 2HB SER 126 -11.892 11.026 -9.045 978 HB3 SER 126 1HB SER 126 -11.970 9.927 -7.672 979 HG SER 126 HG SER 126 -13.930 10.455 -9.648 980 H SER 127 H SER 127 -14.907 10.405 -6.174 981 HA SER 127 HA SER 127 -17.155 11.755 -7.638 982 HB2 SER 127 2HB SER 127 -16.621 9.337 -8.195 983 HB3 SER 127 1HB SER 127 -17.054 8.932 -6.536 984 HG SER 127 HG SER 127 -19.121 9.589 -6.922 985 H GLY 128 H GLY 128 -15.719 11.970 -4.799 986 HA2 GLY 128 2HA GLY 128 -18.296 12.027 -3.278 987 HA3 GLY 128 1HA GLY 128 -16.789 11.496 -2.529 988 H LYS 129 H LYS 129 -16.154 13.960 -4.720 989 HA LYS 129 HA LYS 129 -15.334 15.823 -2.692 990 HB2 LYS 129 2HB LYS 129 -15.463 15.575 -5.621 991 HB3 LYS 129 1HB LYS 129 -15.599 17.240 -5.053 992 HG2 LYS 129 2HG LYS 129 -13.530 17.080 -3.837 993 HG3 LYS 129 1HG LYS 129 -13.439 15.339 -4.110 994 HD2 LYS 129 2HD LYS 129 -12.216 15.795 -5.948 995 HD3 LYS 129 1HD LYS 129 -13.693 16.432 -6.672 996 HE2 LYS 129 2HE LYS 129 -13.087 18.629 -5.371 997 HE3 LYS 129 1HE LYS 129 -11.454 17.934 -5.328 998 HZ1 LYS 129 3HZ LYS 129 -11.506 17.637 -7.692 999 HZ2 LYS 129 1HZ LYS 129 -11.882 19.256 -7.357 1000 HZ3 LYS 129 2HZ LYS 129 -13.117 18.168 -7.780 1001 H GLU 130 H GLU 130 -17.232 16.201 -1.365 1002 HA GLU 130 HA GLU 130 -19.144 18.141 -2.587 1003 HB2 GLU 130 2HB GLU 130 -19.988 15.736 -2.603 1004 HB3 GLU 130 1HB GLU 130 -19.963 15.802 -0.841 1005 HG2 GLU 130 2HG GLU 130 -22.192 16.378 -1.471 1006 HG3 GLU 130 1HG GLU 130 -21.411 17.899 -1.037 1007 H LYS 131 H LYS 131 -19.177 19.912 -1.283 1008 HA LYS 131 HA LYS 131 -17.907 20.035 1.289 1009 HB2 LYS 131 2HB LYS 131 -19.821 21.775 -0.275 1010 HB3 LYS 131 1HB LYS 131 -19.182 22.276 1.291 1011 HG2 LYS 131 2HG LYS 131 -16.937 21.383 -0.108 1012 HG3 LYS 131 1HG LYS 131 -17.875 22.265 -1.314 1013 HD2 LYS 131 2HD LYS 131 -16.904 24.114 -0.425 1014 HD3 LYS 131 1HD LYS 131 -18.083 23.913 0.874 1015 HE2 LYS 131 2HE LYS 131 -16.189 23.880 2.186 1016 HE3 LYS 131 1HE LYS 131 -16.144 22.175 1.694 1017 HZ1 LYS 131 3HZ LYS 131 -14.044 23.290 1.195 1018 HZ2 LYS 131 1HZ LYS 131 -14.860 24.425 0.235 1019 HZ3 LYS 131 2HZ LYS 131 -14.824 22.791 -0.228 1020 H LEU 132 H LEU 132 -19.544 21.269 3.047 1021 HA LEU 132 HA LEU 132 -21.198 20.841 4.683 1022 HB2 LEU 132 2HB LEU 132 -22.301 20.851 2.093 1023 HB3 LEU 132 1HB LEU 132 -23.031 19.463 2.901 1024 HG LEU 132 HG LEU 132 -23.361 21.128 4.895 1025 HD11 LEU 132 1HD1 LEU 132 -22.648 22.891 2.581 1026 HD12 LEU 132 2HD1 LEU 132 -22.262 23.080 4.291 1027 HD13 LEU 132 3HD1 LEU 132 -23.886 23.444 3.709 1028 HD21 LEU 132 3HD2 LEU 132 -25.499 21.967 3.738 1029 HD22 LEU 132 1HD2 LEU 132 -25.274 20.220 3.800 1030 HD23 LEU 132 2HD2 LEU 132 -24.932 21.099 2.310 1031 H GLU 133 H GLU 133 -22.703 18.888 5.464 1032 HA GLU 133 HA GLU 133 -22.599 16.736 6.457 1033 HB2 GLU 133 2HB GLU 133 -21.946 16.336 3.526 1034 HB3 GLU 133 1HB GLU 133 -22.287 14.995 4.620 1035 HG2 GLU 133 2HG GLU 133 -24.165 17.337 4.202 1036 HG3 GLU 133 1HG GLU 133 -24.302 15.804 3.339 Start of MODEL 18 1 H1 MET 1 1HT MET 1 3.835 -29.989 -1.743 2 H2 MET 1 2HT MET 1 4.368 -31.553 -2.137 3 H3 MET 1 3HT MET 1 3.339 -30.712 -3.195 4 HA MET 1 HA MET 1 6.026 -30.811 -3.446 5 HB2 MET 1 2HB MET 1 5.584 -29.038 -5.092 6 HB3 MET 1 1HB MET 1 4.238 -30.178 -5.064 7 HG2 MET 1 2HG MET 1 2.808 -28.678 -4.028 8 HG3 MET 1 1HG MET 1 4.123 -27.807 -3.240 9 HE1 MET 1 2HE MET 1 2.887 -25.720 -3.739 10 HE2 MET 1 3HE MET 1 1.626 -26.361 -4.789 11 HE3 MET 1 1HE MET 1 2.613 -24.994 -5.320 12 H MET 2 H MET 2 7.610 -28.946 -3.444 13 HA MET 2 HA MET 2 8.229 -27.935 -0.945 14 HB2 MET 2 2HB MET 2 9.391 -26.105 -2.304 15 HB3 MET 2 1HB MET 2 9.750 -27.763 -2.786 16 HG2 MET 2 2HG MET 2 8.362 -27.645 -4.679 17 HG3 MET 2 1HG MET 2 7.480 -26.252 -4.057 18 HE1 MET 2 3HE MET 2 7.861 -25.277 -6.616 19 HE2 MET 2 1HE MET 2 8.746 -26.781 -6.908 20 HE3 MET 2 2HE MET 2 9.459 -25.233 -7.358 21 H GLU 3 H GLU 3 7.374 -26.374 0.382 22 HA GLU 3 HA GLU 3 5.319 -24.518 -0.777 23 HB2 GLU 3 2HB GLU 3 4.288 -24.688 1.503 24 HB3 GLU 3 1HB GLU 3 4.313 -26.230 0.642 25 HG2 GLU 3 2HG GLU 3 6.654 -25.525 2.371 26 HG3 GLU 3 1HG GLU 3 5.162 -26.041 3.159 27 H GLU 4 H GLU 4 8.335 -24.701 0.606 28 HA GLU 4 HA GLU 4 8.203 -22.559 2.491 29 HB2 GLU 4 2HB GLU 4 10.525 -23.608 0.845 30 HB3 GLU 4 1HB GLU 4 10.664 -22.684 2.341 31 HG2 GLU 4 2HG GLU 4 9.349 -25.402 2.049 32 HG3 GLU 4 1HG GLU 4 10.915 -25.087 2.800 33 H TYR 5 H TYR 5 7.854 -22.509 -0.825 34 HA TYR 5 HA TYR 5 9.242 -20.023 -1.424 35 HB2 TYR 5 2HB TYR 5 7.369 -21.926 -2.770 36 HB3 TYR 5 1HB TYR 5 7.566 -20.319 -3.472 37 HD1 TYR 5 2HD TYR 5 9.913 -22.715 -1.787 38 HD2 TYR 5 1HD TYR 5 9.033 -20.376 -5.279 39 HE1 TYR 5 2HE TYR 5 12.064 -23.420 -2.800 40 HE2 TYR 5 1HE TYR 5 11.184 -21.081 -6.295 41 HH TYR 5 HH TYR 5 12.826 -23.547 -5.592 42 H LEU 6 H LEU 6 6.107 -20.963 -0.336 43 HA LEU 6 HA LEU 6 4.944 -18.273 -0.732 44 HB2 LEU 6 2HB LEU 6 2.903 -19.350 -0.157 45 HB3 LEU 6 1HB LEU 6 3.806 -20.586 -1.032 46 HG LEU 6 HG LEU 6 4.707 -21.162 1.399 47 HD11 LEU 6 1HD1 LEU 6 2.190 -20.815 2.601 48 HD12 LEU 6 2HD1 LEU 6 2.577 -19.257 1.870 49 HD13 LEU 6 3HD1 LEU 6 3.689 -19.990 3.027 50 HD21 LEU 6 3HD2 LEU 6 1.878 -21.967 0.710 51 HD22 LEU 6 1HD2 LEU 6 3.140 -22.940 1.465 52 HD23 LEU 6 2HD2 LEU 6 3.253 -22.527 -0.246 53 H GLY 7 H GLY 7 6.299 -20.293 1.809 54 HA2 GLY 7 2HA GLY 7 5.351 -18.767 4.052 55 HA3 GLY 7 1HA GLY 7 6.762 -19.830 4.065 56 H VAL 8 H VAL 8 8.119 -18.454 1.882 57 HA VAL 8 HA VAL 8 9.249 -16.228 3.442 58 HB VAL 8 HB VAL 8 9.945 -17.729 0.922 59 HG11 VAL 8 1HG1 VAL 8 10.467 -15.288 0.641 60 HG12 VAL 8 2HG1 VAL 8 11.900 -16.317 0.642 61 HG13 VAL 8 3HG1 VAL 8 11.482 -15.386 2.080 62 HG21 VAL 8 3HG2 VAL 8 11.941 -17.374 3.043 63 HG22 VAL 8 1HG2 VAL 8 11.385 -18.855 2.262 64 HG23 VAL 8 2HG2 VAL 8 10.472 -18.169 3.607 65 H PHE 9 H PHE 9 7.206 -16.757 0.730 66 HA PHE 9 HA PHE 9 7.443 -14.153 -0.508 67 HB2 PHE 9 2HB PHE 9 6.101 -16.630 -0.888 68 HB3 PHE 9 1HB PHE 9 4.857 -15.381 -0.849 69 HD1 PHE 9 1HD PHE 9 5.042 -13.395 -2.387 70 HD2 PHE 9 2HD PHE 9 7.611 -16.821 -2.732 71 HE1 PHE 9 1HE PHE 9 5.668 -12.696 -4.683 72 HE2 PHE 9 2HE PHE 9 8.235 -16.122 -5.028 73 HZ PHE 9 HZ PHE 9 7.263 -14.060 -6.004 74 H VAL 10 H VAL 10 5.452 -15.505 2.084 75 HA VAL 10 HA VAL 10 3.797 -13.082 2.320 76 HB VAL 10 HB VAL 10 4.088 -15.456 4.184 77 HG11 VAL 10 1HG1 VAL 10 2.437 -13.088 4.132 78 HG12 VAL 10 2HG1 VAL 10 2.520 -14.351 5.359 79 HG13 VAL 10 3HG1 VAL 10 1.429 -14.529 3.986 80 HG21 VAL 10 3HG2 VAL 10 2.583 -16.679 2.865 81 HG22 VAL 10 1HG2 VAL 10 3.588 -15.903 1.644 82 HG23 VAL 10 2HG2 VAL 10 1.999 -15.242 2.028 83 H ASP 11 H ASP 11 6.519 -14.626 4.024 84 HA ASP 11 HA ASP 11 6.628 -12.895 6.277 85 HB2 ASP 11 2HB ASP 11 7.879 -15.086 5.711 86 HB3 ASP 11 1HB ASP 11 9.015 -14.055 4.840 87 H GLU 12 H GLU 12 7.443 -12.443 2.985 88 HA GLU 12 HA GLU 12 9.039 -9.991 3.459 89 HB2 GLU 12 2HB GLU 12 8.143 -11.605 1.058 90 HB3 GLU 12 1HB GLU 12 8.964 -10.055 0.876 91 HG2 GLU 12 2HG GLU 12 10.934 -10.851 1.945 92 HG3 GLU 12 1HG GLU 12 10.108 -12.282 2.565 93 H THR 13 H THR 13 5.900 -11.001 2.150 94 HA THR 13 HA THR 13 4.945 -8.456 1.292 95 HB THR 13 HB THR 13 3.904 -11.145 2.024 96 HG1 THR 13 1HG THR 13 2.903 -9.625 -0.061 97 HG21 THR 13 3HG2 THR 13 2.258 -8.655 2.253 98 HG22 THR 13 1HG2 THR 13 2.162 -10.153 3.181 99 HG23 THR 13 2HG2 THR 13 1.520 -10.089 1.540 100 H LYS 14 H LYS 14 5.079 -9.998 4.468 101 HA LYS 14 HA LYS 14 3.396 -8.003 5.783 102 HB2 LYS 14 2HB LYS 14 5.125 -10.342 6.545 103 HB3 LYS 14 1HB LYS 14 4.549 -9.248 7.804 104 HG2 LYS 14 2HG LYS 14 2.441 -10.053 7.680 105 HG3 LYS 14 1HG LYS 14 2.440 -9.994 5.917 106 HD2 LYS 14 2HD LYS 14 2.554 -12.246 5.954 107 HD3 LYS 14 1HD LYS 14 4.213 -12.063 6.527 108 HE2 LYS 14 2HE LYS 14 2.514 -11.664 8.780 109 HE3 LYS 14 1HE LYS 14 1.967 -13.137 7.955 110 HZ1 LYS 14 3HZ LYS 14 3.819 -13.578 9.487 111 HZ2 LYS 14 1HZ LYS 14 4.797 -12.504 8.610 112 HZ3 LYS 14 2HZ LYS 14 4.229 -13.927 7.875 113 H GLU 15 H GLU 15 6.900 -8.734 5.737 114 HA GLU 15 HA GLU 15 7.736 -6.584 7.390 115 HB2 GLU 15 2HB GLU 15 9.027 -8.154 5.149 116 HB3 GLU 15 1HB GLU 15 9.925 -6.994 6.127 117 HG2 GLU 15 2HG GLU 15 9.389 -8.237 8.162 118 HG3 GLU 15 1HG GLU 15 8.393 -9.363 7.238 119 H TYR 16 H TYR 16 6.491 -6.635 4.241 120 HA TYR 16 HA TYR 16 7.707 -4.079 3.425 121 HB2 TYR 16 2HB TYR 16 6.194 -6.323 2.228 122 HB3 TYR 16 1HB TYR 16 5.840 -4.740 1.533 123 HD1 TYR 16 1HD TYR 16 8.229 -3.251 1.488 124 HD2 TYR 16 2HD TYR 16 7.774 -7.492 0.977 125 HE1 TYR 16 1HE TYR 16 10.362 -3.328 0.226 126 HE2 TYR 16 2HE TYR 16 9.908 -7.568 -0.286 127 HH TYR 16 HH TYR 16 11.474 -6.310 -1.323 128 H LEU 17 H LEU 17 4.685 -5.348 4.706 129 HA LEU 17 HA LEU 17 3.090 -2.966 4.162 130 HB2 LEU 17 2HB LEU 17 2.893 -5.336 6.053 131 HB3 LEU 17 1HB LEU 17 1.649 -4.089 5.968 132 HG LEU 17 HG LEU 17 2.597 -5.765 3.629 133 HD11 LEU 17 1HD1 LEU 17 -0.110 -5.844 4.967 134 HD12 LEU 17 2HD1 LEU 17 1.210 -6.891 5.487 135 HD13 LEU 17 3HD1 LEU 17 0.587 -7.010 3.842 136 HD21 LEU 17 3HD2 LEU 17 0.450 -4.740 2.634 137 HD22 LEU 17 1HD2 LEU 17 1.850 -3.677 2.777 138 HD23 LEU 17 2HD2 LEU 17 0.541 -3.575 3.955 139 H GLN 18 H GLN 18 5.073 -4.252 6.719 140 HA GLN 18 HA GLN 18 4.670 -2.225 8.713 141 HB2 GLN 18 2HB GLN 18 7.192 -3.764 8.128 142 HB3 GLN 18 1HB GLN 18 6.581 -3.267 9.709 143 HG2 GLN 18 2HG GLN 18 4.582 -4.851 8.474 144 HG3 GLN 18 1HG GLN 18 6.118 -5.689 8.274 145 HE21 GLN 18 1HE2 GLN 18 7.476 -5.049 10.623 146 HE22 GLN 18 2HE2 GLN 18 6.622 -5.632 11.970 147 H ASN 19 H ASN 19 7.184 -2.867 6.393 148 HA ASN 19 HA ASN 19 8.591 -0.422 6.680 149 HB2 ASN 19 2HB ASN 19 8.477 -2.744 4.882 150 HB3 ASN 19 1HB ASN 19 8.990 -1.265 4.067 151 HD21 ASN 19 1HD2 ASN 19 9.616 -2.023 7.502 152 HD22 ASN 19 2HD2 ASN 19 11.304 -2.105 7.345 153 H LEU 20 H LEU 20 5.744 -1.340 5.027 154 HA LEU 20 HA LEU 20 5.595 1.139 3.442 155 HB2 LEU 20 2HB LEU 20 4.859 -0.946 2.429 156 HB3 LEU 20 1HB LEU 20 3.805 -1.278 3.803 157 HG LEU 20 HG LEU 20 2.536 0.814 3.266 158 HD11 LEU 20 1HD1 LEU 20 3.372 1.031 0.521 159 HD12 LEU 20 2HD1 LEU 20 4.771 1.245 1.572 160 HD13 LEU 20 3HD1 LEU 20 3.356 2.278 1.768 161 HD21 LEU 20 3HD2 LEU 20 2.598 -0.907 0.801 162 HD22 LEU 20 1HD2 LEU 20 1.206 -0.239 1.655 163 HD23 LEU 20 2HD2 LEU 20 2.090 -1.602 2.340 164 H ASN 21 H ASN 21 4.880 0.139 6.575 165 HA ASN 21 HA ASN 21 2.609 2.007 6.851 166 HB2 ASN 21 2HB ASN 21 2.004 0.635 8.542 167 HB3 ASN 21 1HB ASN 21 3.275 -0.460 8.005 168 HD21 ASN 21 1HD2 ASN 21 5.552 0.125 9.000 169 HD22 ASN 21 2HD2 ASN 21 5.553 0.629 10.621 170 H ASP 22 H ASP 22 5.900 1.383 7.651 171 HA ASP 22 HA ASP 22 6.270 3.635 9.323 172 HB2 ASP 22 2HB ASP 22 7.842 1.566 8.058 173 HB3 ASP 22 1HB ASP 22 8.669 3.116 7.906 174 H THR 23 H THR 23 6.145 3.045 5.982 175 HA THR 23 HA THR 23 7.085 5.614 4.998 176 HB THR 23 HB THR 23 5.368 3.360 3.963 177 HG1 THR 23 1HG THR 23 7.246 2.483 3.694 178 HG21 THR 23 3HG2 THR 23 6.567 5.708 2.468 179 HG22 THR 23 1HG2 THR 23 4.851 5.406 2.732 180 HG23 THR 23 2HG2 THR 23 5.789 4.319 1.709 181 H LEU 24 H LEU 24 3.896 4.076 5.487 182 HA LEU 24 HA LEU 24 2.380 6.417 4.696 183 HB2 LEU 24 2HB LEU 24 1.887 3.718 5.918 184 HB3 LEU 24 1HB LEU 24 0.592 4.914 5.963 185 HG LEU 24 HG LEU 24 2.061 4.245 3.408 186 HD11 LEU 24 1HD1 LEU 24 1.116 2.152 4.050 187 HD12 LEU 24 2HD1 LEU 24 -0.046 2.861 2.929 188 HD13 LEU 24 3HD1 LEU 24 -0.347 2.918 4.666 189 HD21 LEU 24 3HD2 LEU 24 -0.092 6.030 4.236 190 HD22 LEU 24 1HD2 LEU 24 -0.598 4.960 2.929 191 HD23 LEU 24 2HD2 LEU 24 0.810 6.000 2.722 192 H LEU 25 H LEU 25 3.617 5.063 7.737 193 HA LEU 25 HA LEU 25 2.077 7.015 9.331 194 HB2 LEU 25 2HB LEU 25 4.339 5.115 10.008 195 HB3 LEU 25 1HB LEU 25 3.399 6.016 11.200 196 HG LEU 25 HG LEU 25 2.472 3.832 9.352 197 HD11 LEU 25 1HD1 LEU 25 3.281 3.121 11.527 198 HD12 LEU 25 2HD1 LEU 25 1.524 2.969 11.505 199 HD13 LEU 25 3HD1 LEU 25 2.281 4.331 12.332 200 HD21 LEU 25 3HD2 LEU 25 0.938 6.117 10.487 201 HD22 LEU 25 1HD2 LEU 25 0.180 4.524 10.561 202 HD23 LEU 25 2HD2 LEU 25 0.664 5.201 9.003 203 H GLU 26 H GLU 26 5.012 6.965 7.658 204 HA GLU 26 HA GLU 26 6.068 9.308 9.131 205 HB2 GLU 26 2HB GLU 26 7.118 7.479 6.948 206 HB3 GLU 26 1HB GLU 26 7.974 8.941 7.438 207 HG2 GLU 26 2HG GLU 26 7.137 7.113 9.625 208 HG3 GLU 26 1HG GLU 26 8.435 6.538 8.576 209 H LEU 27 H LEU 27 4.394 8.232 6.378 210 HA LEU 27 HA LEU 27 4.726 10.566 4.773 211 HB2 LEU 27 2HB LEU 27 4.180 8.465 3.744 212 HB3 LEU 27 1HB LEU 27 2.797 8.242 4.817 213 HG LEU 27 HG LEU 27 1.778 10.308 3.802 214 HD11 LEU 27 1HD1 LEU 27 3.966 9.942 1.735 215 HD12 LEU 27 2HD1 LEU 27 3.977 11.206 2.965 216 HD13 LEU 27 3HD1 LEU 27 2.709 11.179 1.738 217 HD21 LEU 27 3HD2 LEU 27 2.248 7.710 2.479 218 HD22 LEU 27 1HD2 LEU 27 1.707 8.990 1.395 219 HD23 LEU 27 2HD2 LEU 27 0.731 8.548 2.796 220 H GLU 28 H GLU 28 2.568 9.527 7.319 221 HA GLU 28 HA GLU 28 0.488 11.496 6.938 222 HB2 GLU 28 2HB GLU 28 1.552 9.868 9.272 223 HB3 GLU 28 1HB GLU 28 0.155 10.932 9.435 224 HG2 GLU 28 2HG GLU 28 -1.158 9.648 7.999 225 HG3 GLU 28 1HG GLU 28 0.238 8.916 7.211 226 H LYS 29 H LYS 29 3.520 11.361 8.800 227 HA LYS 29 HA LYS 29 3.196 14.015 9.940 228 HB2 LYS 29 2HB LYS 29 4.873 13.225 11.235 229 HB3 LYS 29 1HB LYS 29 4.754 11.731 10.317 230 HG2 LYS 29 2HG LYS 29 6.311 13.156 8.623 231 HG3 LYS 29 1HG LYS 29 6.788 13.890 10.155 232 HD2 LYS 29 2HD LYS 29 6.664 10.923 9.667 233 HD3 LYS 29 1HD LYS 29 8.139 11.872 9.499 234 HE2 LYS 29 2HE LYS 29 6.529 12.007 12.047 235 HE3 LYS 29 1HE LYS 29 7.700 10.699 11.788 236 HZ1 LYS 29 3HZ LYS 29 9.089 12.803 10.925 237 HZ2 LYS 29 1HZ LYS 29 9.165 12.235 12.520 238 HZ3 LYS 29 2HZ LYS 29 8.159 13.549 12.135 239 H ASN 30 H ASN 30 4.340 12.653 7.057 240 HA ASN 30 HA ASN 30 4.900 15.329 5.931 241 HB2 ASN 30 2HB ASN 30 6.892 13.372 6.705 242 HB3 ASN 30 1HB ASN 30 6.927 13.593 4.955 243 HD21 ASN 30 1HD2 ASN 30 8.867 14.579 7.088 244 HD22 ASN 30 2HD2 ASN 30 8.958 16.256 6.843 245 HA PRO 31 HA PRO 31 2.563 12.577 3.261 246 HB2 PRO 31 2HB PRO 31 0.338 14.130 3.204 247 HB3 PRO 31 1HB PRO 31 0.690 12.977 4.500 248 HG2 PRO 31 2HG PRO 31 0.776 15.900 4.537 249 HG3 PRO 31 1HG PRO 31 0.569 14.749 5.864 250 HD2 PRO 31 2HD PRO 31 2.940 16.113 5.093 251 HD3 PRO 31 1HD PRO 31 2.737 14.905 6.383 252 H GLU 32 H GLU 32 4.404 15.078 2.764 253 HA GLU 32 HA GLU 32 3.430 15.515 -0.019 254 HB2 GLU 32 2HB GLU 32 4.499 17.980 0.949 255 HB3 GLU 32 1HB GLU 32 2.845 17.648 0.446 256 HG2 GLU 32 2HG GLU 32 2.175 17.069 2.654 257 HG3 GLU 32 1HG GLU 32 3.851 16.945 3.206 258 H ASP 33 H ASP 33 5.840 14.475 1.886 259 HA ASP 33 HA ASP 33 8.172 15.787 0.881 260 HB2 ASP 33 2HB ASP 33 7.657 13.037 2.018 261 HB3 ASP 33 1HB ASP 33 9.272 13.696 1.751 262 H MET 34 H MET 34 6.002 13.608 -0.512 263 HA MET 34 HA MET 34 5.940 12.502 -2.579 264 HB2 MET 34 2HB MET 34 8.106 14.588 -2.940 265 HB3 MET 34 1HB MET 34 7.626 13.518 -4.257 266 HG2 MET 34 2HG MET 34 5.680 15.246 -2.707 267 HG3 MET 34 1HG MET 34 6.413 15.729 -4.236 268 HE1 MET 34 3HE MET 34 4.358 14.902 -6.679 269 HE2 MET 34 1HE MET 34 5.682 13.732 -6.773 270 HE3 MET 34 2HE MET 34 5.969 15.345 -6.123 271 H GLU 35 H GLU 35 8.058 11.943 -0.286 272 HA GLU 35 HA GLU 35 9.765 10.110 -1.895 273 HB2 GLU 35 2HB GLU 35 11.289 10.224 -0.001 274 HB3 GLU 35 1HB GLU 35 10.810 11.875 -0.392 275 HG2 GLU 35 2HG GLU 35 9.089 11.792 1.380 276 HG3 GLU 35 1HG GLU 35 9.594 10.150 1.785 277 H LEU 36 H LEU 36 7.707 10.446 0.956 278 HA LEU 36 HA LEU 36 7.657 7.559 1.485 279 HB2 LEU 36 2HB LEU 36 5.815 9.811 2.386 280 HB3 LEU 36 1HB LEU 36 5.932 8.215 3.126 281 HG LEU 36 HG LEU 36 7.955 10.444 3.146 282 HD11 LEU 36 1HD1 LEU 36 6.462 8.792 5.159 283 HD12 LEU 36 2HD1 LEU 36 6.600 10.547 5.047 284 HD13 LEU 36 3HD1 LEU 36 7.971 9.588 5.605 285 HD21 LEU 36 3HD2 LEU 36 9.189 8.447 2.446 286 HD22 LEU 36 1HD2 LEU 36 8.434 7.505 3.732 287 HD23 LEU 36 2HD2 LEU 36 9.560 8.801 4.133 288 H ILE 37 H ILE 37 6.003 9.857 -0.531 289 HA ILE 37 HA ILE 37 3.647 8.192 -1.021 290 HB ILE 37 HB ILE 37 4.907 10.630 -2.315 291 HG12 ILE 37 2HG1 ILE 37 2.448 10.213 -0.585 292 HG13 ILE 37 1HG1 ILE 37 3.950 10.998 -0.093 293 HG21 ILE 37 1HG2 ILE 37 3.671 9.411 -4.035 294 HG22 ILE 37 2HG2 ILE 37 2.752 10.837 -3.555 295 HG23 ILE 37 3HG2 ILE 37 2.285 9.246 -2.957 296 HD11 ILE 37 3HD1 ILE 37 2.587 12.053 -2.527 297 HD12 ILE 37 1HD1 ILE 37 3.508 12.912 -1.292 298 HD13 ILE 37 2HD1 ILE 37 1.850 12.408 -0.965 299 H ASN 38 H ASN 38 6.888 8.563 -2.323 300 HA ASN 38 HA ASN 38 6.242 6.968 -4.716 301 HB2 ASN 38 2HB ASN 38 8.124 8.941 -3.966 302 HB3 ASN 38 1HB ASN 38 9.049 7.469 -4.270 303 HD21 ASN 38 1HD2 ASN 38 8.058 6.255 -6.395 304 HD22 ASN 38 2HD2 ASN 38 7.859 7.280 -7.733 305 H GLU 39 H GLU 39 7.921 6.650 -1.668 306 HA GLU 39 HA GLU 39 8.963 3.996 -2.268 307 HB2 GLU 39 2HB GLU 39 9.855 4.122 -0.086 308 HB3 GLU 39 1HB GLU 39 9.757 5.816 -0.559 309 HG2 GLU 39 2HG GLU 39 7.509 5.928 0.560 310 HG3 GLU 39 1HG GLU 39 7.786 4.292 1.160 311 H ALA 40 H ALA 40 6.007 5.338 -1.290 312 HA ALA 40 HA ALA 40 4.915 2.835 -0.157 313 HB1 ALA 40 1HB ALA 40 2.983 4.251 0.296 314 HB2 ALA 40 2HB ALA 40 3.609 5.507 -0.773 315 HB3 ALA 40 3HB ALA 40 4.434 5.143 0.739 316 H PHE 41 H PHE 41 4.191 5.076 -2.892 317 HA PHE 41 HA PHE 41 2.219 3.591 -4.208 318 HB2 PHE 41 2HB PHE 41 2.773 5.693 -5.099 319 HB3 PHE 41 1HB PHE 41 4.504 5.364 -5.049 320 HD1 PHE 41 2HD PHE 41 5.442 3.586 -6.643 321 HD2 PHE 41 1HD PHE 41 1.525 5.296 -7.065 322 HE1 PHE 41 2HE PHE 41 5.373 2.840 -9.007 323 HE2 PHE 41 1HE PHE 41 1.455 4.550 -9.430 324 HZ PHE 41 HZ PHE 41 3.379 3.323 -10.402 325 H ARG 42 H ARG 42 5.737 3.098 -4.190 326 HA ARG 42 HA ARG 42 5.787 0.989 -6.165 327 HB2 ARG 42 2HB ARG 42 7.587 2.033 -3.983 328 HB3 ARG 42 1HB ARG 42 8.047 0.616 -4.929 329 HG2 ARG 42 2HG ARG 42 7.237 2.353 -6.893 330 HG3 ARG 42 1HG ARG 42 7.965 3.451 -5.719 331 HD2 ARG 42 2HD ARG 42 9.961 2.849 -6.629 332 HD3 ARG 42 1HD ARG 42 9.734 1.299 -5.792 333 HE ARG 42 HE ARG 42 8.224 1.344 -8.247 334 HH11 ARG 42 1HH1 ARG 42 11.139 2.306 -8.795 335 HH12 ARG 42 2HH1 ARG 42 11.855 0.811 -9.297 336 HH21 ARG 42 1HH2 ARG 42 9.253 -1.144 -8.104 337 HH22 ARG 42 2HH2 ARG 42 10.790 -1.142 -8.904 338 H ALA 43 H ALA 43 6.602 0.686 -2.705 339 HA ALA 43 HA ALA 43 6.481 -1.996 -2.257 340 HB1 ALA 43 1HB ALA 43 5.830 0.433 -0.769 341 HB2 ALA 43 2HB ALA 43 6.718 -0.996 -0.238 342 HB3 ALA 43 3HB ALA 43 4.956 -0.972 -0.158 343 H LEU 44 H LEU 44 3.533 0.043 -2.404 344 HA LEU 44 HA LEU 44 1.696 -2.152 -2.080 345 HB2 LEU 44 2HB LEU 44 1.468 0.600 -3.333 346 HB3 LEU 44 1HB LEU 44 0.087 -0.436 -2.963 347 HG LEU 44 HG LEU 44 2.110 0.215 -0.837 348 HD11 LEU 44 1HD1 LEU 44 1.161 2.317 -2.009 349 HD12 LEU 44 2HD1 LEU 44 1.003 2.219 -0.255 350 HD13 LEU 44 3HD1 LEU 44 -0.380 1.856 -1.287 351 HD21 LEU 44 3HD2 LEU 44 -0.602 -0.966 -1.055 352 HD22 LEU 44 1HD2 LEU 44 -0.354 0.110 0.319 353 HD23 LEU 44 2HD2 LEU 44 0.679 -1.303 0.106 354 H HIS 45 H HIS 45 3.089 -0.534 -4.929 355 HA HIS 45 HA HIS 45 1.602 -2.063 -6.890 356 HB2 HIS 45 2HB HIS 45 3.125 0.164 -6.903 357 HB3 HIS 45 1HB HIS 45 4.337 -0.996 -7.440 358 HD1 HIS 45 1HD HIS 45 0.655 -0.385 -8.290 359 HD2 HIS 45 2HD HIS 45 4.283 -1.157 -10.190 360 HE1 HIS 45 1HE HIS 45 0.162 -0.453 -10.772 361 H THR 46 H THR 46 4.511 -2.530 -5.022 362 HA THR 46 HA THR 46 5.424 -4.866 -6.557 363 HB THR 46 HB THR 46 6.328 -3.051 -4.421 364 HG1 THR 46 1HG THR 46 8.067 -3.115 -5.628 365 HG21 THR 46 3HG2 THR 46 7.829 -4.607 -3.306 366 HG22 THR 46 1HG2 THR 46 7.236 -5.941 -4.299 367 HG23 THR 46 2HG2 THR 46 6.170 -5.177 -3.118 368 H LEU 47 H LEU 47 3.770 -4.154 -3.491 369 HA LEU 47 HA LEU 47 3.657 -6.885 -2.546 370 HB2 LEU 47 2HB LEU 47 2.715 -4.204 -1.849 371 HB3 LEU 47 1HB LEU 47 1.525 -5.447 -1.458 372 HG LEU 47 HG LEU 47 4.444 -5.567 -0.657 373 HD11 LEU 47 1HD1 LEU 47 2.662 -3.806 0.373 374 HD12 LEU 47 2HD1 LEU 47 3.928 -4.565 1.340 375 HD13 LEU 47 3HD1 LEU 47 2.290 -5.219 1.361 376 HD21 LEU 47 3HD2 LEU 47 2.000 -7.256 -0.082 377 HD22 LEU 47 1HD2 LEU 47 3.442 -7.322 0.931 378 HD23 LEU 47 2HD2 LEU 47 3.539 -7.774 -0.771 379 H LYS 48 H LYS 48 1.621 -4.864 -4.598 380 HA LYS 48 HA LYS 48 -0.702 -6.563 -4.670 381 HB2 LYS 48 2HB LYS 48 -0.822 -4.266 -5.333 382 HB3 LYS 48 1HB LYS 48 0.517 -4.452 -6.464 383 HG2 LYS 48 2HG LYS 48 -1.201 -6.308 -7.456 384 HG3 LYS 48 1HG LYS 48 -2.345 -5.141 -6.797 385 HD2 LYS 48 2HD LYS 48 -2.013 -4.200 -8.874 386 HD3 LYS 48 1HD LYS 48 -0.710 -3.411 -7.984 387 HE2 LYS 48 2HE LYS 48 0.859 -5.183 -8.740 388 HE3 LYS 48 1HE LYS 48 -0.451 -5.907 -9.693 389 HZ1 LYS 48 3HZ LYS 48 -0.760 -3.734 -10.775 390 HZ2 LYS 48 1HZ LYS 48 0.775 -4.386 -11.080 391 HZ3 LYS 48 2HZ LYS 48 0.595 -3.137 -9.943 392 H GLY 49 H GLY 49 2.138 -6.245 -6.824 393 HA2 GLY 49 2HA GLY 49 1.357 -8.273 -8.682 394 HA3 GLY 49 1HA GLY 49 3.012 -7.717 -8.429 395 H MET 50 H MET 50 3.019 -8.417 -5.573 396 HA MET 50 HA MET 50 3.808 -11.211 -5.842 397 HB2 MET 50 2HB MET 50 3.626 -9.184 -3.604 398 HB3 MET 50 1HB MET 50 4.152 -10.842 -3.309 399 HG2 MET 50 2HG MET 50 5.802 -10.420 -5.282 400 HG3 MET 50 1HG MET 50 5.478 -8.714 -4.979 401 HE1 MET 50 3HE MET 50 5.138 -8.006 -2.448 402 HE2 MET 50 1HE MET 50 6.216 -8.502 -1.136 403 HE3 MET 50 2HE MET 50 4.845 -9.513 -1.586 404 H ALA 51 H ALA 51 0.887 -9.563 -5.076 405 HA ALA 51 HA ALA 51 -0.267 -11.809 -3.528 406 HB1 ALA 51 1HB ALA 51 -2.289 -10.137 -3.786 407 HB2 ALA 51 2HB ALA 51 -1.048 -9.026 -4.363 408 HB3 ALA 51 3HB ALA 51 -0.938 -9.703 -2.739 409 H GLY 52 H GLY 52 0.044 -10.834 -6.793 410 HA2 GLY 52 2HA GLY 52 -2.446 -12.139 -7.680 411 HA3 GLY 52 1HA GLY 52 -1.250 -11.369 -8.726 412 H THR 53 H THR 53 1.014 -12.750 -7.552 413 HA THR 53 HA THR 53 0.929 -15.186 -9.127 414 HB THR 53 HB THR 53 2.839 -13.662 -7.404 415 HG1 THR 53 1HG THR 53 2.650 -14.578 -10.052 416 HG21 THR 53 3HG2 THR 53 3.153 -16.007 -6.702 417 HG22 THR 53 1HG2 THR 53 4.540 -15.417 -7.617 418 HG23 THR 53 2HG2 THR 53 3.361 -16.478 -8.388 419 H MET 54 H MET 54 0.000 -14.374 -5.987 420 HA MET 54 HA MET 54 0.355 -17.142 -4.940 421 HB2 MET 54 2HB MET 54 0.808 -14.693 -3.845 422 HB3 MET 54 1HB MET 54 -0.842 -14.983 -3.296 423 HG2 MET 54 2HG MET 54 0.793 -15.847 -1.662 424 HG3 MET 54 1HG MET 54 -0.156 -17.160 -2.360 425 HE1 MET 54 3HE MET 54 2.584 -14.864 -2.850 426 HE2 MET 54 1HE MET 54 3.198 -15.465 -4.396 427 HE3 MET 54 2HE MET 54 4.061 -15.823 -2.903 428 H GLY 55 H GLY 55 -1.848 -15.609 -6.771 429 HA2 GLY 55 2HA GLY 55 -4.061 -16.257 -7.304 430 HA3 GLY 55 1HA GLY 55 -4.012 -17.394 -5.957 431 H PHE 56 H PHE 56 -2.954 -14.555 -4.689 432 HA PHE 56 HA PHE 56 -5.622 -13.977 -3.525 433 HB2 PHE 56 2HB PHE 56 -2.826 -12.974 -2.893 434 HB3 PHE 56 1HB PHE 56 -4.259 -12.717 -1.896 435 HD1 PHE 56 1HD PHE 56 -5.561 -15.414 -2.253 436 HD2 PHE 56 2HD PHE 56 -1.488 -14.317 -1.439 437 HE1 PHE 56 1HE PHE 56 -5.191 -17.604 -1.153 438 HE2 PHE 56 2HE PHE 56 -1.118 -16.509 -0.338 439 HZ PHE 56 HZ PHE 56 -2.969 -18.153 -0.195 440 H SER 57 H SER 57 -5.698 -13.146 -6.122 441 HA SER 57 HA SER 57 -4.672 -10.499 -6.590 442 HB2 SER 57 2HB SER 57 -6.879 -12.166 -7.795 443 HB3 SER 57 1HB SER 57 -6.408 -10.600 -8.447 444 HG SER 57 HG SER 57 -5.364 -12.672 -9.252 445 H SER 58 H SER 58 -7.568 -11.749 -5.164 446 HA SER 58 HA SER 58 -9.198 -9.408 -5.162 447 HB2 SER 58 2HB SER 58 -8.943 -11.613 -3.085 448 HB3 SER 58 1HB SER 58 -10.349 -10.579 -3.330 449 HG SER 58 HG SER 58 -9.511 -12.796 -4.711 450 H MET 59 H MET 59 -6.540 -10.527 -3.177 451 HA MET 59 HA MET 59 -6.763 -8.214 -1.347 452 HB2 MET 59 2HB MET 59 -6.323 -10.511 -0.516 453 HB3 MET 59 1HB MET 59 -4.865 -10.580 -1.501 454 HG2 MET 59 2HG MET 59 -5.267 -8.367 0.509 455 HG3 MET 59 1HG MET 59 -4.622 -9.931 1.006 456 HE1 MET 59 3HE MET 59 -3.016 -10.459 -2.107 457 HE2 MET 59 1HE MET 59 -3.007 -11.151 -0.480 458 HE3 MET 59 2HE MET 59 -1.541 -10.434 -1.141 459 H ALA 60 H ALA 60 -5.073 -9.301 -4.169 460 HA ALA 60 HA ALA 60 -2.769 -7.516 -3.905 461 HB1 ALA 60 1HB ALA 60 -2.110 -8.573 -5.858 462 HB2 ALA 60 2HB ALA 60 -3.737 -8.540 -6.539 463 HB3 ALA 60 3HB ALA 60 -3.312 -9.747 -5.326 464 H LYS 61 H LYS 61 -5.957 -7.441 -5.453 465 HA LYS 61 HA LYS 61 -5.590 -5.012 -6.937 466 HB2 LYS 61 2HB LYS 61 -8.015 -6.331 -5.666 467 HB3 LYS 61 1HB LYS 61 -8.110 -5.018 -6.840 468 HG2 LYS 61 2HG LYS 61 -7.520 -6.368 -8.596 469 HG3 LYS 61 1HG LYS 61 -6.455 -7.366 -7.604 470 HD2 LYS 61 2HD LYS 61 -8.382 -8.706 -8.218 471 HD3 LYS 61 1HD LYS 61 -8.493 -8.326 -6.497 472 HE2 LYS 61 2HE LYS 61 -10.036 -6.460 -6.998 473 HE3 LYS 61 1HE LYS 61 -9.939 -6.850 -8.727 474 HZ1 LYS 61 3HZ LYS 61 -10.594 -9.167 -8.090 475 HZ2 LYS 61 1HZ LYS 61 -11.812 -8.005 -7.880 476 HZ3 LYS 61 2HZ LYS 61 -10.946 -8.579 -6.535 477 H LEU 62 H LEU 62 -6.417 -5.749 -3.614 478 HA LEU 62 HA LEU 62 -7.277 -3.198 -2.723 479 HB2 LEU 62 2HB LEU 62 -7.456 -5.313 -1.500 480 HB3 LEU 62 1HB LEU 62 -5.703 -5.472 -1.474 481 HG LEU 62 HG LEU 62 -6.753 -4.619 0.633 482 HD11 LEU 62 1HD1 LEU 62 -4.875 -3.391 1.151 483 HD12 LEU 62 2HD1 LEU 62 -4.931 -2.484 -0.360 484 HD13 LEU 62 3HD1 LEU 62 -4.335 -4.144 -0.349 485 HD21 LEU 62 3HD2 LEU 62 -6.932 -1.939 -0.683 486 HD22 LEU 62 1HD2 LEU 62 -7.779 -2.535 0.745 487 HD23 LEU 62 2HD2 LEU 62 -8.283 -3.058 -0.862 488 H CYS 63 H CYS 63 -4.090 -4.750 -2.872 489 HA CYS 63 HA CYS 63 -2.556 -2.589 -1.830 490 HB2 CYS 63 2HB CYS 63 -1.972 -4.884 -3.720 491 HB3 CYS 63 1HB CYS 63 -0.708 -3.825 -3.094 492 HG CYS 63 HG CYS 63 -2.405 -5.780 -1.354 493 H HIS 64 H HIS 64 -3.459 -3.490 -5.151 494 HA HIS 64 HA HIS 64 -2.053 -1.400 -6.490 495 HB2 HIS 64 2HB HIS 64 -3.058 -3.416 -7.539 496 HB3 HIS 64 1HB HIS 64 -4.664 -2.804 -7.153 497 HD1 HIS 64 1HD HIS 64 -5.696 -1.863 -9.205 498 HD2 HIS 64 2HD HIS 64 -1.618 -1.015 -9.029 499 HE1 HIS 64 1HE HIS 64 -5.172 -0.441 -11.234 500 H THR 65 H THR 65 -5.013 -1.488 -4.672 501 HA THR 65 HA THR 65 -6.086 1.016 -5.681 502 HB THR 65 HB THR 65 -6.769 -1.168 -3.898 503 HG1 THR 65 1HG THR 65 -8.253 -0.907 -5.338 504 HG21 THR 65 3HG2 THR 65 -7.170 1.630 -2.868 505 HG22 THR 65 1HG2 THR 65 -6.646 0.193 -1.992 506 HG23 THR 65 2HG2 THR 65 -8.331 0.360 -2.486 507 H LEU 66 H LEU 66 -4.318 0.052 -2.716 508 HA LEU 66 HA LEU 66 -4.288 2.586 -1.405 509 HB2 LEU 66 2HB LEU 66 -2.070 0.514 -1.487 510 HB3 LEU 66 1HB LEU 66 -2.448 1.617 -0.166 511 HG LEU 66 HG LEU 66 -4.023 -0.783 -1.103 512 HD11 LEU 66 1HD1 LEU 66 -2.251 -0.150 1.087 513 HD12 LEU 66 2HD1 LEU 66 -2.980 -1.699 0.666 514 HD13 LEU 66 3HD1 LEU 66 -3.848 -0.569 1.705 515 HD21 LEU 66 3HD2 LEU 66 -5.524 1.220 -0.795 516 HD22 LEU 66 1HD2 LEU 66 -4.944 1.322 0.865 517 HD23 LEU 66 2HD2 LEU 66 -5.846 -0.094 0.337 518 H GLU 67 H GLU 67 -1.852 1.094 -3.534 519 HA GLU 67 HA GLU 67 -0.074 3.294 -3.720 520 HB2 GLU 67 2HB GLU 67 1.022 1.695 -4.906 521 HB3 GLU 67 1HB GLU 67 -0.373 0.662 -4.601 522 HG2 GLU 67 2HG GLU 67 -0.177 0.560 -6.930 523 HG3 GLU 67 1HG GLU 67 -1.383 1.827 -6.714 524 H ASN 68 H ASN 68 -3.075 2.598 -5.359 525 HA ASN 68 HA ASN 68 -2.833 4.283 -7.626 526 HB2 ASN 68 2HB ASN 68 -4.665 2.615 -6.581 527 HB3 ASN 68 1HB ASN 68 -5.366 4.158 -6.095 528 HD21 ASN 68 1HD2 ASN 68 -6.140 5.600 -7.773 529 HD22 ASN 68 2HD2 ASN 68 -6.306 5.093 -9.384 530 H ILE 69 H ILE 69 -3.975 4.934 -4.338 531 HA ILE 69 HA ILE 69 -4.567 7.696 -4.783 532 HB ILE 69 HB ILE 69 -3.950 5.957 -2.398 533 HG12 ILE 69 2HG1 ILE 69 -6.390 6.513 -1.952 534 HG13 ILE 69 1HG1 ILE 69 -6.419 7.252 -3.546 535 HG21 ILE 69 1HG2 ILE 69 -5.188 8.374 -1.554 536 HG22 ILE 69 2HG2 ILE 69 -3.802 8.830 -2.543 537 HG23 ILE 69 3HG2 ILE 69 -3.577 7.792 -1.138 538 HD11 ILE 69 3HD1 ILE 69 -5.870 5.171 -4.611 539 HD12 ILE 69 1HD1 ILE 69 -7.215 4.873 -3.511 540 HD13 ILE 69 2HD1 ILE 69 -5.582 4.402 -3.049 541 H LEU 70 H LEU 70 -1.876 5.913 -3.611 542 HA LEU 70 HA LEU 70 -0.127 8.134 -3.101 543 HB2 LEU 70 2HB LEU 70 0.581 5.290 -3.890 544 HB3 LEU 70 1HB LEU 70 1.592 6.405 -2.972 545 HG LEU 70 HG LEU 70 -0.905 4.972 -2.094 546 HD11 LEU 70 1HD1 LEU 70 1.707 4.418 -1.712 547 HD12 LEU 70 2HD1 LEU 70 0.460 4.013 -0.534 548 HD13 LEU 70 3HD1 LEU 70 1.423 5.476 -0.330 549 HD21 LEU 70 3HD2 LEU 70 -0.888 6.464 -0.070 550 HD22 LEU 70 1HD2 LEU 70 -1.367 7.295 -1.550 551 HD23 LEU 70 2HD2 LEU 70 0.262 7.507 -0.906 552 H ASP 71 H ASP 71 -1.337 6.665 -5.922 553 HA ASP 71 HA ASP 71 0.879 7.547 -7.644 554 HB2 ASP 71 2HB ASP 71 -0.883 5.569 -7.881 555 HB3 ASP 71 1HB ASP 71 -1.881 6.831 -8.605 556 H LYS 72 H LYS 72 -2.575 8.462 -7.206 557 HA LYS 72 HA LYS 72 -2.384 10.878 -8.739 558 HB2 LYS 72 2HB LYS 72 -4.490 11.358 -7.376 559 HB3 LYS 72 1HB LYS 72 -4.507 9.868 -8.307 560 HG2 LYS 72 2HG LYS 72 -4.121 8.549 -6.379 561 HG3 LYS 72 1HG LYS 72 -3.615 9.956 -5.438 562 HD2 LYS 72 2HD LYS 72 -5.998 10.815 -6.132 563 HD3 LYS 72 1HD LYS 72 -6.319 9.085 -6.242 564 HE2 LYS 72 2HE LYS 72 -5.067 9.109 -3.850 565 HE3 LYS 72 1HE LYS 72 -5.751 10.747 -3.833 566 HZ1 LYS 72 3HZ LYS 72 -7.898 9.953 -4.158 567 HZ2 LYS 72 1HZ LYS 72 -7.248 8.848 -3.047 568 HZ3 LYS 72 2HZ LYS 72 -7.368 8.429 -4.689 569 H ALA 73 H ALA 73 -1.589 9.999 -5.497 570 HA ALA 73 HA ALA 73 -1.296 12.642 -4.384 571 HB1 ALA 73 1HB ALA 73 0.161 10.040 -3.807 572 HB2 ALA 73 2HB ALA 73 -1.422 10.457 -3.153 573 HB3 ALA 73 3HB ALA 73 -0.009 11.403 -2.694 574 H ARG 74 H ARG 74 0.663 10.492 -6.323 575 HA ARG 74 HA ARG 74 3.049 12.233 -6.203 576 HB2 ARG 74 2HB ARG 74 3.990 10.196 -6.571 577 HB3 ARG 74 1HB ARG 74 2.389 9.485 -6.735 578 HG2 ARG 74 2HG ARG 74 2.364 10.111 -9.135 579 HG3 ARG 74 1HG ARG 74 3.982 10.793 -8.965 580 HD2 ARG 74 2HD ARG 74 3.931 8.099 -7.894 581 HD3 ARG 74 1HD ARG 74 3.355 8.114 -9.574 582 HE ARG 74 HE ARG 74 5.733 9.768 -9.089 583 HH11 ARG 74 1HH2 ARG 74 5.084 6.464 -9.077 584 HH12 ARG 74 2HH2 ARG 74 6.208 6.066 -10.334 585 HH21 ARG 74 1HH1 ARG 74 6.911 9.370 -11.118 586 HH22 ARG 74 2HH1 ARG 74 7.236 7.710 -11.494 587 H ASN 75 H ASN 75 0.277 11.543 -8.205 588 HA ASN 75 HA ASN 75 1.236 12.755 -10.657 589 HB2 ASN 75 2HB ASN 75 -0.747 11.140 -10.174 590 HB3 ASN 75 1HB ASN 75 -1.633 12.595 -9.715 591 HD21 ASN 75 1HD2 ASN 75 0.639 11.754 -12.402 592 HD22 ASN 75 2HD2 ASN 75 -0.354 12.380 -13.628 593 H SER 76 H SER 76 0.449 13.993 -7.616 594 HA SER 76 HA SER 76 0.472 16.232 -6.861 595 HB2 SER 76 2HB SER 76 1.654 16.338 -9.328 596 HB3 SER 76 1HB SER 76 0.257 17.384 -9.576 597 HG SER 76 HG SER 76 2.456 17.669 -7.887 598 H GLU 77 H GLU 77 -1.966 14.606 -7.473 599 HA GLU 77 HA GLU 77 -3.830 16.840 -8.108 600 HB2 GLU 77 2HB GLU 77 -5.155 15.259 -9.176 601 HB3 GLU 77 1HB GLU 77 -3.565 14.551 -9.415 602 HG2 GLU 77 2HG GLU 77 -3.859 13.035 -7.616 603 HG3 GLU 77 1HG GLU 77 -5.321 13.861 -7.079 604 H ILE 78 H ILE 78 -3.042 14.252 -5.925 605 HA ILE 78 HA ILE 78 -4.951 15.471 -3.920 606 HB ILE 78 HB ILE 78 -5.214 13.125 -3.087 607 HG12 ILE 78 2HG1 ILE 78 -4.411 11.675 -5.322 608 HG13 ILE 78 1HG1 ILE 78 -3.068 12.752 -4.978 609 HG21 ILE 78 1HG2 ILE 78 -6.313 14.323 -5.413 610 HG22 ILE 78 2HG2 ILE 78 -7.034 13.075 -4.399 611 HG23 ILE 78 3HG2 ILE 78 -6.045 12.620 -5.785 612 HD11 ILE 78 3HD1 ILE 78 -4.363 11.406 -2.670 613 HD12 ILE 78 1HD1 ILE 78 -2.682 11.870 -2.909 614 HD13 ILE 78 2HD1 ILE 78 -3.322 10.437 -3.705 615 H LYS 79 H LYS 79 -4.344 14.671 -1.633 616 HA LYS 79 HA LYS 79 -1.465 14.184 -1.193 617 HB2 LYS 79 2HB LYS 79 -3.015 16.657 -0.356 618 HB3 LYS 79 1HB LYS 79 -1.458 16.221 0.346 619 HG2 LYS 79 2HG LYS 79 -1.988 16.728 -2.598 620 HG3 LYS 79 1HG LYS 79 -1.178 17.839 -1.498 621 HD2 LYS 79 2HD LYS 79 -0.171 15.283 -2.689 622 HD3 LYS 79 1HD LYS 79 0.667 16.809 -2.441 623 HE2 LYS 79 2HE LYS 79 0.948 16.367 -0.088 624 HE3 LYS 79 1HE LYS 79 -0.132 14.958 -0.171 625 HZ1 LYS 79 3HZ LYS 79 2.454 15.293 -1.598 626 HZ2 LYS 79 1HZ LYS 79 1.382 14.003 -1.845 627 HZ3 LYS 79 2HZ LYS 79 2.132 14.203 -0.334 628 H ILE 80 H ILE 80 -1.167 13.111 0.833 629 HA ILE 80 HA ILE 80 -3.306 11.735 2.022 630 HB ILE 80 HB ILE 80 -0.571 12.560 2.902 631 HG12 ILE 80 2HG1 ILE 80 -0.111 10.205 2.653 632 HG13 ILE 80 1HG1 ILE 80 -1.832 9.848 2.504 633 HG21 ILE 80 1HG2 ILE 80 -2.761 11.601 4.611 634 HG22 ILE 80 2HG2 ILE 80 -1.251 12.393 5.062 635 HG23 ILE 80 3HG2 ILE 80 -1.275 10.661 4.736 636 HD11 ILE 80 3HD1 ILE 80 -0.719 9.846 0.295 637 HD12 ILE 80 1HD1 ILE 80 -0.218 11.517 0.555 638 HD13 ILE 80 2HD1 ILE 80 -1.931 11.122 0.407 639 H THR 81 H THR 81 -4.998 12.953 2.493 640 HA THR 81 HA THR 81 -4.782 15.397 4.165 641 HB THR 81 HB THR 81 -6.157 15.243 2.083 642 HG1 THR 81 1HG THR 81 -8.066 15.484 4.065 643 HG21 THR 81 3HG2 THR 81 -6.783 12.871 2.348 644 HG22 THR 81 1HG2 THR 81 -8.188 13.902 2.085 645 HG23 THR 81 2HG2 THR 81 -7.819 13.314 3.705 646 H SER 82 H SER 82 -4.424 12.481 5.147 647 HA SER 82 HA SER 82 -4.881 11.430 7.233 648 HB2 SER 82 2HB SER 82 -5.596 14.102 7.538 649 HB3 SER 82 1HB SER 82 -7.041 13.222 8.021 650 HG SER 82 HG SER 82 -6.035 12.675 9.774 651 H ASP 83 H ASP 83 -7.022 11.998 4.716 652 HA ASP 83 HA ASP 83 -9.041 10.084 5.819 653 HB2 ASP 83 2HB ASP 83 -9.626 12.541 5.185 654 HB3 ASP 83 1HB ASP 83 -9.425 12.005 3.516 655 H LEU 84 H LEU 84 -7.408 11.177 2.818 656 HA LEU 84 HA LEU 84 -8.093 8.859 1.264 657 HB2 LEU 84 2HB LEU 84 -5.717 10.749 1.139 658 HB3 LEU 84 1HB LEU 84 -6.241 9.690 -0.170 659 HG LEU 84 HG LEU 84 -7.772 12.009 1.033 660 HD11 LEU 84 1HD1 LEU 84 -6.572 11.410 -1.679 661 HD12 LEU 84 2HD1 LEU 84 -6.201 12.761 -0.607 662 HD13 LEU 84 3HD1 LEU 84 -7.760 12.689 -1.428 663 HD21 LEU 84 3HD2 LEU 84 -9.600 10.732 0.576 664 HD22 LEU 84 1HD2 LEU 84 -8.676 9.604 -0.417 665 HD23 LEU 84 2HD2 LEU 84 -9.244 11.124 -1.107 666 H LEU 85 H LEU 85 -5.688 9.531 3.694 667 HA LEU 85 HA LEU 85 -4.153 7.084 3.083 668 HB2 LEU 85 2HB LEU 85 -2.525 8.223 4.200 669 HB3 LEU 85 1HB LEU 85 -3.624 9.595 4.120 670 HG LEU 85 HG LEU 85 -4.617 8.491 6.321 671 HD11 LEU 85 1HD1 LEU 85 -3.064 6.530 6.162 672 HD12 LEU 85 2HD1 LEU 85 -2.891 7.426 7.670 673 HD13 LEU 85 3HD1 LEU 85 -1.708 7.636 6.379 674 HD21 LEU 85 3HD2 LEU 85 -3.201 10.002 7.605 675 HD22 LEU 85 1HD2 LEU 85 -3.584 10.753 6.056 676 HD23 LEU 85 2HD2 LEU 85 -2.001 10.020 6.312 677 H ASP 86 H ASP 86 -6.512 8.271 5.425 678 HA ASP 86 HA ASP 86 -6.322 6.073 7.290 679 HB2 ASP 86 2HB ASP 86 -7.713 8.501 6.970 680 HB3 ASP 86 1HB ASP 86 -8.964 7.262 7.036 681 H LYS 87 H LYS 87 -7.762 6.427 4.153 682 HA LYS 87 HA LYS 87 -9.535 4.082 4.498 683 HB2 LYS 87 2HB LYS 87 -8.869 5.934 2.178 684 HB3 LYS 87 1HB LYS 87 -10.075 4.648 2.101 685 HG2 LYS 87 2HG LYS 87 -10.122 7.153 3.787 686 HG3 LYS 87 1HG LYS 87 -11.326 6.593 2.628 687 HD2 LYS 87 2HD LYS 87 -11.542 4.530 4.204 688 HD3 LYS 87 1HD LYS 87 -10.749 5.560 5.397 689 HE2 LYS 87 2HE LYS 87 -12.525 7.135 5.388 690 HE3 LYS 87 1HE LYS 87 -13.183 6.505 3.864 691 HZ1 LYS 87 3HZ LYS 87 -12.856 4.630 6.081 692 HZ2 LYS 87 1HZ LYS 87 -14.043 4.676 4.870 693 HZ3 LYS 87 2HZ LYS 87 -14.136 5.741 6.191 694 H ILE 88 H ILE 88 -6.633 5.081 2.695 695 HA ILE 88 HA ILE 88 -6.169 2.566 1.399 696 HB ILE 88 HB ILE 88 -4.440 4.880 2.283 697 HG12 ILE 88 2HG1 ILE 88 -4.903 4.089 -0.550 698 HG13 ILE 88 1HG1 ILE 88 -6.241 4.835 0.325 699 HG21 ILE 88 1HG2 ILE 88 -3.555 2.274 1.629 700 HG22 ILE 88 2HG2 ILE 88 -2.583 3.725 1.858 701 HG23 ILE 88 3HG2 ILE 88 -3.186 3.313 0.254 702 HD11 ILE 88 3HD1 ILE 88 -5.246 6.782 -0.289 703 HD12 ILE 88 1HD1 ILE 88 -3.680 6.015 -0.558 704 HD13 ILE 88 2HD1 ILE 88 -4.182 6.451 1.077 705 H PHE 89 H PHE 89 -5.424 3.856 4.593 706 HA PHE 89 HA PHE 89 -3.672 1.711 5.423 707 HB2 PHE 89 2HB PHE 89 -3.558 3.846 6.525 708 HB3 PHE 89 1HB PHE 89 -5.294 3.830 6.840 709 HD1 PHE 89 1HD PHE 89 -6.260 2.249 8.500 710 HD2 PHE 89 2HD PHE 89 -2.018 2.628 7.931 711 HE1 PHE 89 1HE PHE 89 -5.866 1.074 10.647 712 HE2 PHE 89 2HE PHE 89 -1.626 1.454 10.080 713 HZ PHE 89 HZ PHE 89 -3.550 0.675 11.437 714 H ALA 90 H ALA 90 -7.088 2.308 5.497 715 HA ALA 90 HA ALA 90 -7.819 0.107 7.236 716 HB1 ALA 90 1HB ALA 90 -9.537 1.657 7.025 717 HB2 ALA 90 2HB ALA 90 -10.020 0.559 5.732 718 HB3 ALA 90 3HB ALA 90 -9.124 2.031 5.353 719 H GLY 91 H GLY 91 -7.232 0.609 3.817 720 HA2 GLY 91 2HA GLY 91 -8.164 -1.972 2.918 721 HA3 GLY 91 1HA GLY 91 -7.072 -0.899 2.031 722 H VAL 92 H VAL 92 -5.072 -0.605 3.959 723 HA VAL 92 HA VAL 92 -3.480 -2.975 3.572 724 HB VAL 92 HB VAL 92 -3.348 -0.415 5.157 725 HG11 VAL 92 1HG1 VAL 92 -1.111 -1.056 5.983 726 HG12 VAL 92 2HG1 VAL 92 -1.314 -2.665 5.290 727 HG13 VAL 92 3HG1 VAL 92 -2.349 -2.139 6.618 728 HG21 VAL 92 3HG2 VAL 92 -1.079 -0.546 3.715 729 HG22 VAL 92 1HG2 VAL 92 -2.594 0.044 3.032 730 HG23 VAL 92 2HG2 VAL 92 -2.084 -1.620 2.741 731 H ASP 93 H ASP 93 -5.777 -1.898 5.940 732 HA ASP 93 HA ASP 93 -5.005 -3.639 8.123 733 HB2 ASP 93 2HB ASP 93 -6.824 -1.557 7.568 734 HB3 ASP 93 1HB ASP 93 -7.833 -2.957 7.940 735 H MET 94 H MET 94 -6.836 -3.985 5.174 736 HA MET 94 HA MET 94 -8.185 -6.464 5.939 737 HB2 MET 94 2HB MET 94 -7.630 -5.216 3.222 738 HB3 MET 94 1HB MET 94 -8.876 -6.409 3.586 739 HG2 MET 94 2HG MET 94 -10.065 -4.856 4.987 740 HG3 MET 94 1HG MET 94 -8.739 -3.698 4.922 741 HE1 MET 94 3HE MET 94 -11.483 -3.297 4.705 742 HE2 MET 94 1HE MET 94 -12.338 -3.325 3.157 743 HE3 MET 94 2HE MET 94 -11.384 -1.915 3.618 744 H ILE 95 H ILE 95 -5.514 -5.655 3.663 745 HA ILE 95 HA ILE 95 -4.758 -8.280 3.012 746 HB ILE 95 HB ILE 95 -2.636 -7.149 2.446 747 HG12 ILE 95 2HG1 ILE 95 -3.819 -4.778 3.902 748 HG13 ILE 95 1HG1 ILE 95 -2.513 -5.782 4.533 749 HG21 ILE 95 1HG2 ILE 95 -3.889 -5.042 1.345 750 HG22 ILE 95 2HG2 ILE 95 -5.292 -6.007 1.802 751 HG23 ILE 95 3HG2 ILE 95 -4.068 -6.683 0.727 752 HD11 ILE 95 3HD1 ILE 95 -1.298 -4.075 3.525 753 HD12 ILE 95 1HD1 ILE 95 -2.478 -3.860 2.232 754 HD13 ILE 95 2HD1 ILE 95 -1.384 -5.245 2.209 755 H THR 96 H THR 96 -3.937 -6.240 5.796 756 HA THR 96 HA THR 96 -1.950 -7.987 6.943 757 HB THR 96 HB THR 96 -3.856 -5.964 8.179 758 HG1 THR 96 1HG THR 96 -2.178 -5.481 6.407 759 HG21 THR 96 3HG2 THR 96 -1.273 -7.188 9.183 760 HG22 THR 96 1HG2 THR 96 -2.875 -7.362 9.900 761 HG23 THR 96 2HG2 THR 96 -2.063 -5.797 9.924 762 H ARG 97 H ARG 97 -5.466 -7.736 7.110 763 HA ARG 97 HA ARG 97 -5.710 -9.841 9.148 764 HB2 ARG 97 2HB ARG 97 -7.503 -8.064 7.515 765 HB3 ARG 97 1HB ARG 97 -8.202 -9.468 8.322 766 HG2 ARG 97 2HG ARG 97 -7.921 -8.577 10.403 767 HG3 ARG 97 1HG ARG 97 -6.383 -7.824 9.982 768 HD2 ARG 97 2HD ARG 97 -7.452 -5.842 9.776 769 HD3 ARG 97 1HD ARG 97 -8.408 -6.524 8.445 770 HE ARG 97 HE ARG 97 -10.076 -7.254 10.089 771 HH11 ARG 97 1HH1 ARG 97 -7.324 -6.101 11.711 772 HH12 ARG 97 2HH1 ARG 97 -8.206 -5.305 12.971 773 HH21 ARG 97 1HH2 ARG 97 -11.306 -5.877 11.527 774 HH22 ARG 97 2HH2 ARG 97 -10.460 -5.177 12.866 775 H MET 98 H MET 98 -5.983 -9.510 5.634 776 HA MET 98 HA MET 98 -7.069 -12.164 5.176 777 HB2 MET 98 2HB MET 98 -5.517 -10.235 3.407 778 HB3 MET 98 1HB MET 98 -6.445 -11.619 2.830 779 HG2 MET 98 2HG MET 98 -8.481 -10.615 3.261 780 HG3 MET 98 1HG MET 98 -7.839 -9.647 4.588 781 HE1 MET 98 3HE MET 98 -9.679 -9.239 1.931 782 HE2 MET 98 1HE MET 98 -8.532 -9.841 0.729 783 HE3 MET 98 2HE MET 98 -9.009 -8.145 0.723 784 H VAL 99 H VAL 99 -3.870 -10.687 5.330 785 HA VAL 99 HA VAL 99 -2.363 -13.007 4.495 786 HB VAL 99 HB VAL 99 -1.840 -10.406 5.935 787 HG11 VAL 99 1HG1 VAL 99 -0.218 -11.830 6.944 788 HG12 VAL 99 2HG1 VAL 99 0.632 -11.039 5.616 789 HG13 VAL 99 3HG1 VAL 99 0.068 -12.699 5.435 790 HG21 VAL 99 3HG2 VAL 99 -1.162 -9.661 3.882 791 HG22 VAL 99 1HG2 VAL 99 -2.151 -10.996 3.293 792 HG23 VAL 99 2HG2 VAL 99 -0.409 -11.199 3.464 793 H ASP 100 H ASP 100 -3.519 -11.748 7.622 794 HA ASP 100 HA ASP 100 -2.034 -13.639 9.245 795 HB2 ASP 100 2HB ASP 100 -3.439 -11.342 9.661 796 HB3 ASP 100 1HB ASP 100 -4.627 -12.534 10.189 797 H LYS 101 H LYS 101 -5.119 -13.658 7.574 798 HA LYS 101 HA LYS 101 -5.917 -16.217 8.803 799 HB2 LYS 101 2HB LYS 101 -7.946 -15.378 8.315 800 HB3 LYS 101 1HB LYS 101 -7.159 -13.956 7.645 801 HG2 LYS 101 2HG LYS 101 -6.902 -15.715 5.564 802 HG3 LYS 101 1HG LYS 101 -8.434 -16.230 6.264 803 HD2 LYS 101 2HD LYS 101 -8.540 -13.469 6.328 804 HD3 LYS 101 1HD LYS 101 -7.769 -13.838 4.783 805 HE2 LYS 101 2HE LYS 101 -10.037 -14.003 4.205 806 HE3 LYS 101 1HE LYS 101 -9.673 -15.680 4.650 807 HZ1 LYS 101 3HZ LYS 101 -10.345 -13.881 6.832 808 HZ2 LYS 101 1HZ LYS 101 -10.758 -15.510 6.605 809 HZ3 LYS 101 2HZ LYS 101 -11.625 -14.294 5.795 810 H ILE 102 H ILE 102 -4.722 -14.863 5.771 811 HA ILE 102 HA ILE 102 -4.904 -17.201 4.145 812 HB ILE 102 HB ILE 102 -3.292 -14.664 4.246 813 HG12 ILE 102 2HG1 ILE 102 -5.097 -15.965 2.182 814 HG13 ILE 102 1HG1 ILE 102 -5.541 -14.651 3.272 815 HG21 ILE 102 1HG2 ILE 102 -1.689 -16.444 3.550 816 HG22 ILE 102 2HG2 ILE 102 -2.026 -15.285 2.263 817 HG23 ILE 102 3HG2 ILE 102 -2.787 -16.877 2.238 818 HD11 ILE 102 3HD1 ILE 102 -4.205 -14.502 0.725 819 HD12 ILE 102 1HD1 ILE 102 -3.164 -13.835 1.981 820 HD13 ILE 102 2HD1 ILE 102 -4.787 -13.187 1.744 821 H VAL 103 H VAL 103 -2.719 -16.058 6.587 822 HA VAL 103 HA VAL 103 -0.707 -18.167 6.201 823 HB VAL 103 HB VAL 103 -1.284 -15.894 8.088 824 HG11 VAL 103 1HG1 VAL 103 0.676 -16.554 9.460 825 HG12 VAL 103 2HG1 VAL 103 0.797 -18.059 8.550 826 HG13 VAL 103 3HG1 VAL 103 -0.614 -17.753 9.563 827 HG21 VAL 103 3HG2 VAL 103 1.310 -15.687 7.416 828 HG22 VAL 103 1HG2 VAL 103 0.022 -15.088 6.372 829 HG23 VAL 103 2HG2 VAL 103 0.757 -16.660 6.053 830 H SER 104 H SER 104 -3.558 -17.505 8.119 831 HA SER 104 HA SER 104 -3.230 -19.805 9.899 832 HB2 SER 104 2HB SER 104 -4.302 -17.570 10.427 833 HB3 SER 104 1HB SER 104 -5.626 -18.041 9.362 834 HG SER 104 HG SER 104 -4.727 -19.617 11.544 835 H GLU 105 H GLU 105 -4.575 -19.208 6.824 836 HA GLU 105 HA GLU 105 -5.566 -21.996 6.652 837 HB2 GLU 105 2HB GLU 105 -7.413 -19.776 5.807 838 HB3 GLU 105 1HB GLU 105 -7.810 -21.426 6.278 839 HG2 GLU 105 2HG GLU 105 -7.139 -20.864 8.626 840 HG3 GLU 105 1HG GLU 105 -6.907 -19.191 8.117 841 H GLY 106 H GLY 106 -5.053 -18.853 5.064 842 HA2 GLY 106 2HA GLY 106 -3.736 -18.771 2.977 843 HA3 GLY 106 1HA GLY 106 -4.391 -20.355 2.563 844 H SER 107 H SER 107 -6.555 -18.035 3.958 845 HA SER 107 HA SER 107 -7.845 -17.671 1.264 846 HB2 SER 107 2HB SER 107 -9.142 -17.359 3.962 847 HB3 SER 107 1HB SER 107 -9.903 -17.711 2.413 848 HG SER 107 HG SER 107 -9.426 -19.759 2.647 849 H ASP 108 H ASP 108 -7.922 -15.637 0.503 850 HA ASP 108 HA ASP 108 -7.112 -13.400 2.304 851 HB2 ASP 108 2HB ASP 108 -6.687 -12.246 0.197 852 HB3 ASP 108 1HB ASP 108 -6.002 -13.866 0.073 853 H ASP 109 H ASP 109 -9.843 -14.932 1.865 854 HA ASP 109 HA ASP 109 -11.567 -12.619 1.091 855 HB2 ASP 109 2HB ASP 109 -11.888 -15.587 1.494 856 HB3 ASP 109 1HB ASP 109 -13.310 -14.546 1.420 857 H ILE 110 H ILE 110 -11.294 -11.310 3.040 858 HA ILE 110 HA ILE 110 -12.238 -12.542 5.585 859 HB ILE 110 HB ILE 110 -11.364 -10.345 6.509 860 HG12 ILE 110 2HG1 ILE 110 -10.188 -10.004 3.741 861 HG13 ILE 110 1HG1 ILE 110 -11.661 -9.177 4.248 862 HG21 ILE 110 1HG2 ILE 110 -9.829 -12.094 6.738 863 HG22 ILE 110 2HG2 ILE 110 -8.908 -10.939 5.775 864 HG23 ILE 110 3HG2 ILE 110 -9.677 -12.321 4.995 865 HD11 ILE 110 3HD1 ILE 110 -10.517 -8.003 5.986 866 HD12 ILE 110 1HD1 ILE 110 -9.482 -7.876 4.564 867 HD13 ILE 110 2HD1 ILE 110 -9.094 -9.031 5.839 868 H GLY 111 H GLY 111 -13.911 -11.592 3.152 869 HA2 GLY 111 2HA GLY 111 -16.158 -10.843 3.072 870 HA3 GLY 111 1HA GLY 111 -16.027 -10.368 4.766 871 H GLU 112 H GLU 112 -13.355 -9.060 3.431 872 HA GLU 112 HA GLU 112 -14.468 -6.373 3.435 873 HB2 GLU 112 2HB GLU 112 -11.791 -7.612 2.754 874 HB3 GLU 112 1HB GLU 112 -12.069 -5.871 2.682 875 HG2 GLU 112 2HG GLU 112 -12.331 -7.667 5.107 876 HG3 GLU 112 1HG GLU 112 -11.171 -6.360 4.866 877 H ASN 113 H ASN 113 -14.241 -4.886 1.557 878 HA ASN 113 HA ASN 113 -14.805 -6.288 -1.034 879 HB2 ASN 113 2HB ASN 113 -16.259 -4.466 0.507 880 HB3 ASN 113 1HB ASN 113 -15.596 -3.494 -0.807 881 HD21 ASN 113 1HD2 ASN 113 -18.375 -3.953 -0.742 882 HD22 ASN 113 2HD2 ASN 113 -18.803 -5.006 -2.003 883 H ILE 114 H ILE 114 -13.765 -5.485 -2.926 884 HA ILE 114 HA ILE 114 -11.488 -3.617 -2.379 885 HB ILE 114 HB ILE 114 -11.780 -5.657 -4.602 886 HG12 ILE 114 2HG1 ILE 114 -11.845 -6.926 -2.569 887 HG13 ILE 114 1HG1 ILE 114 -10.181 -7.009 -3.145 888 HG21 ILE 114 1HG2 ILE 114 -10.059 -3.565 -4.374 889 HG22 ILE 114 2HG2 ILE 114 -9.662 -5.071 -5.204 890 HG23 ILE 114 3HG2 ILE 114 -9.149 -4.823 -3.534 891 HD11 ILE 114 3HD1 ILE 114 -9.465 -5.343 -1.572 892 HD12 ILE 114 1HD1 ILE 114 -10.434 -6.508 -0.670 893 HD13 ILE 114 2HD1 ILE 114 -11.127 -4.958 -1.135 894 H ASP 115 H ASP 115 -13.091 -4.660 -5.413 895 HA ASP 115 HA ASP 115 -12.870 -2.250 -6.794 896 HB2 ASP 115 2HB ASP 115 -13.961 -4.657 -7.283 897 HB3 ASP 115 1HB ASP 115 -15.444 -3.756 -6.962 898 H VAL 116 H VAL 116 -14.892 -3.104 -4.164 899 HA VAL 116 HA VAL 116 -16.618 -0.743 -4.364 900 HB VAL 116 HB VAL 116 -16.319 -3.070 -2.468 901 HG11 VAL 116 1HG1 VAL 116 -17.641 -0.514 -2.067 902 HG12 VAL 116 2HG1 VAL 116 -17.432 -1.848 -0.932 903 HG13 VAL 116 3HG1 VAL 116 -18.808 -1.836 -2.034 904 HG21 VAL 116 3HG2 VAL 116 -18.374 -2.292 -4.559 905 HG22 VAL 116 1HG2 VAL 116 -18.612 -3.605 -3.406 906 HG23 VAL 116 2HG2 VAL 116 -17.303 -3.693 -4.585 907 H PHE 117 H PHE 117 -14.382 -2.083 -1.975 908 HA PHE 117 HA PHE 117 -14.304 0.308 -0.354 909 HB2 PHE 117 2HB PHE 117 -13.659 -2.147 0.158 910 HB3 PHE 117 1HB PHE 117 -12.104 -1.749 -0.575 911 HD1 PHE 117 1HD PHE 117 -14.382 -1.113 2.246 912 HD2 PHE 117 2HD PHE 117 -10.588 -0.142 0.484 913 HE1 PHE 117 1HE PHE 117 -13.672 -0.045 4.367 914 HE2 PHE 117 2HE PHE 117 -9.877 0.926 2.606 915 HZ PHE 117 HZ PHE 117 -11.419 0.974 4.548 916 H SER 118 H SER 118 -12.798 -0.572 -3.335 917 HA SER 118 HA SER 118 -10.677 1.447 -3.093 918 HB2 SER 118 2HB SER 118 -10.007 -0.547 -4.209 919 HB3 SER 118 1HB SER 118 -11.524 -0.644 -5.099 920 HG SER 118 HG SER 118 -9.230 0.628 -5.740 921 H ASP 119 H ASP 119 -13.697 0.768 -4.650 922 HA ASP 119 HA ASP 119 -13.800 3.102 -6.350 923 HB2 ASP 119 2HB ASP 119 -15.240 1.309 -6.911 924 HB3 ASP 119 1HB ASP 119 -15.756 1.099 -5.237 925 H THR 120 H THR 120 -14.653 2.344 -3.096 926 HA THR 120 HA THR 120 -16.125 4.707 -2.419 927 HB THR 120 HB THR 120 -14.730 2.435 -1.110 928 HG1 THR 120 1HG THR 120 -17.090 3.584 -0.186 929 HG21 THR 120 3HG2 THR 120 -15.154 5.086 0.249 930 HG22 THR 120 1HG2 THR 120 -13.752 4.016 0.316 931 HG23 THR 120 2HG2 THR 120 -15.236 3.580 1.164 932 H ILE 121 H ILE 121 -12.787 3.762 -2.215 933 HA ILE 121 HA ILE 121 -11.809 6.314 -1.224 934 HB ILE 121 HB ILE 121 -10.961 3.606 -1.696 935 HG12 ILE 121 2HG1 ILE 121 -10.878 4.886 0.425 936 HG13 ILE 121 1HG1 ILE 121 -9.323 4.159 0.018 937 HG21 ILE 121 1HG2 ILE 121 -8.540 4.197 -2.274 938 HG22 ILE 121 2HG2 ILE 121 -9.168 5.741 -2.850 939 HG23 ILE 121 3HG2 ILE 121 -9.698 4.236 -3.603 940 HD11 ILE 121 3HD1 ILE 121 -8.338 6.183 -0.043 941 HD12 ILE 121 1HD1 ILE 121 -9.850 6.891 0.526 942 HD13 ILE 121 2HD1 ILE 121 -9.531 6.766 -1.203 943 H LYS 122 H LYS 122 -11.888 4.640 -4.372 944 HA LYS 122 HA LYS 122 -10.478 6.607 -5.890 945 HB2 LYS 122 2HB LYS 122 -12.149 4.208 -6.251 946 HB3 LYS 122 1HB LYS 122 -12.310 5.372 -7.571 947 HG2 LYS 122 2HG LYS 122 -10.320 4.717 -8.385 948 HG3 LYS 122 1HG LYS 122 -9.560 5.245 -6.884 949 HD2 LYS 122 2HD LYS 122 -10.904 2.747 -6.429 950 HD3 LYS 122 1HD LYS 122 -9.835 2.589 -7.823 951 HE2 LYS 122 2HE LYS 122 -8.551 4.113 -5.694 952 HE3 LYS 122 1HE LYS 122 -9.039 2.497 -5.141 953 HZ1 LYS 122 3HZ LYS 122 -7.696 2.976 -7.741 954 HZ2 LYS 122 1HZ LYS 122 -7.954 1.489 -6.967 955 HZ3 LYS 122 2HZ LYS 122 -6.839 2.597 -6.324 956 H SER 123 H SER 123 -13.837 6.193 -4.931 957 HA SER 123 HA SER 123 -14.771 8.475 -6.510 958 HB2 SER 123 2HB SER 123 -15.997 6.305 -5.830 959 HB3 SER 123 1HB SER 123 -16.171 7.068 -4.253 960 HG SER 123 HG SER 123 -17.180 7.894 -6.764 961 H PHE 124 H PHE 124 -13.209 7.990 -3.569 962 HA PHE 124 HA PHE 124 -14.388 10.158 -2.031 963 HB2 PHE 124 2HB PHE 124 -12.704 8.007 -1.600 964 HB3 PHE 124 1HB PHE 124 -11.605 9.382 -1.487 965 HD1 PHE 124 1HD PHE 124 -11.911 11.111 0.228 966 HD2 PHE 124 2HD PHE 124 -14.527 7.712 -0.009 967 HE1 PHE 124 1HE PHE 124 -12.778 11.621 2.493 968 HE2 PHE 124 2HE PHE 124 -15.394 8.223 2.258 969 HZ PHE 124 HZ PHE 124 -14.519 10.176 3.509 970 H ALA 125 H ALA 125 -12.566 10.104 -4.797 971 HA ALA 125 HA ALA 125 -11.961 12.957 -4.656 972 HB1 ALA 125 1HB ALA 125 -9.994 10.876 -3.955 973 HB2 ALA 125 2HB ALA 125 -9.986 12.599 -3.576 974 HB3 ALA 125 3HB ALA 125 -9.412 12.038 -5.146 975 H SER 126 H SER 126 -13.519 11.725 -6.523 976 HA SER 126 HA SER 126 -12.330 12.385 -9.021 977 HB2 SER 126 2HB SER 126 -11.195 10.512 -9.610 978 HB3 SER 126 1HB SER 126 -11.324 10.029 -7.923 979 HG SER 126 HG SER 126 -12.254 8.391 -8.996 980 H SER 127 H SER 127 -13.704 11.507 -10.892 981 HA SER 127 HA SER 127 -16.434 11.979 -10.563 982 HB2 SER 127 2HB SER 127 -16.357 10.170 -12.614 983 HB3 SER 127 1HB SER 127 -15.885 11.858 -12.777 984 HG SER 127 HG SER 127 -14.269 10.389 -13.514 985 H GLY 128 H GLY 128 -15.363 8.662 -11.297 986 HA2 GLY 128 2HA GLY 128 -15.980 6.610 -10.320 987 HA3 GLY 128 1HA GLY 128 -16.562 7.513 -8.920 988 H LYS 129 H LYS 129 -17.437 6.780 -12.305 989 HA LYS 129 HA LYS 129 -20.106 5.960 -11.649 990 HB2 LYS 129 2HB LYS 129 -19.829 8.596 -11.238 991 HB3 LYS 129 1HB LYS 129 -20.162 8.639 -12.970 992 HG2 LYS 129 2HG LYS 129 -22.326 8.704 -12.146 993 HG3 LYS 129 1HG LYS 129 -22.105 6.961 -12.297 994 HD2 LYS 129 2HD LYS 129 -22.877 7.095 -10.112 995 HD3 LYS 129 1HD LYS 129 -21.136 7.195 -9.843 996 HE2 LYS 129 2HE LYS 129 -21.799 9.054 -8.622 997 HE3 LYS 129 1HE LYS 129 -21.651 9.819 -10.218 998 HZ1 LYS 129 3HZ LYS 129 -23.870 9.919 -10.480 999 HZ2 LYS 129 1HZ LYS 129 -23.915 9.808 -8.789 1000 HZ3 LYS 129 2HZ LYS 129 -24.142 8.417 -9.736 1001 H GLU 130 H GLU 130 -17.838 5.321 -13.463 1002 HA GLU 130 HA GLU 130 -19.148 5.685 -16.133 1003 HB2 GLU 130 2HB GLU 130 -16.513 6.031 -15.137 1004 HB3 GLU 130 1HB GLU 130 -16.464 4.627 -16.204 1005 HG2 GLU 130 2HG GLU 130 -16.418 6.054 -17.946 1006 HG3 GLU 130 1HG GLU 130 -18.077 6.495 -17.542 1007 H LYS 131 H LYS 131 -19.339 3.802 -17.497 1008 HA LYS 131 HA LYS 131 -19.594 1.265 -15.981 1009 HB2 LYS 131 2HB LYS 131 -20.639 2.510 -18.472 1010 HB3 LYS 131 1HB LYS 131 -20.478 0.753 -18.491 1011 HG2 LYS 131 2HG LYS 131 -21.690 1.923 -16.045 1012 HG3 LYS 131 1HG LYS 131 -22.663 2.014 -17.514 1013 HD2 LYS 131 2HD LYS 131 -22.805 -0.299 -17.727 1014 HD3 LYS 131 1HD LYS 131 -21.318 -0.575 -16.817 1015 HE2 LYS 131 2HE LYS 131 -22.987 0.705 -14.977 1016 HE3 LYS 131 1HE LYS 131 -24.062 -0.421 -15.833 1017 HZ1 LYS 131 3HZ LYS 131 -21.392 -1.119 -14.728 1018 HZ2 LYS 131 1HZ LYS 131 -22.466 -2.182 -15.497 1019 HZ3 LYS 131 2HZ LYS 131 -22.873 -1.504 -13.993 1020 H LEU 132 H LEU 132 -18.334 -0.557 -16.435 1021 HA LEU 132 HA LEU 132 -16.757 -0.963 -18.786 1022 HB2 LEU 132 2HB LEU 132 -15.788 0.963 -16.885 1023 HB3 LEU 132 1HB LEU 132 -14.689 -0.418 -16.900 1024 HG LEU 132 HG LEU 132 -15.626 1.105 -19.350 1025 HD11 LEU 132 1HD1 LEU 132 -13.719 2.348 -19.234 1026 HD12 LEU 132 2HD1 LEU 132 -12.764 1.001 -18.617 1027 HD13 LEU 132 3HD1 LEU 132 -13.777 1.940 -17.520 1028 HD21 LEU 132 3HD2 LEU 132 -13.710 -0.282 -20.373 1029 HD22 LEU 132 1HD2 LEU 132 -15.208 -1.139 -20.012 1030 HD23 LEU 132 2HD2 LEU 132 -13.825 -1.284 -18.927 1031 H GLU 133 H GLU 133 -15.250 -2.839 -18.488 1032 HA GLU 133 HA GLU 133 -14.734 -4.961 -17.574 1033 HB2 GLU 133 2HB GLU 133 -14.901 -2.997 -15.431 1034 HB3 GLU 133 1HB GLU 133 -15.339 -4.605 -14.856 1035 HG2 GLU 133 2HG GLU 133 -13.241 -5.463 -15.232 1036 HG3 GLU 133 1HG GLU 133 -12.945 -4.411 -16.617 Start of MODEL 19 1 H1 MET 1 1HT MET 1 4.747 -31.841 1.035 2 H2 MET 1 2HT MET 1 3.961 -30.487 0.374 3 H3 MET 1 3HT MET 1 5.326 -30.280 1.365 4 HA MET 1 HA MET 1 6.681 -31.478 -0.321 5 HB2 MET 1 2HB MET 1 4.979 -32.806 -1.321 6 HB3 MET 1 1HB MET 1 3.943 -31.406 -1.601 7 HG2 MET 1 2HG MET 1 5.435 -30.554 -3.298 8 HG3 MET 1 1HG MET 1 6.640 -31.787 -2.927 9 HE1 MET 1 2HE MET 1 6.920 -32.352 -5.183 10 HE2 MET 1 3HE MET 1 6.017 -33.641 -5.976 11 HE3 MET 1 1HE MET 1 6.821 -33.942 -4.428 12 H MET 2 H MET 2 8.012 -29.766 -0.770 13 HA MET 2 HA MET 2 8.701 -27.588 -1.393 14 HB2 MET 2 2HB MET 2 7.637 -28.888 -3.455 15 HB3 MET 2 1HB MET 2 6.421 -27.615 -3.338 16 HG2 MET 2 2HG MET 2 8.484 -26.008 -3.230 17 HG3 MET 2 1HG MET 2 9.359 -27.368 -3.934 18 HE1 MET 2 3HE MET 2 9.592 -27.905 -5.954 19 HE2 MET 2 1HE MET 2 9.863 -26.243 -6.495 20 HE3 MET 2 2HE MET 2 8.813 -27.314 -7.419 21 H GLU 3 H GLU 3 8.058 -26.371 0.480 22 HA GLU 3 HA GLU 3 5.557 -24.771 0.092 23 HB2 GLU 3 2HB GLU 3 5.168 -25.049 2.540 24 HB3 GLU 3 1HB GLU 3 5.098 -26.587 1.672 25 HG2 GLU 3 2HG GLU 3 7.246 -27.234 2.432 26 HG3 GLU 3 1HG GLU 3 7.665 -25.583 2.902 27 H GLU 4 H GLU 4 8.837 -24.700 0.486 28 HA GLU 4 HA GLU 4 9.020 -22.591 2.450 29 HB2 GLU 4 2HB GLU 4 10.787 -24.297 1.868 30 HB3 GLU 4 1HB GLU 4 11.026 -23.441 0.345 31 HG2 GLU 4 2HG GLU 4 11.840 -21.502 1.425 32 HG3 GLU 4 1HG GLU 4 11.193 -22.000 2.989 33 H TYR 5 H TYR 5 8.102 -22.649 -0.787 34 HA TYR 5 HA TYR 5 9.142 -20.070 -1.618 35 HB2 TYR 5 2HB TYR 5 7.296 -22.178 -2.601 36 HB3 TYR 5 1HB TYR 5 7.028 -20.559 -3.250 37 HD1 TYR 5 2HD TYR 5 8.787 -19.403 -4.531 38 HD2 TYR 5 1HD TYR 5 9.320 -23.416 -3.098 39 HE1 TYR 5 2HE TYR 5 10.727 -19.687 -6.050 40 HE2 TYR 5 1HE TYR 5 11.260 -23.701 -4.616 41 HH TYR 5 HH TYR 5 12.665 -21.033 -6.321 42 H LEU 6 H LEU 6 6.473 -21.182 0.203 43 HA LEU 6 HA LEU 6 4.941 -18.664 -0.034 44 HB2 LEU 6 2HB LEU 6 4.476 -21.071 1.745 45 HB3 LEU 6 1HB LEU 6 3.283 -19.891 1.206 46 HG LEU 6 HG LEU 6 4.562 -20.951 -1.114 47 HD11 LEU 6 1HD1 LEU 6 3.211 -23.245 0.154 48 HD12 LEU 6 2HD1 LEU 6 4.768 -22.832 0.874 49 HD13 LEU 6 3HD1 LEU 6 4.662 -23.205 -0.846 50 HD21 LEU 6 3HD2 LEU 6 2.391 -21.082 -1.832 51 HD22 LEU 6 1HD2 LEU 6 2.081 -20.132 -0.378 52 HD23 LEU 6 2HD2 LEU 6 1.846 -21.881 -0.356 53 H GLY 7 H GLY 7 6.676 -20.537 2.464 54 HA2 GLY 7 2HA GLY 7 6.264 -18.888 4.684 55 HA3 GLY 7 1HA GLY 7 7.761 -19.783 4.411 56 H VAL 8 H VAL 8 8.602 -18.472 2.032 57 HA VAL 8 HA VAL 8 9.611 -15.973 3.211 58 HB VAL 8 HB VAL 8 10.179 -17.668 0.791 59 HG11 VAL 8 1HG1 VAL 8 10.493 -15.564 -0.190 60 HG12 VAL 8 2HG1 VAL 8 12.096 -15.917 0.457 61 HG13 VAL 8 3HG1 VAL 8 11.015 -14.827 1.325 62 HG21 VAL 8 3HG2 VAL 8 11.359 -17.150 3.436 63 HG22 VAL 8 1HG2 VAL 8 12.533 -17.104 2.120 64 HG23 VAL 8 2HG2 VAL 8 11.550 -18.546 2.374 65 H PHE 9 H PHE 9 7.333 -16.987 0.827 66 HA PHE 9 HA PHE 9 7.098 -14.567 -0.694 67 HB2 PHE 9 2HB PHE 9 6.119 -16.593 -1.502 68 HB3 PHE 9 1HB PHE 9 5.236 -16.846 0.004 69 HD1 PHE 9 1HD PHE 9 5.626 -14.147 -2.583 70 HD2 PHE 9 2HD PHE 9 2.966 -16.356 -0.035 71 HE1 PHE 9 1HE PHE 9 3.699 -12.881 -3.496 72 HE2 PHE 9 2HE PHE 9 1.040 -15.091 -0.949 73 HZ PHE 9 HZ PHE 9 1.407 -13.354 -2.679 74 H VAL 10 H VAL 10 5.303 -15.748 2.166 75 HA VAL 10 HA VAL 10 3.784 -13.270 2.442 76 HB VAL 10 HB VAL 10 4.236 -15.464 4.479 77 HG11 VAL 10 1HG1 VAL 10 2.629 -13.131 4.394 78 HG12 VAL 10 2HG1 VAL 10 2.589 -14.418 5.598 