NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
540544 | 2lr4 | 18346 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 -26.234 10.610 0.159 2 HA2 GLY 1 1HA GLY 1 -23.621 9.230 0.399 3 HA3 GLY 1 2HA GLY 1 -24.808 8.828 -0.850 4 H ALA 2 H ALA 2 -22.546 11.256 0.294 5 HA ALA 2 HA ALA 2 -22.444 12.447 -2.447 6 HB1 ALA 2 1HB ALA 2 -23.574 14.074 -0.969 7 HB2 ALA 2 2HB ALA 2 -22.269 13.932 0.223 8 HB3 ALA 2 3HB ALA 2 -21.938 14.618 -1.379 9 H GLU 3 H GLU 3 -20.660 12.489 0.683 10 HA GLU 3 HA GLU 3 -18.177 12.261 -0.869 11 HB2 GLU 3 1HB GLU 3 -17.027 12.890 1.187 12 HB3 GLU 3 2HB GLU 3 -18.268 14.050 0.749 13 HG2 GLU 3 1HG GLU 3 -18.706 11.849 2.814 14 HG3 GLU 3 2HG GLU 3 -18.068 13.446 3.214 15 H ALA 4 H ALA 4 -20.174 10.069 0.098 16 HA ALA 4 HA ALA 4 -18.060 8.030 0.661 17 HB1 ALA 4 1HB ALA 4 -19.743 6.562 1.581 18 HB2 ALA 4 2HB ALA 4 -19.732 8.101 2.474 19 HB3 ALA 4 3HB ALA 4 -21.020 7.765 1.282 20 H LEU 5 H LEU 5 -18.554 9.190 -1.768 21 HA LEU 5 HA LEU 5 -19.685 7.508 -3.758 22 HB2 LEU 5 1HB LEU 5 -17.348 9.352 -3.518 23 HB3 LEU 5 2HB LEU 5 -17.391 8.377 -4.952 24 HG LEU 5 HG LEU 5 -19.712 9.995 -3.996 25 HD11 LEU 5 1HD1 LEU 5 -17.833 11.553 -4.066 26 HD12 LEU 5 2HD1 LEU 5 -19.013 11.899 -5.322 27 HD13 LEU 5 3HD1 LEU 5 -17.504 11.059 -5.751 28 HD21 LEU 5 3HD2 LEU 5 -20.088 8.394 -5.883 29 HD22 LEU 5 1HD2 LEU 5 -18.781 9.177 -6.792 30 HD23 LEU 5 2HD2 LEU 5 -20.270 10.069 -6.453 31 HA PRO 6 HA PRO 6 -17.292 3.848 -3.232 32 HB2 PRO 6 1HB PRO 6 -17.064 2.887 -5.774 33 HB3 PRO 6 2HB PRO 6 -18.645 2.975 -4.932 34 HG2 PRO 6 1HG PRO 6 -17.491 4.877 -6.984 35 HG3 PRO 6 2HG PRO 6 -19.156 4.227 -6.837 36 HD2 PRO 6 1HD PRO 6 -18.316 6.737 -5.859 37 HD3 PRO 6 2HD PRO 6 -19.730 5.835 -5.244 38 H LEU 7 H LEU 7 -15.286 2.940 -3.767 39 HA LEU 7 HA LEU 7 -13.022 4.608 -3.846 40 HB2 LEU 7 1HB LEU 7 -13.424 2.023 -3.297 41 HB3 LEU 7 2HB LEU 7 -12.837 1.829 -4.951 42 HG LEU 7 HG LEU 7 -11.398 3.196 -2.653 43 HD11 LEU 7 1HD1 LEU 7 -10.965 0.639 -4.269 44 HD12 LEU 7 2HD1 LEU 7 -11.572 0.696 -2.635 45 HD13 LEU 7 3HD1 LEU 7 -9.902 1.212 -2.978 46 HD21 LEU 7 3HD2 LEU 7 -10.465 2.936 -5.503 47 HD22 LEU 7 1HD2 LEU 7 -9.418 3.221 -4.076 48 HD23 LEU 7 2HD2 LEU 7 -10.656 4.394 -4.479 49 H TYR 8 H TYR 8 -12.397 5.943 -5.480 50 HA TYR 8 HA TYR 8 -12.731 5.041 -8.278 51 HB2 TYR 8 1HB TYR 8 -12.849 7.425 -8.869 52 HB3 TYR 8 2HB TYR 8 -14.176 6.822 -7.905 53 HD1 TYR 8 2HD TYR 8 -11.001 8.817 -7.670 54 HD2 TYR 8 1HD TYR 8 -14.822 7.908 -5.916 55 HE1 TYR 8 2HE TYR 8 -10.736 10.728 -6.097 56 HE2 TYR 8 1HE TYR 8 -14.599 9.827 -4.379 57 HH TYR 8 HH TYR 8 -11.819 12.078 -4.563 58 H TYR 9 H TYR 9 -10.254 5.376 -5.988 59 HA TYR 9 HA TYR 9 -8.272 5.263 -8.127 60 HB2 TYR 9 1HB TYR 9 -8.450 7.691 -7.912 61 HB3 TYR 9 2HB TYR 9 -8.321 7.518 -6.198 62 HD1 TYR 9 2HD TYR 9 -6.054 6.744 -5.136 63 HD2 TYR 9 1HD TYR 9 -6.476 8.024 -9.235 64 HE1 TYR 9 2HE TYR 9 -3.643 7.208 -5.247 65 HE2 TYR 9 1HE TYR 9 -4.055 8.466 -9.358 66 HH TYR 9 HH TYR 9 -2.011 8.372 -8.199 67 H LEU 10 H LEU 10 -6.696 3.822 -7.537 68 HA LEU 10 HA LEU 10 -6.212 3.266 -4.689 69 HB2 LEU 10 1HB LEU 10 -7.846 1.737 -5.989 70 HB3 LEU 10 2HB LEU 10 -6.496 1.448 -7.090 71 HG LEU 10 HG LEU 10 -6.472 -0.404 -5.922 72 HD11 LEU 10 1HD1 LEU 10 -4.283 0.654 -5.721 73 HD12 LEU 10 2HD1 LEU 10 -4.602 -0.497 -4.368 74 HD13 LEU 10 3HD1 LEU 10 -4.669 1.231 -4.108 75 HD21 LEU 10 3HD2 LEU 10 -6.939 1.160 -3.333 76 HD22 LEU 10 1HD2 LEU 10 -6.828 -0.606 -3.429 77 HD23 LEU 10 2HD2 LEU 10 -8.190 0.240 -4.194 78 H GLN 11 H GLN 11 -4.002 3.269 -4.453 79 HA GLN 11 HA GLN 11 -2.191 2.556 -6.545 80 HB2 GLN 11 1HB GLN 11 -3.026 5.171 -6.854 81 HB3 GLN 11 2HB GLN 11 -1.661 5.420 -5.808 82 HG2 GLN 11 1HG GLN 11 -0.308 5.314 -7.579 83 HG3 GLN 11 2HG GLN 11 -0.769 3.650 -7.878 84 HE21 GLN 11 1HE2 GLN 11 -2.580 3.217 -9.501 85 HE22 GLN 11 2HE2 GLN 11 -2.964 4.501 -10.605 86 H ILE 12 H ILE 12 -0.344 1.799 -5.524 87 HA ILE 12 HA ILE 12 -0.218 1.569 -2.768 88 HB ILE 12 HB ILE 12 2.065 1.452 -4.761 89 HG12 ILE 12 1HG1 ILE 12 0.517 -0.175 -5.442 90 HG13 ILE 12 2HG1 ILE 12 1.725 -1.019 -4.484 91 HG21 ILE 12 1HG2 ILE 12 3.295 0.062 -3.167 92 HG22 ILE 12 2HG2 ILE 12 2.927 1.588 -2.371 93 HG23 ILE 12 3HG2 ILE 12 1.982 0.145 -1.984 94 HD11 ILE 12 3HD1 ILE 12 0.117 -1.025 -2.540 95 HD12 ILE 12 1HD1 ILE 12 -1.116 -0.347 -3.636 96 HD13 ILE 12 2HD1 ILE 12 -0.410 -1.938 -3.957 97 H THR 13 H THR 13 1.248 4.218 -4.619 98 HA THR 13 HA THR 13 1.779 6.289 -4.095 99 HB THR 13 HB THR 13 0.025 5.859 -1.656 100 HG1 THR 13 1HG THR 13 -1.064 5.357 -3.492 101 HG21 THR 13 3HG2 THR 13 1.248 8.007 -1.519 102 HG22 THR 13 1HG2 THR 13 -0.452 8.283 -1.923 103 HG23 THR 13 2HG2 THR 13 0.782 8.362 -3.199 104 H GLY 14 H GLY 14 2.270 4.569 -0.890 105 HA2 GLY 14 1HA GLY 14 5.104 5.425 -1.100 106 HA3 GLY 14 2HA GLY 14 4.233 5.770 0.394 107 H ILE 15 H ILE 15 6.505 4.060 0.226 108 HA ILE 15 HA ILE 15 5.327 1.677 1.383 109 HB ILE 15 HB ILE 15 5.481 1.226 -1.090 110 HG12 ILE 15 1HG1 ILE 15 7.214 -0.576 0.637 111 HG13 ILE 15 2HG1 ILE 15 5.447 -0.536 0.640 112 HG21 ILE 15 1HG2 ILE 15 7.568 0.956 -2.233 113 HG22 ILE 15 2HG2 ILE 15 7.700 2.508 -1.386 114 HG23 ILE 15 3HG2 ILE 15 8.501 1.082 -0.728 115 HD11 ILE 15 3HD1 ILE 15 7.208 -1.282 -1.734 116 HD12 ILE 15 1HD1 ILE 15 6.171 -2.352 -0.786 117 HD13 ILE 15 2HD1 ILE 15 5.441 -1.088 -1.800 118 H THR 16 H THR 16 6.828 0.713 2.799 119 HA THR 16 HA THR 16 9.589 1.295 2.623 120 HB THR 16 HB THR 16 9.005 3.381 3.713 121 HG1 THR 16 1HG THR 16 10.140 1.923 5.805 122 HG21 THR 16 3HG2 THR 16 8.068 3.582 5.906 123 HG22 THR 16 1HG2 THR 16 7.962 1.819 6.097 124 HG23 THR 16 2HG2 THR 16 6.931 2.655 4.923 125 H SER 17 H SER 17 10.536 0.302 4.866 126 HA SER 17 HA SER 17 8.846 -1.813 5.920 127 HB2 SER 17 1HB SER 17 10.142 -2.933 4.135 128 HB3 SER 17 2HB SER 17 11.638 -2.247 4.800 129 HG SER 17 HG SER 17 11.690 -4.083 5.694 130 H ASP 18 H ASP 18 9.879 -2.603 7.854 131 HA ASP 18 HA ASP 18 10.664 -0.664 9.795 132 HB2 ASP 18 1HB ASP 18 9.539 -2.758 10.329 133 HB3 ASP 18 2HB ASP 18 10.845 -3.695 9.617 134 H GLY 19 H GLY 19 12.618 -3.015 7.862 135 HA2 GLY 19 1HA GLY 19 15.107 -2.227 9.008 136 HA3 GLY 19 2HA GLY 19 14.855 -3.160 7.539 137 H ASN 20 H ASN 20 13.202 -0.273 6.945 138 HA ASN 20 HA ASN 20 15.604 0.760 5.495 139 HB2 ASN 20 1HB ASN 20 12.853 0.176 4.558 140 HB3 ASN 20 2HB ASN 20 13.428 1.760 4.051 141 HD21 ASN 20 1HD2 ASN 20 13.879 1.174 1.707 142 HD22 ASN 20 2HD2 ASN 20 15.036 -0.116 1.403 143 H ASP 21 H ASP 21 14.764 1.566 8.234 144 HA ASP 21 HA ASP 21 14.657 3.435 9.477 145 HB2 ASP 21 1HB ASP 21 16.523 4.161 7.907 146 HB3 ASP 21 2HB ASP 21 15.314 5.080 7.012 147 H PHE 22 H PHE 22 12.289 2.494 7.874 148 HA PHE 22 HA PHE 22 10.161 3.057 7.380 149 HB2 PHE 22 1HB PHE 22 10.595 5.085 9.581 150 HB3 PHE 22 2HB PHE 22 9.052 4.725 8.836 151 HD1 PHE 22 2HD PHE 22 11.898 2.836 10.534 152 HD2 PHE 22 1HD PHE 22 7.640 3.226 9.922 153 HE1 PHE 22 2HE PHE 22 11.509 0.874 11.967 154 HE2 PHE 22 1HE PHE 22 7.260 1.305 11.414 155 HZ PHE 22 HZ PHE 22 9.185 0.066 12.385 156 H ALA 23 H ALA 23 12.334 4.208 5.777 157 HA ALA 23 HA ALA 23 11.758 6.832 4.880 158 HB1 ALA 23 1HB ALA 23 13.242 6.225 3.002 159 HB2 ALA 23 2HB ALA 23 13.944 5.802 4.574 160 HB3 ALA 23 3HB ALA 23 13.227 4.540 3.537 161 H TRP 24 H TRP 24 9.540 7.031 4.429 162 HA TRP 24 HA TRP 24 7.911 5.138 3.161 163 HB2 TRP 24 1HB TRP 24 7.738 8.098 3.797 164 HB3 TRP 24 2HB TRP 24 6.504 7.398 2.778 165 HD1 TRP 24 HD TRP 24 7.124 7.936 6.313 166 HE1 TRP 24 1HE TRP 24 5.632 6.473 7.771 167 HE3 TRP 24 3HE TRP 24 5.619 4.647 2.750 168 HZ2 TRP 24 2HZ TRP 24 3.867 4.173 7.380 169 HZ3 TRP 24 3HZ TRP 24 4.147 2.758 3.312 170 HH2 TRP 24 HH TRP 24 3.246 2.502 5.634 171 H ASP 25 H ASP 25 10.090 7.132 1.639 172 HA ASP 25 HA ASP 25 10.434 7.826 -0.566 173 HB2 ASP 25 1HB ASP 25 10.283 4.850 -0.328 174 HB3 ASP 25 2HB ASP 25 10.458 5.591 -1.924 175 H ASN 26 H ASN 26 8.637 9.165 -0.978 176 HA ASN 26 HA ASN 26 6.116 8.437 -1.847 177 HB2 ASN 26 1HB ASN 26 7.831 10.871 -2.115 178 HB3 ASN 26 2HB ASN 26 6.578 10.713 -3.336 179 HD21 ASN 26 1HD2 ASN 26 4.280 10.069 -2.448 180 HD22 ASN 26 2HD2 ASN 26 3.865 10.806 -0.915 181 H LEU 27 H LEU 27 5.532 7.068 -3.378 182 HA LEU 27 HA LEU 27 7.349 6.336 -5.453 183 HB2 LEU 27 1HB LEU 27 4.400 5.637 -5.097 184 HB3 LEU 27 2HB LEU 27 5.504 4.835 -6.204 185 HG LEU 27 HG LEU 27 5.809 4.870 -3.163 186 HD11 LEU 27 1HD1 LEU 27 5.195 2.500 -3.240 187 HD12 LEU 27 2HD1 LEU 27 4.901 2.611 -4.991 188 HD13 LEU 27 3HD1 LEU 27 3.890 3.517 -3.847 189 HD21 LEU 27 3HD2 LEU 27 7.344 3.233 -5.231 190 HD22 LEU 27 1HD2 LEU 27 7.493 3.163 -3.472 191 HD23 LEU 27 2HD2 LEU 27 7.994 4.621 -4.282 192 H THR 28 H THR 28 7.340 6.807 -7.669 193 HA THR 28 HA THR 28 6.244 9.212 -8.579 194 HB THR 28 HB THR 28 6.632 7.729 -10.808 195 HG1 THR 28 1HG THR 28 8.167 6.332 -10.639 196 HG21 THR 28 3HG2 THR 28 7.941 9.819 -10.074 197 HG22 THR 28 1HG2 THR 28 9.017 8.605 -10.741 198 HG23 THR 28 2HG2 THR 28 8.884 8.801 -8.983 199 H SER 29 H SER 29 4.607 9.508 -10.268 200 HA SER 29 HA SER 29 2.209 8.784 -9.044 201 HB2 SER 29 1HB SER 29 2.522 9.940 -11.825 202 HB3 SER 29 2HB SER 29 1.187 10.186 -10.686 203 HG SER 29 HG SER 29 2.708 11.927 -10.696 204 H SER 30 H SER 30 3.851 6.940 -11.454 205 HA SER 30 HA SER 30 1.608 5.057 -11.580 206 HB2 SER 30 1HB SER 30 2.245 4.906 -14.143 207 HB3 SER 30 2HB SER 30 1.075 6.079 -13.543 208 HG SER 30 HG SER 30 2.906 6.757 -15.030 209 H GLN 31 H GLN 31 4.178 5.245 -10.141 210 HA GLN 31 HA GLN 31 6.358 3.914 -11.207 211 HB2 GLN 31 1HB GLN 31 6.119 4.981 -8.890 212 HB3 GLN 31 2HB GLN 31 5.253 3.584 -8.392 213 HG2 GLN 31 1HG GLN 31 7.108 2.628 -7.764 214 HG3 GLN 31 2HG GLN 31 7.619 2.519 -9.436 215 HE21 GLN 31 1HE2 GLN 31 7.761 4.587 -6.531 216 HE22 GLN 31 2HE2 GLN 31 9.281 5.339 -6.886 217 H THR 32 H THR 32 6.964 1.759 -11.535 218 HA THR 32 HA THR 32 4.984 -0.386 -10.922 219 HB THR 32 HB THR 32 6.041 -1.551 -12.859 220 HG1 THR 32 1HG THR 32 7.930 0.067 -12.929 221 HG21 THR 32 3HG2 THR 32 4.740 1.106 -13.535 222 HG22 THR 32 1HG2 THR 32 3.880 -0.380 -13.058 223 HG23 THR 32 2HG2 THR 32 4.806 -0.333 -14.573 224 H LYS 33 H LYS 33 8.017 0.801 -9.961 225 HA LYS 33 HA LYS 33 8.783 -1.831 -8.880 226 HB2 LYS 33 1HB LYS 33 9.952 -0.741 -11.226 227 HB3 LYS 33 2HB LYS 33 11.120 -0.387 -9.946 228 HG2 LYS 33 1HG LYS 33 11.254 -2.728 -9.339 229 HG3 LYS 33 2HG LYS 33 9.837 -3.111 -10.321 230 HD2 LYS 33 1HD LYS 33 11.209 -2.253 -12.349 231 HD3 LYS 33 2HD LYS 33 12.616 -2.348 -11.274 232 HE2 LYS 33 1HE LYS 33 12.151 -4.761 -10.906 233 HE3 LYS 33 2HE LYS 33 10.712 -4.648 -11.933 234 HZ1 LYS 33 3HZ LYS 33 12.661 -5.494 -13.126 235 HZ2 LYS 33 1HZ LYS 33 13.462 -4.068 -12.830 236 HZ3 LYS 33 2HZ LYS 33 12.122 -4.066 -13.773 237 H ALA 34 H ALA 34 10.432 -1.663 -7.227 238 HA ALA 34 HA ALA 34 9.564 0.207 -5.359 239 HB1 ALA 34 1HB ALA 34 11.374 -0.745 -3.924 240 HB2 ALA 34 2HB ALA 34 10.479 -1.977 -4.804 241 HB3 ALA 34 3HB ALA 34 12.102 -1.498 -5.359 242 HA PRO 35 HA PRO 35 12.529 3.600 -5.698 243 HB2 PRO 35 1HB PRO 35 12.971 4.143 -3.042 244 HB3 PRO 35 2HB PRO 35 11.535 4.719 -3.959 245 HG2 PRO 35 1HG PRO 35 11.717 2.328 -2.100 246 HG3 PRO 35 2HG PRO 35 10.363 3.491 -2.276 247 HD2 PRO 35 1HD PRO 35 10.254 1.096 -3.424 248 HD3 PRO 35 2HD PRO 35 9.585 2.541 -4.219 249 H ASN 36 H ASN 36 13.051 0.946 -3.205 250 HA ASN 36 HA ASN 36 15.748 0.514 -4.114 251 HB2 ASN 36 1HB ASN 36 15.130 2.137 -1.688 252 HB3 ASN 36 2HB ASN 36 16.106 0.718 -1.337 253 HD21 ASN 36 1HD2 ASN 36 16.103 3.852 -2.855 254 HD22 ASN 36 2HD2 ASN 36 17.695 3.774 -3.532 255 H VAL 37 H VAL 37 16.622 -1.297 -2.858 256 HA VAL 37 HA VAL 37 14.842 -3.403 -2.199 257 HB VAL 37 HB VAL 37 16.817 -4.057 -3.007 258 HG11 VAL 37 1HG1 VAL 37 18.115 -2.363 -3.014 259 HG12 VAL 37 2HG1 VAL 37 18.319 -2.344 -1.218 260 HG13 VAL 37 3HG1 VAL 37 18.947 -3.709 -2.242 261 HG21 VAL 37 3HG2 VAL 37 17.437 -4.489 -0.102 262 HG22 VAL 37 1HG2 VAL 37 16.069 -5.292 -0.872 263 HG23 VAL 37 2HG2 VAL 37 17.683 -5.587 -1.494 264 H LEU 38 H LEU 38 13.466 -3.297 -0.770 265 HA LEU 38 HA LEU 38 13.590 -1.875 1.741 266 HB2 LEU 38 1HB LEU 38 11.614 -3.981 0.803 267 HB3 LEU 38 2HB LEU 38 11.392 -2.830 2.120 268 HG LEU 38 HG LEU 38 11.599 -2.187 -0.862 269 HD11 LEU 38 1HD1 LEU 38 9.288 -1.894 1.077 270 HD12 LEU 38 2HD1 LEU 38 9.472 -3.159 -0.168 271 HD13 LEU 38 3HD1 LEU 38 9.296 -1.468 -0.651 272 HD21 LEU 38 3HD2 LEU 38 11.314 -0.282 1.508 273 HD22 LEU 38 1HD2 LEU 38 11.001 0.159 -0.187 274 HD23 LEU 38 2HD2 LEU 38 12.615 -0.325 0.289 275 H LYS 39 H LYS 39 15.043 -2.575 3.262 276 HA LYS 39 HA LYS 39 15.716 -5.342 3.605 277 HB2 LYS 39 1HB LYS 39 16.068 -3.006 5.497 278 HB3 LYS 39 2HB LYS 39 16.864 -4.573 5.665 279 HG2 LYS 39 1HG LYS 39 18.075 -4.192 3.523 280 HG3 LYS 39 2HG LYS 39 17.238 -2.650 3.330 281 HD2 LYS 39 1HD LYS 39 18.202 -2.011 5.627 282 HD3 LYS 39 2HD LYS 39 19.297 -3.400 5.436 283 HE2 LYS 39 1HE LYS 39 19.923 -2.459 3.163 284 HE3 LYS 39 2HE LYS 39 18.908 -1.045 3.545 285 HZ1 LYS 39 3HZ LYS 39 21.455 -1.816 4.804 286 HZ2 LYS 39 1HZ LYS 39 20.419 -0.722 5.505 287 HZ3 LYS 39 2HZ LYS 39 21.088 -0.449 4.026 288 H GLY 40 H GLY 40 15.136 -6.715 5.622 289 HA2 GLY 40 1HA GLY 40 13.912 -6.950 7.653 290 HA3 GLY 40 2HA GLY 40 12.868 -5.627 7.204 291 H ASN 41 H ASN 41 11.243 -7.279 7.870 292 HA ASN 41 HA ASN 41 10.160 -8.579 5.396 293 HB2 ASN 41 1HB ASN 41 10.930 -10.370 6.923 294 HB3 ASN 41 2HB ASN 41 9.948 -9.659 8.217 295 HD21 ASN 41 1HD2 ASN 41 8.302 -11.124 8.575 296 HD22 ASN 41 2HD2 ASN 41 7.378 -11.881 7.297 297 H LYS 42 H LYS 42 9.639 -6.510 8.221 298 HA LYS 42 HA LYS 42 6.749 -6.580 7.989 299 HB2 LYS 42 1HB LYS 42 8.660 -4.691 9.384 300 HB3 LYS 42 2HB LYS 42 6.920 -4.500 9.454 301 HG2 LYS 42 1HG LYS 42 8.381 -6.938 10.546 302 HG3 LYS 42 2HG LYS 42 7.922 -5.505 11.477 303 HD2 LYS 42 1HD LYS 42 5.505 -5.940 10.648 304 HD3 LYS 42 2HD LYS 42 6.107 -7.555 10.188 305 HE2 LYS 42 1HE LYS 42 6.896 -7.904 12.516 306 HE3 LYS 42 2HE LYS 42 6.350 -6.276 12.945 307 HZ1 LYS 42 3HZ LYS 42 4.770 -7.921 13.630 308 HZ2 LYS 42 1HZ LYS 42 4.597 -8.514 12.136 309 HZ3 LYS 42 2HZ LYS 42 4.069 -6.984 12.476 310 H LEU 43 H LEU 43 6.214 -6.077 5.966 311 HA LEU 43 HA LEU 43 7.334 -3.758 4.536 312 HB2 LEU 43 1HB LEU 43 6.831 -6.011 3.475 313 HB3 LEU 43 2HB LEU 43 5.132 -5.689 3.706 314 HG LEU 43 HG LEU 43 5.743 -5.291 1.450 315 HD11 LEU 43 1HD1 LEU 43 5.459 -2.456 2.390 316 HD12 LEU 43 2HD1 LEU 43 4.144 -3.642 2.600 317 HD13 LEU 43 3HD1 LEU 43 4.772 -3.268 0.981 318 HD21 LEU 43 3HD2 LEU 43 7.314 -3.597 0.698 319 HD22 LEU 43 1HD2 LEU 43 8.126 -4.828 1.657 320 HD23 LEU 43 2HD2 LEU 43 7.773 -3.230 2.370 321 H TYR 44 H TYR 44 6.391 -1.811 4.582 322 HA TYR 44 HA TYR 44 3.645 -1.528 5.716 323 HB2 TYR 44 1HB TYR 44 5.944 0.442 5.876 324 HB3 TYR 44 2HB TYR 44 4.360 0.608 6.593 325 HD1 TYR 44 1HD TYR 44 3.827 -1.893 8.001 326 HD2 TYR 44 2HD TYR 44 7.560 0.215 7.541 327 HE1 TYR 44 1HE TYR 44 4.685 -2.918 10.089 328 HE2 TYR 44 2HE TYR 44 8.358 -0.724 9.665 329 HH TYR 44 HH TYR 44 6.425 -2.959 11.695 330 H VAL 45 H VAL 45 2.300 -1.113 4.027 331 HA VAL 45 HA VAL 45 3.234 0.713 1.853 332 HB VAL 45 HB VAL 45 0.681 -0.935 2.089 333 HG11 VAL 45 1HG1 VAL 45 1.605 1.033 -0.005 334 HG12 VAL 45 2HG1 VAL 45 0.389 -0.231 -0.320 335 HG13 VAL 45 3HG1 VAL 45 0.087 0.990 0.910 336 HG21 VAL 45 3HG2 VAL 45 2.594 -2.323 1.626 337 HG22 VAL 45 1HG2 VAL 45 1.554 -2.217 0.215 338 HG23 VAL 45 2HG2 VAL 45 3.084 -1.288 0.267 339 H LYS 46 H LYS 46 2.146 2.677 1.521 340 HA LYS 46 HA LYS 46 0.079 3.487 3.440 341 HB2 LYS 46 1HB LYS 46 1.931 4.655 4.305 342 HB3 LYS 46 2HB LYS 46 2.546 5.103 2.693 343 HG2 LYS 46 1HG LYS 46 0.904 6.726 2.394 344 HG3 LYS 46 2HG LYS 46 -0.162 6.012 3.594 345 HD2 LYS 46 1HD LYS 46 0.547 8.035 4.489 346 HD3 LYS 46 2HD LYS 46 1.352 6.763 5.399 347 HE2 LYS 46 1HE LYS 46 3.462 7.181 4.263 348 HE3 LYS 46 2HE LYS 46 2.669 8.295 3.130 349 HZ1 LYS 46 3HZ LYS 46 3.793 9.485 4.872 350 HZ2 LYS 46 1HZ LYS 46 2.917 8.759 6.045 351 HZ3 LYS 46 2HZ LYS 46 2.173 9.755 4.960 352 H ALA 47 H ALA 47 -1.512 3.019 1.898 353 HA ALA 47 HA ALA 47 -1.072 3.922 -0.905 354 HB1 ALA 47 1HB ALA 47 -1.249 1.495 -0.791 355 HB2 ALA 47 2HB ALA 47 -2.775 1.612 0.113 356 HB3 ALA 47 3HB ALA 47 -2.667 2.151 -1.573 357 H ARG 48 H ARG 48 -2.593 5.025 -1.987 358 HA ARG 48 HA ARG 48 -4.408 6.533 -0.227 359 HB2 ARG 48 1HB ARG 48 -2.756 7.640 -1.683 360 HB3 ARG 48 2HB ARG 48 -3.533 6.943 -3.105 361 HG2 ARG 48 1HG ARG 48 -4.543 9.006 -3.144 362 HG3 ARG 48 2HG ARG 48 -5.698 8.180 -2.095 363 HD2 ARG 48 1HD ARG 48 -5.222 10.207 -0.957 364 HD3 ARG 48 2HD ARG 48 -4.262 8.984 -0.115 365 HE ARG 48 HE ARG 48 -2.354 10.063 -0.699 366 HH11 ARG 48 1HH1 ARG 48 -4.912 11.235 -2.907 367 HH12 ARG 48 2HH1 ARG 48 -3.935 12.559 -3.466 368 HH21 ARG 48 1HH2 ARG 48 -1.086 11.668 -1.594 369 HH22 ARG 48 2HH2 ARG 48 -1.647 12.652 -2.913 370 H PHE 49 H PHE 49 -6.556 6.089 -0.189 371 HA PHE 49 HA PHE 49 -7.851 4.520 -2.374 372 HB2 PHE 49 1HB PHE 49 -8.570 4.505 0.600 373 HB3 PHE 49 2HB PHE 49 -9.424 3.706 -0.662 374 HD1 PHE 49 1HD PHE 49 -6.139 3.807 1.123 375 HD2 PHE 49 2HD PHE 49 -8.765 1.448 -1.350 376 HE1 PHE 49 1HE PHE 49 -4.645 1.858 1.371 377 HE2 PHE 49 2HE PHE 49 -7.331 -0.518 -1.023 378 HZ PHE 49 HZ PHE 49 -5.227 -0.326 0.305 379 H MET 50 H MET 50 -8.640 6.311 -3.508 380 HA MET 50 HA MET 50 -9.887 8.515 -1.958 381 HB2 MET 50 1HB MET 50 -9.761 8.380 -4.960 382 HB3 MET 50 2HB MET 50 -9.939 9.784 -3.943 383 HG2 MET 50 1HG MET 50 -7.403 8.254 -3.642 384 HG3 MET 50 2HG MET 50 -7.622 9.043 -5.186 385 HE1 MET 50 3HE MET 50 -9.086 10.668 -1.903 386 HE2 MET 50 1HE MET 50 -7.840 9.518 -1.354 387 HE3 MET 50 2HE MET 50 -7.594 11.264 -1.126 388 H GLY 51 H GLY 51 -11.833 7.958 -1.333 389 HA2 GLY 51 1HA GLY 51 -14.207 7.616 -2.032 390 HA3 GLY 51 2HA GLY 51 -13.668 6.407 -3.146 391 H TYR 52 H TYR 52 -15.673 5.875 -1.260 392 HA TYR 52 HA TYR 52 -14.699 4.852 1.208 393 HB2 TYR 52 1HB TYR 52 -17.032 5.797 0.311 394 HB3 TYR 52 2HB TYR 52 -17.340 4.122 -0.032 395 HD1 TYR 52 2HD TYR 52 -17.301 2.442 2.000 396 HD2 TYR 52 1HD TYR 52 -17.195 6.745 2.431 397 HE1 TYR 52 2HE TYR 52 -18.197 2.236 4.267 398 HE2 TYR 52 1HE TYR 52 -18.106 6.544 4.717 399 HH TYR 52 HH TYR 52 -18.640 3.385 6.260 400 H THR 53 H THR 53 -13.877 2.847 1.658 401 HA THR 53 HA THR 53 -15.107 0.522 0.510 402 HB THR 53 HB THR 53 -13.396 0.547 -1.146 403 HG1 THR 53 1HG THR 53 -11.827 -0.915 0.555 404 HG21 THR 53 3HG2 THR 53 -11.846 2.233 -0.468 405 HG22 THR 53 1HG2 THR 53 -10.927 0.716 -0.530 406 HG23 THR 53 2HG2 THR 53 -11.429 1.385 1.029 407 H LYS 54 H LYS 54 -15.112 -1.062 2.011 408 HA LYS 54 HA LYS 54 -12.895 -1.188 3.967 409 HB2 LYS 54 1HB LYS 54 -15.855 -1.428 4.612 410 HB3 LYS 54 2HB LYS 54 -14.587 -2.142 5.639 411 HG2 LYS 54 1HG LYS 54 -13.506 0.229 5.588 412 HG3 LYS 54 2HG LYS 54 -15.092 0.788 5.044 413 HD2 LYS 54 1HD LYS 54 -16.126 -0.096 7.071 414 HD3 LYS 54 2HD LYS 54 -14.608 -0.833 7.584 415 HE2 LYS 54 1HE LYS 54 -15.019 2.157 7.187 416 HE3 LYS 54 2HE LYS 54 -15.220 1.326 8.733 417 HZ1 LYS 54 3HZ LYS 54 -12.668 1.325 7.227 418 HZ2 LYS 54 1HZ LYS 54 -12.953 0.691 8.706 419 HZ3 LYS 54 2HZ LYS 54 -13.031 2.305 8.517 420 H LEU 55 H LEU 55 -13.466 -2.399 1.269 421 HA LEU 55 HA LEU 55 -13.302 -5.269 2.070 422 HB2 LEU 55 1HB LEU 55 -14.508 -4.176 -0.497 423 HB3 LEU 55 2HB LEU 55 -14.226 -5.855 -0.083 424 HG LEU 55 HG LEU 55 -15.805 -5.254 2.010 425 HD11 LEU 55 1HD1 LEU 55 -16.659 -3.283 -0.174 426 HD12 LEU 55 2HD1 LEU 55 -16.161 -2.880 1.480 427 HD13 LEU 55 3HD1 LEU 55 -17.666 -3.748 1.206 428 HD21 LEU 55 3HD2 LEU 55 -16.803 -5.819 -0.808 429 HD22 LEU 55 1HD2 LEU 55 -17.722 -6.093 0.693 430 HD23 LEU 55 2HD2 LEU 55 -16.252 -7.020 0.379 431 H THR 56 H THR 56 -11.006 -4.684 2.341 432 HA THR 56 HA THR 56 -9.511 -4.173 -0.165 433 HB THR 56 HB THR 56 -8.087 -4.936 2.352 434 HG1 THR 56 1HG THR 56 -9.485 -3.727 3.356 435 HG21 THR 56 3HG2 THR 56 -7.727 -2.591 0.437 436 HG22 THR 56 1HG2 THR 56 -6.971 -4.187 0.251 437 HG23 THR 56 2HG2 THR 56 -6.560 -3.186 1.641 438 H VAL 57 H VAL 57 -8.230 -5.885 -1.135 439 HA VAL 57 HA VAL 57 -8.178 -8.481 0.280 440 HB VAL 57 HB VAL 57 -8.920 -8.115 -2.656 441 HG11 VAL 57 1HG1 VAL 57 -9.394 -10.534 -2.592 442 HG12 VAL 57 2HG1 VAL 57 -7.700 -10.218 -2.212 443 HG13 VAL 57 3HG1 VAL 57 -8.840 -10.630 -0.918 444 HG21 VAL 57 3HG2 VAL 57 -11.151 -9.020 -2.007 445 HG22 VAL 57 1HG2 VAL 57 -10.692 -8.903 -0.299 446 HG23 VAL 57 2HG2 VAL 57 -10.850 -7.447 -1.281 447 H ILE 58 H ILE 58 -6.275 -9.601 -0.107 448 HA ILE 58 HA ILE 58 -4.288 -8.655 -2.016 449 HB ILE 58 HB ILE 58 -3.563 -9.085 0.920 450 HG12 ILE 58 1HG1 ILE 58 -3.595 -6.371 -0.472 451 HG13 ILE 58 2HG1 ILE 58 -4.849 -6.912 0.639 452 HG21 ILE 58 1HG2 ILE 58 -1.995 -8.050 -1.492 453 HG22 ILE 58 2HG2 ILE 58 -1.337 -8.227 0.137 454 HG23 ILE 58 3HG2 ILE 58 -1.832 -9.660 -0.757 455 HD11 ILE 58 3HD1 ILE 58 -1.961 -6.449 1.374 456 HD12 ILE 58 1HD1 ILE 58 -3.400 -5.555 1.894 457 HD13 ILE 58 2HD1 ILE 58 -3.159 -7.218 2.437 458 H THR 59 H THR 59 -3.860 -10.638 -3.065 459 HA THR 59 HA THR 59 -5.201 -12.881 -2.072 460 HB THR 59 HB THR 59 -3.422 -13.119 -4.404 461 HG1 THR 59 1HG THR 59 -4.291 -11.798 -5.676 462 HG21 THR 59 3HG2 THR 59 -5.255 -14.733 -3.937 463 HG22 THR 59 1HG2 THR 59 -5.442 -13.978 -5.520 464 HG23 THR 59 2HG2 THR 59 -6.446 -13.483 -4.136 465 H GLY 60 H GLY 60 -1.836 -11.877 -2.090 466 HA2 GLY 60 1HA GLY 60 0.086 -12.879 -1.249 467 HA3 GLY 60 2HA GLY 60 -0.975 -14.009 -0.381 468 H LYS 61 H LYS 61 1.066 -15.301 -0.958 469 HA LYS 61 HA LYS 61 1.226 -16.254 -3.663 470 HB2 LYS 61 1HB LYS 61 2.827 -17.825 -2.879 471 HB3 LYS 61 2HB LYS 61 3.099 -16.255 -2.106 472 HG2 LYS 61 1HG LYS 61 2.040 -17.101 -0.014 473 HG3 LYS 61 2HG LYS 61 1.846 -18.683 -0.790 474 HD2 LYS 61 1HD LYS 61 3.790 -18.744 0.553 475 HD3 LYS 61 2HD LYS 61 4.284 -18.825 -1.141 476 HE2 LYS 61 1HE LYS 61 4.948 -16.396 -1.057 477 HE3 LYS 61 2HE LYS 61 4.409 -16.322 0.602 478 HZ1 LYS 61 3HZ LYS 61 6.686 -17.807 -0.477 479 HZ2 LYS 61 1HZ LYS 61 6.058 -18.213 0.978 480 HZ3 LYS 61 2HZ LYS 61 6.676 -16.705 0.737 481 H ASP 62 H ASP 62 -0.298 -17.594 -0.771 482 HA ASP 62 HA ASP 62 -1.036 -20.033 -2.020 483 HB2 ASP 62 1HB ASP 62 -1.642 -18.664 0.570 484 HB3 ASP 62 2HB ASP 62 -2.774 -19.907 0.065 485 H GLY 63 H GLY 63 -2.499 -16.925 -2.278 486 HA2 GLY 63 1HA GLY 63 -4.111 -16.380 -3.825 487 HA3 GLY 63 2HA GLY 63 -4.555 -18.063 -4.028 488 H LYS 64 H LYS 64 -4.493 -16.093 -0.963 489 HA LYS 64 HA LYS 64 -7.405 -16.244 -0.768 490 HB2 LYS 64 1HB LYS 64 -5.549 -17.310 1.421 491 HB3 LYS 64 2HB LYS 64 -7.285 -17.039 1.550 492 HG2 LYS 64 1HG LYS 64 -7.435 -18.647 -0.535 493 HG3 LYS 64 2HG LYS 64 -5.809 -19.137 -0.040 494 HD2 LYS 64 1HD LYS 64 -6.729 -19.720 2.215 495 HD3 LYS 64 2HD LYS 64 -8.327 -19.198 1.673 496 HE2 LYS 64 1HE LYS 64 -7.817 -20.930 -0.325 497 HE3 LYS 64 2HE LYS 64 -6.723 -21.627 0.866 498 HZ1 LYS 64 3HZ LYS 64 -9.641 -21.241 1.190 499 HZ2 LYS 64 1HZ LYS 64 -8.652 -21.819 2.366 500 HZ3 LYS 64 2HZ LYS 64 -8.849 -22.675 0.982 501 H ASN 65 H ASN 65 -8.165 -14.776 0.947 502 HA ASN 65 HA ASN 65 -6.863 -12.246 0.677 503 HB2 ASN 65 1HB ASN 65 -9.386 -12.798 1.049 504 HB3 ASN 65 2HB ASN 65 -8.979 -12.927 2.781 505 HD21 ASN 65 1HD2 ASN 65 -7.576 -10.756 3.497 506 HD22 ASN 65 2HD2 ASN 65 -8.486 -9.340 2.970 507 H LEU 66 H LEU 66 -4.826 -12.161 1.550 508 HA LEU 66 HA LEU 66 -3.951 -13.316 3.901 509 HB2 LEU 66 1HB LEU 66 -3.036 -10.768 2.535 510 HB3 LEU 66 2HB LEU 66 -2.176 -11.495 3.893 511 HG LEU 66 HG LEU 66 -2.684 -12.782 1.181 512 HD11 LEU 66 1HD1 LEU 66 -0.928 -11.122 1.044 513 HD12 LEU 66 2HD1 LEU 66 -0.087 -12.673 1.162 514 HD13 LEU 66 3HD1 LEU 66 -0.205 -11.643 2.582 515 HD21 LEU 66 3HD2 LEU 66 -2.698 -14.611 2.690 516 HD22 LEU 66 1HD2 LEU 66 -1.473 -13.892 3.751 517 HD23 LEU 66 2HD2 LEU 66 -1.021 -14.549 2.156 518 H LEU 67 H LEU 67 -5.498 -10.135 3.592 519 HA LEU 67 HA LEU 67 -5.159 -9.414 6.323 520 HB2 LEU 67 1HB LEU 67 -7.121 -8.526 4.168 521 HB3 LEU 67 2HB LEU 67 -7.157 -7.838 5.759 522 HG LEU 67 HG LEU 67 -4.603 -7.823 4.140 523 HD11 LEU 67 1HD1 LEU 67 -6.300 -6.809 2.691 524 HD12 LEU 67 2HD1 LEU 67 -5.255 -5.540 3.358 525 HD13 LEU 67 3HD1 LEU 67 -6.875 -5.799 4.035 526 HD21 LEU 67 3HD2 LEU 67 -5.645 -5.783 6.143 527 HD22 LEU 67 1HD2 LEU 67 -3.967 -6.058 5.575 528 HD23 LEU 67 2HD2 LEU 67 -4.754 -7.225 6.636 529 H TYR 68 H TYR 68 -7.121 -11.985 5.113 530 HA TYR 68 HA TYR 68 -8.533 -12.062 7.708 531 HB2 TYR 68 1HB TYR 68 -9.909 -11.654 5.527 532 HB3 TYR 68 2HB TYR 68 -9.510 -13.310 5.123 533 HD1 TYR 68 2HD TYR 68 -11.208 -11.106 7.618 534 HD2 TYR 68 1HD TYR 68 -10.766 -15.140 6.145 535 HE1 TYR 68 2HE TYR 68 -13.200 -11.790 8.907 536 HE2 TYR 68 1HE TYR 68 -12.765 -15.827 7.406 537 HH TYR 68 HH TYR 68 -14.521 -15.140 8.813 538 H ASN 69 H ASN 69 -5.789 -13.042 6.507 539 HA ASN 69 HA ASN 69 -6.115 -15.987 6.708 540 HB2 ASN 69 1HB ASN 69 -4.913 -15.219 4.738 541 HB3 ASN 69 2HB ASN 69 -3.803 -14.287 5.762 542 HD21 ASN 69 1HD2 ASN 69 -4.768 -17.651 6.689 543 HD22 ASN 69 2HD2 ASN 69 -3.171 -18.255 6.358 544 H GLY 70 H GLY 70 -3.927 -13.366 7.918 545 HA2 GLY 70 1HA GLY 70 -4.131 -14.036 10.611 546 HA3 GLY 70 2HA GLY 70 -2.821 -15.040 9.985 547 H THR 71 H THR 71 -1.573 -13.185 8.139 548 HA THR 71 HA THR 71 -0.097 -11.836 10.272 549 HB THR 71 HB THR 71 0.693 -11.771 7.367 550 HG1 THR 71 1HG THR 71 0.722 -13.979 9.096 551 HG21 THR 71 3HG2 THR 71 2.262 -12.001 9.981 552 HG22 THR 71 1HG2 THR 71 2.150 -10.569 8.937 553 HG23 THR 71 2HG2 THR 71 2.985 -12.004 8.365 554 H ALA 72 H ALA 72 -1.331 -10.769 7.009 555 HA ALA 72 HA ALA 72 -0.683 -8.020 7.564 556 HB1 ALA 72 1HB ALA 72 -2.596 -9.249 5.520 557 HB2 ALA 72 2HB ALA 72 -1.943 -7.596 5.493 558 HB3 ALA 72 3HB ALA 72 -0.852 -8.984 5.283 559 H LYS 73 H LYS 73 -1.813 -6.499 8.485 560 HA LYS 73 HA LYS 73 -4.728 -6.722 8.810 561 HB2 LYS 73 1HB LYS 73 -4.457 -5.710 11.117 562 HB3 LYS 73 2HB LYS 73 -4.159 -7.431 10.940 563 HG2 LYS 73 1HG LYS 73 -1.614 -6.053 10.661 564 HG3 LYS 73 2HG LYS 73 -2.444 -5.376 12.044 565 HD2 LYS 73 1HD LYS 73 -2.102 -8.379 11.628 566 HD3 LYS 73 2HD LYS 73 -0.941 -7.368 12.496 567 HE2 LYS 73 1HE LYS 73 -2.621 -6.702 14.123 568 HE3 LYS 73 2HE LYS 73 -3.888 -7.536 13.206 569 HZ1 LYS 73 3HZ LYS 73 -3.212 -8.807 15.097 570 HZ2 LYS 73 1HZ LYS 73 -1.647 -8.905 14.579 571 HZ3 LYS 73 2HZ LYS 73 -2.843 -9.640 13.755 572 H MET 74 H MET 74 -5.720 -4.644 8.686 573 HA MET 74 HA MET 74 -4.025 -2.303 8.160 574 HB2 MET 74 1HB MET 74 -6.410 -2.538 7.197 575 HB3 MET 74 2HB MET 74 -6.992 -2.548 8.839 576 HG2 MET 74 1HG MET 74 -5.158 -0.320 7.952 577 HG3 MET 74 2HG MET 74 -6.808 -0.342 7.358 578 HE1 MET 74 3HE MET 74 -8.588 -1.157 8.981 579 HE2 MET 74 1HE MET 74 -9.011 -0.037 10.321 580 HE3 MET 74 2HE MET 74 -8.787 0.586 8.664 581 H PHE 75 H PHE 75 -3.323 -1.060 9.924 582 HA PHE 75 HA PHE 75 -4.452 -1.632 12.631 583 HB2 PHE 75 1HB PHE 75 -2.263 -1.886 13.529 584 HB3 PHE 75 2HB PHE 75 -2.417 -3.013 12.195 585 HD1 PHE 75 1HD PHE 75 -1.294 -2.438 9.938 586 HD2 PHE 75 2HD PHE 75 -0.592 -0.186 13.562 587 HE1 PHE 75 1HE PHE 75 0.721 -1.373 8.916 588 HE2 PHE 75 2HE PHE 75 1.401 0.814 12.557 589 