79 HG13 VAL 10 3HG1 VAL 10 1.538 -14.502 4.185 80 HG21 VAL 10 3HG2 VAL 10 2.880 -15.521 1.842 81 HG22 VAL 10 1HG2 VAL 10 1.959 -16.196 3.186 82 HG23 VAL 10 2HG2 VAL 10 3.549 -16.849 2.790 83 H ASP 11 H ASP 11 6.749 -14.625 3.838 84 HA ASP 11 HA ASP 11 7.057 -12.873 6.047 85 HB2 ASP 11 2HB ASP 11 8.814 -14.496 4.255 86 HB3 ASP 11 1HB ASP 11 9.591 -13.350 5.347 87 H GLU 12 H GLU 12 7.449 -12.375 2.670 88 HA GLU 12 HA GLU 12 8.843 -9.781 3.009 89 HB2 GLU 12 2HB GLU 12 7.884 -11.446 0.662 90 HB3 GLU 12 1HB GLU 12 8.628 -9.859 0.459 91 HG2 GLU 12 2HG GLU 12 10.563 -10.776 1.892 92 HG3 GLU 12 1HG GLU 12 9.866 -12.369 1.591 93 H THR 13 H THR 13 5.699 -11.124 2.153 94 HA THR 13 HA THR 13 4.377 -8.788 1.228 95 HB THR 13 HB THR 13 3.650 -11.384 2.552 96 HG1 THR 13 1HG THR 13 2.786 -11.753 0.566 97 HG21 THR 13 3HG2 THR 13 1.903 -8.975 2.316 98 HG22 THR 13 1HG2 THR 13 1.899 -10.253 3.532 99 HG23 THR 13 2HG2 THR 13 1.197 -10.548 1.941 100 H LYS 14 H LYS 14 4.698 -10.092 4.547 101 HA LYS 14 HA LYS 14 3.252 -7.874 5.774 102 HB2 LYS 14 2HB LYS 14 5.085 -10.046 6.851 103 HB3 LYS 14 1HB LYS 14 4.110 -8.977 7.859 104 HG2 LYS 14 2HG LYS 14 2.154 -10.036 7.330 105 HG3 LYS 14 1HG LYS 14 2.666 -10.375 5.675 106 HD2 LYS 14 2HD LYS 14 3.042 -12.498 6.343 107 HD3 LYS 14 1HD LYS 14 4.419 -11.874 7.251 108 HE2 LYS 14 2HE LYS 14 3.129 -11.670 9.260 109 HE3 LYS 14 1HE LYS 14 1.605 -11.918 8.385 110 HZ1 LYS 14 3HZ LYS 14 2.787 -14.080 7.607 111 HZ2 LYS 14 1HZ LYS 14 2.037 -14.036 9.128 112 HZ3 LYS 14 2HZ LYS 14 3.723 -13.862 9.009 113 H GLU 15 H GLU 15 6.689 -8.725 5.326 114 HA GLU 15 HA GLU 15 7.787 -6.621 6.899 115 HB2 GLU 15 2HB GLU 15 8.692 -8.236 4.519 116 HB3 GLU 15 1HB GLU 15 9.743 -7.015 5.242 117 HG2 GLU 15 2HG GLU 15 9.508 -8.128 7.440 118 HG3 GLU 15 1HG GLU 15 8.497 -9.365 6.692 119 H TYR 16 H TYR 16 6.120 -6.583 3.950 120 HA TYR 16 HA TYR 16 7.249 -4.006 3.066 121 HB2 TYR 16 2HB TYR 16 5.447 -6.135 1.989 122 HB3 TYR 16 1HB TYR 16 5.267 -4.510 1.323 123 HD1 TYR 16 1HD TYR 16 7.889 -3.384 1.264 124 HD2 TYR 16 2HD TYR 16 6.718 -7.451 0.524 125 HE1 TYR 16 1HE TYR 16 9.921 -3.718 -0.118 126 HE2 TYR 16 2HE TYR 16 8.750 -7.784 -0.859 127 HH TYR 16 HH TYR 16 11.361 -5.861 -0.779 128 H LEU 17 H LEU 17 4.296 -5.321 4.507 129 HA LEU 17 HA LEU 17 2.706 -2.935 4.270 130 HB2 LEU 17 2HB LEU 17 2.703 -5.224 6.272 131 HB3 LEU 17 1HB LEU 17 1.390 -4.061 6.084 132 HG LEU 17 HG LEU 17 2.371 -6.091 4.070 133 HD11 LEU 17 1HD1 LEU 17 -0.390 -5.509 5.183 134 HD12 LEU 17 2HD1 LEU 17 0.679 -6.776 5.787 135 HD13 LEU 17 3HD1 LEU 17 0.061 -6.855 4.137 136 HD21 LEU 17 3HD2 LEU 17 0.514 -3.726 3.671 137 HD22 LEU 17 1HD2 LEU 17 0.690 -5.053 2.523 138 HD23 LEU 17 2HD2 LEU 17 2.060 -3.998 2.867 139 H GLN 18 H GLN 18 5.032 -4.099 6.678 140 HA GLN 18 HA GLN 18 4.604 -1.897 8.510 141 HB2 GLN 18 2HB GLN 18 5.599 -3.537 9.697 142 HB3 GLN 18 1HB GLN 18 6.131 -4.336 8.224 143 HG2 GLN 18 2HG GLN 18 8.096 -3.719 9.488 144 HG3 GLN 18 1HG GLN 18 7.989 -2.674 8.072 145 HE21 GLN 18 1HE2 GLN 18 9.475 -1.420 9.848 146 HE22 GLN 18 2HE2 GLN 18 8.620 -0.295 10.788 147 H ASN 19 H ASN 19 6.934 -2.775 6.064 148 HA ASN 19 HA ASN 19 8.523 -0.392 6.190 149 HB2 ASN 19 2HB ASN 19 8.062 -2.708 4.397 150 HB3 ASN 19 1HB ASN 19 8.671 -1.260 3.592 151 HD21 ASN 19 1HD2 ASN 19 10.694 -0.260 4.635 152 HD22 ASN 19 2HD2 ASN 19 11.817 -1.316 5.345 153 H LEU 20 H LEU 20 5.467 -1.261 4.910 154 HA LEU 20 HA LEU 20 5.186 1.209 3.312 155 HB2 LEU 20 2HB LEU 20 4.372 -0.934 2.424 156 HB3 LEU 20 1HB LEU 20 3.373 -1.162 3.860 157 HG LEU 20 HG LEU 20 2.455 1.245 3.114 158 HD11 LEU 20 1HD1 LEU 20 3.764 1.616 1.178 159 HD12 LEU 20 2HD1 LEU 20 2.209 1.066 0.555 160 HD13 LEU 20 3HD1 LEU 20 3.574 -0.050 0.632 161 HD21 LEU 20 3HD2 LEU 20 1.555 -1.282 1.710 162 HD22 LEU 20 1HD2 LEU 20 0.564 0.102 2.173 163 HD23 LEU 20 2HD2 LEU 20 1.225 -0.962 3.414 164 H ASN 21 H ASN 21 4.683 0.142 6.490 165 HA ASN 21 HA ASN 21 2.481 2.042 6.996 166 HB2 ASN 21 2HB ASN 21 3.797 -0.260 8.346 167 HB3 ASN 21 1HB ASN 21 3.169 1.013 9.398 168 HD21 ASN 21 1HD2 ASN 21 2.177 -1.867 8.652 169 HD22 ASN 21 2HD2 ASN 21 0.537 -1.625 8.290 170 H ASP 22 H ASP 22 5.833 1.417 7.436 171 HA ASP 22 HA ASP 22 6.327 3.628 9.165 172 HB2 ASP 22 2HB ASP 22 7.772 1.478 7.878 173 HB3 ASP 22 1HB ASP 22 8.684 2.983 7.759 174 H THR 23 H THR 23 6.142 3.050 5.820 175 HA THR 23 HA THR 23 7.201 5.627 4.897 176 HB THR 23 HB THR 23 5.555 3.392 3.713 177 HG1 THR 23 1HG THR 23 7.613 2.731 4.295 178 HG21 THR 23 3HG2 THR 23 6.971 5.712 2.371 179 HG22 THR 23 1HG2 THR 23 5.234 5.408 2.399 180 HG23 THR 23 2HG2 THR 23 6.304 4.325 1.507 181 H LEU 24 H LEU 24 4.093 4.027 5.421 182 HA LEU 24 HA LEU 24 2.487 6.264 4.469 183 HB2 LEU 24 2HB LEU 24 2.074 3.624 5.864 184 HB3 LEU 24 1HB LEU 24 0.738 4.769 5.751 185 HG LEU 24 HG LEU 24 2.323 3.659 3.416 186 HD11 LEU 24 1HD1 LEU 24 -0.256 2.959 4.735 187 HD12 LEU 24 2HD1 LEU 24 0.891 1.922 3.885 188 HD13 LEU 24 3HD1 LEU 24 -0.229 2.933 2.971 189 HD21 LEU 24 3HD2 LEU 24 0.590 5.990 3.727 190 HD22 LEU 24 1HD2 LEU 24 -0.027 4.871 2.513 191 HD23 LEU 24 2HD2 LEU 24 1.603 5.528 2.360 192 H LEU 25 H LEU 25 3.836 5.109 7.516 193 HA LEU 25 HA LEU 25 2.198 6.940 9.137 194 HB2 LEU 25 2HB LEU 25 4.607 5.188 9.627 195 HB3 LEU 25 1HB LEU 25 3.874 6.167 10.906 196 HG LEU 25 HG LEU 25 2.214 4.366 9.180 197 HD11 LEU 25 1HD1 LEU 25 4.046 3.031 10.229 198 HD12 LEU 25 2HD1 LEU 25 2.450 2.596 10.841 199 HD13 LEU 25 3HD1 LEU 25 3.520 3.609 11.811 200 HD21 LEU 25 3HD2 LEU 25 1.667 4.925 12.053 201 HD22 LEU 25 1HD2 LEU 25 0.547 4.832 10.691 202 HD23 LEU 25 2HD2 LEU 25 1.517 6.287 10.938 203 H GLU 26 H GLU 26 5.033 7.147 7.323 204 HA GLU 26 HA GLU 26 5.928 9.604 8.704 205 HB2 GLU 26 2HB GLU 26 7.010 7.898 6.433 206 HB3 GLU 26 1HB GLU 26 7.803 9.372 6.999 207 HG2 GLU 26 2HG GLU 26 8.202 8.432 9.164 208 HG3 GLU 26 1HG GLU 26 7.138 7.067 8.839 209 H LEU 27 H LEU 27 4.179 8.329 6.090 210 HA LEU 27 HA LEU 27 4.192 10.589 4.384 211 HB2 LEU 27 2HB LEU 27 3.699 8.357 3.580 212 HB3 LEU 27 1HB LEU 27 2.362 8.207 4.721 213 HG LEU 27 HG LEU 27 1.310 10.211 3.580 214 HD11 LEU 27 1HD1 LEU 27 3.573 10.824 2.502 215 HD12 LEU 27 2HD1 LEU 27 2.136 10.954 1.488 216 HD13 LEU 27 3HD1 LEU 27 3.208 9.562 1.324 217 HD21 LEU 27 3HD2 LEU 27 1.756 7.540 2.276 218 HD22 LEU 27 1HD2 LEU 27 0.811 8.767 1.433 219 HD23 LEU 27 2HD2 LEU 27 0.289 8.184 3.014 220 H GLU 28 H GLU 28 2.153 9.525 7.097 221 HA GLU 28 HA GLU 28 0.079 11.507 6.691 222 HB2 GLU 28 2HB GLU 28 0.935 10.464 9.384 223 HB3 GLU 28 1HB GLU 28 -0.696 10.779 8.798 224 HG2 GLU 28 2HG GLU 28 1.102 8.448 8.198 225 HG3 GLU 28 1HG GLU 28 -0.553 8.434 8.787 226 H LYS 29 H LYS 29 3.144 11.405 8.472 227 HA LYS 29 HA LYS 29 2.798 14.113 9.535 228 HB2 LYS 29 2HB LYS 29 4.525 13.430 10.853 229 HB3 LYS 29 1HB LYS 29 4.243 11.852 10.133 230 HG2 LYS 29 2HG LYS 29 5.837 12.839 8.232 231 HG3 LYS 29 1HG LYS 29 6.415 13.817 9.584 232 HD2 LYS 29 2HD LYS 29 7.209 11.988 10.744 233 HD3 LYS 29 1HD LYS 29 6.029 10.893 10.023 234 HE2 LYS 29 2HE LYS 29 7.859 10.217 8.792 235 HE3 LYS 29 1HE LYS 29 7.426 11.624 7.801 236 HZ1 LYS 29 3HZ LYS 29 9.549 11.341 9.793 237 HZ2 LYS 29 1HZ LYS 29 8.764 12.842 9.704 238 HZ3 LYS 29 2HZ LYS 29 9.543 12.211 8.333 239 H ASN 30 H ASN 30 3.855 12.626 6.709 240 HA ASN 30 HA ASN 30 4.518 15.215 5.459 241 HB2 ASN 30 2HB ASN 30 6.454 13.231 6.326 242 HB3 ASN 30 1HB ASN 30 6.502 13.390 4.572 243 HD21 ASN 30 1HD2 ASN 30 6.312 15.927 3.915 244 HD22 ASN 30 2HD2 ASN 30 7.371 16.939 4.772 245 HA PRO 31 HA PRO 31 2.133 12.356 2.914 246 HB2 PRO 31 2HB PRO 31 -0.087 13.903 2.790 247 HB3 PRO 31 1HB PRO 31 0.268 12.823 4.145 248 HG2 PRO 31 2HG PRO 31 0.367 15.747 4.021 249 HG3 PRO 31 1HG PRO 31 0.149 14.674 5.410 250 HD2 PRO 31 2HD PRO 31 2.532 15.979 4.575 251 HD3 PRO 31 1HD PRO 31 2.323 14.838 5.923 252 H GLU 32 H GLU 32 3.941 14.891 2.269 253 HA GLU 32 HA GLU 32 2.965 15.096 -0.526 254 HB2 GLU 32 2HB GLU 32 3.607 17.716 0.056 255 HB3 GLU 32 1HB GLU 32 1.969 17.072 0.014 256 HG2 GLU 32 2HG GLU 32 1.871 16.827 2.354 257 HG3 GLU 32 1HG GLU 32 3.628 16.896 2.523 258 H ASP 33 H ASP 33 5.444 14.349 1.384 259 HA ASP 33 HA ASP 33 7.603 15.947 0.359 260 HB2 ASP 33 2HB ASP 33 8.972 14.083 1.340 261 HB3 ASP 33 1HB ASP 33 7.769 14.736 2.452 262 H MET 34 H MET 34 5.713 13.543 -1.022 263 HA MET 34 HA MET 34 5.804 12.436 -3.087 264 HB2 MET 34 2HB MET 34 7.593 14.794 -3.264 265 HB3 MET 34 1HB MET 34 7.868 13.551 -4.486 266 HG2 MET 34 2HG MET 34 5.080 13.788 -4.330 267 HG3 MET 34 1HG MET 34 5.673 15.446 -4.260 268 HE1 MET 34 3HE MET 34 4.369 15.855 -6.639 269 HE2 MET 34 1HE MET 34 3.858 14.181 -6.387 270 HE3 MET 34 2HE MET 34 4.496 14.683 -7.951 271 H GLU 35 H GLU 35 7.886 12.026 -0.691 272 HA GLU 35 HA GLU 35 9.629 10.154 -2.214 273 HB2 GLU 35 2HB GLU 35 11.313 10.791 -0.785 274 HB3 GLU 35 1HB GLU 35 10.274 12.167 -0.438 275 HG2 GLU 35 2HG GLU 35 9.258 10.892 1.447 276 HG3 GLU 35 1HG GLU 35 10.376 9.567 1.121 277 H LEU 36 H LEU 36 7.464 10.587 0.538 278 HA LEU 36 HA LEU 36 7.490 7.732 1.250 279 HB2 LEU 36 2HB LEU 36 5.560 9.978 1.952 280 HB3 LEU 36 1HB LEU 36 5.701 8.436 2.794 281 HG LEU 36 HG LEU 36 7.643 10.726 2.740 282 HD11 LEU 36 1HD1 LEU 36 7.616 10.171 5.217 283 HD12 LEU 36 2HD1 LEU 36 6.278 9.080 4.857 284 HD13 LEU 36 3HD1 LEU 36 6.114 10.810 4.552 285 HD21 LEU 36 3HD2 LEU 36 8.991 8.762 2.199 286 HD22 LEU 36 1HD2 LEU 36 8.220 7.848 3.496 287 HD23 LEU 36 2HD2 LEU 36 9.274 9.208 3.882 288 H ILE 37 H ILE 37 5.913 9.838 -0.998 289 HA ILE 37 HA ILE 37 3.560 8.165 -1.462 290 HB ILE 37 HB ILE 37 4.924 10.513 -2.797 291 HG12 ILE 37 2HG1 ILE 37 2.113 10.316 -1.720 292 HG13 ILE 37 1HG1 ILE 37 3.477 10.624 -0.645 293 HG21 ILE 37 1HG2 ILE 37 2.805 10.559 -4.246 294 HG22 ILE 37 2HG2 ILE 37 2.570 8.879 -3.761 295 HG23 ILE 37 3HG2 ILE 37 4.013 9.344 -4.663 296 HD11 ILE 37 3HD1 ILE 37 2.404 12.339 -2.871 297 HD12 ILE 37 1HD1 ILE 37 4.088 12.494 -2.367 298 HD13 ILE 37 2HD1 ILE 37 2.790 12.790 -1.210 299 H ASN 38 H ASN 38 6.826 8.505 -2.785 300 HA ASN 38 HA ASN 38 6.243 6.566 -4.937 301 HB2 ASN 38 2HB ASN 38 7.631 8.621 -5.280 302 HB3 ASN 38 1HB ASN 38 8.804 7.977 -4.130 303 HD21 ASN 38 1HD2 ASN 38 10.551 7.508 -5.543 304 HD22 ASN 38 2HD2 ASN 38 10.435 6.440 -6.856 305 H GLU 39 H GLU 39 7.625 6.680 -1.795 306 HA GLU 39 HA GLU 39 9.076 4.153 -2.031 307 HB2 GLU 39 2HB GLU 39 8.258 5.935 0.280 308 HB3 GLU 39 1HB GLU 39 9.262 4.499 0.476 309 HG2 GLU 39 2HG GLU 39 10.166 6.336 -1.649 310 HG3 GLU 39 1HG GLU 39 10.245 7.008 -0.019 311 H ALA 40 H ALA 40 5.932 5.252 -1.255 312 HA ALA 40 HA ALA 40 5.057 2.683 -0.074 313 HB1 ALA 40 1HB ALA 40 4.361 4.996 0.718 314 HB2 ALA 40 2HB ALA 40 3.019 3.908 0.361 315 HB3 ALA 40 3HB ALA 40 3.469 5.165 -0.793 316 H PHE 41 H PHE 41 4.326 4.732 -2.947 317 HA PHE 41 HA PHE 41 2.495 2.979 -4.223 318 HB2 PHE 41 2HB PHE 41 2.658 5.040 -5.259 319 HB3 PHE 41 1HB PHE 41 4.388 5.166 -4.955 320 HD1 PHE 41 1HD PHE 41 5.983 3.758 -6.356 321 HD2 PHE 41 2HD PHE 41 1.836 4.275 -7.351 322 HE1 PHE 41 1HE PHE 41 6.451 3.029 -8.679 323 HE2 PHE 41 2HE PHE 41 2.303 3.545 -9.675 324 HZ PHE 41 HZ PHE 41 4.610 2.921 -10.339 325 H ARG 42 H ARG 42 6.016 2.939 -4.026 326 HA ARG 42 HA ARG 42 6.449 0.882 -6.023 327 HB2 ARG 42 2HB ARG 42 7.935 2.372 -3.931 328 HB3 ARG 42 1HB ARG 42 8.604 0.796 -4.353 329 HG2 ARG 42 2HG ARG 42 8.408 1.514 -6.795 330 HG3 ARG 42 1HG ARG 42 8.085 3.141 -6.190 331 HD2 ARG 42 2HD ARG 42 10.365 3.364 -6.246 332 HD3 ARG 42 1HD ARG 42 10.319 2.432 -4.737 333 HE ARG 42 HE ARG 42 10.331 0.387 -6.410 334 HH11 ARG 42 1HH1 ARG 42 10.992 2.699 -8.478 335 HH12 ARG 42 2HH1 ARG 42 12.680 2.380 -8.705 336 HH21 ARG 42 1HH2 ARG 42 12.928 0.277 -5.960 337 HH22 ARG 42 2HH2 ARG 42 13.775 1.012 -7.279 338 H ALA 43 H ALA 43 7.042 0.656 -2.496 339 HA ALA 43 HA ALA 43 7.146 -2.091 -2.182 340 HB1 ALA 43 1HB ALA 43 5.497 -0.943 -0.107 341 HB2 ALA 43 2HB ALA 43 6.739 0.214 -0.585 342 HB3 ALA 43 3HB ALA 43 7.199 -1.396 -0.032 343 H LEU 44 H LEU 44 4.251 -0.155 -2.786 344 HA LEU 44 HA LEU 44 2.396 -2.340 -2.221 345 HB2 LEU 44 2HB LEU 44 2.161 0.318 -3.665 346 HB3 LEU 44 1HB LEU 44 0.790 -0.719 -3.267 347 HG LEU 44 HG LEU 44 2.744 0.265 -1.183 348 HD11 LEU 44 1HD1 LEU 44 0.770 1.768 -2.632 349 HD12 LEU 44 2HD1 LEU 44 1.802 2.306 -1.307 350 HD13 LEU 44 3HD1 LEU 44 0.232 1.582 -0.962 351 HD21 LEU 44 3HD2 LEU 44 0.666 -0.209 0.253 352 HD22 LEU 44 1HD2 LEU 44 1.495 -1.617 -0.411 353 HD23 LEU 44 2HD2 LEU 44 0.010 -1.032 -1.163 354 H HIS 45 H HIS 45 3.193 -0.616 -5.268 355 HA HIS 45 HA HIS 45 2.008 -2.436 -7.058 356 HB2 HIS 45 2HB HIS 45 3.028 -0.205 -7.570 357 HB3 HIS 45 1HB HIS 45 4.625 -0.914 -7.339 358 HD1 HIS 45 1HD HIS 45 5.678 -1.612 -9.476 359 HD2 HIS 45 2HD HIS 45 1.525 -1.917 -9.667 360 HE1 HIS 45 1HE HIS 45 5.127 -2.426 -11.810 361 H THR 46 H THR 46 4.876 -2.675 -5.119 362 HA THR 46 HA THR 46 6.040 -4.922 -6.562 363 HB THR 46 HB THR 46 6.701 -3.029 -4.498 364 HG1 THR 46 1HG THR 46 8.809 -3.745 -5.094 365 HG21 THR 46 3HG2 THR 46 7.108 -5.933 -3.779 366 HG22 THR 46 1HG2 THR 46 6.445 -4.640 -2.779 367 HG23 THR 46 2HG2 THR 46 8.168 -4.666 -3.160 368 H LEU 47 H LEU 47 4.461 -4.556 -3.348 369 HA LEU 47 HA LEU 47 4.284 -7.465 -3.038 370 HB2 LEU 47 2HB LEU 47 3.668 -6.933 -0.849 371 HB3 LEU 47 1HB LEU 47 4.599 -5.506 -1.300 372 HG LEU 47 HG LEU 47 2.337 -4.513 -2.060 373 HD11 LEU 47 1HD1 LEU 47 1.544 -7.097 -0.914 374 HD12 LEU 47 2HD1 LEU 47 0.626 -6.004 -1.949 375 HD13 LEU 47 3HD1 LEU 47 0.674 -5.736 -0.207 376 HD21 LEU 47 3HD2 LEU 47 2.857 -3.350 -0.192 377 HD22 LEU 47 1HD2 LEU 47 3.587 -4.770 0.558 378 HD23 LEU 47 2HD2 LEU 47 1.851 -4.493 0.698 379 H LYS 48 H LYS 48 2.326 -4.957 -4.382 380 HA LYS 48 HA LYS 48 -0.287 -6.147 -4.146 381 HB2 LYS 48 2HB LYS 48 0.405 -3.763 -4.688 382 HB3 LYS 48 1HB LYS 48 0.880 -4.338 -6.286 383 HG2 LYS 48 2HG LYS 48 -1.848 -5.033 -5.302 384 HG3 LYS 48 1HG LYS 48 -1.551 -3.377 -5.833 385 HD2 LYS 48 2HD LYS 48 -0.803 -5.786 -7.483 386 HD3 LYS 48 1HD LYS 48 -2.352 -4.949 -7.645 387 HE2 LYS 48 2HE LYS 48 -0.865 -2.795 -7.883 388 HE3 LYS 48 1HE LYS 48 0.415 -3.950 -8.305 389 HZ1 LYS 48 3HZ LYS 48 -0.551 -4.382 -10.253 390 HZ2 LYS 48 1HZ LYS 48 -1.565 -3.052 -9.981 391 HZ3 LYS 48 2HZ LYS 48 -2.076 -4.612 -9.541 392 H GLY 49 H GLY 49 2.350 -6.269 -6.554 393 HA2 GLY 49 2HA GLY 49 0.878 -8.052 -8.343 394 HA3 GLY 49 1HA GLY 49 2.582 -7.608 -8.493 395 H MET 50 H MET 50 3.564 -8.386 -6.022 396 HA MET 50 HA MET 50 4.238 -11.068 -6.257 397 HB2 MET 50 2HB MET 50 4.183 -8.984 -4.220 398 HB3 MET 50 1HB MET 50 3.969 -10.583 -3.507 399 HG2 MET 50 2HG MET 50 6.025 -11.368 -4.356 400 HG3 MET 50 1HG MET 50 6.132 -10.066 -5.540 401 HE1 MET 50 3HE MET 50 4.668 -9.070 -2.220 402 HE2 MET 50 1HE MET 50 6.032 -8.957 -1.098 403 HE3 MET 50 2HE MET 50 5.513 -10.528 -1.702 404 H ALA 51 H ALA 51 1.309 -9.667 -4.872 405 HA ALA 51 HA ALA 51 0.279 -12.267 -3.940 406 HB1 ALA 51 1HB ALA 51 -1.627 -10.846 -3.248 407 HB2 ALA 51 2HB ALA 51 -0.944 -9.490 -4.144 408 HB3 ALA 51 3HB ALA 51 -0.100 -10.130 -2.733 409 H GLY 52 H GLY 52 0.127 -10.230 -6.748 410 HA2 GLY 52 2HA GLY 52 -2.327 -11.377 -7.800 411 HA3 GLY 52 1HA GLY 52 -1.206 -10.343 -8.685 412 H THR 53 H THR 53 -0.799 -13.540 -7.108 413 HA THR 53 HA THR 53 -0.703 -15.088 -9.439 414 HB THR 53 HB THR 53 1.376 -13.228 -9.334 415 HG1 THR 53 1HG THR 53 1.797 -15.523 -10.811 416 HG21 THR 53 3HG2 THR 53 3.417 -14.643 -9.215 417 HG22 THR 53 1HG2 THR 53 2.423 -15.989 -8.659 418 HG23 THR 53 2HG2 THR 53 2.578 -14.538 -7.667 419 H MET 54 H MET 54 0.899 -14.525 -6.421 420 HA MET 54 HA MET 54 0.661 -17.441 -5.770 421 HB2 MET 54 2HB MET 54 2.875 -15.741 -5.945 422 HB3 MET 54 1HB MET 54 2.568 -15.915 -4.220 423 HG2 MET 54 2HG MET 54 3.082 -18.152 -4.212 424 HG3 MET 54 1HG MET 54 2.431 -18.409 -5.830 425 HE1 MET 54 3HE MET 54 6.146 -17.235 -4.034 426 HE2 MET 54 1HE MET 54 4.651 -16.295 -3.939 427 HE3 MET 54 2HE MET 54 5.939 -15.801 -5.036 428 H GLY 55 H GLY 55 -0.402 -14.359 -5.100 429 HA2 GLY 55 2HA GLY 55 -1.336 -15.196 -2.381 430 HA3 GLY 55 1HA GLY 55 -0.757 -13.553 -2.675 431 H PHE 56 H PHE 56 -2.205 -14.769 -5.411 432 HA PHE 56 HA PHE 56 -4.367 -14.502 -6.379 433 HB2 PHE 56 2HB PHE 56 -4.835 -15.015 -3.720 434 HB3 PHE 56 1HB PHE 56 -5.574 -13.425 -3.902 435 HD1 PHE 56 1HD PHE 56 -5.264 -16.351 -6.231 436 HD2 PHE 56 2HD PHE 56 -7.887 -13.674 -4.132 437 HE1 PHE 56 1HE PHE 56 -7.220 -17.390 -7.350 438 HE2 PHE 56 2HE PHE 56 -9.841 -14.711 -5.251 439 HZ PHE 56 HZ PHE 56 -9.509 -16.570 -6.859 440 H SER 57 H SER 57 -4.596 -12.726 -7.688 441 HA SER 57 HA SER 57 -3.548 -10.151 -7.035 442 HB2 SER 57 2HB SER 57 -5.726 -10.582 -9.048 443 HB3 SER 57 1HB SER 57 -4.274 -9.594 -9.183 444 HG SER 57 HG SER 57 -3.972 -11.452 -10.383 445 H SER 58 H SER 58 -6.394 -11.649 -6.039 446 HA SER 58 HA SER 58 -8.238 -9.459 -5.911 447 HB2 SER 58 2HB SER 58 -7.906 -11.763 -3.961 448 HB3 SER 58 1HB SER 58 -9.397 -10.914 -4.359 449 HG SER 58 HG SER 58 -9.525 -12.609 -5.666 450 H MET 59 H MET 59 -5.930 -10.814 -3.577 451 HA MET 59 HA MET 59 -6.306 -8.767 -1.597 452 HB2 MET 59 2HB MET 59 -5.320 -11.142 -1.425 453 HB3 MET 59 1HB MET 59 -3.845 -10.468 -2.102 454 HG2 MET 59 2HG MET 59 -5.209 -9.404 0.390 455 HG3 MET 59 1HG MET 59 -3.871 -10.550 0.419 456 HE1 MET 59 3HE MET 59 -1.215 -8.473 -1.678 457 HE2 MET 59 1HE MET 59 -2.648 -9.103 -2.504 458 HE3 MET 59 2HE MET 59 -1.821 -10.081 -1.293 459 H ALA 60 H ALA 60 -4.436 -9.096 -4.525 460 HA ALA 60 HA ALA 60 -2.590 -6.900 -4.050 461 HB1 ALA 60 1HB ALA 60 -3.638 -8.311 -6.532 462 HB2 ALA 60 2HB ALA 60 -2.151 -8.686 -5.660 463 HB3 ALA 60 3HB ALA 60 -2.298 -7.166 -6.543 464 H LYS 61 H LYS 61 -5.804 -7.255 -5.539 465 HA LYS 61 HA LYS 61 -6.007 -4.639 -6.668 466 HB2 LYS 61 2HB LYS 61 -8.071 -6.525 -5.461 467 HB3 LYS 61 1HB LYS 61 -8.479 -5.110 -6.426 468 HG2 LYS 61 2HG LYS 61 -7.308 -7.713 -7.285 469 HG3 LYS 61 1HG LYS 61 -8.505 -6.705 -8.086 470 HD2 LYS 61 2HD LYS 61 -5.562 -6.018 -7.857 471 HD3 LYS 61 1HD LYS 61 -6.323 -6.722 -9.289 472 HE2 LYS 61 2HE LYS 61 -7.924 -4.503 -8.519 473 HE3 LYS 61 1HE LYS 61 -6.235 -3.955 -8.519 474 HZ1 LYS 61 3HZ LYS 61 -7.356 -3.904 -10.749 475 HZ2 LYS 61 1HZ LYS 61 -7.418 -5.598 -10.691 476 HZ3 LYS 61 2HZ LYS 61 -5.916 -4.803 -10.694 477 H LEU 62 H LEU 62 -6.072 -5.829 -3.450 478 HA LEU 62 HA LEU 62 -7.360 -3.482 -2.270 479 HB2 LEU 62 2HB LEU 62 -7.528 -5.692 -1.248 480 HB3 LEU 62 1HB LEU 62 -5.772 -5.837 -1.199 481 HG LEU 62 HG LEU 62 -5.564 -4.173 0.463 482 HD11 LEU 62 1HD1 LEU 62 -8.493 -3.510 0.018 483 HD12 LEU 62 2HD1 LEU 62 -7.137 -2.548 -0.572 484 HD13 LEU 62 3HD1 LEU 62 -7.412 -2.713 1.162 485 HD21 LEU 62 3HD2 LEU 62 -8.159 -5.306 1.409 486 HD22 LEU 62 1HD2 LEU 62 -6.603 -5.227 2.234 487 HD23 LEU 62 2HD2 LEU 62 -6.879 -6.444 0.990 488 H CYS 63 H CYS 63 -4.087 -4.702 -2.888 489 HA CYS 63 HA CYS 63 -2.789 -2.483 -1.459 490 HB2 CYS 63 2HB CYS 63 -2.111 -5.042 -2.173 491 HB3 CYS 63 1HB CYS 63 -1.289 -4.109 -3.425 492 HG CYS 63 HG CYS 63 -0.840 -3.467 -0.396 493 H HIS 64 H HIS 64 -3.564 -3.386 -4.811 494 HA HIS 64 HA HIS 64 -2.082 -1.306 -6.123 495 HB2 HIS 64 2HB HIS 64 -3.204 -3.378 -7.099 496 HB3 HIS 64 1HB HIS 64 -4.742 -2.532 -6.928 497 HD1 HIS 64 1HD HIS 64 -2.143 -0.143 -7.712 498 HD2 HIS 64 2HD HIS 64 -4.539 -2.729 -9.936 499 HE1 HIS 64 1HE HIS 64 -2.063 0.683 -10.106 500 H THR 65 H THR 65 -5.169 -1.430 -4.492 501 HA THR 65 HA THR 65 -6.212 1.089 -5.421 502 HB THR 65 HB THR 65 -6.810 -1.055 -3.521 503 HG1 THR 65 1HG THR 65 -8.286 0.821 -5.032 504 HG21 THR 65 3HG2 THR 65 -8.200 0.221 -1.987 505 HG22 THR 65 1HG2 THR 65 -7.755 1.729 -2.789 506 HG23 THR 65 2HG2 THR 65 -6.543 0.813 -1.895 507 H LEU 66 H LEU 66 -4.508 0.169 -2.390 508 HA LEU 66 HA LEU 66 -4.355 2.757 -1.199 509 HB2 LEU 66 2HB LEU 66 -2.184 0.629 -1.196 510 HB3 LEU 66 1HB LEU 66 -2.543 1.791 0.077 511 HG LEU 66 HG LEU 66 -4.208 -0.586 -0.769 512 HD11 LEU 66 1HD1 LEU 66 -2.289 -0.027 1.314 513 HD12 LEU 66 2HD1 LEU 66 -3.088 -1.551 0.922 514 HD13 LEU 66 3HD1 LEU 66 -3.862 -0.404 2.018 515 HD21 LEU 66 3HD2 LEU 66 -5.345 0.677 1.486 516 HD22 LEU 66 1HD2 LEU 66 -6.043 0.558 -0.127 517 HD23 LEU 66 2HD2 LEU 66 -5.062 1.957 0.307 518 H GLU 67 H GLU 67 -2.072 1.068 -3.342 519 HA GLU 67 HA GLU 67 -0.147 3.138 -3.656 520 HB2 GLU 67 2HB GLU 67 0.288 0.850 -4.226 521 HB3 GLU 67 1HB GLU 67 -1.075 0.804 -5.339 522 HG2 GLU 67 2HG GLU 67 0.960 2.901 -5.865 523 HG3 GLU 67 1HG GLU 67 1.476 1.237 -6.146 524 H ASN 68 H ASN 68 -3.289 2.659 -5.137 525 HA ASN 68 HA ASN 68 -2.915 4.223 -7.493 526 HB2 ASN 68 2HB ASN 68 -4.980 2.940 -6.009 527 HB3 ASN 68 1HB ASN 68 -5.506 4.587 -6.354 528 HD21 ASN 68 1HD2 ASN 68 -4.774 1.475 -7.802 529 HD22 ASN 68 2HD2 ASN 68 -5.223 1.888 -9.386 530 H ILE 69 H ILE 69 -3.908 5.041 -4.197 531 HA ILE 69 HA ILE 69 -4.296 7.851 -4.673 532 HB ILE 69 HB ILE 69 -3.770 6.122 -2.264 533 HG12 ILE 69 2HG1 ILE 69 -6.150 6.766 -1.805 534 HG13 ILE 69 1HG1 ILE 69 -6.173 7.591 -3.360 535 HG21 ILE 69 1HG2 ILE 69 -4.292 8.094 -0.880 536 HG22 ILE 69 2HG2 ILE 69 -4.419 9.087 -2.327 537 HG23 ILE 69 3HG2 ILE 69 -2.862 8.399 -1.862 538 HD11 ILE 69 3HD1 ILE 69 -7.102 5.217 -3.352 539 HD12 ILE 69 1HD1 ILE 69 -5.445 4.676 -3.086 540 HD13 ILE 69 2HD1 ILE 69 -5.860 5.559 -4.556 541 H LEU 70 H LEU 70 -1.702 5.826 -3.819 542 HA LEU 70 HA LEU 70 0.205 7.966 -3.293 543 HB2 LEU 70 2HB LEU 70 0.745 5.071 -4.013 544 HB3 LEU 70 1HB LEU 70 1.799 6.150 -3.098 545 HG LEU 70 HG LEU 70 -0.837 4.966 -2.242 546 HD11 LEU 70 1HD1 LEU 70 1.438 5.019 -0.402 547 HD12 LEU 70 2HD1 LEU 70 1.764 4.127 -1.890 548 HD13 LEU 70 3HD1 LEU 70 0.401 3.671 -0.866 549 HD21 LEU 70 3HD2 LEU 70 0.011 6.469 -0.108 550 HD22 LEU 70 1HD2 LEU 70 -1.243 6.969 -1.244 551 HD23 LEU 70 2HD2 LEU 70 0.418 7.517 -1.467 552 H ASP 71 H ASP 71 -1.154 6.503 -6.040 553 HA ASP 71 HA ASP 71 1.106 7.233 -7.796 554 HB2 ASP 71 2HB ASP 71 -1.145 5.470 -7.847 555 HB3 ASP 71 1HB ASP 71 -1.338 6.602 -9.185 556 H LYS 72 H LYS 72 -2.230 8.274 -7.120 557 HA LYS 72 HA LYS 72 -2.010 10.552 -8.932 558 HB2 LYS 72 2HB LYS 72 -4.021 10.996 -6.962 559 HB3 LYS 72 1HB LYS 72 -4.255 10.501 -8.629 560 HG2 LYS 72 2HG LYS 72 -3.895 8.133 -7.924 561 HG3 LYS 72 1HG LYS 72 -3.838 8.686 -6.248 562 HD2 LYS 72 2HD LYS 72 -6.105 9.878 -7.251 563 HD3 LYS 72 1HD LYS 72 -6.108 8.279 -7.992 564 HE2 LYS 72 2HE LYS 72 -5.718 7.279 -5.727 565 HE3 LYS 72 1HE LYS 72 -5.913 8.903 -5.037 566 HZ1 LYS 72 3HZ LYS 72 -8.110 8.692 -5.200 567 HZ2 LYS 72 1HZ LYS 72 -7.935 7.124 -5.821 568 HZ3 LYS 72 2HZ LYS 72 -7.990 8.454 -6.877 569 H ALA 73 H ALA 73 -1.382 9.778 -5.636 570 HA ALA 73 HA ALA 73 -1.021 12.405 -4.533 571 HB1 ALA 73 1HB ALA 73 -1.134 10.397 -3.154 572 HB2 ALA 73 2HB ALA 73 0.477 11.078 -2.957 573 HB3 ALA 73 3HB ALA 73 0.230 9.683 -4.014 574 H ARG 74 H ARG 74 0.934 10.231 -6.473 575 HA ARG 74 HA ARG 74 3.334 11.940 -6.319 576 HB2 ARG 74 2HB ARG 74 4.293 9.936 -6.794 577 HB3 ARG 74 1HB ARG 74 2.684 9.220 -6.802 578 HG2 ARG 74 2HG ARG 74 2.525 10.016 -9.246 579 HG3 ARG 74 1HG ARG 74 4.264 10.288 -9.148 580 HD2 ARG 74 2HD ARG 74 4.748 8.030 -9.063 581 HD3 ARG 74 1HD ARG 74 3.243 7.637 -8.207 582 HE ARG 74 HE ARG 74 2.051 7.764 -10.314 583 HH11 ARG 74 1HH2 ARG 74 5.170 9.084 -10.693 584 HH12 ARG 74 2HH2 ARG 74 5.368 8.536 -12.324 585 HH21 ARG 74 1HH1 ARG 74 2.417 6.720 -12.356 586 HH22 ARG 74 2HH1 ARG 74 3.811 7.200 -13.264 587 H ASN 75 H ASN 75 0.556 11.418 -8.333 588 HA ASN 75 HA ASN 75 1.730 12.888 -10.635 589 HB2 ASN 75 2HB ASN 75 -0.061 10.814 -10.341 590 HB3 ASN 75 1HB ASN 75 -1.131 12.186 -10.615 591 HD21 ASN 75 1HD2 ASN 75 0.080 13.749 -12.454 592 HD22 ASN 75 2HD2 ASN 75 0.466 12.889 -13.865 593 H SER 76 H SER 76 0.429 13.736 -7.727 594 HA SER 76 HA SER 76 -0.307 15.833 -6.927 595 HB2 SER 76 2HB SER 76 1.111 16.429 -9.104 596 HB3 SER 76 1HB SER 76 -0.476 16.854 -9.738 597 HG SER 76 HG SER 76 0.717 17.809 -7.339 598 H GLU 77 H GLU 77 -2.147 13.640 -7.885 599 HA GLU 77 HA GLU 77 -4.465 15.245 -8.823 600 HB2 GLU 77 2HB GLU 77 -4.710 12.329 -8.361 601 HB3 GLU 77 1HB GLU 77 -5.292 13.290 -9.713 602 HG2 GLU 77 2HG GLU 77 -2.414 12.475 -9.247 603 HG3 GLU 77 1HG GLU 77 -3.510 11.744 -10.414 604 H ILE 78 H ILE 78 -3.229 13.454 -6.150 605 HA ILE 78 HA ILE 78 -5.534 14.374 -4.486 606 HB ILE 78 HB ILE 78 -5.690 12.089 -3.566 607 HG12 ILE 78 2HG1 ILE 78 -4.381 10.326 -4.985 608 HG13 ILE 78 1HG1 ILE 78 -3.334 11.693 -5.377 609 HG21 ILE 78 1HG2 ILE 78 -6.762 12.890 -5.867 610 HG22 ILE 78 2HG2 ILE 78 -6.923 11.221 -5.323 611 HG23 ILE 78 3HG2 ILE 78 -5.703 11.643 -6.522 612 HD11 ILE 78 3HD1 ILE 78 -3.985 11.544 -2.534 613 HD12 ILE 78 1HD1 ILE 78 -2.421 11.730 -3.327 614 HD13 ILE 78 2HD1 ILE 78 -3.121 10.125 -3.120 615 H LYS 79 H LYS 79 -4.886 13.518 -2.078 616 HA LYS 79 HA LYS 79 -2.033 13.569 -1.516 617 HB2 LYS 79 2HB LYS 79 -1.931 15.777 -0.673 618 HB3 LYS 79 1HB LYS 79 -2.921 15.948 -2.110 619 HG2 LYS 79 2HG LYS 79 -4.140 17.133 -0.481 620 HG3 LYS 79 1HG LYS 79 -4.948 15.573 -0.553 621 HD2 LYS 79 2HD LYS 79 -4.224 16.705 1.774 622 HD3 LYS 79 1HD LYS 79 -4.242 14.959 1.553 623 HE2 LYS 79 2HE LYS 79 -1.870 14.900 1.166 624 HE3 LYS 79 1HE LYS 79 -1.784 16.668 1.066 625 HZ1 LYS 79 3HZ LYS 79 -1.341 15.386 3.327 626 HZ2 LYS 79 1HZ LYS 79 -3.027 15.521 3.445 627 HZ3 LYS 79 2HZ LYS 79 -2.072 16.919 3.288 628 H ILE 80 H ILE 80 -1.680 12.963 0.721 629 HA ILE 80 HA ILE 80 -3.825 11.448 1.916 630 HB ILE 80 HB ILE 80 -1.076 12.336 2.680 631 HG12 ILE 80 2HG1 ILE 80 -0.691 9.865 2.514 632 HG13 ILE 80 1HG1 ILE 80 -2.378 9.691 2.030 633 HG21 ILE 80 1HG2 ILE 80 -1.477 11.933 4.856 634 HG22 ILE 80 2HG2 ILE 80 -1.906 10.278 4.429 635 HG23 ILE 80 3HG2 ILE 80 -3.152 11.522 4.493 636 HD11 ILE 80 3HD1 ILE 80 -2.040 10.920 0.023 637 HD12 ILE 80 1HD1 ILE 80 -0.665 9.822 0.130 638 HD13 ILE 80 2HD1 ILE 80 -0.473 11.520 0.565 639 H THR 81 H THR 81 -5.499 12.836 2.282 640 HA THR 81 HA THR 81 -5.233 15.221 4.004 641 HB THR 81 HB THR 81 -7.654 15.395 3.505 642 HG1 THR 81 1HG THR 81 -8.496 13.460 3.372 643 HG21 THR 81 3HG2 THR 81 -7.492 15.569 1.065 644 HG22 THR 81 1HG2 THR 81 -6.036 14.578 1.085 645 HG23 THR 81 2HG2 THR 81 -6.020 16.179 1.821 646 H SER 82 H SER 82 -4.565 12.586 5.172 647 HA SER 82 HA SER 82 -4.952 11.553 7.274 648 HB2 SER 82 2HB SER 82 -6.036 14.077 7.484 649 HB3 SER 82 1HB SER 82 -7.431 13.057 7.818 650 HG SER 82 HG SER 82 -5.555 13.694 9.483 651 H ASP 83 H ASP 83 -8.031 12.380 5.633 652 HA ASP 83 HA ASP 83 -9.331 9.891 6.342 653 HB2 ASP 83 2HB ASP 83 -9.947 12.425 5.294 654 HB3 ASP 83 1HB ASP 83 -10.375 11.282 4.022 655 H LEU 84 H LEU 84 -7.858 11.151 3.301 656 HA LEU 84 HA LEU 84 -8.442 8.844 1.707 657 HB2 LEU 84 2HB LEU 84 -6.162 10.857 1.643 658 HB3 LEU 84 1HB LEU 84 -6.549 9.751 0.325 659 HG LEU 84 HG LEU 84 -8.350 11.911 1.455 660 HD11 LEU 84 1HD1 LEU 84 -7.754 11.840 -1.417 661 HD12 LEU 84 2HD1 LEU 84 -6.320 12.081 -0.420 662 HD13 LEU 84 3HD1 LEU 84 -7.682 13.195 -0.290 663 HD21 LEU 84 3HD2 LEU 84 -9.702 9.982 0.855 664 HD22 LEU 84 1HD2 LEU 84 -8.832 9.796 -0.667 665 HD23 LEU 84 2HD2 LEU 84 -9.878 11.193 -0.416 666 H LEU 85 H LEU 85 -5.974 9.586 4.065 667 HA LEU 85 HA LEU 85 -4.397 7.183 3.438 668 HB2 LEU 85 2HB LEU 85 -2.832 8.415 4.526 669 HB3 LEU 85 1HB LEU 85 -4.041 9.681 4.702 670 HG LEU 85 HG LEU 85 -4.799 8.252 6.785 671 HD11 LEU 85 1HD1 LEU 85 -3.494 6.455 7.184 672 HD12 LEU 85 2HD1 LEU 85 -2.173 7.570 7.538 673 HD13 LEU 85 3HD1 LEU 85 -2.373 6.929 5.907 674 HD21 LEU 85 3HD2 LEU 85 -3.039 10.456 6.378 675 HD22 LEU 85 1HD2 LEU 85 -2.361 9.465 7.670 676 HD23 LEU 85 2HD2 LEU 85 -4.001 10.084 7.810 677 H ASP 86 H ASP 86 -6.825 8.215 5.785 678 HA ASP 86 HA ASP 86 -6.621 5.977 7.585 679 HB2 ASP 86 2HB ASP 86 -8.391 8.255 6.991 680 HB3 ASP 86 1HB ASP 86 -9.244 6.858 7.650 681 H LYS 87 H LYS 87 -8.009 6.379 4.423 682 HA LYS 87 HA LYS 87 -9.712 3.970 4.664 683 HB2 LYS 87 2HB LYS 87 -9.054 5.906 2.415 684 HB3 LYS 87 1HB LYS 87 -10.211 4.584 2.268 685 HG2 LYS 87 2HG LYS 87 -10.392 7.055 3.991 686 HG3 LYS 87 1HG LYS 87 -11.557 6.447 2.816 687 HD2 LYS 87 2HD LYS 87 -11.928 4.456 4.298 688 HD3 LYS 87 1HD LYS 87 -10.882 5.211 5.501 689 HE2 LYS 87 2HE LYS 87 -12.442 7.250 5.365 690 HE3 LYS 87 1HE LYS 87 -13.567 6.185 4.499 691 HZ1 LYS 87 3HZ LYS 87 -12.316 5.533 7.113 692 HZ2 LYS 87 1HZ LYS 87 -13.490 4.622 6.297 693 HZ3 LYS 87 2HZ LYS 87 -13.891 6.144 6.936 694 H ILE 88 H ILE 88 -6.807 5.108 2.963 695 HA ILE 88 HA ILE 88 -6.232 2.617 1.646 696 HB ILE 88 HB ILE 88 -4.608 5.007 2.529 697 HG12 ILE 88 2HG1 ILE 88 -5.020 4.266 -0.312 698 HG13 ILE 88 1HG1 ILE 88 -6.441 4.833 0.567 699 HG21 ILE 88 1HG2 ILE 88 -2.706 3.954 2.025 700 HG22 ILE 88 2HG2 ILE 88 -3.354 3.467 0.458 701 HG23 ILE 88 3HG2 ILE 88 -3.621 2.455 1.877 702 HD11 ILE 88 3HD1 ILE 88 -4.003 6.310 -0.227 703 HD12 ILE 88 1HD1 ILE 88 -4.594 6.643 1.402 704 HD13 ILE 88 2HD1 ILE 88 -5.649 6.896 0.011 705 H PHE 89 H PHE 89 -5.685 3.901 4.861 706 HA PHE 89 HA PHE 89 -3.802 1.859 5.717 707 HB2 PHE 89 2HB PHE 89 -3.927 4.078 6.764 708 HB3 PHE 89 1HB PHE 89 -5.611 3.786 7.203 709 HD1 PHE 89 2HD PHE 89 -6.179 1.981 8.847 710 HD2 PHE 89 1HD PHE 89 -2.128 3.172 8.059 711 HE1 PHE 89 2HE PHE 89 -5.444 0.864 10.936 712 HE2 PHE 89 1HE PHE 89 -1.393 2.055 10.147 713 HZ PHE 89 HZ PHE 89 -3.051 0.901 11.585 714 H ALA 90 H ALA 90 -7.219 2.284 5.612 715 HA ALA 90 HA ALA 90 -7.949 0.044 7.316 716 HB1 ALA 90 1HB ALA 90 -10.110 0.474 5.754 717 HB2 ALA 90 2HB ALA 90 -9.237 1.972 5.423 718 HB3 ALA 90 3HB ALA 90 -9.694 1.564 7.077 719 H GLY 91 H GLY 91 -7.187 0.636 3.961 720 HA2 GLY 91 2HA GLY 91 -8.045 -1.940 2.950 721 HA3 GLY 91 1HA GLY 91 -6.958 -0.813 2.128 722 H VAL 92 H VAL 92 -5.047 -0.533 4.184 723 HA VAL 92 HA VAL 92 -3.373 -2.854 3.749 724 HB VAL 92 HB VAL 92 -3.325 -0.328 5.400 725 HG11 VAL 92 1HG1 VAL 92 -0.871 -1.104 5.898 726 HG12 VAL 92 2HG1 VAL 92 -1.523 -2.724 5.651 727 HG13 VAL 92 3HG1 VAL 92 -2.182 -1.693 6.920 728 HG21 VAL 92 3HG2 VAL 92 -2.615 0.187 3.265 729 HG22 VAL 92 1HG2 VAL 92 -1.976 -1.430 2.969 730 HG23 VAL 92 2HG2 VAL 92 -1.073 -0.292 3.970 731 H ASP 93 H ASP 93 -5.699 -1.851 6.133 732 HA ASP 93 HA ASP 93 -4.897 -3.682 8.248 733 HB2 ASP 93 2HB ASP 93 -6.608 -1.493 7.863 734 HB3 ASP 93 1HB ASP 93 -7.699 -2.846 8.170 735 H MET 94 H MET 94 -6.947 -3.827 5.402 736 HA MET 94 HA MET 94 -8.336 -6.272 6.152 737 HB2 MET 94 2HB MET 94 -7.888 -4.719 3.586 738 HB3 MET 94 1HB MET 94 -8.888 -6.171 3.652 739 HG2 MET 94 2HG MET 94 -9.953 -4.836 5.730 740 HG3 MET 94 1HG MET 94 -9.400 -3.460 4.775 741 HE1 MET 94 3HE MET 94 -11.003 -2.927 2.022 742 HE2 MET 94 1HE MET 94 -10.419 -4.454 1.347 743 HE3 MET 94 2HE MET 94 -9.395 -3.519 2.435 744 H ILE 95 H ILE 95 -5.600 -5.489 3.950 745 HA ILE 95 HA ILE 95 -5.012 -8.131 3.135 746 HB ILE 95 HB ILE 95 -2.786 -7.084 2.690 747 HG12 ILE 95 2HG1 ILE 95 -3.967 -4.614 3.959 748 HG13 ILE 95 1HG1 ILE 95 -2.844 -5.680 4.803 749 HG21 ILE 95 1HG2 ILE 95 -3.596 -5.838 0.938 750 HG22 ILE 95 2HG2 ILE 95 -4.779 -5.008 1.949 751 HG23 ILE 95 3HG2 ILE 95 -5.080 -6.662 1.414 752 HD11 ILE 95 3HD1 ILE 95 -1.604 -3.838 3.782 753 HD12 ILE 95 1HD1 ILE 95 -2.306 -4.209 2.208 754 HD13 ILE 95 2HD1 ILE 95 -1.195 -5.348 2.969 755 H THR 96 H THR 96 -4.141 -6.271 6.020 756 HA THR 96 HA THR 96 -2.221 -8.131 7.099 757 HB THR 96 HB THR 96 -4.072 -6.020 8.253 758 HG1 THR 96 1HG THR 96 -2.451 -5.086 7.163 759 HG21 THR 96 3HG2 THR 96 -2.375 -8.027 9.610 760 HG22 THR 96 1HG2 THR 96 -3.760 -7.124 10.223 761 HG23 THR 96 2HG2 THR 96 -2.169 -6.366 10.164 762 H ARG 97 H ARG 97 -5.730 -7.740 7.302 763 HA ARG 97 HA ARG 97 -6.148 -9.942 9.159 764 HB2 ARG 97 2HB ARG 97 -7.835 -8.250 7.307 765 HB3 ARG 97 1HB ARG 97 -8.546 -9.596 8.199 766 HG2 ARG 97 2HG ARG 97 -8.287 -8.564 10.244 767 HG3 ARG 97 1HG ARG 97 -6.854 -7.671 9.729 768 HD2 ARG 97 2HD ARG 97 -8.427 -5.945 9.780 769 HD3 ARG 97 1HD ARG 97 -8.624 -6.491 8.102 770 HE ARG 97 HE ARG 97 -10.647 -7.621 8.734 771 HH11 ARG 97 1HH1 ARG 97 -10.807 -5.048 10.413 772 HH12 ARG 97 2HH1 ARG 97 -11.320 -5.693 11.937 773 HH21 ARG 97 1HH2 ARG 97 -10.518 -8.966 11.118 774 HH22 ARG 97 2HH2 ARG 97 -11.148 -7.912 12.339 775 H MET 98 H MET 98 -6.129 -9.513 5.637 776 HA MET 98 HA MET 98 -7.084 -12.153 4.964 777 HB2 MET 98 2HB MET 98 -5.481 -9.978 3.593 778 HB3 MET 98 1HB MET 98 -5.863 -11.491 2.772 779 HG2 MET 98 2HG MET 98 -8.118 -11.016 2.648 780 HG3 MET 98 1HG MET 98 -8.100 -10.038 4.116 781 HE1 MET 98 3HE MET 98 -7.934 -8.726 -0.137 782 HE2 MET 98 1HE MET 98 -9.054 -9.758 0.762 783 HE3 MET 98 2HE MET 98 -7.433 -10.333 0.385 784 H VAL 99 H VAL 99 -3.928 -10.667 5.518 785 HA VAL 99 HA VAL 99 -2.310 -12.950 4.835 786 HB VAL 99 HB VAL 99 -2.037 -10.363 6.344 787 HG11 VAL 99 1HG1 VAL 99 0.539 -11.213 6.286 788 HG12 VAL 99 2HG1 VAL 99 -0.280 -12.748 6.578 789 HG13 VAL 99 3HG1 VAL 99 -0.504 -11.402 7.696 790 HG21 VAL 99 3HG2 VAL 99 -1.919 -10.715 3.774 791 HG22 VAL 99 1HG2 VAL 99 -0.339 -11.433 4.091 792 HG23 VAL 99 2HG2 VAL 99 -0.649 -9.754 4.533 793 H ASP 100 H ASP 100 -3.929 -11.851 7.791 794 HA ASP 100 HA ASP 100 -2.641 -13.761 9.554 795 HB2 ASP 100 2HB ASP 100 -3.621 -11.770 10.471 796 HB3 ASP 100 1HB ASP 100 -5.153 -12.070 9.650 797 H LYS 101 H LYS 101 -5.481 -13.778 7.477 798 HA LYS 101 HA LYS 101 -6.357 -16.405 8.481 799 HB2 LYS 101 2HB LYS 101 -8.324 -15.606 7.747 800 HB3 LYS 101 1HB LYS 101 -7.499 -14.129 7.266 801 HG2 LYS 101 2HG LYS 101 -6.908 -15.843 5.178 802 HG3 LYS 101 1HG LYS 101 -8.548 -16.308 5.609 803 HD2 LYS 101 2HD LYS 101 -8.669 -13.589 5.741 804 HD3 LYS 101 1HD LYS 101 -7.527 -13.849 4.416 805 HE2 LYS 101 2HE LYS 101 -9.627 -13.934 3.330 806 HE3 LYS 101 1HE LYS 101 -9.245 -15.643 3.619 807 HZ1 LYS 101 3HZ LYS 101 -11.135 -13.910 5.033 808 HZ2 LYS 101 1HZ LYS 101 -10.332 -15.107 5.922 809 HZ3 LYS 101 2HZ LYS 101 -11.291 -15.541 4.590 810 H ILE 102 H ILE 102 -4.807 -14.892 5.703 811 HA ILE 102 HA ILE 102 -4.648 -17.181 3.991 812 HB ILE 102 HB ILE 102 -3.179 -14.580 4.394 813 HG12 ILE 102 2HG1 ILE 102 -4.755 -15.832 2.125 814 HG13 ILE 102 1HG1 ILE 102 -5.274 -14.513 3.174 815 HG21 ILE 102 1HG2 ILE 102 -1.282 -15.420 3.513 816 HG22 ILE 102 2HG2 ILE 102 -2.176 -15.646 2.010 817 HG23 ILE 102 3HG2 ILE 102 -2.050 -16.970 3.168 818 HD11 ILE 102 3HD1 ILE 102 -3.536 -14.439 0.814 819 HD12 ILE 102 1HD1 ILE 102 -2.856 -13.594 2.204 820 HD13 ILE 102 2HD1 ILE 102 -4.442 -13.135 1.582 821 H VAL 103 H VAL 103 -2.697 -15.883 6.599 822 HA VAL 103 HA VAL 103 -0.542 -17.806 6.453 823 HB VAL 103 HB VAL 103 -1.657 -15.801 8.407 824 HG11 VAL 103 1HG1 VAL 103 -0.889 -17.792 9.731 825 HG12 VAL 103 2HG1 VAL 103 0.074 -16.346 10.030 826 HG13 VAL 103 3HG1 VAL 103 0.702 -17.623 8.989 827 HG21 VAL 103 3HG2 VAL 103 1.203 -15.824 7.715 828 HG22 VAL 103 1HG2 VAL 103 0.036 -14.504 7.631 829 HG23 VAL 103 2HG2 VAL 103 0.140 -15.674 6.316 830 H SER 104 H SER 104 -3.677 -17.644 8.056 831 HA SER 104 HA SER 104 -3.259 -20.066 9.632 832 HB2 SER 104 2HB SER 104 -4.700 -18.028 10.180 833 HB3 SER 104 1HB SER 104 -5.831 -18.635 8.970 834 HG SER 104 HG SER 104 -6.101 -19.297 11.284 835 H GLU 105 H GLU 105 -5.015 -19.184 6.733 836 HA GLU 105 HA GLU 105 -5.385 -22.103 6.132 837 HB2 GLU 105 2HB GLU 105 -7.250 -19.918 5.208 838 HB3 GLU 105 1HB GLU 105 -7.584 -21.637 5.408 839 HG2 GLU 105 2HG GLU 105 -6.862 -20.929 7.955 840 HG3 GLU 105 1HG GLU 105 -7.664 -19.459 7.399 841 H GLY 106 H GLY 106 -4.860 -18.848 4.803 842 HA2 GLY 106 2HA GLY 106 -3.247 -18.569 2.958 843 HA3 GLY 106 1HA GLY 106 -3.746 -20.148 2.353 844 H SER 107 H SER 107 -6.224 -18.019 3.524 845 HA SER 107 HA SER 107 -7.096 -17.549 0.684 846 HB2 SER 107 2HB SER 107 -9.300 -17.160 2.158 847 HB3 SER 107 1HB SER 107 -8.803 -18.764 1.630 848 HG SER 107 HG SER 107 -7.820 -19.073 3.624 849 H ASP 108 H ASP 108 -7.163 -15.473 0.018 850 HA ASP 108 HA ASP 108 -6.707 -13.314 2.026 851 HB2 ASP 108 2HB ASP 108 -6.007 -12.044 0.107 852 HB3 ASP 108 1HB ASP 108 -5.357 -13.666 -0.134 853 H ASP 109 H ASP 109 -9.285 -14.936 1.105 854 HA ASP 109 HA ASP 109 -11.014 -12.671 0.245 855 HB2 ASP 109 2HB ASP 109 -11.022 -15.615 0.247 856 HB3 ASP 109 1HB ASP 109 -12.595 -14.900 0.601 857 H ILE 110 H ILE 110 -11.229 -11.360 2.132 858 HA ILE 110 HA ILE 110 -12.395 -12.698 4.546 859 HB ILE 110 HB ILE 110 -11.614 -10.562 5.662 860 HG12 ILE 110 2HG1 ILE 110 -9.901 -10.033 3.274 861 HG13 ILE 110 1HG1 ILE 110 -11.580 -9.499 3.204 862 HG21 ILE 110 1HG2 ILE 110 -9.605 -12.296 4.198 863 HG22 ILE 110 2HG2 ILE 110 -10.199 -12.510 5.845 864 HG23 ILE 110 3HG2 ILE 110 -9.155 -11.143 5.451 865 HD11 ILE 110 3HD1 ILE 110 -9.970 -7.781 4.132 866 HD12 ILE 110 1HD1 ILE 110 -9.731 -8.854 5.511 867 HD13 ILE 110 2HD1 ILE 110 -11.324 -8.170 5.193 868 H GLY 111 H GLY 111 -13.822 -11.810 2.031 869 HA2 GLY 111 2HA GLY 111 -16.003 -10.978 1.685 870 HA3 GLY 111 1HA GLY 111 -16.043 -10.486 3.378 871 H GLU 112 H GLU 112 -13.209 -9.295 2.123 872 HA GLU 112 HA GLU 112 -13.962 -6.562 2.300 873 HB2 GLU 112 2HB GLU 112 -11.807 -6.299 0.899 874 HB3 GLU 112 1HB GLU 112 -11.664 -7.160 2.432 875 HG2 GLU 112 2HG GLU 112 -11.184 -9.129 1.420 876 HG3 GLU 112 1HG GLU 112 -12.400 -8.881 0.166 877 H ASN 113 H ASN 113 -14.349 -4.989 0.613 878 HA ASN 113 HA ASN 113 -15.439 -6.160 -1.921 879 HB2 ASN 113 2HB ASN 113 -16.828 -4.898 -0.055 880 HB3 ASN 113 1HB ASN 113 -16.172 -3.466 -0.847 881 HD21 ASN 113 1HD2 ASN 113 -16.135 -5.127 -3.479 882 HD22 ASN 113 2HD2 ASN 113 -17.746 -5.063 -4.010 883 H ILE 114 H ILE 114 -13.485 -6.012 -3.126 884 HA ILE 114 HA ILE 114 -11.755 -3.748 -3.181 885 HB ILE 114 HB ILE 114 -12.393 -5.839 -5.280 886 HG12 ILE 114 2HG1 ILE 114 -11.693 -7.077 -3.424 887 HG13 ILE 114 1HG1 ILE 114 -10.158 -6.756 -4.229 888 HG21 ILE 114 1HG2 ILE 114 -11.013 -3.628 -5.793 889 HG22 ILE 114 2HG2 ILE 114 -10.491 -5.193 -6.421 890 HG23 ILE 114 3HG2 ILE 114 -9.728 -4.521 -4.979 891 HD11 ILE 114 3HD1 ILE 114 -11.316 -5.105 -1.961 892 HD12 ILE 114 1HD1 ILE 114 -9.755 -4.841 -2.743 893 HD13 ILE 114 2HD1 ILE 114 -10.028 -6.300 -1.792 894 H ASP 115 H ASP 115 -13.935 -4.702 -5.873 895 HA ASP 115 HA ASP 115 -13.853 -2.397 -7.377 896 HB2 ASP 115 2HB ASP 115 -16.261 -4.079 -6.626 897 HB3 ASP 115 1HB ASP 115 -16.211 -2.979 -8.004 898 H VAL 116 H VAL 116 -15.316 -2.854 -4.304 899 HA VAL 116 HA VAL 116 -16.676 -0.249 -4.290 900 HB VAL 116 HB VAL 116 -16.397 -2.608 -2.447 901 HG11 VAL 116 1HG1 VAL 116 -18.167 -1.294 -1.060 902 HG12 VAL 116 2HG1 VAL 116 -17.535 0.130 -1.886 903 HG13 VAL 116 3HG1 VAL 116 -16.470 -0.848 -0.876 904 HG21 VAL 116 3HG2 VAL 116 -18.070 -3.122 -3.971 905 HG22 VAL 116 1HG2 VAL 116 -18.508 -1.431 -4.217 906 HG23 VAL 116 2HG2 VAL 116 -19.028 -2.272 -2.757 907 H PHE 117 H PHE 117 -14.264 -1.884 -2.291 908 HA PHE 117 HA PHE 117 -13.494 0.359 -0.715 909 HB2 PHE 117 2HB PHE 117 -12.428 -2.291 -1.447 910 HB3 PHE 117 1HB PHE 117 -11.191 -1.128 -0.986 911 HD1 PHE 117 1HD PHE 117 -11.233 -0.050 1.243 912 HD2 PHE 117 2HD PHE 117 -14.039 -3.117 0.160 913 HE1 PHE 117 1HE PHE 117 -11.819 -0.359 3.633 914 HE2 PHE 117 2HE PHE 117 -14.626 -3.425 2.549 915 HZ PHE 117 HZ PHE 117 -13.516 -2.044 4.287 916 H SER 118 H SER 118 -12.819 -0.347 -4.038 917 HA SER 118 HA SER 118 -10.552 1.501 -4.172 918 HB2 SER 118 2HB SER 118 -10.049 -0.015 -5.783 919 HB3 SER 118 1HB SER 118 -11.647 -0.742 -5.628 920 HG SER 118 HG SER 118 -12.026 0.141 -7.491 921 H ASP 119 H ASP 119 -13.856 1.137 -5.197 922 HA ASP 119 HA ASP 119 -13.997 3.686 -6.598 923 HB2 ASP 119 2HB ASP 119 -15.908 1.540 -5.701 924 HB3 ASP 119 1HB ASP 119 -16.524 3.052 -6.368 925 H THR 120 H THR 120 -14.661 2.449 -3.447 926 HA THR 120 HA THR 120 -16.092 4.685 -2.364 927 HB THR 120 HB THR 120 -14.571 2.298 -1.398 928 HG1 THR 120 1HG THR 120 -17.123 3.288 -0.689 929 HG21 THR 120 3HG2 THR 120 -13.812 3.488 0.379 930 HG22 THR 120 1HG2 THR 120 -15.465 3.290 0.960 931 HG23 THR 120 2HG2 THR 120 -14.988 4.782 0.148 932 H ILE 121 H ILE 121 -12.744 3.700 -2.357 933 HA ILE 121 HA ILE 121 -11.707 6.049 -1.035 934 HB ILE 121 HB ILE 121 -10.870 3.499 -2.079 935 HG12 ILE 121 2HG1 ILE 121 -10.637 4.439 0.242 936 HG13 ILE 121 1HG1 ILE 121 -9.167 3.699 -0.391 937 HG21 ILE 121 1HG2 ILE 121 -8.552 4.159 -2.784 938 HG22 ILE 121 2HG2 ILE 121 -9.104 5.833 -2.854 939 HG23 ILE 121 3HG2 ILE 121 -9.808 4.625 -3.931 940 HD11 ILE 121 3HD1 ILE 121 -8.421 5.991 -1.125 941 HD12 ILE 121 1HD1 ILE 121 -8.550 5.803 0.622 942 HD13 ILE 121 2HD1 ILE 121 -9.810 6.657 -0.267 943 H LYS 122 H LYS 122 -12.051 5.018 -4.425 944 HA LYS 122 HA LYS 122 -10.782 7.308 -5.611 945 HB2 LYS 122 2HB LYS 122 -12.313 4.912 -6.334 946 HB3 LYS 122 1HB LYS 122 -12.685 6.286 -7.378 947 HG2 LYS 122 2HG LYS 122 -10.688 6.132 -8.410 948 HG3 LYS 122 1HG LYS 122 -9.852 6.177 -6.859 949 HD2 LYS 122 2HD LYS 122 -11.138 3.614 -7.231 950 HD3 LYS 122 1HD LYS 122 -10.071 3.972 -8.587 951 HE2 LYS 122 2HE LYS 122 -8.293 4.616 -6.840 952 HE3 LYS 122 1HE LYS 122 -9.352 3.833 -5.648 953 HZ1 LYS 122 3HZ LYS 122 -9.018 1.802 -6.536 954 HZ2 LYS 122 1HZ LYS 122 -7.583 2.489 -7.122 955 HZ3 LYS 122 2HZ LYS 122 -8.944 2.383 -8.132 956 H SER 123 H SER 123 -14.031 6.536 -4.525 957 HA SER 123 HA SER 123 -15.196 9.019 -5.569 958 HB2 SER 123 2HB SER 123 -16.084 6.702 -3.864 959 HB3 SER 123 1HB SER 123 -17.130 8.093 -4.133 960 HG SER 123 HG SER 123 -16.860 6.030 -5.686 961 H PHE 124 H PHE 124 -13.433 8.012 -2.871 962 HA PHE 124 HA PHE 124 -14.554 9.805 -0.872 963 HB2 PHE 124 2HB PHE 124 -12.684 7.687 -1.090 964 HB3 PHE 124 1HB PHE 124 -11.798 9.070 -0.447 965 HD1 PHE 124 2HD PHE 124 -12.922 10.373 1.512 966 HD2 PHE 124 1HD PHE 124 -14.030 6.394 0.331 967 HE1 PHE 124 2HE PHE 124 -13.961 10.002 3.733 968 HE2 PHE 124 1HE PHE 124 -15.068 6.024 2.552 969 HZ PHE 124 HZ PHE 124 -15.033 7.828 4.253 970 H ALA 125 H ALA 125 -12.886 10.390 -3.661 971 HA ALA 125 HA ALA 125 -11.656 12.898 -2.560 972 HB1 ALA 125 1HB ALA 125 -10.633 10.690 -4.204 973 HB2 ALA 125 2HB ALA 125 -9.743 11.904 -3.285 974 HB3 ALA 125 3HB ALA 125 -10.318 12.276 -4.910 975 H SER 126 H SER 126 -14.386 12.458 -3.697 976 HA SER 126 HA SER 126 -14.458 13.452 -6.413 977 HB2 SER 126 2HB SER 126 -16.880 13.745 -5.831 978 HB3 SER 126 1HB SER 126 -16.261 12.152 -5.406 979 HG SER 126 HG SER 126 -16.792 14.373 -3.739 980 H SER 127 H SER 127 -13.447 15.449 -6.719 981 HA SER 127 HA SER 127 -13.142 17.789 -6.572 982 HB2 SER 127 2HB SER 127 -15.634 18.167 -5.041 983 HB3 SER 127 1HB SER 127 -15.173 18.824 -6.610 984 HG SER 127 HG SER 127 -16.242 17.267 -7.516 985 H GLY 128 H GLY 128 -11.387 17.458 -4.984 986 HA2 GLY 128 2HA GLY 128 -10.338 17.887 -2.931 987 HA3 GLY 128 1HA GLY 128 -11.686 18.977 -2.602 988 H LYS 129 H LYS 129 -12.227 18.412 -0.514 989 HA LYS 129 HA LYS 129 -12.484 15.541 0.203 990 HB2 LYS 129 2HB LYS 129 -12.628 18.171 1.707 991 HB3 LYS 129 1HB LYS 129 -12.881 16.606 2.480 992 HG2 LYS 129 2HG LYS 129 -10.669 16.116 2.467 993 HG3 LYS 129 1HG LYS 129 -10.464 16.703 0.816 994 HD2 LYS 129 2HD LYS 129 -10.938 18.708 2.989 995 HD3 LYS 129 1HD LYS 129 -9.337 17.977 2.855 996 HE2 LYS 129 2HE LYS 129 -10.460 18.846 0.268 997 HE3 LYS 129 1HE LYS 129 -10.143 20.170 1.407 998 HZ1 LYS 129 3HZ LYS 129 -8.096 19.778 0.360 999 HZ2 LYS 129 1HZ LYS 129 -8.265 18.092 0.446 1000 HZ3 LYS 129 2HZ LYS 129 -7.963 18.987 1.857 1001 H GLU 130 H GLU 130 -14.525 15.065 1.608 1002 HA GLU 130 HA GLU 130 -16.919 16.395 0.379 1003 HB2 GLU 130 2HB GLU 130 -16.529 14.177 -0.567 1004 HB3 GLU 130 1HB GLU 130 -16.396 13.481 1.049 1005 HG2 GLU 130 2HG GLU 130 -18.664 13.558 1.420 1006 HG3 GLU 130 1HG GLU 130 -18.879 15.007 0.438 1007 H LYS 131 H LYS 131 -18.657 16.783 1.797 1008 HA LYS 131 HA LYS 131 -18.872 15.651 4.439 1009 HB2 LYS 131 2HB LYS 131 -18.117 17.661 5.688 1010 HB3 LYS 131 1HB LYS 131 -16.812 16.977 4.718 1011 HG2 LYS 131 2HG LYS 131 -17.096 18.649 3.010 1012 HG3 LYS 131 1HG LYS 131 -18.581 19.239 3.758 1013 HD2 LYS 131 2HD LYS 131 -17.294 20.735 4.856 1014 HD3 LYS 131 1HD LYS 131 -16.700 19.376 5.811 1015 HE2 LYS 131 2HE LYS 131 -14.731 20.405 4.933 1016 HE3 LYS 131 1HE LYS 131 -15.009 19.009 3.870 1017 HZ1 LYS 131 3HZ LYS 131 -16.519 21.335 3.114 1018 HZ2 LYS 131 1HZ LYS 131 -15.543 20.326 2.161 1019 HZ3 LYS 131 2HZ LYS 131 -14.842 21.596 3.046 1020 H LEU 132 H LEU 132 -20.937 16.079 5.192 1021 HA LEU 132 HA LEU 132 -22.354 18.554 4.596 1022 HB2 LEU 132 2HB LEU 132 -22.397 17.393 2.412 1023 HB3 LEU 132 1HB LEU 132 -23.121 15.979 3.180 1024 HG LEU 132 HG LEU 132 -24.641 18.305 3.902 1025 HD11 LEU 132 1HD1 LEU 132 -24.567 17.859 0.917 1026 HD12 LEU 132 2HD1 LEU 132 -23.562 19.087 1.687 1027 HD13 LEU 132 3HD1 LEU 132 -25.319 19.181 1.810 1028 HD21 LEU 132 3HD2 LEU 132 -25.142 15.713 3.551 1029 HD22 LEU 132 1HD2 LEU 132 -25.591 16.257 1.935 1030 HD23 LEU 132 2HD2 LEU 132 -26.413 16.917 3.349 1031 H GLU 133 H GLU 133 -22.066 17.735 7.067 1032 HA GLU 133 HA GLU 133 -23.837 15.699 8.058 1033 HB2 GLU 133 2HB GLU 133 -21.957 17.665 8.999 1034 HB3 GLU 133 1HB GLU 133 -23.412 17.745 9.994 1035 HG2 GLU 133 2HG GLU 133 -22.938 15.002 9.617 1036 HG3 GLU 133 1HG GLU 133 -21.351 15.704 9.938 Start of MODEL 20 1 H1 MET 1 1HT MET 1 12.556 -27.707 -1.397 2 H2 MET 1 2HT MET 1 11.550 -28.380 -0.204 3 H3 MET 1 3HT MET 1 11.858 -26.709 -0.217 4 HA MET 1 HA MET 1 10.532 -26.339 -2.096 5 HB2 MET 1 2HB MET 1 9.857 -28.264 -3.506 6 HB3 MET 1 1HB MET 1 11.611 -28.182 -3.339 7 HG2 MET 1 2HG MET 1 10.045 -29.811 -1.367 8 HG3 MET 1 1HG MET 1 10.352 -30.476 -2.972 9 HE1 MET 1 2HE MET 1 11.111 -31.820 -0.507 10 HE2 MET 1 3HE MET 1 11.678 -30.519 0.538 11 HE3 MET 1 1HE MET 1 12.794 -31.789 0.014 12 H MET 2 H MET 2 10.094 -27.123 0.816 13 HA MET 2 HA MET 2 7.491 -28.497 0.813 14 HB2 MET 2 2HB MET 2 9.077 -27.081 2.981 15 HB3 MET 2 1HB MET 2 7.705 -28.157 3.249 16 HG2 MET 2 2HG MET 2 9.144 -29.887 3.283 17 HG3 MET 2 1HG MET 2 9.478 -29.580 1.580 18 HE1 MET 2 3HE MET 2 10.939 -30.575 4.367 19 HE2 MET 2 1HE MET 2 10.741 -29.090 5.307 20 HE3 MET 2 2HE MET 2 12.349 -29.620 4.820 21 H GLU 3 H GLU 3 6.251 -26.943 2.869 22 HA GLU 3 HA GLU 3 4.948 -24.895 1.273 23 HB2 GLU 3 2HB GLU 3 3.733 -24.525 3.417 24 HB3 GLU 3 1HB GLU 3 3.784 -26.235 2.969 25 HG2 GLU 3 2HG GLU 3 6.108 -25.373 4.541 26 HG3 GLU 3 1HG GLU 3 4.581 -25.186 5.405 27 H GLU 4 H GLU 4 7.816 -24.900 3.003 28 HA GLU 4 HA GLU 4 7.673 -22.377 4.310 29 HB2 GLU 4 2HB GLU 4 9.361 -24.046 4.847 30 HB3 GLU 4 1HB GLU 4 9.993 -23.983 3.201 31 HG2 GLU 4 2HG GLU 4 10.577 -21.584 3.554 32 HG3 GLU 4 1HG GLU 4 10.036 -21.728 5.228 33 H TYR 5 H TYR 5 7.724 -23.134 1.039 34 HA TYR 5 HA TYR 5 9.245 -20.942 -0.036 35 HB2 TYR 5 2HB TYR 5 8.143 -23.207 -0.997 36 HB3 TYR 5 1HB TYR 5 6.894 -22.060 -1.481 37 HD1 TYR 5 2HD TYR 5 10.650 -21.977 -1.320 38 HD2 TYR 5 1HD TYR 5 7.117 -21.383 -3.689 39 HE1 TYR 5 2HE TYR 5 12.053 -21.253 -3.233 40 HE2 TYR 5 1HE TYR 5 8.520 -20.661 -5.602 41 HH TYR 5 HH TYR 5 11.254 -21.260 -6.199 42 H LEU 6 H LEU 6 6.037 -21.337 1.140 43 HA LEU 6 HA LEU 6 5.086 -18.726 0.139 44 HB2 LEU 6 2HB LEU 6 3.763 -20.650 2.070 45 HB3 LEU 6 1HB LEU 6 2.980 -19.482 1.005 46 HG LEU 6 HG LEU 6 4.564 -21.081 -0.682 47 HD11 LEU 6 1HD1 LEU 6 4.847 -22.913 0.702 48 HD12 LEU 6 2HD1 LEU 6 3.287 -23.317 -0.016 49 HD13 LEU 6 3HD1 LEU 6 3.358 -22.602 1.595 50 HD21 LEU 6 3HD2 LEU 6 2.198 -21.984 -1.287 51 HD22 LEU 6 1HD2 LEU 6 2.505 -20.257 -1.475 52 HD23 LEU 6 2HD2 LEU 6 1.622 -20.848 -0.067 53 H GLY 7 H GLY 7 5.722 -20.307 3.290 54 HA2 GLY 7 2HA GLY 7 5.123 -18.236 5.048 55 HA3 GLY 7 1HA GLY 7 6.495 -19.324 5.295 56 H VAL 8 H VAL 8 7.739 -18.475 2.742 57 HA VAL 8 HA VAL 8 9.225 -16.185 3.760 58 HB VAL 8 HB VAL 8 9.266 -17.688 1.133 59 HG11 VAL 8 1HG1 VAL 8 11.706 -16.335 2.079 60 HG12 VAL 8 2HG1 VAL 8 10.395 -15.234 1.652 61 HG13 VAL 8 3HG1 VAL 8 11.002 -16.384 0.463 62 HG21 VAL 8 3HG2 VAL 8 9.895 -18.641 3.626 63 HG22 VAL 8 1HG2 VAL 8 11.453 -18.005 3.095 64 HG23 VAL 8 2HG2 VAL 8 10.623 -19.226 2.130 65 H PHE 9 H PHE 9 7.431 -16.744 0.773 66 HA PHE 9 HA PHE 9 7.303 -14.100 -0.181 67 HB2 PHE 9 2HB PHE 9 6.477 -15.852 -1.552 68 HB3 PHE 9 1HB PHE 9 5.426 -16.466 -0.276 69 HD1 PHE 9 1HD PHE 9 3.364 -15.218 0.364 70 HD2 PHE 9 2HD PHE 9 5.789 -14.039 -2.979 71 HE1 PHE 9 1HE PHE 9 1.507 -13.812 -0.486 72 HE2 PHE 9 2HE PHE 9 3.931 -12.632 -3.829 73 HZ PHE 9 HZ PHE 9 1.790 -12.519 -2.583 74 H VAL 10 H VAL 10 5.178 -15.744 2.162 75 HA VAL 10 HA VAL 10 3.475 -13.434 2.618 76 HB VAL 10 HB VAL 10 4.016 -15.910 4.296 77 HG11 VAL 10 1HG1 VAL 10 1.329 -15.113 4.468 78 HG12 VAL 10 2HG1 VAL 10 2.256 -13.618 4.591 79 HG13 VAL 10 3HG1 VAL 10 2.560 -14.939 5.719 80 HG21 VAL 10 3HG2 VAL 10 2.147 -16.913 3.076 81 HG22 VAL 10 1HG2 VAL 10 3.387 -16.404 1.929 82 HG23 VAL 10 2HG2 VAL 10 1.930 -15.433 2.143 83 H ASP 11 H ASP 11 6.333 -14.830 4.239 84 HA ASP 11 HA ASP 11 6.330 -13.091 6.512 85 HB2 ASP 11 2HB ASP 11 7.662 -15.075 6.532 86 HB3 ASP 11 1HB ASP 11 8.440 -14.647 5.007 87 H GLU 12 H GLU 12 7.073 -12.591 3.230 88 HA GLU 12 HA GLU 12 8.741 -10.192 3.673 89 HB2 GLU 12 2HB GLU 12 7.787 -11.887 1.398 90 HB3 GLU 12 1HB GLU 12 8.252 -10.223 1.037 91 HG2 GLU 12 2HG GLU 12 10.457 -10.555 1.917 92 HG3 GLU 12 1HG GLU 12 10.013 -12.115 2.607 93 H THR 13 H THR 13 5.547 -11.010 2.318 94 HA THR 13 HA THR 13 4.624 -8.427 1.678 95 HB THR 13 HB THR 13 2.418 -9.467 1.861 96 HG1 THR 13 1HG THR 13 2.092 -11.221 3.083 97 HG21 THR 13 3HG2 THR 13 3.566 -11.936 1.058 98 HG22 THR 13 1HG2 THR 13 4.678 -10.663 0.553 99 HG23 THR 13 2HG2 THR 13 2.995 -10.625 0.025 100 H LYS 14 H LYS 14 4.721 -10.096 4.807 101 HA LYS 14 HA LYS 14 3.252 -8.021 6.236 102 HB2 LYS 14 2HB LYS 14 4.997 -10.376 7.018 103 HB3 LYS 14 1HB LYS 14 4.162 -9.370 8.203 104 HG2 LYS 14 2HG LYS 14 2.101 -10.203 7.658 105 HG3 LYS 14 1HG LYS 14 2.511 -10.381 5.951 106 HD2 LYS 14 2HD LYS 14 2.762 -12.587 6.339 107 HD3 LYS 14 1HD LYS 14 4.201 -12.179 7.276 108 HE2 LYS 14 2HE LYS 14 2.896 -12.026 9.325 109 HE3 LYS 14 1HE LYS 14 1.387 -12.261 8.420 110 HZ1 LYS 14 3HZ LYS 14 2.639 -14.336 7.519 111 HZ2 LYS 14 1HZ LYS 14 1.873 -14.409 9.030 112 HZ3 LYS 14 2HZ LYS 14 3.554 -14.181 8.943 113 H GLU 15 H GLU 15 6.696 -8.931 5.903 114 HA GLU 15 HA GLU 15 7.692 -6.834 7.604 115 HB2 GLU 15 2HB GLU 15 8.822 -8.605 5.440 116 HB3 GLU 15 1HB GLU 15 9.827 -7.402 6.250 117 HG2 GLU 15 2HG GLU 15 8.379 -8.785 8.267 118 HG3 GLU 15 1HG GLU 15 9.062 -10.001 7.186 119 H TYR 16 H TYR 16 6.456 -6.885 4.446 120 HA TYR 16 HA TYR 16 7.813 -4.416 3.568 121 HB2 TYR 16 2HB TYR 16 6.044 -6.533 2.426 122 HB3 TYR 16 1HB TYR 16 5.998 -4.947 1.654 123 HD1 TYR 16 1HD TYR 16 8.822 -6.761 3.309 124 HD2 TYR 16 2HD TYR 16 7.234 -5.135 -0.337 125 HE1 TYR 16 1HE TYR 16 10.958 -7.261 2.156 126 HE2 TYR 16 2HE TYR 16 9.371 -5.634 -1.490 127 HH TYR 16 HH TYR 16 11.754 -5.978 -0.874 128 H LEU 17 H LEU 17 4.580 -5.512 4.585 129 HA LEU 17 HA LEU 17 3.166 -3.080 4.074 130 HB2 LEU 17 2HB LEU 17 2.893 -5.296 6.130 131 HB3 LEU 17 1HB LEU 17 1.688 -4.019 5.938 132 HG LEU 17 HG LEU 17 2.624 -5.630 3.579 133 HD11 LEU 17 1HD1 LEU 17 1.853 -7.343 5.044 134 HD12 LEU 17 2HD1 LEU 17 0.481 -6.984 3.997 135 HD13 LEU 17 3HD1 LEU 17 0.530 -6.343 5.639 136 HD21 LEU 17 3HD2 LEU 17 0.357 -3.794 4.275 137 HD22 LEU 17 1HD2 LEU 17 0.100 -5.034 3.045 138 HD23 LEU 17 2HD2 LEU 17 1.364 -3.823 2.828 139 H GLN 18 H GLN 18 5.069 -4.225 6.813 140 HA GLN 18 HA GLN 18 4.625 -1.936 8.503 141 HB2 GLN 18 2HB GLN 18 5.642 -3.400 9.874 142 HB3 GLN 18 1HB GLN 18 5.944 -4.442 8.492 143 HG2 GLN 18 2HG GLN 18 8.088 -3.491 8.106 144 HG3 GLN 18 1HG GLN 18 7.754 -2.120 9.164 145 HE21 GLN 18 1HE2 GLN 18 6.762 -3.332 11.463 146 HE22 GLN 18 2HE2 GLN 18 7.929 -4.370 12.128 147 H ASN 19 H ASN 19 7.182 -2.933 6.343 148 HA ASN 19 HA ASN 19 8.771 -0.564 6.492 149 HB2 ASN 19 2HB ASN 19 8.490 -2.993 4.861 150 HB3 ASN 19 1HB ASN 19 9.037 -1.603 3.919 151 HD21 ASN 19 1HD2 ASN 19 11.093 -3.087 3.878 152 HD22 ASN 19 2HD2 ASN 19 12.208 -2.864 5.139 153 H LEU 20 H LEU 20 5.832 -1.436 4.971 154 HA LEU 20 HA LEU 20 5.753 0.964 3.247 155 HB2 LEU 20 2HB LEU 20 4.880 -0.939 2.172 156 HB3 LEU 20 1HB LEU 20 4.126 -1.534 3.652 157 HG LEU 20 HG LEU 20 2.525 0.386 3.552 158 HD11 LEU 20 1HD1 LEU 20 4.336 1.529 1.881 159 HD12 LEU 20 2HD1 LEU 20 2.639 2.005 1.944 160 HD13 LEU 20 3HD1 LEU 20 3.193 0.877 0.707 161 HD21 LEU 20 3HD2 LEU 20 2.633 -1.345 1.061 162 HD22 LEU 20 1HD2 LEU 20 1.201 -0.515 1.671 163 HD23 LEU 20 2HD2 LEU 20 1.930 -1.821 2.607 164 H ASN 21 H ASN 21 4.919 0.014 6.391 165 HA ASN 21 HA ASN 21 2.772 2.019 6.659 166 HB2 ASN 21 2HB ASN 21 3.913 -0.258 8.223 167 HB3 ASN 21 1HB ASN 21 3.160 1.058 9.128 168 HD21 ASN 21 1HD2 ASN 21 2.161 -0.096 5.891 169 HD22 ASN 21 2HD2 ASN 21 0.622 -0.623 6.378 170 H ASP 22 H ASP 22 6.056 1.275 7.342 171 HA ASP 22 HA ASP 22 6.567 3.441 9.105 172 HB2 ASP 22 2HB ASP 22 7.911 1.242 8.439 173 HB3 ASP 22 1HB ASP 22 8.656 2.339 7.276 174 H THR 23 H THR 23 6.500 2.937 5.734 175 HA THR 23 HA THR 23 7.577 5.515 4.885 176 HB THR 23 HB THR 23 5.869 3.350 3.651 177 HG1 THR 23 1HG THR 23 7.882 2.580 4.093 178 HG21 THR 23 3HG2 THR 23 6.937 4.450 1.493 179 HG22 THR 23 1HG2 THR 23 7.024 5.877 2.527 180 HG23 THR 23 2HG2 THR 23 5.466 5.118 2.198 181 H LEU 24 H LEU 24 4.391 4.008 5.314 182 HA LEU 24 HA LEU 24 2.851 6.325 4.483 183 HB2 LEU 24 2HB LEU 24 2.457 3.606 5.626 184 HB3 LEU 24 1HB LEU 24 1.178 4.770 5.970 185 HG LEU 24 HG LEU 24 2.253 4.220 3.191 186 HD11 LEU 24 1HD1 LEU 24 0.905 2.374 4.572 187 HD12 LEU 24 2HD1 LEU 24 0.587 2.654 2.861 188 HD13 LEU 24 3HD1 LEU 24 -0.468 3.365 4.082 189 HD21 LEU 24 3HD2 LEU 24 0.634 5.697 2.431 190 HD22 LEU 24 1HD2 LEU 24 1.011 6.439 3.986 191 HD23 LEU 24 2HD2 LEU 24 -0.418 5.419 3.819 192 H LEU 25 H LEU 25 4.323 5.145 7.425 193 HA LEU 25 HA LEU 25 2.768 6.928 9.174 194 HB2 LEU 25 2HB LEU 25 5.169 5.126 9.490 195 HB3 LEU 25 1HB LEU 25 4.536 6.091 10.830 196 HG LEU 25 HG LEU 25 2.703 4.393 9.184 197 HD11 LEU 25 1HD1 LEU 25 4.271 3.471 11.614 198 HD12 LEU 25 2HD1 LEU 25 4.554 2.930 9.958 199 HD13 LEU 25 3HD1 LEU 25 3.035 2.541 10.765 200 HD21 LEU 25 3HD2 LEU 25 2.138 6.218 11.024 201 HD22 LEU 25 1HD2 LEU 25 2.514 4.899 12.136 202 HD23 LEU 25 2HD2 LEU 25 1.220 4.711 10.951 203 H GLU 26 H GLU 26 5.556 7.128 7.262 204 HA GLU 26 HA GLU 26 6.508 9.573 8.648 205 HB2 GLU 26 2HB GLU 26 7.528 7.859 6.357 206 HB3 GLU 26 1HB GLU 26 8.320 9.354 6.860 207 HG2 GLU 26 2HG GLU 26 7.727 7.287 8.942 208 HG3 GLU 26 1HG GLU 26 9.089 7.018 7.854 209 H LEU 27 H LEU 27 4.750 8.334 6.020 210 HA LEU 27 HA LEU 27 4.738 10.690 4.425 211 HB2 LEU 27 2HB LEU 27 4.321 8.583 3.373 212 HB3 LEU 27 1HB LEU 27 3.093 8.170 4.570 213 HG LEU 27 HG LEU 27 1.725 10.108 3.731 214 HD11 LEU 27 1HD1 LEU 27 2.357 10.946 1.444 215 HD12 LEU 27 2HD1 LEU 27 3.904 10.119 1.625 216 HD13 LEU 27 3HD1 LEU 27 3.475 11.438 2.715 217 HD21 LEU 27 3HD2 LEU 27 0.951 8.074 2.894 218 HD22 LEU 27 1HD2 LEU 27 2.463 7.728 2.056 219 HD23 LEU 27 2HD2 LEU 27 1.344 8.921 1.398 220 H GLU 28 H GLU 28 2.959 9.536 7.170 221 HA GLU 28 HA GLU 28 0.681 11.327 6.836 222 HB2 GLU 28 2HB GLU 28 -0.013 