HZ PHE 75 HZ PHE 75 2.066 0.222 10.196 590 H LYS 76 H LYS 76 -4.161 0.780 10.391 591 HA LYS 76 HA LYS 76 -3.974 2.912 12.324 592 HB2 LYS 76 1HB LYS 76 -1.588 2.430 12.054 593 HB3 LYS 76 2HB LYS 76 -1.719 2.498 10.308 594 HG2 LYS 76 1HG LYS 76 -2.345 4.930 10.474 595 HG3 LYS 76 2HG LYS 76 -2.192 4.817 12.215 596 HD2 LYS 76 1HD LYS 76 0.264 3.899 11.647 597 HD3 LYS 76 2HD LYS 76 -0.056 4.620 10.090 598 HE2 LYS 76 1HE LYS 76 1.051 6.340 11.245 599 HE3 LYS 76 2HE LYS 76 -0.654 6.788 11.405 600 HZ1 LYS 76 3HZ LYS 76 -0.496 5.506 13.597 601 HZ2 LYS 76 1HZ LYS 76 0.235 6.958 13.555 602 HZ3 LYS 76 2HZ LYS 76 1.129 5.593 13.447 603 H SER 77 H SER 77 -5.202 4.593 11.474 604 HA SER 77 HA SER 77 -5.835 4.637 8.596 605 HB2 SER 77 1HB SER 77 -8.227 4.442 9.095 606 HB3 SER 77 2HB SER 77 -7.349 3.009 9.547 607 HG SER 77 HG SER 77 -8.280 4.849 11.434 608 H ASP 78 H ASP 78 -5.280 6.861 8.161 609 HA ASP 78 HA ASP 78 -5.967 8.814 10.327 610 HB2 ASP 78 1HB ASP 78 -3.520 8.463 9.080 611 HB3 ASP 78 2HB ASP 78 -4.269 9.671 8.077 612 H ALA 79 H ALA 79 -6.167 10.968 8.598 613 HA ALA 79 HA ALA 79 -8.269 10.184 6.629 614 HB1 ALA 79 1HB ALA 79 -9.746 11.856 7.349 615 HB2 ALA 79 2HB ALA 79 -9.212 11.088 8.837 616 HB3 ALA 79 3HB ALA 79 -8.518 12.657 8.367 617 H ILE 80 H ILE 80 -8.574 11.749 4.884 618 HA ILE 80 HA ILE 80 -6.347 13.671 4.482 619 HB ILE 80 HB ILE 80 -7.484 11.745 2.409 620 HG12 ILE 80 1HG1 ILE 80 -4.701 11.868 3.659 621 HG13 ILE 80 2HG1 ILE 80 -5.954 10.705 4.027 622 HG21 ILE 80 1HG2 ILE 80 -5.278 13.825 2.061 623 HG22 ILE 80 2HG2 ILE 80 -5.824 12.656 0.835 624 HG23 ILE 80 3HG2 ILE 80 -6.916 13.902 1.370 625 HD11 ILE 80 3HD1 ILE 80 -4.383 10.962 1.477 626 HD12 ILE 80 1HD1 ILE 80 -4.598 9.547 2.524 627 HD13 ILE 80 2HD1 ILE 80 -5.952 10.119 1.528 628 H LEU 81 H LEU 81 -6.926 15.415 3.344 629 HA LEU 81 HA LEU 81 -9.835 15.921 2.908 630 HB2 LEU 81 1HB LEU 81 -7.728 17.970 3.694 631 HB3 LEU 81 2HB LEU 81 -9.449 18.244 3.426 632 HG LEU 81 HG LEU 81 -8.265 16.557 5.669 633 HD11 LEU 81 1HD1 LEU 81 -7.846 18.898 6.063 634 HD12 LEU 81 2HD1 LEU 81 -9.180 18.405 7.099 635 HD13 LEU 81 3HD1 LEU 81 -9.511 19.345 5.631 636 HD21 LEU 81 3HD2 LEU 81 -10.482 15.724 4.962 637 HD22 LEU 81 1HD2 LEU 81 -11.156 17.345 5.115 638 HD23 LEU 81 2HD2 LEU 81 -10.551 16.494 6.537 639 H GLY 82 H GLY 82 -10.486 16.882 1.033 640 HA2 GLY 82 1HA GLY 82 -8.459 17.378 -1.105 641 HA3 GLY 82 2HA GLY 82 -10.203 17.214 -1.306 642 H GLN 83 H GLN 83 -8.043 19.199 0.739 643 HA GLN 83 HA GLN 83 -7.812 21.336 1.191 644 HB2 GLN 83 1HB GLN 83 -7.629 21.378 -1.373 645 HB3 GLN 83 2HB GLN 83 -9.267 22.023 -1.384 646 HG2 GLN 83 1HG GLN 83 -7.906 23.912 -1.502 647 HG3 GLN 83 2HG GLN 83 -8.409 23.866 0.185 648 HE21 GLN 83 1HE2 GLN 83 -6.651 24.329 1.599 649 HE22 GLN 83 2HE2 GLN 83 -5.011 23.870 1.277 650 H ASN 84 H ASN 84 -11.083 21.184 -0.240 651 HA ASN 84 HA ASN 84 -12.132 23.264 1.485 652 HB2 ASN 84 1HB ASN 84 -13.494 21.346 -0.458 653 HB3 ASN 84 2HB ASN 84 -14.301 22.686 0.343 654 HD21 ASN 84 1HD2 ASN 84 -13.781 22.205 -2.573 655 HD22 ASN 84 2HD2 ASN 84 -12.984 23.673 -3.109 656 H LYS 85 H LYS 85 -11.105 21.054 3.034 657 HA LYS 85 HA LYS 85 -11.467 19.443 4.535 658 HB2 LYS 85 1HB LYS 85 -14.032 20.932 5.167 659 HB3 LYS 85 2HB LYS 85 -13.207 19.755 6.197 660 HG2 LYS 85 1HG LYS 85 -11.141 21.244 6.102 661 HG3 LYS 85 2HG LYS 85 -12.146 22.457 5.303 662 HD2 LYS 85 1HD LYS 85 -12.168 23.134 7.526 663 HD3 LYS 85 2HD LYS 85 -13.701 22.260 7.370 664 HE2 LYS 85 1HE LYS 85 -12.552 20.230 8.344 665 HE3 LYS 85 2HE LYS 85 -11.073 21.183 8.531 666 HZ1 LYS 85 3HZ LYS 85 -12.336 21.120 10.589 667 HZ2 LYS 85 1HZ LYS 85 -13.658 21.757 9.839 668 HZ3 LYS 85 2HZ LYS 85 -12.304 22.649 10.046 669 H VAL 86 H VAL 86 -12.905 19.161 1.773 670 HA VAL 86 HA VAL 86 -14.936 17.252 2.167 671 HB VAL 86 HB VAL 86 -15.049 18.315 0.221 672 HG11 VAL 86 1HG1 VAL 86 -12.237 17.471 -0.250 673 HG12 VAL 86 2HG1 VAL 86 -13.269 18.229 -1.502 674 HG13 VAL 86 3HG1 VAL 86 -12.880 19.111 -0.012 675 HG21 VAL 86 3HG2 VAL 86 -15.092 16.565 -1.479 676 HG22 VAL 86 1HG2 VAL 86 -14.015 15.537 -0.520 677 HG23 VAL 86 2HG2 VAL 86 -15.658 15.901 0.054 678 H VAL 87 H VAL 87 -14.814 15.110 2.778 679 HA VAL 87 HA VAL 87 -12.231 13.904 3.328 680 HB VAL 87 HB VAL 87 -15.027 12.692 3.488 681 HG11 VAL 87 1HG1 VAL 87 -13.348 10.950 3.515 682 HG12 VAL 87 2HG1 VAL 87 -12.314 11.848 4.624 683 HG13 VAL 87 3HG1 VAL 87 -13.868 11.201 5.186 684 HG21 VAL 87 3HG2 VAL 87 -13.412 14.187 5.594 685 HG22 VAL 87 1HG2 VAL 87 -14.987 14.649 4.929 686 HG23 VAL 87 2HG2 VAL 87 -14.852 13.207 5.926 687 H ILE 88 H ILE 88 -11.316 13.948 1.195 688 HA ILE 88 HA ILE 88 -12.563 12.539 -1.012 689 HB ILE 88 HB ILE 88 -10.301 12.723 -2.076 690 HG12 ILE 88 1HG1 ILE 88 -9.474 14.308 0.387 691 HG13 ILE 88 2HG1 ILE 88 -8.929 12.674 0.040 692 HG21 ILE 88 1HG2 ILE 88 -11.448 15.273 -0.868 693 HG22 ILE 88 2HG2 ILE 88 -10.563 15.137 -2.412 694 HG23 ILE 88 3HG2 ILE 88 -12.150 14.397 -2.237 695 HD11 ILE 88 3HD1 ILE 88 -7.240 14.260 -0.752 696 HD12 ILE 88 1HD1 ILE 88 -7.972 13.441 -2.131 697 HD13 ILE 88 2HD1 ILE 88 -8.435 15.105 -1.730 698 H GLY 89 H GLY 89 -10.581 11.459 1.683 699 HA2 GLY 89 1HA GLY 89 -11.140 8.754 1.330 700 HA3 GLY 89 2HA GLY 89 -9.631 9.059 0.452 701 H TRP 90 H TRP 90 -8.910 7.443 2.157 702 HA TRP 90 HA TRP 90 -7.773 8.885 4.479 703 HB2 TRP 90 1HB TRP 90 -9.180 6.205 4.629 704 HB3 TRP 90 2HB TRP 90 -8.460 7.051 5.978 705 HD1 TRP 90 HD TRP 90 -10.014 8.933 7.120 706 HE1 TRP 90 1HE TRP 90 -12.503 9.596 6.843 707 HE3 TRP 90 3HE TRP 90 -11.079 6.357 2.823 708 HZ2 TRP 90 2HZ TRP 90 -14.703 8.916 5.087 709 HZ3 TRP 90 3HZ TRP 90 -13.358 6.445 1.837 710 HH2 TRP 90 HH TRP 90 -15.157 7.716 2.962 711 H ASP 91 H ASP 91 -5.717 7.907 5.021 712 HA ASP 91 HA ASP 91 -4.630 6.289 2.813 713 HB2 ASP 91 1HB ASP 91 -3.617 8.409 4.395 714 HB3 ASP 91 2HB ASP 91 -2.692 7.001 4.856 715 H LYS 92 H LYS 92 -5.383 4.196 3.107 716 HA LYS 92 HA LYS 92 -5.499 3.150 5.840 717 HB2 LYS 92 1HB LYS 92 -6.177 1.866 3.185 718 HB3 LYS 92 2HB LYS 92 -6.073 0.916 4.635 719 HG2 LYS 92 1HG LYS 92 -8.349 1.492 3.845 720 HG3 LYS 92 2HG LYS 92 -8.046 1.797 5.540 721 HD2 LYS 92 1HD LYS 92 -7.881 4.204 5.137 722 HD3 LYS 92 2HD LYS 92 -7.953 3.919 3.376 723 HE2 LYS 92 1HE LYS 92 -10.142 4.592 3.919 724 HE3 LYS 92 2HE LYS 92 -10.241 2.857 3.719 725 HZ1 LYS 92 3HZ LYS 92 -10.042 4.218 6.364 726 HZ2 LYS 92 1HZ LYS 92 -10.348 2.601 6.083 727 HZ3 LYS 92 2HZ LYS 92 -11.412 3.776 5.639 728 H TYR 93 H TYR 93 -3.701 2.611 6.819 729 HA TYR 93 HA TYR 93 -1.283 1.788 5.386 730 HB2 TYR 93 1HB TYR 93 -2.082 1.937 8.307 731 HB3 TYR 93 2HB TYR 93 -0.477 1.506 7.791 732 HD1 TYR 93 2HD TYR 93 -2.943 4.328 7.852 733 HD2 TYR 93 1HD TYR 93 1.150 3.143 7.151 734 HE1 TYR 93 2HE TYR 93 -2.238 6.676 8.085 735 HE2 TYR 93 1HE TYR 93 1.870 5.483 7.370 736 HH TYR 93 HH TYR 93 -0.277 8.085 8.451 737 H PHE 94 H PHE 94 -0.199 -0.306 5.788 738 HA PHE 94 HA PHE 94 -1.850 -2.502 6.902 739 HB2 PHE 94 1HB PHE 94 -0.742 -2.376 4.063 740 HB3 PHE 94 2HB PHE 94 -1.313 -3.858 4.830 741 HD1 PHE 94 2HD PHE 94 -3.729 -3.919 5.729 742 HD2 PHE 94 1HD PHE 94 -2.338 -0.849 3.050 743 HE1 PHE 94 2HE PHE 94 -6.078 -3.425 5.080 744 HE2 PHE 94 1HE PHE 94 -4.660 -0.298 2.489 745 HZ PHE 94 HZ PHE 94 -6.551 -1.582 3.478 746 H GLU 95 H GLU 95 -0.646 -4.279 7.645 747 HA GLU 95 HA GLU 95 2.318 -3.962 7.699 748 HB2 GLU 95 1HB GLU 95 0.930 -3.896 9.838 749 HB3 GLU 95 2HB GLU 95 0.521 -5.563 9.586 750 HG2 GLU 95 1HG GLU 95 2.884 -6.233 9.652 751 HG3 GLU 95 2HG GLU 95 3.399 -4.561 9.637 752 H ILE 96 H ILE 96 2.545 -5.061 5.539 753 HA ILE 96 HA ILE 96 1.410 -7.771 5.412 754 HB ILE 96 HB ILE 96 3.052 -6.304 3.322 755 HG12 ILE 96 1HG1 ILE 96 0.386 -6.138 2.488 756 HG13 ILE 96 2HG1 ILE 96 0.237 -5.787 4.190 757 HG21 ILE 96 1HG2 ILE 96 1.638 -7.792 1.803 758 HG22 ILE 96 2HG2 ILE 96 2.905 -8.559 2.739 759 HG23 ILE 96 3HG2 ILE 96 1.232 -8.713 3.282 760 HD11 ILE 96 3HD1 ILE 96 2.074 -4.445 2.171 761 HD12 ILE 96 1HD1 ILE 96 0.617 -3.739 2.869 762 HD13 ILE 96 2HD1 ILE 96 2.025 -4.015 3.906 763 HA PRO 97 HA PRO 97 5.618 -9.512 6.248 764 HB2 PRO 97 1HB PRO 97 5.208 -12.076 5.476 765 HB3 PRO 97 2HB PRO 97 4.669 -11.427 7.052 766 HG2 PRO 97 1HG PRO 97 3.052 -11.748 4.504 767 HG3 PRO 97 2HG PRO 97 2.595 -12.271 6.138 768 HD2 PRO 97 1HD PRO 97 1.734 -9.933 5.022 769 HD3 PRO 97 2HD PRO 97 2.091 -10.010 6.757 770 H MET 98 H MET 98 7.234 -9.290 4.575 771 HA MET 98 HA MET 98 6.576 -9.188 1.745 772 HB2 MET 98 1HB MET 98 9.238 -9.850 3.081 773 HB3 MET 98 2HB MET 98 8.990 -9.487 1.372 774 HG2 MET 98 1HG MET 98 8.198 -7.230 1.942 775 HG3 MET 98 2HG MET 98 8.385 -7.606 3.664 776 HE1 MET 98 3HE MET 98 9.868 -6.081 4.636 777 HE2 MET 98 1HE MET 98 11.302 -5.369 3.843 778 HE3 MET 98 2HE MET 98 9.677 -5.067 3.194 779 H ASP 99 H ASP 99 7.723 -11.646 3.998 780 HA ASP 99 HA ASP 99 8.499 -13.637 2.356 781 HB2 ASP 99 1HB ASP 99 8.452 -13.357 4.963 782 HB3 ASP 99 2HB ASP 99 7.004 -14.363 4.876 783 H ALA 100 H ALA 100 5.117 -13.118 3.404 784 HA ALA 100 HA ALA 100 4.157 -15.598 2.289 785 HB1 ALA 100 1HB ALA 100 3.199 -14.397 4.302 786 HB2 ALA 100 2HB ALA 100 2.416 -13.280 3.134 787 HB3 ALA 100 3HB ALA 100 2.033 -15.007 3.109 788 H LEU 101 H LEU 101 5.122 -12.995 0.473 789 HA LEU 101 HA LEU 101 2.691 -12.703 -1.175 790 HB2 LEU 101 1HB LEU 101 5.455 -11.471 -1.407 791 HB3 LEU 101 2HB LEU 101 4.061 -11.024 -2.391 792 HG LEU 101 HG LEU 101 4.183 -10.767 0.658 793 HD11 LEU 101 1HD1 LEU 101 4.448 -8.673 -1.506 794 HD12 LEU 101 2HD1 LEU 101 5.761 -9.359 -0.522 795 HD13 LEU 101 3HD1 LEU 101 4.481 -8.390 0.255 796 HD21 LEU 101 3HD2 LEU 101 2.085 -9.894 -1.364 797 HD22 LEU 101 1HD2 LEU 101 2.167 -9.304 0.297 798 HD23 LEU 101 2HD2 LEU 101 1.873 -11.014 0.001 799 H GLN 102 H GLN 102 2.715 -12.965 -3.532 800 HA GLN 102 HA GLN 102 3.485 -15.635 -4.105 801 HB2 GLN 102 1HB GLN 102 1.404 -14.249 -4.794 802 HB3 GLN 102 2HB GLN 102 2.441 -13.516 -6.027 803 HG2 GLN 102 1HG GLN 102 2.851 -15.681 -7.041 804 HG3 GLN 102 2HG GLN 102 2.036 -16.492 -5.687 805 HE21 GLN 102 1HE2 GLN 102 0.026 -17.266 -6.405 806 HE22 GLN 102 2HE2 GLN 102 -0.991 -16.393 -7.517 807 H ASP 103 H ASP 103 4.897 -12.515 -4.831 808 HA ASP 103 HA ASP 103 7.143 -13.716 -6.240 809 HB2 ASP 103 1HB ASP 103 7.015 -12.123 -8.092 810 HB3 ASP 103 2HB ASP 103 5.601 -13.191 -8.067 811 H ASN 104 H ASN 104 8.535 -11.355 -6.761 812 HA ASN 104 HA ASN 104 8.881 -10.318 -4.030 813 HB2 ASN 104 1HB ASN 104 10.565 -9.946 -6.526 814 HB3 ASN 104 2HB ASN 104 10.907 -9.258 -4.936 815 HD21 ASN 104 1HD2 ASN 104 11.730 -10.572 -3.264 816 HD22 ASN 104 2HD2 ASN 104 11.971 -12.303 -3.455 817 H SER 105 H SER 105 6.359 -9.570 -5.334 818 HA SER 105 HA SER 105 6.871 -6.657 -5.327 819 HB2 SER 105 1HB SER 105 5.511 -6.228 -7.162 820 HB3 SER 105 2HB SER 105 6.496 -7.598 -7.690 821 HG SER 105 HG SER 105 4.741 -8.997 -7.060 822 H ILE 106 H ILE 106 4.933 -5.433 -4.807 823 HA ILE 106 HA ILE 106 2.983 -6.971 -3.169 824 HB ILE 106 HB ILE 106 4.458 -5.598 -1.800 825 HG12 ILE 106 1HG1 ILE 106 2.915 -4.512 -0.440 826 HG13 ILE 106 2HG1 ILE 106 1.716 -4.329 -1.735 827 HG21 ILE 106 1HG2 ILE 106 5.050 -3.777 -3.300 828 HG22 ILE 106 2HG2 ILE 106 3.362 -3.221 -3.369 829 HG23 ILE 106 3HG2 ILE 106 4.267 -3.121 -1.856 830 HD11 ILE 106 3HD1 ILE 106 2.598 -6.959 -0.469 831 HD12 ILE 106 1HD1 ILE 106 1.115 -6.066 -0.071 832 HD13 ILE 106 2HD1 ILE 106 1.305 -6.774 -1.677 833 H GLN 107 H GLN 107 0.758 -6.303 -3.418 834 HA GLN 107 HA GLN 107 -0.001 -4.151 -5.180 835 HB2 GLN 107 1HB GLN 107 0.388 -5.865 -6.885 836 HB3 GLN 107 2HB GLN 107 -0.462 -7.079 -5.913 837 HG2 GLN 107 1HG GLN 107 -2.590 -5.922 -6.245 838 HG3 GLN 107 2HG GLN 107 -1.787 -4.598 -7.072 839 HE21 GLN 107 1HE2 GLN 107 -2.662 -4.751 -9.142 840 HE22 GLN 107 2HE2 GLN 107 -2.528 -6.217 -10.106 841 H ILE 108 H ILE 108 -2.160 -3.584 -4.712 842 HA ILE 108 HA ILE 108 -3.620 -5.231 -2.691 843 HB ILE 108 HB ILE 108 -3.700 -2.194 -3.048 844 HG12 ILE 108 1HG1 ILE 108 -2.379 -3.827 -0.840 845 HG13 ILE 108 2HG1 ILE 108 -1.518 -2.945 -2.081 846 HG21 ILE 108 1HG2 ILE 108 -5.007 -2.262 -0.904 847 HG22 ILE 108 2HG2 ILE 108 -5.832 -3.093 -2.190 848 HG23 ILE 108 3HG2 ILE 108 -4.953 -4.034 -0.957 849 HD11 ILE 108 3HD1 ILE 108 -3.162 -1.700 0.135 850 HD12 ILE 108 1HD1 ILE 108 -1.427 -1.598 -0.151 851 HD13 ILE 108 2HD1 ILE 108 -2.543 -0.800 -1.278 852 H LYS 109 H LYS 109 -6.011 -5.253 -3.104 853 HA LYS 109 HA LYS 109 -6.873 -3.746 -5.400 854 HB2 LYS 109 1HB LYS 109 -8.084 -5.651 -6.460 855 HB3 LYS 109 2HB LYS 109 -6.351 -5.708 -6.584 856 HG2 LYS 109 1HG LYS 109 -7.064 -7.241 -4.249 857 HG3 LYS 109 2HG LYS 109 -8.148 -7.682 -5.537 858 HD2 LYS 109 1HD LYS 109 -6.316 -9.177 -5.651 859 HD3 LYS 109 2HD LYS 109 -6.137 -8.111 -7.019 860 HE2 LYS 109 1HE LYS 109 -4.306 -6.944 -6.070 861 HE3 LYS 109 2HE LYS 109 -4.692 -7.510 -4.417 862 HZ1 LYS 109 3HZ LYS 109 -3.609 -9.182 -6.617 863 HZ2 LYS 109 1HZ LYS 109 -4.021 -9.759 -5.152 864 HZ3 LYS 109 2HZ LYS 109 -2.777 -8.713 -5.302 865 H ALA 110 H ALA 110 -9.292 -3.193 -5.234 866 HA ALA 110 HA ALA 110 -10.500 -4.121 -2.668 867 HB1 ALA 110 1HB ALA 110 -9.817 -1.242 -3.292 868 HB2 ALA 110 2HB ALA 110 -10.883 -1.779 -1.976 869 HB3 ALA 110 3HB ALA 110 -9.164 -2.221 -1.960 870 H LEU 111 H LEU 111 -12.769 -3.644 -2.521 871 HA LEU 111 HA LEU 111 -14.072 -3.675 -5.119 872 HB2 LEU 111 1HB LEU 111 -14.986 -4.895 -3.102 873 HB3 LEU 111 2HB LEU 111 -15.338 -3.312 -2.399 874 HG LEU 111 HG LEU 111 -16.692 -2.842 -4.589 875 HD11 LEU 111 1HD1 LEU 111 -16.691 -5.885 -4.743 876 HD12 LEU 111 2HD1 LEU 111 -15.784 -4.851 -5.848 877 HD13 LEU 111 3HD1 LEU 111 -17.540 -4.740 -5.796 878 HD21 LEU 111 3HD2 LEU 111 -17.757 -4.976 -2.718 879 HD22 LEU 111 1HD2 LEU 111 -18.695 -3.867 -3.741 880 HD23 LEU 111 2HD2 LEU 111 -17.734 -3.222 -2.395 881 H SER 112 H SER 112 -14.433 -2.003 -6.295 882 HA SER 112 HA SER 112 -14.615 0.756 -5.279 883 HB2 SER 112 1HB SER 112 -13.355 0.396 -7.297 884 HB3 SER 112 2HB SER 112 -14.638 -0.564 -8.003 885 HG SER 112 HG SER 112 -14.542 2.226 -7.534 886 H SER 113 H SER 113 -16.805 -0.956 -7.588 887 HA SER 113 HA SER 113 -19.084 -0.613 -5.780 888 HB2 SER 113 1HB SER 113 -18.879 1.588 -6.874 889 HB3 SER 113 2HB SER 113 -18.835 0.824 -8.465 890 HG SER 113 HG SER 113 -20.936 1.709 -7.371 891 H GLY 114 H GLY 114 -20.731 -2.017 -6.292 892 HA2 GLY 114 1HA GLY 114 -21.818 -3.800 -7.162 893 HA3 GLY 114 2HA GLY 114 -21.103 -3.436 -8.739 894 H THR 115 H THR 115 -19.303 -4.565 -9.444 895 HA THR 115 HA THR 115 -17.940 -6.316 -7.513 896 HB THR 115 HB THR 115 -18.156 -7.631 -10.119 897 HG1 THR 115 1HG THR 115 -20.201 -7.461 -10.412 898 HG21 THR 115 3HG2 THR 115 -17.362 -8.683 -8.023 899 HG22 THR 115 1HG2 THR 115 -18.805 -9.527 -8.642 900 HG23 THR 115 2HG2 THR 115 -18.949 -8.404 -7.276 901 H THR 116 H THR 116 -17.442 -3.677 -9.140 902 HA THR 116 HA THR 116 -15.045 -4.258 -10.703 903 HB THR 116 HB THR 116 -15.991 -1.730 -9.353 904 HG1 THR 116 1HG THR 116 -17.100 -2.723 -11.293 905 HG21 THR 116 3HG2 THR 116 -14.354 -0.516 -10.758 906 HG22 THR 116 1HG2 THR 116 -13.718 -2.066 -11.351 907 HG23 THR 116 2HG2 THR 116 -13.536 -1.601 -9.644 908 H PHE 117 H PHE 117 -13.287 -4.792 -9.868 909 HA PHE 117 HA PHE 117 -12.572 -4.167 -7.053 910 HB2 PHE 117 1HB PHE 117 -12.791 -6.673 -8.386 911 HB3 PHE 117 2HB PHE 117 -11.049 -6.389 -8.131 912 HD1 PHE 117 1HD PHE 117 -14.339 -6.982 -6.565 913 HD2 PHE 117 2HD PHE 117 -10.220 -5.997 -5.783 914 HE1 PHE 117 1HE PHE 117 -14.687 -7.440 -4.154 915 HE2 PHE 117 2HE PHE 117 -10.569 -6.454 -3.366 916 HZ PHE 117 HZ PHE 117 -12.822 -7.164 -2.553 917 H VAL 118 H VAL 118 -11.323 -2.372 -7.252 918 HA VAL 118 HA VAL 118 -9.746 -1.840 -9.658 919 HB VAL 118 HB VAL 118 -10.422 0.023 -8.250 920 HG11 VAL 118 1HG1 VAL 118 -9.222 -1.103 -5.886 921 HG12 VAL 118 2HG1 VAL 118 -9.730 0.594 -6.128 922 HG13 VAL 118 3HG1 VAL 118 -10.922 -0.690 -6.314 923 HG21 VAL 118 3HG2 VAL 118 -8.436 0.259 -9.578 924 HG22 VAL 118 1HG2 VAL 118 -8.490 1.339 -8.192 925 HG23 VAL 118 2HG2 VAL 118 -7.473 -0.152 -8.155 926 H TYR 119 H TYR 119 -7.899 -2.679 -10.126 927 HA TYR 119 HA TYR 119 -6.292 -4.036 -8.037 928 HB2 TYR 119 1HB TYR 119 -5.757 -3.857 -11.034 929 HB3 TYR 119 2HB TYR 119 -5.092 -5.015 -9.891 930 HD1 TYR 119 1HD TYR 119 -6.547 -6.859 -8.997 931 HD2 TYR 119 2HD TYR 119 -8.057 -4.065 -11.920 932 HE1 TYR 119 1HE TYR 119 -8.503 -8.304 -9.375 933 HE2 TYR 119 2HE TYR 119 -9.912 -5.594 -12.442 934 HH TYR 119 HH TYR 119 -10.910 -7.609 -11.998 935 H SER 120 H SER 120 -4.599 -2.961 -7.196 936 HA SER 120 HA SER 120 -3.881 -0.288 -8.090 937 HB2 SER 120 1HB SER 120 -2.662 -0.313 -6.211 938 HB3 SER 120 2HB SER 120 -3.651 -1.613 -5.780 939 HG SER 120 HG SER 120 -1.221 -2.301 -6.993 940 H GLN 121 H GLN 121 -1.340 -0.153 -8.674 941 HA GLN 121 HA GLN 121 -0.685 -1.815 -10.945 942 HB2 GLN 121 1HB GLN 121 1.451 -0.708 -10.900 943 HB3 GLN 121 2HB GLN 121 0.219 0.503 -10.601 944 HG2 GLN 121 1HG GLN 121 1.433 -0.759 -8.150 945 HG3 GLN 121 2HG GLN 121 2.518 0.139 -9.167 946 HE21 GLN 121 1HE2 GLN 121 2.384 2.362 -9.232 947 HE22 GLN 121 2HE2 GLN 121 1.366 3.258 -8.066 948 H LYS 122 H LYS 122 1.704 -2.806 -10.748 949 HA LYS 122 HA LYS 122 2.047 -4.441 -8.272 950 HB2 LYS 122 1HB LYS 122 1.893 -5.875 -10.176 951 HB3 LYS 122 2HB LYS 122 2.938 -4.858 -11.162 952 HG2 LYS 122 1HG LYS 122 4.039 -5.915 -8.613 953 HG3 LYS 122 2HG LYS 122 3.780 -7.102 -9.864 954 HD2 LYS 122 1HD LYS 122 5.271 -4.621 -10.706 955 HD3 LYS 122 2HD LYS 122 6.068 -5.692 -9.569 956 HE2 LYS 122 1HE LYS 122 6.717 -6.176 -11.859 957 HE3 LYS 122 2HE LYS 122 6.032 -7.555 -11.012 958 HZ1 LYS 122 3HZ LYS 122 4.039 -7.345 -12.245 959 HZ2 LYS 122 1HZ LYS 122 5.274 -7.308 -13.300 960 HZ3 LYS 122 2HZ LYS 122 4.508 -5.896 -12.940 961 H ILE 123 H ILE 123 3.965 -4.003 -7.105 962 HA ILE 123 HA ILE 123 5.956 -2.198 -8.289 963 HB ILE 123 HB ILE 123 5.009 -2.110 -5.399 964 HG12 ILE 123 1HG1 ILE 123 3.415 -0.921 -6.936 965 HG13 ILE 123 2HG1 ILE 123 4.108 0.042 -5.647 966 HG21 ILE 123 1HG2 ILE 123 6.533 -0.131 -5.169 967 HG22 ILE 123 2HG2 ILE 123 7.420 -1.623 -5.548 968 HG23 ILE 123 3HG2 ILE 123 7.119 -0.402 -6.807 969 HD11 ILE 123 3HD1 ILE 123 5.061 0.084 -8.529 970 HD12 ILE 123 1HD1 ILE 123 3.962 1.271 -7.780 971 HD13 ILE 123 2HD1 ILE 123 5.605 1.161 -7.218 972 H ASP 124 H ASP 124 7.397 -3.621 -8.818 973 HA ASP 124 HA ASP 124 8.066 -6.027 -7.306 974 HB2 ASP 124 1HB ASP 124 8.555 -4.971 -9.933 975 HB3 ASP 124 2HB ASP 124 10.121 -5.117 -9.158 976 H PHE 125 H PHE 125 9.896 -6.307 -5.893 977 HA PHE 125 HA PHE 125 11.588 -3.966 -5.420 978 HB2 PHE 125 1HB PHE 125 11.146 -3.988 -3.011 979 HB3 PHE 125 2HB PHE 125 9.666 -3.695 -3.889 980 HD1 PHE 125 2HD PHE 125 11.530 -6.275 -1.998 981 HD2 PHE 125 1HD PHE 125 7.685 -5.040 -3.523 982 HE1 PHE 125 2HE PHE 125 10.469 -7.986 -0.665 983 HE2 PHE 125 1HE PHE 125 6.602 -6.809 -2.172 984 HZ PHE 125 HZ PHE 125 7.971 -8.300 -0.726 985 H GLU 126 H GLU 126 13.406 -4.618 -3.670 986 HA GLU 126 HA GLU 126 14.367 -7.369 -4.223 987 HB2 GLU 126 1HB GLU 126 15.477 -4.697 -4.303 988 HB3 GLU 126 2HB GLU 126 16.512 -6.025 -3.676 989 HG2 GLU 126 1HG GLU 126 15.020 -6.247 -6.310 990 HG3 GLU 126 2HG GLU 126 16.473 -5.262 -6.192 991 H ARG 127 H ARG 127 15.253 -8.510 -2.499 992 HA ARG 127 HA ARG 127 14.116 -7.828 0.162 993 HB2 ARG 127 1HB ARG 127 14.744 -10.397 -1.339 994 HB3 ARG 127 2HB ARG 127 14.476 -10.395 0.399 995 HG2 ARG 127 1HG ARG 127 12.431 -9.338 -1.577 996 HG3 ARG 127 2HG ARG 127 12.552 -11.049 -1.152 997 HD2 ARG 127 1HD ARG 127 12.118 -8.814 0.853 998 HD3 ARG 127 2HD ARG 127 10.861 -9.825 0.136 999 HE ARG 127 HE ARG 127 12.775 -10.550 2.221 1000 HH11 ARG 127 1HH1 ARG 127 10.317 -11.795 -0.068 1001 HH12 ARG 127 2HH1 ARG 127 10.294 -13.379 0.601 1002 HH21 ARG 127 1HH2 ARG 127 12.632 -12.558 3.190 1003 HH22 ARG 127 2HH2 ARG 127 11.775 -13.868 2.439 1004 H GLU 128 H GLU 128 15.889 -6.576 0.744 1005 HA GLU 128 HA GLU 128 17.866 -5.978 1.603 1006 HB2 GLU 128 1HB GLU 128 18.120 -8.881 2.422 1007 HB3 GLU 128 2HB GLU 128 19.235 -7.586 2.897 1008 HG2 GLU 128 1HG GLU 128 17.572 -6.383 4.055 1009 HG3 GLU 128 2HG GLU 128 16.260 -7.322 3.359 Start of MODEL 2 1 H1 GLY 1 H GLY 1 -23.924 17.597 -0.606 2 HA2 GLY 1 1HA GLY 1 -23.661 15.232 -0.138 3 HA3 GLY 1 2HA GLY 1 -22.635 15.705 -1.508 4 H ALA 2 H ALA 2 -20.611 14.849 -1.367 5 HA ALA 2 HA ALA 2 -18.878 13.703 -0.581 6 HB1 ALA 2 1HB ALA 2 -17.547 14.641 1.230 7 HB2 ALA 2 2HB ALA 2 -18.075 15.891 0.085 8 HB3 ALA 2 3HB ALA 2 -18.873 15.737 1.675 9 H GLU 3 H GLU 3 -21.344 12.631 -0.094 10 HA GLU 3 HA GLU 3 -21.418 11.206 2.420 11 HB2 GLU 3 1HB GLU 3 -22.514 10.306 -0.263 12 HB3 GLU 3 2HB GLU 3 -23.062 9.853 1.349 13 HG2 GLU 3 1HG GLU 3 -24.732 11.303 0.881 14 HG3 GLU 3 2HG GLU 3 -23.605 12.460 1.572 15 H ALA 4 H ALA 4 -21.282 8.675 2.107 16 HA ALA 4 HA ALA 4 -18.588 7.904 1.515 17 HB1 ALA 4 1HB ALA 4 -19.866 6.896 3.322 18 HB2 ALA 4 2HB ALA 4 -20.996 6.191 2.138 19 HB3 ALA 4 3HB ALA 4 -19.303 5.680 2.146 20 H LEU 5 H LEU 5 -18.898 8.848 -0.801 21 HA LEU 5 HA LEU 5 -19.739 7.189 -2.861 22 HB2 LEU 5 1HB LEU 5 -18.246 8.550 -4.239 23 HB3 LEU 5 2HB LEU 5 -19.550 9.327 -3.560 24 HG LEU 5 HG LEU 5 -18.072 10.109 -2.252 25 HD11 LEU 5 1HD1 LEU 5 -16.371 7.999 -3.327 26 HD12 LEU 5 2HD1 LEU 5 -16.686 8.435 -1.649 27 HD13 LEU 5 3HD1 LEU 5 -15.502 9.412 -2.517 28 HD21 LEU 5 3HD2 LEU 5 -16.405 11.405 -3.736 29 HD22 LEU 5 1HD2 LEU 5 -18.159 11.490 -4.105 30 HD23 LEU 5 2HD2 LEU 5 -17.141 10.417 -5.046 31 HA PRO 6 HA PRO 6 -16.971 3.866 -2.713 32 HB2 PRO 6 1HB PRO 6 -17.259 2.748 -5.172 33 HB3 PRO 6 2HB PRO 6 -18.627 2.890 -4.010 34 HG2 PRO 6 1HG PRO 6 -18.053 4.588 -6.436 35 HG3 PRO 6 2HG PRO 6 -19.615 4.001 -5.771 36 HD2 PRO 6 1HD PRO 6 -18.429 6.575 -5.299 37 HD3 PRO 6 2HD PRO 6 -19.809 5.854 -4.392 38 H LEU 7 H LEU 7 -15.113 2.973 -3.604 39 HA LEU 7 HA LEU 7 -12.941 4.608 -4.059 40 HB2 LEU 7 1HB LEU 7 -13.038 2.133 -3.376 41 HB3 LEU 7 2HB LEU 7 -13.125 1.753 -5.077 42 HG LEU 7 HG LEU 7 -10.940 2.955 -5.444 43 HD11 LEU 7 1HD1 LEU 7 -10.743 4.423 -3.601 44 HD12 LEU 7 2HD1 LEU 7 -9.577 3.186 -3.262 45 HD13 LEU 7 3HD1 LEU 7 -11.154 3.191 -2.405 46 HD21 LEU 7 3HD2 LEU 7 -9.594 1.136 -4.448 47 HD22 LEU 7 1HD2 LEU 7 -11.050 0.529 -5.261 48 HD23 LEU 7 2HD2 LEU 7 -11.013 0.619 -3.498 49 H TYR 8 H TYR 8 -12.413 5.934 -5.734 50 HA TYR 8 HA TYR 8 -12.685 4.887 -8.526 51 HB2 TYR 8 1HB TYR 8 -12.423 7.423 -9.071 52 HB3 TYR 8 2HB TYR 8 -13.954 6.748 -8.587 53 HD1 TYR 8 2HD TYR 8 -11.119 8.868 -7.408 54 HD2 TYR 8 1HD TYR 8 -15.108 7.444 -6.652 55 HE1 TYR 8 2HE TYR 8 -11.374 10.552 -5.614 56 HE2 TYR 8 1HE TYR 8 -15.442 9.122 -4.946 57 HH TYR 8 HH TYR 8 -13.089 11.736 -4.291 58 H TYR 9 H TYR 9 -10.300 5.166 -6.167 59 HA TYR 9 HA TYR 9 -8.220 5.141 -8.269 60 HB2 TYR 9 1HB TYR 9 -8.458 7.493 -7.513 61 HB3 TYR 9 2HB TYR 9 -8.115 6.906 -5.883 62 HD1 TYR 9 1HD TYR 9 -6.629 6.907 -9.335 63 HD2 TYR 9 2HD TYR 9 -5.901 6.801 -5.096 64 HE1 TYR 9 1HE TYR 9 -4.223 7.260 -9.749 65 HE2 TYR 9 2HE TYR 9 -3.525 7.397 -5.480 66 HH TYR 9 HH TYR 9 -2.118 7.344 -8.741 67 H LEU 10 H LEU 10 -6.500 3.789 -7.687 68 HA LEU 10 HA LEU 10 -6.184 2.950 -4.905 69 HB2 LEU 10 1HB LEU 10 -7.815 1.326 -5.927 70 HB3 LEU 10 2HB LEU 10 -6.716 1.032 -7.220 71 HG LEU 10 HG LEU 10 -5.740 -0.550 -6.139 72 HD11 LEU 10 1HD1 LEU 10 -5.080 -0.755 -3.781 73 HD12 LEU 10 2HD1 LEU 10 -5.892 0.779 -3.445 74 HD13 LEU 10 3HD1 LEU 10 -4.434 0.742 -4.460 75 HD21 LEU 10 3HD2 LEU 10 -6.901 -1.765 -4.517 76 HD22 LEU 10 1HD2 LEU 10 -8.019 -1.102 -5.718 77 HD23 LEU 10 2HD2 LEU 10 -7.915 -0.350 -4.105 78 H GLN 11 H GLN 11 -4.095 3.526 -4.676 79 HA GLN 11 HA GLN 11 -2.073 2.464 -6.562 80 HB2 GLN 11 1HB GLN 11 -2.858 5.175 -6.584 81 HB3 GLN 11 2HB GLN 11 -1.404 5.156 -5.640 82 HG2 GLN 11 1HG GLN 11 -0.423 5.457 -7.620 83 HG3 GLN 11 2HG GLN 11 -0.503 3.703 -7.715 84 HE21 GLN 11 1HE2 GLN 11 -3.163 3.171 -8.630 85 HE22 GLN 11 2HE2 GLN 11 -3.388 4.060 -10.107 86 H ILE 12 H ILE 12 -0.039 2.135 -5.591 87 HA ILE 12 HA ILE 12 -0.123 1.667 -2.785 88 HB ILE 12 HB ILE 12 2.303 1.753 -4.589 89 HG12 ILE 12 1HG1 ILE 12 0.766 0.099 -5.481 90 HG13 ILE 12 2HG1 ILE 12 2.140 -0.691 -4.734 91 HG21 ILE 12 1HG2 ILE 12 2.986 -0.007 -2.644 92 HG22 ILE 12 2HG2 ILE 12 3.189 1.738 -2.408 93 HG23 ILE 12 3HG2 ILE 12 1.790 0.947 -1.739 94 HD11 ILE 12 3HD1 ILE 12 -0.718 -0.455 -3.637 95 HD12 ILE 12 1HD1 ILE 12 0.190 -1.912 -4.110 96 HD13 ILE 12 2HD1 ILE 12 0.675 -1.064 -2.678 97 H THR 13 H THR 13 1.178 4.493 -4.628 98 HA THR 13 HA THR 13 1.728 6.510 -3.993 99 HB THR 13 HB THR 13 -0.037 6.009 -1.602 100 HG1 THR 13 1HG THR 13 -0.650 6.746 -4.272 101 HG21 THR 13 3HG2 THR 13 0.502 8.516 -3.231 102 HG22 THR 13 1HG2 THR 13 1.086 8.222 -1.592 103 HG23 THR 13 2HG2 THR 13 -0.649 8.372 -1.883 104 H GLY 14 H GLY 14 2.171 4.699 -0.836 105 HA2 GLY 14 1HA GLY 14 4.976 5.619 -0.948 106 HA3 GLY 14 2HA GLY 14 4.087 5.961 0.545 107 H ILE 15 H ILE 15 6.389 4.241 0.297 108 HA ILE 15 HA ILE 15 5.258 1.797 1.469 109 HB ILE 15 HB ILE 15 5.482 1.346 -0.970 110 HG12 ILE 15 1HG1 ILE 15 7.417 -0.316 0.673 111 HG13 ILE 15 2HG1 ILE 15 5.663 -0.458 0.765 112 HG21 ILE 15 1HG2 ILE 15 7.680 2.814 -1.103 113 HG22 ILE 15 2HG2 ILE 15 8.506 1.342 -0.664 114 HG23 ILE 15 3HG2 ILE 15 7.535 1.392 -2.159 115 HD11 ILE 15 3HD1 ILE 15 5.488 -1.247 -1.461 116 HD12 ILE 15 1HD1 ILE 15 7.167 -0.799 -1.876 117 HD13 ILE 15 2HD1 ILE 15 6.851 -2.126 -0.773 118 H THR 16 H THR 16 6.716 0.811 2.950 119 HA THR 16 HA THR 16 9.473 1.414 2.853 120 HB THR 16 HB THR 16 8.856 3.500 3.933 121 HG1 THR 16 1HG THR 16 9.975 1.975 6.030 122 HG21 THR 16 3HG2 THR 16 6.756 2.749 5.088 123 HG22 THR 16 1HG2 THR 16 7.851 3.706 6.090 124 HG23 THR 16 2HG2 THR 16 7.770 1.944 6.300 125 H SER 17 H SER 17 10.453 0.388 5.071 126 HA SER 17 HA SER 17 8.676 -1.644 6.150 127 HB2 SER 17 1HB SER 17 10.223 -2.804 4.515 128 HB3 SER 17 2HB SER 17 11.586 -2.226 5.502 129 HG SER 17 HG SER 17 9.406 -3.792 6.454 130 H ASP 18 H ASP 18 9.850 -2.451 8.207 131 HA ASP 18 HA ASP 18 10.315 -0.292 10.054 132 HB2 ASP 18 1HB ASP 18 9.338 -2.318 10.866 133 HB3 ASP 18 2HB ASP 18 10.635 -3.287 10.173 134 H GLY 19 H GLY 19 12.471 -2.805 8.487 135 HA2 GLY 19 1HA GLY 19 14.864 -1.722 9.494 136 HA3 GLY 19 2HA GLY 19 14.667 -2.885 8.191 137 H ASN 20 H ASN 20 13.107 0.229 7.648 138 HA ASN 20 HA ASN 20 15.423 1.020 5.967 139 HB2 ASN 20 1HB ASN 20 12.961 0.164 4.888 140 HB3 ASN 20 2HB ASN 20 12.854 1.937 4.809 141 HD21 ASN 20 1HD2 ASN 20 12.866 1.099 2.366 142 HD22 ASN 20 2HD2 ASN 20 14.450 0.933 1.636 143 H ASP 21 H ASP 21 14.426 1.940 8.646 144 HA ASP 21 HA ASP 21 14.304 3.846 9.830 145 HB2 ASP 21 1HB ASP 21 16.217 4.432 8.104 146 HB3 ASP 21 2HB ASP 21 15.058 5.591 7.490 147 H PHE 22 H PHE 22 12.033 2.891 8.145 148 HA PHE 22 HA PHE 22 9.905 3.409 7.594 149 HB2 PHE 22 1HB PHE 22 10.320 5.529 9.715 150 HB3 PHE 22 2HB PHE 22 8.793 5.202 8.941 151 HD1 PHE 22 2HD PHE 22 11.487 2.961 10.518 152 HD2 PHE 22 1HD PHE 22 7.303 4.092 10.314 153 HE1 PHE 22 2HE PHE 22 10.928 1.181 12.081 154 HE2 PHE 22 1HE PHE 22 6.786 2.367 11.999 155 HZ PHE 22 HZ PHE 22 8.569 0.838 12.797 156 H ALA 23 H ALA 23 12.144 4.629 6.039 157 HA ALA 23 HA ALA 23 11.375 7.137 5.029 158 HB1 ALA 23 1HB ALA 23 13.099 4.934 3.928 159 HB2 ALA 23 2HB ALA 23 12.946 6.548 3.181 160 HB3 ALA 23 3HB ALA 23 13.613 6.369 4.813 161 H TRP 24 H TRP 24 9.160 7.173 4.539 162 HA TRP 24 HA TRP 24 7.678 5.218 3.285 163 HB2 TRP 24 1HB TRP 24 7.322 8.170 3.850 164 HB3 TRP 24 2HB TRP 24 6.154 7.393 2.817 165 HD1 TRP 24 HD TRP 24 6.654 8.051 6.334 166 HE1 TRP 24 1HE TRP 24 5.136 6.596 7.769 167 HE3 TRP 24 3HE TRP 24 5.408 4.618 2.803 168 HZ2 TRP 24 2HZ TRP 24 3.684 4.091 7.424 169 HZ3 TRP 24 3HZ TRP 24 4.037 2.624 3.381 170 HH2 TRP 24 HH TRP 24 3.172 2.353 5.695 171 H ASP 25 H ASP 25 9.798 7.148 1.624 172 HA ASP 25 HA ASP 25 10.094 7.778 -0.611 173 HB2 ASP 25 1HB ASP 25 9.829 4.859 -0.237 174 HB3 ASP 25 2HB ASP 25 9.593 5.389 -1.899 175 H ASN 26 H ASN 26 8.599 9.309 -1.351 176 HA ASN 26 HA ASN 26 5.834 8.599 -1.891 177 HB2 ASN 26 1HB ASN 26 7.515 11.071 -2.297 178 HB3 ASN 26 2HB ASN 26 6.111 10.847 -3.334 179 HD21 ASN 26 1HD2 ASN 26 6.475 10.017 0.212 180 HD22 ASN 26 2HD2 ASN 26 5.069 10.972 0.663 181 H LEU 27 H LEU 27 5.471 7.088 -3.339 182 HA LEU 27 HA LEU 27 7.239 6.509 -5.478 183 HB2 LEU 27 1HB LEU 27 4.380 5.556 -5.074 184 HB3 LEU 27 2HB LEU 27 5.625 4.758 -6.046 185 HG LEU 27 HG LEU 27 5.688 5.149 -3.022 186 HD11 LEU 27 1HD1 LEU 27 5.315 2.802 -2.847 187 HD12 LEU 27 2HD1 LEU 27 5.251 2.631 -4.611 188 HD13 LEU 27 3HD1 LEU 27 4.003 3.568 -3.749 189 HD21 LEU 27 3HD2 LEU 27 7.651 3.581 -4.752 190 HD22 LEU 27 1HD2 LEU 27 7.676 3.754 -2.997 191 HD23 LEU 27 2HD2 LEU 27 7.996 5.141 -3.975 192 H THR 28 H THR 28 7.161 6.820 -7.606 193 HA THR 28 HA THR 28 5.899 9.111 -8.597 194 HB THR 28 HB THR 28 6.590 7.426 -10.813 195 HG1 THR 28 1HG THR 28 8.528 6.633 -10.283 196 HG21 THR 28 3HG2 THR 28 8.180 9.550 -9.316 197 HG22 THR 28 1HG2 THR 28 7.042 9.867 -10.637 198 HG23 THR 28 2HG2 THR 28 8.550 8.982 -10.944 199 H SER 29 H SER 29 4.378 9.368 -10.292 200 HA SER 29 HA SER 29 1.929 8.541 -9.485 201 HB2 SER 29 1HB SER 29 2.636 9.542 -12.264 202 HB3 SER 29 2HB SER 29 1.172 9.856 -11.327 203 HG SER 29 HG SER 29 2.441 11.600 -11.190 204 H SER 30 H SER 30 3.964 6.928 -11.840 205 HA SER 30 HA SER 30 1.903 4.868 -12.337 206 HB2 SER 30 1HB SER 30 2.533 4.934 -14.749 207 HB3 SER 30 2HB SER 30 1.646 6.341 -14.160 208 HG SER 30 HG SER 30 4.096 7.098 -13.877 209 H GLN 31 H GLN 31 4.346 5.023 -10.610 210 HA GLN 31 HA GLN 31 6.585 3.692 -11.724 211 HB2 GLN 31 1HB GLN 31 6.277 4.898 -9.425 212 HB3 GLN 31 2HB GLN 31 5.659 3.383 -8.839 213 HG2 GLN 31 1HG GLN 31 7.664 2.353 -8.950 214 HG3 GLN 31 2HG GLN 31 8.236 3.197 -10.342 215 HE21 GLN 31 1HE2 GLN 31 7.567 3.886 -6.867 216 HE22 GLN 31 2HE2 GLN 31 8.976 4.953 -6.681 217 H THR 32 H THR 32 7.339 1.549 -11.589 218 HA THR 32 HA THR 32 5.255 -0.560 -11.268 219 HB THR 32 HB THR 32 6.453 -1.675 -13.185 220 HG1 THR 32 1HG THR 32 8.349 -0.608 -13.257 221 HG21 THR 32 3HG2 THR 32 4.349 -0.546 -13.566 222 HG22 THR 32 1HG2 THR 32 5.416 -0.292 -14.943 223 HG23 THR 32 2HG2 THR 32 5.170 1.039 -13.788 224 H LYS 33 H LYS 33 8.232 0.628 -10.094 225 HA LYS 33 HA LYS 33 8.764 -1.991 -8.854 226 HB2 LYS 33 1HB LYS 33 10.101 -1.488 -11.123 227 HB3 LYS 33 2HB LYS 33 11.137 -0.543 -10.048 228 HG2 LYS 33 1HG LYS 33 10.392 -3.256 -9.086 229 HG3 LYS 33 2HG LYS 33 11.298 -3.252 -10.589 230 HD2 LYS 33 1HD LYS 33 13.185 -2.185 -9.625 231 HD3 LYS 33 2HD LYS 33 12.341 -1.837 -8.098 232 HE2 LYS 33 1HE LYS 33 12.142 -4.177 -7.553 233 HE3 LYS 33 2HE LYS 33 12.626 -4.662 -9.178 234 HZ1 LYS 33 3HZ LYS 33 14.435 -3.350 -7.253 235 HZ2 LYS 33 1HZ LYS 33 14.799 -3.859 -8.778 236 HZ3 LYS 33 2HZ LYS 33 14.379 -4.970 -7.650 237 H ALA 34 H ALA 34 10.278 -1.878 -7.077 238 HA ALA 34 HA ALA 34 9.512 0.231 -5.390 239 HB1 ALA 34 1HB ALA 34 11.736 -1.847 -5.061 240 HB2 ALA 34 2HB ALA 34 11.077 -0.868 -3.745 241 HB3 ALA 34 3HB ALA 34 10.031 -2.032 -4.580 242 HA PRO 35 HA PRO 35 12.852 3.188 -5.953 243 HB2 PRO 35 1HB PRO 35 13.202 4.115 -3.382 244 HB3 PRO 35 2HB PRO 35 11.800 4.573 -4.408 245 HG2 PRO 35 1HG PRO 35 11.929 2.330 -2.369 246 HG3 PRO 35 2HG PRO 35 10.685 3.602 -2.494 247 HD2 PRO 35 1HD PRO 35 10.240 1.219 -3.500 248 HD3 PRO 35 2HD PRO 35 9.813 2.652 -4.477 249 H ASN 36 H ASN 36 13.168 0.564 -3.417 250 HA ASN 36 HA ASN 36 16.060 0.515 -3.772 251 HB2 ASN 36 1HB ASN 36 14.798 2.202 -1.771 252 HB3 ASN 36 2HB ASN 36 15.506 0.833 -0.932 253 HD21 ASN 36 1HD2 ASN 36 16.190 3.871 -2.190 254 HD22 ASN 36 2HD2 ASN 36 17.864 3.693 -2.587 255 H VAL 37 H VAL 37 16.962 -1.116 -2.073 256 HA VAL 37 HA VAL 37 15.251 -3.451 -1.889 257 HB VAL 37 HB VAL 37 17.854 -2.959 -0.374 258 HG11 VAL 37 1HG1 VAL 37 17.916 -5.426 -0.277 259 HG12 VAL 37 2HG1 VAL 37 16.418 -4.823 0.439 260 HG13 VAL 37 3HG1 VAL 37 16.401 -5.520 -1.196 261 HG21 VAL 37 3HG2 VAL 37 18.927 -4.406 -2.129 262 HG22 VAL 37 1HG2 VAL 37 17.485 -4.217 -3.122 263 HG23 VAL 37 2HG2 VAL 37 18.456 -2.790 -2.730 264 H LEU 38 H LEU 38 13.578 -3.431 -0.616 265 HA LEU 38 HA LEU 38 13.389 -1.846 1.863 266 HB2 LEU 38 1HB LEU 38 11.511 -3.930 0.696 267 HB3 LEU 38 2HB LEU 38 11.162 -2.849 2.055 268 HG LEU 38 HG LEU 38 11.611 -2.059 -0.879 269 HD11 LEU 38 1HD1 LEU 38 9.142 -1.970 0.890 270 HD12 LEU 38 2HD1 LEU 38 9.422 -3.001 -0.522 271 HD13 LEU 38 3HD1 LEU 38 9.284 -1.263 -0.742 272 HD21 LEU 38 3HD2 LEU 38 10.958 0.246 -0.109 273 HD22 LEU 38 1HD2 LEU 38 12.540 -0.299 0.436 274 HD23 LEU 38 2HD2 LEU 38 11.149 -0.307 1.570 275 H LYS 39 H LYS 39 14.903 -2.606 3.258 276 HA LYS 39 HA LYS 39 15.509 -5.408 3.672 277 HB2 LYS 39 1HB LYS 39 15.859 -3.178 5.716 278 HB3 LYS 39 2HB LYS 39 16.724 -4.685 5.648 279 HG2 LYS 39 1HG LYS 39 18.347 -3.487 4.619 280 HG3 LYS 39 2HG LYS 39 17.359 -3.645 3.161 281 HD2 LYS 39 1HD LYS 39 16.129 -1.482 4.090 282 HD3 LYS 39 2HD LYS 39 17.554 -1.324 5.116 283 HE2 LYS 39 1HE LYS 39 18.398 -1.807 2.380 284 HE3 LYS 39 2HE LYS 39 17.152 -0.541 2.380 285 HZ1 LYS 39 3HZ LYS 39 19.623 -0.548 3.981 286 HZ2 LYS 39 1HZ LYS 39 18.458 0.645 4.031 287 HZ3 LYS 39 2HZ LYS 39 19.322 0.384 2.661 288 H GLY 40 H GLY 40 15.124 -6.461 5.903 289 HA2 GLY 40 1HA GLY 40 13.821 -6.677 7.874 290 HA3 GLY 40 2HA GLY 40 12.734 -5.420 7.303 291 H ASN 41 H ASN 41 11.032 -6.706 7.779 292 HA ASN 41 HA ASN 41 10.181 -8.689 5.718 293 HB2 ASN 41 1HB ASN 41 10.934 -10.038 7.597 294 HB3 ASN 41 2HB ASN 41 10.094 -8.985 8.743 295 HD21 ASN 41 1HD2 ASN 41 9.244 -10.933 5.811 296 HD22 ASN 41 2HD2 ASN 41 7.872 -11.704 6.612 297 H LYS 42 H LYS 42 9.342 -6.291 8.261 298 HA LYS 42 HA LYS 42 6.491 -6.579 7.796 299 HB2 LYS 42 1HB LYS 42 8.016 -4.387 9.305 300 HB3 LYS 42 2HB LYS 42 6.272 -4.637 9.314 301 HG2 LYS 42 1HG LYS 42 8.347 -6.558 10.422 302 HG3 LYS 42 2HG LYS 42 7.246 -5.526 11.341 303 HD2 LYS 42 1HD LYS 42 5.322 -6.780 10.261 304 HD3 LYS 42 2HD LYS 42 6.503 -7.935 9.606 305 HE2 LYS 42 1HE LYS 42 6.835 -8.946 11.612 306 HE3 LYS 42 2HE LYS 42 6.920 -7.398 12.457 307 HZ1 LYS 42 3HZ LYS 42 4.460 -7.302 12.312 308 HZ2 LYS 42 1HZ LYS 42 5.003 -8.475 13.274 309 HZ3 LYS 42 2HZ LYS 42 4.423 -8.860 11.804 310 H LEU 43 H LEU 43 5.694 -5.965 5.899 311 HA LEU 43 HA LEU 43 7.015 -3.837 4.359 312 HB2 LEU 43 1HB LEU 43 6.304 -6.315 3.618 313 HB3 LEU 43 2HB LEU 43 4.737 -5.528 3.317 314 HG LEU 43 HG LEU 43 7.429 -4.834 2.082 315 HD11 LEU 43 1HD1 LEU 43 6.248 -6.881 1.213 316 HD12 LEU 43 2HD1 LEU 43 6.389 -5.599 0.004 317 HD13 LEU 43 3HD1 LEU 43 4.837 -5.868 0.838 318 HD21 LEU 43 3HD2 LEU 43 5.899 -3.347 0.623 319 HD22 LEU 43 1HD2 LEU 43 6.359 -2.732 2.229 320 HD23 LEU 43 2HD2 LEU 43 4.764 -3.481 1.967 321 H TYR 44 H TYR 44 6.249 -1.823 4.839 322 HA TYR 44 HA TYR 44 3.444 -1.466 5.730 323 HB2 TYR 44 1HB TYR 44 5.815 0.422 5.838 324 HB3 TYR 44 2HB TYR 44 4.242 0.665 6.553 325 HD1 TYR 44 1HD TYR 44 3.667 -1.936 7.917 326 HD2 TYR 44 2HD TYR 44 7.297 0.379 7.713 327 HE1 TYR 44 1HE TYR 44 4.380 -2.855 10.071 328 HE2 TYR 44 2HE TYR 44 7.981 -0.485 9.880 329 HH TYR 44 HH TYR 44 7.433 -1.917 11.681 330 H VAL 45 H VAL 45 2.032 -0.743 4.230 331 HA VAL 45 HA VAL 45 2.991 0.594 1.725 332 HB VAL 45 HB VAL 45 0.634 -1.305 1.962 333 HG11 VAL 45 1HG1 VAL 45 0.722 0.148 -0.018 334 HG12 VAL 45 2HG1 VAL 45 2.289 -0.623 -0.416 335 HG13 VAL 45 3HG1 VAL 45 0.794 -1.589 -0.384 336 HG21 VAL 45 3HG2 VAL 45 3.437 -2.016 1.085 337 HG22 VAL 45 1HG2 VAL 45 2.660 -2.632 2.578 338 HG23 VAL 45 2HG2 VAL 45 2.027 -3.083 0.986 339 H LYS 46 H LYS 46 2.197 2.706 1.649 340 HA LYS 46 HA LYS 46 -0.226 3.400 3.268 341 HB2 LYS 46 1HB LYS 46 1.864 4.508 3.864 342 HB3 LYS 46 2HB LYS 46 2.098 5.084 2.213 343 HG2 LYS 46 1HG LYS 46 -0.442 5.891 3.603 344 HG3 LYS 46 2HG LYS 46 1.039 6.491 4.311 345 HD2 LYS 46 1HD LYS 46 0.194 7.017 1.445 346 HD3 LYS 46 2HD LYS 46 0.029 8.105 2.821 347 HE2 LYS 46 1HE LYS 46 2.298 8.523 3.000 348 HE3 LYS 46 2HE LYS 46 2.764 7.030 2.201 349 HZ1 LYS 46 3HZ LYS 46 3.083 9.087 0.847 350 HZ2 LYS 46 1HZ LYS 46 1.479 9.307 0.767 351 HZ3 LYS 46 2HZ LYS 46 2.137 7.972 0.097 352 H ALA 47 H ALA 47 -1.591 2.454 1.665 353 HA ALA 47 HA ALA 47 -1.254 3.233 -1.139 354 HB1 ALA 47 1HB ALA 47 -2.987 1.141 0.178 355 HB2 ALA 47 2HB ALA 47 -2.796 1.368 -1.567 356 HB3 ALA 47 3HB ALA 47 -1.402 0.891 -0.588 357 H ARG 48 H ARG 48 -2.254 5.239 -1.736 358 HA ARG 48 HA ARG 48 -4.323 6.271 -0.063 359 HB2 ARG 48 1HB ARG 48 -2.833 7.760 -1.174 360 HB3 ARG 48 2HB ARG 48 -3.222 7.111 -2.772 361 HG2 ARG 48 1HG ARG 48 -4.926 8.513 -3.098 362 HG3 ARG 48 2HG ARG 48 -5.655 8.183 -1.540 363 HD2 ARG 48 1HD ARG 48 -5.111 10.497 -1.577 364 HD3 ARG 48 2HD ARG 48 -3.989 9.688 -0.480 365 HE ARG 48 HE ARG 48 -2.372 9.686 -2.422 366 HH11 ARG 48 1HH1 ARG 48 -4.716 12.370 -1.969 367 HH12 ARG 48 2HH1 ARG 48 -3.803 13.442 -2.980 368 HH21 ARG 48 1HH2 ARG 48 -1.069 11.261 -3.467 369 HH22 ARG 48 2HH2 ARG 48 -1.649 12.865 -3.648 370 H PHE 49 H PHE 49 -6.321 5.487 0.067 371 HA PHE 49 HA PHE 49 -7.731 4.485 -2.355 372 HB2 PHE 49 1HB PHE 49 -8.635 4.466 0.561 373 HB3 PHE 49 2HB PHE 49 -9.497 3.776 -0.792 374 HD1 PHE 49 1HD PHE 49 -8.519 1.693 -2.061 375 HD2 PHE 49 2HD PHE 49 -6.702 3.346 1.485 376 HE1 PHE 49 1HE PHE 49 -7.159 -0.321 -1.800 377 HE2 PHE 49 2HE PHE 49 -5.073 1.503 1.462 378 HZ PHE 49 HZ PHE 49 -5.397 -0.439 -0.062 379 H MET 50 H MET 50 -8.585 6.149 -3.539 380 HA MET 50 HA MET 50 -9.818 8.438 -2.110 381 HB2 MET 50 1HB MET 50 -9.802 8.143 -5.110 382 HB3 MET 50 2HB MET 50 -10.024 9.591 -4.149 383 HG2 MET 50 1HG MET 50 -7.418 8.129 -4.007 384 HG3 MET 50 2HG MET 50 -7.814 9.045 -5.461 385 HE1 MET 50 3HE MET 50 -8.997 10.463 -1.925 386 HE2 MET 50 1HE MET 50 -7.742 9.251 -1.564 387 HE3 MET 50 2HE MET 50 -7.431 10.969 -1.251 388 H GLY 51 H GLY 51 -11.607 7.820 -1.293 389 HA2 GLY 51 1HA GLY 51 -14.055 7.606 -1.783 390 HA3 GLY 51 2HA GLY 51 -13.664 6.305 -2.901 391 H TYR 52 H TYR 52 -15.512 5.769 -0.938 392 HA TYR 52 HA TYR 52 -14.278 4.731 1.472 393 HB2 TYR 52 1HB TYR 52 -16.724 5.772 0.906 394 HB3 TYR 52 2HB TYR 52 -17.099 4.062 0.710 395 HD1 TYR 52 1HD TYR 52 -16.248 2.512 2.734 396 HD2 TYR 52 2HD TYR 52 -16.923 6.763 2.968 397 HE1 TYR 52 1HE TYR 52 -16.355 2.367 5.216 398 HE2 TYR 52 2HE TYR 52 -17.121 6.608 5.421 399 HH TYR 52 HH TYR 52 -16.265 3.676 7.203 400 H THR 53 H THR 53 -13.402 2.735 1.615 401 HA THR 53 HA THR 53 -14.594 0.516 0.157 402 HB THR 53 HB THR 53 -13.020 1.645 -1.406 403 HG1 THR 53 1HG THR 53 -13.309 -0.297 -2.083 404 HG21 THR 53 3HG2 THR 53 -10.763 0.503 0.228 405 HG22 THR 53 1HG2 THR 53 -11.140 2.239 0.043 406 HG23 THR 53 2HG2 THR 53 -10.646 1.241 -1.344 407 H LYS 54 H LYS 54 -14.744 -1.059 1.576 408 HA LYS 54 HA LYS 54 -12.829 -1.267 3.830 409 HB2 LYS 54 1HB LYS 54 -14.590 -1.601 5.422 410 HB3 LYS 54 2HB LYS 54 -14.700 0.015 4.682 411 HG2 LYS 54 1HG LYS 54 -16.573 -0.983 3.190 412 HG3 LYS 54 2HG LYS 54 -16.504 -2.400 4.225 413 HD2 LYS 54 1HD LYS 54 -16.782 -0.597 6.184 414 HD3 LYS 54 2HD LYS 54 -17.431 0.393 4.852 415 HE2 LYS 54 1HE LYS 54 -19.012 -1.566 4.346 416 HE3 LYS 54 2HE LYS 54 -18.446 -2.301 5.850 417 HZ1 LYS 54 3HZ LYS 54 -19.910 0.246 5.567 418 HZ2 LYS 54 1HZ LYS 54 -19.230 -0.263 6.999 419 HZ3 LYS 54 2HZ LYS 54 -20.445 -1.094 6.278 420 H LEU 55 H LEU 55 -13.025 -2.723 1.356 421 HA LEU 55 HA LEU 55 -13.075 -5.394 2.506 422 HB2 LEU 55 1HB LEU 55 -15.320 -4.988 1.449 423 HB3 LEU 55 2HB LEU 55 -14.543 -4.851 -0.121 424 HG LEU 55 HG LEU 55 -14.023 -7.310 1.566 425 HD11 LEU 55 1HD1 LEU 55 -16.468 -6.964 1.661 426 HD12 LEU 55 2HD1 LEU 55 -16.030 -8.385 0.700 427 HD13 LEU 55 3HD1 LEU 55 -16.519 -6.888 -0.114 428 HD21 LEU 55 3HD2 LEU 55 -12.810 -7.186 -0.554 429 HD22 LEU 55 1HD2 LEU 55 -14.313 -6.850 -1.439 430 HD23 LEU 55 2HD2 LEU 55 -14.051 -8.429 -0.684 431 H THR 56 H THR 56 -10.840 -4.830 2.490 432 HA THR 56 HA THR 56 -9.506 -4.426 -0.115 433 HB THR 56 HB THR 56 -8.314 -4.373 2.699 434 HG1 THR 56 1HG THR 56 -9.275 -2.567 2.977 435 HG21 THR 56 3HG2 THR 56 -6.677 -4.456 0.860 436 HG22 THR 56 1HG2 THR 56 -6.660 -2.873 1.618 437 HG23 THR 56 2HG2 THR 56 -7.473 -3.084 0.060 438 H VAL 57 H VAL 57 -8.204 -5.998 -1.071 439 HA VAL 57 HA VAL 57 -7.827 -8.528 0.367 440 HB VAL 57 HB VAL 57 -8.688 -8.326 -2.530 441 HG11 VAL 57 1HG1 VAL 57 -9.437 -10.636 -2.170 442 HG12 VAL 57 2HG1 VAL 57 -7.745 -10.514 -1.705 443 HG13 VAL 57 3HG1 VAL 57 -9.015 -10.542 -0.460 444 HG21 VAL 57 3HG2 VAL 57 -10.511 -8.569 -0.086 445 HG22 VAL 57 1HG2 VAL 57 -10.540 -7.290 -1.327 446 HG23 VAL 57 2HG2 VAL 57 -11.004 -8.944 -1.746 447 H ILE 58 H ILE 58 -6.027 -9.710 -0.171 448 HA ILE 58 HA ILE 58 -4.125 -8.741 -2.191 449 HB ILE 58 HB ILE 58 -3.297 -9.320 0.679 450 HG12 ILE 58 1HG1 ILE 58 -3.514 -6.516 -0.463 451 HG13 ILE 58 2HG1 ILE 58 -4.641 -7.208 0.713 452 HG21 ILE 58 1HG2 ILE 58 -1.664 -9.667 -1.225 453 HG22 ILE 58 2HG2 ILE 58 -1.800 -7.941 -1.592 454 HG23 ILE 58 3HG2 ILE 58 -1.120 -8.477 -0.044 455 HD11 ILE 58 3HD1 ILE 58 -1.709 -6.735 1.251 456 HD12 ILE 58 1HD1 ILE 58 -3.072 -5.812 1.873 457 HD13 ILE 58 2HD1 ILE 58 -2.878 -7.496 2.376 458 H THR 59 H THR 59 -4.326 -10.741 -3.437 459 HA THR 59 HA THR 59 -5.341 -13.017 -2.213 460 HB THR 59 HB THR 59 -4.056 -13.096 -4.933 461 HG1 THR 59 1HG THR 59 -5.211 -11.594 -5.738 462 HG21 THR 59 3HG2 THR 59 -6.199 -14.144 -5.542 463 HG22 THR 59 1HG2 THR 59 -6.839 -13.839 -3.917 464 HG23 THR 59 2HG2 THR 59 -5.490 -14.949 -4.148 465 H GLY 60 H GLY 60 -2.145 -11.987 -2.300 466 HA2 GLY 60 1HA GLY 60 -0.098 -12.920 -1.760 467 HA3 GLY 60 2HA GLY 60 -0.987 -14.027 -0.777 468 H LYS 61 H LYS 61 0.708 -15.445 -1.159 469 HA LYS 61 HA LYS 61 1.039 -16.606 -3.828 470 HB2 LYS 61 1HB LYS 61 2.791 -17.865 -2.810 471 HB3 LYS 61 2HB LYS 61 2.865 -16.166 -2.286 472 HG2 LYS 61 1HG LYS 61 1.940 -16.744 -0.103 473 HG3 LYS 61 2HG LYS 61 1.783 -18.418 -0.589 474 HD2 LYS 61 1HD LYS 61 3.764 -17.900 0.862 475 HD3 LYS 61 2HD LYS 61 4.120 -18.774 -0.634 476 HE2 LYS 61 1HE LYS 61 4.954 -16.748 -1.707 477 HE3 LYS 61 2HE LYS 61 4.507 -15.766 -0.322 478 HZ1 LYS 61 3HZ LYS 61 6.550 -17.890 -0.320 479 HZ2 LYS 61 1HZ LYS 61 6.159 -16.972 0.985 480 HZ3 LYS 61 2HZ LYS 61 6.827 -16.264 -0.328 481 H ASP 62 H ASP 62 -0.851 -17.290 -0.971 482 HA ASP 62 HA ASP 62 -1.267 -20.096 -1.591 483 HB2 ASP 62 1HB ASP 62 -2.505 -20.086 0.451 484 HB3 ASP 62 2HB ASP 62 -1.058 -19.166 0.710 485 H GLY 63 H GLY 63 -2.648 -17.108 -2.536 486 HA2 GLY 63 1HA GLY 63 -4.359 -16.738 -4.066 487 HA3 GLY 63 2HA GLY 63 -4.807 -18.444 -4.024 488 H LYS 64 H LYS 64 -4.529 -16.742 -0.901 489 HA LYS 64 HA LYS 64 -7.459 -16.318 -0.880 490 HB2 LYS 64 1HB LYS 64 -5.860 -17.471 1.452 491 HB3 LYS 64 2HB LYS 64 -7.560 -16.993 1.451 492 HG2 LYS 64 1HG LYS 64 -7.872 -18.716 -0.451 493 HG3 LYS 64 2HG LYS 64 -6.286 -19.343 -0.004 494 HD2 LYS 64 1HD LYS 64 -8.532 -18.973 2.011 495 HD3 LYS 64 2HD LYS 64 -8.376 -20.443 1.045 496 HE2 LYS 64 1HE LYS 64 -6.296 -21.010 2.038 497 HE3 LYS 64 2HE LYS 64 -6.119 -19.418 2.800 498 HZ1 LYS 64 3HZ LYS 64 -8.269 -21.356 3.508 499 HZ2 LYS 64 1HZ LYS 64 -8.038 -19.906 4.180 500 HZ3 LYS 64 2HZ LYS 64 -6.907 -21.100 4.384 501 H ASN 65 H ASN 65 -7.956 -14.747 1.066 502 HA ASN 65 HA ASN 65 -6.315 -12.430 0.444 503 HB2 ASN 65 1HB ASN 65 -8.800 -12.272 0.903 504 HB3 ASN 65 2HB ASN 65 -8.459 -12.619 2.602 505 HD21 ASN 65 1HD2 ASN 65 -9.675 -10.200 2.289 506 HD22 ASN 65 2HD2 ASN 65 -8.473 -8.939 2.453 507 H LEU 66 H LEU 66 -4.335 -12.334 1.217 508 HA LEU 66 HA LEU 66 -3.250 -13.359 3.580 509 HB2 LEU 66 1HB LEU 66 -2.578 -10.754 2.156 510 HB3 LEU 66 2HB LEU 66 -1.623 -11.422 3.463 511 HG LEU 66 HG LEU 66 -2.120 -12.793 0.800 512 HD11 LEU 66 1HD1 LEU 66 0.321 -11.339 1.954 513 HD12 LEU 66 2HD1 LEU 66 -0.651 -10.836 0.561 514 HD13 LEU 66 3HD1 LEU 66 0.340 -12.300 0.476 515 HD21 LEU 66 3HD2 LEU 66 -1.742 -14.451 2.531 516 HD22 LEU 66 1HD2 LEU 66 -0.370 -13.525 3.196 517 HD23 LEU 66 2HD2 LEU 66 -0.260 -14.287 1.576 518 H LEU 67 H LEU 67 -5.019 -10.305 3.057 519 HA LEU 67 HA LEU 67 -4.464 -9.233 5.592 520 HB2 LEU 67 1HB LEU 67 -5.499 -8.241 3.278 521 HB3 LEU 67 2HB LEU 67 -6.993 -8.521 4.168 522 HG LEU 67 HG LEU 67 -5.785 -7.223 6.119 523 HD11 LEU 67 1HD1 LEU 67 -4.222 -5.990 3.849 524 HD12 LEU 67 2HD1 LEU 67 -3.553 -7.324 4.807 525 HD13 LEU 67 3HD1 LEU 67 -3.991 -5.823 5.613 526 HD21 LEU 67 3HD2 LEU 67 -6.675 -5.990 3.497 527 HD22 LEU 67 1HD2 LEU 67 -6.488 -5.058 5.028 528 HD23 LEU 67 2HD2 LEU 67 -7.681 -6.354 4.911 529 H TYR 68 H TYR 68 -6.520 -11.807 4.776 530 HA TYR 68 HA TYR 68 -7.827 -11.631 7.449 531 HB2 TYR 68 1HB TYR 68 -9.381 -11.595 5.526 532 HB3 TYR 68 2HB TYR 68 -8.747 -13.151 4.993 533 HD1 TYR 68 2HD TYR 68 -10.068 -11.555 8.168 534 HD2 TYR 68 1HD TYR 68 -10.017 -15.050 5.622 535 HE1 TYR 68 2HE TYR 68 -11.516 -12.715 9.757 536 HE2 TYR 68 1HE TYR 68 -11.509 -16.217 7.207 537 HH TYR 68 HH TYR 68 -12.360 -14.888 10.375 538 H ASN 69 H ASN 69 -5.343 -13.238 5.690 539 HA ASN 69 HA ASN 69 -5.623 -15.897 6.558 540 HB2 ASN 69 1HB ASN 69 -4.203 -14.927 4.686 541 HB3 ASN 69 2HB ASN 69 -3.020 -14.481 5.920 542 HD21 ASN 69 1HD2 ASN 69 -4.326 -17.036 4.005 543 HD22 ASN 69 2HD2 ASN 69 -3.296 -18.296 4.603 544 H GLY 70 H GLY 70 -3.568 -13.225 7.843 545 HA2 GLY 70 1HA GLY 70 -4.314 -13.418 10.436 546 HA3 GLY 70 2HA GLY 70 -3.042 -14.646 10.347 547 H THR 71 H THR 71 -1.468 -12.992 8.285 548 HA THR 71 HA THR 71 -0.021 -11.555 10.388 549 HB THR 71 HB THR 71 0.797 -11.911 7.471 550 HG1 THR 71 1HG THR 71 0.748 -13.759 9.568 551 HG21 THR 71 3HG2 THR 71 2.406 -11.698 10.061 552 HG22 THR 71 1HG2 THR 71 2.245 -10.437 8.824 553 HG23 THR 71 2HG2 THR 71 3.078 -11.949 8.441 554 H ALA 72 H ALA 72 -0.994 -10.853 7.030 555 HA ALA 72 HA ALA 72 -0.516 -8.019 7.263 556 HB1 ALA 72 1HB ALA 72 -1.441 -7.890 5.042 557 HB2 ALA 72 2HB ALA 72 -0.473 -9.362 5.109 558 HB3 ALA 72 3HB ALA 72 -2.237 -9.478 5.210 559 H LYS 73 H LYS 73 -1.695 -6.517 8.166 560 HA LYS 73 HA LYS 73 -4.619 -6.652 8.252 561 HB2 LYS 73 1HB LYS 73 -4.053 -8.083 10.076 562 HB3 LYS 73 2HB LYS 73 -2.794 -7.009 10.673 563 HG2 LYS 73 1HG LYS 73 -4.291 -5.461 11.493 564 HG3 LYS 73 2HG LYS 73 -5.655 -6.055 10.534 565 HD2 LYS 73 1HD LYS 73 -4.375 -7.715 12.770 566 HD3 LYS 73 2HD LYS 73 -5.685 -6.573 13.025 567 HE2 LYS 73 1HE LYS 73 -6.874 -8.519 12.844 568 HE3 LYS 73 2HE LYS 73 -7.013 -7.861 11.217 569 HZ1 LYS 73 3HZ LYS 73 -5.131 -9.432 10.643 570 HZ2 LYS 73 1HZ LYS 73 -6.521 -10.185 11.109 571 HZ3 LYS 73 2HZ LYS 73 -5.292 -10.065 12.160 572 H MET 74 H MET 74 -5.495 -4.579 8.624 573 HA MET 74 HA MET 74 -3.646 -2.309 8.366 574 HB2 MET 74 1HB MET 74 -5.837 -2.212 7.140 575 HB3 MET 74 2HB MET 74 -6.685 -2.438 8.650 576 HG2 MET 74 1HG MET 74 -4.729 -0.168 8.579 577 HG3 MET 74 2HG MET 74 -6.094 -0.011 7.483 578 HE1 MET 74 3HE MET 74 -9.132 0.156 9.682 579 HE2 MET 74 1HE MET 74 -8.395 0.449 8.082 580 HE3 MET 74 2HE MET 74 -8.430 -1.196 8.729 581 H PHE 75 H PHE 75 -3.011 -1.050 10.063 582 HA PHE 75 HA PHE 75 -4.319 -1.423 12.700 583 HB2 PHE 75 1HB PHE 75 -2.176 -1.438 13.764 584 HB3 PHE 75 2HB PHE 75 -2.244 -2.721 12.577 585 HD1 PHE 75 1HD PHE 75 -0.883 -2.570 10.456 586 HD2 PHE 75 2HD PHE 75 -0.629 0.418 13.560 587 HE1 PHE 75 1HE PHE 75 1.295 -1.767 9.530 588 HE2 PHE 75 2HE PHE 75 1.494 1.207 12.640 589 HZ PHE 75 HZ PHE 75 2.501 0.065 10.605 590 H LYS 76 H LYS 76 -4.149 0.827 10.346 591 HA LYS 76 HA LYS 76 -4.352 3.023 12.131 592 HB2 LYS 76 1HB LYS 76 -1.877 2.919 12.092 593 HB3 LYS 76 2HB LYS 76 -1.876 2.967 10.335 594 HG2 LYS 76 1HG LYS 76 -2.803 5.239 10.357 595 HG3 LYS 76 2HG LYS 76 -2.937 5.180 12.120 596 HD2 LYS 76 1HD LYS 76 -0.586 5.276 12.434 597 HD3 LYS 76 2HD LYS 76 -0.246 4.743 10.794 598 HE2 LYS 76 1HE LYS 76 0.278 7.092 10.907 599 HE3 LYS 76 2HE LYS 76 -1.181 6.926 9.929 600 HZ1 LYS 76 3HZ LYS 76 -1.031 7.826 12.739 601 HZ2 LYS 76 1HZ LYS 76 -2.459 7.585 11.948 602 HZ3 LYS 76 2HZ LYS 76 -1.439 8.743 11.440 603 H SER 77 H SER 77 -5.555 4.649 11.028 604 HA SER 77 HA SER 77 -5.756 4.592 8.114 605 HB2 SER 77 1HB SER 77 -8.034 3.903 9.931 606 HB3 SER 77 2HB SER 77 -8.307 4.676 8.355 607 HG SER 77 HG SER 77 -6.800 2.311 8.763 608 H ASP 78 H ASP 78 -4.820 6.600 8.122 609 HA ASP 78 HA ASP 78 -5.881 8.705 9.934 610 HB2 ASP 78 1HB ASP 78 -3.326 8.205 9.148 611 HB3 ASP 78 2HB ASP 78 -3.799 9.373 7.897 612 H ALA 79 H ALA 79 -6.145 10.960 8.627 613 HA ALA 79 HA ALA 79 -8.292 10.303 6.625 614 HB1 ALA 79 1HB ALA 79 -9.323 12.423 7.334 615 HB2 ALA 79 2HB ALA 79 -9.077 11.332 8.716 616 HB3 ALA 79 3HB ALA 79 -7.980 12.711 8.461 617 H ILE 80 H ILE 80 -8.502 11.486 4.671 618 HA ILE 80 HA ILE 80 -6.189 13.219 3.966 619 HB ILE 80 HB ILE 80 -7.626 11.303 2.113 620 HG12 ILE 80 1HG1 ILE 80 -4.910 11.029 3.487 621 HG13 ILE 80 2HG1 ILE 80 -6.325 10.019 3.756 622 HG21 ILE 80 1HG2 ILE 80 -5.887 11.895 0.510 623 HG22 ILE 80 2HG2 ILE 80 -6.693 13.352 1.059 624 HG23 ILE 80 3HG2 ILE 80 -5.099 12.929 1.725 625 HD11 ILE 80 3HD1 ILE 80 -5.051 8.712 2.298 626 HD12 ILE 80 1HD1 ILE 80 -6.180 9.495 1.186 627 HD13 ILE 80 2HD1 ILE 80 -4.509 10.122 1.401 628 H LEU 81 H LEU 81 -7.006 15.166 4.096 629 HA LEU 81 HA LEU 81 -9.654 15.807 2.984 630 HB2 LEU 81 1HB LEU 81 -7.557 17.677 4.140 631 HB3 LEU 81 2HB LEU 81 -9.211 18.092 3.682 632 HG LEU 81 HG LEU 81 -8.380 16.260 5.969 633 HD11 LEU 81 1HD1 LEU 81 -9.767 18.975 5.994 634 HD12 LEU 81 2HD1 LEU 81 -8.071 18.672 6.396 635 HD13 LEU 81 3HD1 LEU 81 -9.339 17.978 7.410 636 HD21 LEU 81 3HD2 LEU 81 -10.796 16.200 6.565 637 HD22 LEU 81 1HD2 LEU 81 -10.457 15.391 5.041 638 HD23 LEU 81 2HD2 LEU 81 -11.189 17.015 5.032 639 H GLY 82 H GLY 82 -9.895 16.940 1.010 640 HA2 GLY 82 1HA GLY 82 -7.680 16.589 -0.902 641 HA3 GLY 82 2HA GLY 82 -9.346 17.046 -1.262 642 H GLN 83 H GLN 83 -9.725 19.179 -1.765 643 HA GLN 83 HA GLN 83 -7.944 21.282 -0.641 644 HB2 GLN 83 1HB GLN 83 -7.871 22.441 -2.827 645 HB3 GLN 83 2HB GLN 83 -6.977 20.932 -2.767 646 HG2 GLN 83 1HG GLN 83 -8.788 19.760 -3.997 647 HG3 GLN 83 2HG GLN 83 -9.720 21.259 -4.054 648 HE21 GLN 83 1HE2 GLN 83 -9.587 20.688 -6.488 649 HE22 GLN 83 2HE2 GLN 83 -8.132 21.195 -7.324 650 H ASN 84 H ASN 84 -10.192 20.767 0.561 651 HA ASN 84 HA ASN 84 -11.718 23.143 0.372 652 HB2 ASN 84 1HB ASN 84 -12.689 20.944 -1.357 653 HB3 ASN 84 2HB ASN 84 -13.928 21.429 -0.220 654 HD21 ASN 84 1HD2 ASN 84 -12.803 22.058 -3.203 655 HD22 ASN 84 2HD2 ASN 84 -13.143 23.761 -3.349 656 H LYS 85 H LYS 85 -10.522 21.033 2.329 657 HA LYS 85 HA LYS 85 -11.027 19.872 4.175 658 HB2 LYS 85 1HB LYS 85 -13.374 21.750 4.620 659 HB3 LYS 85 2HB LYS 85 -12.576 20.726 5.792 660 HG2 LYS 85 1HG LYS 85 -10.462 21.993 5.482 661 HG3 LYS 85 2HG LYS 85 -11.293 23.100 4.340 662 HD2 LYS 85 1HD LYS 85 -12.244 22.635 7.218 663 HD3 LYS 85 2HD LYS 85 -11.057 23.865 6.794 664 HE2 LYS 85 1HE LYS 85 -13.303 24.075 4.959 665 HE3 LYS 85 2HE LYS 85 -13.932 23.998 6.618 666 HZ1 LYS 85 3HZ LYS 85 -13.377 26.297 5.902 667 HZ2 LYS 85 1HZ LYS 85 -11.798 25.876 5.766 668 HZ3 LYS 85 2HZ LYS 85 -12.526 25.832 7.212 669 H VAL 86 H VAL 86 -11.750 18.769 1.841 670 HA VAL 86 HA VAL 86 -14.314 17.446 2.290 671 HB VAL 86 HB VAL 86 -14.415 18.622 0.400 672 HG11 VAL 86 1HG1 VAL 86 -11.905 17.315 -0.474 673 HG12 VAL 86 2HG1 VAL 86 -12.952 18.360 -1.482 674 HG13 VAL 86 3HG1 VAL 86 -12.174 19.013 -0.024 675 HG21 VAL 86 3HG2 VAL 86 -13.898 15.700 -0.383 676 HG22 VAL 86 1HG2 VAL 86 -15.404 16.299 0.351 677 HG23 VAL 86 2HG2 VAL 86 -14.918 16.857 -1.261 678 H VAL 87 H VAL 87 -14.084 15.378 3.225 679 HA VAL 87 HA VAL 87 -11.528 14.021 3.256 680 HB VAL 87 HB VAL 87 -14.319 12.950 3.810 681 HG11 VAL 87 1HG1 VAL 87 -11.513 11.883 4.445 682 HG12 VAL 87 2HG1 VAL 87 -13.033 11.233 5.090 683 HG13 VAL 87 3HG1 VAL 87 -12.704 11.140 3.357 684 HG21 VAL 87 3HG2 VAL 87 -12.166 13.973 5.734 685 HG22 VAL 87 1HG2 VAL 87 -13.691 14.802 5.369 686 HG23 VAL 87 2HG2 VAL 87 -13.717 13.244 6.178 687 H ILE 88 H ILE 88 -10.689 13.637 1.255 688 HA ILE 88 HA ILE 88 -12.394 12.586 -0.937 689 HB ILE 88 HB ILE 88 -10.328 12.710 -2.283 690 HG12 ILE 88 1HG1 ILE 88 -9.035 14.203 0.040 691 HG13 ILE 88 2HG1 ILE 88 -8.705 12.516 -0.302 692 HG21 ILE 88 1HG2 ILE 88 -12.028 14.564 -2.065 693 HG22 ILE 88 2HG2 ILE 88 -10.988 15.304 -0.838 694 HG23 ILE 88 3HG2 ILE 88 -10.416 15.133 -2.518 695 HD11 ILE 88 3HD1 ILE 88 -6.975 13.900 -1.314 696 HD12 ILE 88 1HD1 ILE 88 -7.927 13.129 -2.598 697 HD13 ILE 88 2HD1 ILE 88 -8.180 14.836 -2.208 698 H GLY 89 H GLY 89 -10.338 11.409 1.617 699 HA2 GLY 89 1HA GLY 89 -10.889 8.673 1.067 700 HA3 GLY 89 2HA GLY 89 -9.307 9.117 0.396 701 H TRP 90 H TRP 90 -8.672 7.439 2.034 702 HA TRP 90 HA TRP 90 -7.911 8.764 4.567 703 HB2 TRP 90 1HB TRP 90 -9.240 6.061 4.368 704 HB3 TRP 90 2HB TRP 90 -8.513 6.720 5.833 705 HD1 TRP 90 HD TRP 90 -9.807 8.761 6.975 706 HE1 TRP 90 1HE TRP 90 -12.206 9.724 6.736 707 HE3 TRP 90 3HE TRP 90 -11.182 6.393 2.674 708 HZ2 TRP 90 2HZ TRP 90 -14.496 9.301 5.016 709 HZ3 TRP 90 3HZ TRP 90 -13.443 6.793 1.699 710 HH2 TRP 90 HH TRP 90 -15.096 8.209 2.867 711 H ASP 91 H ASP 91 -6.012 7.909 5.411 712 HA ASP 91 HA ASP 91 -4.260 6.520 3.479 713 HB2 ASP 91 1HB ASP 91 -3.747 8.110 6.004 714 HB3 ASP 91 2HB ASP 91 -2.541 6.968 5.357 715 H LYS 92 H LYS 92 -5.196 4.457 3.685 716 HA LYS 92 HA LYS 92 -5.539 3.112 6.354 717 HB2 LYS 92 1HB LYS 92 -6.214 2.329 3.494 718 HB3 LYS 92 2HB LYS 92 -5.906 1.083 4.695 719 HG2 LYS 92 1HG LYS 92 -8.265 1.373 4.451 720 HG3 LYS 92 2HG LYS 92 -7.761 1.797 6.058 721 HD2 LYS 92 1HD LYS 92 -7.868 4.211 5.490 722 HD3 LYS 92 2HD LYS 92 -8.402 3.793 3.839 723 HE2 LYS 92 1HE LYS 92 -9.924 3.080 6.401 724 HE3 LYS 92 2HE LYS 92 -10.206 4.531 5.463 725 HZ1 LYS 92 3HZ LYS 92 -11.759 3.169 4.573 726 HZ2 LYS 92 1HZ LYS 92 -10.936 1.800 4.805 727 HZ3 LYS 92 2HZ LYS 92 -10.561 2.834 3.535 728 H TYR 93 H TYR 93 -3.768 2.225 7.218 729 HA TYR 93 HA TYR 93 -1.410 1.662 5.518 730 HB2 TYR 93 1HB TYR 93 -1.836 1.855 8.523 731 HB3 TYR 93 2HB TYR 93 -0.310 1.407 7.813 732 HD1 TYR 93 2HD TYR 93 -2.773 4.227 8.041 733 HD2 TYR 93 1HD TYR 93 1.247 3.087 6.970 734 HE1 TYR 93 2HE TYR 93 -2.180 6.591 7.726 735 HE2 TYR 93 1HE TYR 93 1.770 5.453 6.467 736 HH TYR 93 HH TYR 93 -0.422 8.178 6.966 737 H PHE 94 H PHE 94 -0.221 -0.499 6.038 738 HA PHE 94 HA PHE 94 -1.930 -2.669 7.076 739 HB2 PHE 94 1HB PHE 94 -0.760 -2.853 4.273 740 HB3 PHE 94 2HB PHE 94 -1.745 -4.055 5.090 741 HD1 PHE 94 2HD PHE 94 -4.236 -3.679 5.334 