10.316 8.818 223 HB3 GLU 28 1HB GLU 28 1.097 9.101 8.196 224 HG2 GLU 28 2HG GLU 28 2.897 10.025 9.585 225 HG3 GLU 28 1HG GLU 28 1.788 11.235 10.222 226 H LYS 29 H LYS 29 3.748 11.347 8.642 227 HA LYS 29 HA LYS 29 3.289 13.965 9.854 228 HB2 LYS 29 2HB LYS 29 5.909 12.568 9.242 229 HB3 LYS 29 1HB LYS 29 5.618 13.765 10.503 230 HG2 LYS 29 2HG LYS 29 4.532 12.260 11.876 231 HG3 LYS 29 1HG LYS 29 3.971 11.272 10.522 232 HD2 LYS 29 2HD LYS 29 6.425 10.687 10.127 233 HD3 LYS 29 1HD LYS 29 6.740 11.381 11.719 234 HE2 LYS 29 2HE LYS 29 4.473 9.482 11.625 235 HE3 LYS 29 1HE LYS 29 6.072 8.765 11.341 236 HZ1 LYS 29 3HZ LYS 29 5.879 8.829 13.659 237 HZ2 LYS 29 1HZ LYS 29 5.165 10.369 13.658 238 HZ3 LYS 29 2HZ LYS 29 6.815 10.198 13.293 239 H ASN 30 H ASN 30 4.157 12.700 6.852 240 HA ASN 30 HA ASN 30 4.489 15.426 5.721 241 HB2 ASN 30 2HB ASN 30 6.700 13.898 6.368 242 HB3 ASN 30 1HB ASN 30 6.425 13.446 4.686 243 HD21 ASN 30 1HD2 ASN 30 5.494 15.843 3.579 244 HD22 ASN 30 2HD2 ASN 30 6.693 17.039 3.703 245 HA PRO 31 HA PRO 31 1.928 12.604 3.311 246 HB2 PRO 31 2HB PRO 31 -0.357 14.039 3.572 247 HB3 PRO 31 1HB PRO 31 0.224 12.894 4.788 248 HG2 PRO 31 2HG PRO 31 0.193 15.820 4.863 249 HG3 PRO 31 1HG PRO 31 0.167 14.644 6.184 250 HD2 PRO 31 2HD PRO 31 2.390 16.106 5.219 251 HD3 PRO 31 1HD PRO 31 2.378 14.829 6.457 252 H GLU 32 H GLU 32 3.633 15.060 2.565 253 HA GLU 32 HA GLU 32 2.222 15.597 -0.002 254 HB2 GLU 32 2HB GLU 32 3.485 17.995 0.593 255 HB3 GLU 32 1HB GLU 32 1.764 17.684 0.790 256 HG2 GLU 32 2HG GLU 32 2.013 17.164 3.099 257 HG3 GLU 32 1HG GLU 32 3.769 17.039 2.956 258 H ASP 33 H ASP 33 4.762 14.246 1.404 259 HA ASP 33 HA ASP 33 6.896 15.421 -0.255 260 HB2 ASP 33 2HB ASP 33 7.109 14.729 2.180 261 HB3 ASP 33 1HB ASP 33 6.944 13.058 1.641 262 H MET 34 H MET 34 7.298 14.577 -2.273 263 HA MET 34 HA MET 34 5.849 12.330 -3.319 264 HB2 MET 34 2HB MET 34 7.790 14.337 -4.153 265 HB3 MET 34 1HB MET 34 8.105 12.779 -4.917 266 HG2 MET 34 2HG MET 34 5.997 12.710 -5.943 267 HG3 MET 34 1HG MET 34 5.305 13.876 -4.814 268 HE1 MET 34 3HE MET 34 4.911 16.371 -7.492 269 HE2 MET 34 1HE MET 34 4.383 15.696 -5.944 270 HE3 MET 34 2HE MET 34 4.372 14.696 -7.396 271 H GLU 35 H GLU 35 8.473 12.384 -1.201 272 HA GLU 35 HA GLU 35 9.846 10.021 -2.248 273 HB2 GLU 35 2HB GLU 35 10.072 11.970 -0.045 274 HB3 GLU 35 1HB GLU 35 10.590 10.342 0.390 275 HG2 GLU 35 2HG GLU 35 12.052 10.297 -1.618 276 HG3 GLU 35 1HG GLU 35 11.576 11.958 -1.978 277 H LEU 36 H LEU 36 7.961 10.656 0.746 278 HA LEU 36 HA LEU 36 7.590 7.855 1.311 279 HB2 LEU 36 2HB LEU 36 5.770 10.123 2.151 280 HB3 LEU 36 1HB LEU 36 6.158 8.660 3.050 281 HG LEU 36 HG LEU 36 7.776 11.149 2.690 282 HD11 LEU 36 1HD1 LEU 36 6.785 11.038 4.794 283 HD12 LEU 36 2HD1 LEU 36 8.377 10.347 5.103 284 HD13 LEU 36 3HD1 LEU 36 6.981 9.289 4.899 285 HD21 LEU 36 3HD2 LEU 36 9.487 9.770 1.925 286 HD22 LEU 36 1HD2 LEU 36 8.844 8.348 2.745 287 HD23 LEU 36 2HD2 LEU 36 9.701 9.585 3.665 288 H ILE 37 H ILE 37 6.060 10.142 -0.816 289 HA ILE 37 HA ILE 37 3.593 8.594 -1.160 290 HB ILE 37 HB ILE 37 4.937 10.949 -2.498 291 HG12 ILE 37 2HG1 ILE 37 2.376 10.606 -0.907 292 HG13 ILE 37 1HG1 ILE 37 3.866 11.350 -0.327 293 HG21 ILE 37 1HG2 ILE 37 2.262 9.724 -3.232 294 HG22 ILE 37 2HG2 ILE 37 3.724 9.606 -4.211 295 HG23 ILE 37 3HG2 ILE 37 2.973 11.177 -3.934 296 HD11 ILE 37 3HD1 ILE 37 2.666 13.233 -0.973 297 HD12 ILE 37 1HD1 ILE 37 1.875 12.396 -2.309 298 HD13 ILE 37 2HD1 ILE 37 3.563 12.888 -2.452 299 H ASN 38 H ASN 38 6.794 8.822 -2.616 300 HA ASN 38 HA ASN 38 6.014 7.069 -4.860 301 HB2 ASN 38 2HB ASN 38 7.541 8.992 -5.188 302 HB3 ASN 38 1HB ASN 38 8.658 8.296 -4.013 303 HD21 ASN 38 1HD2 ASN 38 7.016 7.414 -7.105 304 HD22 ASN 38 2HD2 ASN 38 8.311 6.490 -7.696 305 H GLU 39 H GLU 39 7.621 6.968 -1.804 306 HA GLU 39 HA GLU 39 8.773 4.311 -2.148 307 HB2 GLU 39 2HB GLU 39 8.201 6.085 0.246 308 HB3 GLU 39 1HB GLU 39 9.096 4.567 0.347 309 HG2 GLU 39 2HG GLU 39 9.995 6.531 -1.705 310 HG3 GLU 39 1HG GLU 39 10.332 6.921 -0.017 311 H ALA 40 H ALA 40 5.747 5.654 -1.370 312 HA ALA 40 HA ALA 40 4.675 3.208 -0.099 313 HB1 ALA 40 1HB ALA 40 4.154 5.585 0.613 314 HB2 ALA 40 2HB ALA 40 2.728 4.613 0.255 315 HB3 ALA 40 3HB ALA 40 3.310 5.792 -0.921 316 H PHE 41 H PHE 41 3.980 5.241 -3.000 317 HA PHE 41 HA PHE 41 2.067 3.581 -4.235 318 HB2 PHE 41 2HB PHE 41 2.486 5.681 -5.210 319 HB3 PHE 41 1HB PHE 41 4.235 5.457 -5.164 320 HD1 PHE 41 1HD PHE 41 5.315 3.809 -6.735 321 HD2 PHE 41 2HD PHE 41 1.199 4.981 -7.101 322 HE1 PHE 41 1HE PHE 41 5.278 2.949 -9.060 323 HE2 PHE 41 2HE PHE 41 1.163 4.122 -9.429 324 HZ PHE 41 HZ PHE 41 3.203 3.105 -10.408 325 H ARG 42 H ARG 42 5.534 3.167 -3.902 326 HA ARG 42 HA ARG 42 5.778 1.057 -5.909 327 HB2 ARG 42 2HB ARG 42 7.470 2.284 -3.737 328 HB3 ARG 42 1HB ARG 42 8.019 0.832 -4.574 329 HG2 ARG 42 2HG ARG 42 7.892 1.958 -6.724 330 HG3 ARG 42 1HG ARG 42 7.185 3.388 -5.972 331 HD2 ARG 42 2HD ARG 42 9.337 4.144 -5.843 332 HD3 ARG 42 1HD ARG 42 9.499 3.007 -4.489 333 HE ARG 42 HE ARG 42 10.462 1.383 -6.020 334 HH11 ARG 42 1HH1 ARG 42 8.803 2.834 -8.316 335 HH12 ARG 42 2HH1 ARG 42 10.121 3.293 -9.343 336 HH21 ARG 42 1HH2 ARG 42 12.552 2.663 -6.952 337 HH22 ARG 42 2HH2 ARG 42 12.242 3.195 -8.571 338 H ALA 43 H ALA 43 6.266 0.998 -2.357 339 HA ALA 43 HA ALA 43 6.332 -1.702 -1.835 340 HB1 ALA 43 1HB ALA 43 5.191 -1.086 0.316 341 HB2 ALA 43 2HB ALA 43 4.785 0.476 -0.395 342 HB3 ALA 43 3HB ALA 43 6.473 0.039 -0.132 343 H LEU 44 H LEU 44 3.303 0.191 -2.172 344 HA LEU 44 HA LEU 44 1.556 -2.086 -1.964 345 HB2 LEU 44 2HB LEU 44 1.371 0.728 -3.046 346 HB3 LEU 44 1HB LEU 44 -0.005 -0.373 -3.147 347 HG LEU 44 HG LEU 44 1.418 0.009 -0.526 348 HD11 LEU 44 1HD1 LEU 44 -0.051 1.865 0.020 349 HD12 LEU 44 2HD1 LEU 44 -0.845 1.746 -1.551 350 HD13 LEU 44 3HD1 LEU 44 0.836 2.269 -1.449 351 HD21 LEU 44 3HD2 LEU 44 -0.159 -1.706 -0.362 352 HD22 LEU 44 1HD2 LEU 44 -1.255 -0.943 -1.514 353 HD23 LEU 44 2HD2 LEU 44 -1.117 -0.308 0.126 354 H HIS 45 H HIS 45 3.065 -0.401 -4.704 355 HA HIS 45 HA HIS 45 1.771 -1.943 -6.778 356 HB2 HIS 45 2HB HIS 45 2.798 0.192 -7.255 357 HB3 HIS 45 1HB HIS 45 4.335 -0.332 -6.564 358 HD1 HIS 45 1HD HIS 45 5.821 -0.314 -8.616 359 HD2 HIS 45 2HD HIS 45 2.265 -2.393 -9.260 360 HE1 HIS 45 1HE HIS 45 6.047 -1.440 -10.873 361 H THR 46 H THR 46 4.614 -2.338 -4.763 362 HA THR 46 HA THR 46 5.643 -4.665 -6.217 363 HB THR 46 HB THR 46 6.359 -2.849 -4.015 364 HG1 THR 46 1HG THR 46 8.486 -3.748 -4.888 365 HG21 THR 46 3HG2 THR 46 6.385 -4.628 -2.500 366 HG22 THR 46 1HG2 THR 46 8.033 -4.653 -3.130 367 HG23 THR 46 2HG2 THR 46 6.840 -5.803 -3.735 368 H LEU 47 H LEU 47 3.821 -4.023 -3.218 369 HA LEU 47 HA LEU 47 3.662 -6.834 -2.454 370 HB2 LEU 47 2HB LEU 47 2.781 -4.175 -1.521 371 HB3 LEU 47 1HB LEU 47 1.667 -5.483 -1.115 372 HG LEU 47 HG LEU 47 4.635 -5.736 -0.635 373 HD11 LEU 47 1HD1 LEU 47 4.426 -4.078 0.897 374 HD12 LEU 47 2HD1 LEU 47 3.502 -5.249 1.835 375 HD13 LEU 47 3HD1 LEU 47 2.666 -4.093 0.798 376 HD21 LEU 47 3HD2 LEU 47 3.155 -7.092 1.301 377 HD22 LEU 47 1HD2 LEU 47 3.921 -7.816 -0.114 378 HD23 LEU 47 2HD2 LEU 47 2.228 -7.325 -0.181 379 H LYS 48 H LYS 48 1.587 -4.524 -4.174 380 HA LYS 48 HA LYS 48 -0.785 -6.105 -4.337 381 HB2 LYS 48 2HB LYS 48 -0.825 -3.788 -4.892 382 HB3 LYS 48 1HB LYS 48 0.507 -3.963 -6.036 383 HG2 LYS 48 2HG LYS 48 -1.505 -5.755 -6.898 384 HG3 LYS 48 1HG LYS 48 -2.322 -4.243 -6.504 385 HD2 LYS 48 2HD LYS 48 -1.674 -3.884 -8.720 386 HD3 LYS 48 1HD LYS 48 -0.363 -3.130 -7.814 387 HE2 LYS 48 2HE LYS 48 1.164 -4.725 -8.444 388 HE3 LYS 48 1HE LYS 48 -0.041 -6.029 -8.414 389 HZ1 LYS 48 3HZ LYS 48 0.601 -5.437 -10.693 390 HZ2 LYS 48 1HZ LYS 48 0.066 -3.849 -10.432 391 HZ3 LYS 48 2HZ LYS 48 -1.045 -5.133 -10.402 392 H GLY 49 H GLY 49 2.152 -6.003 -6.342 393 HA2 GLY 49 2HA GLY 49 1.161 -7.802 -8.372 394 HA3 GLY 49 1HA GLY 49 2.857 -7.399 -8.100 395 H MET 50 H MET 50 3.216 -8.263 -5.489 396 HA MET 50 HA MET 50 3.664 -11.061 -5.785 397 HB2 MET 50 2HB MET 50 3.531 -9.110 -3.487 398 HB3 MET 50 1HB MET 50 3.870 -10.816 -3.199 399 HG2 MET 50 2HG MET 50 5.650 -10.497 -5.106 400 HG3 MET 50 1HG MET 50 5.510 -8.789 -4.688 401 HE1 MET 50 3HE MET 50 4.610 -9.893 -1.373 402 HE2 MET 50 1HE MET 50 4.995 -8.330 -2.109 403 HE3 MET 50 2HE MET 50 5.999 -8.969 -0.807 404 H ALA 51 H ALA 51 0.907 -9.256 -4.492 405 HA ALA 51 HA ALA 51 -0.391 -11.718 -3.491 406 HB1 ALA 51 1HB ALA 51 -0.850 -8.757 -3.439 407 HB2 ALA 51 2HB ALA 51 -0.823 -9.906 -2.100 408 HB3 ALA 51 3HB ALA 51 -2.230 -9.819 -3.162 409 H GLY 52 H GLY 52 -0.063 -10.195 -6.470 410 HA2 GLY 52 2HA GLY 52 -2.802 -10.733 -7.394 411 HA3 GLY 52 1HA GLY 52 -1.494 -10.066 -8.370 412 H THR 53 H THR 53 -1.216 -12.997 -6.436 413 HA THR 53 HA THR 53 -1.834 -14.927 -8.391 414 HB THR 53 HB THR 53 0.373 -13.340 -9.063 415 HG1 THR 53 1HG THR 53 0.629 -15.061 -10.670 416 HG21 THR 53 3HG2 THR 53 1.742 -14.596 -7.418 417 HG22 THR 53 1HG2 THR 53 2.283 -14.869 -9.075 418 HG23 THR 53 2HG2 THR 53 1.327 -16.098 -8.245 419 H MET 54 H MET 54 0.290 -13.940 -5.867 420 HA MET 54 HA MET 54 0.312 -16.693 -4.706 421 HB2 MET 54 2HB MET 54 2.078 -14.277 -4.621 422 HB3 MET 54 1HB MET 54 2.183 -15.471 -3.329 423 HG2 MET 54 2HG MET 54 2.207 -16.487 -6.135 424 HG3 MET 54 1HG MET 54 3.663 -15.676 -5.556 425 HE1 MET 54 3HE MET 54 3.535 -16.481 -2.305 426 HE2 MET 54 1HE MET 54 4.783 -16.079 -3.493 427 HE3 MET 54 2HE MET 54 4.871 -17.593 -2.594 428 H GLY 55 H GLY 55 -0.946 -13.572 -4.413 429 HA2 GLY 55 2HA GLY 55 -1.913 -14.166 -1.643 430 HA3 GLY 55 1HA GLY 55 -1.460 -12.529 -2.137 431 H PHE 56 H PHE 56 -2.709 -14.084 -4.769 432 HA PHE 56 HA PHE 56 -4.813 -14.062 -5.849 433 HB2 PHE 56 2HB PHE 56 -5.313 -14.318 -3.032 434 HB3 PHE 56 1HB PHE 56 -6.518 -13.229 -3.720 435 HD1 PHE 56 1HD PHE 56 -7.854 -13.973 -5.729 436 HD2 PHE 56 2HD PHE 56 -5.347 -16.650 -3.494 437 HE1 PHE 56 1HE PHE 56 -9.034 -15.913 -6.729 438 HE2 PHE 56 2HE PHE 56 -6.526 -18.589 -4.492 439 HZ PHE 56 HZ PHE 56 -8.370 -18.221 -6.109 440 H SER 57 H SER 57 -5.243 -12.366 -7.169 441 HA SER 57 HA SER 57 -4.570 -9.679 -6.633 442 HB2 SER 57 2HB SER 57 -6.707 -10.657 -8.525 443 HB3 SER 57 1HB SER 57 -5.665 -9.249 -8.721 444 HG SER 57 HG SER 57 -4.927 -11.046 -9.936 445 H SER 58 H SER 58 -7.225 -11.479 -5.523 446 HA SER 58 HA SER 58 -9.255 -9.488 -5.334 447 HB2 SER 58 2HB SER 58 -8.837 -12.149 -4.574 448 HB3 SER 58 1HB SER 58 -9.056 -11.302 -3.046 449 HG SER 58 HG SER 58 -10.954 -10.340 -4.085 450 H MET 59 H MET 59 -6.499 -10.348 -3.312 451 HA MET 59 HA MET 59 -7.048 -8.069 -1.490 452 HB2 MET 59 2HB MET 59 -6.552 -10.265 -0.532 453 HB3 MET 59 1HB MET 59 -5.068 -10.376 -1.481 454 HG2 MET 59 2HG MET 59 -4.550 -8.061 -0.263 455 HG3 MET 59 1HG MET 59 -5.661 -8.719 0.938 456 HE1 MET 59 3HE MET 59 -2.892 -9.439 -1.416 457 HE2 MET 59 1HE MET 59 -3.301 -11.156 -1.310 458 HE3 MET 59 2HE MET 59 -1.791 -10.565 -0.625 459 H ALA 60 H ALA 60 -5.008 -9.096 -4.114 460 HA ALA 60 HA ALA 60 -2.924 -7.084 -3.630 461 HB1 ALA 60 1HB ALA 60 -3.322 -9.455 -5.163 462 HB2 ALA 60 2HB ALA 60 -1.838 -8.516 -5.006 463 HB3 ALA 60 3HB ALA 60 -2.977 -8.156 -6.304 464 H LYS 61 H LYS 61 -5.907 -7.372 -5.502 465 HA LYS 61 HA LYS 61 -5.396 -5.013 -7.141 466 HB2 LYS 61 2HB LYS 61 -6.950 -6.888 -7.717 467 HB3 LYS 61 1HB LYS 61 -7.965 -6.436 -6.345 468 HG2 LYS 61 2HG LYS 61 -7.383 -4.125 -7.990 469 HG3 LYS 61 1HG LYS 61 -8.118 -5.409 -8.954 470 HD2 LYS 61 2HD LYS 61 -9.223 -4.565 -6.276 471 HD3 LYS 61 1HD LYS 61 -9.741 -3.812 -7.786 472 HE2 LYS 61 2HE LYS 61 -9.788 -6.817 -7.425 473 HE3 LYS 61 1HE LYS 61 -11.166 -5.796 -6.964 474 HZ1 LYS 61 3HZ LYS 61 -11.525 -5.133 -9.102 475 HZ2 LYS 61 1HZ LYS 61 -10.911 -6.682 -9.414 476 HZ3 LYS 61 2HZ LYS 61 -9.902 -5.322 -9.564 477 H LEU 62 H LEU 62 -6.434 -5.717 -3.938 478 HA LEU 62 HA LEU 62 -7.809 -3.222 -3.376 479 HB2 LEU 62 2HB LEU 62 -8.216 -5.267 -2.111 480 HB3 LEU 62 1HB LEU 62 -6.502 -5.407 -1.716 481 HG LEU 62 HG LEU 62 -6.645 -3.243 -0.492 482 HD11 LEU 62 1HD1 LEU 62 -8.656 -2.076 -0.225 483 HD12 LEU 62 2HD1 LEU 62 -9.639 -3.481 -0.637 484 HD13 LEU 62 3HD1 LEU 62 -8.768 -2.613 -1.900 485 HD21 LEU 62 3HD2 LEU 62 -7.187 -5.646 0.465 486 HD22 LEU 62 1HD2 LEU 62 -8.821 -4.996 0.610 487 HD23 LEU 62 2HD2 LEU 62 -7.482 -4.219 1.456 488 H CYS 63 H CYS 63 -4.516 -4.502 -3.133 489 HA CYS 63 HA CYS 63 -3.411 -2.223 -1.704 490 HB2 CYS 63 2HB CYS 63 -2.384 -4.600 -3.246 491 HB3 CYS 63 1HB CYS 63 -1.264 -3.361 -2.680 492 HG CYS 63 HG CYS 63 -2.156 -5.509 -0.947 493 H HIS 64 H HIS 64 -3.693 -3.169 -5.135 494 HA HIS 64 HA HIS 64 -2.048 -1.139 -6.267 495 HB2 HIS 64 2HB HIS 64 -2.834 -2.911 -7.654 496 HB3 HIS 64 1HB HIS 64 -4.506 -2.659 -7.166 497 HD1 HIS 64 1HD HIS 64 -1.751 -0.756 -9.005 498 HD2 HIS 64 2HD HIS 64 -5.909 -1.063 -8.937 499 HE1 HIS 64 1HE HIS 64 -2.612 0.714 -10.881 500 H THR 65 H THR 65 -5.459 -1.172 -5.303 501 HA THR 65 HA THR 65 -6.180 1.399 -6.257 502 HB THR 65 HB THR 65 -7.334 -0.712 -4.899 503 HG1 THR 65 1HG THR 65 -8.415 0.610 -6.326 504 HG21 THR 65 3HG2 THR 65 -6.680 0.099 -2.708 505 HG22 THR 65 1HG2 THR 65 -8.412 0.335 -2.901 506 HG23 THR 65 2HG2 THR 65 -7.313 1.703 -3.070 507 H LEU 66 H LEU 66 -4.918 0.428 -3.052 508 HA LEU 66 HA LEU 66 -4.786 2.970 -1.783 509 HB2 LEU 66 2HB LEU 66 -2.764 0.693 -1.711 510 HB3 LEU 66 1HB LEU 66 -3.052 1.879 -0.442 511 HG LEU 66 HG LEU 66 -4.847 -0.370 -1.350 512 HD11 LEU 66 1HD1 LEU 66 -3.175 0.252 0.943 513 HD12 LEU 66 2HD1 LEU 66 -3.954 -1.271 0.515 514 HD13 LEU 66 3HD1 LEU 66 -4.840 -0.056 1.435 515 HD21 LEU 66 3HD2 LEU 66 -6.399 1.421 -1.271 516 HD22 LEU 66 1HD2 LEU 66 -5.576 2.185 0.084 517 HD23 LEU 66 2HD2 LEU 66 -6.495 0.705 0.336 518 H GLU 67 H GLU 67 -2.378 1.274 -3.794 519 HA GLU 67 HA GLU 67 -0.438 3.371 -3.918 520 HB2 GLU 67 2HB GLU 67 0.222 1.174 -4.487 521 HB3 GLU 67 1HB GLU 67 -1.182 0.931 -5.525 522 HG2 GLU 67 2HG GLU 67 0.591 3.159 -6.327 523 HG3 GLU 67 1HG GLU 67 1.311 1.554 -6.453 524 H ASN 68 H ASN 68 -3.422 2.777 -5.641 525 HA ASN 68 HA ASN 68 -2.968 4.420 -7.945 526 HB2 ASN 68 2HB ASN 68 -4.995 2.879 -6.743 527 HB3 ASN 68 1HB ASN 68 -5.654 4.508 -6.883 528 HD21 ASN 68 1HD2 ASN 68 -4.528 1.718 -8.732 529 HD22 ASN 68 2HD2 ASN 68 -5.017 2.295 -10.250 530 H ILE 69 H ILE 69 -4.294 5.018 -4.720 531 HA ILE 69 HA ILE 69 -4.864 7.789 -5.103 532 HB ILE 69 HB ILE 69 -4.318 5.963 -2.765 533 HG12 ILE 69 2HG1 ILE 69 -6.755 6.640 -2.329 534 HG13 ILE 69 1HG1 ILE 69 -6.720 7.342 -3.943 535 HG21 ILE 69 1HG2 ILE 69 -4.133 8.847 -2.778 536 HG22 ILE 69 2HG2 ILE 69 -3.860 7.731 -1.447 537 HG23 ILE 69 3HG2 ILE 69 -5.484 8.332 -1.776 538 HD11 ILE 69 3HD1 ILE 69 -5.986 4.479 -3.339 539 HD12 ILE 69 1HD1 ILE 69 -6.170 5.216 -4.933 540 HD13 ILE 69 2HD1 ILE 69 -7.580 4.990 -3.895 541 H LEU 70 H LEU 70 -2.192 5.963 -3.937 542 HA LEU 70 HA LEU 70 -0.432 8.151 -3.313 543 HB2 LEU 70 2HB LEU 70 0.205 5.312 -4.175 544 HB3 LEU 70 1HB LEU 70 1.297 6.396 -3.316 545 HG LEU 70 HG LEU 70 -1.079 4.902 -2.299 546 HD11 LEU 70 1HD1 LEU 70 1.185 5.762 -0.596 547 HD12 LEU 70 2HD1 LEU 70 1.575 4.659 -1.917 548 HD13 LEU 70 3HD1 LEU 70 0.386 4.194 -0.700 549 HD21 LEU 70 3HD2 LEU 70 -1.848 7.128 -1.819 550 HD22 LEU 70 1HD2 LEU 70 -0.233 7.644 -1.331 551 HD23 LEU 70 2HD2 LEU 70 -1.139 6.515 -0.325 552 H ASP 71 H ASP 71 -1.546 6.731 -6.206 553 HA ASP 71 HA ASP 71 0.677 7.680 -7.868 554 HB2 ASP 71 2HB ASP 71 -0.909 5.682 -8.273 555 HB3 ASP 71 1HB ASP 71 -2.117 6.882 -8.733 556 H LYS 72 H LYS 72 -2.775 8.582 -7.432 557 HA LYS 72 HA LYS 72 -2.546 11.036 -8.900 558 HB2 LYS 72 2HB LYS 72 -4.694 11.502 -7.544 559 HB3 LYS 72 1HB LYS 72 -4.705 10.078 -8.582 560 HG2 LYS 72 2HG LYS 72 -4.376 8.608 -6.748 561 HG3 LYS 72 1HG LYS 72 -3.897 9.931 -5.686 562 HD2 LYS 72 2HD LYS 72 -6.318 10.776 -6.501 563 HD3 LYS 72 1HD LYS 72 -6.552 9.025 -6.501 564 HE2 LYS 72 2HE LYS 72 -5.341 9.198 -4.129 565 HE3 LYS 72 1HE LYS 72 -5.978 10.855 -4.199 566 HZ1 LYS 72 3HZ LYS 72 -8.138 10.135 -4.361 567 HZ2 LYS 72 1HZ LYS 72 -7.495 8.950 -3.331 568 HZ3 LYS 72 2HZ LYS 72 -7.709 8.612 -4.982 569 H ALA 73 H ALA 73 -1.744 10.034 -5.720 570 HA ALA 73 HA ALA 73 -1.551 12.594 -4.422 571 HB1 ALA 73 1HB ALA 73 -1.560 10.247 -3.423 572 HB2 ALA 73 2HB ALA 73 -0.305 11.310 -2.790 573 HB3 ALA 73 3HB ALA 73 0.098 10.085 -3.996 574 H ARG 74 H ARG 74 0.689 10.563 -6.293 575 HA ARG 74 HA ARG 74 2.843 12.573 -6.100 576 HB2 ARG 74 2HB ARG 74 4.133 10.869 -7.258 577 HB3 ARG 74 1HB ARG 74 3.166 10.065 -6.021 578 HG2 ARG 74 2HG ARG 74 1.607 9.253 -7.606 579 HG3 ARG 74 1HG ARG 74 2.165 10.367 -8.854 580 HD2 ARG 74 2HD ARG 74 4.235 8.529 -7.772 581 HD3 ARG 74 1HD ARG 74 2.963 7.775 -8.754 582 HE ARG 74 HE ARG 74 5.029 9.458 -9.794 583 HH11 ARG 74 1HH2 ARG 74 1.732 8.537 -10.081 584 HH12 ARG 74 2HH2 ARG 74 1.501 9.319 -11.609 585 HH21 ARG 74 1HH1 ARG 74 4.703 10.653 -11.708 586 HH22 ARG 74 2HH1 ARG 74 3.183 10.521 -12.529 587 H ASN 75 H ASN 75 0.219 11.733 -8.184 588 HA ASN 75 HA ASN 75 1.345 12.953 -10.607 589 HB2 ASN 75 2HB ASN 75 -0.923 11.353 -9.777 590 HB3 ASN 75 1HB ASN 75 -1.462 12.705 -10.773 591 HD21 ASN 75 1HD2 ASN 75 0.124 13.044 -12.802 592 HD22 ASN 75 2HD2 ASN 75 0.532 11.617 -13.627 593 H SER 76 H SER 76 0.394 14.262 -7.760 594 HA SER 76 HA SER 76 -0.037 16.515 -7.186 595 HB2 SER 76 2HB SER 76 0.606 18.007 -8.783 596 HB3 SER 76 1HB SER 76 1.011 16.578 -9.729 597 HG SER 76 HG SER 76 -1.172 18.308 -9.909 598 H GLU 77 H GLU 77 -2.183 14.371 -7.765 599 HA GLU 77 HA GLU 77 -4.424 16.207 -8.444 600 HB2 GLU 77 2HB GLU 77 -5.030 13.360 -8.061 601 HB3 GLU 77 1HB GLU 77 -5.411 14.400 -9.429 602 HG2 GLU 77 2HG GLU 77 -2.852 14.207 -9.954 603 HG3 GLU 77 1HG GLU 77 -2.933 12.786 -8.915 604 H ILE 78 H ILE 78 -3.022 14.270 -5.953 605 HA ILE 78 HA ILE 78 -4.984 15.411 -4.007 606 HB ILE 78 HB ILE 78 -5.396 13.083 -3.190 607 HG12 ILE 78 2HG1 ILE 78 -4.656 11.569 -5.362 608 HG13 ILE 78 1HG1 ILE 78 -3.275 12.625 -5.120 609 HG21 ILE 78 1HG2 ILE 78 -5.968 13.263 -6.152 610 HG22 ILE 78 2HG2 ILE 78 -6.813 14.282 -4.985 611 HG23 ILE 78 3HG2 ILE 78 -6.964 12.526 -4.896 612 HD11 ILE 78 3HD1 ILE 78 -4.436 11.504 -2.650 613 HD12 ILE 78 1HD1 ILE 78 -2.747 11.694 -3.114 614 HD13 ILE 78 2HD1 ILE 78 -3.680 10.327 -3.718 615 H LYS 79 H LYS 79 -4.384 14.368 -1.735 616 HA LYS 79 HA LYS 79 -1.502 13.844 -1.368 617 HB2 LYS 79 2HB LYS 79 -1.328 15.802 0.162 618 HB3 LYS 79 1HB LYS 79 -1.715 16.295 -1.487 619 HG2 LYS 79 2HG LYS 79 -3.719 17.130 -0.868 620 HG3 LYS 79 1HG LYS 79 -4.107 15.688 0.072 621 HD2 LYS 79 2HD LYS 79 -1.996 17.402 1.214 622 HD3 LYS 79 1HD LYS 79 -3.608 18.116 1.184 623 HE2 LYS 79 2HE LYS 79 -4.454 16.587 2.695 624 HE3 LYS 79 1HE LYS 79 -3.388 15.288 2.122 625 HZ1 LYS 79 3HZ LYS 79 -1.547 16.898 2.982 626 HZ2 LYS 79 1HZ LYS 79 -2.340 15.858 4.061 627 HZ3 LYS 79 2HZ LYS 79 -2.797 17.492 3.969 628 H ILE 80 H ILE 80 -1.090 13.124 0.905 629 HA ILE 80 HA ILE 80 -3.324 11.573 1.946 630 HB ILE 80 HB ILE 80 -0.508 12.187 2.812 631 HG12 ILE 80 2HG1 ILE 80 -0.163 9.838 2.261 632 HG13 ILE 80 1HG1 ILE 80 -1.892 9.620 2.011 633 HG21 ILE 80 1HG2 ILE 80 -1.364 10.033 4.339 634 HG22 ILE 80 2HG2 ILE 80 -2.720 11.158 4.416 635 HG23 ILE 80 3HG2 ILE 80 -1.119 11.674 4.932 636 HD11 ILE 80 3HD1 ILE 80 -1.866 11.077 0.085 637 HD12 ILE 80 1HD1 ILE 80 -0.584 9.884 -0.122 638 HD13 ILE 80 2HD1 ILE 80 -0.187 11.525 0.390 639 H THR 81 H THR 81 -4.900 12.860 2.594 640 HA THR 81 HA THR 81 -4.506 15.176 4.372 641 HB THR 81 HB THR 81 -6.898 15.415 4.072 642 HG1 THR 81 1HG THR 81 -6.890 12.850 2.885 643 HG21 THR 81 3HG2 THR 81 -6.312 16.142 2.016 644 HG22 THR 81 1HG2 THR 81 -6.853 14.570 1.429 645 HG23 THR 81 2HG2 THR 81 -5.151 14.832 1.802 646 H SER 82 H SER 82 -3.692 12.456 5.342 647 HA SER 82 HA SER 82 -3.782 11.353 7.437 648 HB2 SER 82 2HB SER 82 -4.508 13.818 8.038 649 HB3 SER 82 1HB SER 82 -6.114 13.106 8.177 650 HG SER 82 HG SER 82 -3.806 12.063 9.455 651 H ASP 83 H ASP 83 -7.042 12.271 6.254 652 HA ASP 83 HA ASP 83 -8.223 9.738 7.084 653 HB2 ASP 83 2HB ASP 83 -9.046 12.202 5.570 654 HB3 ASP 83 1HB ASP 83 -10.127 10.816 5.692 655 H LEU 84 H LEU 84 -7.185 11.194 3.951 656 HA LEU 84 HA LEU 84 -8.269 9.115 2.296 657 HB2 LEU 84 2HB LEU 84 -7.584 11.218 1.349 658 HB3 LEU 84 1HB LEU 84 -5.969 11.077 2.049 659 HG LEU 84 HG LEU 84 -5.459 9.188 0.618 660 HD11 LEU 84 1HD1 LEU 84 -8.371 9.454 -0.136 661 HD12 LEU 84 2HD1 LEU 84 -7.520 8.026 0.452 662 HD13 LEU 84 3HD1 LEU 84 -7.223 8.619 -1.181 663 HD21 LEU 84 3HD2 LEU 84 -5.698 11.764 -0.240 664 HD22 LEU 84 1HD2 LEU 84 -6.736 10.938 -1.404 665 HD23 LEU 84 2HD2 LEU 84 -5.047 10.462 -1.235 666 H LEU 85 H LEU 85 -5.433 9.397 4.278 667 HA LEU 85 HA LEU 85 -4.226 6.945 3.135 668 HB2 LEU 85 2HB LEU 85 -2.322 7.896 3.935 669 HB3 LEU 85 1HB LEU 85 -3.309 9.310 4.276 670 HG LEU 85 HG LEU 85 -3.858 8.009 6.502 671 HD11 LEU 85 1HD1 LEU 85 -2.773 5.979 6.389 672 HD12 LEU 85 2HD1 LEU 85 -1.471 6.940 7.090 673 HD13 LEU 85 3HD1 LEU 85 -1.486 6.608 5.359 674 HD21 LEU 85 3HD2 LEU 85 -2.042 9.214 7.589 675 HD22 LEU 85 1HD2 LEU 85 -2.665 10.198 6.266 676 HD23 LEU 85 2HD2 LEU 85 -1.154 9.310 6.068 677 H ASP 86 H ASP 86 -5.953 8.069 5.993 678 HA ASP 86 HA ASP 86 -5.591 5.757 7.656 679 HB2 ASP 86 2HB ASP 86 -7.177 8.205 7.517 680 HB3 ASP 86 1HB ASP 86 -8.113 6.866 8.183 681 H LYS 87 H LYS 87 -7.576 6.397 4.870 682 HA LYS 87 HA LYS 87 -9.353 4.084 5.329 683 HB2 LYS 87 2HB LYS 87 -8.946 6.072 3.067 684 HB3 LYS 87 1HB LYS 87 -10.196 4.827 3.068 685 HG2 LYS 87 2HG LYS 87 -9.921 7.194 4.922 686 HG3 LYS 87 1HG LYS 87 -11.280 6.778 3.880 687 HD2 LYS 87 2HD LYS 87 -10.363 5.278 6.346 688 HD3 LYS 87 1HD LYS 87 -11.855 6.203 6.168 689 HE2 LYS 87 2HE LYS 87 -12.066 4.495 4.038 690 HE3 LYS 87 1HE LYS 87 -11.219 3.471 5.214 691 HZ1 LYS 87 3HZ LYS 87 -13.354 5.126 6.281 692 HZ2 LYS 87 1HZ LYS 87 -12.942 3.521 6.646 693 HZ3 LYS 87 2HZ LYS 87 -13.856 3.869 5.256 694 H ILE 88 H ILE 88 -6.850 5.123 2.998 695 HA ILE 88 HA ILE 88 -6.614 2.629 1.609 696 HB ILE 88 HB ILE 88 -4.793 4.963 2.193 697 HG12 ILE 88 2HG1 ILE 88 -5.553 4.186 -0.549 698 HG13 ILE 88 1HG1 ILE 88 -6.866 4.752 0.486 699 HG21 ILE 88 1HG2 ILE 88 -4.038 2.335 1.278 700 HG22 ILE 88 2HG2 ILE 88 -3.020 3.715 1.691 701 HG23 ILE 88 3HG2 ILE 88 -3.685 3.564 0.063 702 HD11 ILE 88 3HD1 ILE 88 -4.651 6.262 -0.686 703 HD12 ILE 88 1HD1 ILE 88 -4.813 6.530 1.053 704 HD13 ILE 88 2HD1 ILE 88 -6.177 6.845 -0.024 705 H PHE 89 H PHE 89 -5.315 3.881 4.626 706 HA PHE 89 HA PHE 89 -3.438 1.745 5.134 707 HB2 PHE 89 2HB PHE 89 -3.304 3.969 6.177 708 HB3 PHE 89 1HB PHE 89 -4.878 3.717 6.935 709 HD1 PHE 89 2HD PHE 89 -5.156 2.046 8.740 710 HD2 PHE 89 1HD PHE 89 -1.308 2.899 7.033 711 HE1 PHE 89 2HE PHE 89 -4.056 0.923 10.658 712 HE2 PHE 89 1HE PHE 89 -0.207 1.777 8.952 713 HZ PHE 89 HZ PHE 89 -1.581 0.789 10.765 714 H ALA 90 H ALA 90 -6.808 2.255 5.608 715 HA ALA 90 HA ALA 90 -7.278 0.023 7.426 716 HB1 ALA 90 1HB ALA 90 -9.207 1.220 7.558 717 HB2 ALA 90 2HB ALA 90 -9.595 0.719 5.912 718 HB3 ALA 90 3HB ALA 90 -8.701 2.213 6.191 719 H GLY 91 H GLY 91 -7.271 0.656 3.970 720 HA2 GLY 91 2HA GLY 91 -8.332 -1.898 3.147 721 HA3 GLY 91 1HA GLY 91 -7.395 -0.794 2.128 722 H VAL 92 H VAL 92 -5.115 -0.573 3.773 723 HA VAL 92 HA VAL 92 -3.633 -2.956 3.046 724 HB VAL 92 HB VAL 92 -3.210 -0.322 4.381 725 HG11 VAL 92 1HG1 VAL 92 -0.766 -1.232 4.857 726 HG12 VAL 92 2HG1 VAL 92 -1.608 -2.771 5.035 727 HG13 VAL 92 3HG1 VAL 92 -2.037 -1.406 6.067 728 HG21 VAL 92 3HG2 VAL 92 -2.108 0.034 2.454 729 HG22 VAL 92 1HG2 VAL 92 -2.568 -1.588 1.938 730 HG23 VAL 92 2HG2 VAL 92 -1.036 -1.329 2.773 731 H ASP 93 H ASP 93 -5.467 -1.882 5.784 732 HA ASP 93 HA ASP 93 -4.308 -3.699 7.750 733 HB2 ASP 93 2HB ASP 93 -5.341 -1.764 8.612 734 HB3 ASP 93 1HB ASP 93 -6.696 -1.873 7.492 735 H MET 94 H MET 94 -6.762 -3.849 5.277 736 HA MET 94 HA MET 94 -8.066 -6.255 6.309 737 HB2 MET 94 2HB MET 94 -8.182 -4.460 3.927 738 HB3 MET 94 1HB MET 94 -8.792 -6.102 3.712 739 HG2 MET 94 2HG MET 94 -10.663 -5.626 4.870 740 HG3 MET 94 1HG MET 94 -9.719 -5.003 6.225 741 HE1 MET 94 3HE MET 94 -10.591 -4.639 2.765 742 HE2 MET 94 1HE MET 94 -9.921 -3.053 2.355 743 HE3 MET 94 2HE MET 94 -11.642 -3.227 2.693 744 H ILE 95 H ILE 95 -5.734 -5.511 3.680 745 HA ILE 95 HA ILE 95 -5.372 -8.162 2.754 746 HB ILE 95 HB ILE 95 -3.253 -7.170 1.907 747 HG12 ILE 95 2HG1 ILE 95 -4.078 -4.717 3.464 748 HG13 ILE 95 1HG1 ILE 95 -2.811 -5.822 3.994 749 HG21 ILE 95 1HG2 ILE 95 -5.333 -5.046 1.633 750 HG22 ILE 95 2HG2 ILE 95 -5.695 -6.674 1.059 751 HG23 ILE 95 3HG2 ILE 95 -4.327 -5.786 0.389 752 HD11 ILE 95 3HD1 ILE 95 -1.758 -5.443 1.672 753 HD12 ILE 95 1HD1 ILE 95 -1.652 -4.114 2.825 754 HD13 ILE 95 2HD1 ILE 95 -2.855 -4.069 1.537 755 H THR 96 H THR 96 -3.907 -6.352 5.439 756 HA THR 96 HA THR 96 -1.905 -8.295 6.139 757 HB THR 96 HB THR 96 -3.455 -6.212 7.723 758 HG1 THR 96 1HG THR 96 -1.951 -4.893 7.055 759 HG21 THR 96 3HG2 THR 96 -1.657 -6.415 9.401 760 HG22 THR 96 1HG2 THR 96 -0.944 -7.734 8.476 761 HG23 THR 96 2HG2 THR 96 -2.529 -7.937 9.221 762 H ARG 97 H ARG 97 -5.308 -7.791 7.004 763 HA ARG 97 HA ARG 97 -5.405 -10.077 8.829 764 HB2 ARG 97 2HB ARG 97 -7.371 -8.173 7.548 765 HB3 ARG 97 1HB ARG 97 -7.937 -9.547 8.498 766 HG2 ARG 97 2HG ARG 97 -7.189 -8.663 10.478 767 HG3 ARG 97 1HG ARG 97 -5.800 -7.879 9.724 768 HD2 ARG 97 2HD ARG 97 -6.945 -5.925 9.715 769 HD3 ARG 97 1HD ARG 97 -8.166 -6.666 8.660 770 HE ARG 97 HE ARG 97 -8.401 -7.433 11.482 771 HH11 ARG 97 1HH2 ARG 97 -8.692 -4.440 11.363 772 HH12 ARG 97 2HH2 ARG 97 -10.392 -4.258 11.088 773 HH21 ARG 97 1HH1 ARG 97 -10.855 -7.548 10.099 774 HH22 ARG 97 2HH1 ARG 97 -11.616 -6.016 10.371 775 H MET 98 H MET 98 -6.086 -9.425 5.429 776 HA MET 98 HA MET 98 -7.421 -11.937 4.859 777 HB2 MET 98 2HB MET 98 -5.947 -9.865 3.199 778 HB3 MET 98 1HB MET 98 -6.834 -11.215 2.495 779 HG2 MET 98 2HG MET 98 -8.893 -10.345 3.068 780 HG3 MET 98 1HG MET 98 -8.263 -9.519 4.494 781 HE1 MET 98 3HE MET 98 -8.685 -9.111 0.409 782 HE2 MET 98 1HE MET 98 -9.631 -7.697 0.895 783 HE3 MET 98 2HE MET 98 -9.921 -9.259 1.656 784 H VAL 99 H VAL 99 -4.101 -10.766 4.902 785 HA VAL 99 HA VAL 99 -2.994 -13.166 3.686 786 HB VAL 99 HB VAL 99 -2.044 -10.600 4.919 787 HG11 VAL 99 1HG1 VAL 99 -0.587 -12.405 5.886 788 HG12 VAL 99 2HG1 VAL 99 0.286 -11.290 4.835 789 HG13 VAL 99 3HG1 VAL 99 -0.169 -12.888 4.241 790 HG21 VAL 99 3HG2 VAL 99 -1.733 -10.080 2.751 791 HG22 VAL 99 1HG2 VAL 99 -2.469 -11.627 2.328 792 HG23 VAL 99 2HG2 VAL 99 -0.719 -11.504 2.510 793 H ASP 100 H ASP 100 -3.484 -11.908 6.979 794 HA ASP 100 HA ASP 100 -1.944 -13.921 8.360 795 HB2 ASP 100 2HB ASP 100 -4.086 -11.919 8.952 796 HB3 ASP 100 1HB ASP 100 -3.863 -13.212 10.129 797 H LYS 101 H LYS 101 -5.230 -13.709 7.136 798 HA LYS 101 HA LYS 101 -6.084 -16.265 8.251 799 HB2 LYS 101 2HB LYS 101 -8.122 -15.552 7.441 800 HB3 LYS 101 1HB LYS 101 -7.293 -14.004 7.282 801 HG2 LYS 101 2HG LYS 101 -8.174 -14.296 5.133 802 HG3 LYS 101 1HG LYS 101 -6.549 -14.963 4.961 803 HD2 LYS 101 2HD LYS 101 -7.769 -16.674 4.062 804 HD3 LYS 101 1HD LYS 101 -7.709 -17.181 5.743 805 HE2 LYS 101 2HE LYS 101 -9.928 -15.465 5.615 806 HE3 LYS 101 1HE LYS 101 -10.042 -16.469 4.158 807 HZ1 LYS 101 3HZ LYS 101 -11.027 -17.625 6.025 808 HZ2 LYS 101 1HZ LYS 101 -9.603 -17.446 6.931 809 HZ3 LYS 101 2HZ LYS 101 -9.608 -18.426 5.542 810 H ILE 102 H ILE 102 -4.407 -15.088 5.461 811 HA ILE 102 HA ILE 102 -4.802 -17.357 3.701 812 HB ILE 102 HB ILE 102 -3.233 -14.872 3.931 813 HG12 ILE 102 2HG1 ILE 102 -4.168 -16.140 1.385 814 HG13 ILE 102 1HG1 ILE 102 -5.353 -15.516 2.529 815 HG21 ILE 102 1HG2 ILE 102 -2.220 -17.046 2.096 816 HG22 ILE 102 2HG2 ILE 102 -1.433 -16.589 3.608 817 HG23 ILE 102 3HG2 ILE 102 -1.560 -15.422 2.292 818 HD11 ILE 102 3HD1 ILE 102 -3.063 -13.730 1.918 819 HD12 ILE 102 1HD1 ILE 102 -4.763 -13.335 2.173 820 HD13 ILE 102 2HD1 ILE 102 -4.229 -13.977 0.620 821 H VAL 103 H VAL 103 -2.233 -16.286 5.912 822 HA VAL 103 HA VAL 103 -0.526 -18.565 5.670 823 HB VAL 103 HB VAL 103 -1.127 -16.485 7.789 824 HG11 VAL 103 1HG1 VAL 103 0.686 -17.276 9.125 825 HG12 VAL 103 2HG1 VAL 103 1.221 -18.392 7.868 826 HG13 VAL 103 3HG1 VAL 103 -0.273 -18.708 8.750 827 HG21 VAL 103 3HG2 VAL 103 0.466 -15.264 6.736 828 HG22 VAL 103 1HG2 VAL 103 0.304 -16.411 5.407 829 HG23 VAL 103 2HG2 VAL 103 1.558 -16.645 6.624 830 H SER 104 H SER 104 -3.451 -17.847 7.450 831 HA SER 104 HA SER 104 -3.379 -20.246 9.115 832 HB2 SER 104 2HB SER 104 -5.139 -17.903 8.617 833 HB3 SER 104 1HB SER 104 -5.886 -19.329 9.330 834 HG SER 104 HG SER 104 -3.863 -19.179 10.752 835 H GLU 105 H GLU 105 -5.571 -19.106 6.601 836 HA GLU 105 HA GLU 105 -6.295 -21.953 5.985 837 HB2 GLU 105 2HB GLU 105 -7.754 -19.452 5.118 838 HB3 GLU 105 1HB GLU 105 -8.402 -21.081 5.317 839 HG2 GLU 105 2HG GLU 105 -7.347 -20.420 7.829 840 HG3 GLU 105 1HG GLU 105 -8.154 -18.951 7.277 841 H GLY 106 H GLY 106 -5.413 -18.848 4.510 842 HA2 GLY 106 2HA GLY 106 -3.846 -18.821 2.603 843 HA3 GLY 106 1HA GLY 106 -4.560 -20.342 2.067 844 H SER 107 H SER 107 -6.611 -17.790 3.264 845 HA SER 107 HA SER 107 -7.535 -17.281 0.445 846 HB2 SER 107 2HB SER 107 -9.037 -17.555 3.047 847 HB3 SER 107 1HB SER 107 -9.767 -16.926 1.574 848 HG SER 107 HG SER 107 -10.025 -18.931 1.029 849 H ASP 108 H ASP 108 -7.285 -15.237 -0.180 850 HA ASP 108 HA ASP 108 -6.686 -13.121 1.786 851 HB2 ASP 108 2HB ASP 108 -5.951 -11.939 -0.130 852 HB3 ASP 108 1HB ASP 108 -5.621 -13.614 -0.551 853 H ASP 109 H ASP 109 -9.457 -14.549 0.816 854 HA ASP 109 HA ASP 109 -11.033 -12.035 0.478 855 HB2 ASP 109 2HB ASP 109 -11.094 -14.313 -0.900 856 HB3 ASP 109 1HB ASP 109 -12.172 -14.807 0.405 857 H ILE 110 H ILE 110 -11.206 -11.236 2.625 858 HA ILE 110 HA ILE 110 -12.211 -13.106 4.716 859 HB ILE 110 HB ILE 110 -11.558 -11.278 6.235 860 HG12 ILE 110 2HG1 ILE 110 -10.725 -9.790 3.726 861 HG13 ILE 110 1HG1 ILE 110 -12.204 -9.446 4.623 862 HG21 ILE 110 1HG2 ILE 110 -9.109 -11.177 5.580 863 HG22 ILE 110 2HG2 ILE 110 -9.549 -12.011 4.089 864 HG23 ILE 110 3HG2 ILE 110 -9.792 -12.803 5.647 865 HD11 ILE 110 3HD1 ILE 110 -9.524 -9.486 6.005 866 HD12 ILE 110 1HD1 ILE 110 -11.021 -8.716 6.531 867 HD13 ILE 110 2HD1 ILE 110 -10.105 -8.036 5.186 868 H GLY 111 H GLY 111 -13.878 -12.027 2.456 869 HA2 GLY 111 2HA GLY 111 -16.194 -11.529 2.377 870 HA3 GLY 111 1HA GLY 111 -16.148 -11.171 4.102 871 H GLU 112 H GLU 112 -13.624 -9.447 3.112 872 HA GLU 112 HA GLU 112 -15.068 -6.930 3.172 873 HB2 GLU 112 2HB GLU 112 -12.214 -7.806 2.698 874 HB3 GLU 112 1HB GLU 112 -12.681 -6.104 2.651 875 HG2 GLU 112 2HG GLU 112 -13.642 -7.679 4.984 876 HG3 GLU 112 1HG GLU 112 -11.914 -7.331 4.926 877 H ASN 113 H ASN 113 -15.012 -5.312 1.430 878 HA ASN 113 HA ASN 113 -15.369 -6.543 -1.247 879 HB2 ASN 113 2HB ASN 113 -15.850 -3.696 -0.348 880 HB3 ASN 113 1HB ASN 113 -16.594 -4.540 -1.705 881 HD21 ASN 113 1HD2 ASN 113 -17.755 -3.325 0.914 882 HD22 ASN 113 2HD2 ASN 113 -18.715 -4.579 1.535 883 H ILE 114 H ILE 114 -14.125 -5.921 -3.055 884 HA ILE 114 HA ILE 114 -11.673 -4.324 -2.412 885 HB ILE 114 HB ILE 114 -12.145 -6.423 -4.552 886 HG12 ILE 114 2HG1 ILE 114 -12.288 -7.550 -2.451 887 HG13 ILE 114 1HG1 ILE 114 -10.635 -7.798 -3.013 888 HG21 ILE 114 1HG2 ILE 114 -10.224 -4.474 -4.442 889 HG22 ILE 114 2HG2 ILE 114 -10.014 -6.037 -5.238 890 HG23 ILE 114 3HG2 ILE 114 -9.427 -5.801 -3.591 891 HD11 ILE 114 3HD1 ILE 114 -11.479 -5.601 -1.106 892 HD12 ILE 114 1HD1 ILE 114 -9.829 -6.004 -1.587 893 HD13 ILE 114 2HD1 ILE 114 -10.762 -7.131 -0.604 894 H ASP 115 H ASP 115 -13.083 -5.239 -5.564 895 HA ASP 115 HA ASP 115 -12.503 -2.910 -6.945 896 HB2 ASP 115 2HB ASP 115 -14.060 -5.205 -7.290 897 HB3 ASP 115 1HB ASP 115 -15.202 -3.877 -7.502 898 H VAL 116 H VAL 116 -14.846 -3.456 -4.508 899 HA VAL 116 HA VAL 116 -16.245 -0.911 -4.885 900 HB VAL 116 HB VAL 116 -16.372 -3.237 -2.972 901 HG11 VAL 116 1HG1 VAL 116 -18.216 -0.824 -3.030 902 HG12 VAL 116 2HG1 VAL 116 -16.948 -1.073 -1.830 903 HG13 VAL 116 3HG1 VAL 116 -18.305 -2.195 -1.924 904 HG21 VAL 116 3HG2 VAL 116 -17.257 -3.328 -5.402 905 HG22 VAL 116 1HG2 VAL 116 -18.514 -2.220 -4.852 906 HG23 VAL 116 2HG2 VAL 116 -18.367 -3.820 -4.122 907 H PHE 117 H PHE 117 -14.396 -2.446 -2.298 908 HA PHE 117 HA PHE 117 -14.208 -0.059 -0.690 909 HB2 PHE 117 2HB PHE 117 -13.887 -2.534 -0.077 910 HB3 PHE 117 1HB PHE 117 -12.260 -2.373 -0.741 911 HD1 PHE 117 1HD PHE 117 -10.738 -0.548 0.196 912 HD2 PHE 117 2HD PHE 117 -14.394 -1.757 2.097 913 HE1 PHE 117 1HE PHE 117 -9.974 0.481 2.318 914 HE2 PHE 117 2HE PHE 117 -13.631 -0.728 4.222 915 HZ PHE 117 HZ PHE 117 -11.421 0.393 4.332 916 H SER 118 H SER 118 -12.413 -1.208 -3.455 917 HA SER 118 HA SER 118 -10.204 0.663 -2.991 918 HB2 SER 118 2HB SER 118 -9.129 -0.968 -4.143 919 HB3 SER 118 1HB SER 118 -10.657 -1.816 -4.342 920 HG SER 118 HG SER 118 -9.417 -1.032 -6.292 921 H ASP 119 H ASP 119 -13.151 0.377 -4.711 922 HA ASP 119 HA ASP 119 -12.530 2.626 -6.512 923 HB2 ASP 119 2HB ASP 119 -13.729 0.669 -7.384 924 HB3 ASP 119 1HB ASP 119 -14.977 0.886 -6.156 925 H THR 120 H THR 120 -14.472 1.841 -3.756 926 HA THR 120 HA THR 120 -15.966 4.292 -3.635 927 HB THR 120 HB THR 120 -15.248 2.040 -1.783 928 HG1 THR 120 1HG THR 120 -17.023 2.222 -3.489 929 HG21 THR 120 3HG2 THR 120 -16.497 4.676 -1.055 930 HG22 THR 120 1HG2 THR 120 -15.272 3.752 -0.187 931 HG23 THR 120 2HG2 THR 120 -16.948 3.206 -0.191 932 H ILE 121 H ILE 121 -13.031 3.149 -2.115 933 HA ILE 121 HA ILE 121 -12.457 5.558 -0.656 934 HB ILE 121 HB ILE 121 -11.586 2.915 -0.935 935 HG12 ILE 121 2HG1 ILE 121 -11.941 4.322 1.100 936 HG13 ILE 121 1HG1 ILE 121 -10.468 3.351 1.146 937 HG21 ILE 121 1HG2 ILE 121 -9.102 3.169 -0.981 938 HG22 ILE 121 2HG2 ILE 121 -9.321 4.853 -1.458 939 HG23 ILE 121 3HG2 ILE 121 -9.861 3.558 -2.526 940 HD11 ILE 121 3HD1 ILE 121 -10.603 6.103 1.531 941 HD12 ILE 121 1HD1 ILE 121 -10.054 5.943 -0.136 942 HD13 ILE 121 2HD1 ILE 121 -9.141 5.182 1.166 943 H LYS 122 H LYS 122 -11.513 4.318 -3.866 944 HA LYS 122 HA LYS 122 -9.642 6.502 -4.331 945 HB2 LYS 122 2HB LYS 122 -9.041 4.747 -5.627 946 HB3 LYS 122 1HB LYS 122 -10.598 3.978 -5.366 947 HG2 LYS 122 2HG LYS 122 -11.519 5.582 -7.117 948 HG3 LYS 122 1HG LYS 122 -9.827 5.901 -7.542 949 HD2 LYS 122 2HD LYS 122 -11.030 3.155 -7.290 950 HD3 LYS 122 1HD LYS 122 -10.841 3.995 -8.839 951 HE2 LYS 122 2HE LYS 122 -8.325 4.238 -7.651 952 HE3 LYS 122 1HE LYS 122 -8.838 2.588 -7.229 953 HZ1 LYS 122 3HZ LYS 122 -8.618 3.813 -9.911 954 HZ2 LYS 122 1HZ LYS 122 -9.629 2.477 -9.646 955 HZ3 LYS 122 2HZ LYS 122 -7.959 2.347 -9.359 956 H SER 123 H SER 123 -13.019 5.769 -4.855 957 HA SER 123 HA SER 123 -13.478 8.108 -6.579 958 HB2 SER 123 2HB SER 123 -14.717 5.872 -6.636 959 HB3 SER 123 1HB SER 123 -15.457 6.358 -5.115 960 HG SER 123 HG SER 123 -16.642 6.888 -7.099 961 H PHE 124 H PHE 124 -12.959 7.477 -3.333 962 HA PHE 124 HA PHE 124 -14.833 9.304 -2.097 963 HB2 PHE 124 2HB PHE 124 -13.614 7.487 -0.928 964 HB3 PHE 124 1HB PHE 124 -12.090 8.310 -1.257 965 HD1 PHE 124 2HD PHE 124 -15.199 10.125 -0.450 966 HD2 PHE 124 1HD PHE 124 -11.478 8.615 1.076 967 HE1 PHE 124 2HE PHE 124 -15.487 11.490 1.600 968 HE2 PHE 124 1HE PHE 124 -11.765 9.981 3.126 969 HZ PHE 124 HZ PHE 124 -13.768 11.418 3.388 970 H ALA 125 H ALA 125 -12.296 9.800 -4.202 971 HA ALA 125 HA ALA 125 -11.844 12.592 -3.197 972 HB1 ALA 125 1HB ALA 125 -9.986 10.900 -4.889 973 HB2 ALA 125 2HB ALA 125 -9.935 10.893 -3.126 974 HB3 ALA 125 3HB ALA 125 -9.592 12.379 -4.012 975 H SER 126 H SER 126 -12.659 10.521 -5.891 976 HA SER 126 HA SER 126 -13.427 12.904 -7.488 977 HB2 SER 126 2HB SER 126 -12.132 12.018 -9.419 978 HB3 SER 126 1HB SER 126 -11.084 12.397 -8.056 979 HG SER 126 HG SER 126 -12.168 9.835 -8.175 980 H SER 127 H SER 127 -13.905 11.395 -9.885 981 HA SER 127 HA SER 127 -15.288 8.945 -9.559 982 HB2 SER 127 2HB SER 127 -16.654 11.383 -8.599 983 HB3 SER 127 1HB SER 127 -17.636 10.358 -9.642 984 HG SER 127 HG SER 127 -17.760 9.752 -7.428 985 H GLY 128 H GLY 128 -15.728 12.164 -11.075 986 HA2 GLY 128 2HA GLY 128 -15.350 12.465 -13.479 987 HA3 GLY 128 1HA GLY 128 -15.825 10.782 -13.719 988 H LYS 129 H LYS 129 -18.178 10.480 -12.511 989 HA LYS 129 HA LYS 129 -19.974 12.244 -14.063 990 HB2 LYS 129 2HB LYS 129 -20.406 9.791 -12.324 991 HB3 LYS 129 1HB LYS 129 -21.652 10.549 -13.315 992 HG2 LYS 129 2HG LYS 129 -20.325 10.131 -15.340 993 HG3 LYS 129 1HG LYS 129 -19.045 9.408 -14.364 994 HD2 LYS 129 2HD LYS 129 -20.162 7.475 -14.900 995 HD3 LYS 129 1HD LYS 129 -21.127 7.934 -13.497 996 HE2 LYS 129 2HE LYS 129 -22.950 8.503 -14.773 997 HE3 LYS 129 1HE LYS 129 -21.948 9.138 -16.095 998 HZ1 LYS 129 3HZ LYS 129 -23.014 7.016 -16.682 999 HZ2 LYS 129 1HZ LYS 129 -22.213 6.262 -15.389 1000 HZ3 LYS 129 2HZ LYS 129 -21.318 6.901 -16.685 1001 H GLU 130 H GLU 130 -21.895 13.209 -12.962 1002 HA GLU 130 HA GLU 130 -21.132 14.478 -10.418 1003 HB2 GLU 130 2HB GLU 130 -23.327 14.730 -12.464 1004 HB3 GLU 130 1HB GLU 130 -23.461 15.558 -10.913 1005 HG2 GLU 130 2HG GLU 130 -21.945 17.121 -11.508 1006 HG3 GLU 130 1HG GLU 130 -20.822 15.902 -12.114 1007 H LYS 131 H LYS 131 -22.075 14.044 -8.428 1008 HA LYS 131 HA LYS 131 -24.513 12.387 -8.256 1009 HB2 LYS 131 2HB LYS 131 -22.129 11.107 -8.443 1010 HB3 LYS 131 1HB LYS 131 -22.195 11.365 -6.699 1011 HG2 LYS 131 2HG LYS 131 -24.264 10.194 -6.503 1012 HG3 LYS 131 1HG LYS 131 -24.515 10.201 -8.249 1013 HD2 LYS 131 2HD LYS 131 -21.978 8.962 -7.396 1014 HD3 LYS 131 1HD LYS 131 -23.422 8.107 -6.853 1015 HE2 LYS 131 2HE LYS 131 -23.303 9.031 -9.709 1016 HE3 LYS 131 1HE LYS 131 -22.408 7.573 -9.240 1017 HZ1 LYS 131 3HZ LYS 131 -24.702 7.211 -7.932 1018 HZ2 LYS 131 1HZ LYS 131 -24.410 6.593 -9.484 1019 HZ3 LYS 131 2HZ LYS 131 -25.273 8.044 -9.296 1020 H LEU 132 H LEU 132 -24.555 14.904 -7.419 1021 HA LEU 132 HA LEU 132 -24.696 16.358 -5.551 1022 HB2 LEU 132 2HB LEU 132 -26.495 14.732 -5.173 1023 HB3 LEU 132 1HB LEU 132 -25.360 13.630 -4.390 1024 HG LEU 132 HG LEU 132 -24.877 15.610 -2.783 1025 HD11 LEU 132 1HD1 LEU 132 -25.951 17.515 -3.368 1026 HD12 LEU 132 2HD1 LEU 132 -27.409 16.745 -2.742 1027 HD13 LEU 132 3HD1 LEU 132 -27.036 16.659 -4.464 1028 HD21 LEU 132 3HD2 LEU 132 -26.260 14.565 -1.295 1029 HD22 LEU 132 1HD2 LEU 132 -26.518 13.436 -2.624 1030 HD23 LEU 132 2HD2 LEU 132 -27.672 14.736 -2.336 1031 H GLU 133 H GLU 133 -22.277 16.668 -5.590 1032 HA GLU 133 HA GLU 133 -20.162 16.672 -4.524 1033 HB2 GLU 133 2HB GLU 133 -22.299 16.458 -2.437 1034 HB3 GLU 133 1HB GLU 133 -20.616 16.321 -1.919 1035 HG2 GLU 133 2HG GLU 133 -20.430 18.558 -2.014 1036 HG3 GLU 133 1HG GLU 133 -20.744 18.489 -3.750 Start of MODEL 21 1 H1 MET 1 1HT MET 1 5.361 -31.668 -0.142 2 H2 MET 1 2HT MET 1 4.565 -30.227 0.276 3 H3 MET 1 3HT MET 1 6.252 -30.242 0.086 4 HA MET 1 HA MET 1 5.723 -31.021 -2.319 5 HB2 MET 1 2HB MET 1 3.158 -30.366 -1.035 6 HB3 MET 1 1HB MET 1 3.381 -29.577 -2.597 7 HG2 MET 1 2HG MET 1 2.792 -31.524 -3.569 8 HG3 MET 1 1HG MET 1 4.308 -32.200 -2.971 9 HE1 MET 1 2HE MET 1 4.110 -34.144 -2.678 10 HE2 MET 1 3HE MET 1 2.748 -35.118 -2.129 11 HE3 MET 1 1HE MET 1 3.970 -34.567 -0.974 12 H MET 2 H MET 2 7.379 -29.206 -0.977 13 HA MET 2 HA MET 2 8.352 -27.068 -1.220 14 HB2 MET 2 2HB MET 2 8.026 -28.069 -3.604 15 HB3 MET 2 1HB MET 2 6.714 -26.899 -3.748 16 HG2 MET 2 2HG MET 2 8.323 -25.087 -3.126 17 HG3 MET 2 1HG MET 2 9.619 -26.281 -3.140 18 HE1 MET 2 3HE MET 2 8.163 -23.535 -5.083 19 HE2 MET 2 1HE MET 2 6.769 -24.621 -5.029 20 HE3 MET 2 2HE MET 2 7.518 -24.220 -6.572 21 H GLU 3 H GLU 3 6.685 -26.547 0.622 22 HA GLU 3 HA GLU 3 4.649 -24.574 -0.335 23 HB2 GLU 3 2HB GLU 3 3.688 -24.957 1.938 24 HB3 GLU 3 1HB GLU 3 3.802 -26.451 1.000 25 HG2 GLU 3 2HG GLU 3 6.214 -25.786 2.573 26 HG3 GLU 3 1HG GLU 3 4.782 -26.146 3.539 27 H GLU 4 H GLU 4 7.646 -24.875 1.202 28 HA GLU 4 HA GLU 4 7.453 -22.681 3.030 29 HB2 GLU 4 2HB GLU 4 9.785 -24.042 1.655 30 HB3 GLU 4 1HB GLU 4 9.959 -22.915 3.003 31 HG2 GLU 4 2HG GLU 4 8.602 -24.364 4.433 32 HG3 GLU 4 1HG GLU 4 8.327 -25.471 3.088 33 H TYR 5 H TYR 5 7.424 -22.725 -0.303 34 HA TYR 5 HA TYR 5 8.986 -20.329 -0.838 35 HB2 TYR 5 2HB TYR 5 7.288 -22.282 -2.272 36 HB3 TYR 5 1HB TYR 5 7.357 -20.674 -2.992 37 HD1 TYR 5 2HD TYR 5 10.061 -22.243 -1.000 38 HD2 TYR 5 1HD TYR 5 8.687 -21.186 -4.931 39 HE1 TYR 5 2HE TYR 5 12.305 -22.752 -1.922 40 HE2 TYR 5 1HE TYR 5 10.932 -21.696 -5.852 41 HH TYR 5 HH TYR 5 13.193 -23.470 -4.303 42 H LEU 6 H LEU 6 5.710 -21.091 -0.050 43 HA LEU 6 HA LEU 6 4.737 -18.354 -0.617 44 HB2 LEU 6 2HB LEU 6 2.586 -19.311 -0.193 45 HB3 LEU 6 1HB LEU 6 3.496 -20.574 -1.021 46 HG LEU 6 HG LEU 6 4.163 -21.101 1.565 47 HD11 LEU 6 1HD1 LEU 6 2.799 -19.732 2.812 48 HD12 LEU 6 2HD1 LEU 6 1.664 -21.057 2.554 49 HD13 LEU 6 3HD1 LEU 6 1.581 -19.614 1.542 50 HD21 LEU 6 3HD2 LEU 6 2.220 -22.796 1.417 51 HD22 LEU 6 1HD2 LEU 6 3.428 -22.841 0.133 52 HD23 LEU 6 2HD2 LEU 6 1.870 -22.064 -0.148 53 H GLY 7 H GLY 7 5.790 -20.355 2.056 54 HA2 GLY 7 2HA GLY 7 4.671 -18.809 4.199 55 HA3 GLY 7 1HA GLY 7 6.077 -19.869 4.336 56 H VAL 8 H VAL 8 7.723 -18.589 2.389 57 HA VAL 8 HA VAL 8 8.670 -16.321 3.977 58 HB VAL 8 HB VAL 8 9.581 -17.821 1.527 59 HG11 VAL 8 1HG1 VAL 8 10.368 -15.683 0.977 60 HG12 VAL 8 2HG1 VAL 8 11.715 -16.349 1.900 61 HG13 VAL 8 3HG1 VAL 8 10.592 -15.225 2.665 62 HG21 VAL 8 3HG2 VAL 8 10.013 -17.982 4.375 63 HG22 VAL 8 1HG2 VAL 8 11.544 -17.646 3.567 64 HG23 VAL 8 2HG2 VAL 8 10.599 -19.064 3.111 65 H PHE 9 H PHE 9 6.987 -16.859 0.997 66 HA PHE 9 HA PHE 9 7.293 -14.283 -0.211 67 HB2 PHE 9 2HB PHE 9 6.388 -15.983 -1.557 68 HB3 PHE 9 1HB PHE 9 5.291 -16.533 -0.292 69 HD1 PHE 9 1HD PHE 9 5.867 -14.008 -2.915 70 HD2 PHE 9 2HD PHE 9 3.170 -15.407 0.121 71 HE1 PHE 9 1HE PHE 9 4.069 -12.586 -3.858 72 HE2 PHE 9 2HE PHE 9 1.371 -13.984 -0.822 73 HZ PHE 9 HZ PHE 9 1.820 -12.574 -2.812 74 H VAL 10 H VAL 10 5.121 -15.527 2.287 75 HA VAL 10 HA VAL 10 3.476 -13.117 2.425 76 HB VAL 10 HB VAL 10 3.903 -15.529 4.221 77 HG11 VAL 10 1HG1 VAL 10 1.986 -14.839 5.479 78 HG12 VAL 10 2HG1 VAL 10 1.621 -13.544 4.340 79 HG13 VAL 10 3HG1 VAL 10 3.039 -13.427 5.383 80 HG21 VAL 10 3HG2 VAL 10 2.928 -16.082 2.056 81 HG22 VAL 10 1HG2 VAL 10 1.755 -14.775 2.214 82 HG23 VAL 10 2HG2 VAL 10 1.668 -16.172 3.286 83 H ASP 11 H ASP 11 6.044 -14.558 4.471 84 HA ASP 11 HA ASP 11 6.216 -12.570 6.445 85 HB2 ASP 11 2HB ASP 11 7.898 -14.666 5.260 86 HB3 ASP 11 1HB ASP 11 8.833 -13.345 5.962 87 H GLU 12 H GLU 12 7.080 -12.494 3.137 88 HA GLU 12 HA GLU 12 8.837 -10.158 3.261 89 HB2 GLU 12 2HB GLU 12 7.525 -11.893 1.193 90 HB3 GLU 12 1HB GLU 12 8.155 -10.324 0.688 91 HG2 GLU 12 2HG GLU 12 10.333 -10.978 1.850 92 HG3 GLU 12 1HG GLU 12 9.674 -12.611 1.951 93 H THR 13 H THR 13 5.446 -10.819 2.429 94 HA THR 13 HA THR 13 4.754 -8.116 1.701 95 HB THR 13 HB THR 13 2.521 -9.012 1.689 96 HG1 THR 13 1HG THR 13 3.530 -11.148 3.256 97 HG21 THR 13 3HG2 THR 13 4.655 -10.271 0.428 98 HG22 THR 13 1HG2 THR 13 2.949 -10.491 0.038 99 HG23 THR 13 2HG2 THR 13 3.751 -11.605 1.146 100 H LYS 14 H LYS 14 4.547 -9.968 4.746 101 HA LYS 14 HA LYS 14 3.179 -7.992 6.293 102 HB2 LYS 14 2HB LYS 14 4.916 -10.395 6.714 103 HB3 LYS 14 1HB LYS 14 4.611 -9.350 8.103 104 HG2 LYS 14 2HG LYS 14 2.920 -11.117 7.989 105 HG3 LYS 14 1HG LYS 14 2.181 -9.547 7.694 106 HD2 LYS 14 2HD LYS 14 3.175 -11.055 5.325 107 HD3 LYS 14 1HD LYS 14 1.711 -11.650 6.107 108 HE2 LYS 14 2HE LYS 14 2.167 -8.859 4.996 109 HE3 LYS 14 1HE LYS 14 1.014 -10.070 4.407 110 HZ1 LYS 14 3HZ LYS 14 -0.367 -9.007 5.831 111 HZ2 LYS 14 1HZ LYS 14 0.891 -8.408 6.797 112 HZ3 LYS 14 2HZ LYS 14 0.374 -10.016 6.980 113 H GLU 15 H GLU 15 6.625 -8.641 5.670 114 HA GLU 15 HA GLU 15 7.557 -6.489 7.371 115 HB2 GLU 15 2HB GLU 15 8.829 -8.150 5.178 116 HB3 GLU 15 1HB GLU 15 9.731 -7.054 6.227 117 HG2 GLU 15 2HG GLU 15 9.023 -8.317 8.202 118 HG3 GLU 15 1HG GLU 15 8.045 -9.382 7.194 119 H TYR 16 H TYR 16 6.177 -6.648 4.304 120 HA TYR 16 HA TYR 16 7.465 -4.205 3.259 121 HB2 TYR 16 2HB TYR 16 5.647 -6.375 2.287 122 HB3 TYR 16 1HB TYR 16 5.583 -4.824 1.452 123 HD1 TYR 16 1HD TYR 16 8.537 -6.379 3.096 124 HD2 TYR 16 2HD TYR 16 6.647 -5.330 -0.615 125 HE1 TYR 16 1HE TYR 16 10.619 -6.949 1.875 126 HE2 TYR 16 2HE TYR 16 8.729 -5.899 -1.837 127 HH TYR 16 HH TYR 16 10.830 -7.623 -1.176 128 H LEU 17 H LEU 17 4.262 -5.336 4.368 129 HA LEU 17 HA LEU 17 2.846 -2.887 3.937 130 HB2 LEU 17 2HB LEU 17 2.567 -5.137 5.959 131 HB3 LEU 17 1HB LEU 17 1.354 -3.876 5.739 132 HG LEU 17 HG LEU 17 2.337 -5.746 3.569 133 HD11 LEU 17 1HD1 LEU 17 0.801 -6.584 5.544 134 HD12 LEU 17 2HD1 LEU 17 0.414 -7.022 3.880 135 HD13 LEU 17 3HD1 LEU 17 -0.454 -5.706 4.671 136 HD21 LEU 17 3HD2 LEU 17 0.289 -4.774 2.389 137 HD22 LEU 17 1HD2 LEU 17 1.655 -3.674 2.577 138 HD23 LEU 17 2HD2 LEU 17 0.262 -3.541 3.652 139 H GLN 18 H GLN 18 4.843 -4.096 6.576 140 HA GLN 18 HA GLN 18 4.406 -1.868 8.358 141 HB2 GLN 18 2HB GLN 18 5.462 -3.360 9.671 142 HB3 GLN 18 1HB GLN 18 5.720 -4.371 8.257 143 HG2 GLN 18 2HG GLN 18 7.828 -3.228 7.781 144 HG3 GLN 18 1HG GLN 18 7.562 -2.126 9.133 145 HE21 GLN 18 1HE2 GLN 18 7.317 -3.279 11.352 146 HE22 GLN 18 2HE2 GLN 18 8.279 -4.653 11.616 147 H ASN 19 H ASN 19 6.945 -2.781 6.129 148 HA ASN 19 HA ASN 19 8.502 -0.391 6.329 149 HB2 ASN 19 2HB ASN 19 8.143 -2.708 4.485 150 HB3 ASN 19 1HB ASN 19 8.894 -1.271 3.780 151 HD21 ASN 19 1HD2 ASN 19 9.324 -1.926 7.213 152 HD22 ASN 19 2HD2 ASN 19 10.954 -2.391 7.110 153 H LEU 20 H LEU 20 5.560 -1.276 4.825 154 HA LEU 20 HA LEU 20 5.407 1.159 3.160 155 HB2 LEU 20 2HB LEU 20 4.589 -0.794 2.102 156 HB3 LEU 20 1HB LEU 20 3.802 -1.354 3.574 157 HG LEU 20 HG LEU 20 2.262 0.658 3.392 158 HD11 LEU 20 1HD1 LEU 20 3.487 2.104 1.938 159 HD12 LEU 20 2HD1 LEU 20 2.111 1.537 0.990 160 HD13 LEU 20 3HD1 LEU 20 3.707 0.829 0.738 161 HD21 LEU 20 3HD2 LEU 20 2.331 -1.794 1.817 162 HD22 LEU 20 1HD2 LEU 20 1.410 -0.527 1.010 163 HD23 LEU 20 2HD2 LEU 20 0.967 -1.033 2.639 164 H ASN 21 H ASN 21 4.644 0.155 6.310 165 HA ASN 21 HA ASN 21 2.444 2.102 6.618 166 HB2 ASN 21 2HB ASN 21 3.547 -0.239 8.053 167 HB3 ASN 21 1HB ASN 21 3.024 1.089 9.093 168 HD21 ASN 21 1HD2 ASN 21 1.912 -1.512 7.060 169 HD22 ASN 21 2HD2 ASN 21 0.251 -1.207 7.230 170 H ASP 22 H ASP 22 5.750 1.429 7.265 171 HA ASP 22 HA ASP 22 6.201 3.606 9.039 172 HB2 ASP 22 2HB ASP 22 8.133 2.181 7.196 173 HB3 ASP 22 1HB ASP 22 8.567 3.077 8.653 174 H THR 23 H THR 23 6.132 3.079 5.680 175 HA THR 23 HA THR 23 7.180 5.673 4.824 176 HB THR 23 HB THR 23 5.535 3.478 3.549 177 HG1 THR 23 1HG THR 23 7.379 2.516 3.293 178 HG21 THR 23 3HG2 THR 23 5.241 5.007 1.901 179 HG22 THR 23 1HG2 THR 23 6.942 4.726 1.528 180 HG23 THR 23 2HG2 THR 23 6.476 6.079 2.560 181 H LEU 24 H LEU 24 4.011 4.082 5.168 182 HA LEU 24 HA LEU 24 2.462 6.385 4.307 183 HB2 LEU 24 2HB LEU 24 1.951 3.743 5.687 184 HB3 LEU 24 1HB LEU 24 0.650 4.919 5.505 185 HG LEU 24 HG LEU 24 2.326 3.866 3.208 186 HD11 LEU 24 1HD1 LEU 24 0.194 2.651 2.618 187 HD12 LEU 24 2HD1 LEU 24 -0.428 3.089 4.209 188 HD13 LEU 24 3HD1 LEU 24 0.987 2.045 4.071 189 HD21 LEU 24 3HD2 LEU 24 0.261 4.830 1.962 190 HD22 LEU 24 1HD2 LEU 24 1.457 5.973 2.577 191 HD23 LEU 24 2HD2 LEU 24 -0.048 5.712 3.459 192 H LEU 25 H LEU 25 3.861 5.199 7.291 193 HA LEU 25 HA LEU 25 2.298 7.094 8.945 194 HB2 LEU 25 2HB LEU 25 4.532 5.122 9.459 195 HB3 LEU 25 1HB LEU 25 3.794 6.100 10.734 196 HG LEU 25 HG LEU 25 2.089 4.503 8.858 197 HD11 LEU 25 1HD1 LEU 25 2.255 2.561 10.183 198 HD12 LEU 25 2HD1 LEU 25 3.030 3.425 11.512 199 HD13 LEU 25 3HD1 LEU 25 3.926 3.101 10.026 200 HD21 LEU 25 3HD2 LEU 25 0.457 4.738 10.578 201 HD22 LEU 25 1HD2 LEU 25 1.248 6.313 10.473 202 HD23 LEU 25 2HD2 LEU 25 1.672 5.195 11.771 203 H GLU 26 H GLU 26 5.150 7.051 7.143 204 HA GLU 26 HA GLU 26 6.319 9.361 8.569 205 HB2 GLU 26 2HB GLU 26 7.191 7.424 6.421 206 HB3 GLU 26 1HB GLU 26 8.065 8.940 6.652 207 HG2 GLU 26 2HG GLU 26 8.478 8.370 9.002 208 HG3 GLU 26 1HG GLU 26 7.559 6.876 8.815 209 H LEU 27 H LEU 27 4.611 8.265 5.823 210 HA LEU 27 HA LEU 27 4.752 10.594 4.218 211 HB2 LEU 27 2HB LEU 27 4.142 8.376 3.366 212 HB3 LEU 27 1HB LEU 27 2.754 8.334 4.448 213 HG LEU 27 HG LEU 27 1.863 10.363 3.298 214 HD11 LEU 27 1HD1 LEU 27 4.052 9.792 1.283 215 HD12 LEU 27 2HD1 LEU 27 4.091 11.127 2.435 216 HD13 LEU 27 3HD1 LEU 27 2.842 11.070 1.192 217 HD21 LEU 27 3HD2 LEU 27 1.455 9.083 1.055 218 HD22 LEU 27 1HD2 LEU 27 0.863 8.372 2.558 219 HD23 LEU 27 2HD2 LEU 27 2.359 7.782 1.831 220 H GLU 28 H GLU 28 2.657 9.474 6.805 221 HA GLU 28 HA GLU 28 0.607 11.481 6.558 222 HB2 GLU 28 2HB GLU 28 1.670 9.757 8.820 223 HB3 GLU 28 1HB GLU 28 0.232 10.765 8.982 224 HG2 GLU 28 2HG GLU 28 0.202 9.126 6.558 225 HG3 GLU 28 1HG GLU 28 0.263 8.164 8.034 226 H LYS 29 H LYS 29 3.679 11.253 8.340 227 HA LYS 29 HA LYS 29 3.330 13.850 9.626 228 HB2 LYS 29 2HB LYS 29 5.049 13.050 10.879 229 HB3 LYS 29 1HB LYS 29 4.817 11.553 9.984 230 HG2 LYS 29 2HG LYS 29 6.395 12.771 8.219 231 HG3 LYS 29 1HG LYS 29 6.928 13.641 9.661 232 HD2 LYS 29 2HD LYS 29 7.770 11.733 10.660 233 HD3 LYS 29 1HD LYS 29 6.641 10.676 9.810 234 HE2 LYS 29 2HE LYS 29 8.539 10.190 8.578 235 HE3 LYS 29 1HE LYS 29 8.028 11.640 7.692 236 HZ1 LYS 29 3HZ LYS 29 9.287 12.824 9.637 237 HZ2 LYS 29 1HZ LYS 29 10.137 12.253 8.286 238 HZ3 LYS 29 2HZ LYS 29 10.126 11.350 9.725 239 H ASN 30 H ASN 30 4.453 12.637 6.680 240 HA ASN 30 HA ASN 30 5.045 15.348 5.676 241 HB2 ASN 30 2HB ASN 30 7.025 13.268 6.305 242 HB3 ASN 30 1HB ASN 30 7.128 13.804 4.628 243 HD21 ASN 30 1HD2 ASN 30 9.185 14.405 6.557 244 HD22 ASN 30 2HD2 ASN 30 9.198 16.083 6.806 245 HA PRO 31 HA PRO 31 2.786 12.647 2.861 246 HB2 PRO 31 2HB PRO 31 0.528 14.149 2.824 247 HB3 PRO 31 1HB PRO 31 0.885 12.960 4.084 248 HG2 PRO 31 2HG PRO 31 0.912 15.883 4.222 249 HG3 PRO 31 1HG PRO 31 0.690 14.684 5.502 250 HD2 PRO 31 2HD PRO 31 3.053 16.116 4.854 251 HD3 PRO 31 1HD PRO 31 2.847 14.845 6.079 252 H GLU 32 H GLU 32 4.629 15.104 2.412 253 HA GLU 32 HA GLU 32 3.616 15.680 -0.324 254 HB2 GLU 32 2HB GLU 32 4.642 18.121 0.714 255 HB3 GLU 32 1HB GLU 32 2.972 17.765 0.277 256 HG2 GLU 32 2HG GLU 32 2.423 17.086 2.488 257 HG3 GLU 32 1HG GLU 32 4.124 16.972 2.954 258 H ASP 33 H ASP 33 6.053 14.556 1.486 259 HA ASP 33 HA ASP 33 8.350 15.973 0.498 260 HB2 ASP 33 2HB ASP 33 9.550 14.003 1.397 261 HB3 ASP 33 1HB ASP 33 8.318 14.567 2.526 262 H MET 34 H MET 34 6.207 13.801 -0.934 263 HA MET 34 HA MET 34 6.108 12.870 -3.078 264 HB2 MET 34 2HB MET 34 8.085 15.023 -3.151 265 HB3 MET 34 1HB MET 34 8.433 13.762 -4.335 266 HG2 MET 34 2HG MET 34 5.599 14.313 -4.274 267 HG3 MET 34 1HG MET 34 6.501 15.804 -4.544 268 HE1 MET 34 3HE MET 34 4.945 13.542 -7.608 269 HE2 MET 34 1HE MET 34 4.976 15.295 -7.377 270 HE3 MET 34 2HE MET 34 4.464 14.239 -6.063 271 H GLU 35 H GLU 35 8.424 12.161 -0.807 272 HA GLU 35 HA GLU 35 9.670 10.067 -2.503 273 HB2 GLU 35 2HB GLU 35 10.345 11.459 0.084 274 HB3 GLU 35 1HB GLU 35 11.081 9.897 -0.286 275 HG2 GLU 35 2HG GLU 35 11.954 10.769 -2.394 276 HG3 GLU 35 1HG GLU 35 11.162 12.319 -2.106 277 H LEU 36 H LEU 36 7.765 10.703 0.381 278 HA LEU 36 HA LEU 36 7.439 7.878 1.084 279 HB2 LEU 36 2HB LEU 36 6.069 10.479 1.853 280 HB3 LEU 36 1HB LEU 36 5.659 8.924 2.574 281 HG LEU 36 HG LEU 36 8.509 9.791 2.496 282 HD11 LEU 36 1HD1 LEU 36 7.386 10.454 5.031 283 HD12 LEU 36 2HD1 LEU 36 6.435 11.264 3.788 284 HD13 LEU 36 3HD1 LEU 36 8.175 11.531 3.878 285 HD21 LEU 36 3HD2 LEU 36 7.588 7.487 3.232 286 HD22 LEU 36 1HD2 LEU 36 7.022 8.335 4.670 287 HD23 LEU 36 2HD2 LEU 36 8.746 8.284 4.299 288 H ILE 37 H ILE 37 5.943 10.272 -0.958 289 HA ILE 37 HA ILE 37 3.435 8.854 -1.389 290 HB ILE 37 HB ILE 37 4.982 11.081 -2.729 291 HG12 ILE 37 2HG1 ILE 37 2.325 10.916 -1.267 292 HG13 ILE 37 1HG1 ILE 37 3.821 11.607 -0.637 293 HG21 ILE 37 1HG2 ILE 37 3.879 9.980 -4.565 294 HG22 ILE 37 2HG2 ILE 37 2.905 11.391 -4.148 295 HG23 ILE 37 3HG2 ILE 37 2.397 9.783 -3.629 296 HD11 ILE 37 3HD1 ILE 37 1.865 12.762 -2.513 297 HD12 ILE 37 1HD1 ILE 37 3.546 12.961 -3.009 298 HD13 ILE 37 2HD1 ILE 37 3.009 13.570 -1.443 299 H ASN 38 H ASN 38 6.642 8.922 -2.890 300 HA ASN 38 HA ASN 38 5.790 7.051 -5.007 301 HB2 ASN 38 2HB ASN 38 7.596 9.115 -4.855 302 HB3 ASN 38 1HB ASN 38 8.642 7.708 -4.662 303 HD21 ASN 38 1HD2 ASN 38 7.513 5.812 -6.320 304 HD22 ASN 38 2HD2 ASN 38 7.466 6.368 -7.924 305 H GLU 39 H GLU 39 7.661 7.116 -2.067 306 HA GLU 39 HA GLU 39 8.879 4.536 -2.268 307 HB2 GLU 39 2HB GLU 39 8.044 6.373 -0.027 308 HB3 GLU 39 1HB GLU 39 8.751 4.796 0.331 309 HG2 GLU 39 2HG GLU 39 10.797 5.343 -0.705 310 HG3 GLU 39 1HG GLU 39 10.086 6.695 -1.587 311 H ALA 40 H ALA 40 5.706 5.610 -1.627 312 HA ALA 40 HA ALA 40 4.770 3.013 -0.570 313 HB1 ALA 40 1HB ALA 40 2.975 4.257 0.160 314 HB2 ALA 40 2HB ALA 40 2.908 5.206 -1.326 315 HB3 ALA 40 3HB ALA 40 4.098 5.595 -0.083 316 H PHE 41 H PHE 41 3.731 5.195 -3.240 317 HA PHE 41 HA PHE 41 2.129 3.488 -4.716 318 HB2 PHE 41 2HB PHE 41 2.446 5.733 -5.422 319 HB3 PHE 41 1HB PHE 41 4.199 5.553 -5.477 320 HD1 PHE 41 1HD PHE 41 1.027 4.480 -7.117 321 HD2 PHE 41 2HD PHE 41 5.299 4.788 -7.437 322 HE1 PHE 41 1HE PHE 41 0.892 3.854 -9.513 323 HE2 PHE 41 2HE PHE 41 5.165 4.160 -9.831 324 HZ PHE 41 HZ PHE 41 2.962 3.694 -10.870 325 H ARG 42 H ARG 42 5.661 3.386 -4.445 326 HA ARG 42 HA ARG 42 5.962 1.378 -6.564 327 HB2 ARG 42 2HB ARG 42 8.290 1.579 -6.038 328 HB3 ARG 42 1HB ARG 42 7.612 3.195 -5.858 329 HG2 ARG 42 2HG ARG 42 7.399 2.810 -3.413 330 HG3 ARG 42 1HG ARG 42 8.152 1.226 -3.617 331 HD2 ARG 42 2HD ARG 42 10.110 2.491 -4.732 332 HD3 ARG 42 1HD ARG 42 9.397 3.953 -4.021 333 HE ARG 42 HE ARG 42 10.357 3.200 -2.004 334 HH11 ARG 42 1HH2 ARG 42 10.534 0.572 -4.069 335 HH12 ARG 42 2HH2 ARG 42 10.369 -0.636 -2.839 336 HH21 ARG 42 1HH1 ARG 42 9.590 1.638 -0.338 337 HH22 ARG 42 2HH1 ARG 42 9.835 -0.032 -0.726 338 H ALA 43 H ALA 43 6.172 1.406 -2.997 339 HA ALA 43 HA ALA 43 6.773 -1.369 -2.647 340 HB1 ALA 43 1HB ALA 43 6.941 0.474 -0.954 341 HB2 ALA 43 2HB ALA 43 6.047 -0.921 -0.351 342 HB3 ALA 43 3HB ALA 43 5.180 0.521 -0.883 343 H LEU 44 H LEU 44 3.645 0.359 -2.593 344 HA LEU 44 HA LEU 44 2.010 -1.969 -2.245 345 HB2 LEU 44 2HB LEU 44 1.635 0.805 -3.384 346 HB3 LEU 44 1HB LEU 44 0.293 -0.335 -3.282 347 HG LEU 44 HG LEU 44 1.985 0.112 -0.855 348 HD11 LEU 44 1HD1 LEU 44 1.580 2.375 -1.273 349 HD12 LEU 44 2HD1 LEU 44 0.169 1.929 -0.314 350 HD13 LEU 44 3HD1 LEU 44 0.040 2.055 -2.069 351 HD21 LEU 44 3HD2 LEU 44 -0.801 -0.760 -1.546 352 HD22 LEU 44 1HD2 LEU 44 -0.496 -0.070 0.048 353 HD23 LEU 44 2HD2 LEU 44 0.369 -1.517 -0.467 354 H HIS 45 H HIS 45 3.315 -0.320 -5.099 355 HA HIS 45 HA HIS 45 1.894 -1.809 -7.101 356 HB2 HIS 45 2HB HIS 45 3.110 0.307 -7.481 357 HB3 HIS 45 1HB HIS 45 4.631 -0.484 -7.069 358 HD1 HIS 45 1HD HIS 45 2.754 -2.922 -8.854 359 HD2 HIS 45 2HD HIS 45 4.947 0.429 -10.004 360 HE1 HIS 45 1HE HIS 45 3.279 -3.220 -11.313 361 H THR 46 H THR 46 4.840 -2.360 -5.243 362 HA THR 46 HA THR 46 5.520 -4.814 -6.711 363 HB THR 46 HB THR 46 6.750 -2.906 -4.939 364 HG1 THR 46 1HG THR 46 8.296 -3.434 -6.226 365 HG21 THR 46 3HG2 THR 46 8.066 -4.476 -3.522 366 HG22 THR 46 1HG2 THR 46 7.021 -5.795 -4.053 367 HG23 THR 46 2HG2 THR 46 6.354 -4.466 -3.103 368 H LEU 47 H LEU 47 4.072 -3.838 -3.635 369 HA LEU 47 HA LEU 47 3.843 -6.465 -2.480 370 HB2 LEU 47 2HB LEU 47 3.084 -3.690 -1.995 371 HB3 LEU 47 1HB LEU 47 1.803 -4.802 -1.502 372 HG LEU 47 HG LEU 47 4.704 -5.149 -0.720 373 HD11 LEU 47 1HD1 LEU 47 3.182 -4.445 1.535 374 HD12 LEU 47 2HD1 LEU 47 2.696 -3.305 0.279 375 HD13 LEU 47 3HD1 LEU 47 4.394 -3.449 0.730 376 HD21 LEU 47 3HD2 LEU 47 2.549 -6.241 0.958 377 HD22 LEU 47 1HD2 LEU 47 4.009 -7.027 0.359 378 HD23 LEU 47 2HD2 LEU 47 2.580 -6.920 -0.669 379 H LYS 48 H LYS 48 1.734 -4.441 -4.503 380 HA LYS 48 HA LYS 48 -0.570 -6.158 -4.444 381 HB2 LYS 48 2HB LYS 48 -0.907 -3.945 -5.133 382 HB3 LYS 48 1HB LYS 48 0.537 -3.937 -6.141 383 HG2 LYS 48 2HG LYS 48 -0.696 -5.673 -7.606 384 HG3 LYS 48 1HG LYS 48 -2.147 -5.187 -6.729 385 HD2 LYS 48 2HD LYS 48 -2.233 -3.659 -8.455 386 HD3 LYS 48 1HD LYS 48 -1.224 -2.756 -7.322 387 HE2 LYS 48 2HE LYS 48 0.276 -2.636 -9.027 388 HE3 LYS 48 1HE LYS 48 0.614 -4.341 -8.673 389 HZ1 LYS 48 3HZ LYS 48 -1.223 -3.203 -10.683 390 HZ2 LYS 48 1HZ LYS 48 -1.486 -4.765 -10.072 391 HZ3 LYS 48 2HZ LYS 48 -0.037 -4.403 -10.884 392 H GLY 49 H GLY 49 2.319 -5.993 -6.505 393 HA2 GLY 49 2HA GLY 49 1.401 -7.903 -8.463 394 HA3 GLY 49 1HA GLY 49 3.080 -7.429 -8.208 395 H MET 50 H MET 50 3.848 -8.298 -5.865 396 HA MET 50 HA MET 50 4.325 -11.016 -5.975 397 HB2 MET 50 2HB MET 50 3.804 -9.213 -3.593 398 HB3 MET 50 1HB MET 50 4.518 -10.819 -3.452 399 HG2 MET 50 2HG MET 50 6.208 -9.962 -5.243 400 HG3 MET 50 1HG MET 50 5.657 -8.359 -4.758 401 HE1 MET 50 3HE MET 50 5.089 -10.011 -1.443 402 HE2 MET 50 1HE MET 50 4.863 -8.400 -2.140 403 HE3 MET 50 2HE MET 50 6.054 -8.655 -0.866 404 H ALA 51 H ALA 51 1.400 -9.443 -4.730 405 HA ALA 51 HA ALA 51 0.254 -12.022 -3.854 406 HB1 ALA 51 1HB ALA 51 -1.198 -9.396 -3.999 407 HB2 ALA 51 2HB ALA 51 0.107 -9.602 -2.829 408 HB3 ALA 51 3HB ALA 51 -1.303 -10.659 -2.771 409 H GLY 52 H GLY 52 0.397 -10.190 -6.722 410 HA2 GLY 52 2HA GLY 52 -2.247 -11.002 -7.703 411 HA3 GLY 52 1HA GLY 52 -1.031 -10.113 -8.620 412 H THR 53 H THR 53 -0.694 -13.216 -6.918 413 HA THR 53 HA THR 53 -0.959 -15.008 -9.024 414 HB THR 53 HB THR 53 1.218 -13.180 -9.379 415 HG1 THR 53 1HG THR 53 0.274 -13.777 -11.175 416 HG21 THR 53 3HG2 THR 53 2.044 -16.026 -8.819 417 HG22 THR 53 1HG2 THR 53 2.771 -14.531 -8.227 418 HG23 THR 53 2HG2 THR 53 2.971 -15.003 -9.915 419 H MET 54 H MET 54 0.844 -14.021 -6.285 420 HA MET 54 HA MET 54 1.110 -16.864 -5.380 421 HB2 MET 54 2HB MET 54 2.805 -14.416 -5.260 422 HB3 MET 54 1HB MET 54 2.968 -15.614 -3.981 423 HG2 MET 54 2HG MET 54 2.963 -16.610 -6.794 424 HG3 MET 54 1HG MET 54 4.409 -15.766 -6.240 425 HE1 MET 54 3HE MET 54 5.994 -16.566 -4.352 426 HE2 MET 54 1HE MET 54 5.471 -17.702 -3.102 427 HE3 MET 54 2HE MET 54 4.593 -16.195 -3.350 428 H GLY 55 H GLY 55 -0.334 -13.879 -4.854 429 HA2 GLY 55 2HA GLY 55 -1.096 -14.693 -2.079 430 HA3 GLY 55 1HA GLY 55 -0.644 -13.019 -2.422 431 H PHE 56 H PHE 56 -2.099 -14.429 -5.079 432 HA PHE 56 HA PHE 56 -4.295 -14.296 -5.985 433 HB2 PHE 56 2HB PHE 56 -4.572 -14.702 -3.203 434 HB3 PHE 56 1HB PHE 56 -5.665 -13.377 -3.598 435 HD1 PHE 56 1HD PHE 56 -4.596 -16.694 -5.000 436 HD2 PHE 56 2HD PHE 56 -7.807 -13.922 -4.324 437 HE1 PHE 56 1HE PHE 56 -6.199 -18.309 -5.984 438 HE2 PHE 56 2HE PHE 56 -9.409 -15.537 -5.309 439 HZ PHE 56 HZ PHE 56 -8.604 -17.731 -6.139 440 H SER 57 H SER 57 -4.867 -12.551 -7.208 441 HA SER 57 HA SER 57 -3.974 -9.902 -6.677 442 HB2 SER 57 2HB SER 57 -6.245 -10.864 -8.428 443 HB3 SER 57 1HB SER 57 -5.378 -9.340 -8.601 444 HG SER 57 HG SER 57 -4.755 -11.703 -9.610 445 H SER 58 H SER 58 -6.498 -11.592 -5.240 446 HA SER 58 HA SER 58 -8.489 -9.572 -4.892 447 HB2 SER 58 2HB SER 58 -7.595 -11.878 -3.129 448 HB3 SER 58 1HB SER 58 -9.116 -11.007 -2.948 449 HG SER 58 HG SER 58 -8.322 -12.262 -5.362 450 H MET 59 H MET 59 -5.690 -10.600 -2.971 451 HA MET 59 HA MET 59 -5.952 -8.445 -1.042 452 HB2 MET 59 2HB MET 59 -4.935 -10.726 -0.671 453 HB3 MET 59 1HB MET 59 -3.607 -10.253 -1.732 454 HG2 MET 59 2HG MET 59 -3.978 -8.184 0.209 455 HG3 MET 59 1HG MET 59 -3.896 -9.725 1.058 456 HE1 MET 59 3HE MET 59 -2.410 -8.899 -2.416 457 HE2 MET 59 1HE MET 59 -0.818 -8.238 -2.011 458 HE3 MET 59 2HE MET 59 -2.274 -7.376 -1.536 459 H ALA 60 H ALA 60 -4.326 -8.965 -4.114 460 HA ALA 60 HA ALA 60 -2.445 -6.781 -3.902 461 HB1 ALA 60 1HB ALA 60 -2.318 -8.755 -5.449 462 HB2 ALA 60 2HB ALA 60 -2.157 -7.212 -6.291 463 HB3 ALA 60 3HB ALA 60 -3.685 -8.090 -6.344 464 H LYS 61 H LYS 61 -5.793 -7.056 -5.036 465 HA LYS 61 HA LYS 61 -5.965 -4.510 -6.339 466 HB2 LYS 61 2HB LYS 61 -7.901 -6.345 -4.906 467 HB3 LYS 61 1HB LYS 61 -8.443 -4.852 -5.678 468 HG2 LYS 61 2HG LYS 61 -8.145 -5.682 -7.783 469 HG3 LYS 61 1HG LYS 61 -6.707 -6.599 -7.324 470 HD2 LYS 61 2HD LYS 61 -8.372 -8.057 -5.950 471 HD3 LYS 61 1HD LYS 61 -9.602 -7.347 -6.995 472 HE2 LYS 61 2HE LYS 61 -8.228 -8.092 -8.987 473 HE3 LYS 61 1HE LYS 61 -7.200 -8.991 -7.853 474 HZ1 LYS 61 3HZ LYS 61 -8.836 -10.450 -7.374 475 HZ2 LYS 61 1HZ LYS 61 -9.429 -10.004 -8.899 476 HZ3 LYS 61 2HZ LYS 61 -10.071 -9.289 -7.498 477 H LEU 62 H LEU 62 -6.131 -5.561 -3.017 478 HA LEU 62 HA LEU 62 -7.144 -3.162 -1.829 479 HB2 LEU 62 2HB LEU 62 -5.336 -5.417 -0.907 480 HB3 LEU 62 1HB LEU 62 -5.951 -4.176 0.187 481 HG LEU 62 HG LEU 62 -7.811 -5.736 -1.590 482 HD11 LEU 62 1HD1 LEU 62 -7.612 -6.598 1.221 483 HD12 LEU 62 2HD1 LEU 62 -6.194 -6.989 0.246 484 HD13 LEU 62 3HD1 LEU 62 -7.787 -7.567 -0.242 485 HD21 LEU 62 3HD2 LEU 62 -8.132 -4.330 1.082 486 HD22 LEU 62 1HD2 LEU 62 -9.427 -5.105 0.170 487 HD23 LEU 62 2HD2 LEU 62 -8.621 -3.676 -0.480 488 H CYS 63 H CYS 63 -3.886 -4.356 -2.576 489 HA CYS 63 HA CYS 63 -2.570 -1.945 -1.555 490 HB2 CYS 63 2HB CYS 63 -1.800 -4.494 -2.954 491 HB3 CYS 63 1HB CYS 63 -0.628 -3.179 -2.847 492 HG CYS 63 HG CYS 63 -0.325 -4.603 -0.690 493 H HIS 64 H HIS 64 -3.622 -3.213 -4.672 494 HA HIS 64 HA HIS 64 -2.263 -1.489 -6.443 495 HB2 HIS 64 2HB HIS 64 -3.558 -3.383 -7.195 496 HB3 HIS 64 1HB HIS 64 -5.022 -2.747 -6.449 497 HD1 HIS 64 1HD HIS 64 -2.810 -0.370 -8.279 498 HD2 HIS 64 2HD HIS 64 -6.266 -2.572 -9.045 499 HE1 HIS 64 1HE HIS 64 -3.781 0.546 -10.432 500 H THR 65 H THR 65 -5.048 -0.915 -4.342 501 HA THR 65 HA THR 65 -5.643 1.643 -5.634 502 HB THR 65 HB THR 65 -7.000 -0.225 -4.077 503 HG1 THR 65 1HG THR 65 -7.506 2.299 -5.146 504 HG21 THR 65 3HG2 THR 65 -6.744 2.374 -2.540 505 HG22 THR 65 1HG2 THR 65 -6.153 0.800 -2.011 506 HG23 THR 65 2HG2 THR 65 -7.884 1.079 -2.177 507 H LEU 66 H LEU 66 -4.350 0.657 -2.423 508 HA LEU 66 HA LEU 66 -3.942 3.207 -1.305 509 HB2 LEU 66 2HB LEU 66 -1.768 1.118 -1.191 510 HB3 LEU 66 1HB LEU 66 -2.349 2.167 0.093 511 HG LEU 66 HG LEU 66 -3.681 -0.295 -1.038 512 HD11 LEU 66 1HD1 LEU 66 -2.733 0.559 1.703 513 HD12 LEU 66 2HD1 LEU 66 -2.101 -0.757 0.715 514 HD13 LEU 66 3HD1 LEU 66 -3.714 -0.879 1.419 515 HD21 LEU 66 3HD2 LEU 66 -5.026 1.181 1.147 516 HD22 LEU 66 1HD2 LEU 66 -5.727 0.320 -0.219 517 HD23 LEU 66 2HD2 LEU 66 -5.110 1.958 -0.430 518 H GLU 67 H GLU 67 -2.045 1.470 -3.722 519 HA GLU 67 HA GLU 67 0.023 3.492 -4.014 520 HB2 GLU 67 2HB GLU 67 0.863 1.569 -4.890 521 HB3 GLU 67 1HB GLU 67 -0.742 0.851 -4.971 522 HG2 GLU 67 2HG GLU 67 -1.105 2.165 -7.112 523 HG3 GLU 67 1HG GLU 67 0.602 2.599 -7.052 524 H ASN 68 H ASN 68 -2.896 2.573 -5.843 525 HA ASN 68 HA ASN 68 -2.749 4.437 -7.958 526 HB2 ASN 68 2HB ASN 68 -4.501 2.569 -6.915 527 HB3 ASN 68 1HB ASN 68 -5.377 4.087 -6.730 528 HD21 ASN 68 1HD2 ASN 68 -3.327 2.510 -9.265 529 HD22 ASN 68 2HD2 ASN 68 -4.331 2.958 -10.558 530 H ILE 69 H ILE 69 -3.890 4.810 -4.624 531 HA ILE 69 HA ILE 69 -4.882 7.490 -5.001 532 HB ILE 69 HB ILE 69 -3.852 6.194 -2.469 533 HG12 ILE 69 2HG1 ILE 69 -5.586 4.928 -4.063 534 HG13 ILE 69 1HG1 ILE 69 -5.690 4.849 -2.311 535 HG21 ILE 69 1HG2 ILE 69 -6.115 8.170 -2.875 536 HG22 ILE 69 2HG2 ILE 69 -4.482 8.612 -2.383 537 HG23 ILE 69 3HG2 ILE 69 -5.473 7.598 -1.336 538 HD11 ILE 69 3HD1 ILE 69 -7.446 6.425 -2.249 539 HD12 ILE 69 1HD1 ILE 69 -7.841 5.383 -3.619 540 HD13 ILE 69 2HD1 ILE 69 -7.117 6.971 -3.896 541 H LEU 70 H LEU 70 -2.062 5.957 -3.886 542 HA LEU 70 HA LEU 70 -0.502 8.320 -3.298 543 HB2 LEU 70 2HB LEU 70 0.204 5.422 -3.861 544 HB3 LEU 70 1HB LEU 70 1.358 6.617 -3.265 545 HG LEU 70 HG LEU 70 -1.251 6.139 -1.842 546 HD11 LEU 70 1HD1 LEU 70 -0.572 4.181 -0.976 547 HD12 LEU 70 2HD1 LEU 70 1.008 4.850 -0.572 548 HD13 LEU 70 3HD1 LEU 70 0.723 4.174 -2.175 549 HD21 LEU 70 3HD2 LEU 70 0.334 6.858 0.087 550 HD22 LEU 70 1HD2 LEU 70 -0.199 8.089 -1.058 551 HD23 LEU 70 2HD2 LEU 70 1.413 7.386 -1.205 552 H ASP 71 H ASP 71 -1.612 6.822 -6.102 553 HA ASP 71 HA ASP 71 0.630 7.693 -7.810 554 HB2 ASP 71 2HB ASP 71 -0.799 5.622 -8.184 555 HB3 ASP 71 1HB ASP 71 -2.145 6.700 -8.547 556 H LYS 72 H LYS 72 -2.819 8.575 -7.262 557 HA LYS 72 HA LYS 72 -2.602 10.920 -8.961 558 HB2 LYS 72 2HB LYS 72 -4.677 11.500 -7.317 559 HB3 LYS 72 1HB LYS 72 -4.826 10.433 -8.705 560 HG2 LYS 72 2HG LYS 72 -4.644 8.480 -7.341 561 HG3 LYS 72 1HG LYS 72 -4.109 9.425 -5.948 562 HD2 LYS 72 2HD LYS 72 -6.511 10.571 -6.779 563 HD3 LYS 72 1HD LYS 72 -6.765 8.828 -6.827 564 HE2 LYS 72 2HE LYS 72 -5.541 8.945 -4.450 565 HE3 LYS 72 1HE LYS 72 -6.203 10.588 -4.476 566 HZ1 LYS 72 3HZ LYS 72 -7.754 8.854 -3.591 567 HZ2 LYS 72 1HZ LYS 72 -7.802 8.183 -5.149 568 HZ3 LYS 72 2HZ LYS 72 -8.368 9.764 -4.889 569 H ALA 73 H ALA 73 -1.646 10.118 -5.797 570 HA ALA 73 HA ALA 73 -1.523 12.735 -4.603 571 HB1 ALA 73 1HB ALA 73 0.567 11.090 -3.638 572 HB2 ALA 73 2HB ALA 73 -0.736 9.990 -4.089 573 HB3 ALA 73 3HB ALA 73 -1.034 11.283 -2.924 574 H ARG 74 H ARG 74 0.714 10.740 -6.514 575 HA ARG 74 HA ARG 74 2.756 12.880 -6.524 576 HB2 ARG 74 2HB ARG 74 4.070 11.183 -7.706 577 HB3 ARG 74 1HB ARG 74 3.280 10.434 -6.318 578 HG2 ARG 74 2HG ARG 74 1.944 9.131 -7.619 579 HG3 ARG 74 1HG ARG 74 1.685 10.411 -8.803 580 HD2 ARG 74 2HD ARG 74 4.130 10.009 -9.528 581 HD3 ARG 74 1HD ARG 74 4.016 8.495 -8.609 582 HE ARG 74 HE ARG 74 1.720 8.876 -10.343 583 HH11 ARG 74 1HH1 ARG 74 5.008 7.834 -10.143 584 HH12 ARG 74 2HH1 ARG 74 4.894 6.790 -11.519 585 HH21 ARG 74 1HH2 ARG 74 1.569 7.535 -12.152 586 HH22 ARG 74 2HH2 ARG 74 2.951 6.619 -12.654 587 H ASN 75 H ASN 75 0.066 11.810 -8.383 588 HA ASN 75 HA ASN 75 0.999 12.956 -10.932 589 HB2 ASN 75 2HB ASN 75 -0.695 10.964 -10.278 590 HB3 ASN 75 1HB ASN 75 -1.857 12.285 -10.393 591 HD21 ASN 75 1HD2 ASN 75 0.628 10.513 -12.251 592 HD22 ASN 75 2HD2 ASN 75 0.051 10.979 -13.778 593 H SER 76 H SER 76 0.031 14.302 -8.094 594 HA SER 76 HA SER 76 -0.537 16.538 -7.589 595 HB2 SER 76 2HB SER 76 -0.155 18.048 -9.270 596 HB3 SER 76 1HB SER 76 0.476 16.631 -10.103 597 HG SER 76 HG SER 76 -1.727 16.341 -10.886 598 H GLU 77 H GLU 77 -2.538 14.295 -7.811 599 HA GLU 77 HA GLU 77 -4.930 15.934 -8.507 600 HB2 GLU 77 2HB GLU 77 -5.288 13.037 -8.148 601 HB3 GLU 77 1HB GLU 77 -5.838 14.072 -9.461 602 HG2 GLU 77 2HG GLU 77 -3.283 14.121 -10.102 603 HG3 GLU 77 1HG GLU 77 -3.222 12.640 -9.148 604 H ILE 78 H ILE 78 -3.362 14.011 -6.089 605 HA ILE 78 HA ILE 78 -5.324 15.025 -4.076 606 HB ILE 78 HB ILE 78 -5.479 12.696 -3.169 607 HG12 ILE 78 2HG1 ILE 78 -4.726 11.236 -5.456 608 HG13 ILE 78 1HG1 ILE 78 -3.379 12.311 -5.099 609 HG21 ILE 78 1HG2 ILE 78 -6.899 13.832 -5.178 610 HG22 ILE 78 2HG2 ILE 78 -7.254 12.228 -4.538 611 HG23 ILE 78 3HG2 ILE 78 -6.293 12.399 -6.007 612 HD11 ILE 78 3HD1 ILE 78 -4.248 9.938 -3.663 613 HD12 ILE 78 1HD1 ILE 78 -4.225 11.343 -2.601 614 HD13 ILE 78 2HD1 ILE 78 -2.772 10.872 -3.475 615 H LYS 79 H LYS 79 -4.534 14.113 -1.817 616 HA LYS 79 HA LYS 79 -1.623 13.835 -1.526 617 HB2 LYS 79 2HB LYS 79 -1.552 15.912 -0.098 618 HB3 LYS 79 1HB LYS 79 -1.891 16.247 -1.797 619 HG2 LYS 79 2HG LYS 79 -3.876 17.160 -1.271 620 HG3 LYS 79 1HG LYS 79 -4.354 15.702 -0.398 621 HD2 LYS 79 2HD LYS 79 -2.357 17.355 0.998 622 HD3 LYS 79 1HD LYS 79 -3.925 18.132 0.784 623 HE2 LYS 79 2HE LYS 79 -5.054 16.483 2.028 624 HE3 LYS 79 1HE LYS 79 -3.753 15.296 1.806 625 HZ1 LYS 79 3HZ LYS 79 -3.925 17.526 3.669 626 HZ2 LYS 79 1HZ LYS 79 -2.412 17.292 2.938 627 HZ3 LYS 79 2HZ LYS 79 -3.127 16.036 3.832 628 H ILE 80 H ILE 80 -1.104 13.211 0.728 629 HA ILE 80 HA ILE 80 -3.150 11.612 1.939 630 HB ILE 80 HB ILE 80 -0.424 12.583 2.592 631 HG12 ILE 80 2HG1 ILE 80 0.079 10.220 2.486 632 HG13 ILE 80 1HG1 ILE 80 -1.640 9.824 2.482 633 HG21 ILE 80 1HG2 ILE 80 -2.312 11.245 4.526 634 HG22 ILE 80 2HG2 ILE 80 -1.366 12.712 4.781 635 HG23 ILE 80 3HG2 ILE 80 -0.559 11.147 4.703 636 HD11 ILE 80 3HD1 ILE 80 -0.172 11.374 0.325 637 HD12 ILE 80 1HD1 ILE 80 -1.899 11.014 0.327 638 HD13 ILE 80 2HD1 ILE 80 -0.725 9.704 0.199 639 H THR 81 H THR 81 -4.910 12.725 2.487 640 HA THR 81 HA THR 81 -4.866 15.226 4.037 641 HB THR 81 HB THR 81 -7.249 15.071 3.762 642 HG1 THR 81 1HG THR 81 -8.272 13.179 3.448 643 HG21 THR 81 3HG2 THR 81 -6.965 13.684 1.288 644 HG22 THR 81 1HG2 THR 81 -5.484 14.596 1.571 645 HG23 THR 81 2HG2 THR 81 -7.040 15.425 1.554 646 H SER 82 H SER 82 -4.074 12.182 4.870 647 HA SER 82 HA SER 82 -3.850 11.172 7.006 648 HB2 SER 82 2HB SER 82 -5.777 13.129 8.184 649 HB3 SER 82 1HB SER 82 -4.285 12.479 8.862 650 HG SER 82 HG SER 82 -4.456 14.791 7.933 651 H ASP 83 H ASP 83 -6.654 11.773 5.237 652 HA ASP 83 HA ASP 83 -8.253 9.764 6.759 653 HB2 ASP 83 2HB ASP 83 -8.988 11.923 4.752 654 HB3 ASP 83 1HB ASP 83 -10.144 10.824 5.505 655 H LEU 84 H LEU 84 -7.012 10.775 3.573 656 HA LEU 84 HA LEU 84 -8.165 8.633 2.039 657 HB2 LEU 84 2HB LEU 84 -5.470 9.981 1.656 658 HB3 LEU 84 1HB LEU 84 -6.490 9.274 0.405 659 HG LEU 84 HG LEU 84 -6.860 11.846 1.916 660 HD11 LEU 84 1HD1 LEU 84 -6.624 10.906 -0.895 661 HD12 LEU 84 2HD1 LEU 84 -6.005 12.377 -0.144 662 HD13 LEU 84 3HD1 LEU 84 -7.704 12.271 -0.607 663 HD21 LEU 84 3HD2 LEU 84 -9.213 11.694 0.631 664 HD22 LEU 84 1HD2 LEU 84 -9.022 11.126 2.291 665 HD23 LEU 84 2HD2 LEU 84 -8.982 9.975 0.955 666 H LEU 85 H LEU 85 -5.541 8.921 4.267 667 HA LEU 85 HA LEU 85 -4.261 6.366 3.601 668 HB2 LEU 85 2HB LEU 85 -4.046 8.417 5.821 669 HB3 LEU 85 1HB LEU 85 -2.996 7.003 5.710 670 HG LEU 85 HG LEU 85 -3.249 9.265 3.715 671 HD11 LEU 85 1HD1 LEU 85 -1.037 8.210 5.489 672 HD12 LEU 85 2HD1 LEU 85 -1.806 9.797 5.574 673 HD13 LEU 85 3HD1 LEU 85 -0.768 9.386 4.203 674 HD21 LEU 85 3HD2 LEU 85 -1.322 7.886 2.610 675 HD22 LEU 85 1HD2 LEU 85 -2.988 7.385 2.318 676 HD23 LEU 85 2HD2 LEU 85 -2.003 6.527 3.504 677 H ASP 86 H ASP 86 -6.141 7.685 6.354 678 HA ASP 86 HA ASP 86 -6.331 5.478 8.029 679 HB2 ASP 86 2HB ASP 86 -8.370 7.541 7.160 680 HB3 ASP 86 1HB ASP 86 -8.696 6.398 8.462 681 H LYS 87 H LYS 87 -7.946 5.948 4.930 682 HA LYS 87 HA LYS 87 -9.510 3.452 5.248 683 HB2 LYS 87 2HB LYS 87 -9.155 5.257 2.836 684 HB3 LYS 87 1HB LYS 87 -10.489 4.146 3.152 685 HG2 LYS 87 2HG LYS 87 -9.837 6.715 4.613 686 HG3 LYS 87 1HG LYS 87 -11.304 6.326 3.713 687 HD2 LYS 87 2HD LYS 87 -11.369 4.302 5.473 688 HD3 LYS 87 1HD LYS 87 -10.476 5.473 6.446 689 HE2 LYS 87 2HE LYS 87 -12.536 6.303 6.983 690 HE3 LYS 87 1HE LYS 87 -12.516 7.011 5.356 691 HZ1 LYS 87 3HZ LYS 87 -13.213 4.584 4.704 692 HZ2 LYS 87 1HZ LYS 87 -14.377 5.715 5.198 693 HZ3 LYS 87 2HZ LYS 87 -13.807 4.550 6.295 694 H ILE 88 H ILE 88 -6.932 4.762 3.153 695 HA ILE 88 HA ILE 88 -6.358 2.380 1.700 696 HB ILE 88 HB ILE 88 -4.887 4.865 2.546 697 HG12 ILE 88 2HG1 ILE 88 -5.298 3.843 -0.238 698 HG13 ILE 88 1HG1 ILE 88 -6.647 4.562 0.639 699 HG21 ILE 88 1HG2 ILE 88 -3.249 3.715 0.649 700 HG22 ILE 88 2HG2 ILE 88 -3.672 2.347 1.680 701 HG23 ILE 88 3HG2 ILE 88 -2.917 3.780 2.380 702 HD11 ILE 88 3HD1 ILE 88 -5.857 6.621 0.212 703 HD12 ILE 88 1HD1 ILE 88 -4.533 5.911 -0.712 704 HD13 ILE 88 2HD1 ILE 88 -4.340 6.218 1.015 705 H PHE 89 H PHE 89 -5.642 3.422 4.938 706 HA PHE 89 HA PHE 89 -3.665 1.324 5.486 707 HB2 PHE 89 2HB PHE 89 -3.361 3.335 6.702 708 HB3 PHE 89 1HB PHE 89 -5.090 3.498 7.013 709 HD1 PHE 89 2HD PHE 89 -6.210 2.027 8.681 710 HD2 PHE 89 1HD PHE 89 -1.953 1.981 8.111 711 HE1 PHE 89 2HE PHE 89 -5.934 0.850 10.845 712 HE2 PHE 89 1HE PHE 89 -1.676 0.804 10.277 713 HZ PHE 89 HZ PHE 89 -3.667 0.239 11.644 714 H ALA 90 H ALA 90 -7.050 1.897 5.794 715 HA ALA 90 HA ALA 90 -7.676 -0.327 7.552 716 HB1 ALA 90 1HB ALA 90 -9.831 0.467 7.274 717 HB2 ALA 90 2HB ALA 90 -9.638 0.657 5.531 718 HB3 ALA 90 3HB ALA 90 -8.988 1.875 6.630 719 H GLY 91 H GLY 91 -7.053 0.175 4.176 720 HA2 GLY 91 2HA GLY 91 -8.165 -2.318 3.213 721 HA3 GLY 91 1HA GLY 91 -7.013 -1.292 2.347 722 H VAL 92 H VAL 92 -4.909 -1.157 4.069 723 HA VAL 92 HA VAL 92 -3.524 -3.635 3.708 724 HB VAL 92 HB VAL 92 -3.163 -1.098 5.295 725 HG11 VAL 92 1HG1 VAL 92 -1.674 -3.676 5.596 726 HG12 VAL 92 2HG1 VAL 92 -2.023 -2.436 6.801 727 HG13 VAL 92 3HG1 VAL 92 -0.743 -2.179 5.616 728 HG21 VAL 92 3HG2 VAL 92 -0.950 -1.623 3.679 729 HG22 VAL 92 1HG2 VAL 92 -2.286 -0.541 3.288 730 HG23 VAL 92 2HG2 VAL 92 -2.317 -2.215 2.735 731 H ASP 93 H ASP 93 -5.640 -2.370 6.148 732 HA ASP 93 HA ASP 93 -4.952 -4.169 8.316 733 HB2 ASP 93 2HB ASP 93 -6.817 -2.029 7.660 734 HB3 ASP 93 1HB ASP 93 -7.639 -3.330 8.525 735 H MET 94 H MET 94 -7.386 -4.159 5.719 736 HA MET 94 HA MET 94 -8.570 -6.703 6.504 737 HB2 MET 94 2HB MET 94 -8.593 -4.964 4.013 738 HB3 MET 94 1HB MET 94 -9.515 -6.463 4.124 739 HG2 MET 94 2HG MET 94 -10.468 -5.461 6.324 740 HG3 MET 94 1HG MET 94 -9.861 -3.924 5.709 741 HE1 MET 94 3HE MET 94 -10.144 -4.987 2.518 742 HE2 MET 94 1HE MET 94 -10.205 -3.323 3.116 743 HE3 MET 94 2HE MET 94 -11.511 -3.951 2.112 744 H ILE 95 H ILE 95 -5.992 -5.537 4.475 745 HA ILE 95 HA ILE 95 -5.391 -7.912 2.988 746 HB ILE 95 HB ILE 95 -4.097 -5.355 3.855 747 HG12 ILE 95 2HG1 ILE 95 -4.368 -6.641 1.129 748 HG13 ILE 95 1HG1 ILE 95 -5.588 -5.585 1.840 749 HG21 ILE 95 1HG2 ILE 95 -2.623 -7.738 2.751 750 HG22 ILE 95 2HG2 ILE 95 -2.196 -6.720 4.128 751 HG23 ILE 95 3HG2 ILE 95 -2.051 -6.089 2.488 752 HD11 ILE 95 3HD1 ILE 95 -2.718 -4.697 1.624 753 HD12 ILE 95 1HD1 ILE 95 -4.168 -3.707 1.793 754 HD13 ILE 95 2HD1 ILE 95 -3.825 -4.514 0.263 755 H THR 96 H THR 96 -4.498 -6.737 6.210 756 HA THR 96 HA THR 96 -2.554 -8.836 6.749 757 HB THR 96 HB THR 96 -4.026 -6.714 8.317 758 HG1 THR 96 1HG THR 96 -2.071 -6.452 6.894 759 HG21 THR 96 3HG2 THR 96 -2.090 -8.778 9.406 760 HG22 THR 96 1HG2 THR 96 -3.796 -8.631 9.828 761 HG23 THR 96 2HG2 THR 96 -2.663 -7.361 10.286 762 H ARG 97 H ARG 97 -5.968 -8.238 7.626 763 HA ARG 97 HA ARG 97 -6.311 -10.555 9.268 764 HB2 ARG 97 2HB ARG 97 -8.038 -8.686 7.669 765 HB3 ARG 97 1HB ARG 97 -8.772 -10.113 8.395 766 HG2 ARG 97 2HG ARG 97 -8.701 -7.873 9.755 767 HG3 ARG 97 1HG ARG 97 -8.340 -9.388 10.576 768 HD2 ARG 97 2HD ARG 97 -5.983 -8.971 10.516 769 HD3 ARG 97 1HD ARG 97 -6.181 -7.643 9.357 770 HE ARG 97 HE ARG 97 -7.046 -6.265 11.121 771 HH11 ARG 97 1HH1 ARG 97 -8.580 -8.607 12.408 772 HH12 ARG 97 2HH1 ARG 97 -7.795 -8.690 13.949 773 HH21 ARG 97 1HH2 ARG 97 -5.089 -6.755 12.972 774 HH22 ARG 97 2HH2 ARG 97 -5.817 -7.644 14.269 775 H MET 98 H MET 98 -6.874 -10.028 5.776 776 HA MET 98 HA MET 98 -7.771 -12.732 5.267 777 HB2 MET 98 2HB MET 98 -7.606 -12.036 2.958 778 HB3 MET 98 1HB MET 98 -8.127 -10.624 3.876 779 HG2 MET 98 2HG MET 98 -5.963 -9.646 3.806 780 HG3 MET 98 1HG MET 98 -5.209 -11.156 3.297 781 HE1 MET 98 3HE MET 98 -8.422 -9.257 0.643 782 HE2 MET 98 1HE MET 98 -8.183 -8.827 2.342 783 HE3 MET 98 2HE MET 98 -8.659 -10.466 1.903 784 H VAL 99 H VAL 99 -4.690 -11.163 5.610 785 HA VAL 99 HA VAL 99 -3.166 -13.350 4.400 786 HB VAL 99 HB VAL 99 -2.682 -10.668 5.656 787 HG11 VAL 99 1HG1 VAL 99 -0.122 -11.519 5.098 788 HG12 VAL 99 2HG1 VAL 99 -0.833 -12.961 5.825 789 HG13 VAL 99 3HG1 VAL 99 -0.821 -11.438 6.715 790 HG21 VAL 99 3HG2 VAL 99 -2.251 -10.113 3.513 791 HG22 VAL 99 1HG2 VAL 99 -2.796 -11.728 3.062 792 HG23 VAL 99 2HG2 VAL 99 -1.083 -11.424 3.349 793 H ASP 100 H ASP 100 -3.871 -12.084 7.682 794 HA ASP 100 HA ASP 100 -2.197 -13.950 9.106 795 HB2 ASP 100 2HB ASP 100 -3.014 -12.025 10.259 796 HB3 ASP 100 1HB ASP 100 -4.672 -12.321 9.732 797 H LYS 101 H LYS 101 -5.437 -14.040 7.783 798 HA LYS 101 HA LYS 101 -6.099 -16.648 8.934 799 HB2 LYS 101 2HB LYS 101 -8.191 -16.106 8.122 800 HB3 LYS 101 1HB LYS 101 -7.489 -14.491 8.012 801 HG2 LYS 101 2HG LYS 101 -8.356 -14.814 5.859 802 HG3 LYS 101 1HG LYS 101 -6.663 -15.284 5.676 803 HD2 LYS 101 2HD LYS 101 -7.335 -17.267 4.959 804 HD3 LYS 101 1HD LYS 101 -7.978 -17.588 6.568 805 HE2 LYS 101 2HE LYS 101 -9.945 -15.981 5.491 806 HE3 LYS 101 1HE LYS 101 -9.430 -16.934 4.088 807 HZ1 LYS 101 3HZ LYS 101 -9.463 -18.893 5.700 808 HZ2 LYS 101 1HZ LYS 101 -10.960 -18.307 5.160 809 HZ3 LYS 101 2HZ LYS 101 -10.399 -17.897 6.710 810 H ILE 102 H ILE 102 -4.432 -15.389 6.193 811 HA ILE 102 HA ILE 102 -4.725 -17.701 4.446 812 HB ILE 102 HB ILE 102 -3.389 -15.087 4.573 813 HG12 ILE 102 2HG1 ILE 102 -4.203 -16.628 2.125 814 HG13 ILE 102 1HG1 ILE 102 -5.406 -15.920 3.198 815 HG21 ILE 102 1HG2 ILE 102 -1.857 -15.839 2.600 816 HG22 ILE 102 2HG2 ILE 102 -2.000 -17.438 3.332 817 HG23 ILE 102 3HG2 ILE 102 -1.313 -16.102 4.256 818 HD11 ILE 102 3HD1 ILE 102 -3.285 -14.026 2.602 819 HD12 ILE 102 1HD1 ILE 102 -5.028 -13.850 2.401 820 HD13 ILE 102 2HD1 ILE 102 -4.066 -14.603 1.129 821 H VAL 103 H VAL 103 -2.159 -16.405 6.557 822 HA VAL 103 HA VAL 103 -0.360 -18.626 6.339 823 HB VAL 103 HB VAL 103 -0.954 -16.469 8.381 824 HG11 VAL 103 1HG1 VAL 103 -0.075 -18.573 9.490 825 HG12 VAL 103 2HG1 VAL 103 0.960 -17.158 9.677 826 HG13 VAL 103 3HG1 VAL 103 1.376 -18.406 8.502 827 HG21 VAL 103 3HG2 VAL 103 1.133 -16.979 6.268 828 HG22 VAL 103 1HG2 VAL 103 1.479 -15.895 7.614 829 HG23 VAL 103 2HG2 VAL 103 0.142 -15.542 6.521 830 H SER 104 H SER 104 -3.281 -17.970 8.130 831 HA SER 104 HA SER 104 -3.067 -20.262 9.930 832 HB2 SER 104 2HB SER 104 -4.207 -18.248 10.636 833 HB3 SER 104 1HB SER 104 -5.234 -18.286 9.204 834 HG SER 104 HG SER 104 -5.142 -20.393 11.095 835 H GLU 105 H GLU 105 -5.377 -19.366 7.428 836 HA GLU 105 HA GLU 105 -5.974 -22.267 6.974 837 HB2 GLU 105 2HB GLU 105 -7.460 -19.867 5.890 838 HB3 GLU 105 1HB GLU 105 -8.081 -21.492 6.180 839 HG2 GLU 105 2HG GLU 105 -7.267 -20.856 8.684 840 HG3 GLU 105 1HG GLU 105 -7.682 -19.250 8.083 841 H GLY 106 H GLY 106 -5.173 -19.260 5.267 842 HA2 GLY 106 2HA GLY 106 -3.555 -19.317 3.404 843 HA3 GLY 106 1HA GLY 106 -4.183 -20.911 2.983 844 H SER 107 H SER 107 -6.421 -18.428 3.939 845 HA SER 107 HA SER 107 -7.235 -18.084 1.057 846 HB2 SER 107 2HB SER 107 -8.817 -18.602 3.564 847 HB3 SER 107 1HB SER 107 -9.560 -17.901 2.129 848 HG SER 107 HG SER 107 -8.314 -19.835 1.123 849 H ASP 108 H ASP 108 -7.255 -16.013 0.413 850 HA ASP 108 HA ASP 108 -6.887 -13.861 2.386 851 HB2 ASP 108 2HB ASP 108 -6.780 -12.496 0.265 852 HB3 ASP 108 1HB ASP 108 -5.655 -13.855 0.274 853 H ASP 109 H ASP 109 -9.511 -15.585 1.564 854 HA ASP 109 HA ASP 109 -11.371 -13.357 1.020 855 HB2 ASP 109 2HB ASP 109 -12.890 -15.065 0.557 856 HB3 ASP 109 1HB ASP 109 -11.363 -15.878 0.229 857 H ILE 110 H ILE 110 -12.056 -12.077 2.674 858 HA ILE 110 HA ILE 110 -12.692 -13.356 5.300 859 HB ILE 110 HB ILE 110 -11.646 -11.210 6.290 860 HG12 ILE 110 2HG1 ILE 110 -10.032 -11.150 3.761 861 HG13 ILE 110 1HG1 ILE 110 -11.567 -10.281 3.816 862 HG21 ILE 110 1HG2 ILE 110 -10.577 -13.419 6.476 863 HG22 ILE 110 2HG2 ILE 110 -9.363 -12.170 6.189 864 HG23 ILE 110 3HG2 ILE 110 -9.874 -13.225 4.870 865 HD11 ILE 110 3HD1 ILE 110 -9.804 -8.758 4.500 866 HD12 ILE 110 1HD1 ILE 110 -9.210 -9.918 5.688 867 HD13 ILE 110 2HD1 ILE 110 -10.781 -9.149 5.915 868 H GLY 111 H GLY 111 -14.157 -12.112 2.859 869 HA2 GLY 111 2HA GLY 111 -16.250 -11.032 2.680 870 HA3 GLY 111 1HA GLY 111 -16.215 -10.763 4.423 871 H GLU 112 H GLU 112 -13.300 -9.721 3.215 872 HA GLU 112 HA GLU 112 -13.834 -6.950 3.728 873 HB2 GLU 112 2HB GLU 112 -11.537 -6.701 2.767 874 HB3 GLU 112 1HB GLU 112 -11.641 -7.998 3.960 875 HG2 GLU 112 2HG GLU 112 -10.738 -9.321 2.367 876 HG3 GLU 112 1HG GLU 112 -12.331 -9.269 1.612 877 H ASN 113 H ASN 113 -12.795 -5.458 1.720 878 HA ASN 113 HA ASN 113 -14.195 -6.147 -0.815 879 HB2 ASN 113 2HB ASN 113 -14.741 -3.780 0.992 880 HB3 ASN 113 1HB ASN 113 -15.262 -3.834 -0.693 881 HD21 ASN 113 1HD2 ASN 113 -16.800 -5.614 -1.295 882 HD22 ASN 113 2HD2 ASN 113 -17.795 -6.296 -0.099 883 H ILE 114 H ILE 114 -13.273 -5.081 -2.620 884 HA ILE 114 HA ILE 114 -11.065 -3.141 -2.083 885 HB ILE 114 HB ILE 114 -10.718 -5.315 -4.128 886 HG12 ILE 114 2HG1 ILE 114 -9.456 -6.510 -2.141 887 HG13 ILE 114 1HG1 ILE 114 -10.628 -5.638 -1.148 888 HG21 ILE 114 1HG2 ILE 114 -8.873 -3.745 -2.316 889 HG22 ILE 114 2HG2 ILE 114 -9.063 -3.557 -4.058 890 HG23 ILE 114 3HG2 ILE 114 -8.339 -5.025 -3.402 891 HD11 ILE 114 3HD1 ILE 114 -11.058 -7.850 -3.076 892 HD12 ILE 114 1HD1 ILE 114 -12.271 -6.569 -3.070 893 HD13 ILE 114 2HD1 ILE 114 -11.927 -7.463 -1.589 894 H ASP 115 H ASP 115 -12.310 -4.871 -4.967 895 HA ASP 115 HA ASP 115 -12.127 -2.871 -6.845 896 HB2 ASP 115 2HB ASP 115 -14.234 -3.924 -7.807 897 HB3 ASP 115 1HB ASP 115 -12.967 -5.074 -7.379 898 H VAL 116 H VAL 116 -14.651 -3.278 -4.470 899 HA VAL 116 HA VAL 116 -15.862 -0.683 -5.171 900 HB VAL 116 HB VAL 116 -16.589 -3.016 -3.410 901 HG11 VAL 116 1HG1 VAL 116 -17.727 -0.229 -3.442 902 HG12 VAL 116 2HG1 VAL 116 -17.375 -1.265 -2.059 903 HG13 VAL 116 3HG1 VAL 116 -18.770 -1.607 -3.084 904 HG21 VAL 116 3HG2 VAL 116 -17.327 -1.966 -6.054 905 HG22 VAL 116 1HG2 VAL 116 -18.722 -2.349 -5.044 906 HG23 VAL 116 2HG2 VAL 116 -17.522 -3.591 -5.398 907 H PHE 117 H PHE 117 -14.173 -2.236 -2.518 908 HA PHE 117 HA PHE 117 -14.433 -0.083 -0.621 909 HB2 PHE 117 2HB PHE 117 -13.729 -2.483 -0.208 910 HB3 PHE 117 1HB PHE 117 -12.175 -2.088 -0.941 911 HD1 PHE 117 2HD PHE 117 -14.527 -0.808 1.687 912 HD2 PHE 117 1HD PHE 117 -10.451 -1.325 0.436 913 HE1 PHE 117 2HE PHE 117 -13.745 0.124 3.848 914 HE2 PHE 117 1HE PHE 117 -9.669 -0.392 2.598 915 HZ PHE 117 HZ PHE 117 -11.317 0.333 4.303 916 H SER 118 H SER 118 -12.143 -0.764 -3.223 917 HA SER 118 HA SER 118 -10.463 1.522 -2.538 918 HB2 SER 118 2HB SER 118 -9.038 0.173 -3.661 919 HB3 SER 118 1HB SER 118 -10.370 -0.877 -4.114 920 HG SER 118 HG SER 118 -10.581 0.163 -5.977 921 H ASP 119 H ASP 119 -12.802 0.628 -4.996 922 HA ASP 119 HA ASP 119 -12.624 3.046 -6.518 923 HB2 ASP 119 2HB ASP 119 -14.687 0.876 -6.151 924 HB3 ASP 119 1HB ASP 119 -15.016 2.259 -7.193 925 H THR 120 H THR 120 -13.872 2.367 -3.472 926 HA THR 120 HA THR 120 -15.774 4.611 -3.426 927 HB THR 120 HB THR 120 -15.015 2.254 -1.839 928 HG1 THR 120 1HG THR 120 -17.087 2.041 -1.957 929 HG21 THR 120 3HG2 THR 120 -14.295 3.675 -0.119 930 HG22 THR 120 1HG2 THR 120 -15.982 3.361 0.290 931 HG23 THR 120 2HG2 THR 120 -15.528 4.885 -0.474 932 H ILE 121 H ILE 121 -12.749 3.612 -2.057 933 HA ILE 121 HA ILE 121 -12.140 6.143 -0.764 934 HB ILE 121 HB ILE 121 -11.302 3.412 -0.860 935 HG12 ILE 121 2HG1 ILE 121 -11.955 4.702 1.126 936 HG13 ILE 121 1HG1 ILE 121 -10.354 3.987 1.328 937 HG21 ILE 121 1HG2 ILE 121 -9.008 5.385 -1.015 938 HG22 ILE 121 2HG2 ILE 121 -9.410 4.186 -2.245 939 HG23 ILE 121 3HG2 ILE 121 -8.869 3.664 -0.650 940 HD11 ILE 121 3HD1 ILE 121 -10.609 6.464 1.992 941 HD12 ILE 121 1HD1 ILE 121 -10.709 6.789 0.262 942 HD13 ILE 121 2HD1 ILE 121 -9.255 6.054 0.938 943 H LYS 122 H LYS 122 -11.242 4.588 -3.862 944 HA LYS 122 HA LYS 122 -9.226 6.635 -4.423 945 HB2 LYS 122 2HB LYS 122 -8.617 4.988 -5.840 946 HB3 LYS 122 1HB LYS 122 -9.952 4.038 -5.200 947 HG2 LYS 122 2HG LYS 122 -11.387 5.351 -6.950 948 HG3 LYS 122 1HG LYS 122 -9.826 5.650 -7.730 949 HD2 LYS 122 2HD LYS 122 -10.841 2.931 -6.888 950 HD3 LYS 122 1HD LYS 122 -10.892 3.548 -8.547 951 HE2 LYS 122 2HE LYS 122 -8.236 3.878 -7.388 952 HE3 LYS 122 1HE LYS 122 -8.747 2.176 -7.360 953 HZ1 LYS 122 3HZ LYS 122 -9.281 3.814 -9.746 954 HZ2 LYS 122 1HZ LYS 122 -9.081 2.134 -9.624 955 HZ3 LYS 122 2HZ LYS 122 -7.729 3.159 -9.523 956 H SER 123 H SER 123 -12.606 6.046 -4.989 957 HA SER 123 HA SER 123 -12.870 8.286 -6.886 958 HB2 SER 123 2HB SER 123 -14.859 6.535 -5.424 959 HB3 SER 123 1HB SER 123 -15.273 7.666 -6.705 960 HG SER 123 HG SER 123 -13.244 5.856 -7.262 961 H PHE 124 H PHE 124 -12.529 7.789 -3.586 962 HA PHE 124 HA PHE 124 -14.352 9.787 -2.542 963 HB2 PHE 124 2HB PHE 124 -13.248 7.886 -1.304 964 HB3 PHE 124 1HB PHE 124 -11.727 8.771 -1.420 965 HD1 PHE 124 1HD PHE 124 -15.158 8.841 -0.010 966 HD2 PHE 124 2HD PHE 124 -11.281 10.695 -0.046 967 HE1 PHE 124 1HE PHE 124 -15.779 10.182 1.982 968 HE2 PHE 124 2HE PHE 124 -11.904 12.033 1.946 969 HZ PHE 124 HZ PHE 124 -14.154 11.778 2.959 970 H ALA 125 H ALA 125 -11.689 10.093 -4.507 971 HA ALA 125 HA ALA 125 -10.235 12.300 -3.450 972 HB1 ALA 125 1HB ALA 125 -10.830 11.990 -6.379 973 HB2 ALA 125 2HB ALA 125 -9.952 10.709 -5.544 974 HB3 ALA 125 3HB ALA 125 -9.292 12.342 -5.591 975 H SER 126 H SER 126 -13.229 12.151 -5.346 976 HA SER 126 HA SER 126 -14.062 14.775 -4.398 977 HB2 SER 126 2HB SER 126 -14.108 15.248 -7.137 978 HB3 SER 126 1HB SER 126 -12.932 15.910 -6.005 979 HG SER 126 HG SER 126 -12.368 14.424 -7.995 980 H SER 127 H SER 127 -15.146 12.061 -4.482 981 HA SER 127 HA SER 127 -17.778 12.673 -5.635 982 HB2 SER 127 2HB SER 127 -17.123 11.824 -7.654 983 HB3 SER 127 1HB SER 127 -15.726 11.009 -6.959 984 HG SER 127 HG SER 127 -17.476 9.630 -7.765 985 H GLY 128 H GLY 128 -19.337 10.869 -5.125 986 HA2 GLY 128 2HA GLY 128 -19.344 8.569 -3.913 987 HA3 GLY 128 1HA GLY 128 -18.479 9.441 -2.647 988 H LYS 129 H LYS 129 -20.130 9.227 -1.078 989 HA LYS 129 HA LYS 129 -22.803 10.373 -1.743 990 HB2 LYS 129 2HB LYS 129 -23.515 9.192 0.251 991 HB3 LYS 129 1HB LYS 129 -22.491 8.096 -0.679 992 HG2 LYS 129 2HG LYS 129 -20.548 8.763 0.730 993 HG3 LYS 129 1HG LYS 129 -21.627 9.767 1.700 994 HD2 LYS 129 2HD LYS 129 -21.502 7.735 2.904 995 HD3 LYS 129 1HD LYS 129 -23.026 7.616 2.021 996 HE2 LYS 129 2HE LYS 129 -21.026 6.629 0.267 997 HE3 LYS 129 1HE LYS 129 -20.729 5.880 1.848 998 HZ1 LYS 129 3HZ LYS 129 -22.384 4.549 0.943 999 HZ2 LYS 129 1HZ LYS 129 -23.198 5.854 0.229 1000 HZ3 LYS 129 2HZ LYS 129 -23.267 5.629 1.912 1001 H GLU 130 H GLU 130 -19.967 11.602 -0.790 1002 HA GLU 130 HA GLU 130 -21.151 13.395 1.300 1003 HB2 GLU 130 2HB GLU 130 -18.719 11.896 1.060 1004 HB3 GLU 130 1HB GLU 130 -18.309 13.612 1.092 1005 HG2 GLU 130 2HG GLU 130 -20.307 13.316 3.037 1006 HG3 GLU 130 1HG GLU 130 -19.255 11.918 3.252 1007 H LYS 131 H LYS 131 -21.525 15.471 0.633 1008 HA LYS 131 HA LYS 131 -20.259 16.396 -1.909 1009 HB2 LYS 131 2HB LYS 131 -22.860 16.361 -0.948 1010 HB3 LYS 131 1HB LYS 131 -22.361 18.029 -0.670 1011 HG2 LYS 131 2HG LYS 131 -21.494 18.015 -3.082 1012 HG3 LYS 131 1HG LYS 131 -22.395 16.511 -3.284 1013 HD2 LYS 131 2HD LYS 131 -24.356 17.942 -2.201 1014 HD3 LYS 131 1HD LYS 131 -23.416 19.288 -2.847 1015 HE2 LYS 131 2HE LYS 131 -23.508 17.306 -4.888 1016 HE3 LYS 131 1HE LYS 131 -25.162 17.510 -4.276 1017 HZ1 LYS 131 3HZ LYS 131 -24.551 19.172 -5.987 1018 HZ2 LYS 131 1HZ LYS 131 -23.338 19.754 -4.955 1019 HZ3 LYS 131 2HZ LYS 131 -24.970 19.872 -4.497 1020 H LEU 132 H LEU 132 -18.732 16.402 0.579 1021 HA LEU 132 HA LEU 132 -17.526 17.885 1.992 1022 HB2 LEU 132 2HB LEU 132 -17.798 19.607 -0.490 1023 HB3 LEU 132 1HB LEU 132 -16.448 19.576 0.645 1024 HG LEU 132 HG LEU 132 -16.819 16.909 -0.228 1025 HD11 LEU 132 1HD1 LEU 132 -16.172 18.088 -2.747 1026 HD12 LEU 132 2HD1 LEU 132 -17.707 18.769 -2.211 1027 HD13 LEU 132 3HD1 LEU 132 -17.523 17.022 -2.359 1028 HD21 LEU 132 3HD2 LEU 132 -14.784 19.088 -0.539 1029 HD22 LEU 132 1HD2 LEU 132 -14.591 17.616 -1.490 1030 HD23 LEU 132 2HD2 LEU 132 -14.637 17.528 0.271 1031 H GLU 133 H GLU 133 -19.618 18.208 3.294 1032 HA GLU 133 HA GLU 133 -21.182 20.626 2.813 1033 HB2 GLU 133 2HB GLU 133 -20.960 18.493 4.926 1034 HB3 GLU 133 1HB GLU 133 -21.941 19.928 5.223 1035 HG2 GLU 133 2HG GLU 133 -22.412 18.770 2.577 1036 HG3 GLU 133 1HG GLU 133 -22.788 17.651 3.886 Start of MODEL 22 1 H1 MET 1 1HT MET 1 7.337 -31.013 -1.533 2 H2 MET 1 2HT MET 1 6.760 -30.870 0.058 3 H3 MET 1 3HT MET 1 8.064 -31.903 -0.286 4 HA MET 1 HA MET 1 8.497 -29.548 0.739 5 HB2 MET 1 2HB MET 1 9.870 -31.217 -1.336 6 HB3 MET 1 1HB MET 1 10.613 -29.684 -0.877 7 HG2 MET 1 2HG MET 1 11.021 -30.370 1.294 8 HG3 MET 1 1HG MET 1 9.668 -31.501 1.301 9 HE1 MET 1 2HE MET 1 12.964 -30.596 0.945 10 HE2 MET 1 3HE MET 1 13.881 -31.748 -0.022 11 HE3 MET 1 1HE MET 1 13.526 -32.096 1.676 12 H MET 2 H MET 2 6.329 -28.773 -0.821 13 HA MET 2 HA MET 2 7.567 -26.724 -2.627 14 HB2 MET 2 2HB MET 2 6.345 -28.849 -3.605 15 HB3 MET 2 1HB MET 2 4.883 -27.962 -3.169 16 HG2 MET 2 2HG MET 2 5.221 -26.350 -4.764 17 HG3 MET 2 1HG MET 2 6.977 -26.426 -4.619 18 HE1 MET 2 3HE MET 2 7.464 -27.190 -7.924 19 HE2 MET 2 1HE MET 2 6.938 -25.926 -6.804 20 HE3 MET 2 2HE MET 2 5.806 -26.594 -7.978 21 H GLU 3 H GLU 3 6.589 -26.625 0.217 22 HA GLU 3 HA GLU 3 4.246 -24.789 -0.086 23 HB2 GLU 3 2HB GLU 3 4.023 -25.214 2.361 24 HB3 GLU 3 1HB GLU 3 3.967 -26.710 1.422 25 HG2 GLU 3 2HG GLU 3 6.093 -27.366 2.108 26 HG3 GLU 3 1HG GLU 3 6.613 -25.706 2.419 27 H GLU 4 H GLU 4 7.561 -24.734 0.241 28 HA GLU 4 HA GLU 4 7.783 -22.624 2.195 29 HB2 GLU 4 2HB GLU 4 9.540 -24.310 1.640 30 HB3 GLU 4 1HB GLU 4 9.715 -23.561 0.053 31 HG2 GLU 4 2HG GLU 4 10.127 -21.363 1.368 32 HG3 GLU 4 1HG GLU 4 10.410 -22.419 2.753 33 H TYR 5 H TYR 5 6.678 -22.643 -0.950 34 HA TYR 5 HA TYR 5 7.778 -20.149 -1.923 35 HB2 TYR 5 2HB TYR 5 6.216 -22.302 -2.848 36 HB3 TYR 5 1HB TYR 5 5.200 -20.872 -3.020 37 HD1 TYR 5 2HD TYR 5 8.843 -21.687 -3.453 38 HD2 TYR 5 1HD TYR 5 5.328 -19.848 -5.100 39 HE1 TYR 5 2HE TYR 5 10.137 -21.006 -5.456 40 HE2 TYR 5 1HE TYR 5 6.622 -19.168 -7.102 41 HH TYR 5 HH TYR 5 9.995 -19.247 -7.225 42 H LEU 6 H LEU 6 4.931 -21.099 -0.174 43 HA LEU 6 HA LEU 6 3.812 -18.364 -0.147 44 HB2 LEU 6 2HB LEU 6 1.937 -19.453 0.925 45 HB3 LEU 6 1HB LEU 6 2.492 -20.526 -0.361 46 HG LEU 6 HG LEU 6 4.033 -21.468 1.603 47 HD11 LEU 6 1HD1 LEU 6 1.998 -21.429 3.502 48 HD12 LEU 6 2HD1 LEU 6 2.072 -19.763 2.928 49 HD13 LEU 6 3HD1 LEU 6 3.514 -20.533 3.588 50 HD21 LEU 6 3HD2 LEU 6 2.259 -22.648 0.215 51 HD22 LEU 6 1HD2 LEU 6 1.094 -22.189 1.456 52 HD23 LEU 6 2HD2 LEU 6 2.439 -23.254 1.862 53 H GLY 7 H GLY 7 5.678 -20.522 1.884 54 HA2 GLY 7 2HA GLY 7 5.229 -19.311 4.418 55 HA3 GLY 7 1HA GLY 7 6.694 -20.187 3.970 56 H VAL 8 H VAL 8 7.612 -18.551 1.866 57 HA VAL 8 HA VAL 8 8.660 -16.287 3.418 58 HB VAL 8 HB VAL 8 9.171 -17.420 0.664 59 HG11 VAL 8 1HG1 VAL 8 11.306 -15.759 1.380 60 HG12 VAL 8 2HG1 VAL 8 9.865 -14.828 1.788 61 HG13 VAL 8 3HG1 VAL 8 10.091 -15.428 0.146 62 HG21 VAL 8 3HG2 VAL 8 11.316 -18.099 1.683 63 HG22 VAL 8 1HG2 VAL 8 9.955 -18.771 2.581 64 HG23 VAL 8 2HG2 VAL 8 10.821 -17.370 3.211 65 H PHE 9 H PHE 9 6.471 -16.868 0.803 66 HA PHE 9 HA PHE 9 6.212 -14.315 -0.367 67 HB2 PHE 9 2HB PHE 9 5.049 -16.116 -1.349 68 HB3 PHE 9 1HB PHE 9 4.356 -16.622 0.189 69 HD1 PHE 9 1HD PHE 9 4.491 -13.214 -1.351 70 HD2 PHE 9 2HD PHE 9 2.024 -16.507 -0.116 71 HE1 PHE 9 1HE PHE 9 2.461 -11.869 -1.816 72 HE2 PHE 9 2HE PHE 9 -0.006 -15.160 -0.580 73 HZ PHE 9 HZ PHE 9 0.213 -12.841 -1.430 74 H VAL 10 H VAL 10 4.876 -15.565 2.673 75 HA VAL 10 HA VAL 10 3.392 -13.056 3.175 76 HB VAL 10 HB VAL 10 3.822 -15.492 4.932 77 HG11 VAL 10 1HG1 VAL 10 1.248 -14.295 5.186 78 HG12 VAL 10 2HG1 VAL 10 2.444 -13.001 5.274 79 HG13 VAL 10 3HG1 VAL 10 2.535 -14.363 6.391 80 HG21 VAL 10 3HG2 VAL 10 2.228 -16.642 3.762 81 HG22 VAL 10 1HG2 VAL 10 2.722 -15.590 2.437 82 HG23 VAL 10 2HG2 VAL 10 1.303 -15.185 3.400 83 H ASP 11 H ASP 11 6.096 -14.893 4.663 84 HA ASP 11 HA ASP 11 6.720 -13.132 6.762 85 HB2 ASP 11 2HB ASP 11 7.689 -15.432 6.055 86 HB3 ASP 11 1HB ASP 11 8.790 -14.493 5.045 87 H GLU 12 H GLU 12 7.287 -12.838 3.375 88 HA GLU 12 HA GLU 12 9.027 -10.465 3.680 89 HB2 GLU 12 2HB GLU 12 9.342 -10.713 1.324 90 HB3 GLU 12 1HB GLU 12 9.261 -12.358 1.955 91 HG2 GLU 12 2HG GLU 12 6.878 -12.482 1.359 92 HG3 GLU 12 1HG GLU 12 6.945 -10.831 0.741 93 H THR 13 H THR 13 5.769 -11.335 2.578 94 HA THR 13 HA THR 13 4.953 -8.739 1.677 95 HB THR 13 HB THR 13 3.756 -11.353 2.464 96 HG1 THR 13 1HG THR 13 3.164 -11.300 0.409 97 HG21 THR 13 3HG2 THR 13 2.062 -10.257 3.576 98 HG22 THR 13 1HG2 THR 13 1.455 -10.105 1.926 99 HG23 THR 13 2HG2 THR 13 2.302 -8.755 2.682 100 H LYS 14 H LYS 14 5.262 -10.179 4.849 101 HA LYS 14 HA LYS 14 3.639 -8.143 6.217 102 HB2 LYS 14 2HB LYS 14 5.581 -10.250 7.229 103 HB3 LYS 14 1HB LYS 14 4.402 -9.381 8.212 104 HG2 LYS 14 2HG LYS 14 2.601 -10.531 7.320 105 HG3 LYS 14 1HG LYS 14 3.427 -10.849 5.793 106 HD2 LYS 14 2HD LYS 14 3.979 -12.890 6.561 107 HD3 LYS 14 1HD LYS 14 4.955 -12.120 7.812 108 HE2 LYS 14 2HE LYS 14 2.760 -11.859 9.140 109 HE3 LYS 14 1HE LYS 14 2.071 -13.019 7.988 110 HZ1 LYS 14 3HZ LYS 14 3.732 -13.565 10.168 111 HZ2 LYS 14 1HZ LYS 14 4.625 -13.907 8.766 112 HZ3 LYS 14 2HZ LYS 14 3.124 -14.659 9.023 113 H GLU 15 H GLU 15 7.125 -8.974 6.033 114 HA GLU 15 HA GLU 15 8.032 -6.749 7.590 115 HB2 GLU 15 2HB GLU 15 9.287 -8.465 5.432 116 HB3 GLU 15 1HB GLU 15 10.206 -7.302 6.388 117 HG2 GLU 15 2HG GLU 15 8.510 -9.088 7.997 118 HG3 GLU 15 1HG GLU 15 9.778 -9.925 7.103 119 H TYR 16 H TYR 16 6.704 -6.933 4.496 120 HA TYR 16 HA TYR 16 7.994 -4.501 3.447 121 HB2 TYR 16 2HB TYR 16 6.571 -6.828 2.467 122 HB3 TYR 16 1HB TYR 16 5.855 -5.358 1.812 123 HD1 TYR 16 2HD TYR 16 8.209 -3.561 1.694 124 HD2 TYR 16 1HD TYR 16 7.824 -7.715 0.674 125 HE1 TYR 16 2HE TYR 16 10.097 -3.345 0.102 126 HE2 TYR 16 1HE TYR 16 9.712 -7.500 -0.920 127 HH TYR 16 HH TYR 16 11.884 -5.522 -0.935 128 H LEU 17 H LEU 17 4.700 -5.613 4.349 129 HA LEU 17 HA LEU 17 3.356 -3.161 3.843 130 HB2 LEU 17 2HB LEU 17 1.578 -4.181 5.003 131 HB3 LEU 17 1HB LEU 17 2.529 -5.567 4.474 132 HG LEU 17 HG LEU 17 3.746 -5.288 6.775 133 HD11 LEU 17 1HD1 LEU 17 2.977 -3.530 7.974 134 HD12 LEU 17 2HD1 LEU 17 1.525 -4.493 8.251 135 HD13 LEU 17 3HD1 LEU 17 1.574 -3.335 6.923 136 HD21 LEU 17 3HD2 LEU 17 2.497 -7.076 7.455 137 HD22 LEU 17 1HD2 LEU 17 1.755 -6.927 5.862 138 HD23 LEU 17 2HD2 LEU 17 0.976 -6.205 7.269 139 H GLN 18 H GLN 18 5.278 -4.240 6.597 140 HA GLN 18 HA GLN 18 4.633 -1.958 8.269 141 HB2 GLN 18 2HB GLN 18 5.456 -3.523 9.661 142 HB3 GLN 18 1HB GLN 18 6.089 -4.438 8.301 143 HG2 GLN 18 2HG GLN 18 7.966 -3.869 9.676 144 HG3 GLN 18 1HG GLN 18 8.032 -2.825 8.259 145 HE21 GLN 18 1HE2 GLN 18 6.286 -2.692 11.424 146 HE22 GLN 18 2HE2 GLN 18 6.723 -1.086 11.759 147 H ASN 19 H ASN 19 7.233 -2.950 6.169 148 HA ASN 19 HA ASN 19 8.837 -0.572 6.412 149 HB2 ASN 19 2HB ASN 19 9.160 -3.016 5.313 150 HB3 ASN 19 1HB ASN 19 8.669 -2.140 3.867 151 HD21 ASN 19 1HD2 ASN 19 9.963 -0.025 3.463 152 HD22 ASN 19 2HD2 ASN 19 11.613 -0.043 3.860 153 H LEU 20 H LEU 20 5.962 -1.471 4.804 154 HA LEU 20 HA LEU 20 5.937 0.904 3.054 155 HB2 LEU 20 2HB LEU 20 5.086 -1.050 2.017 156 HB3 LEU 20 1HB LEU 20 4.233 -1.547 3.478 157 HG LEU 20 HG LEU 20 2.728 0.427 3.226 158 HD11 LEU 20 1HD1 LEU 20 3.196 2.068 1.762 159 HD12 LEU 20 2HD1 LEU 20 3.301 0.915 0.432 160 HD13 LEU 20 3HD1 LEU 20 4.723 1.252 1.418 161 HD21 LEU 20 3HD2 LEU 20 1.412 -0.513 1.412 162 HD22 LEU 20 1HD2 LEU 20 2.176 -1.840 2.285 163 HD23 LEU 20 2HD2 LEU 20 2.837 -1.308 0.739 164 H ASN 21 H ASN 21 5.048 0.013 6.203 165 HA ASN 21 HA ASN 21 2.909 2.037 6.354 166 HB2 ASN 21 2HB ASN 21 2.145 0.601 7.923 167 HB3 ASN 21 1HB ASN 21 3.552 -0.423 7.667 168 HD21 ASN 21 1HD2 ASN 21 5.123 -0.475 9.342 169 HD22 ASN 21 2HD2 ASN 21 5.052 0.496 10.732 170 H ASP 22 H ASP 22 6.201 1.369 7.011 171 HA ASP 22 HA ASP 22 6.639 3.563 8.767 172 HB2 ASP 22 2HB ASP 22 8.052 1.408 8.266 173 HB3 ASP 22 1HB ASP 22 8.730 2.391 6.968 174 H THR 23 H THR 23 6.641 2.991 5.429 175 HA THR 23 HA THR 23 7.663 5.588 4.568 176 HB THR 23 HB THR 23 6.046 3.384 3.306 177 HG1 THR 23 1HG THR 23 8.152 2.835 4.152 178 HG21 THR 23 3HG2 THR 23 7.380 5.833 2.204 179 HG22 THR 23 1HG2 THR 23 5.815 5.130 1.790 180 HG23 THR 23 2HG2 THR 23 7.300 4.379 1.206 181 H LEU 24 H LEU 24 4.496 3.995 4.888 182 HA LEU 24 HA LEU 24 3.076 6.362 3.913 183 HB2 LEU 24 2HB LEU 24 1.412 4.857 3.577 184 HB3 LEU 24 1HB LEU 24 2.628 3.645 3.945 185 HG LEU 24 HG LEU 24 1.955 3.993 6.416 186 HD11 LEU 24 1HD1 LEU 24 0.168 5.308 6.912 187 HD12 LEU 24 2HD1 LEU 24 -0.740 4.758 5.504 188 HD13 LEU 24 3HD1 LEU 24 0.463 6.039 5.333 189 HD21 LEU 24 3HD2 LEU 24 0.951 2.354 4.324 190 HD22 LEU 24 1HD2 LEU 24 -0.434 2.821 5.312 191 HD23 LEU 24 2HD2 LEU 24 0.945 2.011 6.056 192 H LEU 25 H LEU 25 3.937 4.887 7.025 193 HA LEU 25 HA LEU 25 2.069 6.652 8.456 194 HB2 LEU 25 2HB LEU 25 2.842 5.594 10.396 195 HB3 LEU 25 1HB LEU 25 2.966 4.357 9.154 196 HG LEU 25 HG LEU 25 5.338 5.285 8.807 197 HD11 LEU 25 1HD1 LEU 25 5.550 5.876 11.648 198 HD12 LEU 25 2HD1 LEU 25 4.466 7.005 10.835 199 HD13 LEU 25 3HD1 LEU 25 6.127 6.816 10.272 200 HD21 LEU 25 3HD2 LEU 25 4.465 3.677 11.224 201 HD22 LEU 25 1HD2 LEU 25 6.148 3.805 10.713 202 HD23 LEU 25 2HD2 LEU 25 4.958 3.050 9.651 203 H GLU 26 H GLU 26 5.136 6.902 7.136 204 HA GLU 26 HA GLU 26 5.882 9.268 8.756 205 HB2 GLU 26 2HB GLU 26 7.189 7.640 6.561 206 HB3 GLU 26 1HB GLU 26 7.883 9.155 7.141 207 HG2 GLU 26 2HG GLU 26 7.918 8.222 9.450 208 HG3 GLU 26 1HG GLU 26 7.326 6.688 8.813 209 H LEU 27 H LEU 27 4.549 8.171 5.827 210 HA LEU 27 HA LEU 27 4.721 10.484 4.229 211 HB2 LEU 27 2HB LEU 27 4.150 8.412 3.214 212 HB3 LEU 27 1HB LEU 27 2.920 8.089 4.429 213 HG LEU 27 HG LEU 27 1.640 10.074 3.529 214 HD11 LEU 27 1HD1 LEU 27 3.759 10.962 2.356 215 HD12 LEU 27 2HD1 LEU 27 2.255 11.023 1.435 216 HD13 LEU 27 3HD1 LEU 27 3.433 9.750 1.118 217 HD21 LEU 27 3HD2 LEU 27 2.154 7.496 2.130 218 HD22 LEU 27 1HD2 LEU 27 1.241 8.711 1.236 219 HD23 LEU 27 2HD2 LEU 27 0.650 8.134 2.794 220 H GLU 28 H GLU 28 2.545 9.435 6.782 221 HA GLU 28 HA GLU 28 0.456 11.366 6.413 222 HB2 GLU 28 2HB GLU 28 1.475 10.173 9.005 223 HB3 GLU 28 1HB GLU 28 -0.178 10.668 8.631 224 HG2 GLU 28 2HG GLU 28 0.157 8.909 6.643 225 HG3 GLU 28 1HG GLU 28 1.304 8.218 7.793 226 H LYS 29 H LYS 29 3.514 11.382 8.215 227 HA LYS 29 HA LYS 29 3.069 14.100 9.215 228 HB2 LYS 29 2HB LYS 29 5.588 12.417 9.202 229 HB3 LYS 29 1HB LYS 29 5.212 13.753 10.291 230 HG2 LYS 29 2HG LYS 29 3.841 12.477 11.602 231 HG3 LYS 29 1HG LYS 29 3.241 11.536 10.236 232 HD2 LYS 29 2HD LYS 29 4.622 10.153 11.747 233 HD3 LYS 29 1HD LYS 29 5.342 10.292 10.144 234 HE2 LYS 29 2HE LYS 29 7.175 11.365 10.950 235 HE3 LYS 29 1HE LYS 29 6.192 12.431 11.973 236 HZ1 LYS 29 3HZ LYS 29 7.532 10.864 13.289 237 HZ2 LYS 29 1HZ LYS 29 6.741 9.565 12.539 238 HZ3 LYS 29 2HZ LYS 29 5.865 10.636 13.526 239 H ASN 30 H ASN 30 4.341 12.532 6.494 240 HA ASN 30 HA ASN 30 5.157 15.131 5.316 241 HB2 ASN 30 2HB ASN 30 6.842 12.745 5.911 242 HB3 ASN 30 1HB ASN 30 7.084 13.474 4.323 243 HD21 ASN 30 1HD2 ASN 30 9.184 14.375 4.879 244 HD22 ASN 30 2HD2 ASN 30 9.342 15.659 5.978 245 HA PRO 31 HA PRO 31 2.636 12.570 2.600 246 HB2 PRO 31 2HB PRO 31 0.440 14.157 2.644 247 HB3 PRO 31 1HB PRO 31 0.792 12.963 3.900 248 HG2 PRO 31 2HG PRO 31 0.916 15.877 4.030 249 HG3 PRO 31 1HG PRO 31 0.753 14.687 5.328 250 HD2 PRO 31 2HD PRO 31 3.117 16.052 4.456 251 HD3 PRO 31 1HD PRO 31 2.943 14.877 5.781 252 H GLU 32 H GLU 32 4.386 15.255 2.325 253 HA GLU 32 HA GLU 32 3.452 15.801 -0.459 254 HB2 GLU 32 2HB GLU 32 4.495 18.191 0.770 255 HB3 GLU 32 1HB GLU 32 2.881 17.917 0.122 256 HG2 GLU 32 2HG GLU 32 2.077 17.081 2.223 257 HG3 GLU 32 1HG GLU 32 3.715 16.981 2.877 258 H ASP 33 H ASP 33 5.884 14.757 1.470 259 HA ASP 33 HA ASP 33 8.168 16.158 0.464 260 HB2 ASP 33 2HB ASP 33 7.582 13.608 1.901 261 HB3 ASP 33 1HB ASP 33 9.204 13.844 1.249 262 H MET 34 H MET 34 6.089 13.885 -0.906 263 HA MET 34 HA MET 34 6.064 12.817 -2.996 264 HB2 MET 34 2HB MET 34 7.976 15.055 -3.166 265 HB3 MET 34 1HB MET 34 8.287 13.774 -4.338 266 HG2 MET 34 2HG MET 34 5.524 14.920 -3.919 267 HG3 MET 34 1HG MET 34 6.665 15.629 -5.063 268 HE1 MET 34 3HE MET 34 5.277 14.700 -7.716 269 HE2 MET 34 1HE MET 34 4.619 15.408 -6.234 270 HE3 MET 34 2HE MET 34 3.891 13.957 -6.921 271 H GLU 35 H GLU 35 8.176 12.278 -0.614 272 HA GLU 35 HA GLU 35 9.744 10.246 -2.121 273 HB2 GLU 35 2HB GLU 35 10.135 11.908 0.339 274 HB3 GLU 35 1HB GLU 35 10.881 10.309 0.316 275 HG2 GLU 35 2HG GLU 35 11.751 10.992 -2.032 276 HG3 GLU 35 1HG GLU 35 11.374 12.638 -1.526 277 H LEU 36 H LEU 36 7.727 10.855 0.729 278 HA LEU 36 HA LEU 36 7.498 8.000 1.370 279 HB2 LEU 36 2HB LEU 36 5.773 10.350 2.236 280 HB3 LEU 36 1HB LEU 36 5.944 8.807 3.065 281 HG LEU 36 HG LEU 36 7.857 11.105 2.931 282 HD11 LEU 36 1HD1 LEU 36 6.473 10.846 4.908 283 HD12 LEU 36 2HD1 LEU 36 8.139 10.448 5.327 284 HD13 LEU 36 3HD1 LEU 36 6.963 9.159 5.070 285 HD21 LEU 36 3HD2 LEU 36 8.571 8.197 2.916 286 HD22 LEU 36 1HD2 LEU 36 9.496 9.270 3.966 287 HD23 LEU 36 2HD2 LEU 36 9.445 9.565 2.228 288 H ILE 37 H ILE 37 6.030 10.296 -0.769 289 HA ILE 37 HA ILE 37 3.525 8.812 -1.146 290 HB ILE 37 HB ILE 37 4.945 11.047 -2.640 291 HG12 ILE 37 2HG1 ILE 37 2.684 10.973 -0.622 292 HG13 ILE 37 1HG1 ILE 37 4.250 11.770 -0.451 293 HG21 ILE 37 1HG2 ILE 37 2.791 9.387 -3.492 294 HG22 ILE 37 2HG2 ILE 37 3.420 10.835 -4.281 295 HG23 ILE 37 3HG2 ILE 37 2.115 10.968 -3.101 296 HD11 ILE 37 3HD1 ILE 37 1.839 12.830 -1.572 297 HD12 ILE 37 1HD1 ILE 37 3.048 12.732 -2.853 298 HD13 ILE 37 2HD1 ILE 37 3.398 13.633 -1.378 299 H ASN 38 H ASN 38 6.728 9.053 -2.624 300 HA ASN 38 HA ASN 38 5.967 7.221 -4.809 301 HB2 ASN 38 2HB ASN 38 7.435 9.254 -5.094 302 HB3 ASN 38 1HB ASN 38 8.639 8.454 -4.084 303 HD21 ASN 38 1HD2 ASN 38 7.771 8.926 -7.291 304 HD22 ASN 38 2HD2 ASN 38 8.537 7.573 -7.974 305 H GLU 39 H GLU 39 7.689 7.249 -1.799 306 HA GLU 39 HA GLU 39 8.960 4.660 -2.119 307 HB2 GLU 39 2HB GLU 39 8.339 6.527 0.170 308 HB3 GLU 39 1HB GLU 39 9.094 4.959 0.458 309 HG2 GLU 39 2HG GLU 39 10.279 6.670 -1.676 310 HG3 GLU 39 1HG GLU 39 10.552 7.159 -0.003 311 H ALA 40 H ALA 40 5.869 5.817 -1.252 312 HA ALA 40 HA ALA 40 4.944 3.317 0.009 313 HB1 ALA 40 1HB ALA 40 3.433 5.787 -0.903 314 HB2 ALA 40 2HB ALA 40 4.250 5.659 0.655 315 HB3 ALA 40 3HB ALA 40 2.895 4.596 0.282 316 H PHE 41 H PHE 41 4.137 5.227 -2.940 317 HA PHE 41 HA PHE 41 2.370 3.399 -4.155 318 HB2 PHE 41 2HB PHE 41 2.565 5.492 -5.175 319 HB3 PHE 41 1HB PHE 41 4.324 5.491 -5.067 320 HD1 PHE 41 1HD PHE 41 5.690 4.230 -6.682 321 HD2 PHE 41 2HD PHE 41 1.410 4.393 -7.016 322 HE1 PHE 41 1HE PHE 41 5.840 3.374 -9.003 323 HE2 PHE 41 2HE PHE 41 1.561 3.536 -9.340 324 HZ PHE 41 HZ PHE 41 3.776 3.027 -10.332 325 H ARG 42 H ARG 42 5.947 3.469 -4.260 326 HA ARG 42 HA ARG 42 6.232 1.296 -6.121 327 HB2 ARG 42 2HB ARG 42 8.504 1.600 -5.702 328 HB3 ARG 42 1HB ARG 42 7.863 3.154 -5.181 329 HG2 ARG 42 2HG ARG 42 7.890 2.450 -2.858 330 HG3 ARG 42 1HG ARG 42 8.353 0.811 -3.322 331 HD2 ARG 42 2HD ARG 42 10.145 2.903 -4.384 332 HD3 ARG 42 1HD ARG 42 10.156 2.750 -2.615 333 HE ARG 42 HE ARG 42 10.921 0.631 -4.534 334 HH11 ARG 42 1HH1 ARG 42 12.129 1.767 -1.826 335 HH12 ARG 42 2HH1 ARG 42 12.002 0.337 -0.856 336 HH21 ARG 42 1HH2 ARG 42 9.894 -1.299 -3.071 337 HH22 ARG 42 2HH2 ARG 42 10.737 -1.398 -1.561 338 H ALA 43 H ALA 43 6.383 1.374 -2.539 339 HA ALA 43 HA ALA 43 6.871 -1.378 -2.085 340 HB1 ALA 43 1HB ALA 43 5.877 0.976 -0.665 341 HB2 ALA 43 2HB ALA 43 6.893 -0.336 -0.069 342 HB3 ALA 43 3HB ALA 43 5.138 -0.512 -0.073 343 H LEU 44 H LEU 44 3.724 0.318 -2.300 344 HA LEU 44 HA LEU 44 2.117 -2.054 -2.111 345 HB2 LEU 44 2HB LEU 44 1.748 0.741 -3.207 346 HB3 LEU 44 1HB LEU 44 0.435 -0.439 -3.205 347 HG LEU 44 HG LEU 44 1.956 -0.021 -0.672 348 HD11 LEU 44 1HD1 LEU 44 1.555 2.261 -1.238 349 HD12 LEU 44 2HD1 LEU 44 0.258 1.811 -0.131 350 HD13 LEU 44 3HD1 LEU 44 -0.052 1.897 -1.865 351 HD21 LEU 44 3HD2 LEU 44 -0.847 -0.766 -1.510 352 HD22 LEU 44 1HD2 LEU 44 -0.488 -0.294 0.151 353 HD23 LEU 44 2HD2 LEU 44 0.299 -1.706 -0.554 354 H HIS 45 H HIS 45 3.569 -0.295 -4.826 355 HA HIS 45 HA HIS 45 2.310 -1.766 -6.949 356 HB2 HIS 45 2HB HIS 45 3.548 0.430 -7.071 357 HB3 HIS 45 1HB HIS 45 5.049 -0.459 -6.821 358 HD1 HIS 45 1HD HIS 45 6.142 -1.394 -8.870 359 HD2 HIS 45 2HD HIS 45 2.128 -0.487 -9.539 360 HE1 HIS 45 1HE HIS 45 5.722 -1.781 -11.337 361 H THR 46 H THR 46 5.195 -2.250 -4.976 362 HA THR 46 HA THR 46 6.064 -4.621 -6.458 363 HB THR 46 HB THR 46 7.016 -2.778 -4.425 364 HG1 THR 46 1HG THR 46 8.190 -4.726 -6.103 365 HG21 THR 46 3HG2 THR 46 7.177 -5.715 -3.789 366 HG22 THR 46 1HG2 THR 46 6.854 -4.360 -2.706 367 HG23 THR 46 2HG2 THR 46 8.486 -4.631 -3.318 368 H LEU 47 H LEU 47 4.393 -3.877 -3.414 369 HA LEU 47 HA LEU 47 4.142 -6.618 -2.518 370 HB2 LEU 47 2HB LEU 47 3.300 -3.892 -1.788 371 HB3 LEU 47 1HB LEU 47 2.117 -5.129 -1.351 372 HG LEU 47 HG LEU 47 5.015 -5.600 -0.746 373 HD11 LEU 47 1HD1 LEU 47 3.900 -4.563 1.596 374 HD12 LEU 47 2HD1 LEU 47 3.380 -3.442 0.339 375 HD13 LEU 47 3HD1 LEU 47 5.098 -3.769 0.574 376 HD21 LEU 47 3HD2 LEU 47 3.657 -6.558 1.345 377 HD22 LEU 47 1HD2 LEU 47 3.792 -7.475 -0.155 378 HD23 LEU 47 2HD2 LEU 47 2.332 -6.546 0.181 379 H LYS 48 H LYS 48 2.091 -4.383 -4.387 380 HA LYS 48 HA LYS 48 -0.253 -6.011 -4.533 381 HB2 LYS 48 2HB LYS 48 -0.155 -3.625 -5.064 382 HB3 LYS 48 1HB LYS 48 0.976 -3.940 -6.379 383 HG2 LYS 48 2HG LYS 48 -1.068 -5.627 -7.035 384 HG3 LYS 48 1HG LYS 48 -1.947 -4.289 -6.294 385 HD2 LYS 48 2HD LYS 48 -1.780 -3.531 -8.484 386 HD3 LYS 48 1HD LYS 48 -0.333 -2.816 -7.765 387 HE2 LYS 48 2HE LYS 48 1.096 -4.439 -8.720 388 HE3 LYS 48 1HE LYS 48 -0.249 -5.550 -9.049 389 HZ1 LYS 48 3HZ LYS 48 -0.178 -2.835 -10.216 390 HZ2 LYS 48 1HZ LYS 48 -1.082 -4.178 -10.721 391 HZ3 LYS 48 2HZ LYS 48 0.595 -4.137 -10.986 392 H GLY 49 H GLY 49 2.760 -5.928 -6.380 393 HA2 GLY 49 2HA GLY 49 1.863 -7.652 -8.519 394 HA3 GLY 49 1HA GLY 49 3.546 -7.299 -8.122 395 H MET 50 H MET 50 3.798 -8.241 -5.567 396 HA MET 50 HA MET 50 4.176 -11.030 -5.871 397 HB2 MET 50 2HB MET 50 3.958 -9.095 -3.579 398 HB3 MET 50 1HB MET 50 4.120 -10.817 -3.242 399 HG2 MET 50 2HG MET 50 6.270 -10.915 -4.050 400 HG3 MET 50 1HG MET 50 5.986 -9.656 -5.252 401 HE1 MET 50 3HE MET 50 5.346 -10.145 -1.613 402 HE2 MET 50 1HE MET 50 4.620 -8.534 -1.717 403 HE3 MET 50 2HE MET 50 6.084 -8.788 -0.766 404 H ALA 51 H ALA 51 1.303 -9.227 -5.099 405 HA ALA 51 HA ALA 51 -0.109 -11.570 -3.975 406 HB1 ALA 51 1HB ALA 51 -0.846 -8.692 -4.589 407 HB2 ALA 51 2HB ALA 51 -0.476 -9.377 -3.006 408 HB3 ALA 51 3HB ALA 51 -1.955 -9.844 -3.846 409 H GLY 52 H GLY 52 0.381 -10.022 -7.025 410 HA2 GLY 52 2HA GLY 52 -2.056 -11.202 -8.213 411 HA3 GLY 52 1HA GLY 52 -0.898 -10.160 -9.047 412 H THR 53 H THR 53 1.374 -11.725 -7.964 413 HA THR 53 HA THR 53 1.481 -13.753 -10.072 414 HB THR 53 HB THR 53 3.300 -12.538 -8.014 415 HG1 THR 53 1HG THR 53 4.486 -12.399 -10.169 416 HG21 THR 53 3HG2 THR 53 3.743 -15.084 -9.555 417 HG22 THR 53 1HG2 THR 53 4.057 -14.755 -7.851 418 HG23 THR 53 2HG2 THR 53 5.099 -14.057 -9.091 419 H MET 54 H MET 54 0.465 -13.643 -6.865 420 HA MET 54 HA MET 54 1.032 -16.534 -6.388 421 HB2 MET 54 2HB MET 54 1.669 -14.699 -4.740 422 HB3 MET 54 1HB MET 54 -0.059 -14.442 -4.487 423 HG2 MET 54 2HG MET 54 0.897 -15.975 -2.786 424 HG3 MET 54 1HG MET 54 -0.326 -16.773 -3.776 425 HE1 MET 54 3HE MET 54 3.690 -16.351 -5.241 426 HE2 MET 54 1HE MET 54 4.110 -16.985 -3.643 427 HE3 MET 54 2HE MET 54 3.078 -15.565 -3.787 428 H GLY 55 H GLY 55 -1.281 -14.831 -7.873 429 HA2 GLY 55 2HA GLY 55 -3.462 -15.502 -8.494 430 HA3 GLY 55 1HA GLY 55 -3.331 -16.848 -7.361 431 H PHE 56 H PHE 56 -2.420 -14.205 -5.623 432 HA PHE 56 HA PHE 56 -5.127 -13.986 -4.412 433 HB2 PHE 56 2HB PHE 56 -2.278 -13.521 -3.615 434 HB3 PHE 56 1HB PHE 56 -3.531 -12.624 -2.757 435 HD1 PHE 56 2HD PHE 56 -5.574 -14.011 -1.903 436 HD2 PHE 56 1HD PHE 56 -1.781 -15.720 -2.973 437 HE1 PHE 56 2HE PHE 56 -6.106 -16.030 -0.565 438 HE2 PHE 56 1HE PHE 56 -2.314 -17.740 -1.635 439 HZ PHE 56 HZ PHE 56 -4.477 -17.895 -0.432 440 H SER 57 H SER 57 -5.137 -12.701 -6.834 441 HA SER 57 HA SER 57 -4.236 -9.989 -6.812 442 HB2 SER 57 2HB SER 57 -6.598 -11.214 -8.245 443 HB3 SER 57 1HB SER 57 -5.708 -9.778 -8.738 444 HG SER 57 HG SER 57 -3.873 -11.103 -9.006 445 H SER 58 H SER 58 -6.918 -11.565 -5.372 446 HA SER 58 HA SER 58 -8.730 -9.380 -5.028 447 HB2 SER 58 2HB SER 58 -8.110 -11.937 -3.534 448 HB3 SER 58 1HB SER 58 -9.368 -10.840 -2.972 449 HG SER 58 HG SER 58 -9.218 -11.821 -5.628 450 H MET 59 H MET 59 -5.879 -10.498 -3.314 451 HA MET 59 HA MET 59 -6.107 -8.387 -1.262 452 HB2 MET 59 2HB MET 59 -5.414 -10.692 -0.695 453 HB3 MET 59 1HB MET 59 -4.074 -10.574 -1.835 454 HG2 MET 59 2HG MET 59 -3.478 -8.421 -0.406 455 HG3 MET 59 1HG MET 59 -4.421 -9.251 0.833 456 HE1 MET 59 3HE MET 59 -2.305 -11.342 -1.936 457 HE2 MET 59 1HE MET 59 -0.730 -10.760 -1.380 458 HE3 MET 59 2HE MET 59 -1.963 -9.616 -1.902 459 H ALA 60 H ALA 60 -4.514 -9.087 -4.277 460 HA ALA 60 HA ALA 60 -2.354 -7.151 -4.005 461 HB1 ALA 60 1HB ALA 60 -1.893 -7.800 -6.241 462 HB2 ALA 60 2HB ALA 60 -3.583 -8.181 -6.567 463 HB3 ALA 60 3HB ALA 60 -2.623 -9.240 -5.535 464 H LYS 61 H LYS 61 -5.667 -7.124 -5.293 465 HA LYS 61 HA LYS 61 -5.585 -4.602 -6.618 466 HB2 LYS 61 2HB LYS 61 -7.706 -6.176 -5.129 467 HB3 LYS 61 1HB LYS 61 -8.080 -4.687 -6.003 468 HG2 LYS 61 2HG LYS 61 -7.853 -5.679 -8.042 469 HG3 LYS 61 1HG LYS 61 -6.496 -6.677 -7.513 470 HD2 LYS 61 2HD LYS 61 -8.267 -8.219 -7.865 471 HD3 LYS 61 1HD LYS 61 -8.217 -7.975 -6.117 472 HE2 LYS 61 2HE LYS 61 -10.395 -7.374 -6.218 473 HE3 LYS 61 1HE LYS 61 -9.893 -5.935 -7.127 474 HZ1 LYS 61 3HZ LYS 61 -9.757 -7.523 -9.103 475 HZ2 LYS 61 1HZ LYS 61 -11.302 -7.046 -8.595 476 HZ3 LYS 61 2HZ LYS 61 -10.706 -8.580 -8.170 477 H LEU 62 H LEU 62 -5.912 -5.563 -3.263 478 HA LEU 62 HA LEU 62 -6.624 -3.021 -2.145 479 HB2 LEU 62 2HB LEU 62 -5.118 -5.449 -1.117 480 HB3 LEU 62 1HB LEU 62 -5.646 -4.123 -0.077 481 HG LEU 62 HG LEU 62 -7.431 -5.875 -1.784 482 HD11 LEU 62 1HD1 LEU 62 -8.371 -6.323 0.606 483 HD12 LEU 62 2HD1 LEU 62 -6.807 -5.726 1.155 484 HD13 LEU 62 3HD1 LEU 62 -6.893 -7.145 0.111 485 HD21 LEU 62 3HD2 LEU 62 -9.087 -4.483 -0.138 486 HD22 LEU 62 1HD2 LEU 62 -8.690 -3.964 -1.776 487 HD23 LEU 62 2HD2 LEU 62 -7.824 -3.281 -0.400 488 H CYS 63 H CYS 63 -3.558 -4.627 -2.887 489 HA CYS 63 HA CYS 63 -1.858 -2.552 -1.806 490 HB2 CYS 63 2HB CYS 63 -1.433 -4.717 -3.892 491 HB3 CYS 63 1HB CYS 63 -0.137 -3.801 -3.119 492 HG CYS 63 HG CYS 63 -0.682 -4.933 -0.869 493 H HIS 64 H HIS 64 -3.425 -3.147 -4.895 494 HA HIS 64 HA HIS 64 -1.975 -1.030 -6.321 495 HB2 HIS 64 2HB HIS 64 -3.170 -3.232 -7.156 496 HB3 HIS 64 1HB HIS 64 -4.614 -2.224 -7.142 497 HD1 HIS 64 1HD HIS 64 -4.580 -2.461 -9.811 498 HD2 HIS 64 2HD HIS 64 -1.392 -0.337 -8.165 499 HE1 HIS 64 1HE HIS 64 -3.497 -1.199 -11.721 500 H THR 65 H THR 65 -4.692 -1.311 -4.237 501 HA THR 65 HA THR 65 -6.153 1.040 -5.134 502 HB THR 65 HB