742 HD2 PHE 94 1HD PHE 94 -1.712 -0.911 3.212 743 HE1 PHE 94 2HE PHE 94 -6.241 -2.605 4.347 744 HE2 PHE 94 1HE PHE 94 -3.677 0.166 2.264 745 HZ PHE 94 HZ PHE 94 -5.982 -0.670 2.805 746 H GLU 95 H GLU 95 -0.666 -4.453 7.840 747 HA GLU 95 HA GLU 95 2.284 -4.091 7.655 748 HB2 GLU 95 1HB GLU 95 1.035 -4.050 9.830 749 HB3 GLU 95 2HB GLU 95 0.645 -5.730 9.647 750 HG2 GLU 95 1HG GLU 95 2.957 -6.410 9.736 751 HG3 GLU 95 2HG GLU 95 3.542 -4.791 9.377 752 H ILE 96 H ILE 96 2.368 -5.161 5.443 753 HA ILE 96 HA ILE 96 1.338 -7.894 5.375 754 HB ILE 96 HB ILE 96 2.574 -6.032 3.333 755 HG12 ILE 96 1HG1 ILE 96 -0.279 -6.934 3.201 756 HG13 ILE 96 2HG1 ILE 96 0.068 -5.817 4.481 757 HG21 ILE 96 1HG2 ILE 96 1.661 -7.588 1.616 758 HG22 ILE 96 2HG2 ILE 96 2.969 -8.313 2.557 759 HG23 ILE 96 3HG2 ILE 96 1.285 -8.758 2.898 760 HD11 ILE 96 3HD1 ILE 96 -0.683 -4.667 2.435 761 HD12 ILE 96 1HD1 ILE 96 0.930 -4.158 2.976 762 HD13 ILE 96 2HD1 ILE 96 0.765 -5.258 1.592 763 HA PRO 97 HA PRO 97 5.580 -9.595 5.995 764 HB2 PRO 97 1HB PRO 97 5.087 -12.183 5.275 765 HB3 PRO 97 2HB PRO 97 4.641 -11.503 6.866 766 HG2 PRO 97 1HG PRO 97 2.906 -11.789 4.396 767 HG3 PRO 97 2HG PRO 97 2.506 -12.324 6.053 768 HD2 PRO 97 1HD PRO 97 1.634 -9.999 4.968 769 HD3 PRO 97 2HD PRO 97 2.105 -10.034 6.680 770 H MET 98 H MET 98 7.087 -9.189 4.423 771 HA MET 98 HA MET 98 6.687 -9.252 1.590 772 HB2 MET 98 1HB MET 98 9.200 -9.829 3.196 773 HB3 MET 98 2HB MET 98 9.181 -9.489 1.464 774 HG2 MET 98 1HG MET 98 8.374 -7.234 1.884 775 HG3 MET 98 2HG MET 98 8.164 -7.575 3.596 776 HE1 MET 98 3HE MET 98 9.583 -5.058 2.839 777 HE2 MET 98 1HE MET 98 9.505 -5.620 4.527 778 HE3 MET 98 2HE MET 98 11.063 -5.088 3.829 779 H ASP 99 H ASP 99 7.777 -11.731 3.872 780 HA ASP 99 HA ASP 99 8.491 -13.724 2.019 781 HB2 ASP 99 1HB ASP 99 8.432 -13.322 4.909 782 HB3 ASP 99 2HB ASP 99 7.952 -14.954 4.527 783 H ALA 100 H ALA 100 5.288 -12.803 2.642 784 HA ALA 100 HA ALA 100 4.325 -15.559 1.949 785 HB1 ALA 100 1HB ALA 100 3.569 -14.682 4.207 786 HB2 ALA 100 2HB ALA 100 2.602 -13.493 3.273 787 HB3 ALA 100 3HB ALA 100 2.309 -15.207 3.069 788 H LEU 101 H LEU 101 5.075 -12.821 0.361 789 HA LEU 101 HA LEU 101 2.539 -12.494 -1.094 790 HB2 LEU 101 1HB LEU 101 5.302 -11.280 -1.432 791 HB3 LEU 101 2HB LEU 101 3.973 -10.928 -2.530 792 HG LEU 101 HG LEU 101 3.758 -10.504 0.483 793 HD11 LEU 101 1HD1 LEU 101 4.234 -8.172 0.097 794 HD12 LEU 101 2HD1 LEU 101 4.411 -8.459 -1.658 795 HD13 LEU 101 3HD1 LEU 101 5.565 -9.157 -0.508 796 HD21 LEU 101 3HD2 LEU 101 1.574 -10.704 -0.733 797 HD22 LEU 101 1HD2 LEU 101 2.085 -9.407 -1.830 798 HD23 LEU 101 2HD2 LEU 101 1.842 -9.094 -0.096 799 H GLN 102 H GLN 102 2.236 -12.837 -3.285 800 HA GLN 102 HA GLN 102 2.765 -15.349 -4.271 801 HB2 GLN 102 1HB GLN 102 0.965 -13.655 -4.838 802 HB3 GLN 102 2HB GLN 102 2.149 -12.794 -5.812 803 HG2 GLN 102 1HG GLN 102 2.463 -14.807 -7.225 804 HG3 GLN 102 2HG GLN 102 1.290 -15.668 -6.211 805 HE21 GLN 102 1HE2 GLN 102 -0.944 -14.695 -6.146 806 HE22 GLN 102 2HE2 GLN 102 -1.508 -13.887 -7.617 807 H ASP 103 H ASP 103 4.519 -12.345 -4.860 808 HA ASP 103 HA ASP 103 6.600 -13.630 -6.464 809 HB2 ASP 103 1HB ASP 103 4.967 -11.168 -7.305 810 HB3 ASP 103 2HB ASP 103 6.462 -11.684 -8.071 811 H ASN 104 H ASN 104 8.379 -11.813 -6.619 812 HA ASN 104 HA ASN 104 8.589 -10.332 -4.106 813 HB2 ASN 104 1HB ASN 104 10.415 -10.354 -6.550 814 HB3 ASN 104 2HB ASN 104 10.758 -9.585 -4.996 815 HD21 ASN 104 1HD2 ASN 104 11.941 -10.838 -3.519 816 HD22 ASN 104 2HD2 ASN 104 11.783 -12.605 -3.463 817 H SER 105 H SER 105 6.269 -9.469 -5.109 818 HA SER 105 HA SER 105 6.861 -6.701 -5.632 819 HB2 SER 105 1HB SER 105 5.304 -6.406 -7.509 820 HB3 SER 105 2HB SER 105 6.567 -7.578 -7.921 821 HG SER 105 HG SER 105 5.263 -9.130 -8.035 822 H ILE 106 H ILE 106 4.926 -5.337 -5.093 823 HA ILE 106 HA ILE 106 2.908 -6.809 -3.501 824 HB ILE 106 HB ILE 106 4.425 -5.931 -1.885 825 HG12 ILE 106 1HG1 ILE 106 2.942 -4.508 -0.545 826 HG13 ILE 106 2HG1 ILE 106 1.903 -4.218 -1.935 827 HG21 ILE 106 1HG2 ILE 106 3.976 -3.159 -3.063 828 HG22 ILE 106 2HG2 ILE 106 4.882 -3.556 -1.585 829 HG23 ILE 106 3HG2 ILE 106 5.479 -4.098 -3.153 830 HD11 ILE 106 3HD1 ILE 106 1.385 -6.717 -1.980 831 HD12 ILE 106 1HD1 ILE 106 2.385 -6.861 -0.520 832 HD13 ILE 106 2HD1 ILE 106 0.897 -5.902 -0.499 833 H GLN 107 H GLN 107 0.875 -6.193 -3.733 834 HA GLN 107 HA GLN 107 0.049 -3.777 -5.157 835 HB2 GLN 107 1HB GLN 107 0.361 -5.432 -6.925 836 HB3 GLN 107 2HB GLN 107 -0.503 -6.670 -6.003 837 HG2 GLN 107 1HG GLN 107 -2.526 -5.022 -6.157 838 HG3 GLN 107 2HG GLN 107 -1.549 -4.121 -7.293 839 HE21 GLN 107 1HE2 GLN 107 -2.456 -4.482 -9.110 840 HE22 GLN 107 2HE2 GLN 107 -2.844 -5.979 -9.942 841 H ILE 108 H ILE 108 -2.105 -3.257 -4.403 842 HA ILE 108 HA ILE 108 -3.448 -5.214 -2.598 843 HB ILE 108 HB ILE 108 -3.345 -2.191 -2.291 844 HG12 ILE 108 1HG1 ILE 108 -2.325 -4.404 -0.432 845 HG13 ILE 108 2HG1 ILE 108 -1.294 -3.431 -1.482 846 HG21 ILE 108 1HG2 ILE 108 -5.585 -3.002 -1.731 847 HG22 ILE 108 2HG2 ILE 108 -4.895 -4.323 -0.754 848 HG23 ILE 108 3HG2 ILE 108 -4.751 -2.633 -0.239 849 HD11 ILE 108 3HD1 ILE 108 -2.898 -2.399 0.859 850 HD12 ILE 108 1HD1 ILE 108 -1.149 -2.520 0.711 851 HD13 ILE 108 2HD1 ILE 108 -2.049 -1.368 -0.317 852 H LYS 109 H LYS 109 -5.843 -5.247 -2.937 853 HA LYS 109 HA LYS 109 -6.780 -3.701 -5.268 854 HB2 LYS 109 1HB LYS 109 -7.847 -5.759 -6.207 855 HB3 LYS 109 2HB LYS 109 -6.114 -5.651 -6.421 856 HG2 LYS 109 1HG LYS 109 -6.911 -7.208 -4.025 857 HG3 LYS 109 2HG LYS 109 -7.523 -7.846 -5.509 858 HD2 LYS 109 1HD LYS 109 -5.381 -8.856 -4.871 859 HD3 LYS 109 2HD LYS 109 -5.357 -8.141 -6.468 860 HE2 LYS 109 1HE LYS 109 -4.011 -6.293 -5.738 861 HE3 LYS 109 2HE LYS 109 -4.281 -6.720 -4.001 862 HZ1 LYS 109 3HZ LYS 109 -2.158 -7.520 -4.429 863 HZ2 LYS 109 1HZ LYS 109 -2.529 -8.015 -5.951 864 HZ3 LYS 109 2HZ LYS 109 -3.047 -8.876 -4.696 865 H ALA 110 H ALA 110 -8.971 -3.177 -5.051 866 HA ALA 110 HA ALA 110 -10.474 -4.309 -2.728 867 HB1 ALA 110 1HB ALA 110 -9.907 -1.357 -3.154 868 HB2 ALA 110 2HB ALA 110 -10.956 -2.083 -1.918 869 HB3 ALA 110 3HB ALA 110 -9.214 -2.384 -1.866 870 H LEU 111 H LEU 111 -12.718 -4.006 -2.810 871 HA LEU 111 HA LEU 111 -13.974 -3.704 -5.430 872 HB2 LEU 111 1HB LEU 111 -14.778 -5.234 -3.524 873 HB3 LEU 111 2HB LEU 111 -15.267 -3.780 -2.674 874 HG LEU 111 HG LEU 111 -16.635 -3.256 -4.890 875 HD11 LEU 111 1HD1 LEU 111 -16.435 -6.294 -5.045 876 HD12 LEU 111 2HD1 LEU 111 -15.703 -5.172 -6.201 877 HD13 LEU 111 3HD1 LEU 111 -17.457 -5.245 -6.048 878 HD21 LEU 111 3HD2 LEU 111 -17.691 -3.663 -2.733 879 HD22 LEU 111 1HD2 LEU 111 -17.479 -5.421 -2.931 880 HD23 LEU 111 2HD2 LEU 111 -18.558 -4.516 -4.017 881 H SER 112 H SER 112 -14.717 -1.832 -6.319 882 HA SER 112 HA SER 112 -14.906 0.668 -4.812 883 HB2 SER 112 1HB SER 112 -15.974 -0.047 -7.573 884 HB3 SER 112 2HB SER 112 -15.863 1.574 -6.883 885 HG SER 112 HG SER 112 -13.862 1.673 -7.282 886 H SER 113 H SER 113 -17.462 -1.004 -6.688 887 HA SER 113 HA SER 113 -19.311 -1.557 -4.667 888 HB2 SER 113 1HB SER 113 -19.327 0.836 -4.117 889 HB3 SER 113 2HB SER 113 -19.669 1.248 -5.810 890 HG SER 113 HG SER 113 -21.479 1.167 -4.294 891 H GLY 114 H GLY 114 -20.428 -3.043 -5.778 892 HA2 GLY 114 1HA GLY 114 -21.764 -3.969 -7.386 893 HA3 GLY 114 2HA GLY 114 -21.726 -2.452 -8.295 894 H THR 115 H THR 115 -20.054 -5.416 -7.562 895 HA THR 115 HA THR 115 -18.569 -6.721 -8.446 896 HB THR 115 HB THR 115 -20.433 -6.960 -9.919 897 HG1 THR 115 1HG THR 115 -18.012 -7.555 -11.227 898 HG21 THR 115 3HG2 THR 115 -19.861 -6.407 -12.325 899 HG22 THR 115 1HG2 THR 115 -18.613 -5.325 -11.619 900 HG23 THR 115 2HG2 THR 115 -20.327 -5.062 -11.258 901 H THR 116 H THR 116 -17.985 -3.442 -9.101 902 HA THR 116 HA THR 116 -15.664 -3.710 -10.673 903 HB THR 116 HB THR 116 -15.343 -1.308 -9.341 904 HG1 THR 116 1HG THR 116 -17.999 -1.047 -9.696 905 HG21 THR 116 3HG2 THR 116 -16.458 -0.376 -11.320 906 HG22 THR 116 1HG2 THR 116 -17.078 -2.023 -11.703 907 HG23 THR 116 2HG2 THR 116 -15.319 -1.720 -11.652 908 H PHE 117 H PHE 117 -13.794 -4.554 -10.141 909 HA PHE 117 HA PHE 117 -12.859 -4.024 -7.423 910 HB2 PHE 117 1HB PHE 117 -13.358 -6.522 -8.609 911 HB3 PHE 117 2HB PHE 117 -11.606 -6.348 -8.724 912 HD1 PHE 117 1HD PHE 117 -10.266 -5.938 -6.569 913 HD2 PHE 117 2HD PHE 117 -14.432 -7.004 -6.592 914 HE1 PHE 117 1HE PHE 117 -10.119 -6.593 -4.158 915 HE2 PHE 117 2HE PHE 117 -14.300 -7.630 -4.185 916 HZ PHE 117 HZ PHE 117 -12.160 -7.389 -2.968 917 H VAL 118 H VAL 118 -11.151 -2.824 -7.267 918 HA VAL 118 HA VAL 118 -9.729 -2.065 -9.764 919 HB VAL 118 HB VAL 118 -9.786 -0.605 -7.087 920 HG11 VAL 118 1HG1 VAL 118 -9.203 0.409 -9.909 921 HG12 VAL 118 2HG1 VAL 118 -9.053 1.322 -8.389 922 HG13 VAL 118 3HG1 VAL 118 -7.957 -0.028 -8.729 923 HG21 VAL 118 3HG2 VAL 118 -11.472 0.935 -8.105 924 HG22 VAL 118 1HG2 VAL 118 -11.635 -0.196 -9.473 925 HG23 VAL 118 2HG2 VAL 118 -12.102 -0.684 -7.834 926 H TYR 119 H TYR 119 -7.588 -2.478 -9.877 927 HA TYR 119 HA TYR 119 -6.228 -3.832 -7.603 928 HB2 TYR 119 1HB TYR 119 -5.838 -4.155 -10.614 929 HB3 TYR 119 2HB TYR 119 -4.925 -4.962 -9.355 930 HD1 TYR 119 1HD TYR 119 -8.401 -4.586 -10.637 931 HD2 TYR 119 2HD TYR 119 -5.594 -7.107 -8.590 932 HE1 TYR 119 1HE TYR 119 -10.082 -6.350 -10.565 933 HE2 TYR 119 2HE TYR 119 -7.303 -8.901 -8.465 934 HH TYR 119 HH TYR 119 -10.582 -8.422 -9.926 935 H SER 120 H SER 120 -4.393 -2.826 -6.835 936 HA SER 120 HA SER 120 -3.823 -0.205 -7.842 937 HB2 SER 120 1HB SER 120 -2.412 0.013 -6.035 938 HB3 SER 120 2HB SER 120 -3.486 -1.144 -5.421 939 HG SER 120 HG SER 120 -0.953 -1.842 -6.551 940 H GLN 121 H GLN 121 -1.523 0.397 -8.493 941 HA GLN 121 HA GLN 121 -0.662 -1.291 -10.682 942 HB2 GLN 121 1HB GLN 121 1.276 0.228 -10.823 943 HB3 GLN 121 2HB GLN 121 -0.280 1.002 -10.928 944 HG2 GLN 121 1HG GLN 121 0.012 1.698 -8.475 945 HG3 GLN 121 2HG GLN 121 1.671 1.025 -8.610 946 HE21 GLN 121 1HE2 GLN 121 2.361 3.248 -8.075 947 HE22 GLN 121 2HE2 GLN 121 2.431 4.415 -9.383 948 H LYS 122 H LYS 122 1.223 -2.435 -10.842 949 HA LYS 122 HA LYS 122 1.871 -4.127 -8.512 950 HB2 LYS 122 1HB LYS 122 1.417 -5.083 -10.736 951 HB3 LYS 122 2HB LYS 122 2.594 -4.054 -11.488 952 HG2 LYS 122 1HG LYS 122 3.585 -5.897 -9.309 953 HG3 LYS 122 2HG LYS 122 3.074 -6.617 -10.815 954 HD2 LYS 122 1HD LYS 122 4.744 -4.473 -11.648 955 HD3 LYS 122 2HD LYS 122 5.515 -5.105 -10.205 956 HE2 LYS 122 1HE LYS 122 6.405 -6.259 -12.112 957 HE3 LYS 122 2HE LYS 122 5.467 -7.391 -11.166 958 HZ1 LYS 122 3HZ LYS 122 3.700 -7.245 -12.756 959 HZ2 LYS 122 1HZ LYS 122 5.101 -7.516 -13.582 960 HZ3 LYS 122 2HZ LYS 122 4.419 -6.017 -13.569 961 H ILE 123 H ILE 123 3.755 -3.858 -7.294 962 HA ILE 123 HA ILE 123 6.016 -2.396 -8.556 963 HB ILE 123 HB ILE 123 5.066 -2.075 -5.684 964 HG12 ILE 123 1HG1 ILE 123 3.477 -0.828 -7.028 965 HG13 ILE 123 2HG1 ILE 123 4.520 0.247 -6.153 966 HG21 ILE 123 1HG2 ILE 123 7.224 -0.608 -7.211 967 HG22 ILE 123 2HG2 ILE 123 6.841 -0.376 -5.500 968 HG23 ILE 123 3HG2 ILE 123 7.533 -1.893 -6.044 969 HD11 ILE 123 3HD1 ILE 123 4.883 1.416 -8.080 970 HD12 ILE 123 1HD1 ILE 123 5.780 0.016 -8.686 971 HD13 ILE 123 2HD1 ILE 123 4.045 0.147 -8.978 972 H ASP 124 H ASP 124 7.311 -3.941 -9.042 973 HA ASP 124 HA ASP 124 7.992 -6.244 -7.443 974 HB2 ASP 124 1HB ASP 124 9.038 -4.860 -9.868 975 HB3 ASP 124 2HB ASP 124 10.218 -5.755 -8.917 976 H PHE 125 H PHE 125 9.804 -6.517 -6.003 977 HA PHE 125 HA PHE 125 11.278 -4.097 -5.245 978 HB2 PHE 125 1HB PHE 125 10.781 -4.299 -2.890 979 HB3 PHE 125 2HB PHE 125 9.300 -4.035 -3.789 980 HD1 PHE 125 2HD PHE 125 11.253 -6.546 -1.857 981 HD2 PHE 125 1HD PHE 125 7.483 -5.588 -3.692 982 HE1 PHE 125 2HE PHE 125 10.161 -8.377 -0.583 983 HE2 PHE 125 1HE PHE 125 6.412 -7.442 -2.426 984 HZ PHE 125 HZ PHE 125 7.768 -8.867 -0.905 985 H GLU 126 H GLU 126 12.980 -4.690 -3.568 986 HA GLU 126 HA GLU 126 13.861 -7.513 -3.665 987 HB2 GLU 126 1HB GLU 126 15.615 -5.051 -3.803 988 HB3 GLU 126 2HB GLU 126 16.154 -6.700 -3.415 989 HG2 GLU 126 1HG GLU 126 14.931 -7.339 -5.668 990 HG3 GLU 126 2HG GLU 126 15.096 -5.616 -6.038 991 H ARG 127 H ARG 127 14.096 -8.371 -1.866 992 HA ARG 127 HA ARG 127 13.928 -6.730 0.538 993 HB2 ARG 127 1HB ARG 127 13.168 -8.803 1.753 994 HB3 ARG 127 2HB ARG 127 12.043 -7.760 0.902 995 HG2 ARG 127 1HG ARG 127 11.330 -9.929 0.500 996 HG3 ARG 127 2HG ARG 127 12.009 -9.261 -0.999 997 HD2 ARG 127 1HD ARG 127 12.385 -11.651 -0.628 998 HD3 ARG 127 2HD ARG 127 13.821 -10.690 -0.955 999 HE ARG 127 HE ARG 127 13.259 -11.016 1.893 1000 HH11 ARG 127 1HH1 ARG 127 15.196 -12.438 -0.788 1001 HH12 ARG 127 2HH1 ARG 127 16.192 -13.307 0.307 1002 HH21 ARG 127 1HH2 ARG 127 14.630 -12.063 3.222 1003 HH22 ARG 127 2HH2 ARG 127 15.834 -13.164 2.646 1004 H GLU 128 H GLU 128 15.791 -6.670 1.288 1005 HA GLU 128 HA GLU 128 18.044 -8.292 0.699 1006 HB2 GLU 128 1HB GLU 128 19.216 -7.167 2.250 1007 HB3 GLU 128 2HB GLU 128 17.892 -6.067 2.054 1008 HG2 GLU 128 1HG GLU 128 18.125 -6.081 4.311 1009 HG3 GLU 128 2HG GLU 128 16.819 -7.229 4.101 Start of MODEL 3 1 H1 GLY 1 H GLY 1 -23.368 18.223 -1.937 2 HA2 GLY 1 1HA GLY 1 -21.309 18.600 -0.716 3 HA3 GLY 1 2HA GLY 1 -22.683 18.703 0.399 4 H ALA 2 H ALA 2 -20.053 16.692 -0.789 5 HA ALA 2 HA ALA 2 -19.298 14.668 -0.481 6 HB1 ALA 2 1HB ALA 2 -19.244 13.595 1.730 7 HB2 ALA 2 2HB ALA 2 -18.742 15.288 1.839 8 HB3 ALA 2 3HB ALA 2 -20.368 14.796 2.374 9 H GLU 3 H GLU 3 -20.030 12.362 -0.139 10 HA GLU 3 HA GLU 3 -22.855 11.844 0.212 11 HB2 GLU 3 1HB GLU 3 -22.078 12.482 -2.443 12 HB3 GLU 3 2HB GLU 3 -22.196 10.735 -2.452 13 HG2 GLU 3 1HG GLU 3 -24.350 12.594 -1.338 14 HG3 GLU 3 2HG GLU 3 -24.320 12.037 -2.999 15 H ALA 4 H ALA 4 -19.943 11.059 0.924 16 HA ALA 4 HA ALA 4 -18.552 9.301 1.152 17 HB1 ALA 4 1HB ALA 4 -21.189 8.070 1.864 18 HB2 ALA 4 2HB ALA 4 -19.709 7.102 1.883 19 HB3 ALA 4 3HB ALA 4 -19.841 8.543 2.915 20 H LEU 5 H LEU 5 -18.591 9.969 -1.229 21 HA LEU 5 HA LEU 5 -19.397 8.399 -3.346 22 HB2 LEU 5 1HB LEU 5 -16.662 9.669 -3.028 23 HB3 LEU 5 2HB LEU 5 -17.390 9.240 -4.560 24 HG LEU 5 HG LEU 5 -18.442 11.346 -2.641 25 HD11 LEU 5 1HD1 LEU 5 -16.273 11.981 -3.610 26 HD12 LEU 5 2HD1 LEU 5 -17.593 12.993 -4.218 27 HD13 LEU 5 3HD1 LEU 5 -16.936 11.695 -5.242 28 HD21 LEU 5 3HD2 LEU 5 -20.243 10.420 -4.030 29 HD22 LEU 5 1HD2 LEU 5 -19.249 10.602 -5.489 30 HD23 LEU 5 2HD2 LEU 5 -19.835 12.031 -4.629 31 HA PRO 6 HA PRO 6 -17.240 4.544 -2.823 32 HB2 PRO 6 1HB PRO 6 -17.267 3.509 -5.333 33 HB3 PRO 6 2HB PRO 6 -18.792 3.803 -4.432 34 HG2 PRO 6 1HG PRO 6 -17.483 5.588 -6.510 35 HG3 PRO 6 2HG PRO 6 -19.189 5.052 -6.404 36 HD2 PRO 6 1HD PRO 6 -18.278 7.481 -5.426 37 HD3 PRO 6 2HD PRO 6 -19.673 6.609 -4.724 38 H LEU 7 H LEU 7 -15.300 3.401 -3.575 39 HA LEU 7 HA LEU 7 -13.055 5.090 -3.699 40 HB2 LEU 7 1HB LEU 7 -13.065 2.988 -2.548 41 HB3 LEU 7 2HB LEU 7 -13.344 2.107 -4.058 42 HG LEU 7 HG LEU 7 -11.130 2.662 -4.888 43 HD11 LEU 7 1HD1 LEU 7 -10.755 4.922 -4.184 44 HD12 LEU 7 2HD1 LEU 7 -9.560 3.932 -3.349 45 HD13 LEU 7 3HD1 LEU 7 -10.993 4.510 -2.470 46 HD21 LEU 7 3HD2 LEU 7 -10.637 2.196 -1.955 47 HD22 LEU 7 1HD2 LEU 7 -9.812 1.465 -3.355 48 HD23 LEU 7 2HD2 LEU 7 -11.432 0.940 -2.886 49 H TYR 8 H TYR 8 -12.833 6.384 -5.431 50 HA TYR 8 HA TYR 8 -12.955 5.258 -8.155 51 HB2 TYR 8 1HB TYR 8 -12.615 7.648 -8.855 52 HB3 TYR 8 2HB TYR 8 -14.094 7.233 -8.025 53 HD1 TYR 8 1HD TYR 8 -10.856 9.057 -7.664 54 HD2 TYR 8 2HD TYR 8 -14.728 8.223 -5.954 55 HE1 TYR 8 1HE TYR 8 -10.560 10.935 -6.075 56 HE2 TYR 8 2HE TYR 8 -14.450 10.083 -4.364 57 HH TYR 8 HH TYR 8 -11.567 12.219 -4.441 58 H TYR 9 H TYR 9 -10.413 5.690 -5.850 59 HA TYR 9 HA TYR 9 -8.380 5.260 -7.978 60 HB2 TYR 9 1HB TYR 9 -8.646 7.720 -7.689 61 HB3 TYR 9 2HB TYR 9 -8.346 7.465 -6.006 62 HD1 TYR 9 2HD TYR 9 -6.803 7.335 -9.327 63 HD2 TYR 9 1HD TYR 9 -6.087 7.136 -5.092 64 HE1 TYR 9 2HE TYR 9 -4.390 7.640 -9.743 65 HE2 TYR 9 1HE TYR 9 -3.646 7.471 -5.483 66 HH TYR 9 HH TYR 9 -2.268 7.196 -8.587 67 H LEU 10 H LEU 10 -6.880 3.828 -7.319 68 HA LEU 10 HA LEU 10 -6.293 3.412 -4.457 69 HB2 LEU 10 1HB LEU 10 -8.031 1.899 -4.724 70 HB3 LEU 10 2HB LEU 10 -7.705 1.640 -6.381 71 HG LEU 10 HG LEU 10 -6.507 -0.052 -6.055 72 HD11 LEU 10 1HD1 LEU 10 -5.273 -0.682 -3.867 73 HD12 LEU 10 2HD1 LEU 10 -5.636 0.990 -3.312 74 HD13 LEU 10 3HD1 LEU 10 -4.565 0.690 -4.711 75 HD21 LEU 10 3HD2 LEU 10 -7.349 -1.538 -4.671 76 HD22 LEU 10 1HD2 LEU 10 -8.645 -0.304 -4.634 77 HD23 LEU 10 2HD2 LEU 10 -7.538 -0.434 -3.288 78 H GLN 11 H GLN 11 -4.150 3.599 -4.377 79 HA GLN 11 HA GLN 11 -2.391 2.246 -6.316 80 HB2 GLN 11 1HB GLN 11 -2.798 5.182 -6.224 81 HB3 GLN 11 2HB GLN 11 -1.165 4.752 -5.801 82 HG2 GLN 11 1HG GLN 11 -0.728 4.796 -7.928 83 HG3 GLN 11 2HG GLN 11 -1.495 3.208 -8.058 84 HE21 GLN 11 1HE2 GLN 11 -4.105 3.437 -8.398 85 HE22 GLN 11 2HE2 GLN 11 -4.465 4.600 -9.663 86 H ILE 12 H ILE 12 -0.264 1.834 -5.417 87 HA ILE 12 HA ILE 12 -0.214 1.347 -2.596 88 HB ILE 12 HB ILE 12 2.094 1.542 -4.565 89 HG12 ILE 12 1HG1 ILE 12 0.685 -0.174 -5.411 90 HG13 ILE 12 2HG1 ILE 12 2.053 -0.942 -4.642 91 HG21 ILE 12 1HG2 ILE 12 2.064 0.060 -1.878 92 HG22 ILE 12 2HG2 ILE 12 3.413 0.197 -3.009 93 HG23 ILE 12 3HG2 ILE 12 2.833 1.620 -2.136 94 HD11 ILE 12 3HD1 ILE 12 0.556 -1.351 -2.599 95 HD12 ILE 12 1HD1 ILE 12 -0.792 -0.758 -3.583 96 HD13 ILE 12 2HD1 ILE 12 0.103 -2.201 -4.074 97 H THR 13 H THR 13 0.973 4.075 -4.544 98 HA THR 13 HA THR 13 1.468 6.140 -4.098 99 HB THR 13 HB THR 13 0.011 5.913 -1.452 100 HG1 THR 13 1HG THR 13 -1.204 4.810 -2.985 101 HG21 THR 13 3HG2 THR 13 0.016 7.998 -3.680 102 HG22 THR 13 1HG2 THR 13 1.004 8.126 -2.198 103 HG23 THR 13 2HG2 THR 13 -0.750 8.146 -2.077 104 H GLY 14 H GLY 14 2.106 4.647 -0.771 105 HA2 GLY 14 1HA GLY 14 4.923 5.527 -1.120 106 HA3 GLY 14 2HA GLY 14 4.073 6.030 0.331 107 H ILE 15 H ILE 15 6.379 4.247 0.324 108 HA ILE 15 HA ILE 15 5.195 1.878 1.564 109 HB ILE 15 HB ILE 15 5.490 1.485 -0.941 110 HG12 ILE 15 1HG1 ILE 15 6.959 -0.477 0.824 111 HG13 ILE 15 2HG1 ILE 15 5.203 -0.299 0.745 112 HG21 ILE 15 1HG2 ILE 15 7.863 2.607 -0.923 113 HG22 ILE 15 2HG2 ILE 15 8.435 1.052 -0.351 114 HG23 ILE 15 3HG2 ILE 15 7.620 1.164 -1.930 115 HD11 ILE 15 3HD1 ILE 15 5.805 -2.081 -0.756 116 HD12 ILE 15 1HD1 ILE 15 5.310 -0.710 -1.746 117 HD13 ILE 15 2HD1 ILE 15 7.038 -1.102 -1.556 118 H THR 16 H THR 16 6.741 0.820 2.953 119 HA THR 16 HA THR 16 9.493 1.568 2.900 120 HB THR 16 HB THR 16 8.691 3.536 4.105 121 HG1 THR 16 1HG THR 16 9.729 2.082 6.216 122 HG21 THR 16 3HG2 THR 16 7.555 3.503 6.196 123 HG22 THR 16 1HG2 THR 16 7.729 1.735 6.381 124 HG23 THR 16 2HG2 THR 16 6.630 2.411 5.167 125 H SER 17 H SER 17 10.366 0.391 5.178 126 HA SER 17 HA SER 17 8.674 -1.800 6.033 127 HB2 SER 17 1HB SER 17 11.339 -2.363 4.696 128 HB3 SER 17 2HB SER 17 10.425 -3.529 5.672 129 HG SER 17 HG SER 17 8.877 -2.213 3.822 130 H ASP 18 H ASP 18 9.911 -2.927 7.863 131 HA ASP 18 HA ASP 18 10.612 -1.136 9.903 132 HB2 ASP 18 1HB ASP 18 9.854 -3.419 10.233 133 HB3 ASP 18 2HB ASP 18 11.305 -4.070 9.498 134 H GLY 19 H GLY 19 12.849 -3.060 7.795 135 HA2 GLY 19 1HA GLY 19 15.229 -1.703 8.781 136 HA3 GLY 19 2HA GLY 19 15.123 -2.908 7.499 137 H ASN 20 H ASN 20 13.065 -0.028 7.346 138 HA ASN 20 HA ASN 20 14.957 1.146 5.359 139 HB2 ASN 20 1HB ASN 20 12.535 0.127 4.570 140 HB3 ASN 20 2HB ASN 20 12.166 1.840 4.860 141 HD21 ASN 20 1HD2 ASN 20 14.622 -0.246 3.213 142 HD22 ASN 20 2HD2 ASN 20 14.801 0.876 1.876 143 H ASP 21 H ASP 21 13.882 1.621 8.405 144 HA ASP 21 HA ASP 21 13.863 3.409 9.805 145 HB2 ASP 21 1HB ASP 21 15.886 3.969 8.265 146 HB3 ASP 21 2HB ASP 21 14.861 5.253 7.636 147 H PHE 22 H PHE 22 11.550 2.805 8.046 148 HA PHE 22 HA PHE 22 9.502 3.597 7.459 149 HB2 PHE 22 1HB PHE 22 10.017 5.600 9.634 150 HB3 PHE 22 2HB PHE 22 8.515 5.463 8.761 151 HD1 PHE 22 2HD PHE 22 10.873 3.184 10.695 152 HD2 PHE 22 1HD PHE 22 6.804 4.171 9.641 153 HE1 PHE 22 2HE PHE 22 10.054 1.692 12.462 154 HE2 PHE 22 1HE PHE 22 5.998 2.687 11.440 155 HZ PHE 22 HZ PHE 22 7.608 1.435 12.861 156 H ALA 23 H ALA 23 11.975 4.604 6.007 157 HA ALA 23 HA ALA 23 11.362 7.169 4.912 158 HB1 ALA 23 1HB ALA 23 13.596 6.151 4.770 159 HB2 ALA 23 2HB ALA 23 12.940 4.843 3.763 160 HB3 ALA 23 3HB ALA 23 12.940 6.506 3.154 161 H TRP 24 H TRP 24 9.211 7.287 4.384 162 HA TRP 24 HA TRP 24 7.674 5.272 3.173 163 HB2 TRP 24 1HB TRP 24 7.319 8.226 3.755 164 HB3 TRP 24 2HB TRP 24 6.103 7.386 2.813 165 HD1 TRP 24 HD TRP 24 6.802 8.124 6.293 166 HE1 TRP 24 1HE TRP 24 5.412 6.667 7.850 167 HE3 TRP 24 3HE TRP 24 5.424 4.592 2.922 168 HZ2 TRP 24 2HZ TRP 24 3.940 4.103 7.640 169 HZ3 TRP 24 3HZ TRP 24 4.126 2.613 3.602 170 HH2 TRP 24 HH TRP 24 3.360 2.362 5.960 171 H ASP 25 H ASP 25 9.865 7.033 1.664 172 HA ASP 25 HA ASP 25 10.290 7.840 -0.527 173 HB2 ASP 25 1HB ASP 25 9.989 4.864 -0.262 174 HB3 ASP 25 2HB ASP 25 10.463 5.641 -1.794 175 H ASN 26 H ASN 26 8.752 9.195 -1.363 176 HA ASN 26 HA ASN 26 6.130 8.459 -2.107 177 HB2 ASN 26 1HB ASN 26 6.152 10.529 -3.592 178 HB3 ASN 26 2HB ASN 26 6.415 10.740 -1.869 179 HD21 ASN 26 1HD2 ASN 26 8.606 10.032 -4.649 180 HD22 ASN 26 2HD2 ASN 26 9.801 11.219 -4.245 181 H LEU 27 H LEU 27 5.571 6.898 -3.394 182 HA LEU 27 HA LEU 27 7.228 6.070 -5.582 183 HB2 LEU 27 1HB LEU 27 4.348 5.303 -5.085 184 HB3 LEU 27 2HB LEU 27 5.565 4.421 -6.015 185 HG LEU 27 HG LEU 27 5.595 4.938 -3.037 186 HD11 LEU 27 1HD1 LEU 27 5.020 2.673 -2.677 187 HD12 LEU 27 2HD1 LEU 27 5.178 2.256 -4.384 188 HD13 LEU 27 3HD1 LEU 27 3.851 3.320 -3.823 189 HD21 LEU 27 3HD2 LEU 27 7.473 3.644 -2.714 190 HD22 LEU 27 1HD2 LEU 27 7.924 4.668 -4.035 191 HD23 LEU 27 2HD2 LEU 27 7.461 2.954 -4.334 192 H THR 28 H THR 28 7.098 6.571 -7.722 193 HA THR 28 HA THR 28 5.626 8.841 -8.599 194 HB THR 28 HB THR 28 6.339 7.644 -10.876 195 HG1 THR 28 1HG THR 28 8.188 6.484 -10.665 196 HG21 THR 28 3HG2 THR 28 7.334 9.772 -9.792 197 HG22 THR 28 1HG2 THR 28 8.517 8.817 -10.693 198 HG23 THR 28 2HG2 THR 28 8.458 8.722 -8.922 199 H SER 29 H SER 29 3.857 8.865 -10.137 200 HA SER 29 HA SER 29 1.682 7.213 -9.399 201 HB2 SER 29 1HB SER 29 2.061 8.823 -11.953 202 HB3 SER 29 2HB SER 29 0.534 8.134 -11.383 203 HG SER 29 HG SER 29 0.786 10.323 -10.822 204 H SER 30 H SER 30 3.509 7.136 -12.488 205 HA SER 30 HA SER 30 2.550 4.534 -13.234 206 HB2 SER 30 1HB SER 30 4.847 6.063 -14.447 207 HB3 SER 30 2HB SER 30 3.788 4.865 -15.201 208 HG SER 30 HG SER 30 3.196 6.927 -15.812 209 H GLN 31 H GLN 31 4.460 4.834 -10.712 210 HA GLN 31 HA GLN 31 6.941 3.585 -11.379 211 HB2 GLN 31 1HB GLN 31 6.218 4.708 -9.140 212 HB3 GLN 31 2HB GLN 31 5.421 3.225 -8.766 213 HG2 GLN 31 1HG GLN 31 7.659 2.113 -9.164 214 HG3 GLN 31 2HG GLN 31 8.389 3.709 -9.237 215 HE21 GLN 31 1HE2 GLN 31 8.965 4.717 -7.170 216 HE22 GLN 31 2HE2 GLN 31 8.478 3.961 -5.683 217 H THR 32 H THR 32 7.460 1.399 -11.709 218 HA THR 32 HA THR 32 5.413 -0.668 -11.045 219 HB THR 32 HB THR 32 5.973 -1.870 -13.023 220 HG1 THR 32 1HG THR 32 7.939 0.149 -13.434 221 HG21 THR 32 3HG2 THR 32 4.346 0.072 -13.191 222 HG22 THR 32 1HG2 THR 32 5.076 -0.445 -14.730 223 HG23 THR 32 2HG2 THR 32 5.654 1.018 -13.931 224 H LYS 33 H LYS 33 8.353 0.516 -10.121 225 HA LYS 33 HA LYS 33 9.164 -2.014 -8.924 226 HB2 LYS 33 1HB LYS 33 10.512 -0.825 -11.240 227 HB3 LYS 33 2HB LYS 33 11.585 -0.706 -9.850 228 HG2 LYS 33 1HG LYS 33 11.831 -2.966 -9.620 229 HG3 LYS 33 2HG LYS 33 10.187 -3.286 -10.120 230 HD2 LYS 33 1HD LYS 33 11.183 -2.480 -12.536 231 HD3 LYS 33 2HD LYS 33 12.646 -3.135 -11.782 232 HE2 LYS 33 1HE LYS 33 11.565 -4.934 -12.968 233 HE3 LYS 33 2HE LYS 33 11.345 -5.226 -11.237 234 HZ1 LYS 33 3HZ LYS 33 9.101 -4.165 -11.512 235 HZ2 LYS 33 1HZ LYS 33 9.280 -5.603 -12.236 236 HZ3 LYS 33 2HZ LYS 33 9.304 -4.202 -13.126 237 H ALA 34 H ALA 34 10.156 -1.785 -7.014 238 HA ALA 34 HA ALA 34 9.412 0.421 -5.502 239 HB1 ALA 34 1HB ALA 34 9.770 -1.830 -4.593 240 HB2 ALA 34 2HB ALA 34 11.498 -1.772 -5.024 241 HB3 ALA 34 3HB ALA 34 10.861 -0.728 -3.748 242 HA PRO 35 HA PRO 35 12.910 3.234 -5.700 243 HB2 PRO 35 1HB PRO 35 13.419 3.571 -2.949 244 HB3 PRO 35 2HB PRO 35 12.279 4.534 -3.942 245 HG2 PRO 35 1HG PRO 35 11.666 2.217 -2.123 246 HG3 PRO 35 2HG PRO 35 10.666 3.665 -2.469 247 HD2 PRO 35 1HD PRO 35 10.098 1.284 -3.524 248 HD3 PRO 35 2HD PRO 35 9.834 2.786 -4.437 249 H ASN 36 H ASN 36 12.925 0.371 -3.483 250 HA ASN 36 HA ASN 36 15.822 0.058 -3.795 251 HB2 ASN 36 1HB ASN 36 14.665 1.751 -1.797 252 HB3 ASN 36 2HB ASN 36 15.005 0.245 -0.958 253 HD21 ASN 36 1HD2 ASN 36 16.327 3.152 -1.825 254 HD22 ASN 36 2HD2 ASN 36 17.999 2.753 -1.919 255 H VAL 37 H VAL 37 16.592 -1.648 -2.356 256 HA VAL 37 HA VAL 37 14.785 -3.830 -1.756 257 HB VAL 37 HB VAL 37 16.900 -4.563 -2.320 258 HG11 VAL 37 1HG1 VAL 37 18.159 -2.629 -0.552 259 HG12 VAL 37 2HG1 VAL 37 18.893 -4.042 -1.434 260 HG13 VAL 37 3HG1 VAL 37 18.102 -2.790 -2.356 261 HG21 VAL 37 3HG2 VAL 37 15.965 -5.068 0.359 262 HG22 VAL 37 1HG2 VAL 37 16.785 -6.116 -0.813 263 HG23 VAL 37 2HG2 VAL 37 17.734 -5.101 0.295 264 H LEU 38 H LEU 38 13.321 -3.432 -0.421 265 HA LEU 38 HA LEU 38 13.549 -1.761 1.963 266 HB2 LEU 38 1HB LEU 38 11.390 -3.767 1.202 267 HB3 LEU 38 2HB LEU 38 11.319 -2.462 2.388 268 HG LEU 38 HG LEU 38 11.487 -2.101 -0.628 269 HD11 LEU 38 1HD1 LEU 38 9.342 -2.991 0.142 270 HD12 LEU 38 2HD1 LEU 38 9.180 -1.330 -0.449 271 HD13 LEU 38 3HD1 LEU 38 9.181 -1.656 1.303 272 HD21 LEU 38 3HD2 LEU 38 11.012 0.297 -0.132 273 HD22 LEU 38 1HD2 LEU 38 12.576 -0.218 0.481 274 HD23 LEU 38 2HD2 LEU 38 11.209 -0.033 1.605 275 H LYS 39 H LYS 39 14.926 -2.594 3.529 276 HA LYS 39 HA LYS 39 15.248 -5.481 3.805 277 HB2 LYS 39 1HB LYS 39 16.374 -3.063 5.250 278 HB3 LYS 39 2HB LYS 39 16.609 -4.667 5.916 279 HG2 LYS 39 1HG LYS 39 18.083 -5.320 4.347 280 HG3 LYS 39 2HG LYS 39 17.267 -4.470 3.035 281 HD2 LYS 39 1HD LYS 39 18.762 -2.827 5.076 282 HD3 LYS 39 2HD LYS 39 19.649 -3.744 3.836 283 HE2 LYS 39 1HE LYS 39 18.024 -2.771 2.146 284 HE3 LYS 39 2HE LYS 39 17.550 -1.577 3.390 285 HZ1 LYS 39 3HZ LYS 39 19.764 -0.701 3.358 286 HZ2 LYS 39 1HZ LYS 39 19.395 -0.938 1.785 287 HZ3 LYS 39 2HZ LYS 39 20.374 -1.993 2.567 288 H GLY 40 H GLY 40 14.836 -6.651 5.731 289 HA2 GLY 40 1HA GLY 40 13.748 -7.005 7.821 290 HA3 GLY 40 2HA GLY 40 12.633 -5.670 7.471 291 H ASN 41 H ASN 41 10.973 -7.273 7.842 292 HA ASN 41 HA ASN 41 10.171 -8.688 5.326 293 HB2 ASN 41 1HB ASN 41 10.761 -10.424 6.920 294 HB3 ASN 41 2HB ASN 41 9.850 -9.609 8.187 295 HD21 ASN 41 1HD2 ASN 41 7.836 -10.381 8.592 296 HD22 ASN 41 2HD2 ASN 41 6.943 -11.396 7.485 297 H LYS 42 H LYS 42 9.271 -6.745 8.202 298 HA LYS 42 HA LYS 42 6.457 -6.798 7.481 299 HB2 LYS 42 1HB LYS 42 8.085 -5.125 9.405 300 HB3 LYS 42 2HB LYS 42 6.444 -4.682 9.004 301 HG2 LYS 42 1HG LYS 42 7.096 -7.465 10.044 302 HG3 LYS 42 2HG LYS 42 6.703 -6.097 11.097 303 HD2 LYS 42 1HD LYS 42 4.539 -5.785 9.889 304 HD3 LYS 42 2HD LYS 42 4.871 -7.238 8.931 305 HE2 LYS 42 1HE LYS 42 4.845 -8.638 10.894 306 HE3 LYS 42 2HE LYS 42 4.829 -7.229 11.975 307 HZ1 LYS 42 3HZ LYS 42 2.607 -7.800 10.111 308 HZ2 LYS 42 1HZ LYS 42 2.627 -6.747 11.402 309 HZ3 LYS 42 2HZ LYS 42 2.674 -8.356 11.652 310 H LEU 43 H LEU 43 5.784 -5.966 5.715 311 HA LEU 43 HA LEU 43 7.236 -3.850 4.300 312 HB2 LEU 43 1HB LEU 43 6.500 -6.299 3.412 313 HB3 LEU 43 2HB LEU 43 5.042 -5.425 2.967 314 HG LEU 43 HG LEU 43 7.911 -4.864 2.143 315 HD11 LEU 43 1HD1 LEU 43 5.531 -5.434 0.363 316 HD12 LEU 43 2HD1 LEU 43 6.654 -6.685 0.950 317 HD13 LEU 43 3HD1 LEU 43 7.255 -5.376 -0.082 318 HD21 LEU 43 3HD2 LEU 43 5.421 -3.226 1.448 319 HD22 LEU 43 1HD2 LEU 43 7.041 -3.054 0.725 320 HD23 LEU 43 2HD2 LEU 43 6.805 -2.662 2.407 321 H TYR 44 H TYR 44 6.471 -1.931 5.071 322 HA TYR 44 HA TYR 44 3.626 -1.676 5.774 323 HB2 TYR 44 1HB TYR 44 5.914 0.282 6.174 324 HB3 TYR 44 2HB TYR 44 4.296 0.443 6.786 325 HD1 TYR 44 2HD TYR 44 3.456 -1.914 8.035 326 HD2 TYR 44 1HD TYR 44 7.453 -0.328 7.838 327 HE1 TYR 44 2HE TYR 44 4.024 -3.173 10.083 328 HE2 TYR 44 1HE TYR 44 8.050 -1.528 9.903 329 HH TYR 44 HH TYR 44 7.247 -2.896 11.671 330 H VAL 45 H VAL 45 2.264 -1.072 4.200 331 HA VAL 45 HA VAL 45 3.214 0.799 2.060 332 HB VAL 45 HB VAL 45 0.700 -0.904 2.224 333 HG11 VAL 45 1HG1 VAL 45 1.685 0.991 0.089 334 HG12 VAL 45 2HG1 VAL 45 0.451 -0.272 -0.191 335 HG13 VAL 45 3HG1 VAL 45 0.153 1.024 0.965 336 HG21 VAL 45 3HG2 VAL 45 2.806 -2.219 1.850 337 HG22 VAL 45 1HG2 VAL 45 1.642 -2.267 0.538 338 HG23 VAL 45 2HG2 VAL 45 3.092 -1.245 0.391 339 H LYS 46 H LYS 46 2.106 2.763 1.715 340 HA LYS 46 HA LYS 46 0.072 3.589 3.691 341 HB2 LYS 46 1HB LYS 46 2.181 4.776 4.169 342 HB3 LYS 46 2HB LYS 46 2.359 5.268 2.483 343 HG2 LYS 46 1HG LYS 46 -0.162 6.057 3.828 344 HG3 LYS 46 2HG LYS 46 1.278 6.752 4.533 345 HD2 LYS 46 1HD LYS 46 0.641 7.114 1.605 346 HD3 LYS 46 2HD LYS 46 0.050 8.177 2.890 347 HE2 LYS 46 1HE LYS 46 2.409 8.445 3.711 348 HE3 LYS 46 2HE LYS 46 2.958 7.522 2.318 349 HZ1 LYS 46 3HZ LYS 46 1.605 9.392 1.041 350 HZ2 LYS 46 1HZ LYS 46 3.096 9.745 1.612 351 HZ3 LYS 46 2HZ LYS 46 1.743 10.208 2.435 352 H ALA 47 H ALA 47 -1.618 3.064 2.374 353 HA ALA 47 HA ALA 47 -1.354 3.475 -0.557 354 HB1 ALA 47 1HB ALA 47 -1.746 1.213 -0.228 355 HB2 ALA 47 2HB ALA 47 -2.806 1.474 1.169 356 HB3 ALA 47 3HB ALA 47 -3.387 1.849 -0.468 357 H ARG 48 H ARG 48 -2.497 4.990 -1.476 358 HA ARG 48 HA ARG 48 -4.443 6.607 -0.074 359 HB2 ARG 48 1HB ARG 48 -2.820 7.297 -1.908 360 HB3 ARG 48 2HB ARG 48 -3.803 6.403 -3.062 361 HG2 ARG 48 1HG ARG 48 -4.640 8.535 -3.361 362 HG3 ARG 48 2HG ARG 48 -5.750 7.942 -2.120 363 HD2 ARG 48 1HD ARG 48 -5.082 10.094 -1.454 364 HD3 ARG 48 2HD ARG 48 -4.174 8.979 -0.387 365 HE ARG 48 HE ARG 48 -2.423 9.410 -2.361 366 HH11 ARG 48 1HH1 ARG 48 -4.141 11.601 -0.186 367 HH12 ARG 48 2HH1 ARG 48 -3.287 13.029 -0.713 368 HH21 ARG 48 1HH2 ARG 48 -1.093 11.281 -2.865 369 HH22 ARG 48 2HH2 ARG 48 -1.547 12.825 -2.273 370 H PHE 49 H PHE 49 -6.652 6.076 0.112 371 HA PHE 49 HA PHE 49 -7.881 4.542 -2.121 372 HB2 PHE 49 1HB PHE 49 -8.715 4.417 0.824 373 HB3 PHE 49 2HB PHE 49 -9.543 3.671 -0.530 374 HD1 PHE 49 2HD PHE 49 -6.379 3.702 1.369 375 HD2 PHE 49 1HD PHE 49 -8.794 1.441 -1.372 376 HE1 PHE 49 2HE PHE 49 -4.921 1.786 1.652 377 HE2 PHE 49 1HE PHE 49 -7.382 -0.523 -1.033 378 HZ PHE 49 HZ PHE 49 -5.370 -0.369 0.437 379 H MET 50 H MET 50 -8.686 6.260 -3.297 380 HA MET 50 HA MET 50 -9.877 8.549 -1.818 381 HB2 MET 50 1HB MET 50 -9.841 8.272 -4.807 382 HB3 MET 50 2HB MET 50 -10.038 9.719 -3.851 383 HG2 MET 50 1HG MET 50 -7.457 8.206 -3.597 384 HG3 MET 50 2HG MET 50 -7.752 9.080 -5.087 385 HE1 MET 50 3HE MET 50 -7.906 9.515 -1.198 386 HE2 MET 50 1HE MET 50 -7.701 11.272 -1.027 387 HE3 MET 50 2HE MET 50 -9.179 10.634 -1.764 388 H GLY 51 H GLY 51 -11.502 7.304 -0.817 389 HA2 GLY 51 1HA GLY 51 -14.001 7.743 -1.207 390 HA3 GLY 51 2HA GLY 51 -13.848 6.656 -2.558 391 H TYR 52 H TYR 52 -15.726 5.997 -0.780 392 HA TYR 52 HA TYR 52 -14.826 4.397 1.425 393 HB2 TYR 52 1HB TYR 52 -17.402 5.149 0.197 394 HB3 TYR 52 2HB TYR 52 -17.375 3.486 0.720 395 HD1 TYR 52 1HD TYR 52 -16.999 2.844 3.117 396 HD2 TYR 52 2HD TYR 52 -17.364 6.945 1.819 397 HE1 TYR 52 1HE TYR 52 -17.414 3.574 5.465 398 HE2 TYR 52 2HE TYR 52 -17.852 7.654 4.144 399 HH TYR 52 HH TYR 52 -17.556 5.407 6.876 400 H THR 53 H THR 53 -14.130 2.399 1.474 401 HA THR 53 HA THR 53 -15.414 0.366 -0.080 402 HB THR 53 HB THR 53 -13.485 0.766 -1.555 403 HG1 THR 53 1HG THR 53 -13.623 -1.255 -1.672 404 HG21 THR 53 3HG2 THR 53 -11.135 0.303 -0.600 405 HG22 THR 53 1HG2 THR 53 -11.838 0.612 0.996 406 HG23 THR 53 2HG2 THR 53 -11.891 1.874 -0.194 407 H LYS 54 H LYS 54 -15.122 -1.664 1.025 408 HA LYS 54 HA LYS 54 -13.606 -1.642 3.483 409 HB2 LYS 54 1HB LYS 54 -16.624 -2.025 3.491 410 HB3 LYS 54 2HB LYS 54 -15.606 -2.805 4.709 411 HG2 LYS 54 1HG LYS 54 -15.763 -1.019 5.968 412 HG3 LYS 54 2HG LYS 54 -14.733 -0.181 4.843 413 HD2 LYS 54 1HD LYS 54 -16.584 1.247 5.013 414 HD3 LYS 54 2HD LYS 54 -16.972 0.342 3.533 415 HE2 LYS 54 1HE LYS 54 -18.272 -1.283 5.033 416 HE3 LYS 54 2HE LYS 54 -17.978 -0.186 6.370 417 HZ1 LYS 54 3HZ LYS 54 -20.112 0.221 5.493 418 HZ2 LYS 54 1HZ LYS 54 -19.597 0.370 3.959 419 HZ3 LYS 54 2HZ LYS 54 -19.246 1.531 5.087 420 H LEU 55 H LEU 55 -13.331 -2.789 0.811 421 HA LEU 55 HA LEU 55 -13.187 -5.676 1.464 422 HB2 LEU 55 1HB LEU 55 -14.188 -4.481 -1.138 423 HB3 LEU 55 2HB LEU 55 -13.700 -6.137 -0.943 424 HG LEU 55 HG LEU 55 -16.002 -6.137 -1.065 425 HD11 LEU 55 1HD1 LEU 55 -16.691 -7.213 0.971 426 HD12 LEU 55 2HD1 LEU 55 -15.351 -6.477 1.885 427 HD13 LEU 55 3HD1 LEU 55 -15.021 -7.669 0.599 428 HD21 LEU 55 3HD2 LEU 55 -17.566 -4.880 0.149 429 HD22 LEU 55 1HD2 LEU 55 -16.360 -3.717 -0.414 430 HD23 LEU 55 2HD2 LEU 55 -16.365 -4.261 1.283 431 H THR 56 H THR 56 -10.944 -4.743 1.991 432 HA THR 56 HA THR 56 -9.269 -4.150 -0.375 433 HB THR 56 HB THR 56 -8.369 -4.745 2.477 434 HG1 THR 56 1HG THR 56 -9.213 -3.029 3.116 435 HG21 THR 56 3HG2 THR 56 -6.448 -3.366 1.869 436 HG22 THR 56 1HG2 THR 56 -7.167 -3.002 0.289 437 HG23 THR 56 2HG2 THR 56 -6.639 -4.658 0.690 438 H VAL 57 H VAL 57 -8.159 -5.863 -1.466 439 HA VAL 57 HA VAL 57 -7.836 -8.400 0.065 440 HB VAL 57 HB VAL 57 -8.428 -8.170 -2.903 441 HG11 VAL 57 1HG1 VAL 57 -7.089 -10.119 -2.588 442 HG12 VAL 57 2HG1 VAL 57 -7.899 -10.575 -1.088 443 HG13 VAL 57 3HG1 VAL 57 -8.756 -10.696 -2.626 444 HG21 VAL 57 3HG2 VAL 57 -10.457 -7.655 -1.644 445 HG22 VAL 57 1HG2 VAL 57 -10.590 -9.265 -2.349 446 HG23 VAL 57 2HG2 VAL 57 -10.234 -9.079 -0.620 447 H ILE 58 H ILE 58 -5.952 -9.400 -0.055 448 HA ILE 58 HA ILE 58 -3.679 -8.384 -1.648 449 HB ILE 58 HB ILE 58 -3.732 -8.987 1.343 450 HG12 ILE 58 1HG1 ILE 58 -2.756 -6.358 0.202 451 HG13 ILE 58 2HG1 ILE 58 -4.472 -6.587 0.447 452 HG21 ILE 58 1HG2 ILE 58 -1.313 -8.447 1.328 453 HG22 ILE 58 2HG2 ILE 58 -1.655 -9.826 0.281 454 HG23 ILE 58 3HG2 ILE 58 -1.364 -8.229 -0.431 455 HD11 ILE 58 3HD1 ILE 58 -2.368 -6.823 2.627 456 HD12 ILE 58 1HD1 ILE 58 -3.541 -5.507 2.391 457 HD13 ILE 58 2HD1 ILE 58 -4.100 -7.122 2.855 458 H THR 59 H THR 59 -3.638 -10.227 -2.984 459 HA THR 59 HA THR 59 -4.853 -12.643 -2.351 460 HB THR 59 HB THR 59 -2.953 -11.800 -4.554 461 HG1 THR 59 1HG THR 59 -5.787 -11.860 -4.464 462 HG21 THR 59 3HG2 THR 59 -4.078 -13.473 -5.962 463 HG22 THR 59 1HG2 THR 59 -4.993 -14.059 -4.551 464 HG23 THR 59 2HG2 THR 59 -3.213 -14.219 -4.616 465 H GLY 60 H GLY 60 -1.335 -11.844 -2.503 466 HA2 GLY 60 1HA GLY 60 0.458 -12.815 -1.411 467 HA3 GLY 60 2HA GLY 60 -0.704 -13.696 -0.408 468 H LYS 61 H LYS 61 1.284 -15.290 -0.717 469 HA LYS 61 HA LYS 61 1.290 -16.700 -3.241 470 HB2 LYS 61 1HB LYS 61 2.982 -17.917 -2.501 471 HB3 LYS 61 2HB LYS 61 3.146 -16.545 -1.438 472 HG2 LYS 61 1HG LYS 61 1.583 -18.598 -0.110 473 HG3 LYS 61 2HG LYS 61 3.003 -19.312 -0.850 474 HD2 LYS 61 1HD LYS 61 2.881 -17.221 1.296 475 HD3 LYS 61 2HD LYS 61 3.533 -18.834 1.400 476 HE2 LYS 61 1HE LYS 61 4.805 -16.544 -0.201 477 HE3 LYS 61 2HE LYS 61 5.238 -17.017 1.426 478 HZ1 LYS 61 3HZ LYS 61 5.986 -19.149 0.631 479 HZ2 LYS 61 1HZ LYS 61 6.764 -17.918 -0.038 480 HZ3 LYS 61 2HZ LYS 61 5.651 -18.681 -0.950 481 H ASP 62 H ASP 62 -0.619 -16.984 -0.366 482 HA ASP 62 HA ASP 62 -1.744 -19.553 -0.797 483 HB2 ASP 62 1HB ASP 62 -2.739 -17.030 0.582 484 HB3 ASP 62 2HB ASP 62 -3.746 -18.456 0.399 485 H GLY 63 H GLY 63 -2.294 -16.586 -2.635 486 HA2 GLY 63 1HA GLY 63 -3.597 -16.328 -4.527 487 HA3 GLY 63 2HA GLY 63 -4.066 -18.015 -4.390 488 H LYS 64 H LYS 64 -4.588 -15.759 -1.700 489 HA LYS 64 HA LYS 64 -7.524 -15.685 -2.206 490 HB2 LYS 64 1HB LYS 64 -7.990 -16.442 0.006 491 HB3 LYS 64 2HB LYS 64 -7.591 -17.617 -1.251 492 HG2 LYS 64 1HG LYS 64 -5.821 -18.409 -0.263 493 HG3 LYS 64 2HG LYS 64 -5.204 -16.813 0.229 494 HD2 LYS 64 1HD LYS 64 -6.047 -16.909 2.257 495 HD3 LYS 64 2HD LYS 64 -7.576 -17.627 1.694 496 HE2 LYS 64 1HE LYS 64 -6.727 -19.831 1.760 497 HE3 LYS 64 2HE LYS 64 -5.047 -19.331 1.672 498 HZ1 LYS 64 3HZ LYS 64 -4.918 -19.261 3.884 499 HZ2 LYS 64 1HZ LYS 64 -6.286 -20.114 3.885 500 HZ3 LYS 64 2HZ LYS 64 -6.377 -18.481 4.072 501 H ASN 65 H ASN 65 -5.954 -15.038 0.913 502 HA ASN 65 HA ASN 65 -6.138 -12.147 0.529 503 HB2 ASN 65 1HB ASN 65 -8.571 -13.311 0.703 504 HB3 ASN 65 2HB ASN 65 -8.235 -13.252 2.405 505 HD21 ASN 65 1HD2 ASN 65 -7.320 -10.890 3.112 506 HD22 ASN 65 2HD2 ASN 65 -8.306 -9.617 2.403 507 H LEU 66 H LEU 66 -4.050 -12.164 1.467 508 HA LEU 66 HA LEU 66 -3.338 -13.482 3.863 509 HB2 LEU 66 1HB LEU 66 -2.248 -10.841 2.798 510 HB3 LEU 66 2HB LEU 66 -1.487 -11.873 4.007 511 HG LEU 66 HG LEU 66 -1.955 -12.508 1.083 512 HD11 LEU 66 1HD1 LEU 66 0.555 -12.125 2.791 513 HD12 LEU 66 2HD1 LEU 66 -0.039 -11.030 1.534 514 HD13 LEU 66 3HD1 LEU 66 0.587 -12.629 1.102 515 HD21 LEU 66 3HD2 LEU 66 -1.018 -14.344 3.315 516 HD22 LEU 66 1HD2 LEU 66 -0.604 -14.645 1.625 517 HD23 LEU 66 2HD2 LEU 66 -2.297 -14.621 2.122 518 H LEU 67 H LEU 67 -5.077 -10.417 3.441 519 HA LEU 67 HA LEU 67 -4.828 -9.445 6.079 520 HB2 LEU 67 1HB LEU 67 -5.765 -8.465 3.845 521 HB3 LEU 67 2HB LEU 67 -7.299 -9.142 4.405 522 HG LEU 67 HG LEU 67 -6.810 -7.767 6.570 523 HD11 LEU 67 1HD1 LEU 67 -5.185 -6.129 4.606 524 HD12 LEU 67 2HD1 LEU 67 -4.483 -7.124 5.902 525 HD13 LEU 67 3HD1 LEU 67 -5.546 -5.762 6.304 526 HD21 LEU 67 3HD2 LEU 67 -7.620 -6.518 3.906 527 HD22 LEU 67 1HD2 LEU 67 -7.953 -5.811 5.505 528 HD23 LEU 67 2HD2 LEU 67 -8.679 -7.358 5.040 529 H TYR 68 H TYR 68 -6.630 -12.216 4.869 530 HA TYR 68 HA TYR 68 -8.148 -12.464 7.385 531 HB2 TYR 68 1HB TYR 68 -9.420 -12.774 5.318 532 HB3 TYR 68 2HB TYR 68 -8.242 -13.934 4.739 533 HD1 TYR 68 2HD TYR 68 -9.508 -14.004 8.289 534 HD2 TYR 68 1HD TYR 68 -9.846 -15.644 4.293 535 HE1 TYR 68 2HE TYR 68 -10.652 -15.975 9.199 536 HE2 TYR 68 1HE TYR 68 -10.918 -17.657 5.222 537 HH TYR 68 HH TYR 68 -11.882 -18.609 7.138 538 H ASN 69 H ASN 69 -5.348 -13.794 5.550 539 HA ASN 69 HA ASN 69 -5.061 -16.214 7.035 540 HB2 ASN 69 1HB ASN 69 -3.877 -15.682 4.889 541 HB3 ASN 69 2HB ASN 69 -2.838 -14.557 5.782 542 HD21 ASN 69 1HD2 ASN 69 -2.756 -17.707 4.540 543 HD22 ASN 69 2HD2 ASN 69 -1.925 -18.487 5.840 544 H GLY 70 H GLY 70 -3.914 -12.892 7.562 545 HA2 GLY 70 1HA GLY 70 -4.407 -12.058 9.756 546 HA3 GLY 70 2HA GLY 70 -3.777 -13.545 10.471 547 H THR 71 H THR 71 -1.533 -12.984 8.136 548 HA THR 71 HA THR 71 0.299 -11.688 10.045 549 HB THR 71 HB THR 71 0.771 -12.161 7.088 550 HG1 THR 71 1HG THR 71 0.296 -14.037 8.934 551 HG21 THR 71 3HG2 THR 71 2.694 -12.068 9.455 552 HG22 THR 71 1HG2 THR 71 2.506 -10.812 8.209 553 HG23 THR 71 2HG2 THR 71 3.129 -12.408 7.770 554 H ALA 72 H ALA 72 -1.210 -10.828 6.905 555 HA ALA 72 HA ALA 72 -0.420 -8.013 7.126 556 HB1 ALA 72 1HB ALA 72 -0.693 -9.178 4.896 557 HB2 ALA 72 2HB ALA 72 -2.420 -9.370 5.247 558 HB3 ALA 72 3HB ALA 72 -1.731 -7.744 5.065 559 H LYS 73 H LYS 73 -1.714 -6.394 7.910 560 HA LYS 73 HA LYS 73 -4.554 -6.694 8.419 561 HB2 LYS 73 1HB LYS 73 -3.760 -7.922 10.319 562 HB3 LYS 73 2HB LYS 73 -2.435 -6.812 10.603 563 HG2 LYS 73 1HG LYS 73 -3.787 -5.156 11.480 564 HG3 LYS 73 2HG LYS 73 -5.285 -5.864 10.816 565 HD2 LYS 73 1HD LYS 73 -4.289 -7.862 12.553 566 HD3 LYS 73 2HD LYS 73 -3.931 -6.350 13.376 567 HE2 LYS 73 1HE LYS 73 -6.094 -6.820 14.139 568 HE3 LYS 73 2HE LYS 73 -6.379 -5.663 12.842 569 HZ1 LYS 73 3HZ LYS 73 -6.705 -7.793 11.415 570 HZ2 LYS 73 1HZ LYS 73 -7.888 -7.397 12.491 571 HZ3 LYS 73 2HZ LYS 73 -6.821 -8.557 12.875 572 H MET 74 H MET 74 -5.430 -4.442 9.215 573 HA MET 74 HA MET 74 -3.531 -2.283 8.698 574 HB2 MET 74 1HB MET 74 -5.424 -0.940 8.565 575 HB3 MET 74 2HB MET 74 -5.771 -2.376 7.592 576 HG2 MET 74 1HG MET 74 -6.888 -3.255 9.811 577 HG3 MET 74 2HG MET 74 -6.761 -1.559 10.303 578 HE1 MET 74 3HE MET 74 -8.903 0.074 7.377 579 HE2 MET 74 1HE MET 74 -7.586 0.304 8.560 580 HE3 MET 74 2HE MET 74 -7.288 -0.614 7.068 581 H PHE 75 H PHE 75 -2.884 -0.975 10.282 582 HA PHE 75 HA PHE 75 -3.827 -1.268 13.072 583 HB2 PHE 75 1HB PHE 75 -1.556 -1.165 13.808 584 HB3 PHE 75 2HB PHE 75 -1.761 -2.524 12.720 585 HD1 PHE 75 2HD PHE 75 -0.930 -2.276 10.250 586 HD2 PHE 75 1HD PHE 75 0.212 0.367 13.477 587 HE1 PHE 75 2HE PHE 75 0.983 -1.451 8.912 588 HE2 PHE 75 1HE PHE 75 2.250 1.007 12.178 589 HZ PHE 75 HZ PHE 75 2.619 0.082 9.918 590 H LYS 76 H LYS 76 -3.623 0.876 10.421 591 HA LYS 76 HA LYS 76 -3.802 3.249 12.108 592 HB2 LYS 76 1HB LYS 76 -1.329 2.965 11.880 593 HB3 LYS 76 2HB LYS 76 -1.493 2.804 10.142 594 HG2 LYS 76 1HG LYS 76 -2.407 5.164 10.059 595 HG3 LYS 76 2HG LYS 76 -2.100 5.280 11.797 596 HD2 LYS 76 1HD LYS 76 0.348 4.783 11.308 597 HD3 LYS 76 2HD LYS 76 -0.049 4.802 9.589 598 HE2 LYS 76 1HE LYS 76 0.355 7.010 9.608 599 HE3 LYS 76 2HE LYS 76 -1.181 7.193 10.469 600 HZ1 LYS 76 3HZ LYS 76 0.520 8.271 11.703 601 HZ2 LYS 76 1HZ LYS 76 1.527 6.982 11.613 602 HZ3 LYS 76 2HZ LYS 76 0.152 6.908 12.550 603 H SER 77 H SER 77 -5.182 4.699 10.928 604 HA SER 77 HA SER 77 -4.890 4.636 8.037 605 HB2 SER 77 1HB SER 77 -7.238 4.970 7.564 606 HB3 SER 77 2HB SER 77 -6.902 3.365 8.224 607 HG SER 77 HG SER 77 -7.777 3.990 10.183 608 H ASP 78 H ASP 78 -5.477 6.870 7.155 609 HA ASP 78 HA ASP 78 -5.649 8.982 9.243 610 HB2 ASP 78 1HB ASP 78 -3.262 8.515 8.272 611 HB3 ASP 78 2HB ASP 78 -3.853 9.364 6.842 612 H ALA 79 H ALA 79 -6.441 11.056 8.225 613 HA ALA 79 HA ALA 79 -8.679 10.304 6.380 614 HB1 ALA 79 1HB ALA 79 -8.471 12.553 8.427 615 HB2 ALA 79 2HB ALA 79 -9.881 12.201 7.403 616 HB3 ALA 79 3HB ALA 79 -9.362 11.030 8.635 617 H ILE 80 H ILE 80 -8.463 10.973 4.306 618 HA ILE 80 HA ILE 80 -6.494 13.105 3.745 619 HB ILE 80 HB ILE 80 -7.994 11.379 1.765 620 HG12 ILE 80 1HG1 ILE 80 -5.065 11.035 2.517 621 HG13 ILE 80 2HG1 ILE 80 -6.311 10.195 3.418 622 HG21 ILE 80 1HG2 ILE 80 -7.126 13.565 0.906 623 HG22 ILE 80 2HG2 ILE 80 -5.515 13.165 1.518 624 HG23 ILE 80 3HG2 ILE 80 -6.231 12.231 0.197 625 HD11 ILE 80 3HD1 ILE 80 -5.965 10.038 0.410 626 HD12 ILE 80 1HD1 ILE 80 -5.420 8.802 1.552 627 HD13 ILE 80 2HD1 ILE 80 -7.150 9.138 1.337 628 H LEU 81 H LEU 81 -7.517 14.773 4.479 629 HA LEU 81 HA LEU 81 -10.129 15.663 3.427 630 HB2 LEU 81 1HB LEU 81 -8.013 17.389 4.750 631 HB3 LEU 81 2HB LEU 81 -9.683 17.814 4.385 632 HG LEU 81 HG LEU 81 -8.687 15.864 6.487 633 HD11 LEU 81 1HD1 LEU 81 -8.659 18.292 7.008 634 HD12 LEU 81 2HD1 LEU 81 -9.835 17.411 7.997 635 HD13 LEU 81 3HD1 LEU 81 -10.392 18.388 6.609 636 HD21 LEU 81 3HD2 LEU 81 -11.555 16.328 5.547 637 HD22 LEU 81 1HD2 LEU 81 -11.105 15.531 7.073 638 HD23 LEU 81 2HD2 LEU 81 -10.652 14.795 5.538 639 H GLY 82 H GLY 82 -10.398 16.692 1.460 640 HA2 GLY 82 1HA GLY 82 -8.220 16.533 -0.394 641 HA3 GLY 82 2HA GLY 82 -9.823 17.216 -0.728 642 H GLN 83 H GLN 83 -10.188 19.397 0.318 643 HA GLN 83 HA GLN 83 -7.913 21.080 0.937 644 HB2 GLN 83 1HB GLN 83 -7.701 21.400 -1.407 645 HB3 GLN 83 2HB GLN 83 -9.455 21.436 -1.677 646 HG2 GLN 83 1HG GLN 83 -9.685 23.599 -0.710 647 HG3 GLN 83 2HG GLN 83 -8.106 23.514 0.053 648 HE21 GLN 83 1HE2 GLN 83 -6.318 24.202 -1.074 649 HE22 GLN 83 2HE2 GLN 83 -6.505 25.110 -2.562 650 H ASN 84 H ASN 84 -11.365 20.871 0.051 651 HA ASN 84 HA ASN 84 -12.042 23.121 1.827 652 HB2 ASN 84 1HB ASN 84 -13.703 21.517 -0.177 653 HB3 ASN 84 2HB ASN 84 -14.252 22.918 0.724 654 HD21 ASN 84 1HD2 ASN 84 -12.096 21.840 -1.889 655 HD22 ASN 84 2HD2 ASN 84 -11.854 23.442 -2.564 656 H LYS 85 H LYS 85 -11.133 20.745 3.221 657 HA LYS 85 HA LYS 85 -11.592 19.334 4.836 658 HB2 LYS 85 1HB LYS 85 -14.063 21.044 5.232 659 HB3 LYS 85 2HB LYS 85 -13.463 19.878 6.391 660 HG2 LYS 85 1HG LYS 85 -11.311 21.039 6.547 661 HG3 LYS 85 2HG LYS 85 -11.867 22.301 5.446 662 HD2 LYS 85 1HD LYS 85 -13.395 21.672 8.006 663 HD3 LYS 85 2HD LYS 85 -11.964 22.684 8.015 664 HE2 LYS 85 1HE LYS 85 -13.825 24.142 7.894 665 HE3 LYS 85 2HE LYS 85 -12.976 24.221 6.350 666 HZ1 LYS 85 3HZ LYS 85 -15.452 22.706 6.897 667 HZ2 LYS 85 1HZ LYS 85 -14.718 22.810 5.427 668 HZ3 LYS 85 2HZ LYS 85 -15.370 24.153 6.097 669 H VAL 86 H VAL 86 -12.886 18.904 2.122 670 HA VAL 86 HA VAL 86 -15.068 17.015 2.541 671 HB VAL 86 HB VAL 86 -13.172 17.363 0.153 672 HG11 VAL 86 1HG1 VAL 86 -14.514 15.286 0.092 673 HG12 VAL 86 2HG1 VAL 86 -16.005 16.227 0.305 674 HG13 VAL 86 3HG1 VAL 86 -15.021 16.419 -1.164 675 HG21 VAL 86 3HG2 VAL 86 -14.880 18.824 -0.849 676 HG22 VAL 86 1HG2 VAL 86 -15.790 18.812 0.682 677 HG23 VAL 86 2HG2 VAL 86 -14.157 19.516 0.599 678 H VAL 87 H VAL 87 -14.704 14.920 3.291 679 HA VAL 87 HA VAL 87 -11.982 13.831 3.456 680 HB VAL 87 HB VAL 87 -14.652 12.446 3.922 681 HG11 VAL 87 1HG1 VAL 87 -11.782 11.814 4.761 682 HG12 VAL 87 2HG1 VAL 87 -13.233 10.951 5.298 683 HG13 VAL 87 3HG1 VAL 87 -12.767 10.909 3.592 684 HG21 VAL 87 3HG2 VAL 87 -14.470 14.374 5.483 685 HG22 VAL 87 1HG2 VAL 87 -14.289 12.837 6.319 686 HG23 VAL 87 2HG2 VAL 87 -12.853 13.816 5.968 687 H ILE 88 H ILE 88 -11.162 13.658 1.375 688 HA ILE 88 HA ILE 88 -12.881 12.657 -0.823 689 HB ILE 88 HB ILE 88 -10.902 12.971 -2.230 690 HG12 ILE 88 1HG1 ILE 88 -9.527 14.390 0.073 691 HG13 ILE 88 2HG1 ILE 88 -9.193 12.708 -0.307 692 HG21 ILE 88 1HG2 ILE 88 -11.062 15.426 -2.238 693 HG22 ILE 88 2HG2 ILE 88 -12.639 14.721 -1.867 694 HG23 ILE 88 3HG2 ILE 88 -11.653 15.410 -0.561 695 HD11 ILE 88 3HD1 ILE 88 -8.537 13.360 -2.626 696 HD12 ILE 88 1HD1 ILE 88 -8.806 15.063 -2.210 697 HD13 ILE 88 2HD1 ILE 88 -7.536 14.142 -1.391 698 H GLY 89 H GLY 89 -10.756 11.383 1.582 699 HA2 GLY 89 1HA GLY 89 -11.397 8.708 0.954 700 HA3 GLY 89 2HA GLY 89 -9.810 9.094 0.241 701 H TRP 90 H TRP 90 -9.147 7.323 1.837 702 HA TRP 90 HA TRP 90 -8.129 8.690 4.200 703 HB2 TRP 90 1HB TRP 90 -9.404 5.949 4.273 704 HB3 TRP 90 2HB TRP 90 -8.555 6.715 5.615 705 HD1 TRP 90 HD TRP 90 -9.879 8.615 6.926 706 HE1 TRP 90 1HE TRP 90 -12.320 9.469 6.897 707 HE3 TRP 90 3HE TRP 90 -11.512 6.188 2.742 708 HZ2 TRP 90 2HZ TRP 90 -14.727 8.974 5.354 709 HZ3 TRP 90 3HZ TRP 90 -13.859 6.489 1.956 710 HH2 TRP 90 HH TRP 90 -15.432 7.887 3.229 711 H ASP 91 H ASP 91 -6.125 7.847 4.719 712 HA ASP 91 HA ASP 91 -4.839 6.218 2.582 713 HB2 ASP 91 1HB ASP 91 -3.975 8.510 4.036 714 HB3 ASP 91 2HB ASP 91 -3.036 7.158 4.658 715 H LYS 92 H LYS 92 -5.562 4.206 3.033 716 HA LYS 92 HA LYS 92 -5.685 3.223 5.841 717 HB2 LYS 92 1HB LYS 92 -6.215 1.497 3.416 718 HB3 LYS 92 2HB LYS 92 -6.641 1.182 5.052 719 HG2 LYS 92 1HG LYS 92 -7.959 3.164 3.163 720 HG3 LYS 92 2HG LYS 92 -8.608 1.649 3.801 721 HD2 LYS 92 1HD LYS 92 -8.365 2.720 6.132 722 HD3 LYS 92 2HD LYS 92 -8.022 4.218 5.244 723 HE2 LYS 92 1HE LYS 92 -10.337 4.337 5.778 724 HE3 LYS 92 2HE LYS 92 -10.254 3.941 4.059 725 HZ1 LYS 92 3HZ LYS 92 -11.901 2.636 5.187 726 HZ2 LYS 92 1HZ LYS 92 -10.800 1.987 6.220 727 HZ3 LYS 92 2HZ LYS 92 -10.767 1.648 4.609 728 H TYR 93 H TYR 93 -3.663 2.641 6.753 729 HA TYR 93 HA TYR 93 -1.470 1.977 4.893 730 HB2 TYR 93 1HB TYR 93 -1.623 2.157 7.929 731 HB3 TYR 93 2HB TYR 93 -0.183 1.818 7.030 732 HD1 TYR 93 1HD TYR 93 -2.868 4.431 7.372 733 HD2 TYR 93 2HD TYR 93 1.285 3.617 6.548 734 HE1 TYR 93 1HE TYR 93 -2.416 6.829 7.324 735 HE2 TYR 93 2HE TYR 93 1.772 6.030 6.591 736 HH TYR 93 HH TYR 93 0.799 8.271 6.783 737 H PHE 94 H PHE 94 -0.262 -0.188 5.392 738 HA PHE 94 HA PHE 94 -1.905 -2.270 6.716 739 HB2 PHE 94 1HB PHE 94 -1.025 -2.362 3.801 740 HB3 PHE 94 2HB PHE 94 -1.484 -3.797 4.720 741 HD1 PHE 94 1HD PHE 94 -3.785 -4.107 5.575 742 HD2 PHE 94 2HD PHE 94 -2.740 -0.707 3.117 743 HE1 PHE 94 1HE PHE 94 -6.205 -3.606 5.231 744 HE2 PHE 94 2HE PHE 94 -5.131 -0.268 2.750 745 HZ PHE 94 HZ PHE 94 -6.877 -1.674 3.823 746 H GLU 95 H GLU 95 -0.722 -4.105 7.411 747 HA GLU 95 HA GLU 95 2.228 -3.774 7.434 748 HB2 GLU 95 1HB GLU 95 2.218 -4.609 9.593 749 HB3 GLU 95 2HB GLU 95 0.819 -3.579 9.536 750 HG2 GLU 95 1HG GLU 95 -0.605 -5.620 9.277 751 HG3 GLU 95 2HG GLU 95 0.841 -6.565 9.644 752 H ILE 96 H ILE 96 1.684 -4.857 5.084 753 HA ILE 96 HA ILE 96 1.078 -7.671 5.152 754 HB ILE 96 HB ILE 96 2.503 -6.276 2.880 755 HG12 ILE 96 1HG1 ILE 96 -0.125 -6.180 2.083 756 HG13 ILE 96 2HG1 ILE 96 -0.335 -5.821 3.779 757 HG21 ILE 96 1HG2 ILE 96 1.226 -7.888 1.494 758 HG22 ILE 96 2HG2 ILE 96 2.222 -8.712 2.665 759 HG23 ILE 96 3HG2 ILE 96 0.469 -8.573 2.950 760 HD11 ILE 96 3HD1 ILE 96 1.566 -4.386 1.861 761 HD12 ILE 96 1HD1 ILE 96 -0.045 -3.808 2.312 762 HD13 ILE 96 2HD1 ILE 96 1.239 -3.898 3.539 763 HA PRO 97 HA PRO 97 5.419 -8.956 5.894 764 HB2 PRO 97 1HB PRO 97 5.325 -11.525 4.969 765 HB3 PRO 97 2HB PRO 97 4.633 -11.010 6.545 766 HG2 PRO 97 1HG PRO 97 3.225 -11.283 3.870 767 HG3 PRO 97 2HG PRO 97 2.736 -12.027 5.436 768 HD2 PRO 97 1HD PRO 97 1.618 -9.755 4.611 769 HD3 PRO 97 2HD PRO 97 2.104 -9.879 6.310 770 H MET 98 H MET 98 7.166 -10.137 4.483 771 HA MET 98 HA MET 98 6.932 -9.489 1.590 772 HB2 MET 98 1HB MET 98 9.387 -9.992 3.319 773 HB3 MET 98 2HB MET 98 9.409 -9.821 1.562 774 HG2 MET 98 1HG MET 98 8.603 -7.538 1.699 775 HG3 MET 98 2HG MET 98 8.381 -7.677 3.443 776 HE1 MET 98 3HE MET 98 11.285 -5.383 3.945 777 HE2 MET 98 1HE MET 98 9.949 -5.169 2.818 778 HE3 MET 98 2HE MET 98 9.654 -5.890 4.417 779 H ASP 99 H ASP 99 8.079 -12.097 3.912 780 HA ASP 99 HA ASP 99 8.685 -13.821 1.762 781 HB2 ASP 99 1HB ASP 99 9.623 -14.052 4.030 782 HB3 ASP 99 2HB ASP 99 8.073 -14.662 4.606 783 H ALA 100 H ALA 100 5.630 -13.384 3.490 784 HA ALA 100 HA ALA 100 4.392 -15.783 2.544 785 HB1 ALA 100 1HB ALA 100 3.644 -14.425 4.531 786 HB2 ALA 100 2HB ALA 100 2.834 -13.348 3.347 787 HB3 ALA 100 3HB ALA 100 2.377 -15.050 3.464 788 H LEU 101 H LEU 101 5.382 -13.386 0.541 789 HA LEU 101 HA LEU 101 2.938 -13.073 -1.081 790 HB2 LEU 101 1HB LEU 101 5.774 -12.107 -1.535 791 HB3 LEU 101 2HB LEU 101 4.356 -11.605 -2.453 792 HG LEU 101 HG LEU 101 4.745 -11.074 0.531 793 HD11 LEU 101 1HD1 LEU 101 5.016 -9.134 -1.783 794 HD12 LEU 101 2HD1 LEU 101 6.371 -10.001 -1.045 795 HD13 LEU 101 3HD1 LEU 101 5.445 -8.887 -0.057 796 HD21 LEU 101 3HD2 LEU 101 2.874 -9.575 0.384 797 HD22 LEU 101 1HD2 LEU 101 2.355 -11.166 -0.139 798 HD23 LEU 101 2HD2 LEU 101 2.674 -9.898 -1.347 799 H GLN 102 H GLN 102 2.827 -13.691 -3.302 800 HA GLN 102 HA GLN 102 3.865 -16.288 -3.910 801 HB2 GLN 102 1HB GLN 102 1.612 -15.065 -4.542 802 HB3 GLN 102 2HB GLN 102 2.584 -14.247 -5.749 803 HG2 GLN 102 1HG GLN 102 3.253 -16.570 -6.596 804 HG3 GLN 102 2HG GLN 102 2.037 -17.189 -5.471 805 HE21 GLN 102 1HE2 GLN 102 2.131 -14.356 -7.865 806 HE22 GLN 102 2HE2 GLN 102 0.690 -14.905 -8.690 807 H ASP 103 H ASP 103 4.882 -12.984 -4.554 808 HA ASP 103 HA ASP 103 6.977 -13.780 -6.441 809 HB2 ASP 103 1HB ASP 103 5.116 -11.467 -7.038 810 HB3 ASP 103 2HB ASP 103 6.345 -12.145 -8.090 811 H ASN 104 H ASN 104 8.483 -11.868 -6.634 812 HA ASN 104 HA ASN 104 8.735 -10.515 -4.048 813 HB2 ASN 104 1HB ASN 104 10.488 -10.467 -6.550 814 HB3 ASN 104 2HB ASN 104 10.843 -9.644 -5.037 815 HD21 ASN 104 1HD2 ASN 104 12.682 -11.495 -5.986 816 HD22 ASN 104 2HD2 ASN 104 12.755 -12.690 -4.694 817 H SER 105 H SER 105 6.385 -9.623 -5.032 818 HA SER 105 HA SER 105 6.912 -6.808 -5.402 819 HB2 SER 105 1HB SER 105 5.180 -6.541 -7.258 820 HB3 SER 105 2HB SER 105 6.665 -7.298 -7.735 821 HG SER 105 HG SER 105 5.869 -9.296 -7.530 822 H ILE 106 H ILE 106 5.016 -5.517 -4.937 823 HA ILE 106 HA ILE 106 2.941 -6.934 -3.336 824 HB ILE 106 HB ILE 106 4.587 -5.609 -2.084 825 HG12 ILE 106 1HG1 ILE 106 2.192 -5.962 -1.340 826 HG13 ILE 106 2HG1 ILE 106 3.197 -4.774 -0.528 827 HG21 ILE 106 1HG2 ILE 106 5.209 -3.833 -3.553 828 HG22 ILE 106 2HG2 ILE 106 3.548 -3.198 -3.620 829 HG23 ILE 106 3HG2 ILE 106 4.473 -3.124 -2.115 830 HD11 ILE 106 3HD1 ILE 106 1.059 -4.020 -2.560 831 HD12 ILE 106 1HD1 ILE 106 0.881 -3.997 -0.810 832 HD13 ILE 106 2HD1 ILE 106 2.054 -2.922 -1.604 833 H GLN 107 H GLN 107 0.795 -6.351 -3.675 834 HA GLN 107 HA GLN 107 0.082 -4.029 -5.299 835 HB2 GLN 107 1HB GLN 107 0.374 -5.867 -6.984 836 HB3 GLN 107 2HB GLN 107 -0.752 -6.861 -6.041 837 HG2 GLN 107 1HG GLN 107 -2.529 -5.132 -6.423 838 HG3 GLN 107 2HG GLN 107 -1.379 -4.219 -7.411 839 HE21 GLN 107 1HE2 GLN 107 -2.406 -4.365 -9.328 840 HE22 GLN 107 2HE2 GLN 107 -2.732 -5.812 -10.232 841 H ILE 108 H ILE 108 -2.059 -3.323 -4.605 842 HA ILE 108 HA ILE 108 -3.558 -5.109 -2.739 843 HB ILE 108 HB ILE 108 -3.472 -2.076 -2.665 844 HG12 ILE 108 1HG1 ILE 108 -2.164 -4.154 -0.835 845 HG13 ILE 108 2HG1 ILE 108 -1.332 -3.005 -1.874 846 HG21 ILE 108 1HG2 ILE 108 -4.808 -4.150 -0.857 847 HG22 ILE 108 2HG2 ILE 108 -4.747 -2.412 -0.526 848 HG23 ILE 108 3HG2 ILE 108 -5.638 -2.976 -1.912 849 HD11 ILE 108 3HD1 ILE 108 -1.136 -2.162 0.313 850 HD12 ILE 108 1HD1 ILE 108 -2.317 -1.127 -0.520 851 HD13 ILE 108 2HD1 ILE 108 -2.859 -2.356 0.653 852 H LYS 109 H LYS 109 -6.022 -4.818 -3.095 853 HA LYS 109 HA LYS 109 -6.805 -3.426 -5.560 854 HB2 LYS 109 1HB LYS 109 -7.931 -5.494 -6.474 855 HB3 LYS 109 2HB LYS 109 -6.196 -5.437 -6.591 856 HG2 LYS 109 1HG LYS 109 -6.745 -6.840 -4.152 857 HG3 LYS 109 2HG LYS 109 -7.934 -7.386 -5.296 858 HD2 LYS 109 1HD LYS 109 -5.960 -8.821 -5.320 859 HD3 LYS 109 2HD LYS 109 -6.228 -8.050 -6.864 860 HE2 LYS 109 1HE LYS 109 -3.879 -8.070 -6.464 861 HE3 LYS 109 2HE LYS 109 -4.361 -6.384 -6.305 862 HZ1 LYS 109 3HZ LYS 109 -3.031 -6.877 -4.400 863 HZ2 LYS 109 1HZ LYS 109 -3.602 -8.353 -4.240 864 HZ3 LYS 109 2HZ LYS 109 -4.553 -7.087 -3.779 865 H ALA 110 H ALA 110 -9.149 -2.821 -5.426 866 HA ALA 110 HA ALA 110 -10.523 -4.243 -3.165 867 HB1 ALA 110 1HB ALA 110 -11.239 -2.149 -2.109 868 HB2 ALA 110 2HB ALA 110 -9.475 -2.247 -2.145 869 HB3 ALA 110 3HB ALA 110 -10.326 -1.202 -3.296 870 H LEU 111 H LEU 111 -12.770 -4.112 -3.053 871 HA LEU 111 HA LEU 111 -14.242 -3.746 -5.529 872 HB2 LEU 111 1HB LEU 111 -15.004 -5.229 -3.535 873 HB3 LEU 111 2HB LEU 111 -15.387 -3.718 -2.718 874 HG LEU 111 HG LEU 111 -16.885 -3.153 -4.749 875 HD11 LEU 111 1HD1 LEU 111 -17.781 -5.068 -5.982 876 HD12 LEU 111 2HD1 LEU 111 -16.645 -6.162 -5.170 877 HD13 LEU 111 3HD1 LEU 111 -16.050 -4.917 -6.293 878 HD21 LEU 111 3HD2 LEU 111 -17.639 -5.470 -2.933 879 HD22 LEU 111 1HD2 LEU 111 -18.756 -4.437 -3.843 880 HD23 LEU 111 2HD2 LEU 111 -17.773 -3.733 -2.545 881 H SER 112 H SER 112 -15.116 -1.885 -6.277 882 HA SER 112 HA SER 112 -15.056 0.586 -4.593 883 HB2 SER 112 1HB SER 112 -13.844 0.896 -6.602 884 HB3 SER 112 2HB SER 112 -15.059 0.086 -7.586 885 HG SER 112 HG SER 112 -15.049 2.419 -7.642 886 H SER 113 H SER 113 -17.171 -0.668 -7.227 887 HA SER 113 HA SER 113 -19.540 -0.490 -5.517 888 HB2 SER 113 1HB SER 113 -20.579 1.051 -7.262 889 HB3 SER 113 2HB SER 113 -19.301 1.786 -6.272 890 HG SER 113 HG SER 113 -18.825 2.350 -8.319 891 H GLY 114 H GLY 114 -21.305 -1.623 -6.329 892 HA2 GLY 114 1HA GLY 114 -22.313 -3.423 -7.304 893 HA3 GLY 114 2HA GLY 114 -21.528 -2.937 -8.815 894 H THR 115 H THR 115 -19.738 -4.030 -9.517 895 HA THR 115 HA THR 115 -18.602 -6.243 -7.874 896 HB THR 115 HB THR 115 -18.310 -7.328 -10.216 897 HG1 THR 115 1HG THR 115 -19.897 -6.641 -11.709 898 HG21 THR 115 3HG2 THR 115 -19.906 -8.123 -8.522 899 HG22 THR 115 1HG2 THR 115 -20.623 -8.232 -10.139 900 HG23 THR 115 2HG2 THR 115 -21.095 -6.910 -9.066 901 H THR 116 H THR 116 -17.941 -3.276 -9.304 902 HA THR 116 HA THR 116 -15.638 -3.607 -10.829 903 HB THR 116 HB THR 116 -16.326 -1.334 -8.962 904 HG1 THR 116 1HG THR 116 -18.058 -1.284 -10.071 905 HG21 THR 116 3HG2 THR 116 -14.694 -1.322 -11.507 906 HG22 THR 116 1HG2 THR 116 -14.120 -1.011 -9.847 907 HG23 THR 116 2HG2 THR 116 -15.221 0.130 -10.616 908 H PHE 117 H PHE 117 -13.685 -4.190 -10.309 909 HA PHE 117 HA PHE 117 -12.665 -3.821 -7.551 910 HB2 PHE 117 1HB PHE 117 -13.245 -6.246 -8.832 911 HB3 PHE 117 2HB PHE 117 -11.494 -6.104 -8.964 912 HD1 PHE 117 1HD PHE 117 -10.120 -5.912 -6.846 913 HD2 PHE 117 2HD PHE 117 -14.374 -6.540 -6.749 914 HE1 PHE 117 1HE PHE 117 -9.971 -6.600 -4.442 915 HE2 PHE 117 2HE PHE 117 -14.223 -7.223 -4.357 916 HZ PHE 117 HZ PHE 117 -12.036 -7.249 -3.211 917 H VAL 118 H VAL 118 -11.261 -2.254 -7.653 918 HA VAL 118 HA VAL 118 -9.559 -1.735 -9.980 919 HB VAL 118 HB VAL 118 -10.247 0.140 -8.724 920 HG11 VAL 118 1HG1 VAL 118 -9.579 -1.196 -6.278 921 HG12 VAL 118 2HG1 VAL 118 -9.775 0.596 -6.407 922 HG13 VAL 118 3HG1 VAL 118 -11.079 -0.470 -6.902 923 HG21 VAL 118 3HG2 VAL 118 -7.938 0.199 -9.637 924 HG22 VAL 118 1HG2 VAL 118 -8.297 1.368 -8.385 925 HG23 VAL 118 2HG2 VAL 118 -7.367 -0.120 -8.006 926 H TYR 119 H TYR 119 -7.514 -2.361 -10.201 927 HA TYR 119 HA TYR 119 -6.216 -3.796 -7.953 928 HB2 TYR 119 1HB TYR 119 -5.651 -4.120 -10.934 929 HB3 TYR 119 2HB TYR 119 -4.934 -5.020 -9.608 930 HD1 TYR 119 1HD TYR 119 -8.081 -4.470 -11.495 931 HD2 TYR 119 2HD TYR 119 -5.997 -6.976 -8.716 932 HE1 TYR 119 1HE TYR 119 -9.946 -6.062 -11.604 933 HE2 TYR 119 2HE TYR 119 -7.897 -8.612 -8.759 934 HH TYR 119 HH TYR 119 -10.851 -7.910 -10.700 935 H SER 120 H SER 120 -4.522 -2.764 -7.104 936 HA SER 120 HA SER 120 -3.891 -0.110 -7.959 937 HB2 SER 120 1HB SER 120 -2.719 -0.000 -5.994 938 HB3 SER 120 2HB SER 120 -3.797 -1.260 -5.628 939 HG SER 120 HG SER 120 -1.142 -1.806 -6.520 940 H GLN 121 H GLN 121 -1.252 0.253 -8.295 941 HA GLN 121 HA GLN 121 -0.433 -1.426 -10.530 942 HB2 GLN 121 1HB GLN 121 1.595 -0.211 -10.597 943 HB3 GLN 121 2HB GLN 121 0.291 0.939 -10.370 944 HG2 GLN 121 1HG GLN 121 1.967 -0.064 -8.030 945 HG3 GLN 121 2HG GLN 121 2.503 1.227 -9.101 946 HE21 GLN 121 1HE2 GLN 121 2.173 3.143 -8.389 947 HE22 GLN 121 2HE2 GLN 121 0.921 3.730 -7.353 948 H LYS 122 H LYS 122 1.576 -2.650 -10.555 949 HA LYS 122 HA LYS 122 2.066 -4.356 -8.165 950 HB2 LYS 122 1HB LYS 122 1.754 -5.340 -10.483 951 HB3 LYS 122 2HB LYS 122 3.123 -4.392 -11.042 952 HG2 LYS 122 1HG LYS 122 4.559 -5.648 -9.319 953 HG3 LYS 122 2HG LYS 122 3.166 -6.721 -9.098 954 HD2 LYS 122 1HD LYS 122 3.267 -7.178 -11.600 955 HD3 LYS 122 2HD LYS 122 4.752 -6.200 -11.669 956 HE2 LYS 122 1HE LYS 122 5.751 -7.745 -9.918 957 HE3 LYS 122 2HE LYS 122 4.271 -8.696 -10.000 958 HZ1 LYS 122 3HZ LYS 122 4.891 -8.874 -12.512 959 HZ2 LYS 122 1HZ LYS 122 5.648 -9.813 -11.404 960 HZ3 LYS 122 2HZ LYS 122 6.399 -8.496 -12.004 961 H ILE 123 H ILE 123 3.950 -4.020 -6.944 962 HA ILE 123 HA ILE 123 6.159 -2.574 -8.279 963 HB ILE 123 HB ILE 123 5.215 -2.119 -5.407 964 HG12 ILE 123 1HG1 ILE 123 3.649 -1.007 -6.871 965 HG13 ILE 123 2HG1 ILE 123 4.622 0.172 -6.028 966 HG21 ILE 123 1HG2 ILE 123 6.835 -0.318 -5.226 967 HG22 ILE 123 2HG2 ILE 123 7.687 -1.794 -5.709 968 HG23 ILE 123 3HG2 ILE 123 7.344 -0.502 -6.894 969 HD11 ILE 123 3HD1 ILE 123 5.926 -0.424 -8.569 970 HD12 ILE 123 1HD1 ILE 123 4.233 -0.077 -8.848 971 HD13 ILE 123 2HD1 ILE 123 5.252 1.095 -8.017 972 H ASP 124 H ASP 124 7.504 -3.950 -8.680 973 HA ASP 124 HA ASP 124 8.275 -6.318 -7.174 974 HB2 ASP 124 1HB ASP 124 8.933 -4.855 -9.657 975 HB3 ASP 124 2HB ASP 124 10.323 -5.601 -8.903 976 H PHE 125 H PHE 125 9.957 -6.492 -5.674 977 HA PHE 125 HA PHE 125 11.680 -4.165 -5.153 978 HB2 PHE 125 1HB PHE 125 11.130 -4.028 -2.816 979 HB3 PHE 125 2HB PHE 125 9.654 -3.846 -3.734 980 HD1 PHE 125 1HD PHE 125 7.911 -5.662 -3.758 981 HD2 PHE 125 2HD PHE 125 11.424 -5.847 -1.258 982 HE1 PHE 125 1HE PHE 125 6.938 -7.576 -2.507 983 HE2 PHE 125 2HE PHE 125 10.417 -7.682 0.012 984 HZ PHE 125 HZ PHE 125 8.206 -8.617 -0.639 985 H GLU 126 H GLU 126 13.358 -4.800 -3.260 986 HA GLU 126 HA GLU 126 14.276 -7.562 -3.762 987 HB2 GLU 126 1HB GLU 126 15.544 -4.958 -3.734 988 HB3 GLU 126 2HB GLU 126 16.505 -6.431 -3.308 989 HG2 GLU 126 1HG GLU 126 14.789 -6.117 -5.803 990 HG3 GLU 126 2HG GLU 126 16.450 -5.511 -5.730 991 H ARG 127 H ARG 127 14.889 -8.803 -2.075 992 HA ARG 127 HA ARG 127 13.752 -7.917 0.547 993 HB2 ARG 127 1HB ARG 127 14.255 -10.808 -0.090 994 HB3 ARG 127 2HB ARG 127 13.414 -10.108 1.242 995 HG2 ARG 127 1HG ARG 127 11.806 -11.110 -0.154 996 HG3 ARG 127 2HG ARG 127 11.584 -9.381 -0.273 997 HD2 ARG 127 1HD ARG 127 11.389 -10.722 -2.413 998 HD3 ARG 127 2HD ARG 127 12.460 -9.327 -2.492 999 HE ARG 127 HE ARG 127 13.585 -11.956 -1.751 1000 HH11 ARG 127 1HH1 ARG 127 13.481 -9.493 -4.317 1001 HH12 ARG 127 2HH1 ARG 127 15.194 -9.617 -4.656 1002 HH21 ARG 127 1HH2 ARG 127 15.727 -12.253 -2.360 1003 HH22 ARG 127 2HH2 ARG 127 16.453 -11.337 -3.622 1004 H GLU 128 H GLU 128 15.506 -6.858 1.290 1005 HA GLU 128 HA GLU 128 17.389 -6.386 2.280 1006 HB2 GLU 128 1HB GLU 128 17.790 -9.258 3.030 1007 HB3 GLU 128 2HB GLU 128 18.516 -7.808 3.760 1008 HG2 GLU 128 1HG GLU 128 16.338 -7.089 4.571 1009 HG3 GLU 128 2HG GLU 128 15.534 -8.465 3.834 Start of MODEL 4 1 H1 GLY 1 H GLY 1 -24.203 8.191 -0.450 2 HA2 GLY 1 1HA GLY 1 -25.017 10.582 1.104 3 HA3 GLY 1 2HA GLY 1 -23.405 9.832 1.158 4 H ALA 2 H ALA 2 -22.300 11.668 0.402 5 HA ALA 2 HA ALA 2 -22.425 12.091 -2.516 6 HB1 ALA 2 1HB ALA 2 -22.451 14.375 -0.471 7 HB2 ALA 2 2HB ALA 2 -22.231 14.548 -2.225 8 HB3 ALA 2 3HB ALA 2 -23.779 13.965 -1.585 9 H GLU 3 H GLU 3 -20.643 13.168 0.451 10 HA GLU 3 HA GLU 3 -18.153 12.781 -1.070 11 HB2 GLU 3 1HB GLU 3 -16.973 13.624 0.808 12 HB3 GLU 3 2HB GLU 3 -18.289 14.707 0.406 13 HG2 GLU 3 1HG GLU 3 -18.567 12.628 2.628 14 HG3 GLU 3 2HG GLU 3 -17.813 14.199 2.899 15 H ALA 4 H ALA 4 -20.130 10.701 0.152 16 HA ALA 4 HA ALA 4 -17.981 8.676 0.645 17 HB1 ALA 4 1HB ALA 4 -19.602 8.728 2.493 18 HB2 ALA 4 2HB ALA 4 -20.932 8.427 1.353 19 HB3 ALA 4 3HB ALA 4 -19.665 7.196 1.596 20 H LEU 5 H LEU 5 -18.011 9.543 -1.897 21 HA LEU 5 HA LEU 5 -19.575 7.896 -3.651 22 HB2 LEU 5 1HB LEU 5 -16.819 9.148 -3.997 23 HB3 LEU 5 2HB LEU 5 -17.787 8.296 -5.164 24 HG LEU 5 HG LEU 5 -19.575 9.919 -4.468 25 HD11 LEU 5 1HD1 LEU 5 -16.977 11.408 -4.993 26 HD12 LEU 5 2HD1 LEU 5 -17.831 11.410 -3.442 27 HD13 LEU 5 3HD1 LEU 5 -18.574 12.173 -4.875 28 HD21 LEU 5 3HD2 LEU 5 -19.315 9.020 -6.625 29 HD22 LEU 5 1HD2 LEU 5 -17.855 10.005 -6.929 30 HD23 LEU 5 2HD2 LEU 5 -19.440 10.785 -6.751 31 HA PRO 6 HA PRO 6 -17.252 4.125 -2.818 32 HB2 PRO 6 1HB PRO 6 -17.236 3.078 -5.439 33 HB3 PRO 6 2HB PRO 6 -18.505 2.842 -4.210 34 HG2 PRO 6 1HG PRO 6 -18.703 4.369 -6.656 35 HG3 PRO 6 2HG PRO 6 -19.938 4.101 -5.384 36 HD2 PRO 6 1HD PRO 6 -18.090 6.416 -5.794 37 HD3 PRO 6 2HD PRO 6 -19.660 6.431 -5.027 38 H LEU 7 H LEU 7 -15.330 3.106 -3.435 39 HA LEU 7 HA LEU 7 -13.061 4.639 -3.729 40 HB2 LEU 7 1HB LEU 7 -13.196 2.438 -2.729 41 HB3 LEU 7 2HB LEU 7 -13.552 1.735 -4.304 42 HG LEU 7 HG LEU 7 -11.212 2.599 -5.055 43 HD11 LEU 7 1HD1 LEU 7 -9.608 2.860 -3.184 44 HD12 LEU 7 2HD1 LEU 7 -10.972 2.823 -2.026 45 HD13 LEU 7 3HD1 LEU 7 -10.803 4.152 -3.185 46 HD21 LEU 7 3HD2 LEU 7 -11.635 0.456 -2.941 47 HD22 LEU 7 1HD2 LEU 7 -10.177 0.628 -3.929 48 HD23 LEU 7 2HD2 LEU 7 -11.745 0.269 -4.683 49 H TYR 8 H TYR 8 -12.792 5.981 -5.439 50 HA TYR 8 HA TYR 8 -13.146 4.972 -8.197 51 HB2 TYR 8 1HB TYR 8 -13.097 7.333 -8.832 52 HB3 TYR 8 2HB TYR 8 -14.388 6.914 -7.731 53 HD1 TYR 8 1HD TYR 8 -11.125 8.676 -8.011 54 HD2 TYR 8 2HD TYR 8 -14.607 7.969 -5.575 55 HE1 TYR 8 1HE TYR 8 -10.513 10.606 -6.581 56 HE2 TYR 8 2HE TYR 8 -14.037 9.921 -4.162 57 HH TYR 8 HH TYR 8 -11.214 12.019 -4.928 58 H TYR 9 H TYR 9 -10.573 5.263 -5.971 59 HA TYR 9 HA TYR 9 -8.593 4.943 -8.121 60 HB2 TYR 9 1HB TYR 9 -8.823 7.404 -7.870 61 HB3 TYR 9 2HB TYR 9 -8.613 7.194 -6.150 62 HD1 TYR 9 1HD TYR 9 -6.344 6.693 -5.153 63 HD2 TYR 9 2HD TYR 9 -6.948 7.371 -9.353 64 HE1 TYR 9 1HE TYR 9 -3.972 7.274 -5.380 65 HE2 TYR 9 2HE TYR 9 -4.550 7.896 -9.638 66 HH TYR 9 HH TYR 9 -2.350 7.535 -8.366 67 H LEU 10 H LEU 10 -6.719 3.873 -7.415 68 HA LEU 10 HA LEU 10 -6.365 3.250 -4.574 69 HB2 LEU 10 1HB LEU 10 -7.904 1.620 -5.871 70 HB3 LEU 10 2HB LEU 10 -6.549 1.402 -6.970 71 HG LEU 10 HG LEU 10 -6.406 -0.448 -5.809 72 HD11 LEU 10 1HD1 LEU 10 -4.262 0.721 -5.564 73 HD12 LEU 10 2HD1 LEU 10 -4.560 -0.441 -4.242 74 HD13 LEU 10 3HD1 LEU 10 -4.746 1.290 -3.980 75 HD21 LEU 10 3HD2 LEU 10 -6.701 -0.651 -3.283 76 HD22 LEU 10 1HD2 LEU 10 -8.144 -0.006 -4.076 77 HD23 LEU 10 2HD2 LEU 10 -7.018 1.096 -3.227 78 H GLN 11 H GLN 11 -4.184 3.368 -4.288 79 HA GLN 11 HA GLN 11 -2.287 2.678 -6.366 80 HB2 GLN 11 1HB GLN 11 -3.176 5.287 -6.538 81 HB3 GLN 11 2HB GLN 11 -1.777 5.520 -5.537 82 HG2 GLN 11 1HG GLN 11 -0.502 5.506 -7.370 83 HG3 GLN 11 2HG GLN 11 -0.971 3.844 -7.707 84 HE21 GLN 11 1HE2 GLN 11 -3.530 3.850 -8.569 85 HE22 GLN 11 2HE2 GLN 11 -3.734 4.880 -9.954 86 H ILE 12 H ILE 12 -0.408 1.965 -5.425 87 HA ILE 12 HA ILE 12 -0.133 1.582 -2.717 88 HB ILE 12 HB ILE 12 2.178 1.850 -4.636 89 HG12 ILE 12 1HG1 ILE 12 0.403 0.271 -5.510 90 HG13 ILE 12 2HG1 ILE 12 1.976 -0.426 -5.197 91 HG21 ILE 12 1HG2 ILE 12 2.847 1.671 -2.180 92 HG22 ILE 12 2HG2 ILE 12 2.015 0.133 -2.104 93 HG23 ILE 12 3HG2 ILE 12 3.404 0.323 -3.181 94 HD11 ILE 12 3HD1 ILE 12 -0.221 -0.671 -3.137 95 HD12 ILE 12 1HD1 ILE 12 -0.062 -1.785 -4.502 96 HD13 ILE 12 2HD1 ILE 12 1.263 -1.613 -3.347 97 H THR 13 H THR 13 1.201 4.386 -4.469 98 HA THR 13 HA THR 13 1.763 6.406 -3.832 99 HB THR 13 HB THR 13 -0.040 5.867 -1.460 100 HG1 THR 13 1HG THR 13 -1.133 5.400 -3.250 101 HG21 THR 13 3HG2 THR 13 1.110 8.028 -1.219 102 HG22 THR 13 1HG2 THR 13 -0.572 8.277 -1.691 103 HG23 THR 13 2HG2 THR 13 0.717 8.448 -2.907 104 H GLY 14 H GLY 14 2.235 4.618 -0.598 105 HA2 GLY 14 1HA GLY 14 5.068 5.486 -0.888 106 HA3 GLY 14 2HA GLY 14 4.243 5.894 0.601 107 H ILE 15 H ILE 15 6.531 4.175 0.544 108 HA ILE 15 HA ILE 15 5.454 1.674 1.517 109 HB ILE 15 HB ILE 15 5.633 1.272 -0.949 110 HG12 ILE 15 1HG1 ILE 15 7.455 -0.441 0.782 111 HG13 ILE 15 2HG1 ILE 15 5.697 -0.587 0.624 112 HG21 ILE 15 1HG2 ILE 15 7.660 1.283 -2.142 113 HG22 ILE 15 2HG2 ILE 15 7.873 2.690 -1.069 114 HG23 ILE 15 3HG2 ILE 15 8.647 1.169 -0.667 115 HD11 ILE 15 3HD1 ILE 15 7.759 -1.052 -1.587 116 HD12 ILE 15 1HD1 ILE 15 6.796 -2.269 -0.764 117 HD13 ILE 15 2HD1 ILE 15 5.993 -1.085 -1.814 118 H THR 16 H THR 16 6.901 0.715 2.955 119 HA THR 16 HA THR 16 9.669 1.293 2.749 120 HB THR 16 HB THR 16 8.957 3.346 3.916 121 HG1 THR 16 1HG THR 16 10.981 2.565 4.211 122 HG21 THR 16 3HG2 THR 16 8.248 1.594 6.301 123 HG22 THR 16 1HG2 THR 16 7.054 2.400 5.251 124 HG23 THR 16 2HG2 THR 16 8.190 3.369 6.192 125 H SER 17 H SER 17 10.681 0.336 5.029 126 HA SER 17 HA SER 17 9.209 -1.960 5.920 127 HB2 SER 17 1HB SER 17 10.560 -2.733 3.812 128 HB3 SER 17 2HB SER 17 12.009 -2.408 4.795 129 HG SER 17 HG SER 17 9.872 -4.010 5.785 130 H ASP 18 H ASP 18 10.532 -3.002 7.716 131 HA ASP 18 HA ASP 18 11.068 -1.023 9.739 132 HB2 ASP 18 1HB ASP 18 10.044 -3.124 10.295 133 HB3 ASP 18 2HB ASP 18 11.343 -4.034 9.533 134 H GLY 19 H GLY 19 13.232 -3.309 7.859 135 HA2 GLY 19 1HA GLY 19 15.658 -2.369 9.078 136 HA3 GLY 19 2HA GLY 19 15.495 -3.274 7.587 137 H ASN 20 H ASN 20 13.495 -0.712 7.035 138 HA ASN 20 HA ASN 20 15.634 0.768 5.634 139 HB2 ASN 20 1HB ASN 20 12.923 -0.073 4.887 140 HB3 ASN 20 2HB ASN 20 13.167 1.657 4.620 141 HD21 ASN 20 1HD2 ASN 20 13.479 1.690 2.379 142 HD22 ASN 20 2HD2 ASN 20 14.809 0.869 1.599 143 H ASP 21 H ASP 21 14.582 1.103 8.543 144 HA ASP 21 HA ASP 21 14.421 2.822 9.970 145 HB2 ASP 21 1HB ASP 21 16.433 3.568 8.448 146 HB3 ASP 21 2HB ASP 21 15.334 4.797 7.855 147 H PHE 22 H PHE 22 12.218 2.120 8.154 148 HA PHE 22 HA PHE 22 10.152 2.705 7.567 149 HB2 PHE 22 1HB PHE 22 10.413 4.583 9.933 150 HB3 PHE 22 2HB PHE 22 8.907 4.112 9.175 151 HD1 PHE 22 2HD PHE 22 11.888 2.652 10.995 152 HD2 PHE 22 1HD PHE 22 7.748 2.148 9.890 153 HE1 PHE 22 2HE PHE 22 11.768 0.613 12.365 154 HE2 PHE 22 1HE PHE 22 7.595 0.189 11.366 155 HZ PHE 22 HZ PHE 22 9.627 -0.640 12.571 156 H ALA 23 H ALA 23 12.433 4.208 6.319 157 HA ALA 23 HA ALA 23 11.683 6.780 5.460 158 HB1 ALA 23 1HB ALA 23 13.267 4.621 4.035 159 HB2 ALA 23 2HB ALA 23 13.202 6.334 3.576 160 HB3 ALA 23 3HB ALA 23 13.904 5.867 5.135 161 H TRP 24 H TRP 24 9.439 6.887 5.014 162 HA TRP 24 HA TRP 24 7.894 5.037 3.593 163 HB2 TRP 24 1HB TRP 24 7.585 7.907 4.482 164 HB3 TRP 24 2HB TRP 24 6.424 7.275 3.328 165 HD1 TRP 24 HD TRP 24 6.975 7.350 6.961 166 HE1 TRP 24 1HE TRP 24 5.524 5.593 8.154 167 HE3 TRP 24 3HE TRP 24 5.555 4.625 2.915 168 HZ2 TRP 24 2HZ TRP 24 3.915 3.272 7.413 169 HZ3 TRP 24 3HZ TRP 24 4.118 2.653 3.154 170 HH2 TRP 24 HH TRP 24 3.278 1.968 5.401 171 H ASP 25 H ASP 25 9.979 7.250 2.122 172 HA ASP 25 HA ASP 25 10.280 8.000 -0.000 173 HB2 ASP 25 1HB ASP 25 9.899 5.198 -0.097 174 HB3 ASP 25 2HB ASP 25 8.964 5.804 -1.447 175 H ASN 26 H ASN 26 8.990 8.128 -2.365 176 HA ASN 26 HA ASN 26 6.111 8.403 -1.918 177 HB2 ASN 26 1HB ASN 26 7.723 10.621 -3.276 178 HB3 ASN 26 2HB ASN 26 5.967 10.602 -3.062 179 HD21 ASN 26 1HD2 ASN 26 5.255 10.476 -0.679 180 HD22 ASN 26 2HD2 ASN 26 6.410 11.000 0.525 181 H LEU 27 H LEU 27 5.315 7.049 -3.419 182 HA LEU 27 HA LEU 27 7.021 6.112 -5.598 183 HB2 LEU 27 1HB LEU 27 4.166 5.411 -4.892 184 HB3 LEU 27 2HB LEU 27 5.280 4.529 -5.942 185 HG LEU 27 HG LEU 27 5.568 4.976 -2.952 186 HD11 LEU 27 1HD1 LEU 27 5.088 2.378 -4.439 187 HD12 LEU 27 2HD1 LEU 27 3.846 3.332 -3.601 188 HD13 LEU 27 3HD1 LEU 27 5.176 2.616 -2.685 189 HD21 LEU 27 3HD2 LEU 27 7.510 3.680 -2.866 190 HD22 LEU 27 1HD2 LEU 27 7.831 4.870 -4.087 191 HD23 LEU 27 2HD2 LEU 27 7.396 3.188 -4.548 192 H THR 28 H THR 28 6.851 6.436 -7.748 193 HA THR 28 HA THR 28 5.532 8.804 -8.637 194 HB THR 28 HB THR 28 6.292 7.642 -10.916 195 HG1 THR 28 1HG THR 28 7.515 6.039 -10.800 196 HG21 THR 28 3HG2 THR 28 8.574 8.608 -10.558 197 HG22 THR 28 1HG2 THR 28 8.286 8.648 -8.807 198 HG23 THR 28 2HG2 THR 28 7.336 9.679 -9.891 199 H SER 29 H SER 29 4.057 8.775 -10.598 200 HA SER 29 HA SER 29 1.664 7.388 -10.013 201 HB2 SER 29 1HB SER 29 2.516 8.785 -12.590 202 HB3 SER 29 2HB SER 29 0.860 8.465 -12.043 203 HG SER 29 HG SER 29 1.037 9.964 -10.543 204 H SER 30 H SER 30 3.580 7.102 -13.082 205 HA SER 30 HA SER 30 2.455 4.478 -13.570 206 HB2 SER 30 1HB SER 30 4.580 6.161 -14.958 207 HB3 SER 30 2HB SER 30 3.992 4.609 -15.562 208 HG SER 30 HG SER 30 2.939 6.267 -16.530 209 H GLN 31 H GLN 31 4.254 4.794 -11.059 210 HA GLN 31 HA GLN 31 6.722 3.501 -11.581 211 HB2 GLN 31 1HB GLN 31 5.854 4.691 -9.429 212 HB3 GLN 31 2HB GLN 31 5.115 3.197 -9.006 213 HG2 GLN 31 1HG GLN 31 7.358 2.129 -9.300 214 HG3 GLN 31 2HG GLN 31 8.051 3.737 -9.509 215 HE21 GLN 31 1HE2 GLN 31 8.797 4.725 -7.586 216 HE22 GLN 31 2HE2 GLN 31 8.238 4.237 -6.009 217 H THR 32 H THR 32 7.293 1.411 -11.777 218 HA THR 32 HA THR 32 5.290 -0.757 -11.405 219 HB THR 32 HB THR 32 6.257 -1.876 -13.324 220 HG1 THR 32 1HG THR 32 7.883 0.457 -13.498 221 HG21 THR 32 3HG2 THR 32 5.253 -0.509 -15.041 222 HG22 THR 32 1HG2 THR 32 5.517 0.965 -14.117 223 HG23 THR 32 2HG2 THR 32 4.343 -0.238 -13.546 224 H LYS 33 H LYS 33 8.185 0.558 -10.262 225 HA LYS 33 HA LYS 33 8.973 -1.963 -9.003 226 HB2 LYS 33 1HB LYS 33 10.302 -0.890 -11.323 227 HB3 LYS 33 2HB LYS 33 11.368 -0.600 -9.933 228 HG2 LYS 33 1HG LYS 33 11.377 -2.957 -9.370 229 HG3 LYS 33 2HG LYS 33 10.019 -3.262 -10.474 230 HD2 LYS 33 1HD LYS 33 12.126 -4.045 -11.444 231 HD3 LYS 33 2HD LYS 33 11.412 -2.741 -12.412 232 HE2 LYS 33 1HE LYS 33 12.978 -1.104 -11.476 233 HE3 LYS 33 2HE LYS 33 13.632 -2.316 -10.360 234 HZ1 LYS 33 3HZ LYS 33 15.006 -1.960 -12.377 235 HZ2 LYS 33 1HZ LYS 33 13.783 -2.598 -13.302 236 HZ3 LYS 33 2HZ LYS 33 14.518 -3.511 -12.163 237 H ALA 34 H ALA 34 10.011 -1.648 -7.065 238 HA ALA 34 HA ALA 34 9.288 0.669 -5.651 239 HB1 ALA 34 1HB ALA 34 11.257 -1.583 -5.020 240 HB2 ALA 34 2HB ALA 34 10.743 -0.373 -3.827 241 HB3 ALA 34 3HB ALA 34 9.537 -1.457 -4.543 242 HA PRO 35 HA PRO 35 12.684 3.397 -6.423 243 HB2 PRO 35 1HB PRO 35 12.770 4.922 -4.147 244 HB3 PRO 35 2HB PRO 35 11.365 4.963 -5.271 245 HG2 PRO 35 1HG PRO 35 11.678 3.288 -2.754 246 HG3 PRO 35 2HG PRO 35 10.306 4.361 -3.173 247 HD2 PRO 35 1HD PRO 35 10.143 1.745 -3.647 248 HD3 PRO 35 2HD PRO 35 9.563 2.918 -4.870 249 H ASN 36 H ASN 36 12.941 1.157 -3.505 250 HA ASN 36 HA ASN 36 15.818 1.236 -3.758 251 HB2 ASN 36 1HB ASN 36 14.169 2.012 -1.284 252 HB3 ASN 36 2HB ASN 36 15.789 1.313 -1.172 253 HD21 ASN 36 1HD2 ASN 36 14.085 4.372 -1.580 254 HD22 ASN 36 2HD2 ASN 36 15.557 5.216 -2.044 255 H VAL 37 H VAL 37 16.585 -0.758 -2.776 256 HA VAL 37 HA VAL 37 14.578 -2.815 -2.046 257 HB VAL 37 HB VAL 37 17.645 -2.596 -1.399 258 HG11 VAL 37 1HG1 VAL 37 17.613 -5.065 -1.283 259 HG12 VAL 37 2HG1 VAL 37 16.528 -4.300 -0.131 260 HG13 VAL 37 3HG1 VAL 37 15.872 -5.069 -1.587 261 HG21 VAL 37 3HG2 VAL 37 17.897 -2.450 -3.661 262 HG22 VAL 37 1HG2 VAL 37 17.943 -4.194 -3.478 263 HG23 VAL 37 2HG2 VAL 37 16.454 -3.380 -4.047 264 H LEU 38 H LEU 38 13.664 -2.748 -0.588 265 HA LEU 38 HA LEU 38 13.946 -1.537 1.950 266 HB2 LEU 38 1HB LEU 38 11.995 -3.690 1.413 267 HB3 LEU 38 2HB LEU 38 11.872 -2.196 2.334 268 HG LEU 38 HG LEU 38 10.632 -1.989 0.466 269 HD11 LEU 38 1HD1 LEU 38 12.925 -0.185 -0.131 270 HD12 LEU 38 2HD1 LEU 38 11.687 0.047 1.120 271 HD13 LEU 38 3HD1 LEU 38 11.232 0.048 -0.594 272 HD21 LEU 38 3HD2 LEU 38 10.673 -2.447 -1.585 273 HD22 LEU 38 1HD2 LEU 38 11.526 -3.769 -0.776 274 HD23 LEU 38 2HD2 LEU 38 12.435 -2.549 -1.692 275 H LYS 39 H LYS 39 14.945 -2.447 3.785 276 HA LYS 39 HA LYS 39 15.748 -5.310 3.682 277 HB2 LYS 39 1HB LYS 39 16.582 -3.073 5.556 278 HB3 LYS 39 2HB LYS 39 17.380 -4.630 5.343 279 HG2 LYS 39 1HG LYS 39 17.960 -3.939 2.999 280 HG3 LYS 39 2HG LYS 39 17.189 -2.395 3.238 281 HD2 LYS 39 1HD LYS 39 18.734 -2.229 5.370 282 HD3 LYS 39 2HD LYS 39 19.668 -3.503 4.536 283 HE2 LYS 39 1HE LYS 39 19.769 -1.969 2.507 284 HE3 LYS 39 2HE LYS 39 18.954 -0.733 3.483 285 HZ1 LYS 39 3HZ LYS 39 21.637 -1.862 3.874 286 HZ2 LYS 39 1HZ LYS 39 20.870 -1.010 5.078 287 HZ3 LYS 39 2HZ LYS 39 21.228 -0.306 3.641 288 H GLY 40 H GLY 40 15.487 -6.622 5.670 289 HA2 GLY 40 1HA GLY 40 14.250 -7.304 7.584 290 HA3 GLY 40 2HA GLY 40 13.348 -5.786 7.557 291 H ASN 41 H ASN 41 11.664 -7.672 7.974 292 HA ASN 41 HA ASN 41 10.514 -8.676 5.377 293 HB2 ASN 41 1HB ASN 41 11.080 -10.524 6.853 294 HB3 ASN 41 2HB ASN 41 10.255 -9.727 8.198 295 HD21 ASN 41 1HD2 ASN 41 8.316 -10.661 8.689 296 HD22 ASN 41 2HD2 ASN 41 7.332 -11.528 7.557 297 H LYS 42 H LYS 42 9.876 -6.647 8.185 298 HA LYS 42 HA LYS 42 7.014 -6.698 7.856 299 HB2 LYS 42 1HB LYS 42 8.953 -4.839 9.217 300 HB3 LYS 42 2HB LYS 42 7.276 -4.384 9.087 301 HG2 LYS 42 1HG LYS 42 8.116 -6.998 10.392 302 HG3 LYS 42 2HG LYS 42 7.914 -5.472 11.283 303 HD2 LYS 42 1HD LYS 42 5.582 -5.280 10.483 304 HD3 LYS 42 2HD LYS 42 5.779 -6.808 9.603 305 HE2 LYS 42 1HE LYS 42 6.173 -7.999 11.695 306 HE3 LYS 42 2HE LYS 42 5.966 -6.501 12.619 307 HZ1 LYS 42 3HZ LYS 42 3.877 -7.523 10.794 308 HZ2 LYS 42 1HZ LYS 42 3.726 -6.388 12.001 309 HZ3 LYS 42 2HZ LYS 42 3.923 -7.980 12.356 310 H LEU 43 H LEU 43 6.080 -6.087 6.081 311 HA LEU 43 HA LEU 43 7.268 -4.013 4.304 312 HB2 LEU 43 1HB LEU 43 6.357 -6.429 3.601 313 HB3 LEU 43 2HB LEU 43 4.802 -5.626 3.621 314 HG LEU 43 HG LEU 43 7.232 -4.924 1.950 315 HD11 LEU 43 1HD1 LEU 43 5.810 -6.876 1.250 316 HD12 LEU 43 2HD1 LEU 43 5.825 -5.557 0.072 317 HD13 LEU 43 3HD1 LEU 43 4.422 -5.767 1.139 318 HD21 LEU 43 3HD2 LEU 43 6.295 -2.779 2.347 319 HD22 LEU 43 1HD2 LEU 43 4.620 -3.406 2.283 320 HD23 LEU 43 2HD2 LEU 43 5.607 -3.280 0.812 321 H TYR 44 H TYR 44 6.412 -1.939 4.477 322 HA TYR 44 HA TYR 44 3.687 -1.660 5.653 323 HB2 TYR 44 1HB TYR 44 6.088 0.177 5.903 324 HB3 TYR 44 2HB TYR 44 4.477 0.475 6.552 325 HD1 TYR 44 2HD TYR 44 3.502 -1.588 8.052 326 HD2 TYR 44 1HD TYR 44 7.662 -0.579 7.477 327 HE1 TYR 44 2HE TYR 44 4.076 -2.693 10.187 328 HE2 TYR 44 1HE TYR 44 8.230 -1.656 9.605 329 HH TYR 44 HH TYR 44 7.354 -2.605 11.596 330 H VAL 45 H VAL 45 2.282 -0.900 4.216 331 HA VAL 45 HA VAL 45 3.216 0.815 1.943 332 HB VAL 45 HB VAL 45 0.700 -0.885 2.034 333 HG11 VAL 45 1HG1 VAL 45 0.635 -0.322 -0.389 334 HG12 VAL 45 2HG1 VAL 45 0.387 1.053 0.688 335 HG13 VAL 45 3HG1 VAL 45 1.957 0.851 -0.076 336 HG21 VAL 45 3HG2 VAL 45 1.695 -2.374 0.498 337 HG22 VAL 45 1HG2 VAL 45 3.206 -1.418 0.415 338 HG23 VAL 45 2HG2 VAL 45 2.748 -2.299 1.886 339 H LYS 46 H LYS 46 2.076 2.737 1.668 340 HA LYS 46 HA LYS 46 0.045 3.481 3.694 341 HB2 LYS 46 1HB LYS 46 2.066 4.501 4.391 342 HB3 LYS 46 2HB LYS 46 2.498 5.035 2.762 343 HG2 LYS 46 1HG LYS 46 0.933 6.765 2.784 344 HG3 LYS 46 2HG LYS 46 -0.047 5.980 4.013 345 HD2 LYS 46 1HD LYS 46 0.883 7.724 5.208 346 HD3 LYS 46 2HD LYS 46 1.924 6.372 5.653 347 HE2 LYS 46 1HE LYS 46 3.609 7.098 3.986 348 HE3 LYS 46 2HE LYS 46 2.517 8.383 3.442 349 HZ1 LYS 46 3HZ LYS 46 2.684 9.390 5.619 350 HZ2 LYS 46 1HZ LYS 46 4.165 9.239 4.905 351 HZ3 LYS 46 2HZ LYS 46 3.762 8.233 6.126 352 H ALA 47 H ALA 47 -1.657 3.106 2.324 353 HA ALA 47 HA ALA 47 -1.290 3.607 -0.585 354 HB1 ALA 47 1HB ALA 47 -2.923 1.587 0.981 355 HB2 ALA 47 2HB ALA 47 -3.123 1.875 -0.757 356 HB3 ALA 47 3HB ALA 47 -1.587 1.286 -0.149 357 H ARG 48 H ARG 48 -2.603 4.907 -1.711 358 HA ARG 48 HA ARG 48 -4.524 6.440 -0.136 359 HB2 ARG 48 1HB ARG 48 -2.786 7.570 -1.507 360 HB3 ARG 48 2HB ARG 48 -3.497 6.880 -2.970 361 HG2 ARG 48 1HG ARG 48 -4.607 8.866 -3.057 362 HG3 ARG 48 2HG ARG 48 -5.718 8.082 -1.961 363 HD2 ARG 48 1HD ARG 48 -5.281 10.173 -0.952 364 HD3 ARG 48 2HD ARG 48 -4.302 9.020 -0.040 365 HE ARG 48 HE ARG 48 -2.380 10.017 -0.792 366 HH11 ARG 48 1HH1 ARG 48 -5.071 11.343 -2.791 367 HH12 ARG 48 2HH1 ARG 48 -4.089 12.666 -3.335 368 HH21 ARG 48 1HH2 ARG 48 -1.165 11.599 -1.691 369 HH22 ARG 48 2HH2 ARG 48 -1.785 12.713 -2.880 370 H PHE 49 H PHE 49 -6.459 5.649 -0.029 371 HA PHE 49 HA PHE 49 -7.864 4.341 -2.319 372 HB2 PHE 49 1HB PHE 49 -8.588 4.392 0.662 373 HB3 PHE 49 2HB PHE 49 -9.501 3.629 -0.613 374 HD1 PHE 49 1HD PHE 49 -6.288 3.488 1.236 375 HD2 PHE 49 2HD PHE 49 -9.005 1.368 -1.368 376 HE1 PHE 49 1HE PHE 49 -5.025 1.418 1.603 377 HE2 PHE 49 2HE PHE 49 -7.879 -0.756 -0.810 378 HZ PHE 49 HZ PHE 49 -5.904 -0.757 0.722 379 H MET 50 H MET 50 -8.797 6.059 -3.469 380 HA MET 50 HA MET 50 -9.894 8.352 -1.912 381 HB2 MET 50 1HB MET 50 -9.897 8.219 -4.909 382 HB3 MET 50 2HB MET 50 -9.966 9.617 -3.883 383 HG2 MET 50 1HG MET 50 -7.455 8.056 -3.618 384 HG3 MET 50 2HG MET 50 -7.737 8.704 -5.218 385 HE1 MET 50 3HE MET 50 -7.561 11.386 -1.467 386 HE2 MET 50 1HE MET 50 -9.072 10.741 -2.155 387 HE3 MET 50 2HE MET 50 -7.864 9.625 -1.462 388 H GLY 51 H GLY 51 -12.001 8.379 -1.574 389 HA2 GLY 51 1HA GLY 51 -14.308 7.818 -1.775 390 HA3 GLY 51 2HA GLY 51 -13.934 6.772 -3.147 391 H TYR 52 H TYR 52 -15.680 5.988 -1.083 392 HA TYR 52 HA TYR 52 -14.375 4.740 1.119 393 HB2 TYR 52 1HB TYR 52 -17.062 5.378 0.298 394 HB3 TYR 52 2HB TYR 52 -17.044 3.682 0.694 395 HD1 TYR 52 1HD TYR 52 -15.929 2.994 2.992 396 HD2 TYR 52 2HD TYR 52 -17.219 7.000 2.015 397 HE1 TYR 52 1HE TYR 52 -15.952 3.594 5.400 398 HE2 TYR 52 2HE TYR 52 -17.275 7.582 4.410 399 HH TYR 52 HH TYR 52 -17.507 6.052 6.734 400 H THR 53 H THR 53 -13.503 2.723 1.354 401 HA THR 53 HA THR 53 -15.080 0.566 0.354 402 HB THR 53 HB THR 53 -13.320 0.728 -1.451 403 HG1 THR 53 1HG THR 53 -13.652 -1.272 -1.629 404 HG21 THR 53 3HG2 THR 53 -11.040 -0.113 -0.930 405 HG22 THR 53 1HG2 THR 53 -11.435 -0.194 0.778 406 HG23 THR 53 2HG2 THR 53 -11.364 1.385 -0.033 407 H LYS 54 H LYS 54 -14.736 -1.300 1.485 408 HA LYS 54 HA LYS 54 -12.995 -1.329 3.823 409 HB2 LYS 54 1HB LYS 54 -16.010 -1.780 3.955 410 HB3 LYS 54 2HB LYS 54 -14.904 -2.331 5.215 411 HG2 LYS 54 1HG LYS 54 -14.636 -0.317 6.130 412 HG3 LYS 54 2HG LYS 54 -14.515 0.525 4.607 413 HD2 LYS 54 1HD LYS 54 -16.432 1.421 5.453 414 HD3 LYS 54 2HD LYS 54 -17.074 0.153 4.399 415 HE2 LYS 54 1HE LYS 54 -17.175 -1.326 6.505 416 HE3 LYS 54 2HE LYS 54 -16.756 0.137 7.423 417 HZ1 LYS 54 3HZ LYS 54 -19.177 -0.424 5.870 418 HZ2 LYS 54 1HZ LYS 54 -18.764 1.136 6.206 419 HZ3 LYS 54 2HZ LYS 54 -19.054 0.057 7.436 420 H LEU 55 H LEU 55 -13.055 -2.519 1.084 421 HA LEU 55 HA LEU 55 -13.291 -5.410 1.738 422 HB2 LEU 55 1HB LEU 55 -14.224 -4.023 -0.791 423 HB3 LEU 55 2HB LEU 55 -14.174 -5.760 -0.516 424 HG LEU 55 HG LEU 55 -15.773 -5.033 1.579 425 HD11 LEU 55 1HD1 LEU 55 -17.437 -3.408 0.776 426 HD12 LEU 55 2HD1 LEU 55 -16.487 -3.111 -0.692 427 HD13 LEU 55 3HD1 LEU 55 -15.851 -2.642 0.898 428 HD21 LEU 55 3HD2 LEU 55 -16.600 -5.639 -1.288 429 HD22 LEU 55 1HD2 LEU 55 -17.690 -5.689 0.099 430 HD23 LEU 55 2HD2 LEU 55 -16.311 -6.807 0.013 431 H THR 56 H THR 56 -10.915 -4.231 2.086 432 HA THR 56 HA THR 56 -9.335 -4.144 -0.368 433 HB THR 56 HB THR 56 -8.316 -4.283 2.507 434 HG1 THR 56 1HG THR 56 -9.509 -2.555 2.815 435 HG21 THR 56 3HG2 THR 56 -7.319 -2.939 -0.044 436 HG22 THR 56 1HG2 THR 56 -6.640 -4.386 0.732 437 HG23 THR 56 2HG2 THR 56 -6.543 -2.832 1.552 438 H VAL 57 H VAL 57 -7.881 -5.848 -1.040 439 HA VAL 57 HA VAL 57 -7.807 -8.354 0.528 440 HB VAL 57 HB VAL 57 -8.461 -8.150 -2.452 441 HG11 VAL 57 1HG1 VAL 57 -8.000 -10.590 -0.673 442 HG12 VAL 57 2HG1 VAL 57 -8.841 -10.660 -2.230 443 HG13 VAL 57 3HG1 VAL 57 -7.162 -10.147 -2.175 444 HG21 VAL 57 3HG2 VAL 57 -10.454 -7.596 -1.231 445 HG22 VAL 57 1HG2 VAL 57 -10.621 -9.269 -1.791 446 HG23 VAL 57 2HG2 VAL 57 -10.218 -8.931 -0.097 447 H ILE 58 H ILE 58 -5.934 -9.632 -0.028 448 HA ILE 58 HA ILE 58 -3.895 -8.555 -1.788 449 HB ILE 58 HB ILE 58 -3.175 -9.456 1.027 450 HG12 ILE 58 1HG1 ILE 58 -3.418 -6.552 0.117 451 HG13 ILE 58 2HG1 ILE 58 -4.430 -7.368 1.320 452 HG21 ILE 58 1HG2 ILE 58 -1.486 -9.678 -0.830 453 HG22 ILE 58 2HG2 ILE 58 -1.547 -7.912 -1.040 454 HG23 ILE 58 3HG2 ILE 58 -0.953 -8.627 0.469 455 HD11 ILE 58 3HD1 ILE 58 -1.511 -6.688 1.575 456 HD12 ILE 58 1HD1 ILE 58 -2.862 -6.103 2.553 457 HD13 ILE 58 2HD1 ILE 58 -2.349 -7.794 2.695 458 H THR 59 H THR 59 -3.346 -10.369 -3.010 459 HA THR 59 HA THR 59 -4.798 -12.716 -2.591 460 HB THR 59 HB THR 59 -2.576 -12.016 -4.535 461 HG1 THR 59 1HG THR 59 -5.399 -11.840 -4.816 462 HG21 THR 59 3HG2 THR 59 -3.633 -13.614 -6.106 463 HG22 THR 59 1HG2 THR 59 -4.734 -14.148 -4.810 464 HG23 THR 59 2HG2 THR 59 -2.980 -14.410 -4.675 465 H GLY 60 H GLY 60 -1.324 -11.995 -2.051 466 HA2 GLY 60 1HA GLY 60 0.266 -13.140 -0.895 467 HA3 GLY 60 2HA GLY 60 -1.018 -14.149 -0.202 468 H LYS 61 H LYS 61 1.420 -15.329 -0.702 469 HA LYS 61 HA LYS 61 1.750 -16.596 -3.183 470 HB2 LYS 61 1HB LYS 61 3.019 -16.549 -0.724 471 HB3 LYS 61 2HB LYS 61 2.334 -18.179 -0.720 472 HG2 LYS 61 1HG LYS 61 3.487 -18.656 -2.813 473 HG3 LYS 61 2HG LYS 61 4.013 -16.967 -2.944 474 HD2 LYS 61 1HD LYS 61 4.675 -18.422 -0.408 475 HD3 LYS 61 2HD LYS 61 5.550 -18.938 -1.851 476 HE2 LYS 61 1HE LYS 61 5.517 -16.076 -0.761 477 HE3 LYS 61 2HE LYS 61 6.768 -17.287 -0.473 478 HZ1 LYS 61 3HZ LYS 61 6.148 -15.875 -2.930 479 HZ2 LYS 61 1HZ LYS 61 6.935 -17.308 -3.042 480 HZ3 LYS 61 2HZ LYS 61 7.592 -16.068 -2.178 481 H ASP 62 H ASP 62 -0.010 -17.694 -0.352 482 HA ASP 62 HA ASP 62 -1.145 -20.004 -1.152 483 HB2 ASP 62 1HB ASP 62 -2.615 -17.809 0.364 484 HB3 ASP 62 2HB ASP 62 -2.942 -19.548 0.438 485 H GLY 63 H GLY 63 -2.129 -16.815 -2.430 486 HA2 GLY 63 1HA GLY 63 -3.923 -16.214 -3.764 487 HA3 GLY 63 2HA GLY 63 -4.213 -17.920 -4.129 488 H LYS 64 H LYS 64 -4.067 -16.286 -0.955 489 HA LYS 64 HA LYS 64 -6.931 -16.636 -0.483 490 HB2 LYS 64 1HB LYS 64 -4.749 -17.576 1.451 491 HB3 LYS 64 2HB LYS 64 -6.476 -17.463 1.800 492 HG2 LYS 64 1HG LYS 64 -6.826 -19.001 -0.216 493 HG3 LYS 64 2HG LYS 64 -5.103 -19.347 -0.155 494 HD2 LYS 64 1HD LYS 64 -5.348 -20.112 2.225 495 HD3 LYS 64 2HD LYS 64 -7.082 -19.748 2.121 496 HE2 LYS 64 1HE LYS 64 -7.136 -22.002 1.700 497 HE3 LYS 64 2HE LYS 64 -7.062 -21.360 0.057 498 HZ1 LYS 64 3HZ LYS 64 -5.534 -23.124 0.267 499 HZ2 LYS 64 1HZ LYS 64 -4.796 -22.528 1.601 500 HZ3 LYS 64 2HZ LYS 64 -4.632 -21.817 0.118 501 H ASN 65 H ASN 65 -7.704 -15.071 0.796 502 HA ASN 65 HA ASN 65 -6.562 -12.535 0.644 503 HB2 ASN 65 1HB ASN 65 -9.015 -13.379 0.994 504 HB3 ASN 65 2HB ASN 65 -8.649 -13.336 2.712 505 HD21 ASN 65 1HD2 ASN 65 -7.605 -11.095 3.401 506 HD22 ASN 65 2HD2 ASN 65 -8.605 -9.768 2.844 507 H LEU 66 H LEU 66 -4.478 -12.355 1.587 508 HA LEU 66 HA LEU 66 -3.744 -13.324 4.098 509 HB2 LEU 66 1HB LEU 66 -2.743 -10.728 2.862 510 HB3 LEU 66 2HB LEU 66 -1.958 -11.647 4.140 511 HG LEU 66 HG LEU 66 -2.377 -12.569 1.259 512 HD11 LEU 66 1HD1 LEU 66 0.146 -12.470 1.279 513 HD12 LEU 66 2HD1 LEU 66 0.093 -11.801 2.910 514 HD13 LEU 66 3HD1 LEU 66 -0.598 -10.883 1.551 515 HD21 LEU 66 3HD2 LEU 66 -0.863 -14.506 2.031 516 HD22 LEU 66 1HD2 LEU 66 -2.515 -14.555 2.635 517 HD23 LEU 66 2HD2 LEU 66 -1.204 -13.995 3.692 518 H LEU 67 H LEU 67 -5.463 -10.299 3.415 519 HA LEU 67 HA LEU 67 -5.333 -9.325 6.114 520 HB2 LEU 67 1HB LEU 67 -6.989 -8.663 3.649 521 HB3 LEU 67 2HB LEU 67 -7.452 -7.961 5.190 522 HG LEU 67 HG LEU 67 -4.664 -7.690 4.040 523 HD11 LEU 67 1HD1 LEU 67 -7.027 -5.770 3.827 524 HD12 LEU 67 2HD1 LEU 67 -6.341 -6.704 2.490 525 HD13 LEU 67 3HD1 LEU 67 -5.367 -5.453 3.274 526 HD21 LEU 67 3HD2 LEU 67 -6.023 -5.821 6.010 527 HD22 LEU 67 1HD2 LEU 67 -4.278 -6.151 5.735 528 HD23 LEU 67 2HD2 LEU 67 -5.295 -7.301 6.587 529 H TYR 68 H TYR 68 -6.971 -12.089 5.031 530 HA TYR 68 HA TYR 68 -8.539 -12.038 7.520 531 HB2 TYR 68 1HB TYR 68 -9.938 -11.695 5.364 532 HB3 TYR 68 2HB TYR 68 -9.502 -13.343 4.959 533 HD1 TYR 68 2HD TYR 68 -11.062 -11.266 7.710 534 HD2 TYR 68 1HD TYR 68 -10.900 -15.108 5.743 535 HE1 TYR 68 2HE TYR 68 -13.071 -11.987 8.954 536 HE2 TYR 68 1HE TYR 68 -12.911 -15.811 6.967 537 HH TYR 68 HH TYR 68 -14.444 -15.297 8.536 538 H ASN 69 H ASN 69 -5.802 -12.760 6.866 539 HA ASN 69 HA ASN 69 -5.870 -15.702 7.301 540 HB2 ASN 69 1HB ASN 69 -4.565 -15.192 5.295 541 HB3 ASN 69 2HB ASN 69 -3.584 -14.026 6.221 542 HD21 ASN 69 1HD2 ASN 69 -4.504 -17.497 6.096 543 HD22 ASN 69 2HD2 ASN 69 -3.129 -18.013 7.049 544 H GLY 70 H GLY 70 -4.086 -12.696 8.233 545 HA2 GLY 70 1HA GLY 70 -4.531 -12.468 10.781 546 HA3 GLY 70 2HA GLY 70 -3.578 -13.944 10.893 547 H THR 71 H THR 71 -1.814 -12.808 8.513 548 HA THR 71 HA THR 71 -0.005 -11.412 10.361 549 HB THR 71 HB THR 71 0.564 -11.698 7.408 550 HG1 THR 71 1HG THR 71 0.360 -13.804 9.260 551 HG21 THR 71 3HG2 THR 71 2.872 -12.076 8.248 552 HG22 THR 71 1HG2 THR 71 2.293 -12.028 9.921 553 HG23 THR 71 2HG2 THR 71 2.234 -10.573 8.910 554 H ALA 72 H ALA 72 -1.601 -10.678 7.220 555 HA ALA 72 HA ALA 72 -0.894 -7.852 7.348 556 HB1 ALA 72 1HB ALA 72 -2.854 -9.304 5.498 557 HB2 ALA 72 2HB ALA 72 -2.119 -7.713 5.235 558 HB3 ALA 72 3HB ALA 72 -1.112 -9.179 5.197 559 H LYS 73 H LYS 73 -2.028 -6.297 8.167 560 HA LYS 73 HA LYS 73 -4.881 -6.539 8.859 561 HB2 LYS 73 1HB LYS 73 -3.787 -7.450 10.759 562 HB3 LYS 73 2HB LYS 73 -2.463 -6.286 10.662 563 HG2 LYS 73 1HG LYS 73 -3.794 -4.530 11.563 564 HG3 LYS 73 2HG LYS 73 -5.261 -5.560 11.586 565 HD2 LYS 73 1HD LYS 73 -4.263 -7.045 13.190 566 HD3 LYS 73 2HD LYS 73 -2.663 -6.324 12.975 567 HE2 LYS 73 1HE LYS 73 -3.594 -4.163 13.908 568 HE3 LYS 73 2HE LYS 73 -5.059 -5.056 14.358 569 HZ1 LYS 73 3HZ LYS 73 -3.636 -6.487 15.747 570 HZ2 LYS 73 1HZ LYS 73 -3.496 -4.916 16.172 571 HZ3 LYS 73 2HZ LYS 73 -2.300 -5.624 15.284 572 H MET 74 H MET 74 -5.802 -4.399 8.974 573 HA MET 74 HA MET 74 -4.031 -2.121 8.331 574 HB2 MET 74 1HB MET 74 -6.270 -2.125 7.196 575 HB3 MET 74 2HB MET 74 -7.041 -2.224 8.759 576 HG2 MET 74 1HG MET 74 -5.009 -0.039 8.286 577 HG3 MET 74 2HG MET 74 -6.560 0.117 7.472 578 HE1 MET 74 3HE MET 74 -9.155 0.301 10.136 579 HE2 MET 74 1HE MET 74 -8.678 0.917 8.529 580 HE3 MET 74 2HE MET 74 -8.601 -0.832 8.863 581 H PHE 75 H PHE 75 -3.273 -0.947 9.974 582 HA PHE 75 HA PHE 75 -4.238 -1.406 12.754 583 HB2 PHE 75 1HB PHE 75 -1.947 -1.531 13.459 584 HB3 PHE 75 2HB PHE 75 -2.180 -2.717 12.185 585 HD1 PHE 75 1HD PHE 75 -1.373 -2.131 9.785 586 HD2 PHE 75 2HD PHE 75 -0.295 0.182 13.265 587 HE1 PHE 75 1HE PHE 75 0.476 -1.064 8.520 588 HE2 PHE 75 2HE PHE 75 1.537 1.252 11.983 589 HZ PHE 75 HZ PHE 75 1.922 0.629 9.604 590 H LYS 76 H LYS 76 -4.182 0.932 10.395 591 HA LYS 76 HA LYS 76 -4.199 3.080 12.217 592 HB2 LYS 76 1HB LYS 76 -1.711 2.809 12.083 593 HB3 LYS 76 2HB LYS 76 -1.787 2.975 10.331 594 HG2 LYS 76 1HG LYS 76 -2.688 5.248 10.555 595 HG3 LYS 76 2HG LYS 76 -2.799 5.037 12.312 596 HD2 LYS 76 1HD LYS 76 -0.397 5.059 12.557 597 HD3 LYS 76 2HD LYS 76 -0.159 4.948 10.807 598 HE2 LYS 76 1HE LYS 76 0.176 7.259 11.481 599 HE3 LYS 76 2HE LYS 76 -1.291 7.132 10.501 600 HZ1 LYS 76 3HZ LYS 76 -1.843 8.476 12.341 601 HZ2 LYS 76 1HZ LYS 76 -1.142 7.444 13.435 602 HZ3 LYS 76 2HZ LYS 76 -2.525 7.050 12.685 603 H SER 77 H SER 77 -5.372 4.743 11.230 604 HA SER 77 HA SER 77 -5.665 4.869 8.313 605 HB2 SER 77 1HB SER 77 -8.164 4.401 8.590 606 HB3 SER 77 2HB SER 77 -7.114 3.022 8.810 607 HG SER 77 HG SER 77 -8.125 4.581 10.980 608 H ASP 78 H ASP 78 -5.251 7.084 8.200 609 HA ASP 78 HA ASP 78 -6.602 8.972 10.032 610 HB2 ASP 78 1HB ASP 78 -4.097 9.059 9.137 611 HB3 ASP 78 2HB ASP 78 -4.846 9.740 7.715 612 H ALA 79 H ALA 79 -7.349 11.030 8.516 613 HA ALA 79 HA ALA 79 -9.086 10.020 6.328 614 HB1 ALA 79 1HB ALA 79 -9.852 11.831 8.657 615 HB2 ALA 79 2HB ALA 79 -10.904 11.402 7.290 616 HB3 ALA 79 3HB ALA 79 -10.378 10.162 8.438 617 H ILE 80 H ILE 80 -8.742 11.101 4.526 618 HA ILE 80 HA ILE 80 -6.884 13.387 4.621 619 HB ILE 80 HB ILE 80 -7.753 11.620 2.299 620 HG12 ILE 80 1HG1 ILE 80 -5.134 11.722 3.876 621 HG13 ILE 80 2HG1 ILE 80 -6.383 10.522 4.065 622 HG21 ILE 80 1HG2 ILE 80 -5.564 13.751 2.391 623 HG22 ILE 80 2HG2 ILE 80 -5.995 12.730 0.998 624 HG23 ILE 80 3HG2 ILE 80 -7.129 13.932 1.578 625 HD11 ILE 80 3HD1 ILE 80 -4.732 9.537 2.645 626 HD12 ILE 80 1HD1 ILE 80 -6.084 9.980 1.577 627 HD13 ILE 80 2HD1 ILE 80 -4.621 10.983 1.637 628 H LEU 81 H LEU 81 -7.685 15.174 4.556 629 HA LEU 81 HA LEU 81 -10.270 15.883 3.244 630 HB2 LEU 81 1HB LEU 81 -8.335 17.689 4.746 631 HB3 LEU 81 2HB LEU 81 -9.942 18.130 4.166 632 HG LEU 81 HG LEU 81 -9.385 16.028 6.298 633 HD11 LEU 81 1HD1 LEU 81 -10.381 18.881 6.649 634 HD12 LEU 81 2HD1 LEU 81 -8.728 18.322 6.973 635 HD13 LEU 81 3HD1 LEU 81 -10.048 17.664 7.927 636 HD21 LEU 81 3HD2 LEU 81 -12.050 17.375 5.640 637 HD22 LEU 81 1HD2 LEU 81 -11.738 16.015 6.737 638 HD23 LEU 81 2HD2 LEU 81 -11.585 15.796 5.006 639 H GLY 82 H GLY 82 -10.283 17.273 1.489 640 HA2 GLY 82 1HA GLY 82 -7.837 17.967 0.005 641 HA3 GLY 82 2HA GLY 82 -9.507 18.423 -0.372 642 H GLN 83 H GLN 83 -9.315 20.664 -0.448 643 HA GLN 83 HA GLN 83 -7.841 22.110 1.675 644 HB2 GLN 83 1HB GLN 83 -7.317 22.693 -0.612 645 HB3 GLN 83 2HB GLN 83 -9.030 22.956 -0.992 646 HG2 GLN 83 1HG GLN 83 -9.158 24.880 0.391 647 HG3 GLN 83 2HG GLN 83 -7.566 24.578 1.117 648 HE21 GLN 83 1HE2 GLN 83 -5.636 25.168 -0.112 649 HE22 GLN 83 2HE2 GLN 83 -5.798 26.189 -1.535 650 H ASN 84 H ASN 84 -11.191 21.486 0.635 651 HA ASN 84 HA ASN 84 -12.085 23.625 2.547 652 HB2 ASN 84 1HB ASN 84 -13.767 22.518 0.307 653 HB3 ASN 84 2HB ASN 84 -14.017 23.966 1.260 654 HD21 ASN 84 1HD2 ASN 84 -13.316 23.147 -1.753 655 HD22 ASN 84 2HD2 ASN 84 -11.957 24.189 -2.178 656 H LYS 85 H LYS 85 -11.328 21.285 3.728 657 HA LYS 85 HA LYS 85 -11.878 19.521 4.941 658 HB2 LYS 85 1HB LYS 85 -14.380 21.171 5.398 659 HB3 LYS 85 2HB LYS 85 -14.002 19.701 6.298 660 HG2 LYS 85 1HG LYS 85 -11.952 20.629 7.175 661 HG3 LYS 85 2HG LYS 85 -12.128 22.098 6.197 662 HD2 LYS 85 1HD LYS 85 -14.139 22.734 7.364 663 HD3 LYS 85 2HD LYS 85 -14.201 21.208 8.244 664 HE2 LYS 85 1HE LYS 85 -11.940 23.233 8.517 665 HE3 LYS 85 2HE LYS 85 -13.388 23.222 9.538 666 HZ1 LYS 85 3HZ LYS 85 -11.376 21.066 9.360 667 HZ2 LYS 85 1HZ LYS 85 -12.805 20.941 10.190 668 HZ3 LYS 85 2HZ LYS 85 -11.661 22.042 10.631 669 H VAL 86 H VAL 86 -12.665 19.472 2.045 670 HA VAL 86 HA VAL 86 -14.909 17.630 1.876 671 HB VAL 86 HB VAL 86 -12.751 18.125 -0.218 672 HG11 VAL 86 1HG1 VAL 86 -15.689 17.330 -0.404 673 HG12 VAL 86 2HG1 VAL 86 -14.590 17.568 -1.782 674 HG13 VAL 86 3HG1 VAL 86 -14.308 16.252 -0.634 675 HG21 VAL 86 3HG2 VAL 86 -13.421 20.334 0.305 676 HG22 VAL 86 1HG2 VAL 86 -14.244 19.887 -1.176 677 HG23 VAL 86 2HG2 VAL 86 -15.144 19.889 0.364 678 H VAL 87 H VAL 87 -14.607 15.602 2.874 679 HA VAL 87 HA VAL 87 -12.017 14.284 3.047 680 HB VAL 87 HB VAL 87 -13.508 13.657 4.636 681 HG11 VAL 87 1HG1 VAL 87 -15.694 12.585 4.280 682 HG12 VAL 87 2HG1 VAL 87 -15.646 14.283 3.799 683 HG13 VAL 87 3HG1 VAL 87 -15.588 12.998 2.556 684 HG21 VAL 87 3HG2 VAL 87 -13.558 11.347 2.681 685 HG22 VAL 87 1HG2 VAL 87 -12.107 11.851 3.576 686 HG23 VAL 87 2HG2 VAL 87 -13.528 11.301 4.457 687 H ILE 88 H ILE 88 -11.033 13.160 1.505 688 HA ILE 88 HA ILE 88 -12.480 12.516 -1.040 689 HB ILE 88 HB ILE 88 -10.254 12.847 -2.153 690 HG12 ILE 88 1HG1 ILE 88 -9.435 14.329 0.386 691 HG13 ILE 88 2HG1 ILE 88 -8.829 12.736 -0.070 692 HG21 ILE 88 1HG2 ILE 88 -12.154 14.484 -2.151 693 HG22 ILE 88 2HG2 ILE 88 -11.373 15.322 -0.791 694 HG23 ILE 88 3HG2 ILE 88 -10.566 15.235 -2.379 695 HD11 ILE 88 3HD1 ILE 88 -7.958 13.737 -2.215 696 HD12 ILE 88 1HD1 ILE 88 -8.422 15.340 -1.591 697 HD13 ILE 88 2HD1 ILE 88 -7.202 14.381 -0.746 698 H GLY 89 H GLY 89 -10.373 11.376 1.530 699 HA2 GLY 89 1HA GLY 89 -10.768 8.643 0.807 700 HA3 GLY 89 2HA GLY 89 -9.156 9.191 0.306 701 H TRP 90 H TRP 90 -8.707 7.420 1.963 702 HA TRP 90 HA TRP 90 -8.111 8.613 4.588 703 HB2 TRP 90 1HB TRP 90 -9.648 6.012 4.142 704 HB3 TRP 90 2HB TRP 90 -9.052 6.566 5.694 705 HD1 TRP 90 HD TRP 90 -10.460 8.536 6.838 706 HE1 TRP 90 1HE TRP 90 -12.704 9.763 6.254 707 HE3 TRP 90 3HE TRP 90 -11.347 6.494 2.279 708 HZ2 TRP 90 2HZ TRP 90 -14.854 9.370 4.339 709 HZ3 TRP 90 3HZ TRP 90 -13.446 7.003 1.051 710 HH2 TRP 90 HH TRP 90 -15.199 8.433 2.075 711 H ASP 91 H ASP 91 -5.948 7.945 5.024 712 HA ASP 91 HA ASP 91 -4.690 6.234 2.964 713 HB2 ASP 91 1HB ASP 91 -3.854 8.423 4.611 714 HB3 ASP 91 2HB ASP 91 -2.943 7.015 5.138 715 H LYS 92 H LYS 92 -5.351 4.145 3.341 716 HA LYS 92 HA LYS 92 -5.497 3.139 6.186 717 HB2 LYS 92 1HB LYS 92 -6.388 1.877 3.550 718 HB3 LYS 92 2HB LYS 92 -6.120 0.926 4.994 719 HG2 LYS 92 1HG LYS 92 -8.411 1.239 4.817 720 HG3 LYS 92 2HG LYS 92 -7.868 2.184 6.200 721 HD2 LYS 92 1HD LYS 92 -8.209 4.226 5.116 722 HD3 LYS 92 2HD LYS 92 -8.211 3.518 3.485 723 HE2 LYS 92 1HE LYS 92 -10.312 2.693 5.500 724 HE3 LYS 92 2HE LYS 92 -10.523 4.207 4.618 725 HZ1 LYS 92 3HZ LYS 92 -11.618 2.235 3.645 726 HZ2 LYS 92 1HZ LYS 92 -10.141 1.617 3.241 727 HZ3 LYS 92 2HZ LYS 92 -10.683 3.046 2.605 728 H TYR 93 H TYR 93 -3.607 2.568 6.993 729 HA TYR 93 HA TYR 93 -1.331 1.770 5.377 730 HB2 TYR 93 1HB TYR 93 -1.937 1.681 8.364 731 HB3 TYR 93 2HB TYR 93 -0.415 1.174 7.675 732 HD1 TYR 93 2HD TYR 93 -2.668 4.198 7.874 733 HD2 TYR 93 1HD TYR 93 1.352 2.671 7.380 734 HE1 TYR 93 2HE TYR 93 -1.760 6.393 8.401 735 HE2 TYR 93 1HE TYR 93 2.256 4.924 7.773 736 HH TYR 93 HH TYR 93 1.730 6.922 8.906 737 H PHE 94 H PHE 94 -0.368 -0.361 5.418 738 HA PHE 94 HA PHE 94 -1.986 -2.522 6.632 739 HB2 PHE 94 1HB PHE 94 -1.108 -2.390 3.726 740 HB3 PHE 94 2HB PHE 94 -1.563 -3.893 4.538 741 HD1 PHE 94 1HD PHE 94 -3.822 -4.109 5.615 742 HD2 PHE 94 2HD PHE 94 -2.862 -0.732 3.132 743 HE1 PHE 94 1HE PHE 94 -6.255 -3.656 5.312 744 HE2 PHE 94 2HE PHE 94 -5.271 -0.236 2.936 745 HZ PHE 94 HZ PHE 94 -6.974 -1.704 3.969 746 H GLU 95 H GLU 95 -0.897 -4.163 7.441 747 HA GLU 95 HA GLU 95 2.022 -3.868 7.761 748 HB2 GLU 95 1HB GLU 95 0.433 -3.646 9.647 749 HB3 GLU 95 2HB GLU 95 -0.141 -5.280 9.403 750 HG2 GLU 95 1HG GLU 95 2.045 -6.176 10.025 751 HG3 GLU 95 2HG GLU 95 2.767 -4.571 9.983 752 H ILE 96 H ILE 96 2.309 -5.052 5.567 753 HA ILE 96 HA ILE 96 1.229 -7.793 5.554 754 HB ILE 96 HB ILE 96 2.770 -6.730 3.221 755 HG12 ILE 96 1HG1 ILE 96 0.289 -6.037 2.512 756 HG13 ILE 96 2HG1 ILE 96 0.095 -5.676 4.196 757 HG21 ILE 96 1HG2 ILE 96 0.364 -8.555 3.674 758 HG22 ILE 96 2HG2 ILE 96 0.892 -8.070 2.084 759 HG23 ILE 96 3HG2 ILE 96 1.980 -9.013 3.087 760 HD11 ILE 96 3HD1 ILE 96 0.788 -3.694 2.877 761 HD12 ILE 96 1HD1 ILE 96 2.082 -4.113 4.012 762 HD13 ILE 96 2HD1 ILE 96 2.225 -4.561 2.301 763 HA PRO 97 HA PRO 97 5.538 -9.410 6.253 764 HB2 PRO 97 1HB PRO 97 5.243 -11.924 5.249 765 HB3 PRO 97 2HB PRO 97 4.649 -11.458 6.868 766 HG2 PRO 97 1HG PRO 97 3.081 -11.556 4.272 767 HG3 PRO 97 2HG PRO 97 2.636 -12.293 5.846 768 HD2 PRO 97 1HD PRO 97 1.678 -9.907 5.014 769 HD3 PRO 97 2HD PRO 97 2.065 -10.135 6.729 770 H MET 98 H MET 98 7.237 -9.966 4.620 771 HA MET 98 HA MET 98 6.530 -9.334 1.786 772 HB2 MET 98 1HB MET 98 9.209 -9.847 3.140 773 HB3 MET 98 2HB MET 98 8.978 -9.655 1.399 774 HG2 MET 98 1HG MET 98 7.935 -7.418 1.808 775 HG3 MET 98 2HG MET 98 8.312 -7.605 3.522 776 HE1 MET 98 3HE MET 98 11.151 -5.258 3.335 777 HE2 MET 98 1HE MET 98 9.403 -5.080 3.049 778 HE3 MET 98 2HE MET 98 9.989 -6.133 4.356 779 H ASP 99 H ASP 99 7.978 -11.981 3.797 780 HA ASP 99 HA ASP 99 8.568 -13.476 1.562 781 HB2 ASP 99 1HB ASP 99 9.493 -13.670 3.948 782 HB3 ASP 99 2HB ASP 99 8.144 -14.762 4.277 783 H ALA 100 H ALA 100 5.523 -13.417 3.230 784 HA ALA 100 HA ALA 100 4.473 -15.923 2.176 785 HB1 ALA 100 1HB ALA 100 2.466 -15.256 3.400 786 HB2 ALA 100 2HB ALA 100 3.869 -14.885 4.403 787 HB3 ALA 100 3HB ALA 100 3.029 -13.598 3.512 788 H LEU 101 H LEU 101 5.163 -13.309 0.363 789 HA LEU 101 HA LEU 101 2.494 -12.883 -0.845 790 HB2 LEU 101 1HB LEU 101 5.196 -11.574 -1.245 791 HB3 LEU 101 2HB LEU 101 3.767 -11.118 -2.148 792 HG LEU 101 HG LEU 101 3.915 -11.000 0.903 793 HD11 LEU 101 1HD1 LEU 101 5.529 -9.536 -0.293 794 HD12 LEU 101 2HD1 LEU 101 4.335 -8.653 0.658 795 HD13 LEU 101 3HD1 LEU 101 4.189 -8.748 -1.133 796 HD21 LEU 101 3HD2 LEU 101 1.596 -11.160 -0.005 797 HD22 LEU 101 1HD2 LEU 101 1.907 -9.755 -1.045 798 HD23 LEU 101 2HD2 LEU 101 1.918 -9.612 0.730 799 H GLN 102 H GLN 102 2.234 -12.805 -3.222 800 HA GLN 102 HA GLN 102 3.006 -15.370 -4.126 801 HB2 GLN 102 1HB GLN 102 0.787 -14.010 -4.489 802 HB3 GLN 102 2HB GLN 102 1.627 -13.304 -5.868 803 HG2 GLN 102 1HG GLN 102 2.011 -15.419 -6.850 804 HG3 GLN 102 2HG GLN 102 1.523 -16.310 -5.400 805 HE21 GLN 102 1HE2 GLN 102 -0.855 -16.166 -4.748 806 HE22 GLN 102 2HE2 GLN 102 -1.968 -16.275 -6.095 807 H ASP 103 H ASP 103 4.374 -12.275 -4.734 808 HA ASP 103 HA ASP 103 6.493 -13.540 -6.288 809 HB2 ASP 103 1HB ASP 103 4.747 -12.542 -7.927 810 HB3 ASP 103 2HB ASP 103 5.248 -10.969 -7.270 811 H ASN 104 H ASN 104 8.211 -11.534 -6.685 812 HA ASN 104 HA ASN 104 8.817 -10.177 -4.179 813 HB2 ASN 104 1HB ASN 104 10.037 -10.483 -6.952 814 HB3 ASN 104 2HB ASN 104 10.360 -9.004 -6.151 815 HD21 ASN 104 1HD2 ASN 104 12.076 -9.006 -5.089 816 HD22 ASN 104 2HD2 ASN 104 13.004 -10.362 -4.375 817 H SER 105 H SER 105 6.216 -9.569 -6.033 818 HA SER 105 HA SER 105 6.722 -6.652 -6.086 819 HB2 SER 105 1HB SER 105 5.221 -6.491 -8.010 820 HB3 SER 105 2HB SER 105 6.724 -7.343 -8.333 821 HG SER 105 HG SER 105 5.737 -9.015 -8.901 822 H ILE 106 H ILE 106 5.429 -5.422 -5.004 823 HA ILE 106 HA ILE 106 3.275 -6.710 -3.469 824 HB ILE 106 HB ILE 106 4.805 -5.007 -2.433 825 HG12 ILE 106 1HG1 ILE 106 2.406 -5.725 -1.744 826 HG13 ILE 106 2HG1 ILE 106 3.375 -4.571 -0.838 827 HG21 ILE 106 1HG2 ILE 106 4.399 -2.630 -2.656 828 HG22 ILE 106 2HG2 ILE 106 5.085 -3.367 -4.104 829 HG23 ILE 106 3HG2 ILE 106 3.362 -2.929 -4.063 830 HD11 ILE 106 3HD1 ILE 106 0.997 -3.958 -1.041 831 HD12 ILE 106 1HD1 ILE 106 2.105 -2.730 -1.693 832 HD13 ILE 106 2HD1 ILE 106 1.193 -3.784 -2.789 833 H GLN 107 H GLN 107 1.040 -6.032 -3.633 834 HA GLN 107 HA GLN 107 0.154 -3.995 -5.379 835 HB2 GLN 107 1HB GLN 107 0.494 -5.751 -7.122 836 HB3 GLN 107 2HB GLN 107 -0.361 -6.929 -6.128 837 HG2 GLN 107 1HG GLN 107 -2.465 -5.760 -6.472 838 HG3 GLN 107 2HG GLN 107 -1.631 -4.433 -7.290 839 HE21 GLN 107 1HE2 GLN 107 -2.697 -4.627 -9.262 840 HE22 GLN 107 2HE2 GLN 107 -2.554 -5.991 -10.317 841 H ILE 108 H ILE 108 -2.113 -3.629 -4.885 842 HA ILE 108 HA ILE 108 -3.366 -5.368 -2.840 843 HB ILE 108 HB ILE 108 -3.290 -2.316 -2.824 844 HG12 ILE 108 1HG1 ILE 108 -2.299 -4.213 -0.651 845 HG13 ILE 108 2HG1 ILE 108 -1.245 -3.518 -1.865 846 HG21 ILE 108 1HG2 ILE 108 -5.510 -3.004 -2.126 847 HG22 ILE 108 2HG2 ILE 108 -4.848 -4.316 -1.116 848 HG23 ILE 108 3HG2 ILE 108 -4.646 -2.639 -0.648 849 HD11 ILE 108 3HD1 ILE 108 -1.762 -1.240 -1.120 850 HD12 ILE 108 1HD1 ILE 108 -2.771 -1.882 0.184 851 HD13 ILE 108 2HD1 ILE 108 -1.047 -2.238 0.154 852 H LYS 109 H LYS 109 -5.802 -5.155 -3.051 853 HA LYS 109 HA LYS 109 -6.755 -3.804 -5.446 854 HB2 LYS 109 1HB LYS 109 -7.845 -5.891 -6.317 855 HB3 LYS 109 2HB LYS 109 -6.109 -5.878 -6.438 856 HG2 LYS 109 1HG LYS 109 -6.575 -7.169 -3.962 857 HG3 LYS 109 2HG LYS 109 -7.888 -7.706 -4.976 858 HD2 LYS 109 1HD LYS 109 -6.039 -9.239 -5.112 859 HD3 LYS 109 2HD LYS 109 -6.250 -8.485 -6.686 860 HE2 LYS 109 1HE LYS 109 -4.279 -7.025 -6.304 861 HE3 LYS 109 2HE LYS 109 -4.210 -7.580 -4.605 862 HZ1 LYS 109 3HZ LYS 109 -3.915 -9.875 -5.644 863 HZ2 LYS 109 1HZ LYS 109 -2.644 -8.858 -5.648 864 HZ3 LYS 109 2HZ LYS 109 -3.547 -9.084 -7.031 865 H ALA 110 H ALA 110 -9.206 -3.454 -5.291 866 HA ALA 110 HA ALA 110 -10.399 -4.579 -2.837 867 HB1 ALA 110 1HB ALA 110 -10.107 -1.579 -3.268 868 HB2 ALA 110 2HB ALA 110 -11.087 -2.345 -2.000 869 HB3 ALA 110 3HB ALA 110 -9.320 -2.506 -1.978 870 H LEU 111 H LEU 111 -12.633 -4.400 -2.782 871 HA LEU 111 HA LEU 111 -13.994 -4.262 -5.349 872 HB2 LEU 111 1HB LEU 111 -14.665 -5.516 -3.135 873 HB3 LEU 111 2HB LEU 111 -15.276 -3.948 -2.645 874 HG LEU 111 HG LEU 111 -17.075 -5.163 -3.401 875 HD11 LEU 111 1HD1 LEU 111 -16.737 -3.535 -5.851 876 HD12 LEU 111 2HD1 LEU 111 -17.184 -2.890 -4.229 877 HD13 LEU 111 3HD1 LEU 111 -18.196 -4.086 -5.031 878 HD21 LEU 111 3HD2 LEU 111 -17.330 -6.398 -5.394 879 HD22 LEU 111 1HD2 LEU 111 -15.861 -6.921 -4.616 880 HD23 LEU 111 2HD2 LEU 111 -15.758 -5.835 -6.029 881 H SER 112 H SER 112 -15.041 -2.519 -6.194 882 HA SER 112 HA SER 112 -14.527 0.092 -4.980 883 HB2 SER 112 1HB SER 112 -14.256 0.883 -6.984 884 HB3 SER 112 2HB SER 112 -13.979 -0.754 -7.465 885 HG SER 112 HG SER 112 -15.699 0.944 -8.430 886 H SER 113 H SER 113 -17.227 -1.374 -6.779 887 HA SER 113 HA SER 113 -19.139 -0.872 -4.681 888 HB2 SER 113 1HB SER 113 -18.705 1.381 -6.008 889 HB3 SER 113 2HB SER 113 -19.735 0.654 -7.225 890 HG SER 113 HG SER 113 -20.343 1.112 -4.458 891 H GLY 114 H GLY 114 -19.211 -1.109 -8.312 892 HA2 GLY 114 1HA GLY 114 -21.484 -2.893 -8.157 893 HA3 GLY 114 2HA GLY 114 -20.765 -2.166 -9.597 894 H THR 115 H THR 115 -19.306 -4.263 -7.183 895 HA THR 115 HA THR 115 -18.270 -6.282 -7.235 896 HB THR 115 HB THR 115 -18.703 -8.033 -8.686 897 HG1 THR 115 1HG THR 115 -19.676 -6.115 -10.498 898 HG21 THR 115 3HG2 THR 115 -21.097 -8.205 -8.824 899 HG22 THR 115 1HG2 THR 115 -21.309 -6.468 -8.573 900 HG23 THR 115 2HG2 THR 115 -20.632 -7.467 -7.265 901 H THR 116 H THR 116 -17.659 -3.868 -9.476 902 HA THR 116 HA THR 116 -15.293 -4.481 -10.776 903 HB THR 116 HB THR 116 -16.180 -2.060 -9.190 904 HG1 THR 116 1HG THR 116 -16.997 -2.950 -11.591 905 HG21 THR 116 3HG2 THR 116 -13.914 -2.193 -11.188 906 HG22 THR 116 1HG2 THR 116 -13.789 -1.810 -9.443 907 HG23 THR 116 2HG2 THR 116 -14.616 -0.693 -10.525 908 H PHE 117 H PHE 117 -13.301 -4.826 -10.092 909 HA PHE 117 HA PHE 117 -12.601 -4.358 -7.263 910 HB2 PHE 117 1HB PHE 117 -12.979 -6.782 -8.569 911 HB3 PHE 117 2HB PHE 117 -11.217 -6.558 -8.625 912 HD1 PHE 117 1HD PHE 117 -10.008 -6.110 -6.397 913 HD2 PHE 117 2HD PHE 117 -14.094 -7.388 -6.615 914 HE1 PHE 117 1HE PHE 117 -9.926 -6.780 -3.985 915 HE2 PHE 117 2HE PHE 117 -14.014 -8.090 -4.216 916 HZ PHE 117 HZ PHE 117 -11.965 -7.722 -2.902 917 H VAL 118 H VAL 118 -11.198 -2.715 -7.285 918 HA VAL 118 HA VAL 118 -9.642 -2.034 -9.704 919 HB VAL 118 HB VAL 118 -10.275 -0.192 -8.289 920 HG11 VAL 118 1HG1 VAL 118 -9.684 0.262 -6.113 921 HG12 VAL 118 2HG1 VAL 118 -10.857 -1.028 -6.361 922 HG13 VAL 118 3HG1 VAL 118 -9.156 -1.430 -5.902 923 HG21 VAL 118 3HG2 VAL 118 -7.354 -0.460 -7.920 924 HG22 VAL 118 1HG2 VAL 118 -8.134 -0.123 -9.472 925 HG23 VAL 118 2HG2 VAL 118 -8.359 1.027 -8.162 926 H TYR 119 H TYR 119 -7.692 -2.793 -10.068 927 HA TYR 119 HA TYR 119 -6.235 -4.125 -7.853 928 HB2 TYR 119 1HB TYR 119 -5.741 -4.460 -10.847 929 HB3 TYR 119 2HB TYR 119 -4.995 -5.363 -9.537 930 HD1 TYR 119 1HD TYR 119 -8.158 -4.812 -11.386 931 HD2 TYR 119 2HD TYR 119 -6.090 -7.351 -8.621 932 HE1 TYR 119 1HE TYR 119 -10.024 -6.391 -11.512 933 HE2 TYR 119 2HE TYR 119 -7.996 -8.943 -8.670 934 HH TYR 119 HH TYR 119 -10.989 -8.205 -10.524 935 H SER 120 H SER 120 -4.549 -2.958 -7.146 936 HA SER 120 HA SER 120 -4.034 -0.292 -8.138 937 HB2 SER 120 1HB SER 120 -2.629 -0.225 -6.321 938 HB3 SER 120 2HB SER 120 -3.704 -1.445 -5.810 939 HG SER 120 HG SER 120 -1.208 -2.115 -6.941 940 H GLN 121 H GLN 121 -1.443 0.047 -8.705 941 HA GLN 121 HA GLN 121 -0.766 -1.596 -11.012 942 HB2 GLN 121 1HB GLN 121 1.269 -0.375 -11.031 943 HB3 GLN 121 2HB GLN 121 -0.033 0.765 -10.740 944 HG2 GLN 121 1HG GLN 121 1.558 -0.344 -8.394 945 HG3 GLN 121 2HG GLN 121 2.242 0.858 -9.465 946 HE21 GLN 121 1HE2 GLN 121 2.225 2.727 -8.542 947 HE22 GLN 121 2HE2 GLN 121 0.967 3.498 -7.645 948 H LYS 122 H LYS 122 1.450 -2.816 -10.943 949 HA LYS 122 HA LYS 122 1.829 -4.185 -8.331 950 HB2 LYS 122 1HB LYS 122 0.999 -5.529 -10.271 951 HB3 LYS 122 2HB LYS 122 2.517 -5.198 -11.116 952 HG2 LYS 122 1HG LYS 122 3.782 -6.410 -9.532 953 HG3 LYS 122 2HG LYS 122 2.514 -6.340 -8.304 954 HD2 LYS 122 1HD LYS 122 2.386 -8.538 -9.014 955 HD3 LYS 122 2HD LYS 122 1.079 -7.727 -9.911 956 HE2 LYS 122 1HE LYS 122 2.677 -7.499 -11.863 957 HE3 LYS 122 2HE LYS 122 3.874 -8.406 -10.931 958 HZ1 LYS 122 3HZ LYS 122 2.230 -10.236 -10.840 959 HZ2 LYS 122 1HZ LYS 122 2.714 -9.891 -12.371 960 HZ3 LYS 122 2HZ LYS 122 1.246 -9.409 -11.814 961 H ILE 123 H ILE 123 3.876 -4.009 -7.397 962 HA ILE 123 HA ILE 123 5.925 -2.430 -8.836 963 HB ILE 123 HB ILE 123 4.958 -2.133 -5.960 964 HG12 ILE 123 1HG1 ILE 123 3.443 -0.941 -7.401 965 HG13 ILE 123 2HG1 ILE 123 4.399 0.173 -6.448 966 HG21 ILE 123 1HG2 ILE 123 6.572 -0.260 -5.728 967 HG22 ILE 123 2HG2 ILE 123 7.384 -1.813 -5.993 968 HG23 ILE 123 3HG2 ILE 123 7.223 -0.648 -7.320 969 HD11 ILE 123 3HD1 ILE 123 4.644 -0.475 -9.392 970 HD12 ILE 123 1HD1 ILE 123 4.212 1.062 -8.648 971 HD13 ILE 123 2HD1 ILE 123 5.870 0.490 -8.533 972 H ASP 124 H ASP 124 7.417 -3.861 -9.271 973 HA ASP 124 HA ASP 124 8.097 -6.111 -7.559 974 HB2 ASP 124 1HB ASP 124 8.821 -5.146 -10.187 975 HB3 ASP 124 2HB ASP 124 10.288 -5.378 -9.248 976 H PHE 125 H PHE 125 9.696 -6.340 -5.999 977 HA PHE 125 HA PHE 125 11.456 -4.073 -5.478 978 HB2 PHE 125 1HB PHE 125 10.904 -3.984 -3.153 979 HB3 PHE 125 2HB PHE 125 9.469 -3.580 -4.079 980 HD1 PHE 125 2HD PHE 125 11.029 -6.184 -1.910 981 HD2 PHE 125 1HD PHE 125 7.465 -4.879 -3.923 982 HE1 PHE 125 2HE PHE 125 9.691 -7.754 -0.550 983 HE2 PHE 125 1HE PHE 125 6.149 -6.517 -2.535 984 HZ PHE 125 HZ PHE 125 7.249 -7.831 -0.790 985 H GLU 126 H GLU 126 12.833 -4.838 -3.382 986 HA GLU 126 HA GLU 126 13.647 -7.657 -3.826 987 HB2 GLU 126 1HB GLU 126 15.272 -5.109 -3.767 988 HB3 GLU 126 2HB GLU 126 16.026 -6.672 -3.557 989 HG2 GLU 126 1HG GLU 126 15.331 -7.371 -5.777 990 HG3 GLU 126 2HG GLU 126 14.324 -5.965 -5.981 991 H ARG 127 H ARG 127 14.950 -8.372 -1.899 992 HA ARG 127 HA ARG 127 13.790 -7.229 0.624 993 HB2 ARG 127 1HB ARG 127 13.946 -10.169 -0.126 994 HB3 ARG 127 2HB ARG 127 13.594 -9.513 1.464 995 HG2 ARG 127 1HG ARG 127 11.419 -9.512 0.878 996 HG3 ARG 127 2HG ARG 127 11.808 -8.075 -0.071 997 HD2 ARG 127 1HD ARG 127 10.647 -9.590 -1.522 998 HD3 ARG 127 2HD ARG 127 12.356 -9.637 -1.992 999 HE ARG 127 HE ARG 127 12.468 -11.583 -0.334 1000 HH11 ARG 127 1HH1 ARG 127 9.367 -11.041 -2.046 1001 HH12 ARG 127 2HH1 ARG 127 9.287 -12.677 -2.627 1002 HH21 ARG 127 1HH2 ARG 127 11.801 -13.826 -0.460 1003 HH22 ARG 127 2HH2 ARG 127 10.397 -14.259 -1.384 1004 H GLU 128 H GLU 128 15.648 -6.129 0.824 1005 HA GLU 128 HA GLU 128 17.820 -5.577 1.107 1006 HB2 GLU 128 1HB GLU 128 19.164 -6.912 2.744 1007 HB3 GLU 128 2HB GLU 128 17.729 -6.040 3.231 1008 HG2 GLU 128 1HG GLU 128 16.415 -8.154 3.182 1009 HG3 GLU 128 2HG GLU 128 17.924 -8.973 2.772 Start of MODEL 5 1 H1 GLY 1 H GLY 1 -26.525 9.923 -1.391 2 HA2 GLY 1 1HA GLY 1 -26.850 10.339 -4.319 3 HA3 GLY 1 2HA GLY 1 -27.597 11.336 -3.072 4 H ALA 2 H ALA 2 -24.936 11.133 -5.134 5 HA ALA 2 HA ALA 2 -22.898 12.070 -5.274 6 HB1 ALA 2 1HB ALA 2 -22.879 14.460 -4.827 7 HB2 ALA 2 2HB ALA 2 -24.454 13.976 -5.475 8 HB3 ALA 2 3HB ALA 2 -24.262 14.300 -3.734 9 H GLU 3 H GLU 3 -23.437 10.710 -2.387 10 HA GLU 3 HA GLU 3 -21.030 11.746 -1.035 11 HB2 GLU 3 1HB GLU 3 -22.253 11.879 0.960 12 HB3 GLU 3 2HB GLU 3 -23.262 12.696 -0.239 13 HG2 GLU 3 1HG GLU 3 -24.309 10.208 -0.479 14 HG3 GLU 3 2HG GLU 3 -23.726 10.052 1.167 15 H ALA 4 H ALA 4 -20.100 10.165 0.443 16 HA ALA 4 HA ALA 4 -19.018 8.208 0.613 17 HB1 ALA 4 1HB ALA 4 -20.783 7.609 2.135 18 HB2 ALA 4 2HB ALA 4 -21.741 6.955 0.768 19 HB3 ALA 4 3HB ALA 4 -20.161 6.224 1.195 20 H LEU 5 H LEU 5 -19.145 9.181 -1.903 21 HA LEU 5 HA LEU 5 -19.943 7.428 -3.961 22 HB2 LEU 5 1HB LEU 5 -17.551 9.197 -3.769 23 HB3 LEU 5 2HB LEU 5 -18.056 8.528 -5.303 24 HG LEU 5 HG LEU 5 -19.846 10.177 -3.579 25 HD11 LEU 5 1HD1 LEU 5 -19.045 12.277 -4.642 26 HD12 LEU 5 2HD1 LEU 5 -17.612 11.344 -5.184 27 