THR 65 -6.158 -0.861 -2.798 503 HG1 THR 65 1HG THR 65 -7.499 -1.764 -4.107 504 HG21 THR 65 3HG2 THR 65 -6.705 1.440 -1.980 505 HG22 THR 65 1HG2 THR 65 -8.031 0.290 -1.823 506 HG23 THR 65 2HG2 THR 65 -8.042 1.475 -3.130 507 H LEU 66 H LEU 66 -4.176 0.338 -2.209 508 HA LEU 66 HA LEU 66 -4.165 3.027 -1.200 509 HB2 LEU 66 2HB LEU 66 -1.899 1.043 -0.910 510 HB3 LEU 66 1HB LEU 66 -2.505 2.184 0.284 511 HG LEU 66 HG LEU 66 -3.660 -0.448 -0.578 512 HD11 LEU 66 1HD1 LEU 66 -4.041 -0.489 1.970 513 HD12 LEU 66 2HD1 LEU 66 -3.010 0.942 2.016 514 HD13 LEU 66 3HD1 LEU 66 -2.375 -0.583 1.399 515 HD21 LEU 66 3HD2 LEU 66 -5.163 2.004 -0.004 516 HD22 LEU 66 1HD2 LEU 66 -5.591 0.667 1.065 517 HD23 LEU 66 2HD2 LEU 66 -5.727 0.479 -0.683 518 H GLU 67 H GLU 67 -2.108 1.293 -3.506 519 HA GLU 67 HA GLU 67 -0.057 3.274 -3.754 520 HB2 GLU 67 2HB GLU 67 0.300 1.020 -4.512 521 HB3 GLU 67 1HB GLU 67 -1.146 1.070 -5.516 522 HG2 GLU 67 2HG GLU 67 0.018 3.006 -6.773 523 HG3 GLU 67 1HG GLU 67 1.491 2.470 -5.964 524 H ASN 68 H ASN 68 -3.036 2.676 -5.606 525 HA ASN 68 HA ASN 68 -2.705 4.669 -7.546 526 HB2 ASN 68 2HB ASN 68 -4.812 3.087 -6.357 527 HB3 ASN 68 1HB ASN 68 -5.395 4.720 -6.678 528 HD21 ASN 68 1HD2 ASN 68 -3.021 2.694 -8.484 529 HD22 ASN 68 2HD2 ASN 68 -3.856 2.771 -9.960 530 H ILE 69 H ILE 69 -4.118 4.964 -4.289 531 HA ILE 69 HA ILE 69 -4.662 7.751 -4.363 532 HB ILE 69 HB ILE 69 -3.582 6.590 -1.831 533 HG12 ILE 69 2HG1 ILE 69 -4.695 4.637 -2.684 534 HG13 ILE 69 1HG1 ILE 69 -5.748 5.370 -1.486 535 HG21 ILE 69 1HG2 ILE 69 -4.673 8.462 -1.196 536 HG22 ILE 69 2HG2 ILE 69 -6.152 7.530 -1.428 537 HG23 ILE 69 3HG2 ILE 69 -5.550 8.566 -2.722 538 HD11 ILE 69 3HD1 ILE 69 -7.230 6.194 -3.086 539 HD12 ILE 69 1HD1 ILE 69 -6.777 4.628 -3.757 540 HD13 ILE 69 2HD1 ILE 69 -6.036 6.104 -4.383 541 H LEU 70 H LEU 70 -1.759 5.993 -4.141 542 HA LEU 70 HA LEU 70 -0.153 8.307 -3.294 543 HB2 LEU 70 2HB LEU 70 0.593 5.493 -4.150 544 HB3 LEU 70 1HB LEU 70 1.700 6.661 -3.429 545 HG LEU 70 HG LEU 70 -0.847 5.740 -2.083 546 HD11 LEU 70 1HD1 LEU 70 1.019 4.575 -0.595 547 HD12 LEU 70 2HD1 LEU 70 1.916 4.590 -2.115 548 HD13 LEU 70 3HD1 LEU 70 0.361 3.768 -2.015 549 HD21 LEU 70 3HD2 LEU 70 0.762 7.931 -1.615 550 HD22 LEU 70 1HD2 LEU 70 1.422 6.734 -0.501 551 HD23 LEU 70 2HD2 LEU 70 -0.284 7.170 -0.415 552 H ASP 71 H ASP 71 -1.213 6.626 -6.061 553 HA ASP 71 HA ASP 71 0.686 7.907 -7.892 554 HB2 ASP 71 2HB ASP 71 -0.839 5.613 -7.928 555 HB3 ASP 71 1HB ASP 71 -1.825 6.698 -8.909 556 H LYS 72 H LYS 72 -2.661 8.316 -6.681 557 HA LYS 72 HA LYS 72 -3.395 10.380 -8.524 558 HB2 LYS 72 2HB LYS 72 -4.150 9.902 -5.644 559 HB3 LYS 72 1HB LYS 72 -5.102 10.811 -6.816 560 HG2 LYS 72 2HG LYS 72 -4.658 7.848 -6.616 561 HG3 LYS 72 1HG LYS 72 -6.171 8.732 -6.701 562 HD2 LYS 72 2HD LYS 72 -5.987 7.909 -8.842 563 HD3 LYS 72 1HD LYS 72 -5.276 9.514 -9.000 564 HE2 LYS 72 2HE LYS 72 -3.167 8.706 -9.308 565 HE3 LYS 72 1HE LYS 72 -3.428 7.334 -8.216 566 HZ1 LYS 72 3HZ LYS 72 -3.499 7.186 -10.930 567 HZ2 LYS 72 1HZ LYS 72 -5.144 7.315 -10.535 568 HZ3 LYS 72 2HZ LYS 72 -4.210 6.060 -9.873 569 H ALA 73 H ALA 73 -1.823 10.223 -5.432 570 HA ALA 73 HA ALA 73 -1.496 12.992 -4.859 571 HB1 ALA 73 1HB ALA 73 0.416 12.020 -3.462 572 HB2 ALA 73 2HB ALA 73 0.026 10.460 -4.194 573 HB3 ALA 73 3HB ALA 73 -1.166 11.288 -3.189 574 H ARG 74 H ARG 74 0.421 10.672 -6.725 575 HA ARG 74 HA ARG 74 2.518 12.653 -7.251 576 HB2 ARG 74 2HB ARG 74 3.718 10.816 -7.976 577 HB3 ARG 74 1HB ARG 74 2.523 9.982 -6.989 578 HG2 ARG 74 2HG ARG 74 1.191 9.441 -8.928 579 HG3 ARG 74 1HG ARG 74 2.178 10.475 -9.961 580 HD2 ARG 74 2HD ARG 74 4.056 8.778 -8.827 581 HD3 ARG 74 1HD ARG 74 2.663 7.714 -9.107 582 HE ARG 74 HE ARG 74 2.768 8.243 -11.458 583 HH11 ARG 74 1HH1 ARG 74 3.595 11.135 -11.135 584 HH12 ARG 74 2HH1 ARG 74 5.207 11.108 -11.768 585 HH21 ARG 74 1HH2 ARG 74 5.505 7.658 -11.588 586 HH22 ARG 74 2HH2 ARG 74 6.288 9.140 -12.025 587 H ASN 75 H ASN 75 -0.527 11.887 -8.560 588 HA ASN 75 HA ASN 75 0.207 12.818 -11.297 589 HB2 ASN 75 2HB ASN 75 -2.015 11.335 -9.969 590 HB3 ASN 75 1HB ASN 75 -2.434 12.290 -11.392 591 HD21 ASN 75 1HD2 ASN 75 -1.142 9.290 -10.385 592 HD22 ASN 75 2HD2 ASN 75 -0.513 8.790 -11.880 593 H SER 76 H SER 76 -0.296 14.365 -8.525 594 HA SER 76 HA SER 76 -0.979 16.580 -8.042 595 HB2 SER 76 2HB SER 76 -0.113 16.676 -10.536 596 HB3 SER 76 1HB SER 76 -1.825 16.839 -10.917 597 HG SER 76 HG SER 76 -1.789 18.562 -9.268 598 H GLU 77 H GLU 77 -2.818 14.165 -8.147 599 HA GLU 77 HA GLU 77 -5.418 15.464 -8.736 600 HB2 GLU 77 2HB GLU 77 -4.742 12.604 -8.038 601 HB3 GLU 77 1HB GLU 77 -6.266 13.185 -8.709 602 HG2 GLU 77 2HG GLU 77 -3.594 13.467 -10.107 603 HG3 GLU 77 1HG GLU 77 -4.734 12.158 -10.421 604 H ILE 78 H ILE 78 -3.929 13.511 -6.218 605 HA ILE 78 HA ILE 78 -5.535 15.028 -4.177 606 HB ILE 78 HB ILE 78 -5.906 12.776 -3.064 607 HG12 ILE 78 2HG1 ILE 78 -5.752 11.040 -5.132 608 HG13 ILE 78 1HG1 ILE 78 -4.295 11.991 -5.383 609 HG21 ILE 78 1HG2 ILE 78 -7.220 13.941 -5.270 610 HG22 ILE 78 2HG2 ILE 78 -7.887 12.760 -4.140 611 HG23 ILE 78 3HG2 ILE 78 -7.102 12.214 -5.628 612 HD11 ILE 78 3HD1 ILE 78 -4.839 11.044 -2.621 613 HD12 ILE 78 1HD1 ILE 78 -3.305 11.213 -3.479 614 HD13 ILE 78 2HD1 ILE 78 -4.356 9.832 -3.817 615 H LYS 79 H LYS 79 -4.674 13.521 -1.985 616 HA LYS 79 HA LYS 79 -1.860 13.092 -1.839 617 HB2 LYS 79 2HB LYS 79 -1.536 15.226 -0.378 618 HB3 LYS 79 1HB LYS 79 -1.560 15.413 -2.128 619 HG2 LYS 79 2HG LYS 79 -2.993 17.122 -1.295 620 HG3 LYS 79 1HG LYS 79 -4.071 15.867 -1.899 621 HD2 LYS 79 2HD LYS 79 -4.721 16.744 0.359 622 HD3 LYS 79 1HD LYS 79 -4.420 15.007 0.336 623 HE2 LYS 79 2HE LYS 79 -2.702 15.205 1.801 624 HE3 LYS 79 1HE LYS 79 -1.979 16.530 0.869 625 HZ1 LYS 79 3HZ LYS 79 -2.670 17.669 2.712 626 HZ2 LYS 79 1HZ LYS 79 -3.992 16.646 3.000 627 HZ3 LYS 79 2HZ LYS 79 -4.069 17.802 1.758 628 H ILE 80 H ILE 80 -1.243 12.986 0.635 629 HA ILE 80 HA ILE 80 -3.260 11.391 1.938 630 HB ILE 80 HB ILE 80 -0.578 12.522 2.553 631 HG12 ILE 80 2HG1 ILE 80 0.028 10.174 2.578 632 HG13 ILE 80 1HG1 ILE 80 -1.674 9.709 2.548 633 HG21 ILE 80 1HG2 ILE 80 -1.592 12.705 4.713 634 HG22 ILE 80 2HG2 ILE 80 -0.693 11.190 4.730 635 HG23 ILE 80 3HG2 ILE 80 -2.444 11.175 4.508 636 HD11 ILE 80 3HD1 ILE 80 -0.316 11.305 0.358 637 HD12 ILE 80 1HD1 ILE 80 -1.949 10.639 0.326 638 HD13 ILE 80 2HD1 ILE 80 -0.554 9.558 0.301 639 H THR 81 H THR 81 -5.057 12.553 2.309 640 HA THR 81 HA THR 81 -5.013 15.119 3.795 641 HB THR 81 HB THR 81 -7.433 15.020 3.343 642 HG1 THR 81 1HG THR 81 -8.375 13.210 2.659 643 HG21 THR 81 3HG2 THR 81 -5.873 15.694 1.513 644 HG22 THR 81 1HG2 THR 81 -7.372 14.984 0.919 645 HG23 THR 81 2HG2 THR 81 -5.890 14.026 0.938 646 H SER 82 H SER 82 -4.461 12.099 4.751 647 HA SER 82 HA SER 82 -4.605 11.083 6.898 648 HB2 SER 82 2HB SER 82 -4.874 13.644 7.478 649 HB3 SER 82 1HB SER 82 -6.563 13.205 7.716 650 HG SER 82 HG SER 82 -5.113 13.027 9.596 651 H ASP 83 H ASP 83 -7.048 11.705 4.702 652 HA ASP 83 HA ASP 83 -8.981 9.861 6.040 653 HB2 ASP 83 2HB ASP 83 -9.152 12.297 4.330 654 HB3 ASP 83 1HB ASP 83 -10.353 11.042 4.021 655 H LEU 84 H LEU 84 -7.335 10.762 3.005 656 HA LEU 84 HA LEU 84 -8.276 8.536 1.440 657 HB2 LEU 84 2HB LEU 84 -5.697 10.154 1.364 658 HB3 LEU 84 1HB LEU 84 -6.290 9.137 0.050 659 HG LEU 84 HG LEU 84 -7.522 11.671 1.145 660 HD11 LEU 84 1HD1 LEU 84 -7.526 11.507 -1.683 661 HD12 LEU 84 2HD1 LEU 84 -5.945 10.936 -1.150 662 HD13 LEU 84 3HD1 LEU 84 -6.512 12.535 -0.670 663 HD21 LEU 84 3HD2 LEU 84 -9.273 10.995 -0.756 664 HD22 LEU 84 1HD2 LEU 84 -9.478 10.453 0.909 665 HD23 LEU 84 2HD2 LEU 84 -8.781 9.367 -0.292 666 H LEU 85 H LEU 85 -5.784 9.075 3.816 667 HA LEU 85 HA LEU 85 -4.397 6.529 3.490 668 HB2 LEU 85 2HB LEU 85 -4.610 8.662 5.632 669 HB3 LEU 85 1HB LEU 85 -3.618 7.220 5.852 670 HG LEU 85 HG LEU 85 -3.317 9.366 3.751 671 HD11 LEU 85 1HD1 LEU 85 -2.245 9.903 5.847 672 HD12 LEU 85 2HD1 LEU 85 -0.982 9.373 4.733 673 HD13 LEU 85 3HD1 LEU 85 -1.576 8.275 5.976 674 HD21 LEU 85 3HD2 LEU 85 -2.898 7.418 2.495 675 HD22 LEU 85 1HD2 LEU 85 -2.238 6.556 3.885 676 HD23 LEU 85 2HD2 LEU 85 -1.296 7.830 3.111 677 H ASP 86 H ASP 86 -6.765 7.867 5.786 678 HA ASP 86 HA ASP 86 -7.253 5.733 7.488 679 HB2 ASP 86 2HB ASP 86 -8.361 8.015 7.365 680 HB3 ASP 86 1HB ASP 86 -9.405 7.361 6.102 681 H LYS 87 H LYS 87 -8.568 6.103 4.178 682 HA LYS 87 HA LYS 87 -9.920 3.500 4.284 683 HB2 LYS 87 2HB LYS 87 -9.218 5.225 1.885 684 HB3 LYS 87 1HB LYS 87 -10.547 4.073 2.019 685 HG2 LYS 87 2HG LYS 87 -10.259 6.647 3.599 686 HG3 LYS 87 1HG LYS 87 -11.387 6.365 2.274 687 HD2 LYS 87 2HD LYS 87 -12.625 4.765 3.529 688 HD3 LYS 87 1HD LYS 87 -11.358 4.631 4.749 689 HE2 LYS 87 2HE LYS 87 -12.250 6.349 5.928 690 HE3 LYS 87 1HE LYS 87 -12.233 7.393 4.492 691 HZ1 LYS 87 3HZ LYS 87 -14.504 6.812 5.391 692 HZ2 LYS 87 1HZ LYS 87 -14.219 5.224 4.867 693 HZ3 LYS 87 2HZ LYS 87 -14.260 6.495 3.740 694 H ILE 88 H ILE 88 -6.917 4.868 3.075 695 HA ILE 88 HA ILE 88 -5.996 2.605 1.577 696 HB ILE 88 HB ILE 88 -5.162 5.202 2.483 697 HG12 ILE 88 2HG1 ILE 88 -3.669 3.602 0.472 698 HG13 ILE 88 1HG1 ILE 88 -5.340 4.077 0.154 699 HG21 ILE 88 1HG2 ILE 88 -3.561 4.339 3.988 700 HG22 ILE 88 2HG2 ILE 88 -2.641 4.595 2.505 701 HG23 ILE 88 3HG2 ILE 88 -3.186 2.975 2.935 702 HD11 ILE 88 3HD1 ILE 88 -4.769 6.246 -0.174 703 HD12 ILE 88 1HD1 ILE 88 -3.106 5.667 -0.286 704 HD13 ILE 88 2HD1 ILE 88 -3.733 6.265 1.251 705 H PHE 89 H PHE 89 -5.464 3.660 4.931 706 HA PHE 89 HA PHE 89 -3.897 1.418 5.772 707 HB2 PHE 89 2HB PHE 89 -3.870 3.454 7.033 708 HB3 PHE 89 1HB PHE 89 -5.630 3.475 7.146 709 HD1 PHE 89 2HD PHE 89 -6.812 1.745 8.539 710 HD2 PHE 89 1HD PHE 89 -2.541 2.203 8.580 711 HE1 PHE 89 2HE PHE 89 -6.694 0.457 10.654 712 HE2 PHE 89 1HE PHE 89 -2.424 0.915 10.696 713 HZ PHE 89 HZ PHE 89 -4.500 0.041 11.733 714 H ALA 90 H ALA 90 -7.283 1.992 5.429 715 HA ALA 90 HA ALA 90 -8.229 -0.257 7.000 716 HB1 ALA 90 1HB ALA 90 -10.289 0.212 5.465 717 HB2 ALA 90 2HB ALA 90 -9.337 1.564 4.850 718 HB3 ALA 90 3HB ALA 90 -9.778 1.499 6.557 719 H GLY 91 H GLY 91 -7.163 0.343 3.725 720 HA2 GLY 91 2HA GLY 91 -7.982 -2.210 2.631 721 HA3 GLY 91 1HA GLY 91 -6.811 -1.098 1.909 722 H VAL 92 H VAL 92 -5.035 -0.870 4.068 723 HA VAL 92 HA VAL 92 -3.450 -3.284 3.776 724 HB VAL 92 HB VAL 92 -3.309 -0.621 5.136 725 HG11 VAL 92 1HG1 VAL 92 -0.998 -1.565 6.054 726 HG12 VAL 92 2HG1 VAL 92 -1.889 -3.086 6.078 727 HG13 VAL 92 3HG1 VAL 92 -2.473 -1.708 7.009 728 HG21 VAL 92 3HG2 VAL 92 -2.142 -1.971 2.893 729 HG22 VAL 92 1HG2 VAL 92 -0.850 -1.521 4.006 730 HG23 VAL 92 2HG2 VAL 92 -1.944 -0.288 3.379 731 H ASP 93 H ASP 93 -5.940 -2.204 5.887 732 HA ASP 93 HA ASP 93 -5.251 -3.865 8.187 733 HB2 ASP 93 2HB ASP 93 -6.529 -1.757 8.326 734 HB3 ASP 93 1HB ASP 93 -7.787 -2.441 7.298 735 H MET 94 H MET 94 -7.028 -4.262 5.196 736 HA MET 94 HA MET 94 -8.448 -6.670 6.094 737 HB2 MET 94 2HB MET 94 -8.166 -5.017 3.609 738 HB3 MET 94 1HB MET 94 -8.796 -6.658 3.456 739 HG2 MET 94 2HG MET 94 -10.265 -5.852 5.554 740 HG3 MET 94 1HG MET 94 -10.000 -4.283 4.794 741 HE1 MET 94 3HE MET 94 -10.237 -5.603 1.245 742 HE2 MET 94 1HE MET 94 -9.620 -4.368 2.351 743 HE3 MET 94 2HE MET 94 -11.194 -4.167 1.586 744 H ILE 95 H ILE 95 -5.847 -6.008 3.671 745 HA ILE 95 HA ILE 95 -5.251 -8.693 3.074 746 HB ILE 95 HB ILE 95 -3.079 -7.697 2.402 747 HG12 ILE 95 2HG1 ILE 95 -4.153 -5.293 3.885 748 HG13 ILE 95 1HG1 ILE 95 -2.670 -6.182 4.241 749 HG21 ILE 95 1HG2 ILE 95 -5.508 -7.261 1.332 750 HG22 ILE 95 2HG2 ILE 95 -4.022 -6.625 0.624 751 HG23 ILE 95 3HG2 ILE 95 -5.020 -5.598 1.656 752 HD11 ILE 95 3HD1 ILE 95 -3.266 -4.507 1.789 753 HD12 ILE 95 1HD1 ILE 95 -1.879 -5.590 1.905 754 HD13 ILE 95 2HD1 ILE 95 -2.021 -4.221 3.007 755 H THR 96 H THR 96 -4.216 -6.616 5.756 756 HA THR 96 HA THR 96 -2.252 -8.400 6.869 757 HB THR 96 HB THR 96 -4.027 -6.175 7.905 758 HG1 THR 96 1HG THR 96 -1.320 -6.526 7.229 759 HG21 THR 96 3HG2 THR 96 -2.677 -8.219 9.451 760 HG22 THR 96 1HG2 THR 96 -3.720 -6.909 10.008 761 HG23 THR 96 2HG2 THR 96 -1.993 -6.629 9.786 762 H ARG 97 H ARG 97 -5.754 -7.988 7.252 763 HA ARG 97 HA ARG 97 -6.033 -10.088 9.249 764 HB2 ARG 97 2HB ARG 97 -7.820 -8.419 7.489 765 HB3 ARG 97 1HB ARG 97 -8.503 -9.784 8.375 766 HG2 ARG 97 2HG ARG 97 -8.208 -8.785 10.421 767 HG3 ARG 97 1HG ARG 97 -6.744 -7.940 9.914 768 HD2 ARG 97 2HD ARG 97 -7.997 -6.072 9.652 769 HD3 ARG 97 1HD ARG 97 -8.857 -6.891 8.333 770 HE ARG 97 HE ARG 97 -10.113 -7.976 10.458 771 HH11 ARG 97 1HH1 ARG 97 -8.875 -5.495 11.904 772 HH12 ARG 97 2HH1 ARG 97 -10.254 -4.449 11.920 773 HH21 ARG 97 1HH2 ARG 97 -12.023 -6.296 9.584 774 HH22 ARG 97 2HH2 ARG 97 -12.033 -4.901 10.609 775 H MET 98 H MET 98 -6.317 -9.853 5.713 776 HA MET 98 HA MET 98 -7.325 -12.512 5.255 777 HB2 MET 98 2HB MET 98 -5.744 -10.482 3.646 778 HB3 MET 98 1HB MET 98 -6.279 -12.015 2.958 779 HG2 MET 98 2HG MET 98 -8.442 -11.343 2.828 780 HG3 MET 98 1HG MET 98 -8.377 -10.521 4.385 781 HE1 MET 98 3HE MET 98 -9.629 -8.795 1.215 782 HE2 MET 98 1HE MET 98 -9.093 -10.480 1.250 783 HE3 MET 98 2HE MET 98 -8.229 -9.297 0.273 784 H VAL 99 H VAL 99 -4.122 -11.050 5.535 785 HA VAL 99 HA VAL 99 -2.573 -13.366 4.836 786 HB VAL 99 HB VAL 99 -2.187 -10.750 6.271 787 HG11 VAL 99 1HG1 VAL 99 0.368 -11.613 6.104 788 HG12 VAL 99 2HG1 VAL 99 -0.430 -13.151 6.432 789 HG13 VAL 99 3HG1 VAL 99 -0.604 -11.808 7.562 790 HG21 VAL 99 3HG2 VAL 99 -1.482 -12.011 3.668 791 HG22 VAL 99 1HG2 VAL 99 -0.302 -10.888 4.342 792 HG23 VAL 99 2HG2 VAL 99 -1.951 -10.349 4.022 793 H ASP 100 H ASP 100 -3.928 -12.142 7.890 794 HA ASP 100 HA ASP 100 -2.580 -14.006 9.618 795 HB2 ASP 100 2HB ASP 100 -4.006 -11.785 9.989 796 HB3 ASP 100 1HB ASP 100 -5.322 -12.941 10.190 797 H LYS 101 H LYS 101 -5.539 -14.126 7.719 798 HA LYS 101 HA LYS 101 -6.262 -16.758 8.824 799 HB2 LYS 101 2HB LYS 101 -8.311 -16.004 8.289 800 HB3 LYS 101 1HB LYS 101 -7.568 -14.514 7.727 801 HG2 LYS 101 2HG LYS 101 -7.153 -16.208 5.588 802 HG3 LYS 101 1HG LYS 101 -8.728 -16.721 6.185 803 HD2 LYS 101 2HD LYS 101 -8.804 -13.960 6.327 804 HD3 LYS 101 1HD LYS 101 -7.959 -14.298 4.812 805 HE2 LYS 101 2HE LYS 101 -10.181 -14.451 4.090 806 HE3 LYS 101 1HE LYS 101 -9.880 -16.132 4.568 807 HZ1 LYS 101 3HZ LYS 101 -10.541 -14.618 6.852 808 HZ2 LYS 101 1HZ LYS 101 -11.361 -15.946 6.191 809 HZ3 LYS 101 2HZ LYS 101 -11.739 -14.376 5.673 810 H ILE 102 H ILE 102 -4.988 -15.240 5.926 811 HA ILE 102 HA ILE 102 -4.978 -17.543 4.208 812 HB ILE 102 HB ILE 102 -3.558 -14.893 4.400 813 HG12 ILE 102 2HG1 ILE 102 -5.372 -16.195 2.344 814 HG13 ILE 102 1HG1 ILE 102 -5.836 -14.949 3.504 815 HG21 ILE 102 1HG2 ILE 102 -2.706 -15.661 1.993 816 HG22 ILE 102 2HG2 ILE 102 -2.745 -17.247 2.761 817 HG23 ILE 102 3HG2 ILE 102 -1.757 -15.960 3.449 818 HD11 ILE 102 3HD1 ILE 102 -5.287 -13.442 1.915 819 HD12 ILE 102 1HD1 ILE 102 -4.489 -14.669 0.931 820 HD13 ILE 102 2HD1 ILE 102 -3.607 -13.871 2.232 821 H VAL 103 H VAL 103 -2.797 -16.172 6.578 822 HA VAL 103 HA VAL 103 -0.595 -18.018 6.159 823 HB VAL 103 HB VAL 103 -1.526 -16.092 8.290 824 HG11 VAL 103 1HG1 VAL 103 0.915 -16.616 9.203 825 HG12 VAL 103 2HG1 VAL 103 0.603 -18.192 8.476 826 HG13 VAL 103 3HG1 VAL 103 -0.470 -17.572 9.732 827 HG21 VAL 103 3HG2 VAL 103 0.338 -14.787 7.574 828 HG22 VAL 103 1HG2 VAL 103 -0.394 -15.400 6.091 829 HG23 VAL 103 2HG2 VAL 103 1.066 -16.154 6.730 830 H SER 104 H SER 104 -3.506 -17.919 8.136 831 HA SER 104 HA SER 104 -2.852 -20.288 9.692 832 HB2 SER 104 2HB SER 104 -4.274 -18.397 10.464 833 HB3 SER 104 1HB SER 104 -5.455 -18.823 9.226 834 HG SER 104 HG SER 104 -5.668 -19.701 11.496 835 H GLU 105 H GLU 105 -4.767 -19.572 6.871 836 HA GLU 105 HA GLU 105 -5.075 -22.514 6.387 837 HB2 GLU 105 2HB GLU 105 -7.208 -20.531 5.627 838 HB3 GLU 105 1HB GLU 105 -7.369 -22.251 5.970 839 HG2 GLU 105 2HG GLU 105 -6.456 -21.342 8.373 840 HG3 GLU 105 1HG GLU 105 -7.385 -19.947 7.824 841 H GLY 106 H GLY 106 -5.027 -19.238 5.002 842 HA2 GLY 106 2HA GLY 106 -3.648 -18.845 2.985 843 HA3 GLY 106 1HA GLY 106 -4.090 -20.460 2.440 844 H SER 107 H SER 107 -6.535 -18.437 3.897 845 HA SER 107 HA SER 107 -7.787 -18.100 1.182 846 HB2 SER 107 2HB SER 107 -9.055 -18.247 3.926 847 HB3 SER 107 1HB SER 107 -9.897 -18.248 2.380 848 HG SER 107 HG SER 107 -8.769 -20.295 3.725 849 H ASP 108 H ASP 108 -8.127 -16.048 0.526 850 HA ASP 108 HA ASP 108 -7.562 -13.815 2.422 851 HB2 ASP 108 2HB ASP 108 -6.441 -13.868 0.233 852 HB3 ASP 108 1HB ASP 108 -7.997 -14.005 -0.586 853 H ASP 109 H ASP 109 -10.119 -15.687 1.841 854 HA ASP 109 HA ASP 109 -12.200 -13.777 1.114 855 HB2 ASP 109 2HB ASP 109 -11.831 -16.581 1.544 856 HB3 ASP 109 1HB ASP 109 -13.201 -16.054 2.523 857 H ILE 110 H ILE 110 -11.733 -12.059 2.757 858 HA ILE 110 HA ILE 110 -12.654 -12.796 5.512 859 HB ILE 110 HB ILE 110 -11.438 -10.683 6.128 860 HG12 ILE 110 2HG1 ILE 110 -10.181 -10.721 3.411 861 HG13 ILE 110 1HG1 ILE 110 -11.742 -9.928 3.604 862 HG21 ILE 110 1HG2 ILE 110 -9.783 -12.703 4.576 863 HG22 ILE 110 2HG2 ILE 110 -10.316 -12.896 6.245 864 HG23 ILE 110 3HG2 ILE 110 -9.183 -11.614 5.826 865 HD11 ILE 110 3HD1 ILE 110 -10.886 -8.426 5.256 866 HD12 ILE 110 1HD1 ILE 110 -9.712 -8.428 3.941 867 HD13 ILE 110 2HD1 ILE 110 -9.389 -9.346 5.413 868 H GLY 111 H GLY 111 -14.403 -12.169 3.149 869 HA2 GLY 111 2HA GLY 111 -16.366 -10.934 2.775 870 HA3 GLY 111 1HA GLY 111 -16.246 -10.396 4.451 871 H GLU 112 H GLU 112 -13.460 -9.822 2.556 872 HA GLU 112 HA GLU 112 -13.453 -7.014 2.932 873 HB2 GLU 112 2HB GLU 112 -11.727 -7.163 1.045 874 HB3 GLU 112 1HB GLU 112 -11.443 -8.208 2.439 875 HG2 GLU 112 2HG GLU 112 -11.481 -9.999 1.084 876 HG3 GLU 112 1HG GLU 112 -13.153 -9.622 0.668 877 H ASN 113 H ASN 113 -13.200 -5.549 0.814 878 HA ASN 113 HA ASN 113 -15.224 -6.118 -1.267 879 HB2 ASN 113 2HB ASN 113 -15.856 -4.747 1.109 880 HB3 ASN 113 1HB ASN 113 -15.678 -3.493 -0.119 881 HD21 ASN 113 1HD2 ASN 113 -18.189 -3.449 0.410 882 HD22 ASN 113 2HD2 ASN 113 -19.161 -4.437 -0.569 883 H ILE 114 H ILE 114 -13.252 -5.992 -2.586 884 HA ILE 114 HA ILE 114 -11.573 -3.642 -2.622 885 HB ILE 114 HB ILE 114 -12.032 -5.532 -4.926 886 HG12 ILE 114 2HG1 ILE 114 -11.883 -7.130 -3.217 887 HG13 ILE 114 1HG1 ILE 114 -10.190 -6.912 -3.656 888 HG21 ILE 114 1HG2 ILE 114 -9.332 -4.813 -3.972 889 HG22 ILE 114 2HG2 ILE 114 -10.298 -3.458 -4.561 890 HG23 ILE 114 3HG2 ILE 114 -9.981 -4.839 -5.611 891 HD11 ILE 114 3HD1 ILE 114 -9.884 -6.545 -1.434 892 HD12 ILE 114 1HD1 ILE 114 -11.594 -6.198 -1.162 893 HD13 ILE 114 2HD1 ILE 114 -10.526 -4.939 -1.781 894 H ASP 115 H ASP 115 -13.794 -4.786 -5.202 895 HA ASP 115 HA ASP 115 -13.896 -2.525 -6.777 896 HB2 ASP 115 2HB ASP 115 -15.103 -4.552 -7.319 897 HB3 ASP 115 1HB ASP 115 -16.111 -4.383 -5.881 898 H VAL 116 H VAL 116 -15.231 -2.987 -3.638 899 HA VAL 116 HA VAL 116 -16.704 -0.441 -3.663 900 HB VAL 116 HB VAL 116 -16.322 -2.712 -1.715 901 HG11 VAL 116 1HG1 VAL 116 -17.519 0.013 -1.323 902 HG12 VAL 116 2HG1 VAL 116 -16.556 -0.953 -0.205 903 HG13 VAL 116 3HG1 VAL 116 -18.245 -1.368 -0.500 904 HG21 VAL 116 3HG2 VAL 116 -18.793 -2.937 -2.070 905 HG22 VAL 116 1HG2 VAL 116 -17.868 -3.156 -3.556 906 HG23 VAL 116 2HG2 VAL 116 -18.708 -1.634 -3.255 907 H PHE 117 H PHE 117 -14.163 -1.931 -1.723 908 HA PHE 117 HA PHE 117 -13.471 0.368 -0.184 909 HB2 PHE 117 2HB PHE 117 -12.069 -2.141 -1.073 910 HB3 PHE 117 1HB PHE 117 -11.168 -0.912 -0.191 911 HD1 PHE 117 2HD PHE 117 -14.758 -1.894 0.158 912 HD2 PHE 117 1HD PHE 117 -10.860 -1.820 1.960 913 HE1 PHE 117 2HE PHE 117 -15.731 -2.691 2.295 914 HE2 PHE 117 1HE PHE 117 -11.833 -2.615 4.098 915 HZ PHE 117 HZ PHE 117 -14.268 -3.053 4.265 916 H SER 118 H SER 118 -12.727 -0.468 -3.490 917 HA SER 118 HA SER 118 -10.641 1.574 -3.710 918 HB2 SER 118 2HB SER 118 -9.985 0.006 -5.216 919 HB3 SER 118 1HB SER 118 -11.532 -0.827 -5.063 920 HG SER 118 HG SER 118 -10.678 0.550 -7.108 921 H ASP 119 H ASP 119 -13.877 0.847 -4.803 922 HA ASP 119 HA ASP 119 -14.233 3.258 -6.357 923 HB2 ASP 119 2HB ASP 119 -15.581 1.273 -6.753 924 HB3 ASP 119 1HB ASP 119 -16.135 1.272 -5.078 925 H THR 120 H THR 120 -14.375 2.438 -3.057 926 HA THR 120 HA THR 120 -15.976 4.692 -2.153 927 HB THR 120 HB THR 120 -14.413 2.407 -1.069 928 HG1 THR 120 1HG THR 120 -16.409 2.689 0.389 929 HG21 THR 120 3HG2 THR 120 -13.440 4.326 0.150 930 HG22 THR 120 1HG2 THR 120 -14.381 3.275 1.208 931 HG23 THR 120 2HG2 THR 120 -15.060 4.808 0.657 932 H ILE 121 H ILE 121 -12.628 3.817 -2.395 933 HA ILE 121 HA ILE 121 -11.589 6.355 -1.386 934 HB ILE 121 HB ILE 121 -10.764 3.656 -1.989 935 HG12 ILE 121 2HG1 ILE 121 -10.569 5.001 0.146 936 HG13 ILE 121 1HG1 ILE 121 -9.123 4.100 -0.310 937 HG21 ILE 121 1HG2 ILE 121 -9.606 4.308 -3.926 938 HG22 ILE 121 2HG2 ILE 121 -8.372 4.358 -2.668 939 HG23 ILE 121 3HG2 ILE 121 -9.120 5.854 -3.228 940 HD11 ILE 121 3HD1 ILE 121 -9.608 7.034 -0.908 941 HD12 ILE 121 1HD1 ILE 121 -8.153 6.122 -1.311 942 HD13 ILE 121 2HD1 ILE 121 -8.570 6.419 0.377 943 H LYS 122 H LYS 122 -11.964 4.756 -4.566 944 HA LYS 122 HA LYS 122 -10.623 6.756 -6.116 945 HB2 LYS 122 2HB LYS 122 -12.331 4.383 -6.446 946 HB3 LYS 122 1HB LYS 122 -12.558 5.588 -7.717 947 HG2 LYS 122 2HG LYS 122 -10.635 4.910 -8.666 948 HG3 LYS 122 1HG LYS 122 -9.782 5.457 -7.225 949 HD2 LYS 122 2HD LYS 122 -11.057 2.946 -6.665 950 HD3 LYS 122 1HD LYS 122 -10.087 2.792 -8.129 951 HE2 LYS 122 2HE LYS 122 -8.393 4.244 -6.517 952 HE3 LYS 122 1HE LYS 122 -9.201 3.188 -5.343 953 HZ1 LYS 122 3HZ LYS 122 -7.182 2.307 -6.725 954 HZ2 LYS 122 1HZ LYS 122 -8.363 2.056 -7.915 955 HZ3 LYS 122 2HZ LYS 122 -8.510 1.300 -6.400 956 H SER 123 H SER 123 -13.897 6.360 -4.916 957 HA SER 123 HA SER 123 -14.961 8.659 -6.370 958 HB2 SER 123 2HB SER 123 -15.870 6.785 -4.206 959 HB3 SER 123 1HB SER 123 -16.860 8.162 -4.681 960 HG SER 123 HG SER 123 -17.205 7.266 -6.604 961 H PHE 124 H PHE 124 -13.283 8.029 -3.470 962 HA PHE 124 HA PHE 124 -14.137 10.441 -2.028 963 HB2 PHE 124 2HB PHE 124 -12.761 8.000 -1.543 964 HB3 PHE 124 1HB PHE 124 -11.660 9.307 -1.117 965 HD1 PHE 124 2HD PHE 124 -15.313 8.496 -0.779 966 HD2 PHE 124 1HD PHE 124 -11.786 10.110 1.067 967 HE1 PHE 124 2HE PHE 124 -16.586 8.887 1.312 968 HE2 PHE 124 1HE PHE 124 -13.060 10.501 3.160 969 HZ PHE 124 HZ PHE 124 -15.460 9.888 3.282 970 H ALA 125 H ALA 125 -12.307 9.990 -4.702 971 HA ALA 125 HA ALA 125 -9.946 11.566 -4.205 972 HB1 ALA 125 1HB ALA 125 -10.118 11.729 -6.797 973 HB2 ALA 125 2HB ALA 125 -11.536 10.695 -6.618 974 HB3 ALA 125 3HB ALA 125 -9.956 10.125 -6.080 975 H SER 126 H SER 126 -12.566 12.529 -6.430 976 HA SER 126 HA SER 126 -12.735 15.176 -5.075 977 HB2 SER 126 2HB SER 126 -12.425 16.181 -7.415 978 HB3 SER 126 1HB SER 126 -10.984 15.496 -6.669 979 HG SER 126 HG SER 126 -11.540 14.876 -8.936 980 H SER 127 H SER 127 -14.812 13.492 -4.855 981 HA SER 127 HA SER 127 -17.086 13.142 -5.411 982 HB2 SER 127 2HB SER 127 -17.071 15.518 -4.861 983 HB3 SER 127 1HB SER 127 -16.517 15.924 -6.484 984 HG SER 127 HG SER 127 -18.586 16.063 -6.865 985 H GLY 128 H GLY 128 -15.384 11.892 -7.251 986 HA2 GLY 128 2HA GLY 128 -15.350 11.033 -9.433 987 HA3 GLY 128 1HA GLY 128 -17.055 11.482 -9.494 988 H LYS 129 H LYS 129 -13.781 12.826 -9.904 989 HA LYS 129 HA LYS 129 -13.013 14.491 -11.397 990 HB2 LYS 129 2HB LYS 129 -14.812 12.908 -12.703 991 HB3 LYS 129 1HB LYS 129 -15.573 14.490 -12.889 992 HG2 LYS 129 2HG LYS 129 -14.161 14.460 -14.738 993 HG3 LYS 129 1HG LYS 129 -13.133 15.252 -13.541 994 HD2 LYS 129 2HD LYS 129 -12.000 13.172 -13.045 995 HD3 LYS 129 1HD LYS 129 -13.123 12.268 -14.062 996 HE2 LYS 129 2HE LYS 129 -12.322 13.508 -16.054 997 HE3 LYS 129 1HE LYS 129 -11.170 14.389 -15.029 998 HZ1 LYS 129 3HZ LYS 129 -10.012 12.520 -15.862 999 HZ2 LYS 129 1HZ LYS 129 -11.297 11.467 -15.520 1000 HZ3 LYS 129 2HZ LYS 129 -10.397 12.146 -14.249 1001 H GLU 130 H GLU 130 -14.632 16.470 -12.742 1002 HA GLU 130 HA GLU 130 -15.549 18.059 -10.371 1003 HB2 GLU 130 2HB GLU 130 -14.382 18.803 -13.070 1004 HB3 GLU 130 1HB GLU 130 -14.996 19.988 -11.917 1005 HG2 GLU 130 2HG GLU 130 -12.828 19.972 -11.185 1006 HG3 GLU 130 1HG GLU 130 -13.381 18.559 -10.284 1007 H LYS 131 H LYS 131 -17.764 18.086 -10.281 1008 HA LYS 131 HA LYS 131 -20.017 18.112 -11.011 1009 HB2 LYS 131 2HB LYS 131 -18.436 20.214 -12.119 1010 HB3 LYS 131 1HB LYS 131 -19.587 19.710 -13.356 1011 HG2 LYS 131 2HG LYS 131 -21.336 19.782 -11.424 1012 HG3 LYS 131 1HG LYS 131 -20.137 20.776 -10.595 1013 HD2 LYS 131 2HD LYS 131 -20.062 22.185 -12.745 1014 HD3 LYS 131 1HD LYS 131 -21.540 21.340 -13.210 1015 HE2 LYS 131 2HE LYS 131 -22.490 23.135 -12.086 1016 HE3 LYS 131 1HE LYS 131 -22.238 22.055 -10.700 1017 HZ1 LYS 131 3HZ LYS 131 -20.822 24.468 -11.423 1018 HZ2 LYS 131 1HZ LYS 131 -19.808 23.173 -11.011 1019 HZ3 LYS 131 2HZ LYS 131 -20.980 23.716 -9.909 1020 H LEU 132 H LEU 132 -20.276 15.919 -11.723 1021 HA LEU 132 HA LEU 132 -19.972 15.521 -14.683 1022 HB2 LEU 132 2HB LEU 132 -18.446 14.266 -13.022 1023 HB3 LEU 132 1HB LEU 132 -19.892 13.364 -12.566 1024 HG LEU 132 HG LEU 132 -19.797 13.440 -15.411 1025 HD11 LEU 132 1HD1 LEU 132 -17.598 13.431 -15.898 1026 HD12 LEU 132 2HD1 LEU 132 -17.466 11.905 -15.024 1027 HD13 LEU 132 3HD1 LEU 132 -17.173 13.428 -14.186 1028 HD21 LEU 132 3HD2 LEU 132 -19.338 11.276 -13.336 1029 HD22 LEU 132 1HD2 LEU 132 -19.501 10.947 -15.061 1030 HD23 LEU 132 2HD2 LEU 132 -20.847 11.657 -14.167 1031 H GLU 133 H GLU 133 -22.329 16.638 -13.860 1032 HA GLU 133 HA GLU 133 -24.315 14.560 -13.224 1033 HB2 GLU 133 2HB GLU 133 -24.361 16.914 -12.370 1034 HB3 GLU 133 1HB GLU 133 -24.612 17.472 -14.024 1035 HG2 GLU 133 2HG GLU 133 -26.479 15.353 -13.335 1036 HG3 GLU 133 1HG GLU 133 -26.604 16.705 -12.211 Start of MODEL 23 1 H1 MET 1 1HT MET 1 3.029 -31.385 -0.744 2 H2 MET 1 2HT MET 1 1.525 -30.991 -1.428 3 H3 MET 1 3HT MET 1 1.934 -30.418 0.117 4 HA MET 1 HA MET 1 3.519 -29.689 -2.281 5 HB2 MET 1 2HB MET 1 0.919 -28.643 -1.169 6 HB3 MET 1 1HB MET 1 2.009 -27.569 -2.047 7 HG2 MET 1 2HG MET 1 1.451 -30.195 -3.317 8 HG3 MET 1 1HG MET 1 0.112 -29.048 -3.278 9 HE1 MET 1 2HE MET 1 -0.188 -27.961 -5.688 10 HE2 MET 1 3HE MET 1 0.357 -29.635 -5.746 11 HE3 MET 1 1HE MET 1 1.066 -28.433 -6.832 12 H MET 2 H MET 2 5.174 -28.293 -1.687 13 HA MET 2 HA MET 2 5.871 -27.984 1.091 14 HB2 MET 2 2HB MET 2 6.870 -27.283 -1.585 15 HB3 MET 2 1HB MET 2 7.328 -26.121 -0.339 16 HG2 MET 2 2HG MET 2 8.686 -27.607 0.732 17 HG3 MET 2 1HG MET 2 7.598 -28.964 0.435 18 HE1 MET 2 3HE MET 2 8.608 -30.772 -2.351 19 HE2 MET 2 1HE MET 2 7.435 -29.538 -2.836 20 HE3 MET 2 2HE MET 2 7.356 -30.252 -1.226 21 H GLU 3 H GLU 3 5.035 -26.503 2.500 22 HA GLU 3 HA GLU 3 3.481 -24.206 1.449 23 HB2 GLU 3 2HB GLU 3 2.811 -24.041 3.851 24 HB3 GLU 3 1HB GLU 3 2.490 -25.640 3.171 25 HG2 GLU 3 2HG GLU 3 4.406 -26.578 4.238 26 HG3 GLU 3 1HG GLU 3 5.063 -24.983 4.615 27 H GLU 4 H GLU 4 6.606 -24.838 2.476 28 HA GLU 4 HA GLU 4 7.059 -22.416 3.981 29 HB2 GLU 4 2HB GLU 4 8.885 -24.409 2.605 30 HB3 GLU 4 1HB GLU 4 9.465 -23.132 3.675 31 HG2 GLU 4 2HG GLU 4 8.002 -24.042 5.485 32 HG3 GLU 4 1HG GLU 4 7.565 -25.376 4.415 33 H TYR 5 H TYR 5 6.569 -22.990 0.726 34 HA TYR 5 HA TYR 5 8.422 -21.128 -0.464 35 HB2 TYR 5 2HB TYR 5 6.090 -22.767 -1.198 36 HB3 TYR 5 1HB TYR 5 6.259 -21.295 -2.154 37 HD1 TYR 5 2HD TYR 5 8.414 -20.842 -3.371 38 HD2 TYR 5 1HD TYR 5 7.589 -24.607 -1.473 39 HE1 TYR 5 2HE TYR 5 10.229 -21.903 -4.686 40 HE2 TYR 5 1HE TYR 5 9.405 -25.667 -2.790 41 HH TYR 5 HH TYR 5 11.148 -25.289 -4.151 42 H LEU 6 H LEU 6 5.143 -20.928 0.697 43 HA LEU 6 HA LEU 6 4.872 -18.072 0.015 44 HB2 LEU 6 2HB LEU 6 2.618 -18.398 0.848 45 HB3 LEU 6 1HB LEU 6 3.043 -19.832 -0.088 46 HG LEU 6 HG LEU 6 3.955 -20.574 2.357 47 HD11 LEU 6 1HD1 LEU 6 3.234 -18.887 3.758 48 HD12 LEU 6 2HD1 LEU 6 1.802 -19.915 3.787 49 HD13 LEU 6 3HD1 LEU 6 1.846 -18.493 2.745 50 HD21 LEU 6 3HD2 LEU 6 1.426 -21.494 2.541 51 HD22 LEU 6 1HD2 LEU 6 2.588 -22.145 1.385 52 HD23 LEU 6 2HD2 LEU 6 1.404 -20.946 0.864 53 H GLY 7 H GLY 7 5.741 -20.075 2.743 54 HA2 GLY 7 2HA GLY 7 5.231 -18.318 4.896 55 HA3 GLY 7 1HA GLY 7 6.539 -19.502 4.872 56 H VAL 8 H VAL 8 8.151 -18.572 2.834 57 HA VAL 8 HA VAL 8 9.354 -16.222 4.095 58 HB VAL 8 HB VAL 8 10.039 -17.948 1.710 59 HG11 VAL 8 1HG1 VAL 8 11.651 -15.723 3.001 60 HG12 VAL 8 2HG1 VAL 8 10.929 -15.670 1.392 61 HG13 VAL 8 3HG1 VAL 8 12.234 -16.806 1.735 62 HG21 VAL 8 3HG2 VAL 8 11.737 -18.875 3.175 63 HG22 VAL 8 1HG2 VAL 8 10.192 -18.939 4.023 64 HG23 VAL 8 2HG2 VAL 8 11.368 -17.688 4.425 65 H PHE 9 H PHE 9 7.552 -16.944 1.211 66 HA PHE 9 HA PHE 9 8.016 -14.490 -0.204 67 HB2 PHE 9 2HB PHE 9 6.338 -16.852 -0.342 68 HB3 PHE 9 1HB PHE 9 5.400 -15.413 -0.744 69 HD1 PHE 9 1HD PHE 9 7.508 -13.675 -1.910 70 HD2 PHE 9 2HD PHE 9 6.733 -17.865 -2.452 71 HE1 PHE 9 1HE PHE 9 8.591 -13.586 -4.138 72 HE2 PHE 9 2HE PHE 9 7.815 -17.776 -4.681 73 HZ PHE 9 HZ PHE 9 8.745 -15.636 -5.525 74 H VAL 10 H VAL 10 5.462 -15.498 2.077 75 HA VAL 10 HA VAL 10 4.194 -12.872 2.119 76 HB VAL 10 HB VAL 10 4.014 -15.259 3.992 77 HG11 VAL 10 1HG1 VAL 10 2.987 -12.692 4.300 78 HG12 VAL 10 2HG1 VAL 10 2.388 -14.145 5.102 79 HG13 VAL 10 3HG1 VAL 10 1.641 -13.594 3.602 80 HG21 VAL 10 3HG2 VAL 10 3.334 -15.076 1.279 81 HG22 VAL 10 1HG2 VAL 10 1.811 -14.839 2.136 82 HG23 VAL 10 2HG2 VAL 10 2.763 -16.295 2.420 83 H ASP 11 H ASP 11 6.597 -14.607 4.079 84 HA ASP 11 HA ASP 11 6.709 -12.885 6.324 85 HB2 ASP 11 2HB ASP 11 7.905 -14.969 6.305 86 HB3 ASP 11 1HB ASP 11 8.775 -14.520 4.838 87 H GLU 12 H GLU 12 7.674 -12.458 3.076 88 HA GLU 12 HA GLU 12 9.366 -10.090 3.606 89 HB2 GLU 12 2HB GLU 12 8.459 -11.674 1.196 90 HB3 GLU 12 1HB GLU 12 9.277 -10.123 1.002 91 HG2 GLU 12 2HG GLU 12 11.229 -10.914 2.158 92 HG3 GLU 12 1HG GLU 12 10.401 -12.388 2.663 93 H THR 13 H THR 13 6.139 -10.981 2.627 94 HA THR 13 HA THR 13 5.273 -8.402 1.654 95 HB THR 13 HB THR 13 4.069 -11.000 2.565 96 HG1 THR 13 1HG THR 13 3.879 -11.218 0.494 97 HG21 THR 13 3HG2 THR 13 2.436 -8.544 1.869 98 HG22 THR 13 1HG2 THR 13 2.600 -9.212 3.493 99 HG23 THR 13 2HG2 THR 13 1.811 -10.155 2.229 100 H LYS 14 H LYS 14 5.204 -10.013 4.837 101 HA LYS 14 HA LYS 14 3.718 -7.893 6.161 102 HB2 LYS 14 2HB LYS 14 5.510 -10.137 7.149 103 HB3 LYS 14 1HB LYS 14 4.481 -9.155 8.190 104 HG2 LYS 14 2HG LYS 14 2.565 -10.189 7.501 105 HG3 LYS 14 1HG LYS 14 3.138 -10.362 5.841 106 HD2 LYS 14 2HD LYS 14 4.124 -12.389 6.246 107 HD3 LYS 14 1HD LYS 14 4.578 -11.953 7.894 108 HE2 LYS 14 2HE LYS 14 1.912 -12.002 8.226 109 HE3 LYS 14 1HE LYS 14 2.044 -13.168 6.895 110 HZ1 LYS 14 3HZ LYS 14 3.733 -13.221 9.337 111 HZ2 LYS 14 1HZ LYS 14 3.701 -14.379 8.100 112 HZ3 LYS 14 2HZ LYS 14 2.354 -14.187 9.117 113 H GLU 15 H GLU 15 7.170 -8.725 5.831 114 HA GLU 15 HA GLU 15 8.149 -6.678 7.578 115 HB2 GLU 15 2HB GLU 15 10.010 -7.891 7.126 116 HB3 GLU 15 1HB GLU 15 9.090 -8.787 5.923 117 HG2 GLU 15 2HG GLU 15 9.705 -7.229 4.186 118 HG3 GLU 15 1HG GLU 15 10.452 -6.141 5.358 119 H TYR 16 H TYR 16 6.910 -6.670 4.404 120 HA TYR 16 HA TYR 16 8.072 -4.072 3.654 121 HB2 TYR 16 2HB TYR 16 6.873 -6.364 2.401 122 HB3 TYR 16 1HB TYR 16 5.994 -4.918 1.904 123 HD1 TYR 16 1HD TYR 16 9.586 -5.210 2.858 124 HD2 TYR 16 2HD TYR 16 6.761 -4.556 -0.310 125 HE1 TYR 16 1HE TYR 16 11.442 -4.606 1.329 126 HE2 TYR 16 2HE TYR 16 8.617 -3.952 -1.840 127 HH TYR 16 HH TYR 16 10.908 -4.114 -2.101 128 H LEU 17 H LEU 17 4.901 -5.409 4.617 129 HA LEU 17 HA LEU 17 3.313 -3.091 4.185 130 HB2 LEU 17 2HB LEU 17 3.248 -5.289 6.281 131 HB3 LEU 17 1HB LEU 17 1.940 -4.123 6.062 132 HG LEU 17 HG LEU 17 2.997 -5.744 3.756 133 HD11 LEU 17 1HD1 LEU 17 0.471 -6.626 4.997 134 HD12 LEU 17 2HD1 LEU 17 1.904 -6.929 5.981 135 HD13 LEU 17 3HD1 LEU 17 1.799 -7.587 4.347 136 HD21 LEU 17 3HD2 LEU 17 1.287 -4.791 2.603 137 HD22 LEU 17 1HD2 LEU 17 1.259 -3.614 3.916 138 HD23 LEU 17 2HD2 LEU 17 0.158 -4.992 3.941 139 H GLN 18 H GLN 18 5.338 -4.067 6.914 140 HA GLN 18 HA GLN 18 4.765 -1.806 8.586 141 HB2 GLN 18 2HB GLN 18 5.908 -3.196 9.935 142 HB3 GLN 18 1HB GLN 18 6.289 -4.199 8.543 143 HG2 GLN 18 2HG GLN 18 8.346 -3.110 8.167 144 HG3 GLN 18 1HG GLN 18 7.892 -1.720 9.155 145 HE21 GLN 18 1HE2 GLN 18 8.139 -1.893 11.468 146 HE22 GLN 18 2HE2 GLN 18 8.910 -3.214 12.203 147 H ASN 19 H ASN 19 7.316 -2.620 6.354 148 HA ASN 19 HA ASN 19 8.750 -0.155 6.438 149 HB2 ASN 19 2HB ASN 19 9.826 -1.985 5.394 150 HB3 ASN 19 1HB ASN 19 8.370 -2.439 4.505 151 HD21 ASN 19 1HD2 ASN 19 10.387 0.562 4.759 152 HD22 ASN 19 2HD2 ASN 19 10.476 0.811 3.081 153 H LEU 20 H LEU 20 5.804 -1.207 5.048 154 HA LEU 20 HA LEU 20 5.490 1.191 3.344 155 HB2 LEU 20 2HB LEU 20 4.749 -0.846 2.353 156 HB3 LEU 20 1HB LEU 20 3.947 -1.358 3.838 157 HG LEU 20 HG LEU 20 2.410 0.645 3.571 158 HD11 LEU 20 1HD1 LEU 20 4.268 1.228 1.503 159 HD12 LEU 20 2HD1 LEU 20 2.821 2.137 1.938 160 HD13 LEU 20 3HD1 LEU 20 2.730 0.866 0.722 161 HD21 LEU 20 3HD2 LEU 20 1.031 -0.459 1.842 162 HD22 LEU 20 1HD2 LEU 20 1.719 -1.642 2.954 163 HD23 LEU 20 2HD2 LEU 20 2.423 -1.426 1.352 164 H ASN 21 H ASN 21 4.873 0.181 6.514 165 HA ASN 21 HA ASN 21 2.581 1.994 6.905 166 HB2 ASN 21 2HB ASN 21 4.022 -0.158 8.414 167 HB3 ASN 21 1HB ASN 21 3.125 1.051 9.337 168 HD21 ASN 21 1HD2 ASN 21 2.379 -1.778 9.149 169 HD22 ASN 21 2HD2 ASN 21 0.865 -1.842 8.382 170 H ASP 22 H ASP 22 5.954 1.568 7.348 171 HA ASP 22 HA ASP 22 6.362 3.784 9.092 172 HB2 ASP 22 2HB ASP 22 7.992 1.888 7.499 173 HB3 ASP 22 1HB ASP 22 8.778 3.394 7.975 174 H THR 23 H THR 23 6.226 3.201 5.759 175 HA THR 23 HA THR 23 7.127 5.827 4.832 176 HB THR 23 HB THR 23 5.551 3.543 3.652 177 HG1 THR 23 1HG THR 23 8.285 4.147 3.253 178 HG21 THR 23 3HG2 THR 23 6.418 4.490 1.459 179 HG22 THR 23 1HG2 THR 23 6.915 5.918 2.365 180 HG23 THR 23 2HG2 THR 23 5.209 5.479 2.277 181 H LEU 24 H LEU 24 4.095 4.088 5.377 182 HA LEU 24 HA LEU 24 2.396 6.264 4.407 183 HB2 LEU 24 2HB LEU 24 2.088 3.544 5.655 184 HB3 LEU 24 1HB LEU 24 0.691 4.619 5.587 185 HG LEU 24 HG LEU 24 2.376 3.747 3.222 186 HD11 LEU 24 1HD1 LEU 24 0.143 2.709 2.547 187 HD12 LEU 24 2HD1 LEU 24 -0.387 3.001 4.203 188 HD13 LEU 24 3HD1 LEU 24 0.975 1.927 3.890 189 HD21 LEU 24 3HD2 LEU 24 -0.120 4.933 2.499 190 HD22 LEU 24 1HD2 LEU 24 1.504 5.517 2.138 191 HD23 LEU 24 2HD2 LEU 24 0.692 6.029 3.617 192 H LEU 25 H LEU 25 3.701 5.137 7.489 193 HA LEU 25 HA LEU 25 1.864 6.935 8.943 194 HB2 LEU 25 2HB LEU 25 2.720 5.945 10.879 195 HB3 LEU 25 1HB LEU 25 2.794 4.661 9.682 196 HG LEU 25 HG LEU 25 5.140 5.584 9.192 197 HD11 LEU 25 1HD1 LEU 25 4.307 7.223 11.414 198 HD12 LEU 25 2HD1 LEU 25 5.795 7.323 10.474 199 HD13 LEU 25 3HD1 LEU 25 5.711 6.265 11.883 200 HD21 LEU 25 3HD2 LEU 25 4.801 3.380 10.118 201 HD22 LEU 25 1HD2 LEU 25 4.378 4.051 11.692 202 HD23 LEU 25 2HD2 LEU 25 6.037 4.162 11.106 203 H GLU 26 H GLU 26 4.813 7.121 7.406 204 HA GLU 26 HA GLU 26 5.668 9.548 8.874 205 HB2 GLU 26 2HB GLU 26 6.847 7.797 6.697 206 HB3 GLU 26 1HB GLU 26 7.588 9.328 7.166 207 HG2 GLU 26 2HG GLU 26 7.015 7.037 9.067 208 HG3 GLU 26 1HG GLU 26 8.594 7.388 8.362 209 H LEU 27 H LEU 27 4.341 8.291 5.976 210 HA LEU 27 HA LEU 27 4.384 10.580 4.361 211 HB2 LEU 27 2HB LEU 27 3.911 8.408 3.441 212 HB3 LEU 27 1HB LEU 27 2.568 8.179 4.557 213 HG LEU 27 HG LEU 27 1.607 10.329 3.426 214 HD11 LEU 27 1HD1 LEU 27 2.951 11.182 1.827 215 HD12 LEU 27 2HD1 LEU 27 2.536 9.770 0.853 216 HD13 LEU 27 3HD1 LEU 27 3.989 9.756 1.852 217 HD21 LEU 27 3HD2 LEU 27 0.698 8.832 1.551 218 HD22 LEU 27 1HD2 LEU 27 0.463 8.249 3.200 219 HD23 LEU 27 2HD2 LEU 27 1.747 7.570 2.199 220 H GLU 28 H GLU 28 2.358 9.603 7.029 221 HA GLU 28 HA GLU 28 0.198 11.456 6.516 222 HB2 GLU 28 2HB GLU 28 -0.576 10.629 8.548 223 HB3 GLU 28 1HB GLU 28 0.546 9.354 8.090 224 HG2 GLU 28 2HG GLU 28 2.294 10.359 9.463 225 HG3 GLU 28 1HG GLU 28 1.216 11.680 9.899 226 H LYS 29 H LYS 29 3.211 11.564 8.392 227 HA LYS 29 HA LYS 29 2.805 14.328 9.262 228 HB2 LYS 29 2HB LYS 29 5.368 12.716 9.125 229 HB3 LYS 29 1HB LYS 29 5.023 14.070 10.200 230 HG2 LYS 29 2HG LYS 29 3.793 12.788 11.642 231 HG3 LYS 29 1HG LYS 29 3.170 11.755 10.357 232 HD2 LYS 29 2HD LYS 29 5.602 10.899 10.145 233 HD3 LYS 29 1HD LYS 29 5.843 11.617 11.737 234 HE2 LYS 29 2HE LYS 29 3.390 9.989 11.534 235 HE3 LYS 29 1HE LYS 29 4.888 9.067 11.321 236 HZ1 LYS 29 3HZ LYS 29 5.070 9.171 13.533 237 HZ2 LYS 29 1HZ LYS 29 3.873 10.363 13.674 238 HZ3 LYS 29 2HZ LYS 29 5.477 10.806 13.332 239 H ASN 30 H ASN 30 3.820 12.649 6.520 240 HA ASN 30 HA ASN 30 4.546 15.193 5.167 241 HB2 ASN 30 2HB ASN 30 6.308 12.824 5.687 242 HB3 ASN 30 1HB ASN 30 6.462 13.619 4.121 243 HD21 ASN 30 1HD2 ASN 30 7.986 13.620 6.981 244 HD22 ASN 30 2HD2 ASN 30 8.406 15.258 7.124 245 HA PRO 31 HA PRO 31 1.874 12.447 2.795 246 HB2 PRO 31 2HB PRO 31 -0.289 14.084 2.810 247 HB3 PRO 31 1HB PRO 31 0.104 12.982 4.137 248 HG2 PRO 31 2HG PRO 31 0.314 15.897 4.020 249 HG3 PRO 31 1HG PRO 31 0.134 14.824 5.413 250 HD2 PRO 31 2HD PRO 31 2.515 16.037 4.444 251 HD3 PRO 31 1HD PRO 31 2.340 14.898 5.797 252 H GLU 32 H GLU 32 3.656 15.063 2.207 253 HA GLU 32 HA GLU 32 2.520 15.457 -0.531 254 HB2 GLU 32 2HB GLU 32 4.139 17.655 0.561 255 HB3 GLU 32 1HB GLU 32 2.560 17.719 -0.217 256 HG2 GLU 32 2HG GLU 32 1.465 17.051 1.863 257 HG3 GLU 32 1HG GLU 32 3.035 16.857 2.650 258 H ASP 33 H ASP 33 5.053 14.395 1.363 259 HA ASP 33 HA ASP 33 7.280 15.141 -0.313 260 HB2 ASP 33 2HB ASP 33 6.759 13.899 2.196 261 HB3 ASP 33 1HB ASP 33 7.742 12.777 1.253 262 H MET 34 H MET 34 7.793 14.163 -2.251 263 HA MET 34 HA MET 34 6.211 11.976 -3.284 264 HB2 MET 34 2HB MET 34 8.825 13.201 -4.225 265 HB3 MET 34 1HB MET 34 7.728 12.232 -5.209 266 HG2 MET 34 2HG MET 34 6.100 14.215 -4.088 267 HG3 MET 34 1HG MET 34 7.581 15.060 -4.541 268 HE1 MET 34 3HE MET 34 4.812 15.424 -5.309 269 HE2 MET 34 1HE MET 34 4.089 14.081 -6.207 270 HE3 MET 34 2HE MET 34 4.622 15.531 -7.057 271 H GLU 35 H GLU 35 8.640 11.881 -0.997 272 HA GLU 35 HA GLU 35 9.933 9.432 -2.030 273 HB2 GLU 35 2HB GLU 35 11.387 9.711 -0.142 274 HB3 GLU 35 1HB GLU 35 11.056 11.339 -0.729 275 HG2 GLU 35 2HG GLU 35 9.278 11.581 0.979 276 HG3 GLU 35 1HG GLU 35 9.660 9.966 1.583 277 H LEU 36 H LEU 36 7.827 10.391 0.697 278 HA LEU 36 HA LEU 36 7.402 7.626 1.538 279 HB2 LEU 36 2HB LEU 36 5.950 10.243 2.096 280 HB3 LEU 36 1HB LEU 36 5.631 8.731 2.941 281 HG LEU 36 HG LEU 36 8.316 10.100 2.852 282 HD11 LEU 36 1HD1 LEU 36 6.089 10.132 4.872 283 HD12 LEU 36 2HD1 LEU 36 6.948 11.503 4.177 284 HD13 LEU 36 3HD1 LEU 36 7.756 10.454 5.342 285 HD21 LEU 36 3HD2 LEU 36 7.337 7.497 3.792 286 HD22 LEU 36 1HD2 LEU 36 8.236 8.390 5.018 287 HD23 LEU 36 2HD2 LEU 36 8.990 8.019 3.468 288 H ILE 37 H ILE 37 6.075 9.874 -0.744 289 HA ILE 37 HA ILE 37 3.547 8.488 -1.173 290 HB ILE 37 HB ILE 37 5.186 10.645 -2.496 291 HG12 ILE 37 2HG1 ILE 37 2.464 10.492 -1.174 292 HG13 ILE 37 1HG1 ILE 37 3.906 11.290 -0.549 293 HG21 ILE 37 1HG2 ILE 37 4.184 9.386 -4.342 294 HG22 ILE 37 2HG2 ILE 37 3.352 10.928 -4.144 295 HG23 ILE 37 3HG2 ILE 37 2.609 9.443 -3.549 296 HD11 ILE 37 3HD1 ILE 37 3.640 12.463 -3.022 297 HD12 ILE 37 1HD1 ILE 37 3.051 13.159 -1.512 298 HD13 ILE 37 2HD1 ILE 37 1.957 12.234 -2.542 299 H ASN 38 H ASN 38 6.815 8.423 -2.561 300 HA ASN 38 HA ASN 38 5.968 6.470 -4.615 301 HB2 ASN 38 2HB ASN 38 7.701 8.480 -4.735 302 HB3 ASN 38 1HB ASN 38 8.807 7.269 -4.086 303 HD21 ASN 38 1HD2 ASN 38 9.176 8.298 -6.724 304 HD22 ASN 38 2HD2 ASN 38 8.856 7.057 -7.838 305 H GLU 39 H GLU 39 7.481 6.588 -1.526 306 HA GLU 39 HA GLU 39 8.720 3.967 -1.615 307 HB2 GLU 39 2HB GLU 39 7.980 6.012 0.457 308 HB3 GLU 39 1HB GLU 39 8.477 4.404 0.984 309 HG2 GLU 39 2HG GLU 39 10.564 4.629 -0.328 310 HG3 GLU 39 1HG GLU 39 10.072 6.251 -0.812 311 H ALA 40 H ALA 40 5.617 5.261 -0.993 312 HA ALA 40 HA ALA 40 4.503 2.788 0.158 313 HB1 ALA 40 1HB ALA 40 3.955 5.301 0.650 314 HB2 ALA 40 2HB ALA 40 2.623 4.150 0.566 315 HB3 ALA 40 3HB ALA 40 2.973 5.197 -0.810 316 H PHE 41 H PHE 41 3.814 4.816 -2.753 317 HA PHE 41 HA PHE 41 2.087 3.103 -4.119 318 HB2 PHE 41 2HB PHE 41 2.607 5.246 -5.023 319 HB3 PHE 41 1HB PHE 41 4.341 4.922 -4.998 320 HD1 PHE 41 1HD PHE 41 5.246 3.065 -6.519 321 HD2 PHE 41 2HD PHE 41 1.314 4.742 -6.936 322 HE1 PHE 41 1HE PHE 41 5.115 2.183 -8.832 323 HE2 PHE 41 2HE PHE 41 1.184 3.857 -9.248 324 HZ PHE 41 HZ PHE 41 3.083 2.578 -10.197 325 H ARG 42 H ARG 42 5.623 2.890 -3.840 326 HA ARG 42 HA ARG 42 6.014 0.743 -5.714 327 HB2 ARG 42 2HB ARG 42 7.487 1.968 -3.396 328 HB3 ARG 42 1HB ARG 42 8.114 0.497 -4.140 329 HG2 ARG 42 2HG ARG 42 7.882 1.721 -6.383 330 HG3 ARG 42 1HG ARG 42 7.670 3.192 -5.430 331 HD2 ARG 42 2HD ARG 42 9.859 3.179 -4.667 332 HD3 ARG 42 1HD ARG 42 9.991 1.412 -4.775 333 HE ARG 42 HE ARG 42 9.720 1.968 -7.376 334 HH11 ARG 42 1HH2 ARG 42 10.735 4.574 -5.559 335 HH12 ARG 42 2HH2 ARG 42 12.252 4.787 -6.366 336 HH21 ARG 42 1HH1 ARG 42 12.006 1.834 -8.169 337 HH22 ARG 42 2HH1 ARG 42 12.970 3.237 -7.850 338 H ALA 43 H ALA 43 6.380 0.530 -2.167 339 HA ALA 43 HA ALA 43 6.298 -2.198 -1.782 340 HB1 ALA 43 1HB ALA 43 6.465 -1.116 0.224 341 HB2 ALA 43 2HB ALA 43 4.709 -1.283 0.262 342 HB3 ALA 43 3HB ALA 43 5.441 0.216 -0.311 343 H LEU 44 H LEU 44 3.384 -0.125 -2.060 344 HA LEU 44 HA LEU 44 1.519 -2.313 -1.923 345 HB2 LEU 44 2HB LEU 44 1.443 0.532 -2.946 346 HB3 LEU 44 1HB LEU 44 0.008 -0.496 -2.925 347 HG LEU 44 HG LEU 44 1.648 -0.262 -0.431 348 HD11 LEU 44 1HD1 LEU 44 1.390 1.993 -0.454 349 HD12 LEU 44 2HD1 LEU 44 -0.303 1.652 -0.094 350 HD13 LEU 44 3HD1 LEU 44 0.207 1.933 -1.760 351 HD21 LEU 44 3HD2 LEU 44 -1.092 -1.039 -1.267 352 HD22 LEU 44 1HD2 LEU 44 -0.970 -0.193 0.276 353 HD23 LEU 44 2HD2 LEU 44 -0.081 -1.694 0.020 354 H HIS 45 H HIS 45 3.195 -0.715 -4.602 355 HA HIS 45 HA HIS 45 1.695 -2.071 -6.695 356 HB2 HIS 45 2HB HIS 45 2.735 -0.066 -7.339 357 HB3 HIS 45 1HB HIS 45 4.199 -0.422 -6.423 358 HD1 HIS 45 1HD HIS 45 6.031 -1.769 -7.584 359 HD2 HIS 45 2HD HIS 45 2.561 -1.460 -9.873 360 HE1 HIS 45 1HE HIS 45 6.606 -2.667 -9.881 361 H THR 46 H THR 46 4.599 -2.666 -4.818 362 HA THR 46 HA THR 46 5.429 -5.004 -6.377 363 HB THR 46 HB THR 46 6.320 -3.352 -4.081 364 HG1 THR 46 1HG THR 46 8.303 -4.481 -5.349 365 HG21 THR 46 3HG2 THR 46 6.807 -6.324 -4.183 366 HG22 THR 46 1HG2 THR 46 6.361 -5.327 -2.798 367 HG23 THR 46 2HG2 THR 46 7.992 -5.234 -3.463 368 H LEU 47 H LEU 47 3.530 -4.299 -3.491 369 HA LEU 47 HA LEU 47 3.365 -7.081 -2.607 370 HB2 LEU 47 2HB LEU 47 2.484 -4.391 -1.803 371 HB3 LEU 47 1HB LEU 47 1.321 -5.658 -1.413 372 HG LEU 47 HG LEU 47 4.266 -5.802 -0.730 373 HD11 LEU 47 1HD1 LEU 47 3.835 -4.446 1.013 374 HD12 LEU 47 2HD1 LEU 47 2.622 -5.593 1.581 375 HD13 LEU 47 3HD1 LEU 47 2.158 -4.285 0.494 376 HD21 LEU 47 3HD2 LEU 47 1.934 -7.381 0.387 377 HD22 LEU 47 1HD2 LEU 47 3.654 -7.715 0.583 378 HD23 LEU 47 2HD2 LEU 47 2.886 -7.938 -0.989 379 H LYS 48 H LYS 48 1.235 -4.793 -4.349 380 HA LYS 48 HA LYS 48 -0.972 -6.659 -4.596 381 HB2 LYS 48 2HB LYS 48 -1.859 -4.951 -6.056 382 HB3 LYS 48 1HB LYS 48 -1.005 -4.122 -4.756 383 HG2 LYS 48 2HG LYS 48 0.131 -3.043 -6.371 384 HG3 LYS 48 1HG LYS 48 0.966 -4.570 -6.661 385 HD2 LYS 48 2HD LYS 48 -1.010 -5.186 -8.173 386 HD3 LYS 48 1HD LYS 48 -1.468 -3.485 -8.079 387 HE2 LYS 48 2HE LYS 48 0.116 -2.924 -9.584 388 HE3 LYS 48 1HE LYS 48 1.366 -3.752 -8.634 389 HZ1 LYS 48 3HZ LYS 48 -0.588 -5.423 -10.018 390 HZ2 LYS 48 1HZ LYS 48 1.063 -5.697 -9.739 391 HZ3 LYS 48 2HZ LYS 48 0.576 -4.655 -10.989 392 H GLY 49 H GLY 49 2.063 -6.237 -6.198 393 HA2 GLY 49 2HA GLY 49 1.293 -7.514 -8.706 394 HA3 GLY 49 1HA GLY 49 2.944 -7.168 -8.182 395 H MET 50 H MET 50 3.111 -8.531 -5.790 396 HA MET 50 HA MET 50 3.306 -11.300 -6.699 397 HB2 MET 50 2HB MET 50 4.199 -11.595 -4.365 398 HB3 MET 50 1HB MET 50 5.007 -10.313 -5.266 399 HG2 MET 50 2HG MET 50 4.254 -8.705 -3.864 400 HG3 MET 50 1HG MET 50 2.632 -9.390 -3.821 401 HE1 MET 50 3HE MET 50 4.762 -8.135 -1.392 402 HE2 MET 50 1HE MET 50 6.008 -8.978 -2.323 403 HE3 MET 50 2HE MET 50 5.712 -9.413 -0.639 404 H ALA 51 H ALA 51 0.861 -9.410 -5.268 405 HA ALA 51 HA ALA 51 -0.434 -11.665 -3.849 406 HB1 ALA 51 1HB ALA 51 -0.681 -8.716 -4.083 407 HB2 ALA 51 2HB ALA 51 -0.868 -9.748 -2.664 408 HB3 ALA 51 3HB ALA 51 -2.193 -9.585 -3.819 409 H GLY 52 H GLY 52 -0.477 -10.112 -6.946 410 HA2 GLY 52 2HA GLY 52 -3.173 -11.059 -7.629 411 HA3 GLY 52 1HA GLY 52 -2.061 -10.225 -8.717 412 H THR 53 H THR 53 -1.621 -13.190 -6.790 413 HA THR 53 HA THR 53 -1.904 -15.098 -8.818 414 HB THR 53 HB THR 53 0.531 -13.428 -8.919 415 HG1 THR 53 1HG THR 53 -0.233 -15.166 -10.942 416 HG21 THR 53 3HG2 THR 53 0.675 -16.405 -8.803 417 HG22 THR 53 1HG2 THR 53 1.869 -15.200 -8.318 418 HG23 THR 53 2HG2 THR 53 1.654 -15.593 -10.025 419 H MET 54 H MET 54 0.219 -14.074 -6.267 420 HA MET 54 HA MET 54 0.210 -16.832 -5.113 421 HB2 MET 54 2HB MET 54 2.213 -14.975 -5.695 422 HB3 MET 54 1HB MET 54 2.011 -14.880 -3.948 423 HG2 MET 54 2HG MET 54 2.666 -17.080 -3.610 424 HG3 MET 54 1HG MET 54 2.128 -17.591 -5.210 425 HE1 MET 54 3HE MET 54 4.765 -15.966 -3.022 426 HE2 MET 54 1HE MET 54 4.378 -14.568 -4.036 427 HE3 MET 54 2HE MET 54 5.969 -15.317 -4.132 428 H GLY 55 H GLY 55 -0.988 -13.707 -4.807 429 HA2 GLY 55 2HA GLY 55 -1.846 -14.244 -1.992 430 HA3 GLY 55 1HA GLY 55 -1.370 -12.624 -2.519 431 H PHE 56 H PHE 56 -2.825 -14.349 -5.002 432 HA PHE 56 HA PHE 56 -4.986 -14.265 -5.977 433 HB2 PHE 56 2HB PHE 56 -5.326 -14.237 -3.111 434 HB3 PHE 56 1HB PHE 56 -6.544 -13.202 -3.855 435 HD1 PHE 56 2HD PHE 56 -4.955 -16.576 -4.215 436 HD2 PHE 56 1HD PHE 56 -8.461 -14.164 -4.797 437 HE1 PHE 56 2HE PHE 56 -6.219 -18.588 -4.927 438 HE2 PHE 56 1HE PHE 56 -9.728 -16.176 -5.508 439 HZ PHE 56 HZ PHE 56 -8.607 -18.388 -5.573 440 H SER 57 H SER 57 -5.306 -12.624 -7.423 441 HA SER 57 HA SER 57 -4.548 -9.923 -7.002 442 HB2 SER 57 2HB SER 57 -6.680 -10.740 -8.941 443 HB3 SER 57 1HB SER 57 -5.339 -9.624 -9.178 444 HG SER 57 HG SER 57 -4.065 -11.252 -9.640 445 H SER 58 H SER 58 -7.276 -11.606 -5.914 446 HA SER 58 HA SER 58 -9.234 -9.494 -5.904 447 HB2 SER 58 2HB SER 58 -8.857 -11.797 -3.962 448 HB3 SER 58 1HB SER 58 -10.362 -10.946 -4.297 449 HG SER 58 HG SER 58 -10.605 -12.118 -6.025 450 H MET 59 H MET 59 -6.594 -10.460 -3.813 451 HA MET 59 HA MET 59 -7.190 -8.275 -1.883 452 HB2 MET 59 2HB MET 59 -6.709 -10.592 -1.108 453 HB3 MET 59 1HB MET 59 -5.141 -10.519 -1.907 454 HG2 MET 59 2HG MET 59 -5.934 -8.440 0.127 455 HG3 MET 59 1HG MET 59 -5.250 -9.983 0.636 456 HE1 MET 59 3HE MET 59 -3.181 -10.275 -2.246 457 HE2 MET 59 1HE MET 59 -3.402 -11.034 -0.664 458 HE3 MET 59 2HE MET 59 -1.892 -10.211 -1.046 459 H ALA 60 H ALA 60 -5.120 -9.164 -4.529 460 HA ALA 60 HA ALA 60 -2.959 -7.310 -3.908 461 HB1 ALA 60 1HB ALA 60 -3.435 -8.078 -6.714 462 HB2 ALA 60 2HB ALA 60 -3.385 -9.447 -5.602 463 HB3 ALA 60 3HB ALA 60 -2.013 -8.345 -5.707 464 H LYS 61 H LYS 61 -5.964 -7.223 -5.794 465 HA LYS 61 HA LYS 61 -5.508 -4.707 -7.101 466 HB2 LYS 61 2HB LYS 61 -7.809 -4.908 -7.640 467 HB3 LYS 61 1HB LYS 61 -7.295 -6.575 -7.411 468 HG2 LYS 61 2HG LYS 61 -8.191 -6.602 -5.158 469 HG3 LYS 61 1HG LYS 61 -8.579 -4.887 -5.261 470 HD2 LYS 61 2HD LYS 61 -10.517 -6.518 -5.675 471 HD3 LYS 61 1HD LYS 61 -10.280 -5.255 -6.882 472 HE2 LYS 61 2HE LYS 61 -9.539 -6.744 -8.492 473 HE3 LYS 61 1HE LYS 61 -8.835 -7.846 -7.293 474 HZ1 LYS 61 3HZ LYS 61 -11.701 -7.451 -7.938 475 HZ2 LYS 61 1HZ LYS 61 -11.190 -8.221 -6.516 476 HZ3 LYS 61 2HZ LYS 61 -10.799 -8.889 -8.029 477 H LEU 62 H LEU 62 -6.558 -5.653 -3.914 478 HA LEU 62 HA LEU 62 -7.559 -3.140 -2.968 479 HB2 LEU 62 2HB LEU 62 -7.968 -5.147 -1.704 480 HB3 LEU 62 1HB LEU 62 -6.258 -5.562 -1.696 481 HG LEU 62 HG LEU 62 -5.730 -3.834 -0.165 482 HD11 LEU 62 1HD1 LEU 62 -6.777 -1.867 -0.649 483 HD12 LEU 62 2HD1 LEU 62 -7.963 -2.423 0.530 484 HD13 LEU 62 3HD1 LEU 62 -8.249 -2.672 -1.193 485 HD21 LEU 62 3HD2 LEU 62 -7.383 -5.855 0.539 486 HD22 LEU 62 1HD2 LEU 62 -8.392 -4.482 0.993 487 HD23 LEU 62 2HD2 LEU 62 -6.786 -4.667 1.696 488 H CYS 63 H CYS 63 -4.333 -4.627 -3.052 489 HA CYS 63 HA CYS 63 -3.009 -2.432 -1.696 490 HB2 CYS 63 2HB CYS 63 -2.178 -4.809 -3.365 491 HB3 CYS 63 1HB CYS 63 -0.986 -3.659 -2.758 492 HG CYS 63 HG CYS 63 -1.540 -4.339 -0.350 493 H HIS 64 H HIS 64 -3.562 -3.320 -5.098 494 HA HIS 64 HA HIS 64 -1.926 -1.365 -6.339 495 HB2 HIS 64 2HB HIS 64 -3.203 -3.352 -7.324 496 HB3 HIS 64 1HB HIS 64 -4.645 -2.337 -7.270 497 HD1 HIS 64 1HD HIS 64 -1.074 -1.478 -8.321 498 HD2 HIS 64 2HD HIS 64 -4.945 -1.440 -9.869 499 HE1 HIS 64 1HE HIS 64 -0.917 -0.425 -10.620 500 H THR 65 H THR 65 -5.115 -1.146 -4.825 501 HA THR 65 HA THR 65 -5.750 1.471 -5.875 502 HB THR 65 HB THR 65 -6.936 -0.555 -4.243 503 HG1 THR 65 1HG THR 65 -7.611 1.110 -6.064 504 HG21 THR 65 3HG2 THR 65 -6.579 0.600 -2.215 505 HG22 THR 65 1HG2 THR 65 -8.202 1.087 -2.701 506 HG23 THR 65 2HG2 THR 65 -6.843 2.174 -2.967 507 H LEU 66 H LEU 66 -4.765 0.465 -2.574 508 HA LEU 66 HA LEU 66 -4.313 2.924 -1.348 509 HB2 LEU 66 2HB LEU 66 -2.343 0.614 -1.287 510 HB3 LEU 66 1HB LEU 66 -2.718 1.736 0.017 511 HG LEU 66 HG LEU 66 -4.446 -0.487 -1.082 512 HD11 LEU 66 1HD1 LEU 66 -4.473 -0.382 1.717 513 HD12 LEU 66 2HD1 LEU 66 -2.807 -0.028 1.261 514 HD13 LEU 66 3HD1 LEU 66 -3.572 -1.519 0.713 515 HD21 LEU 66 3HD2 LEU 66 -5.672 1.783 -0.739 516 HD22 LEU 66 1HD2 LEU 66 -5.369 1.518 0.977 517 HD23 LEU 66 2HD2 LEU 66 -6.336 0.362 0.064 518 H GLU 67 H GLU 67 -2.319 1.206 -3.687 519 HA GLU 67 HA GLU 67 -0.165 3.158 -3.786 520 HB2 GLU 67 2HB GLU 67 0.392 0.970 -4.431 521 HB3 GLU 67 1HB GLU 67 -1.135 0.733 -5.276 522 HG2 GLU 67 2HG GLU 67 0.418 2.902 -6.453 523 HG3 GLU 67 1HG GLU 67 1.318 1.386 -6.448 524 H ASN 68 H ASN 68 -3.002 2.376 -5.799 525 HA ASN 68 HA ASN 68 -2.680 4.243 -7.878 526 HB2 ASN 68 2HB ASN 68 -4.584 2.480 -6.915 527 HB3 ASN 68 1HB ASN 68 -5.378 4.047 -6.763 528 HD21 ASN 68 1HD2 ASN 68 -5.893 1.813 -8.760 529 HD22 ASN 68 2HD2 ASN 68 -5.730 2.545 -10.284 530 H ILE 69 H ILE 69 -4.049 4.671 -4.626 531 HA ILE 69 HA ILE 69 -4.821 7.420 -4.939 532 HB ILE 69 HB ILE 69 -3.794 6.212 -2.368 533 HG12 ILE 69 2HG1 ILE 69 -5.375 4.622 -3.626 534 HG13 ILE 69 1HG1 ILE 69 -5.822 5.051 -1.993 535 HG21 ILE 69 1HG2 ILE 69 -6.216 7.574 -1.991 536 HG22 ILE 69 2HG2 ILE 69 -5.325 8.546 -3.162 537 HG23 ILE 69 3HG2 ILE 69 -4.600 8.165 -1.600 538 HD11 ILE 69 3HD1 ILE 69 -6.840 6.665 -4.301 539 HD12 ILE 69 1HD1 ILE 69 -7.546 6.442 -2.698 540 HD13 ILE 69 2HD1 ILE 69 -7.614 5.133 -3.882 541 H LEU 70 H LEU 70 -1.973 5.751 -3.954 542 HA LEU 70 HA LEU 70 -0.330 8.069 -3.408 543 HB2 LEU 70 2HB LEU 70 0.327 5.191 -4.112 544 HB3 LEU 70 1HB LEU 70 1.473 6.352 -3.435 545 HG LEU 70 HG LEU 70 -1.151 5.753 -2.075 546 HD11 LEU 70 1HD1 LEU 70 1.013 3.929 -2.435 547 HD12 LEU 70 2HD1 LEU 70 -0.420 3.731 -1.426 548 HD13 LEU 70 3HD1 LEU 70 1.033 4.466 -0.756 549 HD21 LEU 70 3HD2 LEU 70 0.011 7.769 -1.367 550 HD22 LEU 70 1HD2 LEU 70 1.518 6.875 -1.176 551 HD23 LEU 70 2HD2 LEU 70 0.160 6.551 -0.100 552 H ASP 71 H ASP 71 -1.431 6.416 -6.170 553 HA ASP 71 HA ASP 71 0.629 7.383 -8.002 554 HB2 ASP 71 2HB ASP 71 -0.954 5.310 -8.180 555 HB3 ASP 71 1HB ASP 71 -2.167 6.474 -8.716 556 H LYS 72 H LYS 72 -2.800 8.214 -7.212 557 HA LYS 72 HA LYS 72 -2.907 10.519 -8.920 558 HB2 LYS 72 2HB LYS 72 -4.268 9.470 -6.486 559 HB3 LYS 72 1HB LYS 72 -4.636 11.113 -7.004 560 HG2 LYS 72 2HG LYS 72 -5.778 10.393 -8.837 561 HG3 LYS 72 1HG LYS 72 -4.650 9.063 -9.130 562 HD2 LYS 72 2HD LYS 72 -6.306 8.954 -6.673 563 HD3 LYS 72 1HD LYS 72 -7.110 8.603 -8.205 564 HE2 LYS 72 2HE LYS 72 -4.669 7.218 -8.306 565 HE3 LYS 72 1HE LYS 72 -5.299 6.950 -6.667 566 HZ1 LYS 72 3HZ LYS 72 -7.059 6.791 -9.039 567 HZ2 LYS 72 1HZ LYS 72 -7.317 6.155 -7.488 568 HZ3 LYS 72 2HZ LYS 72 -6.173 5.438 -8.518 569 H ALA 73 H ALA 73 -1.730 9.894 -5.727 570 HA ALA 73 HA ALA 73 -1.268 12.557 -4.789 571 HB1 ALA 73 1HB ALA 73 -0.849 11.062 -3.093 572 HB2 ALA 73 2HB ALA 73 0.778 11.003 -3.771 573 HB3 ALA 73 3HB ALA 73 -0.411 9.782 -4.229 574 H ARG 74 H ARG 74 0.520 10.322 -6.818 575 HA ARG 74 HA ARG 74 2.773 12.178 -7.220 576 HB2 ARG 74 2HB ARG 74 1.974 9.495 -8.407 577 HB3 ARG 74 1HB ARG 74 3.501 10.310 -8.749 578 HG2 ARG 74 2HG ARG 74 4.235 10.109 -6.495 579 HG3 ARG 74 1HG ARG 74 2.621 9.675 -5.929 580 HD2 ARG 74 2HD ARG 74 4.026 7.654 -6.056 581 HD3 ARG 74 1HD ARG 74 2.761 7.569 -7.300 582 HE ARG 74 HE ARG 74 5.536 8.539 -7.890 583 HH11 ARG 74 1HH1 ARG 74 3.497 5.924 -8.303 584 HH12 ARG 74 2HH1 ARG 74 3.645 5.847 -10.026 585 HH21 ARG 74 1HH2 ARG 74 5.373 8.840 -10.283 586 HH22 ARG 74 2HH2 ARG 74 4.710 7.492 -11.146 587 H ASN 75 H ASN 75 -0.307 11.450 -8.580 588 HA ASN 75 HA ASN 75 0.343 12.711 -11.203 589 HB2 ASN 75 2HB ASN 75 -1.081 10.538 -10.624 590 HB3 ASN 75 1HB ASN 75 -2.367 11.720 -10.378 591 HD21 ASN 75 1HD2 ASN 75 -1.010 13.510 -12.495 592 HD22 ASN 75 2HD2 ASN 75 -1.474 12.817 -13.972 593 H SER 76 H SER 76 -0.584 13.690 -8.157 594 HA SER 76 HA SER 76 -1.324 15.802 -7.391 595 HB2 SER 76 2HB SER 76 -0.267 16.304 -9.805 596 HB3 SER 76 1HB SER 76 -1.952 16.646 -10.189 597 HG SER 76 HG SER 76 -1.588 18.489 -9.259 598 H GLU 77 H GLU 77 -3.108 13.474 -7.849 599 HA GLU 77 HA GLU 77 -5.647 14.888 -8.497 600 HB2 GLU 77 2HB GLU 77 -4.777 12.006 -8.576 601 HB3 GLU 77 1HB GLU 77 -6.456 12.491 -8.798 602 HG2 GLU 77 2HG GLU 77 -4.650 14.075 -10.440 603 HG3 GLU 77 1HG GLU 77 -4.486 12.351 -10.777 604 H ILE 78 H ILE 78 -4.088 12.757 -6.182 605 HA ILE 78 HA ILE 78 -6.151 13.591 -4.162 606 HB ILE 78 HB ILE 78 -6.125 11.322 -3.295 607 HG12 ILE 78 2HG1 ILE 78 -4.775 9.624 -4.753 608 HG13 ILE 78 1HG1 ILE 78 -3.834 11.043 -5.219 609 HG21 ILE 78 1HG2 ILE 78 -7.639 11.727 -5.179 610 HG22 ILE 78 2HG2 ILE 78 -6.985 10.092 -5.279 611 HG23 ILE 78 3HG2 ILE 78 -6.346 11.363 -6.320 612 HD11 ILE 78 3HD1 ILE 78 -3.715 9.503 -2.791 613 HD12 ILE 78 1HD1 ILE 78 -4.115 11.184 -2.423 614 HD13 ILE 78 2HD1 ILE 78 -2.657 10.803 -3.342 615 H LYS 79 H LYS 79 -5.310 13.425 -1.901 616 HA LYS 79 HA LYS 79 -2.378 13.298 -1.617 617 HB2 LYS 79 2HB LYS 79 -2.186 15.556 -0.901 618 HB3 LYS 79 1HB LYS 79 -3.259 15.640 -2.290 619 HG2 LYS 79 2HG LYS 79 -4.369 16.955 -0.682 620 HG3 LYS 79 1HG LYS 79 -5.193 15.404 -0.592 621 HD2 LYS 79 2HD LYS 79 -4.340 16.686 1.602 622 HD3 LYS 79 1HD LYS 79 -4.362 14.931 1.509 623 HE2 LYS 79 2HE LYS 79 -2.028 14.811 1.100 624 HE3 LYS 79 1HE LYS 79 -1.931 16.533 0.689 625 HZ1 LYS 79 3HZ LYS 79 -1.212 16.346 2.926 626 HZ2 LYS 79 1HZ LYS 79 -2.512 15.339 3.343 627 HZ3 LYS 79 2HZ LYS 79 -2.788 16.978 2.990 628 H ILE 80 H ILE 80 -1.797 12.770 0.565 629 HA ILE 80 HA ILE 80 -3.796 11.403 2.108 630 HB ILE 80 HB ILE 80 -0.986 12.340 2.509 631 HG12 ILE 80 2HG1 ILE 80 -0.693 9.807 2.654 632 HG13 ILE 80 1HG1 ILE 80 -2.377 9.692 2.149 633 HG21 ILE 80 1HG2 ILE 80 -1.673 12.453 4.744 634 HG22 ILE 80 2HG2 ILE 80 -1.120 10.784 4.604 635 HG23 ILE 80 3HG2 ILE 80 -2.845 11.150 4.543 636 HD11 ILE 80 3HD1 ILE 80 -1.914 10.835 0.077 637 HD12 ILE 80 1HD1 ILE 80 -0.712 9.554 0.250 638 HD13 ILE 80 2HD1 ILE 80 -0.276 11.227 0.601 639 H THR 81 H THR 81 -5.442 12.774 2.613 640 HA THR 81 HA THR 81 -5.001 15.316 4.054 641 HB THR 81 HB THR 81 -7.506 15.353 3.920 642 HG1 THR 81 1HG THR 81 -8.490 13.549 3.611 643 HG21 THR 81 3HG2 THR 81 -7.641 15.529 1.498 644 HG22 THR 81 1HG2 THR 81 -6.191 14.543 1.316 645 HG23 THR 81 2HG2 THR 81 -6.081 16.152 2.031 646 H SER 82 H SER 82 -4.481 12.390 5.083 647 HA SER 82 HA SER 82 -4.403 11.520 7.301 648 HB2 SER 82 2HB SER 82 -5.106 14.152 7.668 649 HB3 SER 82 1HB SER 82 -6.499 13.312 8.342 650 HG SER 82 HG SER 82 -5.054 13.428 9.980 651 H ASP 83 H ASP 83 -7.221 12.085 5.407 652 HA ASP 83 HA ASP 83 -8.749 9.982 6.882 653 HB2 ASP 83 2HB ASP 83 -9.414 12.344 5.139 654 HB3 ASP 83 1HB ASP 83 -10.581 11.035 5.321 655 H LEU 84 H LEU 84 -7.795 11.110 3.611 656 HA LEU 84 HA LEU 84 -8.813 8.806 2.214 657 HB2 LEU 84 2HB LEU 84 -6.506 10.670 1.555 658 HB3 LEU 84 1HB LEU 84 -7.403 9.675 0.403 659 HG LEU 84 HG LEU 84 -8.549 11.920 2.087 660 HD11 LEU 84 1HD1 LEU 84 -8.928 12.198 -0.741 661 HD12 LEU 84 2HD1 LEU 84 -7.218 11.904 -0.431 662 HD13 LEU 84 3HD1 LEU 84 -8.036 13.256 0.352 663 HD21 LEU 84 3HD2 LEU 84 -10.437 11.299 0.223 664 HD22 LEU 84 1HD2 LEU 84 -10.431 10.646 1.861 665 HD23 LEU 84 2HD2 LEU 84 -9.752 9.703 0.534 666 H LEU 85 H LEU 85 -5.909 9.511 4.017 667 HA LEU 85 HA LEU 85 -4.506 7.096 3.074 668 HB2 LEU 85 2HB LEU 85 -2.753 8.357 3.771 669 HB3 LEU 85 1HB LEU 85 -3.891 9.601 4.278 670 HG LEU 85 HG LEU 85 -4.160 8.259 6.439 671 HD11 LEU 85 1HD1 LEU 85 -2.706 6.526 6.937 672 HD12 LEU 85 2HD1 LEU 85 -1.458 7.121 5.842 673 HD13 LEU 85 3HD1 LEU 85 -2.874 6.289 5.198 674 HD21 LEU 85 3HD2 LEU 85 -2.153 9.259 7.427 675 HD22 LEU 85 1HD2 LEU 85 -2.843 10.368 6.242 676 HD23 LEU 85 2HD2 LEU 85 -1.419 9.412 5.830 677 H ASP 86 H ASP 86 -6.301 8.230 5.921 678 HA ASP 86 HA ASP 86 -5.798 5.997 7.643 679 HB2 ASP 86 2HB ASP 86 -7.779 8.202 7.342 680 HB3 ASP 86 1HB ASP 86 -8.270 6.843 8.355 681 H LYS 87 H LYS 87 -7.876 6.414 4.866 682 HA LYS 87 HA LYS 87 -9.414 3.956 5.431 683 HB2 LYS 87 2HB LYS 87 -9.311 5.920 3.110 684 HB3 LYS 87 1HB LYS 87 -10.459 4.586 3.230 685 HG2 LYS 87 2HG LYS 87 -10.240 7.011 5.016 686 HG3 LYS 87 1HG LYS 87 -11.630 6.473 4.075 687 HD2 LYS 87 2HD LYS 87 -11.659 4.381 5.511 688 HD3 LYS 87 1HD LYS 87 -10.461 5.164 6.541 689 HE2 LYS 87 2HE LYS 87 -12.886 6.772 5.891 690 HE3 LYS 87 1HE LYS 87 -13.103 5.409 7.008 691 HZ1 LYS 87 3HZ LYS 87 -12.356 7.556 8.060 692 HZ2 LYS 87 1HZ LYS 87 -10.877 7.350 7.256 693 HZ3 LYS 87 2HZ LYS 87 -11.389 6.200 8.397 694 H ILE 88 H ILE 88 -6.949 5.153 3.135 695 HA ILE 88 HA ILE 88 -6.609 2.720 1.664 696 HB ILE 88 HB ILE 88 -4.970 5.155 2.326 697 HG12 ILE 88 2HG1 ILE 88 -5.273 4.217 -0.435 698 HG13 ILE 88 1HG1 ILE 88 -6.795 4.576 0.386 699 HG21 ILE 88 1HG2 ILE 88 -3.067 3.956 2.160 700 HG22 ILE 88 2HG2 ILE 88 -3.448 3.870 0.439 701 HG23 ILE 88 3HG2 ILE 88 -3.909 2.548 1.512 702 HD11 ILE 88 3HD1 ILE 88 -4.751 6.411 -0.579 703 HD12 ILE 88 1HD1 ILE 88 -5.095 6.667 1.132 704 HD13 ILE 88 2HD1 ILE 88 -6.399 6.754 -0.054 705 H PHE 89 H PHE 89 -5.276 3.969 4.685 706 HA PHE 89 HA PHE 89 -3.461 1.800 5.225 707 HB2 PHE 89 2HB PHE 89 -3.836 4.248 6.227 708 HB3 PHE 89 1HB PHE 89 -4.821 3.357 7.385 709 HD1 PHE 89 1HD PHE 89 -3.723 1.237 8.459 710 HD2 PHE 89 2HD PHE 89 -1.523 4.383 6.534 711 HE1 PHE 89 1HE PHE 89 -1.673 0.543 9.668 712 HE2 PHE 89 2HE PHE 89 0.528 3.690 7.743 713 HZ PHE 89 HZ PHE 89 0.452 1.770 9.312 714 H ALA 90 H ALA 90 -6.828 2.362 5.708 715 HA ALA 90 HA ALA 90 -7.366 0.158 7.513 716 HB1 ALA 90 1HB ALA 90 -8.789 2.242 7.000 717 HB2 ALA 90 2HB ALA 90 -9.666 0.713 7.020 718 HB3 ALA 90 3HB ALA 90 -9.220 1.453 5.483 719 H GLY 91 H GLY 91 -7.081 0.698 4.075 720 HA2 GLY 91 2HA GLY 91 -8.081 -1.875 3.214 721 HA3 GLY 91 1HA GLY 91 -7.071 -0.782 2.255 722 H VAL 92 H VAL 92 -4.891 -0.492 3.941 723 HA VAL 92 HA VAL 92 -3.300 -2.814 3.415 724 HB VAL 92 HB VAL 92 -3.128 -0.366 5.178 725 HG11 VAL 92 1HG1 VAL 92 -0.722 -1.078 5.612 726 HG12 VAL 92 2HG1 VAL 92 -1.181 -2.684 5.047 727 HG13 VAL 92 3HG1 VAL 92 -1.946 -2.004 6.482 728 HG21 VAL 92 3HG2 VAL 92 -2.450 0.374 3.138 729 HG22 VAL 92 1HG2 VAL 92 -2.151 -1.259 2.542 730 HG23 VAL 92 2HG2 VAL 92 -0.936 -0.442 3.527 731 H ASP 93 H ASP 93 -5.456 -1.864 5.961 732 HA ASP 93 HA ASP 93 -4.566 -3.797 7.954 733 HB2 ASP 93 2HB ASP 93 -6.196 -1.520 7.776 734 HB3 ASP 93 1HB ASP 93 -7.324 -2.835 8.120 735 H MET 94 H MET 94 -6.846 -3.735 5.279 736 HA MET 94 HA MET 94 -8.261 -6.168 6.043 737 HB2 MET 94 2HB MET 94 -8.087 -4.297 3.704 738 HB3 MET 94 1HB MET 94 -8.834 -5.876 3.456 739 HG2 MET 94 2HG MET 94 -10.698 -5.261 4.571 740 HG3 MET 94 1HG MET 94 -9.756 -4.628 5.921 741 HE1 MET 94 3HE MET 94 -9.756 -2.524 1.979 742 HE2 MET 94 1HE MET 94 -11.342 -3.272 2.204 743 HE3 MET 94 2HE MET 94 -9.879 -4.247 2.322 744 H ILE 95 H ILE 95 -5.730 -5.357 3.626 745 HA ILE 95 HA ILE 95 -5.339 -8.003 2.662 746 HB ILE 95 HB ILE 95 -3.135 -6.970 1.991 747 HG12 ILE 95 2HG1 ILE 95 -4.190 -4.427 3.194 748 HG13 ILE 95 1HG1 ILE 95 -3.151 -5.503 4.128 749 HG21 ILE 95 1HG2 ILE 95 -4.971 -4.836 1.270 750 HG22 ILE 95 2HG2 ILE 95 -5.714 -6.429 1.129 751 HG23 ILE 95 3HG2 ILE 95 -4.232 -6.069 0.246 752 HD11 ILE 95 3HD1 ILE 95 -1.582 -4.086 3.143 753 HD12 ILE 95 1HD1 ILE 95 -2.506 -3.945 1.646 754 HD13 ILE 95 2HD1 ILE 95 -1.620 -5.429 2.000 755 H THR 96 H THR 96 -4.167 -6.243 5.480 756 HA THR 96 HA THR 96 -2.103 -8.099 6.268 757 HB THR 96 HB THR 96 -3.859 -6.151 7.810 758 HG1 THR 96 1HG THR 96 -1.201 -5.920 6.858 759 HG21 THR 96 3HG2 THR 96 -1.506 -7.840 8.592 760 HG22 THR 96 1HG2 THR 96 -2.974 -7.484 9.503 761 HG23 THR 96 2HG2 THR 96 -1.719 -6.255 9.337 762 H ARG 97 H ARG 97 -5.578 -7.784 6.847 763 HA ARG 97 HA ARG 97 -5.747 -10.047 8.679 764 HB2 ARG 97 2HB ARG 97 -7.649 -8.304 7.109 765 HB3 ARG 97 1HB ARG 97 -8.247 -9.703 8.000 766 HG2 ARG 97 2HG ARG 97 -7.697 -8.797 10.068 767 HG3 ARG 97 1HG ARG 97 -6.429 -7.773 9.395 768 HD2 ARG 97 2HD ARG 97 -8.061 -6.264 8.430 769 HD3 ARG 97 1HD ARG 97 -9.393 -7.351 8.876 770 HE ARG 97 HE ARG 97 -7.886 -6.797 11.225 771 HH11 ARG 97 1HH2 ARG 97 -8.184 -4.136 9.586 772 HH12 ARG 97 2HH2 ARG 97 -9.541 -3.445 10.411 773 HH21 ARG 97 1HH1 ARG 97 -10.396 -6.392 12.026 774 HH22 ARG 97 2HH1 ARG 97 -10.796 -4.723 11.790 775 H MET 98 H MET 98 -5.997 -9.523 5.197 776 HA MET 98 HA MET 98 -7.090 -12.111 4.516 777 HB2 MET 98 2HB MET 98 -5.881 -9.736 3.218 778 HB3 MET 98 1HB MET 98 -5.651 -11.247 2.339 779 HG2 MET 98 2HG MET 98 -7.868 -11.454 1.850 780 HG3 MET 98 1HG MET 98 -8.378 -10.789 3.402 781 HE1 MET 98 3HE MET 98 -9.911 -9.810 0.565 782 HE2 MET 98 1HE MET 98 -8.434 -10.615 0.016 783 HE3 MET 98 2HE MET 98 -8.774 -8.957 -0.477 784 H VAL 99 H VAL 99 -3.838 -10.705 4.671 785 HA VAL 99 HA VAL 99 -2.397 -13.079 3.915 786 HB VAL 99 HB VAL 99 -1.851 -10.447 5.270 787 HG11 VAL 99 1HG1 VAL 99 -0.057 -12.855 5.180 788 HG12 VAL 99 2HG1 VAL 99 -0.256 -11.659 6.460 789 HG13 VAL 99 3HG1 VAL 99 0.650 -11.250 5.005 790 HG21 VAL 99 3HG2 VAL 99 -1.759 -11.536 2.615 791 HG22 VAL 99 1HG2 VAL 99 -0.130 -11.043 3.079 792 HG23 VAL 99 2HG2 VAL 99 -1.453 -9.878 3.129 793 H ASP 100 H ASP 100 -3.629 -11.795 6.978 794 HA ASP 100 HA ASP 100 -2.188 -13.646 8.683 795 HB2 ASP 100 2HB ASP 100 -4.514 -11.750 8.906 796 HB3 ASP 100 1HB ASP 100 -4.186 -12.870 10.230 797 H LYS 101 H LYS 101 -5.266 -13.693 6.969 798 HA LYS 101 HA LYS 101 -6.026 -16.261 8.204 799 HB2 LYS 101 2HB LYS 101 -8.072 -15.438 7.774 800 HB3 LYS 101 1HB LYS 101 -7.311 -13.998 7.113 801 HG2 LYS 101 2HG LYS 101 -7.104 -15.831 5.036 802 HG3 LYS 101 1HG LYS 101 -8.684 -16.172 5.732 803 HD2 LYS 101 2HD LYS 101 -8.620 -13.443 5.740 804 HD3 LYS 101 1HD LYS 101 -7.724 -13.835 4.268 805 HE2 LYS 101 2HE LYS 101 -9.932 -13.871 3.468 806 HE3 LYS 101 1HE LYS 101 -9.694 -15.570 3.920 807 HZ1 LYS 101 3HZ LYS 101 -11.571 -13.827 4.972 808 HZ2 LYS 101 1HZ LYS 101 -10.410 -14.034 6.191 809 HZ3 LYS 101 2HZ LYS 101 -11.193 -15.386 5.527 810 H ILE 102 H ILE 102 -4.809 -14.877 5.221 811 HA ILE 102 HA ILE 102 -4.999 -17.219 3.559 812 HB ILE 102 HB ILE 102 -3.417 -14.653 3.625 813 HG12 ILE 102 2HG1 ILE 102 -5.370 -15.879 1.652 814 HG13 ILE 102 1HG1 ILE 102 -5.747 -14.618 2.825 815 HG21 ILE 102 1HG2 ILE 102 -2.678 -17.119 2.229 816 HG22 ILE 102 2HG2 ILE 102 -1.742 -15.646 2.482 817 HG23 ILE 102 3HG2 ILE 102 -2.882 -15.747 1.140 818 HD11 ILE 102 3HD1 ILE 102 -5.226 -13.178 1.150 819 HD12 ILE 102 1HD1 ILE 102 -4.366 -14.416 0.235 820 HD13 ILE 102 2HD1 ILE 102 -3.553 -13.567 1.548 821 H VAL 103 H VAL 103 -2.603 -15.881 5.755 822 HA VAL 103 HA VAL 103 -0.557 -17.889 5.303 823 HB VAL 103 HB VAL 103 -1.224 -15.792 7.369 824 HG11 VAL 103 1HG1 VAL 103 -0.052 -16.927 8.936 825 HG12 VAL 103 2HG1 VAL 103 1.374 -16.672 7.930 826 HG13 VAL 103 3HG1 VAL 103 0.435 -18.157 7.769 827 HG21 VAL 103 3HG2 VAL 103 -0.143 -15.348 5.068 828 HG22 VAL 103 1HG2 VAL 103 1.289 -16.141 5.725 829 HG23 VAL 103 2HG2 VAL 103 0.672 -14.670 6.478 830 H SER 104 H SER 104 -3.372 -17.550 7.362 831 HA SER 104 HA SER 104 -2.771 -19.884 9.016 832 HB2 SER 104 2HB SER 104 -4.144 -17.644 9.420 833 HB3 SER 104 1HB SER 104 -5.463 -18.619 8.773 834 HG SER 104 HG SER 104 -3.754 -19.347 10.931 835 H GLU 105 H GLU 105 -4.874 -19.091 6.349 836 HA GLU 105 HA GLU 105 -5.509 -22.006 6.019 837 HB2 GLU 105 2HB GLU 105 -7.354 -19.722 5.303 838 HB3 GLU 105 1HB GLU 105 -7.768 -21.413 5.583 839 HG2 GLU 105 2HG GLU 105 -6.547 -20.604 7.963 840 HG3 GLU 105 1HG GLU 105 -7.550 -19.231 7.499 841 H GLY 106 H GLY 106 -5.080 -18.860 4.422 842 HA2 GLY 106 2HA GLY 106 -3.772 -18.751 2.335 843 HA3 GLY 106 1HA GLY 106 -4.407 -20.343 1.916 844 H SER 107 H SER 107 -6.604 -18.054 3.334 845 HA SER 107 HA SER 107 -7.870 -17.656 0.629 846 HB2 SER 107 2HB SER 107 -9.845 -17.275 2.444 847 HB3 SER 107 1HB SER 107 -9.469 -18.846 1.747 848 HG SER 107 HG SER 107 -8.440 -19.420 3.554 849 H ASP 108 H ASP 108 -8.080 -15.580 -0.017 850 HA ASP 108 HA ASP 108 -7.381 -13.410 1.907 851 HB2 ASP 108 2HB ASP 108 -6.977 -12.130 -0.091 852 HB3 ASP 108 1HB ASP 108 -6.329 -13.738 -0.414 853 H ASP 109 H ASP 109 -10.030 -15.076 1.362 854 HA ASP 109 HA ASP 109 -11.950 -12.991 0.593 855 HB2 ASP 109 2HB ASP 109 -11.812 -15.853 1.026 856 HB3 ASP 109 1HB ASP 109 -13.244 -15.179 1.809 857 H ILE 110 H ILE 110 -11.463 -11.369 2.308 858 HA ILE 110 HA ILE 110 -12.437 -12.180 5.024 859 HB ILE 110 HB ILE 110 -11.208 -10.074 5.705 860 HG12 ILE 110 2HG1 ILE 110 -10.065 -10.186 2.908 861 HG13 ILE 110 1HG1 ILE 110 -11.392 -9.110 3.343 862 HG21 ILE 110 1HG2 ILE 110 -8.933 -11.047 5.352 863 HG22 ILE 110 2HG2 ILE 110 -9.636 -12.208 4.228 864 HG23 ILE 110 3HG2 ILE 110 -10.098 -12.236 5.928 865 HD11 ILE 110 3HD1 ILE 110 -8.570 -9.119 4.416 866 HD12 ILE 110 1HD1 ILE 110 -9.884 -8.314 5.273 867 HD13 ILE 110 2HD1 ILE 110 -9.442 -7.793 3.646 868 H GLY 111 H GLY 111 -14.025 -11.334 2.538 869 HA2 GLY 111 2HA GLY 111 -15.835 -9.925 2.028 870 HA3 GLY 111 1HA GLY 111 -16.106 -9.913 3.772 871 H GLU 112 H GLU 112 -13.069 -8.747 2.584 872 HA GLU 112 HA GLU 112 -13.500 -6.129 3.762 873 HB2 GLU 112 2HB GLU 112 -11.213 -5.750 2.860 874 HB3 GLU 112 1HB GLU 112 -11.339 -7.285 3.725 875 HG2 GLU 112 2HG GLU 112 -10.504 -8.237 1.854 876 HG3 GLU 112 1HG GLU 112 -12.093 -7.950 1.149 877 H ASN 113 H ASN 113 -13.947 -7.445 0.550 878 HA ASN 113 HA ASN 113 -14.748 -6.388 -1.425 879 HB2 ASN 113 2HB ASN 113 -15.800 -5.048 0.851 880 HB3 ASN 113 1HB ASN 113 -15.325 -3.800 -0.303 881 HD21 ASN 113 1HD2 ASN 113 -18.102 -4.580 0.368 882 HD22 ASN 113 2HD2 ASN 113 -18.805 -5.129 -1.077 883 H ILE 114 H ILE 114 -13.661 -5.288 -3.058 884 HA ILE 114 HA ILE 114 -11.562 -3.323 -2.221 885 HB ILE 114 HB ILE 114 -10.993 -5.095 -4.537 886 HG12 ILE 114 2HG1 ILE 114 -10.013 -6.733 -2.685 887 HG13 ILE 114 1HG1 ILE 114 -11.376 -6.112 -1.749 888 HG21 ILE 114 1HG2 ILE 114 -9.354 -3.483 -3.855 889 HG22 ILE 114 2HG2 ILE 114 -8.748 -5.072 -3.385 890 HG23 ILE 114 3HG2 ILE 114 -9.458 -4.005 -2.175 891 HD11 ILE 114 3HD1 ILE 114 -11.376 -7.741 -4.244 892 HD12 ILE 114 1HD1 ILE 114 -12.659 -6.547 -4.041 893 HD13 ILE 114 2HD1 ILE 114 -12.450 -7.830 -2.845 894 H ASP 115 H ASP 115 -12.759 -4.719 -5.313 895 HA ASP 115 HA ASP 115 -12.497 -2.531 -6.962 896 HB2 ASP 115 2HB ASP 115 -13.566 -4.897 -7.291 897 HB3 ASP 115 1HB ASP 115 -15.078 -4.075 -6.901 898 H VAL 116 H VAL 116 -14.936 -3.073 -4.551 899 HA VAL 116 HA VAL 116 -16.190 -0.452 -5.049 900 HB VAL 116 HB VAL 116 -16.807 -2.910 -3.433 901 HG11 VAL 116 1HG1 VAL 116 -17.380 -1.211 -1.866 902 HG12 VAL 116 2HG1 VAL 116 -18.892 -1.610 -2.682 903 HG13 VAL 116 3HG1 VAL 116 -18.007 -0.152 -3.129 904 HG21 VAL 116 3HG2 VAL 116 -18.955 -2.710 -4.722 905 HG22 VAL 116 1HG2 VAL 116 -17.536 -2.902 -5.752 906 HG23 VAL 116 2HG2 VAL 116 -18.273 -1.313 -5.554 907 H PHE 117 H PHE 117 -14.557 -2.187 -2.459 908 HA PHE 117 HA PHE 117 -14.618 -0.067 -0.527 909 HB2 PHE 117 2HB PHE 117 -13.880 -2.673 -0.595 910 HB3 PHE 117 1HB PHE 117 -12.290 -1.913 -0.621 911 HD1 PHE 117 2HD PHE 117 -15.425 -2.315 1.293 912 HD2 PHE 117 1HD PHE 117 -11.473 -0.637 1.270 913 HE1 PHE 117 2HE PHE 117 -15.606 -1.858 3.725 914 HE2 PHE 117 1HE PHE 117 -11.651 -0.180 3.701 915 HZ PHE 117 HZ PHE 117 -13.718 -0.791 4.929 916 H SER 118 H SER 118 -12.456 -0.800 -3.214 917 HA SER 118 HA SER 118 -10.566 1.302 -2.473 918 HB2 SER 118 2HB SER 118 -9.252 -0.008 -3.775 919 HB3 SER 118 1HB SER 118 -10.640 -1.055 -4.043 920 HG SER 118 HG SER 118 -9.418 0.418 -5.809 921 H ASP 119 H ASP 119 -13.043 0.692 -4.872 922 HA ASP 119 HA ASP 119 -12.732 3.183 -6.278 923 HB2 ASP 119 2HB ASP 119 -13.828 1.212 -7.253 924 HB3 ASP 119 1HB ASP 119 -15.061 1.255 -5.992 925 H THR 120 H THR 120 -13.977 2.342 -3.277 926 HA THR 120 HA THR 120 -15.798 4.637 -3.028 927 HB THR 120 HB THR 120 -14.979 2.191 -1.549 928 HG1 THR 120 1HG THR 120 -17.245 2.194 -1.154 929 HG21 THR 120 3HG2 THR 120 -14.550 3.401 0.333 930 HG22 THR 120 1HG2 THR 120 -16.308 3.359 0.468 931 HG23 THR 120 2HG2 THR 120 -15.508 4.782 -0.201 932 H ILE 121 H ILE 121 -12.736 3.456 -1.940 933 HA ILE 121 HA ILE 121 -11.987 5.813 -0.401 934 HB ILE 121 HB ILE 121 -11.192 3.084 -0.889 935 HG12 ILE 121 2HG1 ILE 121 -10.658 5.180 1.206 936 HG13 ILE 121 1HG1 ILE 121 -11.686 3.752 1.313 937 HG21 ILE 121 1HG2 ILE 121 -8.768 3.286 -0.794 938 HG22 ILE 121 2HG2 ILE 121 -8.884 5.046 -0.795 939 HG23 ILE 121 3HG2 ILE 121 -9.364 4.129 -2.224 940 HD11 ILE 121 3HD1 ILE 121 -9.833 2.989 2.479 941 HD12 ILE 121 1HD1 ILE 121 -8.709 3.968 1.536 942 HD13 ILE 121 2HD1 ILE 121 -9.388 2.490 0.848 943 H LYS 122 H LYS 122 -11.153 4.447 -3.603 944 HA LYS 122 HA LYS 122 -9.197 6.526 -4.154 945 HB2 LYS 122 2HB LYS 122 -8.667 4.919 -5.639 946 HB3 LYS 122 1HB LYS 122 -10.023 3.983 -5.025 947 HG2 LYS 122 2HG LYS 122 -11.443 5.413 -6.680 948 HG3 LYS 122 1HG LYS 122 -9.888 5.722 -7.468 949 HD2 LYS 122 2HD LYS 122 -10.957 2.988 -6.757 950 HD3 LYS 122 1HD LYS 122 -11.009 3.693 -8.380 951 HE2 LYS 122 2HE LYS 122 -8.327 3.948 -7.346 952 HE3 LYS 122 1HE LYS 122 -8.851 2.256 -7.198 953 HZ1 LYS 122 3HZ LYS 122 -8.019 2.586 -9.405 954 HZ2 LYS 122 1HZ LYS 122 -8.992 3.956 -9.631 955 HZ3 LYS 122 2HZ LYS 122 -9.706 2.420 -9.502 956 H SER 123 H SER 123 -12.615 6.028 -4.640 957 HA SER 123 HA SER 123 -12.838 8.391 -6.406 958 HB2 SER 123 2HB SER 123 -14.187 6.183 -6.526 959 HB3 SER 123 1HB SER 123 -15.051 6.802 -5.123 960 HG SER 123 HG SER 123 -15.322 8.761 -6.495 961 H PHE 124 H PHE 124 -12.555 7.659 -3.154 962 HA PHE 124 HA PHE 124 -14.402 9.577 -2.001 963 HB2 PHE 124 2HB PHE 124 -12.763 7.567 -1.101 964 HB3 PHE 124 1HB PHE 124 -11.862 8.996 -0.602 965 HD1 PHE 124 1HD PHE 124 -13.632 10.969 0.238 966 HD2 PHE 124 2HD PHE 124 -14.153 6.719 0.565 967 HE1 PHE 124 1HE PHE 124 -15.199 11.309 2.130 968 HE2 PHE 124 2HE PHE 124 -15.719 7.057 2.459 969 HZ PHE 124 HZ PHE 124 -16.242 9.353 3.241 970 H ALA 125 H ALA 125 -11.690 9.939 -3.912 971 HA ALA 125 HA ALA 125 -11.361 12.771 -3.017 972 HB1 ALA 125 1HB ALA 125 -9.087 12.498 -2.725 973 HB2 ALA 125 2HB ALA 125 -8.980 11.234 -3.951 974 HB3 ALA 125 3HB ALA 125 -9.602 10.855 -2.343 975 H SER 126 H SER 126 -12.464 13.572 -4.861 976 HA SER 126 HA SER 126 -10.938 13.462 -7.389 977 HB2 SER 126 2HB SER 126 -12.904 11.597 -6.901 978 HB3 SER 126 1HB SER 126 -13.804 12.855 -7.739 979 HG SER 126 HG SER 126 -12.702 11.193 -9.060 980 H SER 127 H SER 127 -10.783 15.685 -7.618 981 HA SER 127 HA SER 127 -13.320 17.278 -7.411 982 HB2 SER 127 2HB SER 127 -11.773 17.886 -5.674 983 HB3 SER 127 1HB SER 127 -10.419 17.902 -6.801 984 HG SER 127 HG SER 127 -11.157 20.008 -6.395 985 H GLY 128 H GLY 128 -13.721 18.776 -9.102 986 HA2 GLY 128 2HA GLY 128 -12.433 18.177 -11.649 987 HA3 GLY 128 1HA GLY 128 -13.712 19.366 -11.391 988 H LYS 129 H LYS 129 -13.103 21.484 -10.598 989 HA LYS 129 HA LYS 129 -10.258 22.172 -10.347 990 HB2 LYS 129 2HB LYS 129 -10.466 23.754 -12.345 991 HB3 LYS 129 1HB LYS 129 -10.405 22.035 -12.738 992 HG2 LYS 129 2HG LYS 129 -12.938 22.045 -12.733 993 HG3 LYS 129 1HG LYS 129 -12.859 23.804 -12.615 994 HD2 LYS 129 2HD LYS 129 -11.334 22.356 -14.768 995 HD3 LYS 129 1HD LYS 129 -13.046 22.723 -14.982 996 HE2 LYS 129 2HE LYS 129 -11.251 24.934 -14.045 997 HE3 LYS 129 1HE LYS 129 -11.195 24.470 -15.757 998 HZ1 LYS 129 3HZ LYS 129 -13.805 24.732 -14.437 999 HZ2 LYS 129 1HZ LYS 129 -13.397 24.964 -16.067 1000 HZ3 LYS 129 2HZ LYS 129 -12.994 26.146 -14.917 1001 H GLU 130 H GLU 130 -10.261 24.827 -10.521 1002 HA GLU 130 HA GLU 130 -11.576 25.839 -8.265 1003 HB2 GLU 130 2HB GLU 130 -10.614 27.096 -10.844 1004 HB3 GLU 130 1HB GLU 130 -11.188 28.066 -9.486 1005 HG2 GLU 130 2HG GLU 130 -9.415 27.434 -8.109 1006 HG3 GLU 130 1HG GLU 130 -9.113 25.949 -9.012 1007 H LYS 131 H LYS 131 -13.809 25.337 -8.135 1008 HA LYS 131 HA LYS 131 -15.592 26.096 -10.380 1009 HB2 LYS 131 2HB LYS 131 -15.533 24.056 -8.544 1010 HB3 LYS 131 1HB LYS 131 -16.709 25.150 -7.814 1011 HG2 LYS 131 2HG LYS 131 -18.189 24.975 -9.600 1012 HG3 LYS 131 1HG LYS 131 -16.917 24.544 -10.744 1013 HD2 LYS 131 2HD LYS 131 -16.666 22.395 -9.285 1014 HD3 LYS 131 1HD LYS 131 -18.279 22.806 -8.699 1015 HE2 LYS 131 2HE LYS 131 -19.116 21.799 -10.552 1016 HE3 LYS 131 1HE LYS 131 -18.386 23.099 -11.514 1017 HZ1 LYS 131 3HZ LYS 131 -16.762 20.844 -10.513 1018 HZ2 LYS 131 1HZ LYS 131 -16.425 21.906 -11.792 1019 HZ3 LYS 131 2HZ LYS 131 -17.621 20.713 -11.973 1020 H LEU 132 H LEU 132 -17.250 27.693 -10.139 1021 HA LEU 132 HA LEU 132 -16.648 29.771 -8.103 1022 HB2 LEU 132 2HB LEU 132 -17.111 29.882 -10.762 1023 HB3 LEU 132 1HB LEU 132 -18.761 30.102 -10.174 1024 HG LEU 132 HG LEU 132 -17.749 32.292 -10.363 1025 HD11 LEU 132 1HD1 LEU 132 -19.161 31.846 -8.359 1026 HD12 LEU 132 2HD1 LEU 132 -17.923 33.061 -8.042 1027 HD13 LEU 132 3HD1 LEU 132 -17.709 31.410 -7.458 1028 HD21 LEU 132 3HD2 LEU 132 -15.420 30.835 -9.379 1029 HD22 LEU 132 1HD2 LEU 132 -15.679 32.331 -8.484 1030 HD23 LEU 132 2HD2 LEU 132 -15.491 32.373 -10.237 1031 H GLU 133 H GLU 133 -17.615 28.523 -6.298 1032 HA GLU 133 HA GLU 133 -20.592 28.821 -6.246 1033 HB2 GLU 133 2HB GLU 133 -19.952 26.491 -6.810 1034 HB3 GLU 133 1HB GLU 133 -18.966 26.416 -5.350 1035 HG2 GLU 133 2HG GLU 133 -21.608 27.346 -4.673 1036 HG3 GLU 133 1HG GLU 133 -21.729 25.844 -5.589 Start of MODEL 24 1 H1 MET 1 1HT MET 1 10.291 -31.369 -1.436 2 H2 MET 1 2HT MET 1 10.726 -30.059 -2.426 3 H3 MET 1 3HT MET 1 9.304 -30.932 -2.745 4 HA MET 1 HA MET 1 8.108 -29.863 -1.163 5 HB2 MET 1 2HB MET 1 10.713 -30.258 0.242 6 HB3 MET 1 1HB MET 1 9.628 -29.027 0.889 7 HG2 MET 1 2HG MET 1 8.653 -30.764 1.983 8 HG3 MET 1 1HG MET 1 7.890 -31.095 0.428 9 HE1 MET 1 2HE MET 1 11.530 -31.390 1.830 10 HE2 MET 1 3HE MET 1 11.600 -33.103 2.237 11 HE3 MET 1 1HE MET 1 10.453 -32.040 3.066 12 H MET 2 H MET 2 7.876 -28.161 -2.741 13 HA MET 2 HA MET 2 9.819 -25.896 -2.503 14 HB2 MET 2 2HB MET 2 7.989 -26.978 -4.623 15 HB3 MET 2 1HB MET 2 8.455 -25.277 -4.682 16 HG2 MET 2 2HG MET 2 10.360 -25.937 -5.692 17 HG3 MET 2 1HG MET 2 10.842 -26.638 -4.147 18 HE1 MET 2 3HE MET 2 11.387 -30.041 -4.783 19 HE2 MET 2 1HE MET 2 11.655 -28.509 -3.939 20 HE3 MET 2 2HE MET 2 12.327 -28.764 -5.549 21 H GLU 3 H GLU 3 7.319 -26.637 -0.782 22 HA GLU 3 HA GLU 3 5.436 -24.464 -1.291 23 HB2 GLU 3 2HB GLU 3 4.506 -25.280 0.890 24 HB3 GLU 3 1HB GLU 3 4.723 -26.576 -0.291 25 HG2 GLU 3 2HG GLU 3 6.660 -27.389 0.792 26 HG3 GLU 3 1HG GLU 3 6.895 -25.884 1.684 27 H GLU 4 H GLU 4 8.393 -24.811 0.348 28 HA GLU 4 HA GLU 4 8.001 -22.866 2.415 29 HB2 GLU 4 2HB GLU 4 10.472 -23.929 1.014 30 HB3 GLU 4 1HB GLU 4 10.510 -22.981 2.502 31 HG2 GLU 4 2HG GLU 4 8.615 -25.027 2.939 32 HG3 GLU 4 1HG GLU 4 10.000 -25.804 2.171 33 H TYR 5 H TYR 5 8.143 -22.513 -0.899 34 HA TYR 5 HA TYR 5 9.590 -19.977 -1.010 35 HB2 TYR 5 2HB TYR 5 8.087 -21.786 -2.856 36 HB3 TYR 5 1HB TYR 5 8.335 -20.115 -3.365 37 HD1 TYR 5 1HD TYR 5 10.052 -23.239 -2.335 38 HD2 TYR 5 2HD TYR 5 10.504 -19.308 -4.005 39 HE1 TYR 5 1HE TYR 5 12.385 -23.780 -2.979 40 HE2 TYR 5 2HE TYR 5 12.837 -19.848 -4.649 41 HH TYR 5 HH TYR 5 14.635 -21.483 -3.831 42 H LEU 6 H LEU 6 6.383 -21.062 -0.492 43 HA LEU 6 HA LEU 6 5.174 -18.399 -0.947 44 HB2 LEU 6 2HB LEU 6 3.124 -19.576 -0.776 45 HB3 LEU 6 1HB LEU 6 4.209 -20.750 -1.517 46 HG LEU 6 HG LEU 6 4.686 -21.328 1.061 47 HD11 LEU 6 1HD1 LEU 6 1.804 -21.052 1.422 48 HD12 LEU 6 2HD1 LEU 6 2.606 -19.489 1.270 49 HD13 LEU 6 3HD1 LEU 6 3.115 -20.624 2.521 50 HD21 LEU 6 3HD2 LEU 6 2.733 -22.295 -0.956 51 HD22 LEU 6 1HD2 LEU 6 2.482 -22.868 0.693 52 HD23 LEU 6 2HD2 LEU 6 4.016 -23.173 -0.123 53 H GLY 7 H GLY 7 6.229 -20.501 1.668 54 HA2 GLY 7 2HA GLY 7 4.906 -19.092 3.810 55 HA3 GLY 7 1HA GLY 7 6.301 -20.158 3.994 56 H VAL 8 H VAL 8 7.992 -18.690 2.127 57 HA VAL 8 HA VAL 8 8.819 -16.532 3.951 58 HB VAL 8 HB VAL 8 9.961 -17.940 1.546 59 HG11 VAL 8 1HG1 VAL 8 11.028 -15.463 2.932 60 HG12 VAL 8 2HG1 VAL 8 10.590 -15.623 1.231 61 HG13 VAL 8 3HG1 VAL 8 11.993 -16.485 1.866 62 HG21 VAL 8 3HG2 VAL 8 10.905 -19.184 3.170 63 HG22 VAL 8 1HG2 VAL 8 10.141 -18.181 4.402 64 HG23 VAL 8 2HG2 VAL 8 11.729 -17.746 3.772 65 H PHE 9 H PHE 9 7.240 -16.923 0.922 66 HA PHE 9 HA PHE 9 7.686 -14.300 -0.184 67 HB2 PHE 9 2HB PHE 9 6.116 -16.685 -0.683 68 HB3 PHE 9 1HB PHE 9 5.124 -15.245 -0.925 69 HD1 PHE 9 2HD PHE 9 7.107 -13.269 -1.838 70 HD2 PHE 9 1HD PHE 9 6.675 -17.418 -2.855 71 HE1 PHE 9 2HE PHE 9 8.230 -12.853 -4.010 72 HE2 PHE 9 1HE PHE 9 7.798 -17.003 -5.027 73 HZ PHE 9 HZ PHE 9 8.576 -14.721 -5.604 74 H VAL 10 H VAL 10 5.279 -15.663 2.034 75 HA VAL 10 HA VAL 10 3.708 -13.213 2.243 76 HB VAL 10 HB VAL 10 3.891 -15.641 4.059 77 HG11 VAL 10 1HG1 VAL 10 2.672 -13.648 4.954 78 HG12 VAL 10 2HG1 VAL 10 1.618 -15.040 4.700 79 HG13 VAL 10 3HG1 VAL 10 1.611 -13.706 3.545 80 HG21 VAL 10 3HG2 VAL 10 1.629 -15.727 2.333 81 HG22 VAL 10 1HG2 VAL 10 3.002 -16.833 2.368 82 HG23 VAL 10 2HG2 VAL 10 3.040 -15.410 1.325 83 H ASP 11 H ASP 11 6.083 -14.887 4.362 84 HA ASP 11 HA ASP 11 6.138 -13.109 6.518 85 HB2 ASP 11 2HB ASP 11 7.421 -15.192 6.411 86 HB3 ASP 11 1HB ASP 11 8.402 -14.543 5.097 87 H GLU 12 H GLU 12 7.218 -12.674 3.292 88 HA GLU 12 HA GLU 12 8.800 -10.255 3.814 89 HB2 GLU 12 2HB GLU 12 7.908 -11.917 1.484 90 HB3 GLU 12 1HB GLU 12 8.424 -10.259 1.166 91 HG2 GLU 12 2HG GLU 12 10.364 -11.199 2.903 92 HG3 GLU 12 1HG GLU 12 10.026 -12.597 1.882 93 H THR 13 H THR 13 5.584 -11.128 2.642 94 HA THR 13 HA THR 13 4.690 -8.511 1.892 95 HB THR 13 HB THR 13 3.600 -11.216 2.450 96 HG1 THR 13 1HG THR 13 3.913 -10.754 0.372 97 HG21 THR 13 3HG2 THR 13 2.043 -8.738 3.003 98 HG22 THR 13 1HG2 THR 13 1.858 -10.359 3.673 99 HG23 THR 13 2HG2 THR 13 1.234 -9.994 2.064 100 H LYS 14 H LYS 14 4.779 -10.217 5.000 101 HA LYS 14 HA LYS 14 3.115 -8.296 6.419 102 HB2 LYS 14 2HB LYS 14 5.242 -10.066 7.635 103 HB3 LYS 14 1HB LYS 14 3.684 -9.605 8.314 104 HG2 LYS 14 2HG LYS 14 4.248 -11.589 6.112 105 HG3 LYS 14 1HG LYS 14 3.389 -11.851 7.625 106 HD2 LYS 14 2HD LYS 14 2.368 -9.938 5.519 107 HD3 LYS 14 1HD LYS 14 1.947 -11.647 5.519 108 HE2 LYS 14 2HE LYS 14 0.751 -11.487 7.539 109 HE3 LYS 14 1HE LYS 14 1.582 -9.994 8.019 110 HZ1 LYS 14 3HZ LYS 14 -0.812 -10.051 6.805 111 HZ2 LYS 14 1HZ LYS 14 0.217 -9.876 5.468 112 HZ3 LYS 14 2HZ LYS 14 0.262 -8.737 6.728 113 H GLU 15 H GLU 15 6.633 -8.904 6.317 114 HA GLU 15 HA GLU 15 7.345 -6.602 7.846 115 HB2 GLU 15 2HB GLU 15 8.846 -8.150 5.714 116 HB3 GLU 15 1HB GLU 15 9.593 -7.063 6.887 117 HG2 GLU 15 2HG GLU 15 8.246 -8.596 8.610 118 HG3 GLU 15 1HG GLU 15 8.404 -9.771 7.304 119 H TYR 16 H TYR 16 6.080 -6.913 4.736 120 HA TYR 16 HA TYR 16 7.277 -4.436 3.672 121 HB2 TYR 16 2HB TYR 16 5.960 -6.819 2.684 122 HB3 TYR 16 1HB TYR 16 5.176 -5.384 2.033 123 HD1 TYR 16 2HD TYR 16 6.922 -3.453 1.315 124 HD2 TYR 16 1HD TYR 16 7.780 -7.658 1.498 125 HE1 TYR 16 2HE TYR 16 8.802 -3.139 -0.272 126 HE2 TYR 16 1HE TYR 16 9.660 -7.344 -0.088 127 HH TYR 16 HH TYR 16 11.110 -5.635 -0.903 128 H LEU 17 H LEU 17 4.264 -5.563 5.133 129 HA LEU 17 HA LEU 17 2.774 -3.143 4.410 130 HB2 LEU 17 2HB LEU 17 0.999 -4.196 5.563 131 HB3 LEU 17 1HB LEU 17 1.942 -5.570 4.997 132 HG LEU 17 HG LEU 17 3.176 -5.324 7.293 133 HD11 LEU 17 1HD1 LEU 17 1.208 -4.610 8.951 134 HD12 LEU 17 2HD1 LEU 17 0.764 -3.594 7.580 135 HD13 LEU 17 3HD1 LEU 17 2.356 -3.430 8.320 136 HD21 LEU 17 3HD2 LEU 17 2.075 -7.255 7.645 137 HD22 LEU 17 1HD2 LEU 17 0.935 -6.812 6.375 138 HD23 LEU 17 2HD2 LEU 17 0.609 -6.362 8.049 139 H GLN 18 H GLN 18 4.729 -4.370 7.015 140 HA GLN 18 HA GLN 18 4.279 -2.213 8.901 141 HB2 GLN 18 2HB GLN 18 6.743 -3.903 8.554 142 HB3 GLN 18 1HB GLN 18 6.077 -3.272 10.063 143 HG2 GLN 18 2HG GLN 18 4.082 -4.855 8.815 144 HG3 GLN 18 1HG GLN 18 5.586 -5.771 8.795 145 HE21 GLN 18 1HE2 GLN 18 2.943 -5.663 10.612 146 HE22 GLN 18 2HE2 GLN 18 3.595 -5.813 12.172 147 H ASN 19 H ASN 19 6.749 -3.129 6.631 148 HA ASN 19 HA ASN 19 8.363 -0.798 6.865 149 HB2 ASN 19 2HB ASN 19 9.187 -2.880 5.905 150 HB3 ASN 19 1HB ASN 19 7.949 -2.823 4.649 151 HD21 ASN 19 1HD2 ASN 19 11.147 -1.785 5.476 152 HD22 ASN 19 2HD2 ASN 19 11.403 -0.786 4.129 153 H LEU 20 H LEU 20 5.506 -1.575 5.144 154 HA LEU 20 HA LEU 20 5.567 0.886 3.510 155 HB2 LEU 20 2HB LEU 20 4.742 -1.094 2.425 156 HB3 LEU 20 1HB LEU 20 3.718 -1.490 3.806 157 HG LEU 20 HG LEU 20 2.389 0.561 3.388 158 HD11 LEU 20 1HD1 LEU 20 4.599 1.046 1.542 159 HD12 LEU 20 2HD1 LEU 20 3.408 2.177 2.182 160 HD13 LEU 20 3HD1 LEU 20 3.030 1.213 0.754 161 HD21 LEU 20 3HD2 LEU 20 1.511 -1.439 2.423 162 HD22 LEU 20 1HD2 LEU 20 2.723 -1.440 1.143 163 HD23 LEU 20 2HD2 LEU 20 1.440 -0.229 1.142 164 H ASN 21 H ASN 21 4.732 -0.007 6.622 165 HA ASN 21 HA ASN 21 2.472 1.882 6.849 166 HB2 ASN 21 2HB ASN 21 3.660 -0.370 8.372 167 HB3 ASN 21 1HB ASN 21 3.043 0.967 9.351 168 HD21 ASN 21 1HD2 ASN 21 0.736 1.771 8.342 169 HD22 ASN 21 2HD2 ASN 21 -0.362 0.508 8.063 170 H ASP 22 H ASP 22 5.748 1.244 7.691 171 HA ASP 22 HA ASP 22 6.150 3.506 9.350 172 HB2 ASP 22 2HB ASP 22 7.800 1.496 7.910 173 HB3 ASP 22 1HB ASP 22 8.624 2.963 8.437 174 H THR 23 H THR 23 6.272 2.838 6.013 175 HA THR 23 HA THR 23 7.409 5.351 5.082 176 HB THR 23 HB THR 23 5.702 3.156 3.904 177 HG1 THR 23 1HG THR 23 8.470 3.697 4.016 178 HG21 THR 23 3HG2 THR 23 6.835 5.650 2.719 179 HG22 THR 23 1HG2 THR 23 5.348 4.791 2.318 180 HG23 THR 23 2HG2 THR 23 6.900 4.184 1.739 181 H LEU 24 H LEU 24 4.155 3.937 5.365 182 HA LEU 24 HA LEU 24 2.762 6.296 4.407 183 HB2 LEU 24 2HB LEU 24 2.072 3.699 5.783 184 HB3 LEU 24 1HB LEU 24 0.834 4.930 5.532 185 HG LEU 24 HG LEU 24 2.538 3.649 3.377 186 HD11 LEU 24 1HD1 LEU 24 -0.190 3.187 4.457 187 HD12 LEU 24 2HD1 LEU 24 0.919 2.057 3.681 188 HD13 LEU 24 3HD1 LEU 24 -0.036 3.169 2.701 189 HD21 LEU 24 3HD2 LEU 24 1.048 6.143 3.479 190 HD22 LEU 24 1HD2 LEU 24 0.383 5.059 2.256 191 HD23 LEU 24 2HD2 LEU 24 2.085 5.519 2.195 192 H LEU 25 H LEU 25 3.931 5.092 7.496 193 HA LEU 25 HA LEU 25 2.320 6.995 9.056 194 HB2 LEU 25 2HB LEU 25 4.633 5.144 9.643 195 HB3 LEU 25 1HB LEU 25 3.862 6.137 10.889 196 HG LEU 25 HG LEU 25 2.217 4.422 9.065 197 HD11 LEU 25 1HD1 LEU 25 3.487 3.560 11.683 198 HD12 LEU 25 2HD1 LEU 25 3.914 2.947 10.086 199 HD13 LEU 25 3HD1 LEU 25 2.315 2.626 10.754 200 HD21 LEU 25 3HD2 LEU 25 1.434 6.299 10.749 201 HD22 LEU 25 1HD2 LEU 25 1.672 5.031 11.954 202 HD23 LEU 25 2HD2 LEU 25 0.532 4.786 10.630 203 H GLU 26 H GLU 26 5.225 7.085 7.336 204 HA GLU 26 HA GLU 26 6.174 9.507 8.759 205 HB2 GLU 26 2HB GLU 26 7.288 7.666 6.622 206 HB3 GLU 26 1HB GLU 26 8.070 9.194 7.026 207 HG2 GLU 26 2HG GLU 26 8.227 8.459 9.397 208 HG3 GLU 26 1HG GLU 26 7.529 6.906 8.937 209 H LEU 27 H LEU 27 4.559 8.291 6.034 210 HA LEU 27 HA LEU 27 4.735 10.567 4.362 211 HB2 LEU 27 2HB LEU 27 4.247 8.339 3.520 212 HB3 LEU 27 1HB LEU 27 2.833 8.227 4.564 213 HG LEU 27 HG LEU 27 1.738 10.021 3.339 214 HD11 LEU 27 1HD1 LEU 27 4.067 10.031 1.416 215 HD12 LEU 27 2HD1 LEU 27 3.993 11.146 2.779 216 HD13 LEU 27 3HD1 LEU 27 2.746 11.191 1.536 217 HD21 LEU 27 3HD2 LEU 27 1.725 8.881 1.025 218 HD22 LEU 27 1HD2 LEU 27 1.291 7.878 2.410 219 HD23 LEU 27 2HD2 LEU 27 2.905 7.761 1.707 220 H GLU 28 H GLU 28 2.511 9.500 6.885 221 HA GLU 28 HA GLU 28 0.527 11.559 6.404 222 HB2 GLU 28 2HB GLU 28 0.053 10.983 8.909 223 HB3 GLU 28 1HB GLU 28 -0.260 9.771 7.674 224 HG2 GLU 28 2HG GLU 28 1.494 8.456 8.338 225 HG3 GLU 28 1HG GLU 28 2.464 9.826 8.862 226 H LYS 29 H LYS 29 3.422 11.293 8.431 227 HA LYS 29 HA LYS 29 3.001 13.907 9.665 228 HB2 LYS 29 2HB LYS 29 4.581 13.051 11.052 229 HB3 LYS 29 1HB LYS 29 4.482 11.584 10.087 230 HG2 LYS 29 2HG LYS 29 6.200 12.930 8.535 231 HG3 LYS 29 1HG LYS 29 6.566 13.719 10.072 232 HD2 LYS 29 2HD LYS 29 7.380 11.793 11.019 233 HD3 LYS 29 1HD LYS 29 6.295 10.763 10.084 234 HE2 LYS 29 2HE LYS 29 7.939 10.377 8.575 235 HE3 LYS 29 1HE LYS 29 8.100 12.120 8.283 236 HZ1 LYS 29 3HZ LYS 29 10.132 11.107 9.234 237 HZ2 LYS 29 1HZ LYS 29 9.252 10.698 10.624 238 HZ3 LYS 29 2HZ LYS 29 9.478 12.331 10.215 239 H ASN 30 H ASN 30 4.087 12.663 6.756 240 HA ASN 30 HA ASN 30 4.884 15.344 5.803 241 HB2 ASN 30 2HB ASN 30 6.736 13.164 6.453 242 HB3 ASN 30 1HB ASN 30 6.904 13.701 4.780 243 HD21 ASN 30 1HD2 ASN 30 7.746 14.453 8.019 244 HD22 ASN 30 2HD2 ASN 30 8.332 16.023 7.746 245 HA PRO 31 HA PRO 31 2.564 12.864 2.842 246 HB2 PRO 31 2HB PRO 31 0.389 14.481 2.798 247 HB3 PRO 31 1HB PRO 31 0.650 13.240 4.027 248 HG2 PRO 31 2HG PRO 31 0.839 16.151 4.258 249 HG3 PRO 31 1HG PRO 31 0.493 14.931 5.491 250 HD2 PRO 31 2HD PRO 31 2.962 16.230 4.989 251 HD3 PRO 31 1HD PRO 31 2.633 14.919 6.146 252 H GLU 32 H GLU 32 4.538 15.264 2.570 253 HA GLU 32 HA GLU 32 3.626 16.022 -0.164 254 HB2 GLU 32 2HB GLU 32 4.823 18.326 0.946 255 HB3 GLU 32 1HB GLU 32 3.118 18.103 0.569 256 HG2 GLU 32 2HG GLU 32 2.591 17.455 2.779 257 HG3 GLU 32 1HG GLU 32 4.275 17.098 3.168 258 H ASP 33 H ASP 33 5.937 14.627 1.636 259 HA ASP 33 HA ASP 33 8.351 15.881 0.715 260 HB2 ASP 33 2HB ASP 33 9.312 13.643 1.466 261 HB3 ASP 33 1HB ASP 33 8.371 14.505 2.682 262 H MET 34 H MET 34 6.118 13.711 -0.658 263 HA MET 34 HA MET 34 5.952 12.757 -2.799 264 HB2 MET 34 2HB MET 34 7.857 14.998 -2.984 265 HB3 MET 34 1HB MET 34 8.082 13.777 -4.238 266 HG2 MET 34 2HG MET 34 5.331 14.820 -3.587 267 HG3 MET 34 1HG MET 34 6.392 15.706 -4.684 268 HE1 MET 34 3HE MET 34 4.089 15.357 -5.629 269 HE2 MET 34 1HE MET 34 3.328 13.761 -5.614 270 HE3 MET 34 2HE MET 34 4.019 14.398 -7.105 271 H GLU 35 H GLU 35 8.279 12.126 -0.610 272 HA GLU 35 HA GLU 35 9.717 10.178 -2.335 273 HB2 GLU 35 2HB GLU 35 11.350 10.159 -0.528 274 HB3 GLU 35 1HB GLU 35 10.960 11.842 -0.871 275 HG2 GLU 35 2HG GLU 35 9.267 11.757 0.978 276 HG3 GLU 35 1HG GLU 35 9.854 10.143 1.380 277 H LEU 36 H LEU 36 7.842 10.585 0.632 278 HA LEU 36 HA LEU 36 7.648 7.721 1.183 279 HB2 LEU 36 2HB LEU 36 5.988 10.117 2.063 280 HB3 LEU 36 1HB LEU 36 5.914 8.513 2.789 281 HG LEU 36 HG LEU 36 8.216 10.453 2.813 282 HD11 LEU 36 1HD1 LEU 36 6.684 8.979 4.963 283 HD12 LEU 36 2HD1 LEU 36 6.574 10.700 4.597 284 HD13 LEU 36 3HD1 LEU 36 8.068 10.034 5.253 285 HD21 LEU 36 3HD2 LEU 36 8.194 7.490 3.440 286 HD22 LEU 36 1HD2 LEU 36 9.467 8.587 3.979 287 HD23 LEU 36 2HD2 LEU 36 9.203 8.321 2.255 288 H ILE 37 H ILE 37 5.995 10.103 -0.768 289 HA ILE 37 HA ILE 37 3.561 8.596 -1.230 290 HB ILE 37 HB ILE 37 5.028 10.878 -2.573 291 HG12 ILE 37 2HG1 ILE 37 2.511 10.599 -0.908 292 HG13 ILE 37 1HG1 ILE 37 3.986 11.468 -0.484 293 HG21 ILE 37 1HG2 ILE 37 2.302 10.684 -3.438 294 HG22 ILE 37 2HG2 ILE 37 3.109 9.155 -3.785 295 HG23 ILE 37 3HG2 ILE 37 3.766 10.663 -4.420 296 HD11 ILE 37 3HD1 ILE 37 1.703 12.461 -1.878 297 HD12 ILE 37 1HD1 ILE 37 3.063 12.462 -3.001 298 HD13 ILE 37 2HD1 ILE 37 3.186 13.324 -1.467 299 H ASN 38 H ASN 38 6.759 8.790 -2.780 300 HA ASN 38 HA ASN 38 5.902 6.921 -4.903 301 HB2 ASN 38 2HB ASN 38 7.370 8.860 -5.392 302 HB3 ASN 38 1HB ASN 38 8.565 8.229 -4.257 303 HD21 ASN 38 1HD2 ASN 38 6.605 6.576 -6.796 304 HD22 ASN 38 2HD2 ASN 38 7.942 5.906 -7.599 305 H GLU 39 H GLU 39 7.558 6.962 -1.896 306 HA GLU 39 HA GLU 39 8.853 4.370 -2.152 307 HB2 GLU 39 2HB GLU 39 8.218 6.321 0.055 308 HB3 GLU 39 1HB GLU 39 8.880 4.733 0.443 309 HG2 GLU 39 2HG GLU 39 10.180 6.495 -1.627 310 HG3 GLU 39 1HG GLU 39 10.554 6.678 0.088 311 H ALA 40 H ALA 40 5.757 5.572 -1.395 312 HA ALA 40 HA ALA 40 4.783 3.062 -0.171 313 HB1 ALA 40 1HB ALA 40 2.720 4.397 0.086 314 HB2 ALA 40 2HB ALA 40 3.416 5.672 -0.916 315 HB3 ALA 40 3HB ALA 40 4.115 5.309 0.661 316 H PHE 41 H PHE 41 3.877 5.140 -2.987 317 HA PHE 41 HA PHE 41 2.099 3.438 -4.292 318 HB2 PHE 41 2HB PHE 41 2.468 5.530 -5.275 319 HB3 PHE 41 1HB PHE 41 4.220 5.394 -5.138 320 HD1 PHE 41 2HD PHE 41 5.473 3.851 -6.677 321 HD2 PHE 41 1HD PHE 41 1.307 4.749 -7.214 322 HE1 PHE 41 2HE PHE 41 5.593 3.013 -9.008 323 HE2 PHE 41 1HE PHE 41 1.428 3.910 -9.544 324 HZ PHE 41 HZ PHE 41 3.569 3.042 -10.440 325 H ARG 42 H ARG 42 5.587 3.109 -3.957 326 HA ARG 42 HA ARG 42 5.877 0.994 -5.951 327 HB2 ARG 42 2HB ARG 42 7.534 2.282 -3.795 328 HB3 ARG 42 1HB ARG 42 8.120 0.826 -4.600 329 HG2 ARG 42 2HG ARG 42 7.985 1.902 -6.770 330 HG3 ARG 42 1HG ARG 42 7.224 3.327 -6.058 331 HD2 ARG 42 2HD ARG 42 9.424 4.071 -6.104 332 HD3 ARG 42 1HD ARG 42 9.450 3.240 -4.535 333 HE ARG 42 HE ARG 42 9.992 1.476 -6.809 334 HH11 ARG 42 1HH1 ARG 42 11.756 4.096 -5.914 335 HH12 ARG 42 2HH1 ARG 42 13.128 3.232 -5.305 336 HH21 ARG 42 1HH2 ARG 42 11.559 0.143 -5.391 337 HH22 ARG 42 2HH2 ARG 42 13.017 0.997 -5.012 338 H ALA 43 H ALA 43 6.451 0.920 -2.411 339 HA ALA 43 HA ALA 43 6.516 -1.794 -1.914 340 HB1 ALA 43 1HB ALA 43 6.723 -0.066 -0.197 341 HB2 ALA 43 2HB ALA 43 5.448 -1.189 0.278 342 HB3 ALA 43 3HB ALA 43 5.031 0.383 -0.406 343 H LEU 44 H LEU 44 3.566 0.137 -2.430 344 HA LEU 44 HA LEU 44 1.776 -2.114 -2.075 345 HB2 LEU 44 2HB LEU 44 1.586 0.636 -3.328 346 HB3 LEU 44 1HB LEU 44 0.200 -0.453 -3.232 347 HG LEU 44 HG LEU 44 1.808 0.112 -0.761 348 HD11 LEU 44 1HD1 LEU 44 0.187 2.035 -2.286 349 HD12 LEU 44 2HD1 LEU 44 1.340 2.322 -0.984 350 HD13 LEU 44 3HD1 LEU 44 -0.319 1.859 -0.606 351 HD21 LEU 44 3HD2 LEU 44 -0.782 -1.071 -1.520 352 HD22 LEU 44 1HD2 LEU 44 -0.877 0.032 -0.147 353 HD23 LEU 44 2HD2 LEU 44 0.206 -1.358 -0.088 354 H HIS 45 H HIS 45 3.079 -0.416 -4.950 355 HA HIS 45 HA HIS 45 1.861 -2.091 -6.924 356 HB2 HIS 45 2HB HIS 45 2.874 0.033 -7.496 357 HB3 HIS 45 1HB HIS 45 4.424 -0.464 -6.813 358 HD1 HIS 45 1HD HIS 45 2.128 -1.172 -9.739 359 HD2 HIS 45 2HD HIS 45 6.032 -2.001 -8.533 360 HE1 HIS 45 1HE HIS 45 3.285 -2.225 -11.731 361 H THR 46 H THR 46 4.814 -2.344 -5.015 362 HA THR 46 HA THR 46 5.860 -4.674 -6.366 363 HB THR 46 HB THR 46 6.437 -2.910 -4.108 364 HG1 THR 46 1HG THR 46 7.782 -4.465 -5.991 365 HG21 THR 46 3HG2 THR 46 7.899 -4.779 -2.997 366 HG22 THR 46 1HG2 THR 46 6.709 -5.877 -3.699 367 HG23 THR 46 2HG2 THR 46 6.198 -4.638 -2.552 368 H LEU 47 H LEU 47 3.905 -4.113 -3.451 369 HA LEU 47 HA LEU 47 3.542 -6.896 -2.767 370 HB2 LEU 47 2HB LEU 47 2.745 -4.212 -1.935 371 HB3 LEU 47 1HB LEU 47 1.418 -5.364 -1.764 372 HG LEU 47 HG LEU 47 4.204 -5.948 -0.762 373 HD11 LEU 47 1HD1 LEU 47 2.368 -5.355 1.361 374 HD12 LEU 47 2HD1 LEU 47 2.382 -3.995 0.238 375 HD13 LEU 47 3HD1 LEU 47 3.887 -4.547 0.973 376 HD21 LEU 47 3HD2 LEU 47 3.241 -7.795 0.268 377 HD22 LEU 47 1HD2 LEU 47 2.211 -7.672 -1.159 378 HD23 LEU 47 2HD2 LEU 47 1.658 -7.031 0.388 379 H LYS 48 H LYS 48 2.023 -4.680 -5.000 380 HA LYS 48 HA LYS 48 -0.490 -6.039 -5.367 381 HB2 LYS 48 2HB LYS 48 0.634 -3.661 -6.058 382 HB3 LYS 48 1HB LYS 48 0.794 -4.524 -7.583 383 HG2 LYS 48 2HG LYS 48 -1.736 -3.955 -6.030 384 HG3 LYS 48 1HG LYS 48 -1.329 -3.439 -7.668 385 HD2 LYS 48 2HD LYS 48 -1.726 -6.305 -6.778 386 HD3 LYS 48 1HD LYS 48 -2.892 -5.349 -7.698 387 HE2 LYS 48 2HE LYS 48 -0.068 -5.717 -8.710 388 HE3 LYS 48 1HE LYS 48 -1.324 -6.927 -9.043 389 HZ1 LYS 48 3HZ LYS 48 -2.461 -5.525 -10.360 390 HZ2 LYS 48 1HZ LYS 48 -0.982 -4.709 -10.506 391 HZ3 LYS 48 2HZ LYS 48 -2.142 -4.168 -9.388 392 H GLY 49 H GLY 49 2.710 -6.262 -6.898 393 HA2 GLY 49 2HA GLY 49 1.860 -8.074 -8.998 394 HA3 GLY 49 1HA GLY 49 3.531 -7.745 -8.536 395 H MET 50 H MET 50 4.103 -8.722 -6.287 396 HA MET 50 HA MET 50 4.087 -11.508 -6.369 397 HB2 MET 50 2HB MET 50 4.682 -11.316 -3.974 398 HB3 MET 50 1HB MET 50 5.490 -10.073 -4.933 399 HG2 MET 50 2HG MET 50 4.452 -8.433 -3.800 400 HG3 MET 50 1HG MET 50 2.876 -9.166 -4.101 401 HE1 MET 50 3HE MET 50 6.038 -9.319 -1.388 402 HE2 MET 50 1HE MET 50 4.850 -8.470 -0.388 403 HE3 MET 50 2HE MET 50 5.171 -7.925 -2.035 404 H ALA 51 H ALA 51 1.488 -9.393 -5.409 405 HA ALA 51 HA ALA 51 0.030 -11.444 -3.892 406 HB1 ALA 51 1HB ALA 51 -1.752 -9.528 -4.173 407 HB2 ALA 51 2HB ALA 51 -0.388 -8.606 -4.804 408 HB3 ALA 51 3HB ALA 51 -0.337 -9.242 -3.160 409 H GLY 52 H GLY 52 0.276 -10.312 -7.162 410 HA2 GLY 52 2HA GLY 52 -2.241 -11.592 -7.998 411 HA3 GLY 52 1HA GLY 52 -1.119 -10.719 -9.047 412 H THR 53 H THR 53 1.072 -12.342 -7.608 413 HA THR 53 HA THR 53 0.992 -14.629 -9.484 414 HB THR 53 HB THR 53 3.016 -13.066 -7.929 415 HG1 THR 53 1HG THR 53 2.593 -13.925 -10.572 416 HG21 THR 53 3HG2 THR 53 3.966 -15.049 -7.289 417 HG22 THR 53 1HG2 THR 53 4.618 -14.979 -8.926 418 HG23 THR 53 2HG2 THR 53 3.192 -15.961 -8.585 419 H MET 54 H MET 54 0.406 -13.909 -6.231 420 HA MET 54 HA MET 54 0.986 -16.666 -5.284 421 HB2 MET 54 2HB MET 54 1.095 -14.054 -4.200 422 HB3 MET 54 1HB MET 54 -0.201 -14.885 -3.344 423 HG2 MET 54 2HG MET 54 1.238 -16.278 -2.283 424 HG3 MET 54 1HG MET 54 2.196 -16.540 -3.740 425 HE1 MET 54 3HE MET 54 4.889 -14.030 -3.809 426 HE2 MET 54 1HE MET 54 3.584 -14.676 -4.814 427 HE3 MET 54 2HE MET 54 4.598 -15.766 -3.872 428 H GLY 55 H GLY 55 -1.440 -15.269 -6.919 429 HA2 GLY 55 2HA GLY 55 -3.643 -16.050 -7.280 430 HA3 GLY 55 1HA GLY 55 -3.413 -17.196 -5.958 431 H PHE 56 H PHE 56 -2.452 -14.181 -4.885 432 HA PHE 56 HA PHE 56 -5.053 -13.828 -3.466 433 HB2 PHE 56 2HB PHE 56 -2.232 -12.813 -2.989 434 HB3 PHE 56 1HB PHE 56 -3.604 -12.479 -1.930 435 HD1 PHE 56 2HD PHE 56 -5.032 -15.107 -2.101 436 HD2 PHE 56 1HD PHE 56 -0.861 -14.199 -1.621 437 HE1 PHE 56 2HE PHE 56 -4.689 -17.285 -0.966 438 HE2 PHE 56 1HE PHE 56 -0.518 -16.377 -0.485 439 HZ PHE 56 HZ PHE 56 -2.433 -17.920 -0.158 440 H SER 57 H SER 57 -5.409 -12.948 -5.974 441 HA SER 57 HA SER 57 -4.497 -10.281 -6.529 442 HB2 SER 57 2HB SER 57 -7.099 -11.162 -7.603 443 HB3 SER 57 1HB SER 57 -5.660 -10.622 -8.463 444 HG SER 57 HG SER 57 -6.384 -13.168 -7.562 445 H SER 58 H SER 58 -6.983 -11.564 -4.550 446 HA SER 58 HA SER 58 -8.751 -9.308 -4.415 447 HB2 SER 58 2HB SER 58 -8.074 -11.267 -2.202 448 HB3 SER 58 1HB SER 58 -9.608 -10.448 -2.476 449 HG SER 58 HG SER 58 -9.688 -11.611 -4.504 450 H MET 59 H MET 59 -5.757 -10.212 -2.796 451 HA MET 59 HA MET 59 -5.794 -7.788 -1.109 452 HB2 MET 59 2HB MET 59 -5.006 -9.851 -0.123 453 HB3 MET 59 1HB MET 59 -3.910 -10.142 -1.475 454 HG2 MET 59 2HG MET 59 -2.890 -7.824 -0.790 455 HG3 MET 59 1HG MET 59 -3.686 -8.131 0.753 456 HE1 MET 59 3HE MET 59 -0.503 -10.554 -1.392 457 HE2 MET 59 1HE MET 59 -1.804 -9.552 -2.049 458 HE3 MET 59 2HE MET 59 -2.137 -11.202 -1.526 459 H ALA 60 H ALA 60 -4.534 -8.933 -4.136 460 HA ALA 60 HA ALA 60 -2.374 -6.969 -4.283 461 HB1 ALA 60 1HB ALA 60 -3.396 -8.129 -6.783 462 HB2 ALA 60 2HB ALA 60 -3.082 -9.343 -5.543 463 HB3 ALA 60 3HB ALA 60 -1.790 -8.264 -6.067 464 H LYS 61 H LYS 61 -5.736 -7.230 -5.356 465 HA LYS 61 HA LYS 61 -5.770 -4.909 -7.061 466 HB2 LYS 61 2HB LYS 61 -7.852 -6.267 -5.310 467 HB3 LYS 61 1HB LYS 61 -8.240 -5.002 -6.477 468 HG2 LYS 61 2HG LYS 61 -7.732 -6.354 -8.309 469 HG3 LYS 61 1HG LYS 61 -6.694 -7.420 -7.360 470 HD2 LYS 61 2HD LYS 61 -9.055 -7.736 -6.053 471 HD3 LYS 61 1HD LYS 61 -9.631 -7.465 -7.700 472 HE2 LYS 61 2HE LYS 61 -7.331 -9.300 -7.560 473 HE3 LYS 61 1HE LYS 61 -8.784 -9.903 -6.736 474 HZ1 LYS 61 3HZ LYS 61 -8.620 -10.277 -9.248 475 HZ2 LYS 61 1HZ LYS 61 -8.946 -8.619 -9.393 476 HZ3 LYS 61 2HZ LYS 61 -10.074 -9.643 -8.640 477 H LEU 62 H LEU 62 -6.138 -5.477 -3.620 478 HA LEU 62 HA LEU 62 -6.841 -2.833 -2.799 479 HB2 LEU 62 2HB LEU 62 -6.997 -5.018 -1.544 480 HB3 LEU 62 1HB LEU 62 -5.234 -5.003 -1.405 481 HG LEU 62 HG LEU 62 -5.302 -2.928 -0.172 482 HD11 LEU 62 1HD1 LEU 62 -7.979 -2.798 -1.312 483 HD12 LEU 62 2HD1 LEU 62 -6.985 -1.500 -0.650 484 HD13 LEU 62 3HD1 LEU 62 -7.992 -2.474 0.421 485 HD21 LEU 62 3HD2 LEU 62 -7.379 -3.980 1.462 486 HD22 LEU 62 1HD2 LEU 62 -5.641 -4.207 1.656 487 HD23 LEU 62 2HD2 LEU 62 -6.579 -5.353 0.697 488 H CYS 63 H CYS 63 -3.774 -4.538 -3.337 489 HA CYS 63 HA CYS 63 -2.022 -2.476 -2.381 490 HB2 CYS 63 2HB CYS 63 -1.794 -4.773 -4.343 491 HB3 CYS 63 1HB CYS 63 -0.413 -3.757 -3.933 492 HG CYS 63 HG CYS 63 -1.307 -6.016 -2.262 493 H HIS 64 H HIS 64 -3.598 -3.138 -5.467 494 HA HIS 64 HA HIS 64 -2.203 -1.020 -6.917 495 HB2 HIS 64 2HB HIS 64 -3.122 -3.062 -7.980 496 HB3 HIS 64 1HB HIS 64 -4.745 -2.593 -7.472 497 HD1 HIS 64 1HD HIS 64 -2.542 -2.347 -10.290 498 HD2 HIS 64 2HD HIS 64 -5.374 0.190 -8.582 499 HE1 HIS 64 1HE HIS 64 -3.137 -0.641 -12.064 500 H THR 65 H THR 65 -4.992 -1.357 -4.902 501 HA THR 65 HA THR 65 -6.359 1.074 -5.751 502 HB THR 65 HB THR 65 -6.602 -1.118 -3.755 503 HG1 THR 65 1HG THR 65 -7.699 -0.579 -5.925 504 HG21 THR 65 3HG2 THR 65 -7.784 1.629 -3.327 505 HG22 THR 65 1HG2 THR 65 -6.843 0.663 -2.191 506 HG23 THR 65 2HG2 THR 65 -8.481 0.173 -2.618 507 H LEU 66 H LEU 66 -4.689 0.171 -2.693 508 HA LEU 66 HA LEU 66 -4.594 2.734 -1.495 509 HB2 LEU 66 2HB LEU 66 -2.457 0.564 -1.521 510 HB3 LEU 66 1HB LEU 66 -2.683 1.787 -0.271 511 HG LEU 66 HG LEU 66 -4.537 -0.496 -0.970 512 HD11 LEU 66 1HD1 LEU 66 -4.205 -0.486 1.723 513 HD12 LEU 66 2HD1 LEU 66 -2.650 0.169 1.206 514 HD13 LEU 66 3HD1 LEU 66 -3.184 -1.407 0.619 515 HD21 LEU 66 3HD2 LEU 66 -5.108 2.134 0.189 516 HD22 LEU 66 1HD2 LEU 66 -5.619 0.796 1.215 517 HD23 LEU 66 2HD2 LEU 66 -6.222 0.920 -0.437 518 H GLU 67 H GLU 67 -2.309 1.151 -3.708 519 HA GLU 67 HA GLU 67 -0.455 3.314 -3.976 520 HB2 GLU 67 2HB GLU 67 0.149 1.074 -4.545 521 HB3 GLU 67 1HB GLU 67 -1.247 0.895 -5.605 522 HG2 GLU 67 2HG GLU 67 0.202 3.141 -6.554 523 HG3 GLU 67 1HG GLU 67 1.387 1.873 -6.246 524 H ASN 68 H ASN 68 -3.567 2.676 -5.445 525 HA ASN 68 HA ASN 68 -3.278 4.281 -7.807 526 HB2 ASN 68 2HB ASN 68 -5.204 2.742 -6.448 527 HB3 ASN 68 1HB ASN 68 -5.889 4.359 -6.583 528 HD21 ASN 68 1HD2 ASN 68 -6.413 5.158 -8.715 529 HD22 ASN 68 2HD2 ASN 68 -6.338 4.176 -10.098 530 H ILE 69 H ILE 69 -4.385 4.941 -4.514 531 HA ILE 69 HA ILE 69 -5.021 7.698 -4.944 532 HB ILE 69 HB ILE 69 -4.293 5.955 -2.588 533 HG12 ILE 69 2HG1 ILE 69 -6.694 6.482 -2.015 534 HG13 ILE 69 1HG1 ILE 69 -6.812 7.295 -3.573 535 HG21 ILE 69 1HG2 ILE 69 -5.475 8.375 -1.672 536 HG22 ILE 69 2HG2 ILE 69 -4.121 8.822 -2.709 537 HG23 ILE 69 3HG2 ILE 69 -3.858 7.764 -1.322 538 HD11 ILE 69 3HD1 ILE 69 -7.589 4.885 -3.568 539 HD12 ILE 69 1HD1 ILE 69 -5.909 4.432 -3.284 540 HD13 ILE 69 2HD1 ILE 69 -6.357 5.276 -4.768 541 H LEU 70 H LEU 70 -2.277 5.944 -3.824 542 HA LEU 70 HA LEU 70 -0.495 8.152 -3.417 543 HB2 LEU 70 2HB LEU 70 0.102 5.290 -4.233 544 HB3 LEU 70 1HB LEU 70 1.243 6.404 -3.483 545 HG LEU 70 HG LEU 70 -1.102 4.991 -2.267 546 HD11 LEU 70 1HD1 LEU 70 1.685 4.864 -2.056 547 HD12 LEU 70 2HD1 LEU 70 0.510 4.062 -1.014 548 HD13 LEU 70 3HD1 LEU 70 1.148 5.645 -0.569 549 HD21 LEU 70 3HD2 LEU 70 -0.047 7.701 -1.430 550 HD22 LEU 70 1HD2 LEU 70 -0.909 6.632 -0.323 551 HD23 LEU 70 2HD2 LEU 70 -1.720 7.250 -1.763 552 H ASP 71 H ASP 71 -1.814 6.666 -6.180 553 HA ASP 71 HA ASP 71 0.262 7.556 -8.047 554 HB2 ASP 71 2HB ASP 71 -1.728 5.686 -8.093 555 HB3 ASP 71 1HB ASP 71 -2.520 7.007 -8.953 556 H LYS 72 H LYS 72 -3.158 8.496 -7.450 557 HA LYS 72 HA LYS 72 -3.044 10.924 -8.915 558 HB2 LYS 72 2HB LYS 72 -4.965 11.499 -7.256 559 HB3 LYS 72 1HB LYS 72 -5.181 10.130 -8.340 560 HG2 LYS 72 2HG LYS 72 -4.579 8.570 -6.573 561 HG3 LYS 72 1HG LYS 72 -4.166 9.906 -5.498 562 HD2 LYS 72 2HD LYS 72 -6.672 10.575 -6.287 563 HD3 LYS 72 1HD LYS 72 -6.763 8.813 -6.249 564 HE2 LYS 72 2HE LYS 72 -5.571 9.054 -3.919 565 HE3 LYS 72 1HE LYS 72 -6.193 10.716 -3.991 566 HZ1 LYS 72 3HZ LYS 72 -7.923 8.416 -4.644 567 HZ2 LYS 72 1HZ LYS 72 -8.376 9.988 -4.198 568 HZ3 LYS 72 2HZ LYS 72 -7.732 8.928 -3.036 569 H ALA 73 H ALA 73 -1.984 10.074 -5.725 570 HA ALA 73 HA ALA 73 -1.517 12.720 -4.698 571 HB1 ALA 73 1HB ALA 73 -1.364 11.015 -3.108 572 HB2 ALA 73 2HB ALA 73 0.345 11.222 -3.487 573 HB3 ALA 73 3HB ALA 73 -0.571 9.910 -4.233 574 H ARG 74 H ARG 74 0.178 10.530 -6.843 575 HA ARG 74 HA ARG 74 2.587 12.231 -7.027 576 HB2 ARG 74 2HB ARG 74 1.650 9.534 -7.863 577 HB3 ARG 74 1HB ARG 74 2.841 10.296 -8.918 578 HG2 ARG 74 2HG ARG 74 4.219 10.750 -6.827 579 HG3 ARG 74 1HG ARG 74 3.109 9.681 -5.970 580 HD2 ARG 74 2HD ARG 74 4.625 8.072 -6.623 581 HD3 ARG 74 1HD ARG 74 3.702 8.133 -8.138 582 HE ARG 74 HE ARG 74 5.862 10.127 -7.879 583 HH11 ARG 74 1HH1 ARG 74 5.405 6.819 -8.511 584 HH12 ARG 74 2HH1 ARG 74 6.329 6.811 -9.975 585 HH21 ARG 74 1HH2 ARG 74 6.796 10.248 -10.013 586 HH22 ARG 74 2HH2 ARG 74 7.116 8.753 -10.827 587 H ASN 75 H ASN 75 -0.436 11.675 -8.645 588 HA ASN 75 HA ASN 75 0.405 12.946 -11.175 589 HB2 ASN 75 2HB ASN 75 -1.588 11.169 -10.275 590 HB3 ASN 75 1HB ASN 75 -2.451 12.634 -10.745 591 HD21 ASN 75 1HD2 ASN 75 -1.236 13.595 -12.945 592 HD22 ASN 75 2HD2 ASN 75 -1.114 12.432 -14.176 593 H SER 76 H SER 76 -0.222 14.109 -8.162 594 HA SER 76 HA SER 76 -0.570 16.326 -7.424 595 HB2 SER 76 2HB SER 76 0.363 16.607 -9.917 596 HB3 SER 76 1HB SER 76 -1.274 17.192 -10.193 597 HG SER 76 HG SER 76 -0.945 18.667 -8.481 598 H GLU 77 H GLU 77 -2.787 14.253 -7.867 599 HA GLU 77 HA GLU 77 -5.067 16.110 -8.309 600 HB2 GLU 77 2HB GLU 77 -5.615 13.257 -7.825 601 HB3 GLU 77 1HB GLU 77 -6.188 14.293 -9.128 602 HG2 GLU 77 2HG GLU 77 -3.656 14.119 -9.916 603 HG3 GLU 77 1HG GLU 77 -3.711 12.629 -8.975 604 H ILE 78 H ILE 78 -3.463 14.163 -5.958 605 HA ILE 78 HA ILE 78 -5.223 15.323 -3.829 606 HB ILE 78 HB ILE 78 -5.476 13.000 -2.922 607 HG12 ILE 78 2HG1 ILE 78 -4.962 11.479 -5.165 608 HG13 ILE 78 1HG1 ILE 78 -3.568 12.540 -5.061 609 HG21 ILE 78 1HG2 ILE 78 -6.377 13.104 -5.803 610 HG22 ILE 78 2HG2 ILE 78 -7.115 14.126 -4.567 611 HG23 ILE 78 3HG2 ILE 78 -7.206 12.369 -4.432 612 HD11 ILE 78 3HD1 ILE 78 -3.095 10.570 -3.741 613 HD12 ILE 78 1HD1 ILE 78 -4.629 10.716 -2.887 614 HD13 ILE 78 2HD1 ILE 78 -3.362 11.914 -2.635 615 H LYS 79 H LYS 79 -4.280 13.775 -1.734 616 HA LYS 79 HA LYS 79 -1.391 13.560 -1.653 617 HB2 LYS 79 2HB LYS 79 -0.909 15.510 -0.368 618 HB3 LYS 79 1HB LYS 79 -1.949 16.077 -1.671 619 HG2 LYS 79 2HG LYS 79 -3.076 15.247 1.008 620 HG3 LYS 79 1HG LYS 79 -2.517 16.890 0.700 621 HD2 LYS 79 2HD LYS 79 -4.406 17.372 -0.396 622 HD3 LYS 79 1HD LYS 79 -4.144 16.016 -1.488 623 HE2 LYS 79 2HE LYS 79 -5.063 14.532 0.426 624 HE3 LYS 79 1HE LYS 79 -5.678 16.048 1.114 625 HZ1 LYS 79 3HZ LYS 79 -6.488 14.656 -1.300 626 HZ2 LYS 79 1HZ LYS 79 -6.321 16.335 -1.466 627 HZ3 LYS 79 2HZ LYS 79 -7.380 15.699 -0.299 628 H ILE 80 H ILE 80 -0.827 13.573 0.897 629 HA ILE 80 HA ILE 80 -2.755 11.665 2.091 630 HB ILE 80 HB ILE 80 0.127 12.372 2.431 631 HG12 ILE 80 2HG1 ILE 80 0.389 9.996 1.929 632 HG13 ILE 80 1HG1 ILE 80 -1.360 9.797 1.949 633 HG21 ILE 80 1HG2 ILE 80 -0.656 12.151 4.712 634 HG22 ILE 80 2HG2 ILE 80 0.143 10.641 4.281 635 HG23 ILE 80 3HG2 ILE 80 -1.617 10.741 4.284 636 HD11 ILE 80 3HD1 ILE 80 -0.227 10.061 -0.354 637 HD12 ILE 80 1HD1 ILE 80 -0.026 11.758 0.092 638 HD13 ILE 80 2HD1 ILE 80 -1.643 11.060 -0.021 639 H THR 81 H THR 81 -4.243 13.116 2.794 640 HA THR 81 HA THR 81 -3.551 15.358 4.589 641 HB THR 81 HB THR 81 -5.311 15.441 2.847 642 HG1 THR 81 1HG THR 81 -6.010 16.807 4.292 643 HG21 THR 81 3HG2 THR 81 -7.238 13.811 4.279 644 HG22 THR 81 1HG2 THR 81 -5.845 12.890 3.719 645 HG23 THR 81 2HG2 THR 81 -6.805 13.811 2.566 646 H SER 82 H SER 82 -3.270 12.303 5.236 647 HA SER 82 HA SER 82 -3.330 11.111 7.291 648 HB2 SER 82 2HB SER 82 -5.122 13.203 8.468 649 HB3 SER 82 1HB SER 82 -3.802 12.314 9.221 650 HG SER 82 HG SER 82 -2.700 14.053 8.800 651 H ASP 83 H ASP 83 -5.963 12.157 5.426 652 HA ASP 83 HA ASP 83 -7.869 10.272 6.732 653 HB2 ASP 83 2HB ASP 83 -8.254 12.818 6.095 654 HB3 ASP 83 1HB ASP 83 -8.509 12.156 4.480 655 H LEU 84 H LEU 84 -6.419 11.188 3.579 656 HA LEU 84 HA LEU 84 -7.594 9.103 2.027 657 HB2 LEU 84 2HB LEU 84 -4.884 10.472 1.920 658 HB3 LEU 84 1HB LEU 84 -5.512 9.448 0.630 659 HG LEU 84 HG LEU 84 -6.526 12.122 1.574 660 HD11 LEU 84 1HD1 LEU 84 -5.712 12.796 -0.416 661 HD12 LEU 84 2HD1 LEU 84 -6.631 11.550 -1.262 662 HD13 LEU 84 3HD1 LEU 84 -5.028 11.184 -0.623 663 HD21 LEU 84 3HD2 LEU 84 -8.545 11.716 0.143 664 HD22 LEU 84 1HD2 LEU 84 -8.498 10.679 1.568 665 HD23 LEU 84 2HD2 LEU 84 -8.055 10.029 -0.010 666 H LEU 85 H LEU 85 -4.974 9.256 4.302 667 HA LEU 85 HA LEU 85 -3.927 6.574 3.838 668 HB2 LEU 85 2HB LEU 85 -3.728 8.698 5.981 669 HB3 LEU 85 1HB LEU 85 -2.920 7.139 6.162 670 HG LEU 85 HG LEU 85 -2.510 9.162 3.963 671 HD11 LEU 85 1HD1 LEU 85 -1.262 9.816 5.872 672 HD12 LEU 85 2HD1 LEU 85 -0.106 8.911 4.893 673 HD13 LEU 85 3HD1 LEU 85 -0.869 8.148 6.286 674 HD21 LEU 85 3HD2 LEU 85 -0.581 7.276 3.586 675 HD22 LEU 85 1HD2 LEU 85 -2.117 7.280 2.719 676 HD23 LEU 85 2HD2 LEU 85 -1.912 6.262 4.144 677 H ASP 86 H ASP 86 -5.969 8.106 6.315 678 HA ASP 86 HA ASP 86 -6.503 5.956 8.006 679 HB2 ASP 86 2HB ASP 86 -7.808 8.434 7.125 680 HB3 ASP 86 1HB ASP 86 -8.954 7.221 7.698 681 H LYS 87 H LYS 87 -7.685 6.509 4.737 682 HA LYS 87 HA LYS 87 -9.568 4.231 4.896 683 HB2 LYS 87 2HB LYS 87 -8.740 6.090 2.643 684 HB3 LYS 87 1HB LYS 87 -10.095 4.961 2.591 685 HG2 LYS 87 2HG LYS 87 -9.786 7.429 4.307 686 HG3 LYS 87 1HG LYS 87 -11.069 7.054 3.157 687 HD2 LYS 87 2HD LYS 87 -11.644 5.065 4.655 688 HD3 LYS 87 1HD LYS 87 -10.572 5.786 5.858 689 HE2 LYS 87 2HE LYS 87 -12.447 7.735 4.721 690 HE3 LYS 87 1HE LYS 87 -13.260 6.401 5.566 691 HZ1 LYS 87 3HZ LYS 87 -10.898 7.803 6.681 692 HZ2 LYS 87 1HZ LYS 87 -11.958 6.748 7.484 693 HZ3 LYS 87 2HZ LYS 87 -12.489 8.293 7.017 694 H ILE 88 H ILE 88 -6.713 5.141 2.911 695 HA ILE 88 HA ILE 88 -6.386 2.597 1.661 696 HB ILE 88 HB ILE 88 -4.714 4.999 2.297 697 HG12 ILE 88 2HG1 ILE 88 -4.539 4.157 -0.382 698 HG13 ILE 88 1HG1 ILE 88 -6.220 3.954 0.114 699 HG21 ILE 88 1HG2 ILE 88 -3.032 3.386 2.637 700 HG22 ILE 88 2HG2 ILE 88 -2.857 3.855 0.945 701 HG23 ILE 88 3HG2 ILE 88 -3.662 2.343 1.362 702 HD11 ILE 88 3HD1 ILE 88 -5.308 6.297 -0.771 703 HD12 ILE 88 1HD1 ILE 88 -4.827 6.468 0.915 704 HD13 ILE 88 2HD1 ILE 88 -6.523 6.208 0.502 705 H PHE 89 H PHE 89 -5.356 3.930 4.724 706 HA PHE 89 HA PHE 89 -3.655 1.772 5.577 707 HB2 PHE 89 2HB PHE 89 -3.563 4.025 6.524 708 HB3 PHE 89 1HB PHE 89 -5.242 3.894 7.047 709 HD1 PHE 89 1HD PHE 89 -3.313 0.844 7.283 710 HD2 PHE 89 2HD PHE 89 -4.333 4.466 9.355 711 HE1 PHE 89 1HE PHE 89 -2.568 -0.168 9.421 712 HE2 PHE 89 2HE PHE 89 -3.589 3.454 11.491 713 HZ PHE 89 HZ PHE 89 -2.706 1.138 11.525 714 H ALA 90 H ALA 90 -7.055 2.444 5.767 715 HA ALA 90 HA ALA 90 -7.762 0.290 7.577 716 HB1 ALA 90 1HB ALA 90 -9.179 2.277 7.194 717 HB2 ALA 90 2HB ALA 90 -10.053 0.824 6.707 718 HB3 ALA 90 3HB ALA 90 -9.317 1.862 5.485 719 H GLY 91 H GLY 91 -7.275 0.748 4.154 720 HA2 GLY 91 2HA GLY 91 -8.347 -1.818 3.323 721 HA3 GLY 91 1HA GLY 91 -7.320 -0.755 2.350 722 H VAL 92 H VAL 92 -5.169 -0.469 4.115 723 HA VAL 92 HA VAL 92 -3.610 -2.837 3.611 724 HB VAL 92 HB VAL 92 -3.352 -0.360 5.337 725 HG11 VAL 92 1HG1 VAL 92 -1.951 -2.820 5.697 726 HG12 VAL 92 2HG1 VAL 92 -1.645 -1.274 6.488 727 HG13 VAL 92 3HG1 VAL 92 -0.827 -1.670 4.977 728 HG21 VAL 92 3HG2 VAL 92 -2.259 -1.325 2.705 729 HG22 VAL 92 1HG2 VAL 92 -1.377 -0.113 3.633 730 HG23 VAL 92 2HG2 VAL 92 -3.022 0.218 3.093 731 H ASP 93 H ASP 93 -5.660 -1.715 6.205 732 HA ASP 93 HA ASP 93 -4.794 -3.443 8.318 733 HB2 ASP 93 2HB ASP 93 -6.691 -1.432 7.827 734 HB3 ASP 93 1HB ASP 93 -7.660 -2.859 8.203 735 H MET 94 H MET 94 -7.083 -3.783 5.639 736 HA MET 94 HA MET 94 -7.981 -6.441 6.428 737 HB2 MET 94 2HB MET 94 -8.118 -4.977 3.770 738 HB3 MET 94 1HB MET 94 -9.135 -6.331 4.268 739 HG2 MET 94 2HG MET 94 -9.672 -4.730 6.318 740 HG3 MET 94 1HG MET 94 -9.202 -3.477 5.169 741 HE1 MET 94 3HE MET 94 -10.951 -4.521 2.085 742 HE2 MET 94 1HE MET 94 -9.677 -3.611 2.906 743 HE3 MET 94 2HE MET 94 -11.297 -2.933 2.763 744 H ILE 95 H ILE 95 -5.761 -5.087 3.983 745 HA ILE 95 HA ILE 95 -4.893 -7.404 2.683 746 HB ILE 95 HB ILE 95 -4.004 -4.686 3.219 747 HG12 ILE 95 2HG1 ILE 95 -3.038 -6.384 0.942 748 HG13 ILE 95 1HG1 ILE 95 -4.752 -5.986 1.055 749 HG21 ILE 95 1HG2 ILE 95 -2.087 -5.776 4.335 750 HG22 ILE 95 2HG2 ILE 95 -1.592 -5.002 2.829 751 HG23 ILE 95 3HG2 ILE 95 -1.805 -6.752 2.894 752 HD11 ILE 95 3HD1 ILE 95 -3.927 -4.200 -0.208 753 HD12 ILE 95 1HD1 ILE 95 -2.405 -4.146 0.680 754 HD13 ILE 95 2HD1 ILE 95 -3.882 -3.538 1.425 755 H THR 96 H THR 96 -3.839 -6.090 5.821 756 HA THR 96 HA THR 96 -1.931 -8.224 6.348 757 HB THR 96 HB THR 96 -3.251 -5.999 7.911 758 HG1 THR 96 1HG THR 96 -1.611 -5.085 6.987 759 HG21 THR 96 3HG2 THR 96 -1.281 -6.779 9.576 760 HG22 THR 96 1HG2 THR 96 -1.735 -8.349 8.913 761 HG23 THR 96 2HG2 THR 96 -2.940 -7.354 9.730 762 H ARG 97 H ARG 97 -5.288 -7.511 7.305 763 HA ARG 97 HA ARG 97 -5.551 -9.789 9.070 764 HB2 ARG 97 2HB ARG 97 -7.538 -8.032 7.590 765 HB3 ARG 97 1HB ARG 97 -7.986 -9.185 8.849 766 HG2 ARG 97 2HG ARG 97 -6.915 -7.962 10.533 767 HG3 ARG 97 1HG ARG 97 -5.865 -7.121 9.391 768 HD2 ARG 97 2HD ARG 97 -7.413 -5.436 9.862 769 HD3 ARG 97 1HD ARG 97 -8.207 -6.207 8.474 770 HE ARG 97 HE ARG 97 -9.638 -7.433 10.040 771 HH11 ARG 97 1HH1 ARG 97 -9.997 -4.564 10.882 772 HH12 ARG 97 2HH1 ARG 97 -9.786 -4.669 12.599 773 HH21 ARG 97 1HH2 ARG 97 -8.301 -7.800 12.492 774 HH22 ARG 97 2HH2 ARG 97 -8.823 -6.500 13.509 775 H MET 98 H MET 98 -6.020 -9.281 5.609 776 HA MET 98 HA MET 98 -7.452 -11.780 5.155 777 HB2 MET 98 2HB MET 98 -5.853 -9.968 3.307 778 HB3 MET 98 1HB MET 98 -7.019 -11.188 2.795 779 HG2 MET 98 2HG MET 98 -8.838 -9.944 3.492 780 HG3 MET 98 1HG MET 98 -7.922 -9.109 4.746 781 HE1 MET 98 3HE MET 98 -8.856 -7.908 0.553 782 HE2 MET 98 1HE MET 98 -9.492 -9.191 1.591 783 HE3 MET 98 2HE MET 98 -8.011 -9.450 0.671 784 H VAL 99 H VAL 99 -4.131 -10.674 5.214 785 HA VAL 99 HA VAL 99 -3.037 -13.167 4.158 786 HB VAL 99 HB VAL 99 -1.975 -10.590 5.335 787 HG11 VAL 99 1HG1 VAL 99 -0.502 -13.117 4.598 788 HG12 VAL 99 2HG1 VAL 99 -0.309 -12.109 6.032 789 HG13 VAL 99 3HG1 VAL 99 0.286 -11.545 4.470 790 HG21 VAL 99 3HG2 VAL 99 -1.122 -10.267 3.045 791 HG22 VAL 99 1HG2 VAL 99 -2.862 -10.553 3.020 792 HG23 VAL 99 2HG2 VAL 99 -1.750 -11.848 2.579 793 H ASP 100 H ASP 100 -3.498 -11.585 7.310 794 HA ASP 100 HA ASP 100 -1.959 -13.476 8.870 795 HB2 ASP 100 2HB ASP 100 -2.705 -11.189 9.586 796 HB3 ASP 100 1HB ASP 100 -4.371 -11.767 9.599 797 H LYS 101 H LYS 101 -5.254 -13.296 7.680 798 HA LYS 101 HA LYS 101 -6.145 -15.709 9.077 799 HB2 LYS 101 2HB LYS 101 -8.200 -15.009 8.291 800 HB3 LYS 101 1HB LYS 101 -7.339 -13.500 7.992 801 HG2 LYS 101 2HG LYS 101 -8.362 -13.953 5.919 802 HG3 LYS 101 1HG LYS 101 -6.721 -14.571 5.713 803 HD2 LYS 101 2HD LYS 101 -7.704 -16.486 5.099 804 HD3 LYS 101 1HD LYS 101 -7.987 -16.721 6.816 805 HE2 LYS 101 2HE LYS 101 -10.085 -16.986 5.442 806 HE3 LYS 101 1HE LYS 101 -10.207 -15.685 6.638 807 HZ1 LYS 101 3HZ LYS 101 -10.427 -14.202 5.018 808 HZ2 LYS 101 1HZ LYS 101 -10.445 -15.455 3.876 809 HZ3 LYS 101 2HZ LYS 101 -8.978 -14.708 4.291 810 H ILE 102 H ILE 102 -4.421 -14.878 6.225 811 HA ILE 102 HA ILE 102 -5.029 -17.258 4.659 812 HB ILE 102 HB ILE 102 -3.345 -14.835 4.611 813 HG12 ILE 102 2HG1 ILE 102 -4.564 -16.318 2.293 814 HG13 ILE 102 1HG1 ILE 102 -5.554 -15.370 3.401 815 HG21 ILE 102 1HG2 ILE 102 -1.806 -15.615 2.916 816 HG22 ILE 102 2HG2 ILE 102 -2.530 -17.224 2.945 817 HG23 ILE 102 3HG2 ILE 102 -1.633 -16.633 4.344 818 HD11 ILE 102 3HD1 ILE 102 -4.284 -14.358 1.183 819 HD12 ILE 102 1HD1 ILE 102 -3.153 -13.957 2.474 820 HD13 ILE 102 2HD1 ILE 102 -4.826 -13.401 2.559 821 H VAL 103 H VAL 103 -2.270 -16.113 6.608 822 HA VAL 103 HA VAL 103 -0.748 -18.541 6.523 823 HB VAL 103 HB VAL 103 -1.017 -16.201 8.435 824 HG11 VAL 103 1HG1 VAL 103 1.463 -17.676 8.708 825 HG12 VAL 103 2HG1 VAL 103 0.083 -18.721 9.055 826 HG13 VAL 103 3HG1 VAL 103 0.302 -17.220 9.955 827 HG21 VAL 103 3HG2 VAL 103 0.727 -15.260 7.263 828 HG22 VAL 103 1HG2 VAL 103 0.067 -16.260 5.969 829 HG23 VAL 103 2HG2 VAL 103 1.460 -16.821 6.894 830 H SER 104 H SER 104 -3.518 -17.421 8.324 831 HA SER 104 HA SER 104 -3.473 -19.599 10.286 832 HB2 SER 104 2HB SER 104 -4.346 -17.128 10.438 833 HB3 SER 104 1HB SER 104 -5.791 -17.799 9.685 834 HG SER 104 HG SER 104 -5.358 -19.487 11.504 835 H GLU 105 H GLU 105 -5.787 -18.552 7.841 836 HA GLU 105 HA GLU 105 -6.824 -21.353 7.649 837 HB2 GLU 105 2HB GLU 105 -8.001 -18.861 6.412 838 HB3 GLU 105 1HB GLU 105 -8.833 -20.336 6.902 839 HG2 GLU 105 2HG GLU 105 -7.625 -18.223 8.705 840 HG3 GLU 105 1HG GLU 105 -9.328 -18.659 8.559 841 H GLY 106 H GLY 106 -5.547 -18.689 5.679 842 HA2 GLY 106 2HA GLY 106 -4.111 -19.154 3.751 843 HA3 GLY 106 1HA GLY 106 -4.985 -20.669 3.521 844 H SER 107 H SER 107 -6.775 -17.783 4.275 845 HA SER 107 HA SER 107 -7.640 -17.599 1.397 846 HB2 SER 107 2HB SER 107 -9.500 -17.096 3.681 847 HB3 SER 107 1HB SER 107 -9.857 -17.662 2.053 848 HG SER 107 HG SER 107 -9.835 -19.566 2.951 849 H ASP 108 H ASP 108 -7.352 -15.614 0.590 850 HA ASP 108 HA ASP 108 -6.765 -13.342 2.381 851 HB2 ASP 108 2HB ASP 108 -5.724 -14.049 0.060 852 HB3 ASP 108 1HB ASP 108 -7.129 -13.217 -0.610 853 H ASP 109 H ASP 109 -9.543 -14.814 1.592 854 HA ASP 109 HA ASP 109 -11.083 -12.345 0.926 855 HB2 ASP 109 2HB ASP 109 -11.262 -15.218 0.480 856 HB3 ASP 109 1HB ASP 109 -12.779 -14.566 1.102 857 H ILE 110 H ILE 110 -11.297 -11.228 2.900 858 HA ILE 110 HA ILE 110 -12.348 -12.756 5.244 859 HB ILE 110 HB ILE 110 -11.589 -10.767 6.503 860 HG12 ILE 110 2HG1 ILE 110 -10.653 -9.733 3.815 861 HG13 ILE 110 1HG1 ILE 110 -12.102 -9.158 4.636 862 HG21 ILE 110 1HG2 ILE 110 -9.756 -12.130 6.470 863 HG22 ILE 110 2HG2 ILE 110 -9.096 -10.881 5.416 864 HG23 ILE 110 3HG2 ILE 110 -9.815 -12.333 4.719 865 HD11 ILE 110 3HD1 ILE 110 -9.631 -9.204 6.273 866 HD12 ILE 110 1HD1 ILE 110 -10.916 -7.998 6.207 867 HD13 ILE 110 2HD1 ILE 110 -9.662 -8.020 4.966 868 H GLY 111 H GLY 111 -13.840 -11.669 2.759 869 HA2 GLY 111 2HA GLY 111 -16.133 -11.046 2.583 870 HA3 GLY 111 1HA GLY 111 -16.110 -10.580 4.284 871 H GLU 112 H GLU 112 -13.429 -9.140 3.280 872 HA GLU 112 HA GLU 112 -14.475 -6.497 3.288 873 HB2 GLU 112 2HB GLU 112 -12.176 -5.963 2.384 874 HB3 GLU 112 1HB GLU 112 -12.173 -6.997 3.815 875 HG2 GLU 112 2HG GLU 112 -10.881 -8.387 2.584 876 HG3 GLU 112 1HG GLU 112 -12.381 -8.822 1.767 877 H ASN 113 H ASN 113 -14.031 -4.949 1.337 878 HA ASN 113 HA ASN 113 -15.132 -6.209 -1.156 879 HB2 ASN 113 2HB ASN 113 -15.978 -4.051 0.532 880 HB3 ASN 113 1HB ASN 113 -15.548 -3.388 -1.045 881 HD21 ASN 113 1HD2 ASN 113 -17.988 -5.097 0.677 882 HD22 ASN 113 2HD2 ASN 113 -18.951 -5.516 -0.657 883 H ILE 114 H ILE 114 -14.111 -5.658 -3.122 884 HA ILE 114 HA ILE 114 -11.587 -4.071 -2.829 885 HB ILE 114 HB ILE 114 -12.362 -6.186 -4.864 886 HG12 ILE 114 2HG1 ILE 114 -12.137 -7.403 -2.867 887 HG13 ILE 114 1HG1 ILE 114 -10.502 -7.452 -3.523 888 HG21 ILE 114 1HG2 ILE 114 -9.532 -5.658 -4.417 889 HG22 ILE 114 2HG2 ILE 114 -10.394 -4.212 -4.950 890 HG23 ILE 114 3HG2 ILE 114 -10.441 -5.680 -5.930 891 HD11 ILE 114 3HD1 ILE 114 -11.563 -5.937 -1.177 892 HD12 ILE 114 1HD1 ILE 114 -10.272 -5.191 -2.119 893 HD13 ILE 114 2HD1 ILE 114 -10.018 -6.768 -1.372 894 H ASP 115 H ASP 115 -13.470 -4.987 -5.727 895 HA ASP 115 HA ASP 115 -13.079 -2.655 -7.186 896 HB2 ASP 115 2HB ASP 115 -14.360 -4.878 -7.680 897 HB3 ASP 115 1HB ASP 115 -15.764 -4.017 -7.052 898 H VAL 116 H VAL 116 -15.018 -3.185 -4.411 899 HA VAL 116 HA VAL 116 -16.453 -0.636 -4.606 900 HB VAL 116 HB VAL 116 -16.361 -2.956 -2.676 901 HG11 VAL 116 1HG1 VAL 116 -16.890 -1.218 -1.204 902 HG12 VAL 116 2HG1 VAL 116 -18.491 -1.695 -1.770 903 HG13 VAL 116 3HG1 VAL 116 -17.702 -0.271 -2.451 904 HG21 VAL 116 3HG2 VAL 116 -18.634 -3.358 -3.490 905 HG22 VAL 116 1HG2 VAL 116 -17.535 -3.254 -4.866 906 HG23 VAL 116 2HG2 VAL 116 -18.577 -1.888 -4.463 907 H PHE 117 H PHE 117 -14.230 -2.173 -2.332 908 HA PHE 117 HA PHE 117 -13.810 0.273 -0.809 909 HB2 PHE 117 2HB PHE 117 -13.511 -2.223 -0.152 910 HB3 PHE 117 1HB PHE 117 -11.941 -2.096 -0.947 911 HD1 PHE 117 1HD PHE 117 -10.346 -0.237 -0.200 912 HD2 PHE 117 2HD PHE 117 -13.830 -1.387 2.037 913 HE1 PHE 117 1HE PHE 117 -9.410 0.856 1.821 914 HE2 PHE 117 2HE PHE 117 -12.893 -0.294 4.058 915 HZ PHE 117 HZ PHE 117 -10.683 0.826 3.949 916 H SER 118 H SER 118 -12.610 -0.947 -3.763 917 HA SER 118 HA SER 118 -10.139 0.626 -3.715 918 HB2 SER 118 2HB SER 118 -11.496 -1.254 -5.658 919 HB3 SER 118 1HB SER 118 -9.972 -0.446 -6.022 920 HG SER 118 HG SER 118 -9.293 -1.402 -3.911 921 H ASP 119 H ASP 119 -13.352 0.624 -4.979 922 HA ASP 119 HA ASP 119 -12.847 3.023 -6.623 923 HB2 ASP 119 2HB ASP 119 -15.228 1.194 -6.242 924 HB3 ASP 119 1HB ASP 119 -15.242 2.595 -7.315 925 H THR 120 H THR 120 -14.500 1.982 -3.774 926 HA THR 120 HA THR 120 -15.975 4.379 -3.247 927 HB THR 120 HB THR 120 -14.872 2.123 -1.569 928 HG1 THR 120 1HG THR 120 -16.678 1.921 -3.149 929 HG21 THR 120 3HG2 THR 120 -15.061 3.728 0.077 930 HG22 THR 120 1HG2 THR 120 -16.702 3.084 0.066 931 HG23 THR 120 2HG2 THR 120 -16.344 4.596 -0.768 932 H ILE 121 H ILE 121 -12.999 3.130 -1.898 933 HA ILE 121 HA ILE 121 -12.185 5.426 -0.484 934 HB ILE 121 HB ILE 121 -11.473 2.840 -0.873 935 HG12 ILE 121 2HG1 ILE 121 -11.171 4.354 1.092 936 HG13 ILE 121 1HG1 ILE 121 -9.858 3.206 0.838 937 HG21 ILE 121 1HG2 ILE 121 -9.021 2.924 -1.522 938 HG22 ILE 121 2HG2 ILE 121 -9.335 4.532 -2.173 939 HG23 ILE 121 3HG2 ILE 121 -10.163 3.132 -2.848 940 HD11 ILE 121 3HD1 ILE 121 -9.260 5.522 -0.703 941 HD12 ILE 121 1HD1 ILE 121 -8.401 4.920 0.713 942 HD13 ILE 121 2HD1 ILE 121 -9.722 6.073 0.902 943 H LYS 122 H LYS 122 -11.455 4.368 -3.832 944 HA LYS 122 HA LYS 122 -9.674 6.625 -4.287 945 HB2 LYS 122 2HB LYS 122 -9.130 5.050 -5.792 946 HB3 LYS 122 1HB LYS 122 -10.583 4.153 -5.383 947 HG2 LYS 122 2HG LYS 122 -11.822 5.753 -6.937 948 HG3 LYS 122 1HG LYS 122 -10.220 6.206 -7.547 949 HD2 LYS 122 2HD LYS 122 -11.241 3.382 -7.309 950 HD3 LYS 122 1HD LYS 122 -11.224 4.301 -8.823 951 HE2 LYS 122 2HE LYS 122 -8.618 4.559 -7.752 952 HE3 LYS 122 1HE LYS 122 -9.058 2.851 -7.541 953 HZ1 LYS 122 3HZ LYS 122 -9.799 4.158 -10.055 954 HZ2 LYS 122 1HZ LYS 122 -9.367 2.543 -9.765 955 HZ3 LYS 122 2HZ LYS 122 -8.165 3.743 -9.839 956 H SER 123 H SER 123 -13.087 5.955 -4.613 957 HA SER 123 HA SER 123 -13.573 8.439 -6.142 958 HB2 SER 123 2HB SER 123 -14.819 6.223 -6.421 959 HB3 SER 123 1HB SER 123 -15.539 6.549 -4.848 960 HG SER 123 HG SER 123 -16.153 7.568 -7.275 961 H PHE 124 H PHE 124 -13.016 7.455 -2.989 962 HA PHE 124 HA PHE 124 -14.868 9.210 -1.576 963 HB2 PHE 124 2HB PHE 124 -13.379 7.110 -0.865 964 HB3 PHE 124 1HB PHE 124 -12.213 8.370 -0.473 965 HD1 PHE 124 2HD PHE 124 -15.951 8.306 -0.235 966 HD2 PHE 124 1HD PHE 124 -12.215 8.638 1.858 967 HE1 PHE 124 2HE PHE 124 -17.172 8.788 1.868 968 HE2 PHE 124 1HE PHE 124 -13.437 9.121 3.961 969 HZ PHE 124 HZ PHE 124 -15.914 9.197 3.966 970 H ALA 125 H ALA 125 -12.308 9.829 -3.583 971 HA ALA 125 HA ALA 125 -11.377 12.247 -2.101 972 HB1 ALA 125 1HB ALA 125 -9.725 10.631 -2.978 973 HB2 ALA 125 2HB ALA 125 -9.572 12.184 -3.801 974 HB3 ALA 125 3HB ALA 125 -10.383 10.839 -4.601 975 H SER 126 H SER 126 -12.598 11.273 -5.326 976 HA SER 126 HA SER 126 -12.742 13.759 -6.594 977 HB2 SER 126 2HB SER 126 -13.376 11.939 -7.893 978 HB3 SER 126 1HB SER 126 -14.340 11.227 -6.603 979 HG SER 126 HG SER 126 -15.984 12.181 -7.478 980 H SER 127 H SER 127 -14.939 14.953 -7.006 981 HA SER 127 HA SER 127 -16.898 15.008 -4.866 982 HB2 SER 127 2HB SER 127 -16.175 17.129 -3.868 983 HB3 SER 127 1HB SER 127 -14.863 15.958 -3.773 984 HG SER 127 HG SER 127 -15.185 17.882 -5.839 985 H GLY 128 H GLY 128 -18.407 16.925 -5.184 986 HA2 GLY 128 2HA GLY 128 -19.387 18.621 -6.562 987 HA3 GLY 128 1HA GLY 128 -18.172 18.286 -7.797 988 H LYS 129 H LYS 129 -18.432 15.613 -8.255 989 HA LYS 129 HA LYS 129 -19.743 14.125 -9.545 990 HB2 LYS 129 2HB LYS 129 -20.841 14.601 -7.023 991 HB3 LYS 129 1HB LYS 129 -22.215 14.759 -8.118 992 HG2 LYS 129 2HG LYS 129 -20.389 12.465 -8.614 993 HG3 LYS 129 1HG LYS 129 -21.386 12.375 -7.163 994 HD2 LYS 129 2HD LYS 129 -22.879 13.315 -9.500 995 HD3 LYS 129 1HD LYS 129 -22.210 11.697 -9.722 996 HE2 LYS 129 2HE LYS 129 -23.169 11.175 -7.375 997 HE3 LYS 129 1HE LYS 129 -24.129 12.652 -7.590 998 HZ1 LYS 129 3HZ LYS 129 -24.745 11.751 -9.827 999 HZ2 LYS 129 1HZ LYS 129 -25.388 10.886 -8.518 1000 HZ3 LYS 129 2HZ LYS 129 -24.048 10.272 -9.364 1001 H GLU 130 H GLU 130 -19.703 15.460 -11.498 1002 HA GLU 130 HA GLU 130 -21.637 17.554 -11.989 1003 HB2 GLU 130 2HB GLU 130 -20.752 17.393 -14.265 1004 HB3 GLU 130 1HB GLU 130 -19.421 17.233 -13.118 1005 HG2 GLU 130 2HG GLU 130 -18.983 15.106 -13.758 1006 HG3 GLU 130 1HG GLU 130 -20.692 14.671 -13.763 1007 H LYS 131 H LYS 131 -23.514 17.408 -13.388 1008 HA LYS 131 HA LYS 131 -24.460 14.757 -14.258 1009 HB2 LYS 131 2HB LYS 131 -26.473 14.882 -12.812 1010 HB3 LYS 131 1HB LYS 131 -24.997 14.837 -11.848 1011 HG2 LYS 131 2HG LYS 131 -26.028 17.520 -12.648 1012 HG3 LYS 131 1HG LYS 131 -26.913 16.650 -11.396 1013 HD2 LYS 131 2HD LYS 131 -24.663 16.290 -10.243 1014 HD3 LYS 131 1HD LYS 131 -24.003 17.470 -11.375 1015 HE2 LYS 131 2HE LYS 131 -25.884 19.045 -10.602 1016 HE3 LYS 131 1HE LYS 131 -26.130 17.906 -9.264 1017 HZ1 LYS 131 3HZ LYS 131 -24.521 19.499 -8.560 1018 HZ2 LYS 131 1HZ LYS 131 -23.615 19.312 -9.982 1019 HZ3 LYS 131 2HZ LYS 131 -23.695 18.044 -8.854 1020 H LEU 132 H LEU 132 -27.031 15.237 -14.847 1021 HA LEU 132 HA LEU 132 -26.936 17.153 -17.013 1022 HB2 LEU 132 2HB LEU 132 -28.298 14.918 -16.550 1023 HB3 LEU 132 1HB LEU 132 -29.478 16.040 -15.875 1024 HG LEU 132 HG LEU 132 -28.498 17.072 -18.381 1025 HD11 LEU 132 1HD1 LEU 132 -28.428 15.272 -19.730 1026 HD12 LEU 132 2HD1 LEU 132 -30.038 14.782 -19.199 1027 HD13 LEU 132 3HD1 LEU 132 -28.614 14.237 -18.314 1028 HD21 LEU 132 3HD2 LEU 132 -31.028 16.462 -16.988 1029 HD22 LEU 132 1HD2 LEU 132 -31.131 16.372 -18.747 1030 HD23 LEU 132 2HD2 LEU 132 -30.595 17.862 -17.970 1031 H GLU 133 H GLU 133 -26.682 19.286 -16.255 1032 HA GLU 133 HA GLU 133 -28.595 20.275 -14.190 1033 HB2 GLU 133 2HB GLU 133 -25.929 21.103 -15.304 1034 HB3 GLU 133 1HB GLU 133 -26.931 22.300 -14.483 1035 HG2 GLU 133 2HG GLU 133 -26.788 19.768 -13.024 1036 HG3 GLU 133 1HG GLU 133 -25.204 20.517 -13.239 Start of MODEL 25 1 H1 MET 1 1HT MET 1 0.687 -24.704 -4.059 2 H2 MET 1 2HT MET 1 2.319 -25.050 -3.737 3 H3 MET 1 3HT MET 1 1.907 -23.770 -4.777 4 HA MET 1 HA MET 1 2.377 -22.616 -2.850 5 HB2 MET 1 2HB MET 1 -0.243 -22.917 -3.767 6 HB3 MET 1 1HB MET 1 -0.390 -23.046 -2.014 7 HG2 MET 1 2HG MET 1 1.153 -20.956 -1.952 8 HG3 MET 1 1HG MET 1 0.701 -20.761 -3.646 9 HE1 MET 1 2HE MET 1 -0.935 -18.947 -0.320 10 HE2 MET 1 3HE MET 1 0.380 -20.117 -0.391 11 HE3 MET 1 1HE MET 1 -1.214 -20.607 0.199 12 H MET 2 H MET 2 3.623 -24.647 -1.885 13 HA MET 2 HA MET 2 2.658 -24.977 0.863 14 HB2 MET 2 2HB MET 2 2.774 -27.557 0.518 15 HB3 MET 2 1HB MET 2 1.338 -26.706 -0.051 16 HG2 MET 2 2HG MET 2 1.886 -26.974 -2.267 17 HG3 MET 2 1HG MET 2 3.619 -26.941 -1.950 18 HE1 MET 2 3HE MET 2 4.875 -28.362 -2.289 19 HE2 MET 2 1HE MET 2 4.314 -29.687 -3.317 20 HE3 MET 2 2HE MET 2 4.930 -30.024 -1.702 21 H GLU 3 H GLU 3 4.982 -23.758 0.240 22 HA GLU 3 HA GLU 3 7.005 -25.633 1.286 23 HB2 GLU 3 2HB GLU 3 8.461 -25.475 -0.589 24 HB3 GLU 3 1HB GLU 3 6.874 -25.867 -1.257 25 HG2 GLU 3 2HG GLU 3 7.341 -22.970 -0.974 26 HG3 GLU 3 1HG GLU 3 8.481 -23.764 -2.063 27 H GLU 4 H GLU 4 9.103 -23.798 0.116 28 HA GLU 4 HA GLU 4 8.890 -21.781 2.186 29 HB2 GLU 4 2HB GLU 4 11.146 -22.372 0.281 30 HB3 GLU 4 1HB GLU 4 11.268 -21.482 1.801 31 HG2 GLU 4 2HG GLU 4 10.196 -23.728 2.768 32 HG3 GLU 4 1HG GLU 4 10.970 -24.417 1.341 33 H TYR 5 H TYR 5 8.920 -22.002 -1.256 34 HA TYR 5 HA TYR 5 9.402 -19.443 -2.154 35 HB2 TYR 5 2HB TYR 5 8.518 -21.639 -3.299 36 HB3 TYR 5 1HB TYR 5 6.936 -20.898 -3.055 37 HD1 TYR 5 2HD TYR 5 10.312 -19.549 -3.999 38 HD2 TYR 5 1HD TYR 5 6.161 -19.935 -5.033 39 HE1 TYR 5 2HE TYR 5 10.677 -18.126 -5.997 40 HE2 TYR 5 1HE TYR 5 6.526 -18.512 -7.031 41 HH TYR 5 HH TYR 5 8.426 -17.871 -8.509 42 H LEU 6 H LEU 6 6.427 -20.615 -0.731 43 HA LEU 6 HA LEU 6 5.245 -17.907 -0.685 44 HB2 LEU 6 2HB LEU 6 3.249 -19.061 -0.056 45 HB3 LEU 6 1HB LEU 6 4.048 -20.121 -1.216 46 HG LEU 6 HG LEU 6 5.182 -21.134 0.937 47 HD11 LEU 6 1HD1 LEU 6 2.930 -20.962 2.566 48 HD12 LEU 6 2HD1 LEU 6 3.161 -19.309 1.997 49 HD13 LEU 6 3HD1 LEU 6 4.468 -20.144 2.839 50 HD21 LEU 6 3HD2 LEU 6 3.681 -22.370 -0.562 51 HD22 LEU 6 1HD2 LEU 6 2.278 -21.618 0.198 52 HD23 LEU 6 2HD2 LEU 6 3.288 -22.734 1.118 53 H GLY 7 H GLY 7 6.713 -20.261 1.512 54 HA2 GLY 7 2HA GLY 7 5.923 -19.115 3.986 55 HA3 GLY 7 1HA GLY 7 7.413 -20.027 3.738 56 H VAL 8 H VAL 8 8.721 -18.363 1.887 57 HA VAL 8 HA VAL 8 9.590 -16.209 3.675 58 HB VAL 8 HB VAL 8 10.454 -17.370 1.036 59 HG11 VAL 8 1HG1 VAL 8 12.446 -15.579 1.791 60 HG12 VAL 8 2HG1 VAL 8 10.955 -14.672 2.049 61 HG13 VAL 8 3HG1 VAL 8 11.307 -15.356 0.462 62 HG21 VAL 8 3HG2 VAL 8 12.607 -17.278 2.745 63 HG22 VAL 8 1HG2 VAL 8 11.529 -18.662 2.568 64 HG23 VAL 8 2HG2 VAL 8 11.265 -17.500 3.867 65 H PHE 9 H PHE 9 7.721 -16.549 0.778 66 HA PHE 9 HA PHE 9 7.761 -13.856 -0.166 67 HB2 PHE 9 2HB PHE 9 6.136 -16.300 -0.444 68 HB3 PHE 9 1HB PHE 9 5.240 -14.809 -0.732 69 HD1 PHE 9 1HD PHE 9 8.765 -15.900 -1.417 70 HD2 PHE 9 2HD PHE 9 5.094 -14.340 -3.012 71 HE1 PHE 9 1HE PHE 9 9.824 -15.695 -3.650 72 HE2 PHE 9 2HE PHE 9 6.152 -14.135 -5.247 73 HZ PHE 9 HZ PHE 9 8.516 -14.812 -5.566 74 H VAL 10 H VAL 10 5.962 -15.431 2.427 75 HA VAL 10 HA VAL 10 4.197 -13.145 2.909 76 HB VAL 10 HB VAL 10 4.896 -15.607 4.544 77 HG11 VAL 10 1HG1 VAL 10 2.594 -13.641 4.735 78 HG12 VAL 10 2HG1 VAL 10 3.882 -13.858 5.920 79 HG13 VAL 10 3HG1 VAL 10 2.708 -15.145 5.647 80 HG21 VAL 10 3HG2 VAL 10 3.273 -16.758 3.381 81 HG22 VAL 10 1HG2 VAL 10 3.758 -15.642 2.104 82 HG23 VAL 10 2HG2 VAL 10 2.321 -15.306 3.070 83 H ASP 11 H ASP 11 6.943 -14.649 4.678 84 HA ASP 11 HA ASP 11 7.200 -12.819 6.771 85 HB2 ASP 11 2HB ASP 11 8.570 -14.956 5.852 86 HB3 ASP 11 1HB ASP 11 9.674 -13.673 5.357 87 H GLU 12 H GLU 12 7.860 -12.422 3.424 88 HA GLU 12 HA GLU 12 9.308 -9.868 3.771 89 HB2 GLU 12 2HB GLU 12 8.353 -11.398 1.327 90 HB3 GLU 12 1HB GLU 12 9.447 -10.015 1.301 91 HG2 GLU 12 2HG GLU 12 10.045 -12.515 2.892 92 HG3 GLU 12 1HG GLU 12 10.554 -12.320 1.214 93 H THR 13 H THR 13 6.127 -11.056 2.726 94 HA THR 13 HA THR 13 5.138 -8.538 1.752 95 HB THR 13 HB THR 13 4.321 -11.091 1.639 96 HG1 THR 13 1HG THR 13 2.224 -9.283 1.717 97 HG21 THR 13 3HG2 THR 13 2.718 -9.880 3.908 98 HG22 THR 13 1HG2 THR 13 3.711 -11.335 3.971 99 HG23 THR 13 2HG2 THR 13 2.232 -11.318 3.013 100 H LYS 14 H LYS 14 4.964 -10.126 4.947 101 HA LYS 14 HA LYS 14 3.380 -8.083 6.218 102 HB2 LYS 14 2HB LYS 14 5.061 -10.428 6.946 103 HB3 LYS 14 1HB LYS 14 4.808 -9.237 8.223 104 HG2 LYS 14 2HG LYS 14 2.724 -10.008 8.560 105 HG3 LYS 14 1HG LYS 14 2.315 -9.688 6.874 106 HD2 LYS 14 2HD LYS 14 2.358 -11.884 6.402 107 HD3 LYS 14 1HD LYS 14 4.008 -12.010 7.018 108 HE2 LYS 14 2HE LYS 14 2.236 -13.455 8.210 109 HE3 LYS 14 1HE LYS 14 3.230 -12.426 9.260 110 HZ1 LYS 14 3HZ LYS 14 0.912 -11.125 8.118 111 HZ2 LYS 14 1HZ LYS 14 1.516 -11.066 9.702 112 HZ3 LYS 14 2HZ LYS 14 0.545 -12.371 9.212 113 H GLU 15 H GLU 15 6.895 -8.757 6.214 114 HA GLU 15 HA GLU 15 7.697 -6.493 7.696 115 HB2 GLU 15 2HB GLU 15 9.063 -8.001 5.449 116 HB3 GLU 15 1HB GLU 15 9.890 -6.935 6.584 117 HG2 GLU 15 2HG GLU 15 8.205 -9.231 7.573 118 HG3 GLU 15 1HG GLU 15 9.883 -9.482 7.092 119 H TYR 16 H TYR 16 6.460 -6.813 4.550 120 HA TYR 16 HA TYR 16 7.494 -4.238 3.573 121 HB2 TYR 16 2HB TYR 16 6.197 -6.660 2.534 122 HB3 TYR 16 1HB TYR 16 5.557 -5.183 1.815 123 HD1 TYR 16 2HD TYR 16 7.858 -3.387 1.784 124 HD2 TYR 16 1HD TYR 16 7.666 -7.597 0.955 125 HE1 TYR 16 2HE TYR 16 9.877 -3.199 0.358 126 HE2 TYR 16 1HE TYR 16 9.685 -7.409 -0.472 127 HH TYR 16 HH TYR 16 11.101 -4.275 -1.243 128 H LEU 17 H LEU 17 4.736 -5.520 5.226 129 HA LEU 17 HA LEU 17 2.945 -3.278 4.525 130 HB2 LEU 17 2HB LEU 17 2.855 -5.630 6.448 131 HB3 LEU 17 1HB LEU 17 1.544 -4.456 6.315 132 HG LEU 17 HG LEU 17 2.632 -6.144 4.051 133 HD11 LEU 17 1HD1 LEU 17 1.331 -7.520 5.546 134 HD12 LEU 17 2HD1 LEU 17 0.316 -7.146 4.153 135 HD13 LEU 17 3HD1 LEU 17 0.080 -6.283 5.672 136 HD21 LEU 17 3HD2 LEU 17 0.591 -5.213 2.871 137 HD22 LEU 17 1HD2 LEU 17 1.867 -4.036 3.185 138 HD23 LEU 17 2HD2 LEU 17 0.432 -4.073 4.210 139 H GLN 18 H GLN 18 5.111 -4.377 7.004 140 HA GLN 18 HA GLN 18 4.551 -2.315 8.973 141 HB2 GLN 18 2HB GLN 18 7.159 -3.751 8.592 142 HB3 GLN 18 1HB GLN 18 6.367 -3.318 10.108 143 HG2 GLN 18 2HG GLN 18 4.564 -5.006 8.792 144 HG3 GLN 18 1HG GLN 18 6.148 -5.732 8.527 145 HE21 GLN 18 1HE2 GLN 18 3.606 -5.559 10.760 146 HE22 GLN 18 2HE2 GLN 18 4.440 -6.098 12.135 147 H ASN 19 H ASN 19 6.944 -2.967 6.536 148 HA ASN 19 HA ASN 19 8.401 -0.520 6.792 149 HB2 ASN 19 2HB ASN 19 9.476 -2.356 5.723 150 HB3 ASN 19 1HB ASN 19 8.077 -2.665 4.692 151 HD21 ASN 19 1HD2 ASN 19 9.930 -2.522 2.972 152 HD22 ASN 19 2HD2 ASN 19 10.263 -0.979 2.345 153 H LEU 20 H LEU 20 5.543 -1.515 5.198 154 HA LEU 20 HA LEU 20 5.288 0.970 3.622 155 HB2 LEU 20 2HB LEU 20 4.644 -1.162 2.612 156 HB3 LEU 20 1HB LEU 20 3.584 -1.515 3.976 157 HG LEU 20 HG LEU 20 2.288 0.580 3.389 158 HD11 LEU 20 1HD1 LEU 20 3.593 0.406 0.688 159 HD12 LEU 20 2HD1 LEU 20 4.344 1.376 1.955 160 HD13 LEU 20 3HD1 LEU 20 2.708 1.749 1.410 161 HD21 LEU 20 3HD2 LEU 20 2.208 -1.131 0.957 162 HD22 LEU 20 1HD2 LEU 20 0.900 -0.650 2.036 163 HD23 LEU 20 2HD2 LEU 20 1.991 -1.954 2.501 164 H ASN 21 H ASN 21 4.721 -0.036 6.762 165 HA ASN 21 HA ASN 21 2.283 1.590 7.133 166 HB2 ASN 21 2HB ASN 21 3.715 -0.579 8.495 167 HB3 ASN 21 1HB ASN 21 3.211 0.713 9.587 168 HD21 ASN 21 1HD2 ASN 21 2.036 -1.972 9.557 169 HD22 ASN 21 2HD2 ASN 21 0.403 -1.792 9.129 170 H ASP 22 H ASP 22 5.658 1.353 7.782 171 HA ASP 22 HA ASP 22 5.817 3.692 9.402 172 HB2 ASP 22 2HB ASP 22 7.437 1.632 9.063 173 HB3 ASP 22 1HB ASP 22 8.109 2.643 7.784 174 H THR 23 H THR 23 5.957 2.926 6.095 175 HA THR 23 HA THR 23 6.848 5.517 5.080 176 HB THR 23 HB THR 23 5.404 3.117 3.956 177 HG1 THR 23 1HG THR 23 8.084 3.874 4.263 178 HG21 THR 23 3HG2 THR 23 5.906 3.954 1.746 179 HG22 THR 23 1HG2 THR 23 6.846 5.289 2.412 180 HG23 THR 23 2HG2 THR 23 5.097 5.246 2.635 181 H LEU 24 H LEU 24 3.786 3.747 5.439 182 HA LEU 24 HA LEU 24 2.153 5.910 4.360 183 HB2 LEU 24 2HB LEU 24 1.668 3.276 5.775 184 HB3 LEU 24 1HB LEU 24 0.342 4.334 5.292 185 HG LEU 24 HG LEU 24 2.434 3.128 3.457 186 HD11 LEU 24 1HD1 LEU 24 -0.566 2.710 3.663 187 HD12 LEU 24 2HD1 LEU 24 0.663 1.565 4.202 188 HD13 LEU 24 3HD1 LEU 24 0.503 1.946 2.487 189 HD21 LEU 24 3HD2 LEU 24 1.984 4.877 2.107 190 HD22 LEU 24 1HD2 LEU 24 0.728 5.463 3.195 191 HD23 LEU 24 2HD2 LEU 24 0.337 4.256 1.972 192 H LEU 25 H LEU 25 3.309 4.848 7.525 193 HA LEU 25 HA LEU 25 1.389 6.609 8.926 194 HB2 LEU 25 2HB LEU 25 3.778 4.968 9.779 195 HB3 LEU 25 1HB LEU 25 2.767 5.875 10.911 196 HG LEU 25 HG LEU 25 1.580 3.964 8.923 197 HD11 LEU 25 1HD1 LEU 25 2.873 3.408 11.574 198 HD12 LEU 25 2HD1 LEU 25 2.940 2.472 10.080 199 HD13 LEU 25 3HD1 LEU 25 1.479 2.452 11.070 200 HD21 LEU 25 3HD2 LEU 25 0.457 5.840 10.557 201 HD22 LEU 25 1HD2 LEU 25 0.410 4.418 11.601 202 HD23 LEU 25 2HD2 LEU 25 -0.375 4.378 10.022 203 H GLU 26 H GLU 26 4.367 6.947 7.398 204 HA GLU 26 HA GLU 26 5.072 9.395 8.916 205 HB2 GLU 26 2HB GLU 26 6.398 7.694 6.784 206 HB3 GLU 26 1HB GLU 26 7.054 9.262 7.259 207 HG2 GLU 26 2HG GLU 26 7.306 8.512 9.561 208 HG3 GLU 26 1HG GLU 26 6.521 6.980 9.182 209 H LEU 27 H LEU 27 3.846 8.094 6.006 210 HA LEU 27 HA LEU 27 3.813 10.427 4.424 211 HB2 LEU 27 2HB LEU 27 3.591 8.158 3.524 212 HB3 LEU 27 1HB LEU 27 2.114 7.925 4.456 213 HG LEU 27 HG LEU 27 1.125 9.873 3.227 214 HD11 LEU 27 1HD1 LEU 27 3.301 9.514 1.195 215 HD12 LEU 27 2HD1 LEU 27 3.554 10.606 2.558 216 HD13 LEU 27 3HD1 LEU 27 2.221 10.887 1.440 217 HD21 LEU 27 3HD2 LEU 27 1.645 8.232 0.936 218 HD22 LEU 27 1HD2 LEU 27 0.208 8.251 1.959 219 HD23 LEU 27 2HD2 LEU 27 1.559 7.190 2.357 220 H GLU 28 H GLU 28 1.637 9.066 6.826 221 HA GLU 28 HA GLU 28 -0.605 10.811 6.298 222 HB2 GLU 28 2HB GLU 28 0.373 9.099 8.586 223 HB3 GLU 28 1HB GLU 28 -1.083 10.078 8.754 224 HG2 GLU 28 2HG GLU 28 -2.045 8.983 6.756 225 HG3 GLU 28 1HG GLU 28 -0.596 7.987 6.615 226 H LYS 29 H LYS 29 2.257 10.955 8.397 227 HA LYS 29 HA LYS 29 1.449 13.459 9.655 228 HB2 LYS 29 2HB LYS 29 3.223 12.959 11.006 229 HB3 LYS 29 1HB LYS 29 3.174 11.406 10.182 230 HG2 LYS 29 2HG LYS 29 4.696 12.691 8.414 231 HG3 LYS 29 1HG LYS 29 5.087 13.670 9.830 232 HD2 LYS 29 2HD LYS 29 6.131 11.937 10.910 233 HD3 LYS 29 1HD LYS 29 5.063 10.725 10.199 234 HE2 LYS 29 2HE LYS 29 6.955 10.246 8.960 235 HE3 LYS 29 1HE LYS 29 6.349 11.581 7.961 236 HZ1 LYS 29 3HZ LYS 29 7.570 12.947 9.867 237 HZ2 LYS 29 1HZ LYS 29 8.367 12.451 8.454 238 HZ3 LYS 29 2HZ LYS 29 8.540 11.551 9.885 239 H ASN 30 H ASN 30 2.962 12.445 6.805 240 HA ASN 30 HA ASN 30 3.168 15.208 5.815 241 HB2 ASN 30 2HB ASN 30 5.418 13.730 6.858 242 HB3 ASN 30 1HB ASN 30 5.639 13.967 5.123 243 HD21 ASN 30 1HD2 ASN 30 6.408 15.406 7.988 244 HD22 ASN 30 2HD2 ASN 30 6.430 17.034 7.506 245 HA PRO 31 HA PRO 31 1.869 12.133 2.802 246 HB2 PRO 31 2HB PRO 31 -0.593 13.209 2.404 247 HB3 PRO 31 1HB PRO 31 -0.215 12.112 3.739 248 HG2 PRO 31 2HG PRO 31 -0.712 14.996 3.783 249 HG3 PRO 31 1HG PRO 31 -0.909 13.786 5.058 250 HD2 PRO 31 2HD PRO 31 1.240 15.603 4.710 251 HD3 PRO 31 1HD PRO 31 1.085 14.316 5.926 252 H GLU 32 H GLU 32 3.394 14.756 2.493 253 HA GLU 32 HA GLU 32 2.607 15.234 -0.335 254 HB2 GLU 32 2HB GLU 32 3.283 17.763 0.688 255 HB3 GLU 32 1HB GLU 32 1.670 17.215 0.244 256 HG2 GLU 32 2HG GLU 32 1.119 16.644 2.459 257 HG3 GLU 32 1HG GLU 32 2.812 16.573 2.957 258 H ASP 33 H ASP 33 4.953 14.332 1.712 259 HA ASP 33 HA ASP 33 7.192 15.957 0.927 260 HB2 ASP 33 2HB ASP 33 6.599 13.565 2.498 261 HB3 ASP 33 1HB ASP 33 8.161 13.469 1.682 262 H MET 34 H MET 34 5.423 13.534 -0.614 263 HA MET 34 HA MET 34 5.626 12.504 -2.709 264 HB2 MET 34 2HB MET 34 7.411 14.868 -2.742 265 HB3 MET 34 1HB MET 34 7.781 13.642 -3.954 266 HG2 MET 34 2HG MET 34 4.927 14.464 -3.566 267 HG3 MET 34 1HG MET 34 6.002 15.536 -4.464 268 HE1 MET 34 3HE MET 34 4.539 14.890 -7.169 269 HE2 MET 34 1HE MET 34 3.770 14.923 -5.577 270 HE3 MET 34 2HE MET 34 3.510 13.554 -6.655 271 H GLU 35 H GLU 35 7.670 12.120 -0.217 272 HA GLU 35 HA GLU 35 9.437 10.222 -1.678 273 HB2 GLU 35 2HB GLU 35 11.002 10.592 0.049 274 HB3 GLU 35 1HB GLU 35 10.222 12.167 -0.062 275 HG2 GLU 35 2HG GLU 35 8.784 11.660 1.820 276 HG3 GLU 35 1HG GLU 35 9.359 9.993 1.866 277 H LEU 36 H LEU 36 7.279 10.663 1.078 278 HA LEU 36 HA LEU 36 7.194 7.823 1.765 279 HB2 LEU 36 2HB LEU 36 5.387 10.187 2.407 280 HB3 LEU 36 1HB LEU 36 5.314 8.617 3.205 281 HG LEU 36 HG LEU 36 7.871 10.179 3.104 282 HD11 LEU 36 1HD1 LEU 36 7.293 11.521 4.856 283 HD12 LEU 36 2HD1 LEU 36 6.232 10.305 5.561 284 HD13 LEU 36 3HD1 LEU 36 5.669 11.286 4.210 285 HD21 LEU 36 3HD2 LEU 36 6.729 7.922 4.736 286 HD22 LEU 36 1HD2 LEU 36 8.108 8.858 5.315 287 HD23 LEU 36 2HD2 LEU 36 8.227 7.954 3.805 288 H ILE 37 H ILE 37 5.698 9.951 -0.534 289 HA ILE 37 HA ILE 37 3.344 8.287 -1.042 290 HB ILE 37 HB ILE 37 4.716 10.516 -2.589 291 HG12 ILE 37 2HG1 ILE 37 2.488 10.451 -0.541 292 HG13 ILE 37 1HG1 ILE 37 3.999 11.357 -0.464 293 HG21 ILE 37 1HG2 ILE 37 2.891 10.574 -4.027 294 HG22 ILE 37 2HG2 ILE 37 1.816 9.805 -2.859 295 HG23 ILE 37 3HG2 ILE 37 3.008 8.840 -3.728 296 HD11 ILE 37 3HD1 ILE 37 2.602 13.048 -1.175 297 HD12 ILE 37 1HD1 ILE 37 1.511 11.939 -2.004 298 HD13 ILE 37 2HD1 ILE 37 3.047 12.384 -2.747 299 H ASN 38 H ASN 38 6.653 8.559 -2.255 300 HA ASN 38 HA ASN 38 6.094 6.687 -4.471 301 HB2 ASN 38 2HB ASN 38 8.572 8.118 -3.473 302 HB3 ASN 38 1HB ASN 38 8.546 7.096 -4.911 303 HD21 ASN 38 1HD2 ASN 38 9.147 9.921 -5.024 304 HD22 ASN 38 2HD2 ASN 38 7.902 10.682 -5.894 305 H GLU 39 H GLU 39 7.297 6.697 -1.260 306 HA GLU 39 HA GLU 39 8.681 4.131 -1.408 307 HB2 GLU 39 2HB GLU 39 7.736 5.999 0.771 308 HB3 GLU 39 1HB GLU 39 8.465 4.440 1.163 309 HG2 GLU 39 2HG GLU 39 9.761 6.586 -0.543 310 HG3 GLU 39 1HG GLU 39 10.147 6.265 1.149 311 H ALA 40 H ALA 40 5.502 5.288 -0.912 312 HA ALA 40 HA ALA 40 4.459 2.718 0.115 313 HB1 ALA 40 1HB ALA 40 3.120 5.328 -0.680 314 HB2 ALA 40 2HB ALA 40 3.661 4.920 0.948 315 HB3 ALA 40 3HB ALA 40 2.352 4.006 0.200 316 H PHE 41 H PHE 41 3.995 4.853 -2.746 317 HA PHE 41 HA PHE 41 2.356 3.161 -4.300 318 HB2 PHE 41 2HB PHE 41 2.849 5.391 -5.017 319 HB3 PHE 41 1HB PHE 41 4.587 5.116 -4.916 320 HD1 PHE 41 2HD PHE 41 5.663 3.471 -6.533 321 HD2 PHE 41 1HD PHE 41 1.651 4.927 -7.009 322 HE1 PHE 41 2HE PHE 41 5.695 2.778 -8.914 323 HE2 PHE 41 1HE PHE 41 1.682 4.235 -9.391 324 HZ PHE 41 HZ PHE 41 3.705 3.161 -10.343 325 H ARG 42 H ARG 42 5.688 2.903 -3.378 326 HA ARG 42 HA ARG 42 6.464 0.919 -5.379 327 HB2 ARG 42 2HB ARG 42 7.586 2.524 -3.197 328 HB3 ARG 42 1HB ARG 42 8.253 0.891 -3.243 329 HG2 ARG 42 2HG ARG 42 8.050 2.632 -5.706 330 HG3 ARG 42 1HG ARG 42 9.475 2.618 -4.665 331 HD2 ARG 42 2HD ARG 42 8.736 -0.093 -5.176 332 HD3 ARG 42 1HD ARG 42 8.821 0.764 -6.727 333 HE ARG 42 HE ARG 42 11.046 0.613 -4.741 334 HH11 ARG 42 1HH1 ARG 42 10.236 2.795 -7.040 335 HH12 ARG 42 2HH1 ARG 42 11.566 2.490 -8.108 336 HH21 ARG 42 1HH2 ARG 42 12.578 -0.385 -6.455 337 HH22 ARG 42 2HH2 ARG 42 12.891 0.690 -7.777 338 H ALA 43 H ALA 43 6.369 0.763 -1.804 339 HA ALA 43 HA ALA 43 6.392 -2.054 -1.550 340 HB1 ALA 43 1HB ALA 43 6.769 -0.949 0.436 341 HB2 ALA 43 2HB ALA 43 5.046 -1.256 0.644 342 HB3 ALA 43 3HB ALA 43 5.598 0.318 0.068 343 H LEU 44 H LEU 44 3.736 0.068 -2.414 344 HA LEU 44 HA LEU 44 1.711 -1.989 -1.834 345 HB2 LEU 44 2HB LEU 44 1.822 0.819 -2.875 346 HB3 LEU 44 1HB LEU 44 0.381 -0.139 -3.220 347 HG LEU 44 HG LEU 44 1.505 0.054 -0.426 348 HD11 LEU 44 1HD1 LEU 44 0.283 2.159 -1.975 349 HD12 LEU 44 2HD1 LEU 44 0.851 2.205 -0.305 350 HD13 LEU 44 3HD1 LEU 44 -0.796 1.686 -0.662 351 HD21 LEU 44 3HD2 LEU 44 -0.878 -1.071 -1.770 352 HD22 LEU 44 1HD2 LEU 44 -1.216 -0.193 -0.279 353 HD23 LEU 44 2HD2 LEU 44 -0.101 -1.560 -0.264 354 H HIS 45 H HIS 45 3.181 -0.504 -4.740 355 HA HIS 45 HA HIS 45 1.740 -2.148 -6.633 356 HB2 HIS 45 2HB HIS 45 2.837 -0.039 -7.239 357 HB3 HIS 45 1HB HIS 45 4.402 -0.682 -6.742 358 HD1 HIS 45 1HD HIS 45 5.251 -2.839 -8.158 359 HD2 HIS 45 2HD HIS 45 2.165 -0.625 -9.877 360 HE1 HIS 45 1HE HIS 45 5.159 -3.512 -10.598 361 H THR 46 H THR 46 4.701 -2.471 -4.779 362 HA THR 46 HA THR 46 5.695 -4.846 -6.103 363 HB THR 46 HB THR 46 6.249 -3.117 -3.773 364 HG1 THR 46 1HG THR 46 7.418 -3.233 -5.776 365 HG21 THR 46 3HG2 THR 46 7.850 -5.006 -2.891 366 HG22 THR 46 1HG2 THR 46 6.653 -6.084 -3.610 367 HG23 THR 46 2HG2 THR 46 6.174 -4.951 -2.346 368 H LEU 47 H LEU 47 3.676 -4.194 -3.242 369 HA LEU 47 HA LEU 47 3.328 -6.974 -2.494 370 HB2 LEU 47 2HB LEU 47 2.512 -4.279 -1.714 371 HB3 LEU 47 1HB LEU 47 1.198 -5.442 -1.522 372 HG LEU 47 HG LEU 47 4.004 -5.838 -0.455 373 HD11 LEU 47 1HD1 LEU 47 3.028 -5.352 1.751 374 HD12 LEU 47 2HD1 LEU 47 1.464 -5.035 0.999 375 HD13 LEU 47 3HD1 LEU 47 2.831 -3.969 0.674 376 HD21 LEU 47 3HD2 LEU 47 3.197 -7.986 -0.503 377 HD22 LEU 47 1HD2 LEU 47 1.515 -7.461 -0.554 378 HD23 LEU 47 2HD2 LEU 47 2.389 -7.474 0.978 379 H LYS 48 H LYS 48 1.449 -4.613 -4.389 380 HA LYS 48 HA LYS 48 -0.924 -5.981 -4.897 381 HB2 LYS 48 2HB LYS 48 0.199 -3.684 -5.663 382 HB3 LYS 48 1HB LYS 48 0.567 -4.616 -7.113 383 HG2 LYS 48 2HG LYS 48 -2.161 -4.113 -5.906 384 HG3 LYS 48 1HG LYS 48 -1.562 -3.549 -7.468 385 HD2 LYS 48 2HD LYS 48 -1.940 -6.442 -6.671 386 HD3 LYS 48 1HD LYS 48 -3.014 -5.528 -7.733 387 HE2 LYS 48 2HE LYS 48 -1.294 -5.282 -9.403 388 HE3 LYS 48 1HE LYS 48 -0.056 -5.914 -8.300 389 HZ1 LYS 48 3HZ LYS 48 -2.400 -7.371 -9.398 390 HZ2 LYS 48 1HZ LYS 48 -1.438 -7.968 -8.135 391 HZ3 LYS 48 2HZ LYS 48 -0.757 -7.712 -9.670 392 H GLY 49 H GLY 49 2.255 -6.364 -6.467 393 HA2 GLY 49 2HA GLY 49 1.345 -8.345 -8.372 394 HA3 GLY 49 1HA GLY 49 3.028 -7.991 -7.983 395 H MET 50 H MET 50 3.480 -8.690 -5.508 396 HA MET 50 HA MET 50 3.614 -11.478 -5.384 397 HB2 MET 50 2HB MET 50 3.495 -9.300 -3.290 398 HB3 MET 50 1HB MET 50 3.789 -10.984 -2.853 399 HG2 MET 50 2HG MET 50 5.619 -10.863 -4.735 400 HG3 MET 50 1HG MET 50 5.506 -9.123 -4.468 401 HE1 MET 50 3HE MET 50 5.862 -8.011 -1.878 402 HE2 MET 50 1HE MET 50 5.797 -9.129 -0.508 403 HE3 MET 50 2HE MET 50 4.477 -9.083 -1.676 404 H ALA 51 H ALA 51 0.892 -9.397 -4.590 405 HA ALA 51 HA ALA 51 -0.596 -11.595 -3.271 406 HB1 ALA 51 1HB ALA 51 -2.346 -9.628 -3.324 407 HB2 ALA 51 2HB ALA 51 -0.955 -8.654 -3.801 408 HB3 ALA 51 3HB ALA 51 -0.946 -9.508 -2.257 409 H GLY 52 H GLY 52 -0.142 -10.347 -6.434 410 HA2 GLY 52 2HA GLY 52 -2.805 -11.155 -7.385 411 HA3 GLY 52 1HA GLY 52 -1.516 -10.475 -8.377 412 H THR 53 H THR 53 -1.312 -13.271 -6.206 413 HA THR 53 HA THR 53 -1.656 -15.368 -8.008 414 HB THR 53 HB THR 53 0.607 -13.711 -8.617 415 HG1 THR 53 1HG THR 53 -0.024 -16.216 -9.750 416 HG21 THR 53 3HG2 THR 53 1.821 -15.231 -7.024 417 HG22 THR 53 1HG2 THR 53 2.422 -15.315 -8.681 418 HG23 THR 53 2HG2 THR 53 1.376 -16.591 -8.057 419 H MET 54 H MET 54 0.197 -14.029 -5.448 420 HA MET 54 HA MET 54 0.394 -16.699 -4.117 421 HB2 MET 54 2HB MET 54 2.212 -14.573 -4.642 422 HB3 MET 54 1HB MET 54 1.973 -14.659 -2.899 423 HG2 MET 54 2HG MET 54 2.651 -17.048 -4.641 424 HG3 MET 54 1HG MET 54 3.837 -16.138 -3.703 425 HE1 MET 54 3HE MET 54 3.750 -15.588 -1.563 426 HE2 MET 54 1HE MET 54 3.619 -16.839 -0.318 427 HE3 MET 54 2HE MET 54 2.286 -15.720 -0.594 428 H GLY 55 H GLY 55 -1.064 -13.664 -4.103 429 HA2 GLY 55 2HA GLY 55 -2.131 -14.136 -1.353 430 HA3 GLY 55 1HA GLY 55 -1.648 -12.513 -1.867 431 H PHE 56 H PHE 56 -2.792 -14.312 -4.452 432 HA PHE 56 HA PHE 56 -4.818 -14.274 -5.668 433 HB2 PHE 56 2HB PHE 56 -5.480 -14.252 -2.825 434 HB3 PHE 56 1HB PHE 56 -6.710 -13.430 -3.785 435 HD1 PHE 56 2HD PHE 56 -6.840 -14.791 -6.280 436 HD2 PHE 56 1HD PHE 56 -6.120 -16.450 -2.385 437 HE1 PHE 56 2HE PHE 56 -7.696 -16.986 -7.056 438 HE2 PHE 56 1HE PHE 56 -6.974 -18.645 -3.160 439 HZ PHE 56 HZ PHE 56 -7.762 -18.914 -5.498 440 H SER 57 H SER 57 -5.264 -12.640 -7.070 441 HA SER 57 HA SER 57 -4.561 -9.937 -6.645 442 HB2 SER 57 2HB SER 57 -5.977 -11.582 -8.617 443 HB3 SER 57 1HB SER 57 -6.489 -9.898 -8.606 444 HG SER 57 HG SER 57 -4.685 -9.441 -9.560 445 H SER 58 H SER 58 -7.268 -11.653 -5.532 446 HA SER 58 HA SER 58 -9.278 -9.636 -5.475 447 HB2 SER 58 2HB SER 58 -8.840 -11.651 -3.278 448 HB3 SER 58 1HB SER 58 -10.359 -11.116 -3.992 449 HG SER 58 HG SER 58 -9.413 -12.105 -5.996 450 H MET 59 H MET 59 -6.543 -10.386 -3.396 451 HA MET 59 HA MET 59 -7.199 -8.120 -1.597 452 HB2 MET 59 2HB MET 59 -6.580 -10.215 -0.549 453 HB3 MET 59 1HB MET 59 -5.161 -10.367 -1.585 454 HG2 MET 59 2HG MET 59 -4.498 -8.047 -0.538 455 HG3 MET 59 1HG MET 59 -5.614 -8.525 0.743 456 HE1 MET 59 3HE MET 59 -1.854 -10.761 -0.648 457 HE2 MET 59 1HE MET 59 -2.601 -9.333 -1.377 458 HE3 MET 59 2HE MET 59 -3.376 -10.908 -1.523 459 H ALA 60 H ALA 60 -5.232 -8.997 -4.290 460 HA ALA 60 HA ALA 60 -3.173 -6.956 -3.822 461 HB1 ALA 60 1HB ALA 60 -3.427 -8.075 -6.514 462 HB2 ALA 60 2HB ALA 60 -3.441 -9.323 -5.268 463 HB3 ALA 60 3HB ALA 60 -2.087 -8.201 -5.375 464 H LYS 61 H LYS 61 -6.212 -7.260 -5.601 465 HA LYS 61 HA LYS 61 -5.905 -5.035 -7.367 466 HB2 LYS 61 2HB LYS 61 -8.242 -6.315 -5.915 467 HB3 LYS 61 1HB LYS 61 -8.470 -5.005 -7.075 468 HG2 LYS 61 2HG LYS 61 -7.920 -6.323 -8.876 469 HG3 LYS 61 1HG LYS 61 -6.790 -7.308 -7.942 470 HD2 LYS 61 2HD LYS 61 -8.723 -8.675 -8.465 471 HD3 LYS 61 1HD LYS 61 -8.758 -8.301 -6.739 472 HE2 LYS 61 2HE LYS 61 -10.978 -7.861 -7.452 473 HE3 LYS 61 1HE LYS 61 -10.217 -6.258 -7.444 474 HZ1 LYS 61 3HZ LYS 61 -10.544 -8.072 -9.774 475 HZ2 LYS 61 1HZ LYS 61 -9.591 -6.669 -9.798 476 HZ3 LYS 61 2HZ LYS 61 -11.268 -6.551 -9.554 477 H LEU 62 H LEU 62 -6.896 -5.372 -4.013 478 HA LEU 62 HA LEU 62 -7.515 -2.623 -3.504 479 HB2 LEU 62 2HB LEU 62 -8.176 -4.458 -2.028 480 HB3 LEU 62 1HB LEU 62 -6.486 -4.917 -1.794 481 HG LEU 62 HG LEU 62 -6.322 -2.353 -1.041 482 HD11 LEU 62 1HD1 LEU 62 -9.094 -2.721 -1.344 483 HD12 LEU 62 2HD1 LEU 62 -8.291 -1.370 -0.544 484 HD13 LEU 62 3HD1 LEU 62 -8.807 -2.772 0.395 485 HD21 LEU 62 3HD2 LEU 62 -7.099 -3.412 1.321 486 HD22 LEU 62 1HD2 LEU 62 -5.550 -3.789 0.568 487 HD23 LEU 62 2HD2 LEU 62 -6.914 -4.892 0.382 488 H CYS 63 H CYS 63 -4.566 -4.592 -3.346 489 HA CYS 63 HA CYS 63 -2.796 -2.647 -2.243 490 HB2 CYS 63 2HB CYS 63 -2.672 -5.162 -3.821 491 HB3 CYS 63 1HB CYS 63 -1.236 -4.145 -3.901 492 HG CYS 63 HG CYS 63 -2.372 -4.877 -1.094 493 H HIS 64 H HIS 64 -4.086 -3.174 -5.460 494 HA HIS 64 HA HIS 64 -2.287 -1.243 -6.740 495 HB2 HIS 64 2HB HIS 64 -3.382 -3.309 -7.788 496 HB3 HIS 64 1HB HIS 64 -4.898 -2.411 -7.750 497 HD1 HIS 64 1HD HIS 64 -4.937 -2.339 -10.382 498 HD2 HIS 64 2HD HIS 64 -1.675 -0.402 -8.654 499 HE1 HIS 64 1HE HIS 64 -3.886 -0.934 -12.211 500 H THR 65 H THR 65 -5.449 -1.354 -5.267 501 HA THR 65 HA THR 65 -6.477 1.153 -6.244 502 HB THR 65 HB THR 65 -7.023 -0.833 -4.068 503 HG1 THR 65 1HG THR 65 -7.896 -1.127 -6.111 504 HG21 THR 65 3HG2 THR 65 -8.493 1.804 -4.270 505 HG22 THR 65 1HG2 THR 65 -7.302 1.432 -3.025 506 HG23 THR 65 2HG2 THR 65 -8.796 0.501 -3.120 507 H LEU 66 H LEU 66 -4.984 0.292 -3.075 508 HA LEU 66 HA LEU 66 -4.886 2.941 -2.005 509 HB2 LEU 66 2HB LEU 66 -2.775 0.808 -1.589 510 HB3 LEU 66 1HB LEU 66 -3.372 1.986 -0.425 511 HG LEU 66 HG LEU 66 -4.735 -0.497 -1.442 512 HD11 LEU 66 1HD1 LEU 66 -3.426 0.348 0.972 513 HD12 LEU 66 2HD1 LEU 66 -4.066 -1.242 0.557 514 HD13 LEU 66 3HD1 LEU 66 -5.112 -0.039 1.313 515 HD21 LEU 66 3HD2 LEU 66 -6.705 0.611 -1.456 516 HD22 LEU 66 1HD2 LEU 66 -5.962 2.065 -0.791 517 HD23 LEU 66 2HD2 LEU 66 -6.513 0.784 0.288 518 H GLU 67 H GLU 67 -2.508 1.096 -3.917 519 HA GLU 67 HA GLU 67 -0.487 3.119 -4.021 520 HB2 GLU 67 2HB GLU 67 0.330 1.067 -4.635 521 HB3 GLU 67 1HB GLU 67 -1.214 0.547 -5.301 522 HG2 GLU 67 2HG GLU 67 -0.755 2.073 -7.279 523 HG3 GLU 67 1HG GLU 67 0.871 2.301 -6.631 524 H ASN 68 H ASN 68 -3.459 2.670 -5.804 525 HA ASN 68 HA ASN 68 -2.836 4.218 -8.124 526 HB2 ASN 68 2HB ASN 68 -5.080 3.007 -6.785 527 HB3 ASN 68 1HB ASN 68 -5.525 4.616 -7.348 528 HD21 ASN 68 1HD2 ASN 68 -4.764 5.059 -9.745 529 HD22 ASN 68 2HD2 ASN 68 -4.960 3.773 -10.835 530 H ILE 69 H ILE 69 -4.187 5.055 -4.958 531 HA ILE 69 HA ILE 69 -4.525 7.858 -5.453 532 HB ILE 69 HB ILE 69 -4.163 6.117 -3.008 533 HG12 ILE 69 2HG1 ILE 69 -6.592 6.868 -2.741 534 HG13 ILE 69 1HG1 ILE 69 -6.460 7.490 -4.385 535 HG21 ILE 69 1HG2 ILE 69 -3.354 8.548 -2.701 536 HG22 ILE 69 2HG2 ILE 69 -4.590 7.974 -1.584 537 HG23 ILE 69 3HG2 ILE 69 -5.040 9.010 -2.938 538 HD11 ILE 69 3HD1 ILE 69 -7.390 5.128 -4.173 539 HD12 ILE 69 1HD1 ILE 69 -5.774 4.639 -3.669 540 HD13 ILE 69 2HD1 ILE 69 -6.032 5.324 -5.278 541 H LEU 70 H LEU 70 -1.977 5.844 -4.341 542 HA LEU 70 HA LEU 70 -0.118 8.014 -3.739 543 HB2 LEU 70 2HB LEU 70 0.404 5.070 -4.264 544 HB3 LEU 70 1HB LEU 70 1.460 6.180 -3.391 545 HG LEU 70 HG LEU 70 -1.204 5.068 -2.534 546 HD11 LEU 70 1HD1 LEU 70 1.360 4.301 -2.005 547 HD12 LEU 70 2HD1 LEU 70 -0.005 4.006 -0.926 548 HD13 LEU 70 3HD1 LEU 70 1.043 5.399 -0.661 549 HD21 LEU 70 3HD2 LEU 70 0.017 7.697 -1.885 550 HD22 LEU 70 1HD2 LEU 70 -0.591 6.765 -0.516 551 HD23 LEU 70 2HD2 LEU 70 -1.677 7.202 -1.836 552 H ASP 71 H ASP 71 -1.287 6.448 -6.496 553 HA ASP 71 HA ASP 71 1.072 6.988 -8.159 554 HB2 ASP 71 2HB ASP 71 -0.758 5.104 -8.344 555 HB3 ASP 71 1HB ASP 71 -1.716 6.359 -9.131 556 H LYS 72 H LYS 72 -2.309 8.205 -7.854 557 HA LYS 72 HA LYS 72 -1.920 10.431 -9.624 558 HB2 LYS 72 2HB LYS 72 -3.712 9.702 -7.334 559 HB3 LYS 72 1HB LYS 72 -3.931 11.208 -8.216 560 HG2 LYS 72 2HG LYS 72 -4.623 10.121 -10.140 561 HG3 LYS 72 1HG LYS 72 -3.726 8.647 -9.742 562 HD2 LYS 72 2HD LYS 72 -5.781 9.458 -7.808 563 HD3 LYS 72 1HD LYS 72 -6.392 8.887 -9.362 564 HE2 LYS 72 2HE LYS 72 -4.494 7.013 -8.866 565 HE3 LYS 72 1HE LYS 72 -4.990 7.417 -7.210 566 HZ1 LYS 72 3HZ LYS 72 -7.113 6.740 -7.567 567 HZ2 LYS 72 1HZ LYS 72 -6.361 5.717 -8.691 568 HZ3 LYS 72 2HZ LYS 72 -7.098 7.156 -9.213 569 H ALA 73 H ALA 73 -1.472 9.834 -6.222 570 HA ALA 73 HA ALA 73 -0.895 12.447 -5.275 571 HB1 ALA 73 1HB ALA 73 0.417 11.085 -3.563 572 HB2 ALA 73 2HB ALA 73 0.090 9.666 -4.563 573 HB3 ALA 73 3HB ALA 73 -1.246 10.544 -3.810 574 H ARG 74 H ARG 74 0.989 10.018 -6.980 575 HA ARG 74 HA ARG 74 3.424 11.694 -6.926 576 HB2 ARG 74 2HB ARG 74 4.327 9.611 -6.976 577 HB3 ARG 74 1HB ARG 74 2.724 8.911 -7.167 578 HG2 ARG 74 2HG ARG 74 2.865 9.204 -9.604 579 HG3 ARG 74 1HG ARG 74 4.449 9.961 -9.434 580 HD2 ARG 74 2HD ARG 74 5.510 7.954 -9.013 581 HD3 ARG 74 1HD ARG 74 4.094 7.264 -8.192 582 HE ARG 74 HE ARG 74 3.034 7.072 -10.469 583 HH11 ARG 74 1HH2 ARG 74 5.691 8.715 -11.301 584 HH12 ARG 74 2HH2 ARG 74 6.390 7.523 -12.346 585 HH21 ARG 74 1HH1 ARG 74 4.242 4.996 -11.332 586 HH22 ARG 74 2HH1 ARG 74 5.569 5.416 -12.364 587 H ASN 75 H ASN 75 0.651 11.049 -8.863 588 HA ASN 75 HA ASN 75 1.880 12.031 -11.377 589 HB2 ASN 75 2HB ASN 75 0.055 10.152 -10.902 590 HB3 ASN 75 1HB ASN 75 -1.047 11.527 -10.977 591 HD21 ASN 75 1HD2 ASN 75 0.684 9.274 -12.894 592 HD22 ASN 75 2HD2 ASN 75 0.466 10.035 -14.396 593 H SER 76 H SER 76 0.611 13.399 -8.610 594 HA SER 76 HA SER 76 0.197 15.678 -8.132 595 HB2 SER 76 2HB SER 76 0.846 17.196 -9.722 596 HB3 SER 76 1HB SER 76 1.510 15.756 -10.490 597 HG SER 76 HG SER 76 0.265 16.690 -12.024 598 H GLU 77 H GLU 77 -1.928 13.509 -9.034 599 HA GLU 77 HA GLU 77 -4.070 15.392 -9.832 600 HB2 GLU 77 2HB GLU 77 -4.243 12.408 -9.470 601 HB3 GLU 77 1HB GLU 77 -5.303 13.430 -10.426 602 HG2 GLU 77 2HG GLU 77 -2.357 13.247 -11.044 603 HG3 GLU 77 1HG GLU 77 -3.496 12.058 -11.677 604 H ILE 78 H ILE 78 -3.306 13.039 -7.315 605 HA ILE 78 HA ILE 78 -5.134 14.561 -5.476 606 HB ILE 78 HB ILE 78 -5.834 12.363 -4.570 607 HG12 ILE 78 2HG1 ILE 78 -5.112 10.475 -6.366 608 HG13 ILE 78 1HG1 ILE 78 -3.680 11.504 -6.393 609 HG21 ILE 78 1HG2 ILE 78 -6.351 13.335 -7.258 610 HG22 ILE 78 2HG2 ILE 78 -7.475 12.625 -6.099 611 HG23 ILE 78 3HG2 ILE 78 -6.539 11.584 -7.171 612 HD11 ILE 78 3HD1 ILE 78 -4.193 9.529 -4.532 613 HD12 ILE 78 1HD1 ILE 78 -4.644 11.008 -3.684 614 HD13 ILE 78 2HD1 ILE 78 -3.020 10.834 -4.356 615 H LYS 79 H LYS 79 -4.586 12.811 -3.284 616 HA LYS 79 HA LYS 79 -1.723 12.539 -2.880 617 HB2 LYS 79 2HB LYS 79 -1.390 14.384 -1.424 618 HB3 LYS 79 1HB LYS 79 -2.310 15.051 -2.771 619 HG2 LYS 79 2HG LYS 79 -4.151 14.004 -0.822 620 HG3 LYS 79 1HG LYS 79 -3.005 15.072 -0.015 621 HD2 LYS 79 2HD LYS 79 -4.758 15.709 -2.391 622 HD3 LYS 79 1HD LYS 79 -4.818 16.439 -0.786 623 HE2 LYS 79 2HE LYS 79 -2.204 16.902 -1.470 624 HE3 LYS 79 1HE LYS 79 -3.011 17.037 -3.046 625 HZ1 LYS 79 3HZ LYS 79 -2.971 19.042 -1.341 626 HZ2 LYS 79 1HZ LYS 79 -4.337 18.242 -0.737 627 HZ3 LYS 79 2HZ LYS 79 -4.302 18.756 -2.356 628 H ILE 80 H ILE 80 -1.801 12.744 -0.043 629 HA ILE 80 HA ILE 80 -3.932 10.797 0.670 630 HB ILE 80 HB ILE 80 -1.932 10.057 2.229 631 HG12 ILE 80 2HG1 ILE 80 -0.544 11.864 1.143 632 HG13 ILE 80 1HG1 ILE 80 0.187 10.279 1.353 633 HG21 ILE 80 1HG2 ILE 80 -1.462 8.238 0.662 634 HG22 ILE 80 2HG2 ILE 80 -2.136 9.193 -0.658 635 HG23 ILE 80 3HG2 ILE 80 -3.184 8.616 0.637 636 HD11 ILE 80 3HD1 ILE 80 -0.070 11.723 -1.060 637 HD12 ILE 80 1HD1 ILE 80 -1.234 10.405 -1.168 638 HD13 ILE 80 2HD1 ILE 80 0.471 10.055 -0.881 639 H THR 81 H THR 81 -4.819 12.949 1.416 640 HA THR 81 HA THR 81 -3.658 14.563 3.455 641 HB THR 81 HB THR 81 -6.016 15.269 3.728 642 HG1 THR 81 1HG THR 81 -6.398 12.812 2.449 643 HG21 THR 81 3HG2 THR 81 -5.095 16.289 1.847 644 HG22 THR 81 1HG2 THR 81 -6.467 15.440 1.135 645 HG23 THR 81 2HG2 THR 81 -4.848 14.750 1.021 646 H SER 82 H SER 82 -3.008 12.010 4.419 647 HA SER 82 HA SER 82 -3.119 10.731 6.392 648 HB2 SER 82 2HB SER 82 -3.727 13.327 7.044 649 HB3 SER 82 1HB SER 82 -5.193 12.504 7.571 650 HG SER 82 HG SER 82 -4.044 11.343 8.991 651 H ASP 83 H ASP 83 -6.376 12.131 5.931 652 HA ASP 83 HA ASP 83 -7.912 9.845 6.584 653 HB2 ASP 83 2HB ASP 83 -8.359 12.402 5.882 654 HB3 ASP 83 1HB ASP 83 -8.684 11.630 4.331 655 H LEU 84 H LEU 84 -6.766 10.999 3.389 656 HA LEU 84 HA LEU 84 -7.721 8.838 1.823 657 HB2 LEU 84 2HB LEU 84 -5.347 10.701 1.738 658 HB3 LEU 84 1HB LEU 84 -5.581 9.495 0.471 659 HG LEU 84 HG LEU 84 -7.464 11.721 1.263 660 HD11 LEU 84 1HD1 LEU 84 -5.531 12.256 -0.248 661 HD12 LEU 84 2HD1 LEU 84 -7.103 12.496 -1.011 662 HD13 LEU 84 3HD1 LEU 84 -6.149 11.060 -1.387 663 HD21 LEU 84 3HD2 LEU 84 -8.480 10.488 -1.012 664 HD22 LEU 84 1HD2 LEU 84 -9.118 10.308 0.623 665 HD23 LEU 84 2HD2 LEU 84 -7.967 9.131 -0.010 666 H LEU 85 H LEU 85 -4.575 9.371 3.407 667 HA LEU 85 HA LEU 85 -3.447 6.807 3.001 668 HB2 LEU 85 2HB LEU 85 -3.332 8.950 5.081 669 HB3 LEU 85 1HB LEU 85 -2.609 7.390 5.490 670 HG LEU 85 HG LEU 85 -2.042 8.513 2.832 671 HD11 LEU 85 1HD1 LEU 85 -0.642 10.208 3.511 672 HD12 LEU 85 2HD1 LEU 85 -0.247 9.395 5.022 673 HD13 LEU 85 3HD1 LEU 85 -1.779 10.254 4.857 674 HD21 LEU 85 3HD2 LEU 85 -1.071 6.441 4.530 675 HD22 LEU 85 1HD2 LEU 85 0.248 7.580 4.255 676 HD23 LEU 85 2HD2 LEU 85 -0.563 6.823 2.885 677 H ASP 86 H ASP 86 -5.498 7.996 5.579 678 HA ASP 86 HA ASP 86 -5.809 5.750 7.178 679 HB2 ASP 86 2HB ASP 86 -6.982 8.253 6.847 680 HB3 ASP 86 1HB ASP 86 -8.332 7.135 6.654 681 H LYS 87 H LYS 87 -7.357 6.436 4.072 682 HA LYS 87 HA LYS 87 -9.064 4.051 4.177 683 HB2 LYS 87 2HB LYS 87 -8.255 5.875 1.882 684 HB3 LYS 87 1HB LYS 87 -9.628 4.769 1.894 685 HG2 LYS 87 2HG LYS 87 -9.241 7.240 3.596 686 HG3 LYS 87 1HG LYS 87 -10.500 6.948 2.396 687 HD2 LYS 87 2HD LYS 87 -10.834 4.795 4.055 688 HD3 LYS 87 1HD LYS 87 -10.330 6.041 5.198 689 HE2 LYS 87 2HE LYS 87 -12.172 7.307 3.465 690 HE3 LYS 87 1HE LYS 87 -12.891 5.741 3.893 691 HZ1 LYS 87 3HZ LYS 87 -13.204 7.655 5.534 692 HZ2 LYS 87 1HZ LYS 87 -11.567 7.439 5.918 693 HZ3 LYS 87 2HZ LYS 87 -12.669 6.169 6.161 694 H ILE 88 H ILE 88 -6.116 5.055 2.448 695 HA ILE 88 HA ILE 88 -5.687 2.560 1.082 696 HB ILE 88 HB ILE 88 -4.234 5.067 1.761 697 HG12 ILE 88 2HG1 ILE 88 -3.858 3.991 -0.875 698 HG13 ILE 88 1HG1 ILE 88 -5.561 3.941 -0.421 699 HG21 ILE 88 1HG2 ILE 88 -2.299 3.931 2.141 700 HG22 ILE 88 2HG2 ILE 88 -2.280 3.792 0.383 701 HG23 ILE 88 3HG2 ILE 88 -2.893 2.463 1.367 702 HD11 ILE 88 3HD1 ILE 88 -5.409 6.107 -1.259 703 HD12 ILE 88 1HD1 ILE 88 -3.749 6.313 -0.705 704 HD13 ILE 88 2HD1 ILE 88 -5.080 6.392 0.450 705 H PHE 89 H PHE 89 -4.961 3.782 4.258 706 HA PHE 89 HA PHE 89 -3.154 1.626 5.035 707 HB2 PHE 89 2HB PHE 89 -2.901 3.744 6.113 708 HB3 PHE 89 1HB PHE 89 -4.631 3.858 6.437 709 HD1 PHE 89 1HD PHE 89 -5.687 2.375 8.148 710 HD2 PHE 89 2HD PHE 89 -1.432 2.517 7.566 711 HE1 PHE 89 1HE PHE 89 -5.349 1.281 10.349 712 HE2 PHE 89 2HE PHE 89 -1.095 1.423 9.767 713 HZ PHE 89 HZ PHE 89 -3.053 0.806 11.158 714 H ALA 90 H ALA 90 -6.530 2.191 4.968 715 HA ALA 90 HA ALA 90 -7.279 0.090 6.864 716 HB1 ALA 90 1HB ALA 90 -8.929 1.391 4.672 717 HB2 ALA 90 2HB ALA 90 -8.597 2.195 6.206 718 HB3 ALA 90 3HB ALA 90 -9.514 0.689 6.180 719 H GLY 91 H GLY 91 -6.844 0.524 3.397 720 HA2 GLY 91 2HA GLY 91 -7.828 -2.086 2.625 721 HA3 GLY 91 1HA GLY 91 -6.810 -1.030 1.635 722 H VAL 92 H VAL 92 -4.682 -0.689 3.444 723 HA VAL 92 HA VAL 92 -3.150 -3.111 2.993 724 HB VAL 92 HB VAL 92 -2.817 -0.426 4.300 725 HG11 VAL 92 1HG1 VAL 92 -0.589 -1.009 5.111 726 HG12 VAL 92 2HG1 VAL 92 -0.779 -2.664 4.537 727 HG13 VAL 92 3HG1 VAL 92 -1.773 -2.074 5.869 728 HG21 VAL 92 3HG2 VAL 92 -1.226 -0.093 2.601 729 HG22 VAL 92 1HG2 VAL 92 -2.440 -1.095 1.805 730 HG23 VAL 92 2HG2 VAL 92 -0.945 -1.822 2.396 731 H ASP 93 H ASP 93 -5.318 -2.008 5.420 732 HA ASP 93 HA ASP 93 -4.233 -3.638 7.610 733 HB2 ASP 93 2HB ASP 93 -6.268 -1.593 7.118 734 HB3 ASP 93 1HB ASP 93 -6.866 -2.877 8.173 735 H MET 94 H MET 94 -6.742 -3.929 5.115 736 HA MET 94 HA MET 94 -7.900 -6.342 6.286 737 HB2 MET 94 2HB MET 94 -9.073 -6.408 4.059 738 HB3 MET 94 1HB MET 94 -9.234 -4.863 4.890 739 HG2 MET 94 2HG MET 94 -7.705 -3.794 3.458 740 HG3 MET 94 1HG MET 94 -7.012 -5.320 2.907 741 HE1 MET 94 3HE MET 94 -10.975 -3.370 1.912 742 HE2 MET 94 1HE MET 94 -10.028 -3.321 3.405 743 HE3 MET 94 2HE MET 94 -11.115 -4.673 3.090 744 H ILE 95 H ILE 95 -5.429 -5.621 3.814 745 HA ILE 95 HA ILE 95 -5.132 -8.324 2.885 746 HB ILE 95 HB ILE 95 -3.136 -7.379 1.880 747 HG12 ILE 95 2HG1 ILE 95 -3.549 -4.983 3.670 748 HG13 ILE 95 1HG1 ILE 95 -2.353 -6.240 3.984 749 HG21 ILE 95 1HG2 ILE 95 -4.375 -6.140 0.475 750 HG22 ILE 95 2HG2 ILE 95 -4.655 -4.921 1.718 751 HG23 ILE 95 3HG2 ILE 95 -5.702 -6.337 1.620 752 HD11 ILE 95 3HD1 ILE 95 -2.437 -4.811 1.334 753 HD12 ILE 95 1HD1 ILE 95 -1.100 -5.699 2.064 754 HD13 ILE 95 2HD1 ILE 95 -1.570 -4.127 2.709 755 H THR 96 H THR 96 -3.753 -6.404 5.519 756 HA THR 96 HA THR 96 -1.709 -8.266 6.323 757 HB THR 96 HB THR 96 -3.342 -6.131 7.741 758 HG1 THR 96 1HG THR 96 -1.706 -4.864 7.218 759 HG21 THR 96 3HG2 THR 96 -0.822 -7.453 8.768 760 HG22 THR 96 1HG2 THR 96 -2.438 -7.932 9.286 761 HG23 THR 96 2HG2 THR 96 -1.854 -6.301 9.613 762 H ARG 97 H ARG 97 -5.132 -7.799 7.115 763 HA ARG 97 HA ARG 97 -5.243 -10.000 9.024 764 HB2 ARG 97 2HB ARG 97 -7.186 -8.214 7.560 765 HB3 ARG 97 1HB ARG 97 -7.781 -9.585 8.498 766 HG2 ARG 97 2HG ARG 97 -7.123 -8.671 10.516 767 HG3 ARG 97 1HG ARG 97 -5.797 -7.760 9.791 768 HD2 ARG 97 2HD ARG 97 -7.317 -6.036 10.218 769 HD3 ARG 97 1HD ARG 97 -7.805 -6.487 8.572 770 HE ARG 97 HE ARG 97 -9.234 -7.249 11.062 771 HH11 ARG 97 1HH1 ARG 97 -9.983 -5.987 8.207 772 HH12 ARG 97 2HH1 ARG 97 -11.068 -7.223 7.666 773 HH21 ARG 97 1HH2 ARG 97 -10.142 -9.484 10.129 774 HH22 ARG 97 2HH2 ARG 97 -11.154 -9.206 8.750 775 H MET 98 H MET 98 -5.788 -9.563 5.559 776 HA MET 98 HA MET 98 -6.986 -12.154 5.064 777 HB2 MET 98 2HB MET 98 -5.538 -10.054 3.430 778 HB3 MET 98 1HB MET 98 -6.116 -11.549 2.697 779 HG2 MET 98 2HG MET 98 -8.317 -10.944 2.869 780 HG3 MET 98 1HG MET 98 -8.067 -10.070 4.380 781 HE1 MET 98 3HE MET 98 -9.611 -8.774 1.184 782 HE2 MET 98 1HE MET 98 -8.683 -10.274 1.043 783 HE3 MET 98 2HE MET 98 -8.182 -8.835 0.157 784 H VAL 99 H VAL 99 -3.713 -10.811 5.030 785 HA VAL 99 HA VAL 99 -2.368 -13.186 4.101 786 HB VAL 99 HB VAL 99 -1.661 -10.617 5.513 787 HG11 VAL 99 1HG1 VAL 99 0.775 -11.358 5.096 788 HG12 VAL 99 2HG1 VAL 99 0.130 -12.996 4.991 789 HG13 VAL 99 3HG1 VAL 99 -0.051 -12.071 6.481 790 HG21 VAL 99 3HG2 VAL 99 -0.469 -10.192 3.404 791 HG22 VAL 99 1HG2 VAL 99 -2.147 -10.631 3.076 792 HG23 VAL 99 2HG2 VAL 99 -0.862 -11.816 2.840 793 H ASP 100 H ASP 100 -3.289 -11.949 7.304 794 HA ASP 100 HA ASP 100 -1.777 -13.894 8.823 795 HB2 ASP 100 2HB ASP 100 -2.487 -11.867 9.883 796 HB3 ASP 100 1HB ASP 100 -4.152 -12.090 9.347 797 H LYS 101 H LYS 101 -4.946 -13.827 7.320 798 HA LYS 101 HA LYS 101 -5.689 -16.420 8.516 799 HB2 LYS 101 2HB LYS 101 -7.735 -15.534 8.236 800 HB3 LYS 101 1HB LYS 101 -6.981 -14.095 7.570 801 HG2 LYS 101 2HG LYS 101 -6.933 -15.768 5.398 802 HG3 LYS 101 1HG LYS 101 -8.420 -16.268 6.198 803 HD2 LYS 101 2HD LYS 101 -8.366 -13.487 6.366 804 HD3 LYS 101 1HD LYS 101 -7.844 -13.872 4.722 805 HE2 LYS 101 2HE LYS 101 -10.187 -13.903 4.478 806 HE3 LYS 101 1HE LYS 101 -9.847 -15.607 4.838 807 HZ1 LYS 101 3HZ LYS 101 -9.972 -14.155 7.248 808 HZ2 LYS 101 1HZ LYS 101 -10.960 -15.434 6.734 809 HZ3 LYS 101 2HZ LYS 101 -11.377 -13.834 6.352 810 H ILE 102 H ILE 102 -4.758 -14.962 5.432 811 HA ILE 102 HA ILE 102 -5.079 -17.253 3.765 812 HB ILE 102 HB ILE 102 -3.409 -14.750 3.806 813 HG12 ILE 102 2HG1 ILE 102 -5.412 -15.871 1.823 814 HG13 ILE 102 1HG1 ILE 102 -5.802 -14.729 3.109 815 HG21 ILE 102 1HG2 ILE 102 -1.845 -16.258 2.822 816 HG22 ILE 102 2HG2 ILE 102 -2.623 -15.429 1.476 817 HG23 ILE 102 3HG2 ILE 102 -3.104 -17.073 1.895 818 HD11 ILE 102 3HD1 ILE 102 -4.249 -14.297 0.597 819 HD12 ILE 102 1HD1 ILE 102 -3.783 -13.375 2.027 820 HD13 ILE 102 2HD1 ILE 102 -5.421 -13.242 1.387 821 H VAL 103 H VAL 103 -2.706 -16.196 6.062 822 HA VAL 103 HA VAL 103 -0.739 -18.291 5.441 823 HB VAL 103 HB VAL 103 -1.150 -16.083 7.452 824 HG11 VAL 103 1HG1 VAL 103 -0.292 -17.967 8.775 825 HG12 VAL 103 2HG1 VAL 103 0.979 -16.765 8.554 826 HG13 VAL 103 3HG1 VAL 103 0.984 -18.241 7.589 827 HG21 VAL 103 3HG2 VAL 103 0.563 -15.046 6.319 828 HG22 VAL 103 1HG2 VAL 103 0.003 -16.094 5.015 829 HG23 VAL 103 2HG2 VAL 103 1.401 -16.563 5.986 830 H SER 104 H SER 104 -3.442 -17.695 7.573 831 HA SER 104 HA SER 104 -2.963 -20.027 9.281 832 HB2 SER 104 2HB SER 104 -4.015 -17.798 9.912 833 HB3 SER 104 1HB SER 104 -5.421 -18.298 8.973 834 HG SER 104 HG SER 104 -5.039 -20.325 10.428 835 H GLU 105 H GLU 105 -4.672 -19.308 6.391 836 HA GLU 105 HA GLU 105 -5.582 -22.122 6.184 837 HB2 GLU 105 2HB GLU 105 -7.860 -21.036 5.407 838 HB3 GLU 105 1HB GLU 105 -7.535 -21.259 7.123 839 HG2 GLU 105 2HG GLU 105 -6.777 -18.944 7.308 840 HG3 GLU 105 1HG GLU 105 -7.017 -18.706 5.577 841 H GLY 106 H GLY 106 -5.145 -18.943 4.647 842 HA2 GLY 106 2HA GLY 106 -4.033 -18.811 2.466 843 HA3 GLY 106 1HA GLY 106 -4.712 -20.391 2.073 844 H SER 107 H SER 107 -6.741 -18.031 3.648 845 HA SER 107 HA SER 107 -8.162 -17.586 1.029 846 HB2 SER 107 2HB SER 107 -9.335 -17.693 3.813 847 HB3 SER 107 1HB SER 107 -10.209 -17.694 2.284 848 HG SER 107 HG SER 107 -9.807 -19.755 2.065 849 H ASP 108 H ASP 108 -8.336 -15.488 0.456 850 HA ASP 108 HA ASP 108 -7.556 -13.390 2.421 851 HB2 ASP 108 2HB ASP 108 -7.256 -12.041 0.455 852 HB3 ASP 108 1HB ASP 108 -6.664 -13.643 0.016 853 H ASP 109 H ASP 109 -10.235 -15.041 1.988 854 HA ASP 109 HA ASP 109 -12.200 -12.936 1.412 855 HB2 ASP 109 2HB ASP 109 -12.539 -15.701 2.608 856 HB3 ASP 109 1HB ASP 109 -13.777 -14.747 1.790 857 H ILE 110 H ILE 110 -11.429 -11.428 3.192 858 HA ILE 110 HA ILE 110 -12.293 -12.290 5.922 859 HB ILE 110 HB ILE 110 -11.010 -10.232 6.585 860 HG12 ILE 110 2HG1 ILE 110 -9.960 -10.125 3.776 861 HG13 ILE 110 1HG1 ILE 110 -11.457 -9.281 4.169 862 HG21 ILE 110 1HG2 ILE 110 -8.777 -11.150 6.023 863 HG22 ILE 110 2HG2 ILE 110 -9.522 -12.206 4.824 864 HG23 ILE 110 3HG2 ILE 110 -9.885 -12.420 6.536 865 HD11 ILE 110 3HD1 ILE 110 -9.490 -8.785 6.222 866 HD12 ILE 110 1HD1 ILE 110 -10.322 -7.626 5.184 867 HD13 ILE 110 2HD1 ILE 110 -8.823 -8.379 4.641 868 H GLY 111 H GLY 111 -14.211 -11.556 3.771 869 HA2 GLY 111 2HA GLY 111 -16.171 -10.271 3.589 870 HA3 GLY 111 1HA GLY 111 -15.906 -9.789 5.267 871 H GLU 112 H GLU 112 -13.263 -9.219 3.182 872 HA GLU 112 HA GLU 112 -13.123 -6.439 3.644 873 HB2 GLU 112 2HB GLU 112 -11.569 -6.555 1.637 874 HB3 GLU 112 1HB GLU 112 -11.239 -7.743 2.899 875 HG2 GLU 112 2HG GLU 112 -11.435 -9.343 1.331 876 HG3 GLU 112 1HG GLU 112 -13.153 -8.952 1.252 877 H ASN 113 H ASN 113 -12.808 -5.269 1.113 878 HA ASN 113 HA ASN 113 -15.185 -5.572 -0.543 879 HB2 ASN 113 2HB ASN 113 -15.442 -4.171 1.866 880 HB3 ASN 113 1HB ASN 113 -15.266 -2.911 0.644 881 HD21 ASN 113 1HD2 ASN 113 -17.747 -2.928 1.718 882 HD22 ASN 113 2HD2 ASN 113 -18.879 -3.679 0.700 883 H ILE 114 H ILE 114 -13.016 -5.660 -1.815 884 HA ILE 114 HA ILE 114 -11.398 -3.346 -2.175 885 HB ILE 114 HB ILE 114 -12.084 -5.420 -4.268 886 HG12 ILE 114 2HG1 ILE 114 -11.671 -6.807 -2.421 887 HG13 ILE 114 1HG1 ILE 114 -10.062 -6.628 -3.116 888 HG21 ILE 114 1HG2 ILE 114 -9.360 -4.330 -3.645 889 HG22 ILE 114 2HG2 ILE 114 -10.491 -3.354 -4.585 890 HG23 ILE 114 3HG2 ILE 114 -9.994 -4.944 -5.172 891 HD11 ILE 114 3HD1 ILE 114 -11.191 -5.430 -0.614 892 HD12 ILE 114 1HD1 ILE 114 -9.961 -4.527 -1.498 893 HD13 ILE 114 2HD1 ILE 114 -9.602 -6.145 -0.895 894 H ASP 115 H ASP 115 -13.789 -4.556 -4.571 895 HA ASP 115 HA ASP 115 -13.923 -2.326 -6.205 896 HB2 ASP 115 2HB ASP 115 -15.145 -4.526 -6.413 897 HB3 ASP 115 1HB ASP 115 -16.300 -3.928 -5.221 898 H VAL 116 H VAL 116 -15.082 -2.680 -2.990 899 HA VAL 116 HA VAL 116 -16.623 -0.181 -3.030 900 HB VAL 116 HB VAL 116 -16.054 -2.386 -1.061 901 HG11 VAL 116 1HG1 VAL 116 -16.811 0.376 -0.498 902 HG12 VAL 116 2HG1 VAL 116 -16.371 -0.914 0.622 903 HG13 VAL 116 3HG1 VAL 116 -18.037 -0.765 0.059 904 HG21 VAL 116 3HG2 VAL 116 -17.858 -3.179 -2.197 905 HG22 VAL 116 1HG2 VAL 116 -18.233 -1.598 -2.883 906 HG23 VAL 116 2HG2 VAL 116 -18.779 -2.005 -1.255 907 H PHE 117 H PHE 117 -13.931 -1.484 -1.155 908 HA PHE 117 HA PHE 117 -13.243 0.969 0.153 909 HB2 PHE 117 2HB PHE 117 -12.079 -1.706 -0.318 910 HB3 PHE 117 1HB PHE 117 -10.895 -0.440 -0.005 911 HD1 PHE 117 2HD PHE 117 -11.239 1.064 2.040 912 HD2 PHE 117 1HD PHE 117 -13.355 -2.626 1.449 913 HE1 PHE 117 2HE PHE 117 -11.792 0.995 4.457 914 HE2 PHE 117 1HE PHE 117 -13.911 -2.697 3.865 915 HZ PHE 117 HZ PHE 117 -13.128 -0.885 5.370 916 H SER 118 H SER 118 -12.716 -0.119 -3.084 917 HA SER 118 HA SER 118 -10.558 1.801 -3.591 918 HB2 SER 118 2HB SER 118 -10.204 -0.180 -4.774 919 HB3 SER 118 1HB SER 118 -11.929 -0.465 -4.981 920 HG SER 118 HG SER 118 -11.907 0.711 -6.739 921 H ASP 119 H ASP 119 -13.890 1.132 -4.353 922 HA ASP 119 HA ASP 119 -14.306 3.481 -6.010 923 HB2 ASP 119 2HB ASP 119 -15.746 1.625 -6.372 924 HB3 ASP 119 1HB ASP 119 -16.041 1.427 -4.644 925 H THR 120 H THR 120 -14.552 2.655 -2.677 926 HA THR 120 HA THR 120 -15.996 4.969 -1.754 927 HB THR 120 HB THR 120 -14.292 2.777 -0.637 928 HG1 THR 120 1HG THR 120 -16.577 2.609 -0.950 929 HG21 THR 120 3HG2 THR 120 -13.507 4.802 0.532 930 HG22 THR 120 1HG2 THR 120 -14.392 3.727 1.613 931 HG23 THR 120 2HG2 THR 120 -15.170 5.179 0.981 932 H ILE 121 H ILE 121 -12.654 4.097 -2.109 933 HA ILE 121 HA ILE 121 -11.585 6.650 -1.188 934 HB ILE 121 HB ILE 121 -10.760 3.958 -1.850 935 HG12 ILE 121 2HG1 ILE 121 -9.330 6.218 -0.434 936 HG13 ILE 121 1HG1 ILE 121 -10.496 5.123 0.310 937 HG21 ILE 121 1HG2 ILE 121 -8.595 4.373 -2.839 938 HG22 ILE 121 2HG2 ILE 121 -8.875 6.115 -2.825 939 HG23 ILE 121 3HG2 ILE 121 -9.826 5.075 -3.886 940 HD11 ILE 121 3HD1 ILE 121 -7.762 4.700 0.190 941 HD12 ILE 121 1HD1 ILE 121 -8.369 3.719 -1.144 942 HD13 ILE 121 2HD1 ILE 121 -8.973 3.454 0.491 943 H LYS 122 H LYS 122 -12.132 5.041 -4.333 944 HA LYS 122 HA LYS 122 -10.899 7.021 -5.980 945 HB2 LYS 122 2HB LYS 122 -12.622 4.658 -6.173 946 HB3 LYS 122 1HB LYS 122 -13.014 5.874 -7.391 947 HG2 LYS 122 2HG LYS 122 -11.183 5.305 -8.565 948 HG3 LYS 122 1HG LYS 122 -10.183 5.746 -7.182 949 HD2 LYS 122 2HD LYS 122 -11.462 3.187 -6.738 950 HD3 LYS 122 1HD LYS 122 -10.531 3.172 -8.235 951 HE2 LYS 122 2HE LYS 122 -8.701 4.394 -6.735 952 HE3 LYS 122 1HE LYS 122 -9.572 3.572 -5.422 953 HZ1 LYS 122 3HZ LYS 122 -9.515 1.586 -7.078 954 HZ2 LYS 122 1HZ LYS 122 -8.163 1.914 -6.111 955 HZ3 LYS 122 2HZ LYS 122 -8.181 2.407 -7.736 956 H SER 123 H SER 123 -14.093 6.671 -4.557 957 HA SER 123 HA SER 123 -15.193 9.008 -5.920 958 HB2 SER 123 2HB SER 123 -16.019 7.038 -3.820 959 HB3 SER 123 1HB SER 123 -16.988 8.487 -4.080 960 HG SER 123 HG SER 123 -16.619 7.664 -6.451 961 H PHE 124 H PHE 124 -13.306 8.351 -3.176 962 HA PHE 124 HA PHE 124 -14.097 10.666 -1.570 963 HB2 PHE 124 2HB PHE 124 -12.988 8.367 -0.949 964 HB3 PHE 124 1HB PHE 124 -11.489 9.187 -1.381 965 HD1 PHE 124 2HD PHE 124 -10.840 11.306 -0.186 966 HD2 PHE 124 1HD PHE 124 -14.134 8.861 1.090 967 HE1 PHE 124 2HE PHE 124 -10.819 12.431 2.025 968 HE2 PHE 124 1HE PHE 124 -14.113 9.987 3.300 969 HZ PHE 124 HZ PHE 124 -12.456 11.771 3.767 970 H ALA 125 H ALA 125 -12.561 10.425 -4.454 971 HA ALA 125 HA ALA 125 -11.078 12.983 -4.020 972 HB1 ALA 125 1HB ALA 125 -9.884 10.490 -4.157 973 HB2 ALA 125 2HB ALA 125 -9.077 12.017 -4.512 974 HB3 ALA 125 3HB ALA 125 -9.770 11.062 -5.822 975 H SER 126 H SER 126 -13.659 12.366 -5.321 976 HA SER 126 HA SER 126 -13.210 12.427 -8.218 977 HB2 SER 126 2HB SER 126 -15.826 13.156 -7.726 978 HB3 SER 126 1HB SER 126 -15.256 11.494 -7.858 979 HG SER 126 HG SER 126 -16.128 12.887 -5.684 980 H SER 127 H SER 127 -12.562 14.688 -5.976 981 HA SER 127 HA SER 127 -13.870 17.010 -7.244 982 HB2 SER 127 2HB SER 127 -13.259 16.479 -4.726 983 HB3 SER 127 1HB SER 127 -11.686 17.127 -5.184 984 HG SER 127 HG SER 127 -14.164 18.376 -4.962 985 H GLY 128 H GLY 128 -12.965 17.800 -9.107 986 HA2 GLY 128 2HA GLY 128 -10.290 17.190 -9.964 987 HA3 GLY 128 1HA GLY 128 -11.337 18.412 -10.687 988 H LYS 129 H LYS 129 -10.112 20.253 -10.735 989 HA LYS 129 HA LYS 129 -9.235 21.399 -8.152 990 HB2 LYS 129 2HB LYS 129 -6.914 21.715 -9.107 991 HB3 LYS 129 1HB LYS 129 -7.340 20.030 -8.802 992 HG2 LYS 129 2HG LYS 129 -8.134 20.954 -11.473 993 HG3 LYS 129 1HG LYS 129 -6.391 21.019 -11.204 994 HD2 LYS 129 2HD LYS 129 -6.408 18.668 -10.464 995 HD3 LYS 129 1HD LYS 129 -8.151 18.598 -10.721 996 HE2 LYS 129 2HE LYS 129 -7.075 19.607 -13.134 997 HE3 LYS 129 1HE LYS 129 -6.038 18.245 -12.663 998 HZ1 LYS 129 3HZ LYS 129 -8.986 18.093 -12.475 999 HZ2 LYS 129 1HZ LYS 129 -7.865 16.820 -12.481 1000 HZ3 LYS 129 2HZ LYS 129 -8.172 17.687 -13.910 1001 H GLU 130 H GLU 130 -8.118 23.647 -8.735 1002 HA GLU 130 HA GLU 130 -9.563 24.855 -11.071 1003 HB2 GLU 130 2HB GLU 130 -9.991 25.213 -8.292 1004 HB3 GLU 130 1HB GLU 130 -9.211 26.687 -8.867 1005 HG2 GLU 130 2HG GLU 130 -10.903 26.674 -10.782 1006 HG3 GLU 130 1HG GLU 130 -11.766 25.428 -9.881 1007 H LYS 131 H LYS 131 -8.589 27.239 -11.328 1008 HA LYS 131 HA LYS 131 -5.762 27.532 -10.639 1009 HB2 LYS 131 2HB LYS 131 -6.417 25.896 -12.789 1010 HB3 LYS 131 1HB LYS 131 -6.049 27.440 -13.557 1011 HG2 LYS 131 2HG LYS 131 -3.924 27.497 -12.156 1012 HG3 LYS 131 1HG LYS 131 -4.266 25.821 -11.724 1013 HD2 LYS 131 2HD LYS 131 -3.857 25.039 -13.862 1014 HD3 LYS 131 1HD LYS 131 -4.326 26.560 -14.621 1015 HE2 LYS 131 2HE LYS 131 -2.095 27.230 -13.057 1016 HE3 LYS 131 1HE LYS 131 -1.676 25.678 -13.808 1017 HZ1 LYS 131 3HZ LYS 131 -1.274 27.731 -15.210 1018 HZ2 LYS 131 1HZ LYS 131 -2.960 27.876 -15.323 1019 HZ3 LYS 131 2HZ LYS 131 -2.185 26.494 -15.936 1020 H LEU 132 H LEU 132 -4.909 29.600 -11.490 1021 HA LEU 132 HA LEU 132 -7.111 31.548 -12.028 1022 HB2 LEU 132 2HB LEU 132 -4.525 31.491 -10.586 1023 HB3 LEU 132 1HB LEU 132 -4.862 32.993 -11.448 1024 HG LEU 132 HG LEU 132 -5.730 33.019 -9.108 1025 HD11 LEU 132 1HD1 LEU 132 -8.269 33.317 -10.007 1026 HD12 LEU 132 2HD1 LEU 132 -7.401 33.337 -11.541 1027 HD13 LEU 132 3HD1 LEU 132 -7.003 34.512 -10.288 1028 HD21 LEU 132 3HD2 LEU 132 -6.484 30.402 -9.707 1029 HD22 LEU 132 1HD2 LEU 132 -8.010 31.284 -9.685 1030 HD23 LEU 132 2HD2 LEU 132 -6.957 31.312 -8.271 1031 H GLU 133 H GLU 133 -5.817 29.798 -14.109 1032 HA GLU 133 HA GLU 133 -4.903 32.003 -15.914 1033 HB2 GLU 133 2HB GLU 133 -3.251 30.132 -14.718 1034 HB3 GLU 133 1HB GLU 133 -3.581 29.405 -16.292 1035 HG2 GLU 133 2HG GLU 133 -1.916 30.754 -17.042 1036 HG3 GLU 133 1HG GLU 133 -3.131 32.032 -16.968 Start of MODEL 26 1 H1 MET 1 1HT MET 1 5.232 -32.069 -2.832 2 H2 MET 1 2HT MET 1 6.262 -31.439 -1.637 3 H3 MET 1 3HT MET 1 6.902 -32.359 -2.914 4 HA MET 1 HA MET 1 6.870 -30.644 -4.373 5 HB2 MET 1 2HB MET 1 4.963 -29.217 -4.564 6 HB3 MET 1 1HB MET 1 4.323 -30.782 -4.065 7 HG2 MET 1 2HG MET 1 5.006 -28.585 -2.096 8 HG3 MET 1 1HG MET 1 3.402 -28.782 -2.796 9 HE1 MET 1 2HE MET 1 5.803 -30.883 0.171 10 HE2 MET 1 3HE MET 1 4.626 -29.762 0.853 11 HE3 MET 1 1HE MET 1 5.721 -29.230 -0.432 12 H MET 2 H MET 2 6.645 -27.931 -3.927 13 HA MET 2 HA MET 2 8.488 -27.516 -1.601 14 HB2 MET 2 2HB MET 2 8.831 -27.024 -4.263 15 HB3 MET 2 1HB MET 2 8.202 -25.467 -3.724 16 HG2 MET 2 2HG MET 2 9.987 -25.108 -2.249 17 HG3 MET 2 1HG MET 2 10.392 -26.822 -2.171 18 HE1 MET 2 3HE MET 2 11.955 -27.705 -5.436 19 HE2 MET 2 1HE MET 2 10.230 -27.372 -5.641 20 HE3 MET 2 2HE MET 2 10.813 -28.155 -4.174 21 H GLU 3 H GLU 3 7.520 -26.503 0.109 22 HA GLU 3 HA GLU 3 5.187 -24.705 -0.426 23 HB2 GLU 3 2HB GLU 3 4.702 -25.195 1.991 24 HB3 GLU 3 1HB GLU 3 4.701 -26.641 0.976 25 HG2 GLU 3 2HG GLU 3 6.903 -27.254 1.709 26 HG3 GLU 3 1HG GLU 3 7.145 -25.686 2.487 27 H GLU 4 H GLU 4 8.427 -24.742 0.506 28 HA GLU 4 HA GLU 4 8.388 -22.615 2.431 29 HB2 GLU 4 2HB GLU 4 10.190 -24.332 2.074 30 HB3 GLU 4 1HB GLU 4 10.613 -23.503 0.574 31 HG2 GLU 4 2HG GLU 4 11.452 -21.638 1.678 32 HG3 GLU 4 1HG GLU 4 10.456 -21.910 3.108 33 H TYR 5 H TYR 5 7.707 -22.589 -0.825 34 HA TYR 5 HA TYR 5 8.960 -20.085 -1.593 35 HB2 TYR 5 2HB TYR 5 7.241 -22.168 -2.710 36 HB3 TYR 5 1HB TYR 5 6.790 -20.557 -3.269 37 HD1 TYR 5 1HD TYR 5 9.778 -22.767 -2.796 38 HD2 TYR 5 2HD TYR 5 7.998 -19.538 -5.001 39 HE1 TYR 5 1HE TYR 5 11.710 -22.762 -4.351 40 HE2 TYR 5 2HE TYR 5 9.931 -19.534 -6.556 41 HH TYR 5 HH TYR 5 12.015 -20.314 -6.897 42 H LEU 6 H LEU 6 5.900 -21.075 -0.290 43 HA LEU 6 HA LEU 6 4.745 -18.360 -0.448 44 HB2 LEU 6 2HB LEU 6 2.754 -19.472 0.354 45 HB3 LEU 6 1HB LEU 6 3.502 -20.544 -0.828 46 HG LEU 6 HG LEU 6 4.752 -21.314 1.492 47 HD11 LEU 6 1HD1 LEU 6 1.941 -21.308 2.401 48 HD12 LEU 6 2HD1 LEU 6 2.732 -19.733 2.433 49 HD13 LEU 6 3HD1 LEU 6 3.424 -21.086 3.328 50 HD21 LEU 6 3HD2 LEU 6 2.109 -22.465 0.576 51 HD22 LEU 6 1HD2 LEU 6 3.484 -23.324 1.268 52 HD23 LEU 6 2HD2 LEU 6 3.590 -22.655 -0.360 53 H GLY 7 H GLY 7 6.361 -20.449 1.852 54 HA2 GLY 7 2HA GLY 7 5.524 -19.118 4.258 55 HA3 GLY 7 1HA GLY 7 6.979 -20.103 4.092 56 H VAL 8 H VAL 8 8.150 -18.558 1.949 57 HA VAL 8 HA VAL 8 9.222 -16.334 3.558 58 HB VAL 8 HB VAL 8 9.920 -17.724 0.977 59 HG11 VAL 8 1HG1 VAL 8 11.779 -16.187 0.668 60 HG12 VAL 8 2HG1 VAL 8 11.337 -15.304 2.130 61 HG13 VAL 8 3HG1 VAL 8 10.280 -15.257 0.719 62 HG21 VAL 8 3HG2 VAL 8 11.525 -17.238 3.503 63 HG22 VAL 8 1HG2 VAL 8 11.934 -18.328 2.178 64 HG23 VAL 8 2HG2 VAL 8 10.557 -18.684 3.221 65 H PHE 9 H PHE 9 7.099 -16.871 0.908 66 HA PHE 9 HA PHE 9 7.186 -14.222 -0.257 67 HB2 PHE 9 2HB PHE 9 5.887 -16.742 -0.637 68 HB3 PHE 9 1HB PHE 9 4.639 -15.496 -0.582 69 HD1 PHE 9 1HD PHE 9 5.618 -13.175 -1.794 70 HD2 PHE 9 2HD PHE 9 6.568 -17.240 -2.808 71 HE1 PHE 9 1HE PHE 9 6.221 -12.461 -4.092 72 HE2 PHE 9 2HE PHE 9 7.171 -16.526 -5.105 73 HZ PHE 9 HZ PHE 9 6.997 -14.137 -5.747 74 H VAL 10 H VAL 10 5.470 -15.695 2.433 75 HA VAL 10 HA VAL 10 3.647 -13.403 2.767 76 HB VAL 10 HB VAL 10 4.229 -15.932 4.342 77 HG11 VAL 10 1HG1 VAL 10 1.853 -14.106 4.719 78 HG12 VAL 10 2HG1 VAL 10 3.331 -13.902 5.661 79 HG13 VAL 10 3HG1 VAL 10 2.414 -15.405 5.773 80 HG21 VAL 10 3HG2 VAL 10 3.154 -16.520 2.314 81 HG22 VAL 10 1HG2 VAL 10 2.129 -15.086 2.344 82 HG23 VAL 10 2HG2 VAL 10 1.833 -16.404 3.477 83 H ASP 11 H ASP 11 6.526 -14.782 4.376 84 HA ASP 11 HA ASP 11 6.601 -12.927 6.557 85 HB2 ASP 11 2HB ASP 11 7.867 -15.157 6.099 86 HB3 ASP 11 1HB ASP 11 9.013 -14.144 5.221 87 H GLU 12 H GLU 12 7.267 -12.615 3.238 88 HA GLU 12 HA GLU 12 8.978 -10.219 3.530 89 HB2 GLU 12 2HB GLU 12 7.945 -11.960 1.298 90 HB3 GLU 12 1HB GLU 12 8.655 -10.388 0.932 91 HG2 GLU 12 2HG GLU 12 10.532 -11.327 2.627 92 HG3 GLU 12 1HG GLU 12 9.952 -12.856 1.965 93 H THR 13 H THR 13 5.704 -11.102 2.419 94 HA THR 13 HA THR 13 4.918 -8.472 1.583 95 HB THR 13 HB THR 13 3.881 -10.824 1.179 96 HG1 THR 13 1HG THR 13 1.948 -9.846 0.754 97 HG21 THR 13 3HG2 THR 13 1.963 -10.285 3.341 98 HG22 THR 13 1HG2 THR 13 3.560 -10.769 3.910 99 HG23 THR 13 2HG2 THR 13 2.661 -11.815 2.812 100 H LYS 14 H LYS 14 5.172 -10.000 4.713 101 HA LYS 14 HA LYS 14 3.494 -8.023 6.095 102 HB2 LYS 14 2HB LYS 14 5.174 -10.419 6.757 103 HB3 LYS 14 1HB LYS 14 4.756 -9.305 8.061 104 HG2 LYS 14 2HG LYS 14 2.709 -10.226 8.183 105 HG3 LYS 14 1HG LYS 14 2.400 -9.743 6.515 106 HD2 LYS 14 2HD LYS 14 2.697 -11.848 5.744 107 HD3 LYS 14 1HD LYS 14 4.159 -12.075 6.704 108 HE2 LYS 14 2HE LYS 14 1.689 -11.993 8.317 109 HE3 LYS 14 1HE LYS 14 1.784 -13.369 7.199 110 HZ1 LYS 14 3HZ LYS 14 3.706 -14.131 8.140 111 HZ2 LYS 14 1HZ LYS 14 2.982 -13.454 9.515 112 HZ3 LYS 14 2HZ LYS 14 4.192 -12.597 8.685 113 H GLU 15 H GLU 15 6.991 -8.783 5.890 114 HA GLU 15 HA GLU 15 7.862 -6.601 7.528 115 HB2 GLU 15 2HB GLU 15 9.138 -8.214 5.304 116 HB3 GLU 15 1HB GLU 15 10.039 -7.063 6.292 117 HG2 GLU 15 2HG GLU 15 9.134 -8.347 8.325 118 HG3 GLU 15 1HG GLU 15 8.667 -9.603 7.177 119 H TYR 16 H TYR 16 6.517 -6.704 4.433 120 HA TYR 16 HA TYR 16 7.762 -4.208 3.480 121 HB2 TYR 16 2HB TYR 16 6.172 -6.461 2.427 122 HB3 TYR 16 1HB TYR 16 5.762 -4.899 1.719 123 HD1 TYR 16 2HD TYR 16 9.116 -5.612 3.059 124 HD2 TYR 16 1HD TYR 16 6.686 -5.437 -0.479 125 HE1 TYR 16 2HE TYR 16 11.156 -5.713 1.652 126 HE2 TYR 16 1HE TYR 16 8.726 -5.538 -1.885 127 HH TYR 16 HH TYR 16 11.507 -4.789 -1.144 128 H LEU 17 H LEU 17 4.533 -5.402 4.471 129 HA LEU 17 HA LEU 17 3.101 -2.973 4.060 130 HB2 LEU 17 2HB LEU 17 2.826 -5.232 6.070 131 HB3 LEU 17 1HB LEU 17 1.599 -3.986 5.837 132 HG LEU 17 HG LEU 17 2.658 -5.698 3.587 133 HD11 LEU 17 1HD1 LEU 17 1.330 -6.812 5.610 134 HD12 LEU 17 2HD1 LEU 17 0.982 -7.261 3.939 135 HD13 LEU 17 3HD1 LEU 17 -0.056 -6.109 4.778 136 HD21 LEU 17 3HD2 LEU 17 0.287 -4.927 2.731 137 HD22 LEU 17 1HD2 LEU 17 1.654 -3.817 2.632 138 HD23 LEU 17 2HD2 LEU 17 0.482 -3.656 3.939 139 H GLN 18 H GLN 18 5.069 -4.141 6.741 140 HA GLN 18 HA GLN 18 4.540 -1.920 8.507 141 HB2 GLN 18 2HB GLN 18 5.579 -3.414 9.832 142 HB3 GLN 18 1HB GLN 18 5.946 -4.386 8.416 143 HG2 GLN 18 2HG GLN 18 8.055 -3.338 8.107 144 HG3 GLN 18 1HG GLN 18 7.646 -2.017 9.202 145 HE21 GLN 18 1HE2 GLN 18 7.020 -2.927 11.550 146 HE22 GLN 18 2HE2 GLN 18 8.071 -4.114 12.156 147 H ASN 19 H ASN 19 7.151 -2.789 6.347 148 HA ASN 19 HA ASN 19 8.659 -0.374 6.570 149 HB2 ASN 19 2HB ASN 19 8.511 -2.789 4.937 150 HB3 ASN 19 1HB ASN 19 8.902 -1.378 3.949 151 HD21 ASN 19 1HD2 ASN 19 11.156 -1.681 3.659 152 HD22 ASN 19 2HD2 ASN 19 12.265 -1.766 4.942 153 H LEU 20 H LEU 20 5.771 -1.312 4.984 154 HA LEU 20 HA LEU 20 5.618 1.130 3.329 155 HB2 LEU 20 2HB LEU 20 4.887 -0.822 2.214 156 HB3 LEU 20 1HB LEU 20 4.060 -1.427 3.649 157 HG LEU 20 HG LEU 20 2.468 0.522 3.449 158 HD11 LEU 20 1HD1 LEU 20 2.391 1.697 1.287 159 HD12 LEU 20 2HD1 LEU 20 3.815 0.808 0.745 160 HD13 LEU 20 3HD1 LEU 20 3.946 1.957 2.077 161 HD21 LEU 20 3HD2 LEU 20 1.960 -1.775 2.600 162 HD22 LEU 20 1HD2 LEU 20 2.599 -1.299 1.026 163 HD23 LEU 20 2HD2 LEU 20 1.158 -0.510 1.669 164 H ASN 21 H ASN 21 4.777 0.100 6.445 165 HA ASN 21 HA ASN 21 2.495 1.961 6.667 166 HB2 ASN 21 2HB ASN 21 3.701 -0.284 8.212 167 HB3 ASN 21 1HB ASN 21 2.924 0.995 9.150 168 HD21 ASN 21 1HD2 ASN 21 1.868 -1.718 8.940 169 HD22 ASN 21 2HD2 ASN 21 0.371 -1.618 8.147 170 H ASP 22 H ASP 22 5.778 1.385 7.513 171 HA ASP 22 HA ASP 22 6.068 3.630 9.240 172 HB2 ASP 22 2HB ASP 22 7.609 1.439 8.274 173 HB3 ASP 22 1HB ASP 22 8.530 2.912 7.966 174 H THR 23 H THR 23 6.212 3.006 5.902 175 HA THR 23 HA THR 23 7.377 5.529 5.014 176 HB THR 23 HB THR 23 5.712 3.342 3.763 177 HG1 THR 23 1HG THR 23 7.609 2.452 4.254 178 HG21 THR 23 3HG2 THR 23 7.476 5.254 2.244 179 HG22 THR 23 1HG2 THR 23 5.799 5.663 2.601 180 HG23 THR 23 2HG2 THR 23 6.172 4.237 1.633 181 H LEU 24 H LEU 24 4.143 4.084 5.298 182 HA LEU 24 HA LEU 24 2.746 6.445 4.301 183 HB2 LEU 24 2HB LEU 24 2.092 3.769 5.510 184 HB3 LEU 24 1HB LEU 24 0.827 4.994 5.431 185 HG LEU 24 HG LEU 24 2.486 4.262 3.014 186 HD11 LEU 24 1HD1 LEU 24 0.435 2.692 4.365 187 HD12 LEU 24 2HD1 LEU 24 1.464 2.248 3.002 188 HD13 LEU 24 3HD1 LEU 24 -0.047 3.113 2.721 189 HD21 LEU 24 3HD2 LEU 24 -0.354 5.188 2.948 190 HD22 LEU 24 1HD2 LEU 24 0.967 5.543 1.835 191 HD23 LEU 24 2HD2 LEU 24 0.876 6.373 3.388 192 H LEU 25 H LEU 25 3.802 5.122 7.380 193 HA LEU 25 HA LEU 25 2.166 6.950 8.989 194 HB2 LEU 25 2HB LEU 25 4.467 5.069 9.498 195 HB3 LEU 25 1HB LEU 25 3.749 6.041 10.790 196 HG LEU 25 HG LEU 25 2.069 4.377 8.945 197 HD11 LEU 25 1HD1 LEU 25 3.602 3.551 11.398 198 HD12 LEU 25 2HD1 LEU 25 3.393 2.686 9.875 199 HD13 LEU 25 3HD1 LEU 25 2.058 2.782 11.024 200 HD21 LEU 25 3HD2 LEU 25 0.367 4.755 10.526 201 HD22 LEU 25 1HD2 LEU 25 1.241 6.289 10.516 202 HD23 LEU 25 2HD2 LEU 25 1.517 5.122 11.812 203 H GLU 26 H GLU 26 5.087 7.130 7.312 204 HA GLU 26 HA GLU 26 6.020 9.494 8.830 205 HB2 GLU 26 2HB GLU 26 7.129 7.772 6.591 206 HB3 GLU 26 1HB GLU 26 7.924 9.261 7.106 207 HG2 GLU 26 2HG GLU 26 8.289 8.404 9.316 208 HG3 GLU 26 1HG GLU 26 7.242 7.015 9.017 209 H LEU 27 H LEU 27 4.446 8.360 6.040 210 HA LEU 27 HA LEU 27 4.551 10.708 4.458 211 HB2 LEU 27 2HB LEU 27 4.102 8.499 3.539 212 HB3 LEU 27 1HB LEU 27 2.700 8.319 4.591 213 HG LEU 27 HG LEU 27 1.716 10.352 3.454 214 HD11 LEU 27 1HD1 LEU 27 3.874 9.791 1.401 215 HD12 LEU 27 2HD1 LEU 27 3.948 11.125 2.554 216 HD13 LEU 27 3HD1 LEU 27 2.661 11.070 1.349 217 HD21 LEU 27 3HD2 LEU 27 1.264 9.021 1.283 218 HD22 LEU 27 1HD2 LEU 27 0.823 8.252 2.808 219 HD23 LEU 27 2HD2 LEU 27 2.308 7.784 1.981 220 H GLU 28 H GLU 28 2.529 9.541 7.068 221 HA GLU 28 HA GLU 28 0.338 11.396 6.740 222 HB2 GLU 28 2HB GLU 28 1.482 10.050 9.219 223 HB3 GLU 28 1HB GLU 28 -0.142 10.716 9.070 224 HG2 GLU 28 2HG GLU 28 0.019 9.008 6.898 225 HG3 GLU 28 1HG GLU 28 0.907 8.143 8.152 226 H LYS 29 H LYS 29 3.404 11.408 8.546 227 HA LYS 29 HA LYS 29 2.939 14.030 9.719 228 HB2 LYS 29 2HB LYS 29 4.608 13.284 11.040 229 HB3 LYS 29 1HB LYS 29 4.590 11.809 10.084 230 HG2 LYS 29 2HG LYS 29 6.116 13.347 8.469 231 HG3 LYS 29 1HG LYS 29 6.515 14.069 10.031 232 HD2 LYS 29 2HD LYS 29 6.583 11.121 9.411 233 HD3 LYS 29 1HD LYS 29 8.003 12.166 9.436 234 HE2 LYS 29 2HE LYS 29 6.145 11.875 11.819 235 HE3 LYS 29 1HE LYS 29 7.593 10.872 11.598 236 HZ1 LYS 29 3HZ LYS 29 8.772 13.076 11.172 237 HZ2 LYS 29 1HZ LYS 29 8.363 12.716 12.778 238 HZ3 LYS 29 2HZ LYS 29 7.417 13.811 11.887 239 H ASN 30 H ASN 30 4.129 12.765 6.818 240 HA ASN 30 HA ASN 30 4.531 15.462 5.706 241 HB2 ASN 30 2HB ASN 30 6.679 13.698 6.549 242 HB3 ASN 30 1HB ASN 30 6.755 13.947 4.805 243 HD21 ASN 30 1HD2 ASN 30 8.615 15.062 6.851 244 HD22 ASN 30 2HD2 ASN 30 8.518 16.751 6.699 245 HA PRO 31 HA PRO 31 2.588 12.479 2.953 246 HB2 PRO 31 2HB PRO 31 0.224 13.798 2.772 247 HB3 PRO 31 1HB PRO 31 0.625 12.699 4.100 248 HG2 PRO 31 2HG PRO 31 0.435 15.620 4.098 249 HG3 PRO 31 1HG PRO 31 0.254 14.468 5.427 250 HD2 PRO 31 2HD PRO 31 2.529 16.040 4.791 251 HD3 PRO 31 1HD PRO 31 2.372 14.808 6.065 252 H GLU 32 H GLU 32 4.193 15.145 2.529 253 HA GLU 32 HA GLU 32 3.272 15.523 -0.284 254 HB2 GLU 32 2HB GLU 32 4.201 18.027 0.730 255 HB3 GLU 32 1HB GLU 32 2.573 17.621 0.196 256 HG2 GLU 32 2HG GLU 32 1.896 16.990 2.389 257 HG3 GLU 32 1HG GLU 32 3.565 16.932 2.966 258 H ASP 33 H ASP 33 5.703 14.641 1.706 259 HA ASP 33 HA ASP 33 7.980 16.058 0.755 260 HB2 ASP 33 2HB ASP 33 9.140 13.920 1.567 261 HB3 ASP 33 1HB ASP 33 8.132 14.756 2.749 262 H MET 34 H MET 34 5.978 13.760 -0.711 263 HA MET 34 HA MET 34 5.998 12.788 -2.848 264 HB2 MET 34 2HB MET 34 7.797 15.101 -2.907 265 HB3 MET 34 1HB MET 34 8.257 13.865 -4.080 266 HG2 MET 34 2HG MET 34 5.361 14.533 -3.874 267 HG3 MET 34 1HG MET 34 6.410 15.730 -4.633 268 HE1 MET 34 3HE MET 34 4.605 13.851 -7.564 269 HE2 MET 34 1HE MET 34 4.922 15.419 -6.806 270 HE3 MET 34 2HE MET 34 3.983 14.196 -5.953 271 H GLU 35 H GLU 35 8.173 12.241 -0.482 272 HA GLU 35 HA GLU 35 9.758 10.296 -2.079 273 HB2 GLU 35 2HB GLU 35 11.357 10.439 -0.297 274 HB3 GLU 35 1HB GLU 35 10.793 12.093 -0.520 275 HG2 GLU 35 2HG GLU 35 9.202 11.823 1.330 276 HG3 GLU 35 1HG GLU 35 9.718 10.150 1.544 277 H LEU 36 H LEU 36 7.738 10.733 0.783 278 HA LEU 36 HA LEU 36 7.564 7.863 1.349 279 HB2 LEU 36 2HB LEU 36 5.853 10.231 2.203 280 HB3 LEU 36 1HB LEU 36 5.850 8.637 2.958 281 HG LEU 36 HG LEU 36 8.084 10.660 2.915 282 HD11 LEU 36 1HD1 LEU 36 6.662 9.179 5.133 283 HD12 LEU 36 2HD1 LEU 36 6.400 10.866 4.695 284 HD13 LEU 36 3HD1 LEU 36 7.953 10.358 5.355 285 HD21 LEU 36 3HD2 LEU 36 9.063 8.478 2.386 286 HD22 LEU 36 1HD2 LEU 36 8.179 7.737 3.720 287 HD23 LEU 36 2HD2 LEU 36 9.454 8.910 4.050 288 H ILE 37 H ILE 37 6.048 10.171 -0.752 289 HA ILE 37 HA ILE 37 3.585 8.670 -1.203 290 HB ILE 37 HB ILE 37 5.057 10.957 -2.528 291 HG12 ILE 37 2HG1 ILE 37 2.433 10.720 -1.020 292 HG13 ILE 37 1HG1 ILE 37 3.921 11.448 -0.414 293 HG21 ILE 37 1HG2 ILE 37 3.970 9.900 -4.367 294 HG22 ILE 37 2HG2 ILE 37 2.888 11.201 -3.871 295 HG23 ILE 37 3HG2 ILE 37 2.537 9.536 -3.405 296 HD11 ILE 37 3HD1 ILE 37 2.458 12.421 -2.881 297 HD12 ILE 37 1HD1 ILE 37 3.818 13.203 -2.074 298 HD13 ILE 37 2HD1 ILE 37 2.247 13.121 -1.276 299 H ASN 38 H ASN 38 6.816 8.873 -2.668 300 HA ASN 38 HA ASN 38 6.024 7.016 -4.828 301 HB2 ASN 38 2HB ASN 38 7.672 9.123 -4.792 302 HB3 ASN 38 1HB ASN 38 8.837 7.888 -4.315 303 HD21 ASN 38 1HD2 ASN 38 9.848 8.342 -6.510 304 HD22 ASN 38 2HD2 ASN 38 9.194 7.574 -7.875 305 H GLU 39 H GLU 39 7.505 6.989 -1.742 306 HA GLU 39 HA GLU 39 8.876 4.430 -2.046 307 HB2 GLU 39 2HB GLU 39 8.162 6.288 0.222 308 HB3 GLU 39 1HB GLU 39 8.913 4.723 0.536 309 HG2 GLU 39 2HG GLU 39 10.294 6.127 -1.598 310 HG3 GLU 39 1HG GLU 39 10.238 7.103 -0.130 311 H ALA 40 H ALA 40 5.755 5.570 -1.247 312 HA ALA 40 HA ALA 40 4.833 2.994 -0.124 313 HB1 ALA 40 1HB ALA 40 4.176 5.279 0.738 314 HB2 ALA 40 2HB ALA 40 2.804 4.257 0.312 315 HB3 ALA 40 3HB ALA 40 3.321 5.543 -0.780 316 H PHE 41 H PHE 41 4.121 5.123 -2.934 317 HA PHE 41 HA PHE 41 2.233 3.526 -4.269 318 HB2 PHE 41 2HB PHE 41 2.738 5.677 -5.125 319 HB3 PHE 41 1HB PHE 41 4.472 5.358 -5.137 320 HD1 PHE 41 1HD PHE 41 5.435 3.756 -6.814 321 HD2 PHE 41 2HD PHE 41 1.349 5.071 -6.979 322 HE1 PHE 41 1HE PHE 41 5.283 2.989 -9.168 323 HE2 PHE 41 2HE PHE 41 1.197 4.304 -9.332 324 HZ PHE 41 HZ PHE 41 3.164 3.262 -10.426 325 H ARG 42 H ARG 42 5.743 3.158 -4.040 326 HA ARG 42 HA ARG 42 5.927 1.035 -6.030 327 HB2 ARG 42 2HB ARG 42 7.724 2.088 -3.824 328 HB3 ARG 42 1HB ARG 42 8.229 0.841 -4.966 329 HG2 ARG 42 2HG ARG 42 7.776 2.378 -6.845 330 HG3 ARG 42 1HG ARG 42 7.284 3.628 -5.702 331 HD2 ARG 42 2HD ARG 42 9.485 4.262 -5.825 332 HD3 ARG 42 1HD ARG 42 9.747 2.911 -4.703 333 HE ARG 42 HE ARG 42 9.671 2.196 -7.565 334 HH11 ARG 42 1HH2 ARG 42 11.870 3.915 -5.774 335 HH12 ARG 42 2HH2 ARG 42 13.161 2.767 -5.895 336 HH21 ARG 42 1HH1 ARG 42 11.182 0.287 -7.292 337 HH22 ARG 42 2HH1 ARG 42 12.772 0.713 -6.754 338 H ALA 43 H ALA 43 6.542 0.956 -2.492 339 HA ALA 43 HA ALA 43 6.589 -1.763 -2.017 340 HB1 ALA 43 1HB ALA 43 6.877 -0.103 -0.277 341 HB2 ALA 43 2HB ALA 43 5.528 -1.136 0.196 342 HB3 ALA 43 3HB ALA 43 5.220 0.464 -0.480 343 H LEU 44 H LEU 44 3.579 0.193 -2.079 344 HA LEU 44 HA LEU 44 1.817 -2.071 -1.866 345 HB2 LEU 44 2HB LEU 44 1.600 0.797 -2.791 346 HB3 LEU 44 1HB LEU 44 0.201 -0.280 -2.834 347 HG LEU 44 HG LEU 44 1.872 0.102 -0.348 348 HD11 LEU 44 1HD1 LEU 44 -0.312 1.779 -1.502 349 HD12 LEU 44 2HD1 LEU 44 1.066 2.258 -0.509 350 HD13 LEU 44 3HD1 LEU 44 -0.335 1.491 0.238 351 HD21 LEU 44 3HD2 LEU 44 -0.743 -1.192 -1.062 352 HD22 LEU 44 1HD2 LEU 44 -0.499 -0.579 0.574 353 HD23 LEU 44 2HD2 LEU 44 0.574 -1.820 -0.072 354 H HIS 45 H HIS 45 3.360 -0.426 -4.574 355 HA HIS 45 HA HIS 45 1.818 -1.778 -6.648 356 HB2 HIS 45 2HB HIS 45 2.884 0.367 -7.055 357 HB3 HIS 45 1HB HIS 45 4.451 -0.266 -6.551 358 HD1 HIS 45 1HD HIS 45 5.449 0.274 -8.925 359 HD2 HIS 45 2HD HIS 45 2.330 -2.492 -8.963 360 HE1 HIS 45 1HE HIS 45 5.483 -0.814 -11.212 361 H THR 46 H THR 46 4.739 -2.356 -4.811 362 HA THR 46 HA THR 46 5.592 -4.652 -6.437 363 HB THR 46 HB THR 46 6.534 -2.972 -4.181 364 HG1 THR 46 1HG THR 46 8.548 -3.783 -5.388 365 HG21 THR 46 3HG2 THR 46 8.273 -4.785 -3.606 366 HG22 THR 46 1HG2 THR 46 7.132 -5.927 -4.317 367 HG23 THR 46 2HG2 THR 46 6.660 -4.965 -2.915 368 H LEU 47 H LEU 47 3.943 -3.998 -3.362 369 HA LEU 47 HA LEU 47 3.830 -6.753 -2.474 370 HB2 LEU 47 2HB LEU 47 2.889 -4.081 -1.715 371 HB3 LEU 47 1HB LEU 47 1.716 -5.343 -1.331 372 HG LEU 47 HG LEU 47 4.647 -5.502 -0.593 373 HD11 LEU 47 1HD1 LEU 47 3.891 -3.708 0.720 374 HD12 LEU 47 2HD1 LEU 47 3.603 -5.099 1.766 375 HD13 LEU 47 3HD1 LEU 47 2.266 -4.379 0.868 376 HD21 LEU 47 3HD2 LEU 47 3.593 -7.181 1.074 377 HD22 LEU 47 1HD2 LEU 47 3.718 -7.682 -0.613 378 HD23 LEU 47 2HD2 LEU 47 2.174 -7.121 0.027 379 H LYS 48 H LYS 48 1.746 -4.642 -4.409 380 HA LYS 48 HA LYS 48 -0.552 -6.358 -4.554 381 HB2 LYS 48 2HB LYS 48 -0.674 -4.029 -5.136 382 HB3 LYS 48 1HB LYS 48 0.639 -4.189 -6.303 383 HG2 LYS 48 2HG LYS 48 -1.186 -6.063 -7.195 384 HG3 LYS 48 1HG LYS 48 -2.219 -4.755 -6.625 385 HD2 LYS 48 2HD LYS 48 -1.805 -3.993 -8.759 386 HD3 LYS 48 1HD LYS 48 -0.436 -3.264 -7.917 387 HE2 LYS 48 2HE LYS 48 1.091 -4.713 -8.860 388 HE3 LYS 48 1HE LYS 48 -0.077 -6.046 -8.947 389 HZ1 LYS 48 3HZ LYS 48 -0.628 -3.627 -10.501 390 HZ2 LYS 48 1HZ LYS 48 -1.015 -5.241 -10.846 391 HZ3 LYS 48 2HZ LYS 48 0.571 -4.680 -11.086 392 H GLY 49 H GLY 49 2.322 -5.969 -6.640 393 HA2 GLY 49 2HA GLY 49 1.565 -7.873 -8.628 394 HA3 GLY 49 1HA GLY 49 3.224 -7.385 -8.280 395 H MET 50 H MET 50 2.975 -8.236 -5.437 396 HA MET 50 HA MET 50 3.761 -11.028 -5.814 397 HB2 MET 50 2HB MET 50 3.456 -9.135 -3.472 398 HB3 MET 50 1HB MET 50 3.980 -10.805 -3.265 399 HG2 MET 50 2HG MET 50 5.711 -10.202 -5.147 400 HG3 MET 50 1HG MET 50 5.385 -8.542 -4.652 401 HE1 MET 50 3HE MET 50 4.633 -8.413 -2.206 402 HE2 MET 50 1HE MET 50 6.029 -8.234 -1.135 403 HE3 MET 50 2HE MET 50 5.002 -9.660 -1.018 404 H ALA 51 H ALA 51 0.838 -9.343 -5.028 405 HA ALA 51 HA ALA 51 -0.421 -11.684 -3.724 406 HB1 ALA 51 1HB ALA 51 -2.379 -9.984 -3.784 407 HB2 ALA 51 2HB ALA 51 -1.184 -8.839 -4.394 408 HB3 ALA 51 3HB ALA 51 -0.974 -9.565 -2.802 409 H GLY 52 H GLY 52 0.061 -10.493 -6.870 410 HA2 GLY 52 2HA GLY 52 -2.424 -11.664 -7.960 411 HA3 GLY 52 1HA GLY 52 -1.196 -10.796 -8.886 412 H THR 53 H THR 53 1.048 -12.219 -7.820 413 HA THR 53 HA THR 53 0.962 -14.596 -9.517 414 HB THR 53 HB THR 53 2.949 -13.082 -7.851 415 HG1 THR 53 1HG THR 53 2.541 -13.756 -10.543 416 HG21 THR 53 3HG2 THR 53 4.669 -14.793 -8.548 417 HG22 THR 53 1HG2 THR 53 3.333 -15.852 -9.005 418 HG23 THR 53 2HG2 THR 53 3.528 -15.354 -7.324 419 H MET 54 H MET 54 0.228 -13.876 -6.303 420 HA MET 54 HA MET 54 0.900 -16.530 -5.212 421 HB2 MET 54 2HB MET 54 0.695 -13.977 -4.206 422 HB3 MET 54 1HB MET 54 -0.826 -14.699 -3.681 423 HG2 MET 54 2HG MET 54 0.249 -15.835 -2.066 424 HG3 MET 54 1HG MET 54 1.277 -16.605 -3.274 425 HE1 MET 54 3HE MET 54 4.098 -14.307 -3.898 426 HE2 MET 54 1HE MET 54 2.932 -15.498 -4.490 427 HE3 MET 54 2HE MET 54 4.120 -15.953 -3.270 428 H GLY 55 H GLY 55 -1.451 -15.465 -7.206 429 HA2 GLY 55 2HA GLY 55 -3.433 -16.568 -7.877 430 HA3 GLY 55 1HA GLY 55 -3.238 -17.670 -6.513 431 H PHE 56 H PHE 56 -2.895 -14.573 -5.331 432 HA PHE 56 HA PHE 56 -5.814 -14.466 -4.620 433 HB2 PHE 56 2HB PHE 56 -3.276 -13.862 -3.081 434 HB3 PHE 56 1HB PHE 56 -4.872 -13.377 -2.505 435 HD1 PHE 56 2HD PHE 56 -6.577 -15.612 -3.313 436 HD2 PHE 56 1HD PHE 56 -2.595 -15.647 -1.704 437 HE1 PHE 56 2HE PHE 56 -6.954 -17.897 -2.430 438 HE2 PHE 56 1HE PHE 56 -2.972 -17.934 -0.820 439 HZ PHE 56 HZ PHE 56 -5.151 -19.059 -1.185 440 H SER 57 H SER 57 -5.390 -13.149 -6.880 441 HA SER 57 HA SER 57 -4.263 -10.530 -6.722 442 HB2 SER 57 2HB SER 57 -6.596 -11.181 -8.477 443 HB3 SER 57 1HB SER 57 -5.110 -10.327 -8.881 444 HG SER 57 HG SER 57 -4.576 -12.215 -9.664 445 H SER 58 H SER 58 -7.133 -11.836 -5.453 446 HA SER 58 HA SER 58 -8.863 -9.555 -5.423 447 HB2 SER 58 2HB SER 58 -8.494 -11.906 -3.535 448 HB3 SER 58 1HB SER 58 -9.861 -10.797 -3.465 449 HG SER 58 HG SER 58 -10.711 -11.959 -4.983 450 H MET 59 H MET 59 -6.272 -10.693 -3.322 451 HA MET 59 HA MET 59 -6.552 -8.439 -1.457 452 HB2 MET 59 2HB MET 59 -5.909 -10.690 -0.697 453 HB3 MET 59 1HB MET 59 -4.531 -10.681 -1.798 454 HG2 MET 59 2HG MET 59 -3.910 -8.457 -0.513 455 HG3 MET 59 1HG MET 59 -4.934 -9.144 0.748 456 HE1 MET 59 3HE MET 59 -2.504 -11.728 -1.591 457 HE2 MET 59 1HE MET 59 -1.202 -10.588 -1.223 458 HE3 MET 59 2HE MET 59 -2.704 -10.013 -1.943 459 H ALA 60 H ALA 60 -4.879 -9.259 -4.359 460 HA ALA 60 HA ALA 60 -2.722 -7.314 -4.049 461 HB1 ALA 60 1HB ALA 60 -3.638 -8.412 -6.683 462 HB2 ALA 60 2HB ALA 60 -3.031 -9.553 -5.482 463 HB3 ALA 60 3HB ALA 60 -1.999 -8.246 -6.057 464 H LYS 61 H LYS 61 -5.909 -7.448 -5.616 465 HA LYS 61 HA LYS 61 -5.657 -4.942 -7.035 466 HB2 LYS 61 2HB LYS 61 -8.027 -6.506 -5.941 467 HB3 LYS 61 1HB LYS 61 -8.172 -5.151 -7.062 468 HG2 LYS 61 2HG LYS 61 -7.471 -6.385 -8.840 469 HG3 LYS 61 1HG LYS 61 -6.254 -7.239 -7.887 470 HD2 LYS 61 2HD LYS 61 -7.856 -8.903 -8.440 471 HD3 LYS 61 1HD LYS 61 -8.227 -8.452 -6.774 472 HE2 LYS 61 2HE LYS 61 -10.351 -8.156 -7.559 473 HE3 LYS 61 1HE LYS 61 -9.720 -6.627 -8.201 474 HZ1 LYS 61 3HZ LYS 61 -8.988 -7.868 -10.191 475 HZ2 LYS 61 1HZ LYS 61 -10.674 -7.869 -10.004 476 HZ3 LYS 61 2HZ LYS 61 -9.775 -9.252 -9.596 477 H LEU 62 H LEU 62 -6.328 -5.890 -3.776 478 HA LEU 62 HA LEU 62 -7.472 -3.401 -2.854 479 HB2 LEU 62 2HB LEU 62 -7.788 -5.542 -1.721 480 HB3 LEU 62 1HB LEU 62 -6.042 -5.734 -1.535 481 HG LEU 62 HG LEU 62 -5.905 -4.025 0.068 482 HD11 LEU 62 1HD1 LEU 62 -8.388 -3.050 -1.244 483 HD12 LEU 62 2HD1 LEU 62 -7.000 -2.140 -0.647 484 HD13 LEU 62 3HD1 LEU 62 -8.228 -2.716 0.480 485 HD21 LEU 62 3HD2 LEU 62 -7.263 -6.128 0.730 486 HD22 LEU 62 1HD2 LEU 62 -8.673 -5.069 0.664 487 HD23 LEU 62 2HD2 LEU 62 -7.364 -4.726 1.796 488 H CYS 63 H CYS 63 -4.209 -4.762 -3.152 489 HA CYS 63 HA CYS 63 -2.888 -2.604 -1.703 490 HB2 CYS 63 2HB CYS 63 -2.243 -5.074 -3.178 491 HB3 CYS 63 1HB CYS 63 -1.009 -3.821 -3.315 492 HG CYS 63 HG CYS 63 -1.455 -5.486 -0.874 493 H HIS 64 H HIS 64 -3.478 -3.358 -5.158 494 HA HIS 64 HA HIS 64 -1.946 -1.185 -6.232 495 HB2 HIS 64 2HB HIS 64 -3.022 -3.250 -7.361 496 HB3 HIS 64 1HB HIS 64 -4.513 -2.310 -7.376 497 HD1 HIS 64 1HD HIS 64 -3.158 -3.060 -10.047 498 HD2 HIS 64 2HD HIS 64 -2.440 0.512 -8.018 499 HE1 HIS 64 1HE HIS 64 -2.302 -1.414 -11.772 500 H THR 65 H THR 65 -5.128 -1.411 -4.802 501 HA THR 65 HA THR 65 -6.144 1.120 -5.719 502 HB THR 65 HB THR 65 -6.848 -1.098 -3.971 503 HG1 THR 65 1HG THR 65 -8.181 -0.782 -5.591 504 HG21 THR 65 3HG2 THR 65 -7.268 1.683 -2.923 505 HG22 THR 65 1HG2 THR 65 -6.847 0.212 -2.048 506 HG23 THR 65 2HG2 THR 65 -8.493 0.448 -2.632 507 H LEU 66 H LEU 66 -4.375 0.087 -2.798 508 HA LEU 66 HA LEU 66 -4.357 2.604 -1.421 509 HB2 LEU 66 2HB LEU 66 -2.214 0.448 -1.523 510 HB3 LEU 66 1HB LEU 66 -2.502 1.585 -0.206 511 HG LEU 66 HG LEU 66 -4.307 -0.664 -1.115 512 HD11 LEU 66 1HD1 LEU 66 -3.890 -0.637 1.672 513 HD12 LEU 66 2HD1 LEU 66 -2.313 -0.325 0.948 514 HD13 LEU 66 3HD1 LEU 66 -3.214 -1.775 0.507 515 HD21 LEU 66 3HD2 LEU 66 -6.022 0.649 -0.448 516 HD22 LEU 66 1HD2 LEU 66 -4.923 1.866 0.198 517 HD23 LEU 66 2HD2 LEU 66 -5.383 0.478 1.184 518 H GLU 67 H GLU 67 -1.949 1.087 -3.573 519 HA GLU 67 HA GLU 67 -0.165 3.316 -3.730 520 HB2 GLU 67 2HB GLU 67 0.641 1.188 -4.353 521 HB3 GLU 67 1HB GLU 67 -0.776 0.845 -5.343 522 HG2 GLU 67 2HG GLU 67 0.917 3.175 -6.131 523 HG3 GLU 67 1HG GLU 67 1.566 1.563 -6.429 524 H ASN 68 H ASN 68 -3.235 2.735 -5.217 525 HA ASN 68 HA ASN 68 -2.890 4.318 -7.593 526 HB2 ASN 68 2HB ASN 68 -4.931 2.937 -6.109 527 HB3 ASN 68 1HB ASN 68 -5.526 4.528 -6.581 528 HD21 ASN 68 1HD2 ASN 68 -3.245 2.353 -8.322 529 HD22 ASN 68 2HD2 ASN 68 -4.193 2.236 -9.725 530 H ILE 69 H ILE 69 -4.061 5.033 -4.320 531 HA ILE 69 HA ILE 69 -4.555 7.824 -4.772 532 HB ILE 69 HB ILE 69 -4.076 6.031 -2.408 533 HG12 ILE 69 2HG1 ILE 69 -6.482 6.724 -2.029 534 HG13 ILE 69 1HG1 ILE 69 -6.407 7.522 -3.597 535 HG21 ILE 69 1HG2 ILE 69 -5.187 8.511 -1.551 536 HG22 ILE 69 2HG2 ILE 69 -3.730 8.886 -2.467 537 HG23 ILE 69 3HG2 ILE 69 -3.641 7.806 -1.081 538 HD11 ILE 69 3HD1 ILE 69 -7.332 5.149 -3.615 539 HD12 ILE 69 1HD1 ILE 69 -5.698 4.617 -3.225 540 HD13 ILE 69 2HD1 ILE 69 -6.012 5.471 -4.736 541 H LEU 70 H LEU 70 -1.871 5.932 -3.825 542 HA LEU 70 HA LEU 70 -0.115 8.200 -3.274 543 HB2 LEU 70 2HB LEU 70 0.614 5.322 -3.893 544 HB3 LEU 70 1HB LEU 70 1.560 6.482 -2.958 545 HG LEU 70 HG LEU 70 -1.050 5.176 -2.191 546 HD11 LEU 70 1HD1 LEU 70 1.632 4.562 -1.687 547 HD12 LEU 70 2HD1 LEU 70 0.228 3.905 -0.847 548 HD13 LEU 70 3HD1 LEU 70 1.055 5.323 -0.204 549 HD21 LEU 70 3HD2 LEU 70 0.034 7.801 -1.444 550 HD22 LEU 70 1HD2 LEU 70 -0.309 6.764 -0.058 551 HD23 LEU 70 2HD2 LEU 70 -1.588 7.149 -1.210 552 H ASP 71 H ASP 71 -1.397 6.705 -6.005 553 HA ASP 71 HA ASP 71 0.871 7.299 -7.771 554 HB2 ASP 71 2HB ASP 71 -0.852 5.405 -8.014 555 HB3 ASP 71 1HB ASP 71 -2.007 6.651 -8.486 556 H LYS 72 H LYS 72 -2.502 8.526 -7.318 557 HA LYS 72 HA LYS 72 -2.112 10.803 -9.013 558 HB2 LYS 72 2HB LYS 72 -3.849 10.124 -6.667 559 HB3 LYS 72 1HB LYS 72 -4.118 11.544 -7.673 560 HG2 LYS 72 2HG LYS 72 -4.659 10.274 -9.549 561 HG3 LYS 72 1HG LYS 72 -3.797 8.855 -8.951 562 HD2 LYS 72 2HD LYS 72 -6.398 9.970 -7.937 563 HD3 LYS 72 1HD LYS 72 -6.136 8.427 -8.740 564 HE2 LYS 72 2HE LYS 72 -4.388 8.349 -6.584 565 HE3 LYS 72 1HE LYS 72 -5.863 9.085 -5.929 566 HZ1 LYS 72 3HZ LYS 72 -7.133 7.293 -6.486 567 HZ2 LYS 72 1HZ LYS 72 -5.668 6.495 -6.197 568 HZ3 LYS 72 2HZ LYS 72 -6.142 6.838 -7.788 569 H ALA 73 H ALA 73 -1.432 10.112 -5.677 570 HA ALA 73 HA ALA 73 -0.903 12.721 -4.691 571 HB1 ALA 73 1HB ALA 73 -1.030 10.869 -3.194 572 HB2 ALA 73 2HB ALA 73 0.672 11.332 -3.179 573 HB3 ALA 73 3HB ALA 73 0.145 9.940 -4.131 574 H ARG 74 H ARG 74 1.005 10.408 -6.560 575 HA ARG 74 HA ARG 74 3.306 12.276 -6.641 576 HB2 ARG 74 2HB ARG 74 4.445 10.410 -7.715 577 HB3 ARG 74 1HB ARG 74 3.547 9.781 -6.334 578 HG2 ARG 74 2HG ARG 74 1.928 8.781 -7.673 579 HG3 ARG 74 1HG ARG 74 2.239 9.852 -9.037 580 HD2 ARG 74 2HD ARG 74 4.645 8.380 -8.400 581 HD3 ARG 74 1HD ARG 74 3.294 7.258 -8.657 582 HE ARG 74 HE ARG 74 2.983 9.102 -10.691 583 HH11 ARG 74 1HH1 ARG 74 4.202 6.157 -10.632 584 HH12 ARG 74 2HH1 ARG 74 5.542 6.409 -11.699 585 HH21 ARG 74 1HH2 ARG 74 5.307 9.867 -11.609 586 HH22 ARG 74 2HH2 ARG 74 6.169 8.508 -12.252 587 H ASN 75 H ASN 75 0.513 11.348 -8.429 588 HA ASN 75 HA ASN 75 1.462 12.379 -11.022 589 HB2 ASN 75 2HB ASN 75 -0.329 10.504 -10.302 590 HB3 ASN 75 1HB ASN 75 -1.417 11.891 -10.382 591 HD21 ASN 75 1HD2 ASN 75 -1.817 12.855 -12.474 592 HD22 ASN 75 2HD2 ASN 75 -1.289 12.132 -13.916 593 H SER 76 H SER 76 0.360 13.690 -8.133 594 HA SER 76 HA SER 76 -0.015 15.953 -7.577 595 HB2 SER 76 2HB SER 76 1.243 16.177 -9.881 596 HB3 SER 76 1HB SER 76 -0.354 16.602 -10.487 597 HG SER 76 HG SER 76 0.139 18.505 -9.734 598 H GLU 77 H GLU 77 -2.214 13.842 -8.216 599 HA GLU 77 HA GLU 77 -4.361 15.801 -8.866 600 HB2 GLU 77 2HB GLU 77 -4.695 12.817 -8.752 601 HB3 GLU 77 1HB GLU 77 -5.609 13.983 -9.696 602 HG2 GLU 77 2HG GLU 77 -2.949 14.301 -10.536 603 HG3 GLU 77 1HG GLU 77 -3.184 12.557 -10.409 604 H ILE 78 H ILE 78 -3.008 13.922 -6.332 605 HA ILE 78 HA ILE 78 -5.015 15.029 -4.462 606 HB ILE 78 HB ILE 78 -5.571 12.740 -3.606 607 HG12 ILE 78 2HG1 ILE 78 -5.051 11.044 -5.646 608 HG13 ILE 78 1HG1 ILE 78 -3.607 12.060 -5.700 609 HG21 ILE 78 1HG2 ILE 78 -6.897 14.034 -5.411 610 HG22 ILE 78 2HG2 ILE 78 -7.213 12.306 -5.255 611 HG23 ILE 78 3HG2 ILE 78 -6.181 12.898 -6.557 612 HD11 ILE 78 3HD1 ILE 78 -4.271 11.407 -2.964 613 HD12 ILE 78 1HD1 ILE 78 -2.783 11.077 -3.853 614 HD13 ILE 78 2HD1 ILE 78 -4.125 9.935 -3.925 615 H LYS 79 H LYS 79 -4.459 13.552 -2.239 616 HA LYS 79 HA LYS 79 -1.676 12.967 -1.827 617 HB2 LYS 79 2HB LYS 79 -1.497 15.070 -0.245 618 HB3 LYS 79 1HB LYS 79 -1.200 15.243 -1.970 619 HG2 LYS 79 2HG LYS 79 -2.663 17.038 -1.332 620 HG3 LYS 79 1HG LYS 79 -3.640 15.878 -2.229 621 HD2 LYS 79 2HD LYS 79 -4.823 16.606 -0.206 622 HD3 LYS 79 1HD LYS 79 -4.412 14.896 -0.092 623 HE2 LYS 79 2HE LYS 79 -3.367 15.351 1.868 624 HE3 LYS 79 1HE LYS 79 -2.186 16.310 0.955 625 HZ1 LYS 79 3HZ LYS 79 -3.780 17.396 2.760 626 HZ2 LYS 79 1HZ LYS 79 -4.803 17.515 1.413 627 HZ3 LYS 79 2HZ LYS 79 -3.267 18.239 1.377 628 H ILE 80 H ILE 80 -1.265 12.836 0.673 629 HA ILE 80 HA ILE 80 -3.466 11.309 1.809 630 HB ILE 80 HB ILE 80 -0.749 12.214 2.694 631 HG12 ILE 80 2HG1 ILE 80 -0.367 9.729 2.579 632 HG13 ILE 80 1HG1 ILE 80 -2.002 9.573 1.939 633 HG21 ILE 80 1HG2 ILE 80 -1.426 11.930 4.834 634 HG22 ILE 80 2HG2 ILE 80 -1.527 10.212 4.447 635 HG23 ILE 80 3HG2 ILE 80 -2.962 11.230 4.324 636 HD11 ILE 80 3HD1 ILE 80 0.030 11.408 0.668 637 HD12 ILE 80 1HD1 ILE 80 -1.470 10.790 -0.026 638 HD13 ILE 80 2HD1 ILE 80 -0.098 9.708 0.214 639 H THR 81 H THR 81 -5.150 12.653 2.155 640 HA THR 81 HA THR 81 -4.922 15.173 3.672 641 HB THR 81 HB THR 81 -7.388 15.173 3.273 642 HG1 THR 81 1HG THR 81 -8.153 13.218 3.194 643 HG21 THR 81 3HG2 THR 81 -7.275 15.434 0.903 644 HG22 THR 81 1HG2 THR 81 -5.936 14.292 0.776 645 HG23 THR 81 2HG2 THR 81 -5.680 15.873 1.515 646 H SER 82 H SER 82 -4.446 12.261 4.785 647 HA SER 82 HA SER 82 -4.643 11.362 6.979 648 HB2 SER 82 2HB SER 82 -5.413 14.048 7.208 649 HB3 SER 82 1HB SER 82 -6.737 13.142 7.934 650 HG SER 82 HG SER 82 -5.475 12.820 9.570 651 H ASP 83 H ASP 83 -7.093 11.841 4.706 652 HA ASP 83 HA ASP 83 -8.920 9.901 6.065 653 HB2 ASP 83 2HB ASP 83 -9.402 12.443 5.134 654 HB3 ASP 83 1HB ASP 83 -9.841 11.467 3.731 655 H LEU 84 H LEU 84 -7.551 10.935 2.925 656 HA LEU 84 HA LEU 84 -8.378 8.602 1.451 657 HB2 LEU 84 2HB LEU 84 -6.049 10.532 1.121 658 HB3 LEU 84 1HB LEU 84 -6.617 9.422 -0.126 659 HG LEU 84 HG LEU 84 -8.166 11.710 1.118 660 HD11 LEU 84 1HD1 LEU 84 -7.269 11.133 -1.724 661 HD12 LEU 84 2HD1 LEU 84 -6.558 12.336 -0.648 662 HD13 LEU 84 3HD1 LEU 84 -8.217 12.530 -1.212 663 HD21 LEU 84 3HD2 LEU 84 -9.982 11.000 -0.450 664 HD22 LEU 84 1HD2 LEU 84 -9.662 9.804 0.807 665 HD23 LEU 84 2HD2 LEU 84 -9.048 9.552 -0.827 666 H LEU 85 H LEU 85 -5.738 9.358 3.609 667 HA LEU 85 HA LEU 85 -4.213 6.929 2.947 668 HB2 LEU 85 2HB LEU 85 -2.567 8.103 3.995 669 HB3 LEU 85 1HB LEU 85 -3.706 9.442 4.027 670 HG LEU 85 HG LEU 85 -4.566 8.414 6.235 671 HD11 LEU 85 1HD1 LEU 85 -3.280 6.816 7.328 672 HD12 LEU 85 2HD1 LEU 85 -1.817 7.233 6.434 673 HD13 LEU 85 3HD1 LEU 85 -3.091 6.295 5.654 674 HD21 LEU 85 3HD2 LEU 85 -2.876 9.607 7.512 675 HD22 LEU 85 1HD2 LEU 85 -3.173 10.490 6.017 676 HD23 LEU 85 2HD2 LEU 85 -1.730 9.489 6.177 677 H ASP 86 H ASP 86 -6.428 8.076 5.474 678 HA ASP 86 HA ASP 86 -6.132 5.862 7.282 679 HB2 ASP 86 2HB ASP 86 -7.220 8.147 7.629 680 HB3 ASP 86 1HB ASP 86 -8.614 7.520 6.748 681 H LYS 87 H LYS 87 -7.850 6.249 4.261 682 HA LYS 87 HA LYS 87 -9.486 3.818 4.670 683 HB2 LYS 87 2HB LYS 87 -9.038 5.714 2.332 684 HB3 LYS 87 1HB LYS 87 -10.212 4.400 2.332 685 HG2 LYS 87 2HG LYS 87 -10.203 6.897 4.029 686 HG3 LYS 87 1HG LYS 87 -11.468 6.313 2.951 687 HD2 LYS 87 2HD LYS 87 -11.334 4.204 4.614 688 HD3 LYS 87 1HD LYS 87 -10.802 5.466 5.725 689 HE2 LYS 87 2HE LYS 87 -12.916 6.734 4.600 690 HE3 LYS 87 1HE LYS 87 -13.472 5.052 4.484 691 HZ1 LYS 87 3HZ LYS 87 -12.301 6.242 6.940 692 HZ2 LYS 87 1HZ LYS 87 -13.030 4.718 6.788 693 HZ3 LYS 87 2HZ LYS 87 -13.973 6.125 6.657 694 H ILE 88 H ILE 88 -6.695 4.958 2.821 695 HA ILE 88 HA ILE 88 -6.209 2.504 1.401 696 HB ILE 88 HB ILE 88 -4.576 4.901 2.248 697 HG12 ILE 88 2HG1 ILE 88 -5.119 4.059 -0.568 698 HG13 ILE 88 1HG1 ILE 88 -6.424 4.797 0.361 699 HG21 ILE 88 1HG2 ILE 88 -3.267 3.457 0.179 700 HG22 ILE 88 2HG2 ILE 88 -3.569 2.344 1.513 701 HG23 ILE 88 3HG2 ILE 88 -2.670 3.834 1.794 702 HD11 ILE 88 3HD1 ILE 88 -5.452 6.712 -0.481 703 HD12 ILE 88 1HD1 ILE 88 -3.846 5.988 -0.559 704 HD13 ILE 88 2HD1 ILE 88 -4.493 6.532 0.988 705 H PHE 89 H PHE 89 -5.311 3.783 4.570 706 HA PHE 89 HA PHE 89 -3.488 1.634 5.259 707 HB2 PHE 89 2HB PHE 89 -3.358 3.836 6.306 708 HB3 PHE 89 1HB PHE 89 -5.024 3.694 6.868 709 HD1 PHE 89 2HD PHE 89 -1.573 2.429 7.290 710 HD2 PHE 89 1HD PHE 89 -5.601 2.329 8.777 711 HE1 PHE 89 2HE PHE 89 -0.786 1.281 9.343 712 HE2 PHE 89 1HE PHE 89 -4.815 1.180 10.829 713 HZ PHE 89 HZ PHE 89 -2.407 0.657 11.113 714 H ALA 90 H ALA 90 -6.877 2.159 5.352 715 HA ALA 90 HA ALA 90 -7.543 0.010 7.212 716 HB1 ALA 90 1HB ALA 90 -9.094 1.591 5.126 717 HB2 ALA 90 2HB ALA 90 -9.051 1.901 6.862 718 HB3 ALA 90 3HB ALA 90 -9.844 0.452 6.244 719 H GLY 91 H GLY 91 -6.989 0.447 3.795 720 HA2 GLY 91 2HA GLY 91 -8.044 -2.106 2.929 721 HA3 GLY 91 1HA GLY 91 -6.927 -1.083 2.013 722 H VAL 92 H VAL 92 -4.811 -0.854 3.736 723 HA VAL 92 HA VAL 92 -3.377 -3.313 3.400 724 HB VAL 92 HB VAL 92 -3.042 -0.695 4.842 725 HG11 VAL 92 1HG1 VAL 92 -1.061 -2.989 5.020 726 HG12 VAL 92 2HG1 VAL 92 -2.097 -2.464 6.346 727 HG13 VAL 92 3HG1 VAL 92 -0.866 -1.377 5.704 728 HG21 VAL 92 3HG2 VAL 92 -0.801 -1.301 3.294 729 HG22 VAL 92 1HG2 VAL 92 -2.151 -0.277 2.808 730 HG23 VAL 92 2HG2 VAL 92 -2.145 -1.988 2.382 731 H ASP 93 H ASP 93 -5.471 -2.042 5.868 732 HA ASP 93 HA ASP 93 -4.654 -3.763 8.052 733 HB2 ASP 93 2HB ASP 93 -6.313 -1.561 7.617 734 HB3 ASP 93 1HB ASP 93 -7.446 -2.861 7.991 735 H MET 94 H MET 94 -7.165 -3.899 5.535 736 HA MET 94 HA MET 94 -8.239 -6.463 6.422 737 HB2 MET 94 2HB MET 94 -8.413 -4.931 3.800 738 HB3 MET 94 1HB MET 94 -9.448 -6.286 4.252 739 HG2 MET 94 2HG MET 94 -10.013 -4.881 6.357 740 HG3 MET 94 1HG MET 94 -9.339 -3.524 5.455 741 HE1 MET 94 3HE MET 94 -10.126 -5.179 2.585 742 HE2 MET 94 1HE MET 94 -9.944 -3.426 2.748 743 HE3 MET 94 2HE MET 94 -11.422 -4.103 2.069 744 H ILE 95 H ILE 95 -5.743 -5.279 4.312 745 HA ILE 95 HA ILE 95 -5.204 -7.676 2.814 746 HB ILE 95 HB ILE 95 -3.943 -5.058 3.499 747 HG12 ILE 95 2HG1 ILE 95 -4.029 -6.466 0.836 748 HG13 ILE 95 1HG1 ILE 95 -5.450 -5.650 1.487 749 HG21 ILE 95 1HG2 ILE 95 -1.902 -5.844 2.121 750 HG22 ILE 95 2HG2 ILE 95 -2.401 -7.471 2.584 751 HG23 ILE 95 3HG2 ILE 95 -1.976 -6.289 3.826 752 HD11 ILE 95 3HD1 ILE 95 -3.739 -4.331 -0.048 753 HD12 ILE 95 1HD1 ILE 95 -2.842 -4.178 1.463 754 HD13 ILE 95 2HD1 ILE 95 -4.484 -3.546 1.345 755 H THR 96 H THR 96 -4.065 -6.362 5.911 756 HA THR 96 HA THR 96 -2.140 -8.466 6.444 757 HB THR 96 HB THR 96 -3.586 -6.359 8.073 758 HG1 THR 96 1HG THR 96 -1.931 -5.226 7.499 759 HG21 THR 96 3HG2 THR 96 -1.536 -7.061 9.674 760 HG22 THR 96 1HG2 THR 96 -1.884 -8.632 8.951 761 HG23 THR 96 2HG2 THR 96 -3.146 -7.765 9.826 762 H ARG 97 H ARG 97 -5.528 -7.832 7.343 763 HA ARG 97 HA ARG 97 -5.898 -10.087 9.066 764 HB2 ARG 97 2HB ARG 97 -7.562 -8.197 7.457 765 HB3 ARG 97 1HB ARG 97 -8.349 -9.667 8.033 766 HG2 ARG 97 2HG ARG 97 -8.404 -8.915 10.162 767 HG3 ARG 97 1HG ARG 97 -6.712 -8.418 10.103 768 HD2 ARG 97 2HD ARG 97 -7.356 -6.255 9.923 769 HD3 ARG 97 1HD ARG 97 -8.247 -6.642 8.437 770 HE ARG 97 HE ARG 97 -10.196 -7.215 9.833 771 HH11 ARG 97 1HH1 ARG 97 -8.138 -4.782 10.851 772 HH12 ARG 97 2HH1 ARG 97 -8.758 -4.681 12.464 773 HH21 ARG 97 1HH2 ARG 97 -10.741 -7.509 12.161 774 HH22 ARG 97 2HH2 ARG 97 -10.232 -6.226 13.206 775 H MET 98 H MET 98 -6.119 -9.677 5.550 776 HA MET 98 HA MET 98 -7.190 -12.292 4.962 777 HB2 MET 98 2HB MET 98 -5.585 -10.203 3.453 778 HB3 MET 98 1HB MET 98 -6.170 -11.679 2.683 779 HG2 MET 98 2HG MET 98 -8.421 -11.063 2.928 780 HG3 MET 98 1HG MET 98 -8.063 -9.912 4.215 781 HE1 MET 98 3HE MET 98 -9.318 -10.139 0.857 782 HE2 MET 98 1HE MET 98 -7.722 -10.815 0.502 783 HE3 MET 98 2HE MET 98 -8.224 -9.297 -0.237 784 H VAL 99 H VAL 99 -3.961 -10.894 5.273 785 HA VAL 99 HA VAL 99 -2.479 -13.251 4.509 786 HB VAL 99 HB VAL 99 -1.982 -10.645 5.934 787 HG11 VAL 99 1HG1 VAL 99 0.062 -12.852 5.510 788 HG12 VAL 99 2HG1 VAL 99 -0.557 -12.317 7.072 789 HG13 VAL 99 3HG1 VAL 99 0.417 -11.225 6.088 790 HG21 VAL 99 3HG2 VAL 99 -0.727 -11.853 3.452 791 HG22 VAL 99 1HG2 VAL 99 -0.650 -10.171 3.978 792 HG23 VAL 99 2HG2 VAL 99 -2.177 -10.852 3.418 793 H ASP 100 H ASP 100 -3.804 -12.011 7.552 794 HA ASP 100 HA ASP 100 -2.422 -13.862 9.294 795 HB2 ASP 100 2HB ASP 100 -3.515 -11.675 9.914 796 HB3 ASP 100 1HB ASP 100 -5.083 -12.437 9.646 797 H LYS 101 H LYS 101 -5.427 -13.946 7.447 798 HA LYS 101 HA LYS 101 -6.175 -16.550 8.606 799 HB2 LYS 101 2HB LYS 101 -8.218 -15.779 8.062 800 HB3 LYS 101 1HB LYS 101 -7.463 -14.316 7.449 801 HG2 LYS 101 2HG LYS 101 -7.074 -16.057 5.354 802 HG3 LYS 101 1HG LYS 101 -8.634 -16.580 5.979 803 HD2 LYS 101 2HD LYS 101 -8.824 -13.851 6.069 804 HD3 LYS 101 1HD LYS 101 -7.875 -14.125 4.606 805 HE2 LYS 101 2HE LYS 101 -9.937 -14.466 3.642 806 HE3 LYS 101 1HE LYS 101 -9.787 -16.075 4.374 807 HZ1 LYS 101 3HZ LYS 101 -10.700 -13.899 6.092 808 HZ2 LYS 101 1HZ LYS 101 -11.136 -15.537 6.098 809 HZ3 LYS 101 2HZ LYS 101 -11.806 -14.486 4.944 810 H ILE 102 H ILE 102 -4.905 -15.103 5.654 811 HA ILE 102 HA ILE 102 -4.940 -17.419 3.978 812 HB ILE 102 HB ILE 102 -3.411 -14.837 4.190 813 HG12 ILE 102 2HG1 ILE 102 -5.158 -16.135 2.079 814 HG13 ILE 102 1HG1 ILE 102 -5.603 -14.800 3.140 815 HG21 ILE 102 1HG2 ILE 102 -2.586 -15.931 1.771 816 HG22 ILE 102 2HG2 ILE 102 -2.424 -17.270 2.905 817 HG23 ILE 102 3HG2 ILE 102 -1.590 -15.747 3.215 818 HD11 ILE 102 3HD1 ILE 102 -4.173 -14.722 0.625 819 HD12 ILE 102 1HD1 ILE 102 -3.212 -13.993 1.910 820 HD13 ILE 102 2HD1 ILE 102 -4.833 -13.387 1.569 821 H VAL 103 H VAL 103 -2.824 -16.173 6.451 822 HA VAL 103 HA VAL 103 -0.737 -18.204 6.127 823 HB VAL 103 HB VAL 103 -1.471 -15.990 8.039 824 HG11 VAL 103 1HG1 VAL 103 -0.579 -17.269 9.716 825 HG12 VAL 103 2HG1 VAL 103 0.952 -16.779 8.990 826 HG13 VAL 103 3HG1 VAL 103 0.249 -18.346 8.592 827 HG21 VAL 103 3HG2 VAL 103 0.917 -15.323 7.384 828 HG22 VAL 103 1HG2 VAL 103 -0.285 -15.272 6.094 829 HG23 VAL 103 2HG2 VAL 103 0.845 -16.624 6.195 830 H SER 104 H SER 104 -3.688 -17.732 7.942 831 HA SER 104 HA SER 104 -3.254 -20.009 9.733 832 HB2 SER 104 2HB SER 104 -4.487 -17.847 10.240 833 HB3 SER 104 1HB SER 104 -5.754 -18.414 9.153 834 HG SER 104 HG SER 104 -4.917 -19.426 11.644 835 H GLU 105 H GLU 105 -4.677 -19.414 6.671 836 HA GLU 105 HA GLU 105 -5.445 -22.279 6.438 837 HB2 GLU 105 2HB GLU 105 -7.367 -20.117 5.586 838 HB3 GLU 105 1HB GLU 105 -7.703 -21.806 5.959 839 HG2 GLU 105 2HG GLU 105 -6.959 -21.231 8.364 840 HG3 GLU 105 1HG GLU 105 -7.133 -19.545 7.874 841 H GLY 106 H GLY 106 -5.052 -19.107 4.872 842 HA2 GLY 106 2HA GLY 106 -3.634 -18.987 2.841 843 HA3 GLY 106 1HA GLY 106 -4.264 -20.569 2.383 844 H SER 107 H SER 107 -6.524 -18.306 3.728 845 HA SER 107 HA SER 107 -7.664 -17.887 0.977 846 HB2 SER 107 2HB SER 107 -9.035 -17.841 3.673 847 HB3 SER 107 1HB SER 107 -9.807 -17.859 2.091 848 HG SER 107 HG SER 107 -9.351 -19.937 1.880 849 H ASP 108 H ASP 108 -7.754 -15.820 0.283 850 HA ASP 108 HA ASP 108 -7.089 -13.629 2.196 851 HB2 ASP 108 2HB ASP 108 -6.581 -12.399 0.183 852 HB3 ASP 108 1HB ASP 108 -5.951 -14.026 -0.072 853 H ASP 109 H ASP 109 -9.761 -15.247 1.520 854 HA ASP 109 HA ASP 109 -11.556 -13.027 0.748 855 HB2 ASP 109 2HB ASP 109 -11.626 -15.972 1.100 856 HB3 ASP 109 1HB ASP 109 -13.149 -15.129 1.389 857 H ILE 110 H ILE 110 -11.301 -11.607 2.619 858 HA ILE 110 HA ILE 110 -12.336 -12.701 5.207 859 HB ILE 110 HB ILE 110 -11.324 -10.567 6.088 860 HG12 ILE 110 2HG1 ILE 110 -10.047 -10.260 3.379 861 HG13 ILE 110 1HG1 ILE 110 -11.602 -9.502 3.718 862 HG21 ILE 110 1HG2 ILE 110 -9.784 -12.680 4.642 863 HG22 ILE 110 2HG2 ILE 110 -9.802 -12.286 6.361 864 HG23 ILE 110 3HG2 ILE 110 -8.893 -11.280 5.234 865 HD11 ILE 110 3HD1 ILE 110 -10.675 -7.932 5.070 866 HD12 ILE 110 1HD1 ILE 110 -9.157 -8.379 4.292 867 HD13 ILE 110 2HD1 ILE 110 -9.602 -9.101 5.838 868 H GLY 111 H GLY 111 -14.079 -12.033 2.901 869 HA2 GLY 111 2HA GLY 111 -16.156 -10.973 2.607 870 HA3 GLY 111 1HA GLY 111 -16.049 -10.452 4.291 871 H GLU 112 H GLU 112 -13.297 -9.619 2.487 872 HA GLU 112 HA GLU 112 -13.571 -6.824 2.852 873 HB2 GLU 112 2HB GLU 112 -11.756 -6.818 1.037 874 HB3 GLU 112 1HB GLU 112 -11.436 -7.814 2.457 875 HG2 GLU 112 2HG GLU 112 -11.662 -9.775 1.303 876 HG3 GLU 112 1HG GLU 112 -12.909 -9.124 0.240 877 H ASN 113 H ASN 113 -13.054 -5.668 0.355 878 HA ASN 113 HA ASN 113 -15.084 -6.340 -1.620 879 HB2 ASN 113 2HB ASN 113 -16.038 -5.144 0.627 880 HB3 ASN 113 1HB ASN 113 -15.643 -3.724 -0.340 881 HD21 ASN 113 1HD2 ASN 113 -18.353 -4.253 0.182 882 HD22 ASN 113 2HD2 ASN 113 -19.116 -4.778 -1.240 883 H ILE 114 H ILE 114 -12.499 -6.022 -2.167 884 HA ILE 114 HA ILE 114 -11.234 -3.605 -2.501 885 HB ILE 114 HB ILE 114 -11.506 -5.692 -4.680 886 HG12 ILE 114 2HG1 ILE 114 -11.011 -7.076 -2.880 887 HG13 ILE 114 1HG1 ILE 114 -9.387 -6.580 -3.344 888 HG21 ILE 114 1HG2 ILE 114 -8.957 -4.340 -3.896 889 HG22 ILE 114 2HG2 ILE 114 -10.138 -3.416 -4.826 890 HG23 ILE 114 3HG2 ILE 114 -9.481 -4.918 -5.478 891 HD11 ILE 114 3HD1 ILE 114 -9.414 -6.226 -1.014 892 HD12 ILE 114 1HD1 ILE 114 -11.065 -5.601 -1.037 893 HD13 ILE 114 2HD1 ILE 114 -9.741 -4.623 -1.670 894 H ASP 115 H ASP 115 -13.194 -4.902 -5.216 895 HA ASP 115 HA ASP 115 -13.366 -2.658 -6.795 896 HB2 ASP 115 2HB ASP 115 -14.655 -5.101 -6.565 897 HB3 ASP 115 1HB ASP 115 -15.974 -3.938 -6.407 898 H VAL 116 H VAL 116 -14.910 -3.200 -3.761 899 HA VAL 116 HA VAL 116 -16.519 -0.737 -3.911 900 HB VAL 116 HB VAL 116 -16.175 -3.004 -1.956 901 HG11 VAL 116 1HG1 VAL 116 -17.089 -0.318 -1.426 902 HG12 VAL 116 2HG1 VAL 116 -16.958 -1.678 -0.311 903 HG13 VAL 116 3HG1 VAL 116 -18.434 -1.446 -1.248 904 HG21 VAL 116 3HG2 VAL 116 -17.519 -3.427 -3.994 905 HG22 VAL 116 1HG2 VAL 116 -18.536 -2.040 -3.607 906 HG23 VAL 116 2HG2 VAL 116 -18.529 -3.451 -2.549 907 H PHE 117 H PHE 117 -14.054 -2.111 -1.815 908 HA PHE 117 HA PHE 117 -13.612 0.181 -0.172 909 HB2 PHE 117 2HB PHE 117 -12.648 -2.425 -0.473 910 HB3 PHE 117 1HB PHE 117 -11.230 -1.415 -0.751 911 HD1 PHE 117 2HD PHE 117 -10.388 0.095 0.993 912 HD2 PHE 117 1HD PHE 117 -13.786 -2.441 1.682 913 HE1 PHE 117 2HE PHE 117 -10.202 0.509 3.432 914 HE2 PHE 117 1HE PHE 117 -13.600 -2.027 4.120 915 HZ PHE 117 HZ PHE 117 -11.808 -0.553 4.995 916 H SER 118 H SER 118 -12.688 -0.523 -3.437 917 HA SER 118 HA SER 118 -10.621 1.554 -3.524 918 HB2 SER 118 2HB SER 118 -10.186 -0.475 -4.731 919 HB3 SER 118 1HB SER 118 -11.800 -0.468 -5.433 920 HG SER 118 HG SER 118 -10.470 0.339 -6.984 921 H ASP 119 H ASP 119 -13.769 0.799 -4.853 922 HA ASP 119 HA ASP 119 -14.116 3.250 -6.320 923 HB2 ASP 119 2HB ASP 119 -15.340 1.017 -6.561 924 HB3 ASP 119 1HB ASP 119 -16.255 1.473 -5.123 925 H THR 120 H THR 120 -14.423 2.344 -3.049 926 HA THR 120 HA THR 120 -16.100 4.556 -2.185 927 HB THR 120 HB THR 120 -14.624 2.238 -1.096 928 HG1 THR 120 1HG THR 120 -16.572 1.809 -0.471 929 HG21 THR 120 3HG2 THR 120 -13.503 3.739 0.322 930 HG22 THR 120 1HG2 THR 120 -14.895 3.227 1.275 931 HG23 THR 120 2HG2 THR 120 -14.907 4.795 0.468 932 H ILE 121 H ILE 121 -12.724 3.730 -2.159 933 HA ILE 121 HA ILE 121 -11.813 6.282 -1.086 934 HB ILE 121 HB ILE 121 -10.906 3.606 -1.623 935 HG12 ILE 121 2HG1 ILE 121 -10.878 4.832 0.534 936 HG13 ILE 121 1HG1 ILE 121 -9.305 4.145 0.127 937 HG21 ILE 121 1HG2 ILE 121 -8.466 4.374 -2.105 938 HG22 ILE 121 2HG2 ILE 121 -9.228 5.810 -2.788 939 HG23 ILE 121 3HG2 ILE 121 -9.590 4.216 -3.453 940 HD11 ILE 121 3HD1 ILE 121 -10.123 6.975 0.336 941 HD12 ILE 121 1HD1 ILE 121 -9.134 6.596 -1.073 942 HD13 ILE 121 2HD1 ILE 121 -8.531 6.245 0.547 943 H LYS 122 H LYS 122 -12.067 4.765 -4.299 944 HA LYS 122 HA LYS 122 -10.566 6.732 -5.746 945 HB2 LYS 122 2HB LYS 122 -12.328 4.421 -6.200 946 HB3 LYS 122 1HB LYS 122 -12.482 5.659 -7.449 947 HG2 LYS 122 2HG LYS 122 -10.542 4.963 -8.345 948 HG3 LYS 122 1HG LYS 122 -9.728 5.436 -6.855 949 HD2 LYS 122 2HD LYS 122 -11.120 2.936 -6.471 950 HD3 LYS 122 1HD LYS 122 -10.033 2.823 -7.856 951 HE2 LYS 122 2HE LYS 122 -8.427 4.153 -6.092 952 HE3 LYS 122 1HE LYS 122 -9.378 3.144 -4.983 953 HZ1 LYS 122 3HZ LYS 122 -7.496 2.348 -7.040 954 HZ2 LYS 122 1HZ LYS 122 -8.931 1.444 -6.999 955 HZ3 LYS 122 2HZ LYS 122 -7.952 1.543 -5.616 956 H SER 123 H SER 123 -13.925 6.444 -4.736 957 HA SER 123 HA SER 123 -14.714 8.890 -6.163 958 HB2 SER 123 2HB SER 123 -15.964 6.758 -4.494 959 HB3 SER 123 1HB SER 123 -16.816 8.290 -4.651 960 HG SER 123 HG SER 123 -16.211 6.350 -6.573 961 H PHE 124 H PHE 124 -13.274 8.025 -3.240 962 HA PHE 124 HA PHE 124 -14.366 10.123 -1.543 963 HB2 PHE 124 2HB PHE 124 -12.893 7.804 -1.254 964 HB3 PHE 124 1HB PHE 124 -11.690 9.058 -0.956 965 HD1 PHE 124 2HD PHE 124 -12.554 11.063 0.587 966 HD2 PHE 124 1HD PHE 124 -14.198 7.094 0.540 967 HE1 PHE 124 2HE PHE 124 -13.491 11.424 2.855 968 HE2 PHE 124 1HE PHE 124 -15.136 7.456 2.808 969 HZ PHE 124 HZ PHE 124 -14.783 9.621 3.964 970 H ALA 125 H ALA 125 -12.426 10.214 -4.218 971 HA ALA 125 HA ALA 125 -11.572 12.959 -3.700 972 HB1 ALA 125 1HB ALA 125 -9.745 10.601 -3.436 973 HB2 ALA 125 2HB ALA 125 -9.784 12.091 -2.493 974 HB3 ALA 125 3HB ALA 125 -9.091 12.092 -4.115 975 H SER 126 H SER 126 -13.144 12.172 -5.762 976 HA SER 126 HA SER 126 -11.765 13.000 -8.107 977 HB2 SER 126 2HB SER 126 -10.855 11.086 -8.938 978 HB3 SER 126 1HB SER 126 -11.042 10.447 -7.308 979 HG SER 126 HG SER 126 -12.018 9.164 -9.004 980 H SER 127 H SER 127 -13.173 11.373 -10.016 981 HA SER 127 HA SER 127 -15.323 11.100 -10.974 982 HB2 SER 127 2HB SER 127 -16.657 10.105 -9.442 983 HB3 SER 127 1HB SER 127 -15.528 10.614 -8.192 984 HG SER 127 HG SER 127 -17.821 11.960 -9.172 985 H GLY 128 H GLY 128 -14.044 13.869 -9.817 986 HA2 GLY 128 2HA GLY 128 -14.712 15.948 -11.027 987 HA3 GLY 128 1HA GLY 128 -16.389 15.491 -10.723 988 H LYS 129 H LYS 129 -15.416 14.565 -7.938 989 HA LYS 129 HA LYS 129 -15.386 15.508 -5.773 990 HB2 LYS 129 2HB LYS 129 -13.215 16.298 -6.597 991 HB3 LYS 129 1HB LYS 129 -13.991 17.677 -7.374 992 HG2 LYS 129 2HG LYS 129 -14.718 17.473 -4.558 993 HG3 LYS 129 1HG LYS 129 -12.974 17.614 -4.776 994 HD2 LYS 129 2HD LYS 129 -15.064 19.470 -5.953 995 HD3 LYS 129 1HD LYS 129 -13.996 19.843 -4.601 996 HE2 LYS 129 2HE LYS 129 -12.472 20.590 -6.104 997 HE3 LYS 129 1HE LYS 129 -12.325 18.928 -6.710 998 HZ1 LYS 129 3HZ LYS 129 -13.189 20.814 -8.275 999 HZ2 LYS 129 1HZ LYS 129 -14.661 20.529 -7.484 1000 HZ3 LYS 129 2HZ LYS 129 -13.893 19.270 -8.325 1001 H GLU 130 H GLU 130 -17.477 16.368 -7.999 1002 HA GLU 130 HA GLU 130 -18.385 18.996 -7.185 1003 HB2 GLU 130 2HB GLU 130 -19.857 16.718 -8.544 1004 HB3 GLU 130 1HB GLU 130 -20.290 18.427 -8.610 1005 HG2 GLU 130 2HG GLU 130 -17.576 17.471 -9.515 1006 HG3 GLU 130 1HG GLU 130 -18.961 17.454 -10.607 1007 H LYS 131 H LYS 131 -21.238 18.064 -6.998 1008 HA LYS 131 HA LYS 131 -22.767 17.569 -5.270 1009 HB2 LYS 131 2HB LYS 131 -20.428 15.727 -4.872 1010 HB3 LYS 131 1HB LYS 131 -21.805 15.665 -3.768 1011 HG2 LYS 131 2HG LYS 131 -22.927 14.423 -5.266 1012 HG3 LYS 131 1HG LYS 131 -22.858 15.770 -6.403 1013 HD2 LYS 131 2HD LYS 131 -21.855 13.632 -7.287 1014 HD3 LYS 131 1HD LYS 131 -20.743 15.002 -7.289 1015 HE2 LYS 131 2HE LYS 131 -20.535 13.727 -4.736 1016 HE3 LYS 131 1HE LYS 131 -20.395 12.479 -5.991 1017 HZ1 LYS 131 3HZ LYS 131 -18.795 14.936 -5.645 1018 HZ2 LYS 131 1HZ LYS 131 -18.941 14.216 -7.173 1019 HZ3 LYS 131 2HZ LYS 131 -18.259 13.341 -5.887 1020 H LEU 132 H LEU 132 -20.700 16.725 -2.768 1021 HA LEU 132 HA LEU 132 -21.403 18.887 -1.086 1022 HB2 LEU 132 2HB LEU 132 -19.254 18.028 0.173 1023 HB3 LEU 132 1HB LEU 132 -20.657 16.979 0.019 1024 HG LEU 132 HG LEU 132 -19.643 15.715 -1.736 1025 HD11 LEU 132 1HD1 LEU 132 -17.597 16.342 -2.859 1026 HD12 LEU 132 2HD1 LEU 132 -17.357 17.704 -1.768 1027 HD13 LEU 132 3HD1 LEU 132 -18.683 17.729 -2.929 1028 HD21 LEU 132 3HD2 LEU 132 -18.500 14.699 -0.083 1029 HD22 LEU 132 1HD2 LEU 132 -18.193 16.232 0.733 1030 HD23 LEU 132 2HD2 LEU 132 -17.116 15.686 -0.552 1031 H GLU 133 H GLU 133 -20.945 20.718 -2.668 1032 HA GLU 133 HA GLU 133 -18.496 22.075 -1.907 1033 HB2 GLU 133 2HB GLU 133 -17.662 22.104 -4.348 1034 HB3 GLU 133 1HB GLU 133 -17.443 20.599 -3.453 1035 HG2 GLU 133 2HG GLU 133 -18.349 20.049 -5.629 1036 HG3 GLU 133 1HG GLU 133 -19.614 19.785 -4.428
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