HD13 LEU 5 3HD1 LEU 5 -17.981 11.537 -3.448 28 HD21 LEU 5 3HD2 LEU 5 -19.440 10.134 -6.601 29 HD22 LEU 5 1HD2 LEU 5 -20.830 10.844 -5.743 30 HD23 LEU 5 2HD2 LEU 5 -20.591 9.083 -5.766 31 HA PRO 6 HA PRO 6 -17.333 4.046 -3.106 32 HB2 PRO 6 1HB PRO 6 -17.262 2.691 -5.437 33 HB3 PRO 6 2HB PRO 6 -18.812 2.970 -4.598 34 HG2 PRO 6 1HG PRO 6 -17.620 4.582 -6.890 35 HG3 PRO 6 2HG PRO 6 -19.250 3.885 -6.740 36 HD2 PRO 6 1HD PRO 6 -18.602 6.539 -6.019 37 HD3 PRO 6 2HD PRO 6 -19.958 5.615 -5.281 38 H LEU 7 H LEU 7 -15.347 3.197 -3.563 39 HA LEU 7 HA LEU 7 -13.208 4.851 -3.843 40 HB2 LEU 7 1HB LEU 7 -13.246 2.784 -2.768 41 HB3 LEU 7 2HB LEU 7 -13.561 1.895 -4.282 42 HG LEU 7 HG LEU 7 -11.410 2.668 -5.093 43 HD11 LEU 7 1HD1 LEU 7 -10.045 3.100 -2.638 44 HD12 LEU 7 2HD1 LEU 7 -11.415 4.180 -2.600 45 HD13 LEU 7 3HD1 LEU 7 -10.272 4.259 -3.959 46 HD21 LEU 7 3HD2 LEU 7 -11.806 0.391 -4.180 47 HD22 LEU 7 1HD2 LEU 7 -11.168 0.957 -2.622 48 HD23 LEU 7 2HD2 LEU 7 -10.129 0.925 -4.052 49 H TYR 8 H TYR 8 -12.262 5.928 -5.433 50 HA TYR 8 HA TYR 8 -12.509 5.008 -8.245 51 HB2 TYR 8 1HB TYR 8 -12.706 7.394 -8.844 52 HB3 TYR 8 2HB TYR 8 -14.037 6.693 -7.972 53 HD1 TYR 8 1HD TYR 8 -10.989 8.807 -7.466 54 HD2 TYR 8 2HD TYR 8 -14.987 7.862 -6.148 55 HE1 TYR 8 1HE TYR 8 -10.962 10.770 -5.922 56 HE2 TYR 8 2HE TYR 8 -14.969 9.740 -4.612 57 HH TYR 8 HH TYR 8 -12.133 11.925 -4.265 58 H TYR 9 H TYR 9 -10.055 5.032 -6.086 59 HA TYR 9 HA TYR 9 -8.071 5.293 -8.180 60 HB2 TYR 9 1HB TYR 9 -8.366 7.674 -7.543 61 HB3 TYR 9 2HB TYR 9 -8.120 7.191 -5.868 62 HD1 TYR 9 1HD TYR 9 -6.485 7.637 -9.140 63 HD2 TYR 9 2HD TYR 9 -5.865 6.838 -4.953 64 HE1 TYR 9 1HE TYR 9 -4.135 8.256 -9.398 65 HE2 TYR 9 2HE TYR 9 -3.484 7.516 -5.176 66 HH TYR 9 HH TYR 9 -2.130 8.604 -8.320 67 H LEU 10 H LEU 10 -6.564 3.707 -7.728 68 HA LEU 10 HA LEU 10 -5.910 3.005 -4.911 69 HB2 LEU 10 1HB LEU 10 -7.497 1.307 -6.108 70 HB3 LEU 10 2HB LEU 10 -6.191 0.933 -7.132 71 HG LEU 10 HG LEU 10 -5.356 -0.436 -5.622 72 HD11 LEU 10 1HD1 LEU 10 -4.644 1.224 -3.857 73 HD12 LEU 10 2HD1 LEU 10 -5.126 -0.394 -3.296 74 HD13 LEU 10 3HD1 LEU 10 -6.249 0.928 -3.120 75 HD21 LEU 10 3HD2 LEU 10 -6.785 -1.629 -4.306 76 HD22 LEU 10 1HD2 LEU 10 -7.477 -1.201 -5.881 77 HD23 LEU 10 2HD2 LEU 10 -8.023 -0.343 -4.405 78 H GLN 11 H GLN 11 -3.867 3.832 -4.774 79 HA GLN 11 HA GLN 11 -1.876 2.670 -6.629 80 HB2 GLN 11 1HB GLN 11 -2.295 5.558 -6.132 81 HB3 GLN 11 2HB GLN 11 -0.754 5.007 -5.520 82 HG2 GLN 11 1HG GLN 11 -0.077 5.588 -7.535 83 HG3 GLN 11 2HG GLN 11 -0.434 3.899 -7.855 84 HE21 GLN 11 1HE2 GLN 11 -3.122 3.767 -8.422 85 HE22 GLN 11 2HE2 GLN 11 -3.532 4.856 -9.712 86 H ILE 12 H ILE 12 -0.007 2.001 -5.494 87 HA ILE 12 HA ILE 12 -0.315 1.487 -2.677 88 HB ILE 12 HB ILE 12 2.072 1.221 -4.524 89 HG12 ILE 12 1HG1 ILE 12 1.229 -1.258 -3.426 90 HG13 ILE 12 2HG1 ILE 12 -0.281 -0.444 -3.799 91 HG21 ILE 12 1HG2 ILE 12 3.045 -0.159 -2.589 92 HG22 ILE 12 2HG2 ILE 12 3.032 1.591 -2.333 93 HG23 ILE 12 3HG2 ILE 12 1.786 0.604 -1.596 94 HD11 ILE 12 3HD1 ILE 12 1.978 -0.703 -5.780 95 HD12 ILE 12 1HD1 ILE 12 0.671 -1.878 -5.600 96 HD13 ILE 12 2HD1 ILE 12 0.288 -0.200 -6.062 97 H THR 13 H THR 13 1.005 4.177 -4.486 98 HA THR 13 HA THR 13 1.526 6.253 -3.990 99 HB THR 13 HB THR 13 -0.125 5.754 -1.501 100 HG1 THR 13 1HG THR 13 -0.728 6.789 -4.072 101 HG21 THR 13 3HG2 THR 13 1.054 7.882 -1.242 102 HG22 THR 13 1HG2 THR 13 -0.630 8.185 -1.665 103 HG23 THR 13 2HG2 THR 13 0.634 8.361 -2.899 104 H GLY 14 H GLY 14 2.145 4.583 -0.810 105 HA2 GLY 14 1HA GLY 14 4.968 5.291 -1.179 106 HA3 GLY 14 2HA GLY 14 4.232 5.880 0.310 107 H ILE 15 H ILE 15 6.330 4.099 0.271 108 HA ILE 15 HA ILE 15 5.193 1.659 1.492 109 HB ILE 15 HB ILE 15 5.377 1.289 -0.969 110 HG12 ILE 15 1HG1 ILE 15 7.195 -0.492 0.682 111 HG13 ILE 15 2HG1 ILE 15 5.436 -0.556 0.607 112 HG21 ILE 15 1HG2 ILE 15 7.497 2.722 -1.281 113 HG22 ILE 15 2HG2 ILE 15 8.403 1.340 -0.651 114 HG23 ILE 15 3HG2 ILE 15 7.465 1.176 -2.145 115 HD11 ILE 15 3HD1 ILE 15 5.628 -0.911 -1.895 116 HD12 ILE 15 1HD1 ILE 15 7.366 -1.130 -1.660 117 HD13 ILE 15 2HD1 ILE 15 6.236 -2.238 -0.895 118 H THR 16 H THR 16 6.745 0.617 2.898 119 HA THR 16 HA THR 16 9.481 1.318 2.756 120 HB THR 16 HB THR 16 8.600 3.417 3.852 121 HG1 THR 16 1HG THR 16 10.574 3.153 4.178 122 HG21 THR 16 3HG2 THR 16 7.866 3.420 6.117 123 HG22 THR 16 1HG2 THR 16 8.142 1.674 6.308 124 HG23 THR 16 2HG2 THR 16 6.831 2.273 5.264 125 H SER 17 H SER 17 10.383 0.492 5.241 126 HA SER 17 HA SER 17 8.937 -1.837 6.111 127 HB2 SER 17 1HB SER 17 10.235 -2.745 4.156 128 HB3 SER 17 2HB SER 17 11.696 -2.099 4.867 129 HG SER 17 HG SER 17 11.901 -3.951 5.619 130 H ASP 18 H ASP 18 10.041 -2.782 7.914 131 HA ASP 18 HA ASP 18 10.617 -0.842 9.938 132 HB2 ASP 18 1HB ASP 18 9.683 -3.070 10.414 133 HB3 ASP 18 2HB ASP 18 11.183 -3.827 9.930 134 H GLY 19 H GLY 19 12.807 -2.912 8.006 135 HA2 GLY 19 1HA GLY 19 15.235 -1.929 9.255 136 HA3 GLY 19 2HA GLY 19 15.096 -2.973 7.842 137 H ASN 20 H ASN 20 13.209 -0.084 7.371 138 HA ASN 20 HA ASN 20 15.466 1.072 5.796 139 HB2 ASN 20 1HB ASN 20 12.759 0.257 4.907 140 HB3 ASN 20 2HB ASN 20 13.150 1.911 4.442 141 HD21 ASN 20 1HD2 ASN 20 13.856 1.678 2.139 142 HD22 ASN 20 2HD2 ASN 20 15.057 0.497 1.739 143 H ASP 21 H ASP 21 14.547 1.785 8.554 144 HA ASP 21 HA ASP 21 14.236 3.653 9.814 145 HB2 ASP 21 1HB ASP 21 16.278 4.304 8.581 146 HB3 ASP 21 2HB ASP 21 15.285 5.151 7.390 147 H PHE 22 H PHE 22 12.075 2.622 8.149 148 HA PHE 22 HA PHE 22 9.959 2.973 7.543 149 HB2 PHE 22 1HB PHE 22 10.199 5.032 9.750 150 HB3 PHE 22 2HB PHE 22 8.697 4.696 8.924 151 HD1 PHE 22 2HD PHE 22 11.301 2.185 10.186 152 HD2 PHE 22 1HD PHE 22 7.316 3.812 10.556 153 HE1 PHE 22 2HE PHE 22 10.717 0.420 11.801 154 HE2 PHE 22 1HE PHE 22 6.779 2.065 12.210 155 HZ PHE 22 HZ PHE 22 8.446 0.287 12.748 156 H ALA 23 H ALA 23 12.107 4.462 6.078 157 HA ALA 23 HA ALA 23 11.249 6.929 5.106 158 HB1 ALA 23 1HB ALA 23 12.960 4.811 3.780 159 HB2 ALA 23 2HB ALA 23 12.865 6.521 3.312 160 HB3 ALA 23 3HB ALA 23 13.522 6.077 4.895 161 H TRP 24 H TRP 24 9.105 7.067 4.484 162 HA TRP 24 HA TRP 24 7.625 5.085 3.174 163 HB2 TRP 24 1HB TRP 24 7.209 8.016 3.788 164 HB3 TRP 24 2HB TRP 24 6.023 7.167 2.818 165 HD1 TRP 24 HD TRP 24 6.726 7.884 6.294 166 HE1 TRP 24 1HE TRP 24 5.373 6.397 7.845 167 HE3 TRP 24 3HE TRP 24 5.378 4.342 2.904 168 HZ2 TRP 24 2HZ TRP 24 3.831 3.925 7.599 169 HZ3 TRP 24 3HZ TRP 24 4.056 2.359 3.582 170 HH2 TRP 24 HH TRP 24 3.263 2.140 5.933 171 H ASP 25 H ASP 25 9.655 7.145 1.699 172 HA ASP 25 HA ASP 25 9.941 8.062 -0.486 173 HB2 ASP 25 1HB ASP 25 10.142 5.124 -0.288 174 HB3 ASP 25 2HB ASP 25 10.261 5.868 -1.887 175 H ASN 26 H ASN 26 8.492 9.270 -1.515 176 HA ASN 26 HA ASN 26 5.840 8.374 -2.102 177 HB2 ASN 26 1HB ASN 26 7.402 10.818 -3.085 178 HB3 ASN 26 2HB ASN 26 5.679 10.569 -3.339 179 HD21 ASN 26 1HD2 ASN 26 4.270 11.260 -1.713 180 HD22 ASN 26 2HD2 ASN 26 4.851 11.955 -0.205 181 H LEU 27 H LEU 27 5.484 6.846 -3.578 182 HA LEU 27 HA LEU 27 7.225 6.270 -5.751 183 HB2 LEU 27 1HB LEU 27 4.344 5.393 -5.321 184 HB3 LEU 27 2HB LEU 27 5.529 4.601 -6.369 185 HG LEU 27 HG LEU 27 5.727 4.827 -3.331 186 HD11 LEU 27 1HD1 LEU 27 3.929 3.343 -3.932 187 HD12 LEU 27 2HD1 LEU 27 5.295 2.392 -3.343 188 HD13 LEU 27 3HD1 LEU 27 4.979 2.467 -5.093 189 HD21 LEU 27 3HD2 LEU 27 7.475 3.271 -5.283 190 HD22 LEU 27 1HD2 LEU 27 7.553 3.234 -3.505 191 HD23 LEU 27 2HD2 LEU 27 7.955 4.718 -4.334 192 H THR 28 H THR 28 7.148 6.699 -7.936 193 HA THR 28 HA THR 28 5.805 9.012 -8.855 194 HB THR 28 HB THR 28 6.651 7.699 -11.069 195 HG1 THR 28 1HG THR 28 8.204 6.433 -10.829 196 HG21 THR 28 3HG2 THR 28 8.776 8.958 -10.885 197 HG22 THR 28 1HG2 THR 28 8.573 9.075 -9.127 198 HG23 THR 28 2HG2 THR 28 7.467 9.951 -10.221 199 H SER 29 H SER 29 4.300 9.165 -10.643 200 HA SER 29 HA SER 29 2.053 7.566 -10.197 201 HB2 SER 29 1HB SER 29 2.559 9.345 -12.591 202 HB3 SER 29 2HB SER 29 1.003 8.954 -11.841 203 HG SER 29 HG SER 29 2.261 11.016 -11.282 204 H SER 30 H SER 30 4.623 7.057 -12.612 205 HA SER 30 HA SER 30 3.144 4.635 -13.507 206 HB2 SER 30 1HB SER 30 4.370 4.811 -15.604 207 HB3 SER 30 2HB SER 30 3.301 6.183 -15.304 208 HG SER 30 HG SER 30 6.078 6.031 -15.348 209 H GLN 31 H GLN 31 4.896 4.996 -11.108 210 HA GLN 31 HA GLN 31 7.392 3.668 -11.402 211 HB2 GLN 31 1HB GLN 31 6.307 4.782 -9.306 212 HB3 GLN 31 2HB GLN 31 5.430 3.282 -9.122 213 HG2 GLN 31 1HG GLN 31 7.157 2.999 -7.703 214 HG3 GLN 31 2HG GLN 31 7.721 2.179 -9.148 215 HE21 GLN 31 1HE2 GLN 31 8.352 4.697 -6.876 216 HE22 GLN 31 2HE2 GLN 31 9.977 4.787 -7.476 217 H THR 32 H THR 32 7.869 1.447 -11.753 218 HA THR 32 HA THR 32 5.712 -0.478 -11.085 219 HB THR 32 HB THR 32 6.157 -1.936 -12.835 220 HG1 THR 32 1HG THR 32 8.196 -0.139 -13.663 221 HG21 THR 32 3HG2 THR 32 5.265 -0.723 -14.710 222 HG22 THR 32 1HG2 THR 32 5.835 0.827 -14.055 223 HG23 THR 32 2HG2 THR 32 4.556 -0.087 -13.223 224 H LYS 33 H LYS 33 8.641 0.678 -10.110 225 HA LYS 33 HA LYS 33 9.169 -1.847 -8.684 226 HB2 LYS 33 1HB LYS 33 11.164 -0.505 -10.519 227 HB3 LYS 33 2HB LYS 33 11.740 -1.079 -8.967 228 HG2 LYS 33 1HG LYS 33 12.068 -3.017 -10.045 229 HG3 LYS 33 2HG LYS 33 10.367 -3.253 -9.619 230 HD2 LYS 33 1HD LYS 33 9.728 -2.382 -11.885 231 HD3 LYS 33 2HD LYS 33 11.460 -2.249 -12.283 232 HE2 LYS 33 1HE LYS 33 11.788 -4.624 -11.910 233 HE3 LYS 33 2HE LYS 33 10.137 -4.824 -11.324 234 HZ1 LYS 33 3HZ LYS 33 10.320 -5.517 -13.579 235 HZ2 LYS 33 1HZ LYS 33 10.854 -4.035 -14.055 236 HZ3 LYS 33 2HZ LYS 33 9.313 -4.230 -13.460 237 H ALA 34 H ALA 34 10.228 -1.700 -6.793 238 HA ALA 34 HA ALA 34 9.512 0.389 -5.126 239 HB1 ALA 34 1HB ALA 34 11.002 -0.769 -3.479 240 HB2 ALA 34 2HB ALA 34 9.984 -1.901 -4.380 241 HB3 ALA 34 3HB ALA 34 11.711 -1.699 -4.792 242 HA PRO 35 HA PRO 35 12.637 3.411 -5.591 243 HB2 PRO 35 1HB PRO 35 12.769 4.517 -3.135 244 HB3 PRO 35 2HB PRO 35 11.378 4.778 -4.240 245 HG2 PRO 35 1HG PRO 35 11.659 2.739 -1.959 246 HG3 PRO 35 2HG PRO 35 10.290 3.784 -2.336 247 HD2 PRO 35 1HD PRO 35 10.192 1.308 -3.144 248 HD3 PRO 35 2HD PRO 35 9.637 2.615 -4.238 249 H ASN 36 H ASN 36 13.112 0.971 -3.042 250 HA ASN 36 HA ASN 36 15.966 0.897 -3.476 251 HB2 ASN 36 1HB ASN 36 14.778 1.458 -0.667 252 HB3 ASN 36 2HB ASN 36 16.474 1.161 -1.053 253 HD21 ASN 36 1HD2 ASN 36 14.095 3.523 -0.603 254 HD22 ASN 36 2HD2 ASN 36 14.889 4.910 -1.281 255 H VAL 37 H VAL 37 16.835 -0.950 -2.191 256 HA VAL 37 HA VAL 37 15.154 -3.275 -1.897 257 HB VAL 37 HB VAL 37 17.854 -2.587 -0.757 258 HG11 VAL 37 1HG1 VAL 37 16.768 -4.545 0.327 259 HG12 VAL 37 2HG1 VAL 37 16.434 -5.328 -1.240 260 HG13 VAL 37 3HG1 VAL 37 18.074 -5.163 -0.704 261 HG21 VAL 37 3HG2 VAL 37 17.313 -4.366 -3.229 262 HG22 VAL 37 1HG2 VAL 37 17.754 -2.649 -3.417 263 HG23 VAL 37 2HG2 VAL 37 18.852 -3.798 -2.650 264 H LEU 38 H LEU 38 13.441 -3.112 -0.370 265 HA LEU 38 HA LEU 38 13.900 -1.539 2.083 266 HB2 LEU 38 1HB LEU 38 11.596 -3.377 2.009 267 HB3 LEU 38 2HB LEU 38 11.727 -1.825 2.698 268 HG LEU 38 HG LEU 38 11.556 -2.206 -0.314 269 HD11 LEU 38 3HD2 LEU 38 9.548 -3.080 0.804 270 HD12 LEU 38 1HD2 LEU 38 9.224 -1.601 -0.092 271 HD13 LEU 38 2HD2 LEU 38 9.364 -1.553 1.688 272 HD21 LEU 38 1HD1 LEU 38 11.164 0.203 1.524 273 HD22 LEU 38 2HD1 LEU 38 10.934 0.198 -0.233 274 HD23 LEU 38 3HD1 LEU 38 12.526 -0.061 0.430 275 H LYS 39 H LYS 39 15.317 -2.336 3.484 276 HA LYS 39 HA LYS 39 16.012 -5.173 3.808 277 HB2 LYS 39 1HB LYS 39 16.638 -2.574 5.256 278 HB3 LYS 39 2HB LYS 39 17.090 -4.106 5.951 279 HG2 LYS 39 1HG LYS 39 18.864 -4.322 4.662 280 HG3 LYS 39 2HG LYS 39 17.955 -4.102 3.179 281 HD2 LYS 39 1HD LYS 39 18.823 -1.699 4.837 282 HD3 LYS 39 2HD LYS 39 19.932 -2.500 3.733 283 HE2 LYS 39 1HE LYS 39 17.478 -2.191 2.302 284 HE3 LYS 39 2HE LYS 39 17.767 -0.649 3.098 285 HZ1 LYS 39 3HZ LYS 39 19.938 -0.562 2.010 286 HZ2 LYS 39 1HZ LYS 39 18.798 -0.792 0.873 287 HZ3 LYS 39 2HZ LYS 39 19.704 -2.073 1.373 288 H GLY 40 H GLY 40 15.668 -6.265 5.995 289 HA2 GLY 40 1HA GLY 40 14.393 -6.734 7.916 290 HA3 GLY 40 2HA GLY 40 13.425 -5.280 7.661 291 H ASN 41 H ASN 41 11.763 -7.041 8.305 292 HA ASN 41 HA ASN 41 10.742 -8.585 5.956 293 HB2 ASN 41 1HB ASN 41 11.557 -9.948 7.827 294 HB3 ASN 41 2HB ASN 41 10.398 -9.141 8.903 295 HD21 ASN 41 1HD2 ASN 41 8.054 -9.639 8.627 296 HD22 ASN 41 2HD2 ASN 41 7.610 -11.079 7.754 297 H LYS 42 H LYS 42 9.737 -6.168 8.361 298 HA LYS 42 HA LYS 42 6.864 -6.709 7.974 299 HB2 LYS 42 1HB LYS 42 8.416 -4.520 9.372 300 HB3 LYS 42 2HB LYS 42 6.679 -4.532 9.246 301 HG2 LYS 42 1HG LYS 42 8.201 -6.784 10.617 302 HG3 LYS 42 2HG LYS 42 7.648 -5.326 11.444 303 HD2 LYS 42 1HD LYS 42 5.313 -5.895 10.385 304 HD3 LYS 42 2HD LYS 42 5.967 -7.530 10.227 305 HE2 LYS 42 1HE LYS 42 5.978 -5.926 12.826 306 HE3 LYS 42 2HE LYS 42 4.610 -6.929 12.336 307 HZ1 LYS 42 3HZ LYS 42 5.908 -8.854 12.443 308 HZ2 LYS 42 1HZ LYS 42 6.125 -8.039 13.822 309 HZ3 LYS 42 2HZ LYS 42 7.342 -8.015 12.699 310 H LEU 43 H LEU 43 6.005 -6.129 6.032 311 HA LEU 43 HA LEU 43 7.331 -4.013 4.454 312 HB2 LEU 43 1HB LEU 43 6.503 -6.512 3.698 313 HB3 LEU 43 2HB LEU 43 5.100 -5.581 3.230 314 HG LEU 43 HG LEU 43 7.975 -4.938 2.452 315 HD11 LEU 43 1HD1 LEU 43 5.907 -6.089 0.562 316 HD12 LEU 43 2HD1 LEU 43 7.091 -7.081 1.439 317 HD13 LEU 43 3HD1 LEU 43 7.632 -5.837 0.314 318 HD21 LEU 43 3HD2 LEU 43 5.385 -3.797 1.348 319 HD22 LEU 43 1HD2 LEU 43 7.038 -3.434 0.803 320 HD23 LEU 43 2HD2 LEU 43 6.530 -2.932 2.412 321 H TYR 44 H TYR 44 6.584 -2.063 5.161 322 HA TYR 44 HA TYR 44 3.750 -1.822 5.983 323 HB2 TYR 44 1HB TYR 44 5.988 0.203 6.181 324 HB3 TYR 44 2HB TYR 44 4.379 0.339 6.864 325 HD1 TYR 44 1HD TYR 44 3.811 -2.148 8.305 326 HD2 TYR 44 2HD TYR 44 7.582 -0.048 7.834 327 HE1 TYR 44 1HE TYR 44 4.654 -3.169 10.361 328 HE2 TYR 44 2HE TYR 44 8.363 -0.999 9.952 329 HH TYR 44 HH TYR 44 6.347 -2.920 12.141 330 H VAL 45 H VAL 45 2.315 -0.997 4.631 331 HA VAL 45 HA VAL 45 3.253 0.498 2.211 332 HB VAL 45 HB VAL 45 0.920 -1.448 2.254 333 HG11 VAL 45 1HG1 VAL 45 2.698 -0.266 0.139 334 HG12 VAL 45 2HG1 VAL 45 1.392 -1.434 -0.150 335 HG13 VAL 45 3HG1 VAL 45 0.997 0.176 0.472 336 HG21 VAL 45 3HG2 VAL 45 2.458 -3.088 1.127 337 HG22 VAL 45 1HG2 VAL 45 3.833 -2.033 1.514 338 HG23 VAL 45 2HG2 VAL 45 2.925 -2.832 2.804 339 H LYS 46 H LYS 46 1.989 2.242 1.578 340 HA LYS 46 HA LYS 46 -0.189 3.135 3.398 341 HB2 LYS 46 1HB LYS 46 1.891 4.237 4.005 342 HB3 LYS 46 2HB LYS 46 2.209 4.652 2.317 343 HG2 LYS 46 1HG LYS 46 -0.392 5.709 2.962 344 HG3 LYS 46 2HG LYS 46 0.629 6.053 4.328 345 HD2 LYS 46 1HD LYS 46 1.354 6.748 1.457 346 HD3 LYS 46 2HD LYS 46 0.554 7.813 2.608 347 HE2 LYS 46 1HE LYS 46 2.519 7.319 4.213 348 HE3 LYS 46 2HE LYS 46 3.363 6.657 2.790 349 HZ1 LYS 46 3HZ LYS 46 3.104 8.793 1.729 350 HZ2 LYS 46 1HZ LYS 46 3.855 9.005 3.140 351 HZ3 LYS 46 2HZ LYS 46 2.248 9.380 3.044 352 H ALA 47 H ALA 47 -1.282 1.936 1.545 353 HA ALA 47 HA ALA 47 -1.296 3.167 -1.083 354 HB1 ALA 47 1HB ALA 47 -1.712 0.843 -0.872 355 HB2 ALA 47 2HB ALA 47 -3.079 1.089 0.232 356 HB3 ALA 47 3HB ALA 47 -3.202 1.595 -1.472 357 H ARG 48 H ARG 48 -2.534 4.739 -1.873 358 HA ARG 48 HA ARG 48 -4.390 6.169 -0.101 359 HB2 ARG 48 1HB ARG 48 -2.832 7.320 -1.562 360 HB3 ARG 48 2HB ARG 48 -3.554 6.564 -2.999 361 HG2 ARG 48 1HG ARG 48 -4.559 8.637 -3.092 362 HG3 ARG 48 2HG ARG 48 -5.761 7.783 -2.133 363 HD2 ARG 48 1HD ARG 48 -5.426 9.786 -0.939 364 HD3 ARG 48 2HD ARG 48 -4.434 8.622 -0.058 365 HE ARG 48 HE ARG 48 -2.528 9.732 -0.716 366 HH11 ARG 48 1HH1 ARG 48 -5.297 11.216 -2.461 367 HH12 ARG 48 2HH1 ARG 48 -4.326 12.523 -3.048 368 HH21 ARG 48 1HH2 ARG 48 -1.322 11.423 -1.631 369 HH22 ARG 48 2HH2 ARG 48 -2.041 12.516 -2.791 370 H PHE 49 H PHE 49 -6.565 6.057 -0.273 371 HA PHE 49 HA PHE 49 -7.902 4.485 -2.421 372 HB2 PHE 49 1HB PHE 49 -8.535 4.270 0.544 373 HB3 PHE 49 2HB PHE 49 -9.491 3.610 -0.681 374 HD1 PHE 49 2HD PHE 49 -6.145 3.330 0.942 375 HD2 PHE 49 1HD PHE 49 -8.893 1.353 -1.768 376 HE1 PHE 49 2HE PHE 49 -5.016 1.185 1.304 377 HE2 PHE 49 1HE PHE 49 -7.997 -0.754 -1.146 378 HZ PHE 49 HZ PHE 49 -5.954 -0.909 0.336 379 H MET 50 H MET 50 -8.798 6.245 -3.451 380 HA MET 50 HA MET 50 -9.904 8.461 -1.842 381 HB2 MET 50 1HB MET 50 -9.856 8.271 -4.862 382 HB3 MET 50 2HB MET 50 -10.051 9.717 -3.875 383 HG2 MET 50 1HG MET 50 -7.523 8.176 -3.575 384 HG3 MET 50 2HG MET 50 -7.758 8.997 -5.102 385 HE1 MET 50 3HE MET 50 -8.123 9.617 -1.313 386 HE2 MET 50 1HE MET 50 -7.548 11.283 -1.117 387 HE3 MET 50 2HE MET 50 -9.116 10.963 -1.905 388 H GLY 51 H GLY 51 -12.084 8.622 -1.562 389 HA2 GLY 51 1HA GLY 51 -14.453 8.078 -2.355 390 HA3 GLY 51 2HA GLY 51 -13.826 6.484 -2.767 391 H TYR 52 H TYR 52 -15.900 6.075 -1.329 392 HA TYR 52 HA TYR 52 -14.932 5.362 1.327 393 HB2 TYR 52 1HB TYR 52 -17.173 6.480 0.541 394 HB3 TYR 52 2HB TYR 52 -17.650 4.876 0.174 395 HD1 TYR 52 2HD TYR 52 -16.880 3.109 2.302 396 HD2 TYR 52 1HD TYR 52 -18.046 7.269 2.523 397 HE1 TYR 52 2HE TYR 52 -17.512 2.812 4.641 398 HE2 TYR 52 1HE TYR 52 -18.778 6.960 4.817 399 HH TYR 52 HH TYR 52 -19.278 5.129 6.515 400 H THR 53 H THR 53 -13.364 3.610 0.675 401 HA THR 53 HA THR 53 -14.965 1.151 0.667 402 HB THR 53 HB THR 53 -12.653 1.666 -1.165 403 HG1 THR 53 1HG THR 53 -14.580 0.052 -2.121 404 HG21 THR 53 3HG2 THR 53 -11.820 -0.345 -0.278 405 HG22 THR 53 1HG2 THR 53 -12.637 -0.764 -1.757 406 HG23 THR 53 2HG2 THR 53 -13.450 -1.091 -0.216 407 H LYS 54 H LYS 54 -14.459 -0.034 2.296 408 HA LYS 54 HA LYS 54 -11.813 0.262 3.669 409 HB2 LYS 54 1HB LYS 54 -14.550 -0.328 4.878 410 HB3 LYS 54 2HB LYS 54 -13.009 -0.540 5.702 411 HG2 LYS 54 1HG LYS 54 -13.724 1.489 6.516 412 HG3 LYS 54 2HG LYS 54 -12.579 1.970 5.280 413 HD2 LYS 54 1HD LYS 54 -14.275 2.680 3.790 414 HD3 LYS 54 2HD LYS 54 -15.548 1.886 4.721 415 HE2 LYS 54 1HE LYS 54 -13.803 4.047 5.971 416 HE3 LYS 54 2HE LYS 54 -15.142 4.511 4.918 417 HZ1 LYS 54 3HZ LYS 54 -15.680 2.682 7.149 418 HZ2 LYS 54 1HZ LYS 54 -16.685 3.738 6.418 419 HZ3 LYS 54 2HZ LYS 54 -15.540 4.320 7.425 420 H LEU 55 H LEU 55 -14.007 -1.829 1.953 421 HA LEU 55 HA LEU 55 -12.922 -4.348 2.939 422 HB2 LEU 55 1HB LEU 55 -14.742 -3.564 0.631 423 HB3 LEU 55 2HB LEU 55 -14.236 -5.223 0.910 424 HG LEU 55 HG LEU 55 -15.631 -3.633 3.091 425 HD11 LEU 55 1HD1 LEU 55 -17.732 -4.791 2.368 426 HD12 LEU 55 2HD1 LEU 55 -16.891 -5.327 0.894 427 HD13 LEU 55 3HD1 LEU 55 -17.150 -3.606 1.193 428 HD21 LEU 55 3HD2 LEU 55 -15.346 -6.624 2.572 429 HD22 LEU 55 1HD2 LEU 55 -16.220 -5.880 3.923 430 HD23 LEU 55 2HD2 LEU 55 -14.468 -5.704 3.805 431 H THR 56 H THR 56 -10.651 -3.686 2.642 432 HA THR 56 HA THR 56 -9.551 -3.703 -0.054 433 HB THR 56 HB THR 56 -8.110 -4.305 2.549 434 HG1 THR 56 1HG THR 56 -9.257 -1.891 1.763 435 HG21 THR 56 3HG2 THR 56 -7.209 -2.968 -0.036 436 HG22 THR 56 1HG2 THR 56 -6.679 -4.543 0.588 437 HG23 THR 56 2HG2 THR 56 -6.234 -3.078 1.452 438 H VAL 57 H VAL 57 -8.107 -5.507 -0.847 439 HA VAL 57 HA VAL 57 -8.252 -8.108 0.460 440 HB VAL 57 HB VAL 57 -8.929 -7.560 -2.464 441 HG11 VAL 57 1HG1 VAL 57 -7.564 -9.566 -2.413 442 HG12 VAL 57 2HG1 VAL 57 -8.506 -10.247 -1.070 443 HG13 VAL 57 3HG1 VAL 57 -9.235 -10.009 -2.672 444 HG21 VAL 57 3HG2 VAL 57 -11.058 -8.820 -1.874 445 HG22 VAL 57 1HG2 VAL 57 -10.604 -8.647 -0.176 446 HG23 VAL 57 2HG2 VAL 57 -10.908 -7.209 -1.160 447 H ILE 58 H ILE 58 -6.293 -9.332 -0.105 448 HA ILE 58 HA ILE 58 -4.363 -8.174 -1.949 449 HB ILE 58 HB ILE 58 -3.555 -8.842 0.922 450 HG12 ILE 58 1HG1 ILE 58 -3.618 -6.094 -0.408 451 HG13 ILE 58 2HG1 ILE 58 -4.735 -6.645 0.846 452 HG21 ILE 58 1HG2 ILE 58 -1.308 -8.078 0.180 453 HG22 ILE 58 2HG2 ILE 58 -1.871 -9.398 -0.834 454 HG23 ILE 58 3HG2 ILE 58 -1.949 -7.728 -1.435 455 HD11 ILE 58 3HD1 ILE 58 -2.793 -6.949 2.398 456 HD12 ILE 58 1HD1 ILE 58 -1.785 -6.107 1.181 457 HD13 ILE 58 2HD1 ILE 58 -3.158 -5.274 1.926 458 H THR 59 H THR 59 -3.930 -9.986 -3.249 459 HA THR 59 HA THR 59 -5.205 -12.385 -2.748 460 HB THR 59 HB THR 59 -3.015 -12.446 -4.742 461 HG1 THR 59 1HG THR 59 -3.860 -10.839 -6.039 462 HG21 THR 59 3HG2 THR 59 -4.913 -12.868 -6.298 463 HG22 THR 59 1HG2 THR 59 -6.060 -12.532 -4.999 464 HG23 THR 59 2HG2 THR 59 -4.985 -13.930 -4.896 465 H GLY 60 H GLY 60 -1.682 -11.579 -2.654 466 HA2 GLY 60 1HA GLY 60 0.011 -12.451 -1.450 467 HA3 GLY 60 2HA GLY 60 -1.158 -13.449 -0.558 468 H LYS 61 H LYS 61 1.174 -14.661 -0.957 469 HA LYS 61 HA LYS 61 1.469 -16.296 -3.182 470 HB2 LYS 61 1HB LYS 61 2.751 -15.868 -0.839 471 HB3 LYS 61 2HB LYS 61 1.887 -17.328 -0.376 472 HG2 LYS 61 1HG LYS 61 2.901 -18.424 -2.398 473 HG3 LYS 61 2HG LYS 61 3.689 -16.870 -2.771 474 HD2 LYS 61 1HD LYS 61 4.059 -18.171 -0.059 475 HD3 LYS 61 2HD LYS 61 4.971 -18.765 -1.450 476 HE2 LYS 61 1HE LYS 61 5.955 -16.546 -1.845 477 HE3 LYS 61 2HE LYS 61 5.109 -15.880 -0.454 478 HZ1 LYS 61 3HZ LYS 61 7.536 -16.789 -0.163 479 HZ2 LYS 61 1HZ LYS 61 6.827 -18.248 -0.120 480 HZ3 LYS 61 2HZ LYS 61 6.433 -17.144 0.999 481 H ASP 62 H ASP 62 -0.467 -16.769 -0.297 482 HA ASP 62 HA ASP 62 -1.898 -19.064 -0.681 483 HB2 ASP 62 1HB ASP 62 -2.873 -16.298 0.145 484 HB3 ASP 62 2HB ASP 62 -3.970 -17.666 0.078 485 H GLY 63 H GLY 63 -2.523 -15.954 -2.368 486 HA2 GLY 63 1HA GLY 63 -3.499 -15.537 -4.382 487 HA3 GLY 63 2HA GLY 63 -3.793 -17.266 -4.605 488 H LYS 64 H LYS 64 -4.946 -15.454 -1.699 489 HA LYS 64 HA LYS 64 -7.649 -15.325 -2.758 490 HB2 LYS 64 1HB LYS 64 -8.642 -16.262 -0.811 491 HB3 LYS 64 2HB LYS 64 -7.847 -17.431 -1.854 492 HG2 LYS 64 1HG LYS 64 -5.961 -16.623 0.099 493 HG3 LYS 64 2HG LYS 64 -7.474 -16.889 0.973 494 HD2 LYS 64 1HD LYS 64 -7.590 -19.161 -0.256 495 HD3 LYS 64 2HD LYS 64 -5.922 -18.850 -0.770 496 HE2 LYS 64 1HE LYS 64 -5.331 -18.565 1.682 497 HE3 LYS 64 2HE LYS 64 -6.983 -19.082 2.083 498 HZ1 LYS 64 3HZ LYS 64 -5.439 -20.922 2.151 499 HZ2 LYS 64 1HZ LYS 64 -4.964 -20.668 0.622 500 HZ3 LYS 64 2HZ LYS 64 -6.481 -21.186 0.897 501 H ASN 65 H ASN 65 -6.426 -14.827 0.607 502 HA ASN 65 HA ASN 65 -6.717 -11.953 0.254 503 HB2 ASN 65 1HB ASN 65 -9.107 -13.140 0.332 504 HB3 ASN 65 2HB ASN 65 -8.740 -13.345 2.030 505 HD21 ASN 65 1HD2 ASN 65 -7.962 -11.054 3.084 506 HD22 ASN 65 2HD2 ASN 65 -9.063 -9.765 2.622 507 H LEU 66 H LEU 66 -4.626 -12.052 1.133 508 HA LEU 66 HA LEU 66 -3.725 -13.418 3.358 509 HB2 LEU 66 1HB LEU 66 -3.067 -10.543 2.558 510 HB3 LEU 66 2HB LEU 66 -2.159 -11.490 3.731 511 HG LEU 66 HG LEU 66 -2.516 -12.154 0.794 512 HD11 LEU 66 1HD1 LEU 66 -0.128 -11.553 0.628 513 HD12 LEU 66 2HD1 LEU 66 -0.032 -11.278 2.370 514 HD13 LEU 66 3HD1 LEU 66 -1.009 -10.204 1.355 515 HD21 LEU 66 3HD2 LEU 66 -1.202 -13.672 3.090 516 HD22 LEU 66 1HD2 LEU 66 -0.560 -13.846 1.460 517 HD23 LEU 66 2HD2 LEU 66 -2.244 -14.285 1.796 518 H LEU 67 H LEU 67 -5.568 -10.406 3.322 519 HA LEU 67 HA LEU 67 -5.326 -9.715 6.003 520 HB2 LEU 67 1HB LEU 67 -7.878 -9.254 4.423 521 HB3 LEU 67 2HB LEU 67 -7.184 -8.220 5.613 522 HG LEU 67 HG LEU 67 -6.048 -8.571 2.828 523 HD11 LEU 67 1HD1 LEU 67 -7.581 -6.253 4.088 524 HD12 LEU 67 2HD1 LEU 67 -8.277 -7.431 2.969 525 HD13 LEU 67 3HD1 LEU 67 -6.971 -6.364 2.419 526 HD21 LEU 67 3HD2 LEU 67 -5.338 -6.742 5.167 527 HD22 LEU 67 1HD2 LEU 67 -4.783 -6.488 3.502 528 HD23 LEU 67 2HD2 LEU 67 -4.292 -7.962 4.389 529 H TYR 68 H TYR 68 -7.265 -12.354 4.607 530 HA TYR 68 HA TYR 68 -8.998 -12.470 6.966 531 HB2 TYR 68 1HB TYR 68 -9.815 -12.651 4.626 532 HB3 TYR 68 2HB TYR 68 -8.837 -14.087 4.385 533 HD1 TYR 68 2HD TYR 68 -11.623 -12.613 6.404 534 HD2 TYR 68 1HD TYR 68 -9.656 -16.230 5.107 535 HE1 TYR 68 2HE TYR 68 -13.556 -13.970 7.200 536 HE2 TYR 68 1HE TYR 68 -11.561 -17.572 5.946 537 HH TYR 68 HH TYR 68 -13.498 -17.307 7.571 538 H ASN 69 H ASN 69 -5.843 -13.656 6.099 539 HA ASN 69 HA ASN 69 -6.322 -16.246 7.463 540 HB2 ASN 69 1HB ASN 69 -4.215 -15.248 5.573 541 HB3 ASN 69 2HB ASN 69 -3.679 -16.342 6.865 542 HD21 ASN 69 1HD2 ASN 69 -3.357 -17.341 4.284 543 HD22 ASN 69 2HD2 ASN 69 -4.494 -18.647 4.173 544 H GLY 70 H GLY 70 -4.116 -13.385 7.821 545 HA2 GLY 70 1HA GLY 70 -4.524 -13.134 10.523 546 HA3 GLY 70 2HA GLY 70 -3.225 -14.328 10.424 547 H THR 71 H THR 71 -1.694 -13.222 8.209 548 HA THR 71 HA THR 71 -0.177 -11.592 10.031 549 HB THR 71 HB THR 71 0.519 -11.911 7.106 550 HG1 THR 71 1HG THR 71 0.655 -13.882 9.114 551 HG21 THR 71 3HG2 THR 71 2.029 -10.560 8.506 552 HG22 THR 71 1HG2 THR 71 2.806 -12.057 7.974 553 HG23 THR 71 2HG2 THR 71 2.204 -11.920 9.638 554 H ALA 72 H ALA 72 -1.419 -10.845 6.727 555 HA ALA 72 HA ALA 72 -0.425 -8.108 6.895 556 HB1 ALA 72 1HB ALA 72 -0.579 -9.570 4.773 557 HB2 ALA 72 2HB ALA 72 -2.349 -9.423 4.875 558 HB3 ALA 72 3HB ALA 72 -1.343 -7.990 4.608 559 H LYS 73 H LYS 73 -1.350 -6.772 8.238 560 HA LYS 73 HA LYS 73 -4.314 -6.642 8.383 561 HB2 LYS 73 1HB LYS 73 -3.433 -8.344 9.893 562 HB3 LYS 73 2HB LYS 73 -2.301 -7.201 10.583 563 HG2 LYS 73 1HG LYS 73 -3.974 -7.287 12.162 564 HG3 LYS 73 2HG LYS 73 -4.404 -5.867 11.242 565 HD2 LYS 73 1HD LYS 73 -6.298 -6.814 10.357 566 HD3 LYS 73 2HD LYS 73 -5.610 -8.431 10.265 567 HE2 LYS 73 1HE LYS 73 -6.156 -7.422 13.015 568 HE3 LYS 73 2HE LYS 73 -7.564 -7.743 11.991 569 HZ1 LYS 73 3HZ LYS 73 -6.846 -9.977 11.675 570 HZ2 LYS 73 1HZ LYS 73 -6.875 -9.641 13.292 571 HZ3 LYS 73 2HZ LYS 73 -5.437 -9.715 12.536 572 H MET 74 H MET 74 -5.122 -4.740 8.953 573 HA MET 74 HA MET 74 -3.431 -2.395 8.790 574 HB2 MET 74 1HB MET 74 -5.416 -1.170 9.002 575 HB3 MET 74 2HB MET 74 -5.814 -2.568 7.992 576 HG2 MET 74 1HG MET 74 -6.547 -3.685 10.256 577 HG3 MET 74 2HG MET 74 -6.431 -2.039 10.885 578 HE1 MET 74 3HE MET 74 -7.634 -0.031 9.428 579 HE2 MET 74 1HE MET 74 -7.479 -0.813 7.836 580 HE3 MET 74 2HE MET 74 -9.087 -0.304 8.419 581 H PHE 75 H PHE 75 -2.806 -1.039 10.431 582 HA PHE 75 HA PHE 75 -3.597 -1.630 13.211 583 HB2 PHE 75 1HB PHE 75 -1.287 -1.656 13.969 584 HB3 PHE 75 2HB PHE 75 -1.559 -2.959 12.840 585 HD1 PHE 75 1HD PHE 75 -0.739 -2.694 10.426 586 HD2 PHE 75 2HD PHE 75 0.382 0.033 13.565 587 HE1 PHE 75 1HE PHE 75 1.247 -1.981 9.101 588 HE2 PHE 75 2HE PHE 75 2.336 0.749 12.229 589 HZ PHE 75 HZ PHE 75 2.813 -0.325 10.031 590 H LYS 76 H LYS 76 -3.487 0.617 10.806 591 HA LYS 76 HA LYS 76 -3.270 2.876 12.556 592 HB2 LYS 76 1HB LYS 76 -0.917 2.679 12.153 593 HB3 LYS 76 2HB LYS 76 -1.142 2.338 10.447 594 HG2 LYS 76 1HG LYS 76 -1.924 4.629 10.045 595 HG3 LYS 76 2HG LYS 76 -1.839 4.997 11.762 596 HD2 LYS 76 1HD LYS 76 0.563 4.711 11.777 597 HD3 LYS 76 2HD LYS 76 0.582 4.148 10.091 598 HE2 LYS 76 1HE LYS 76 -0.279 6.327 9.314 599 HE3 LYS 76 2HE LYS 76 -0.559 6.830 10.966 600 HZ1 LYS 76 3HZ LYS 76 2.001 6.656 9.545 601 HZ2 LYS 76 1HZ LYS 76 1.956 6.582 11.203 602 HZ3 LYS 76 2HZ LYS 76 1.376 7.889 10.381 603 H SER 77 H SER 77 -4.439 4.604 11.597 604 HA SER 77 HA SER 77 -5.276 4.479 8.800 605 HB2 SER 77 1HB SER 77 -7.686 4.692 9.488 606 HB3 SER 77 2HB SER 77 -6.966 3.121 9.744 607 HG SER 77 HG SER 77 -7.280 4.982 11.865 608 H ASP 78 H ASP 78 -5.559 6.681 8.080 609 HA ASP 78 HA ASP 78 -5.629 8.825 10.117 610 HB2 ASP 78 1HB ASP 78 -3.214 7.978 9.259 611 HB3 ASP 78 2HB ASP 78 -3.613 8.981 7.895 612 H ALA 79 H ALA 79 -5.834 11.040 8.676 613 HA ALA 79 HA ALA 79 -7.949 10.346 6.653 614 HB1 ALA 79 1HB ALA 79 -7.878 12.743 8.546 615 HB2 ALA 79 2HB ALA 79 -9.159 12.335 7.402 616 HB3 ALA 79 3HB ALA 79 -8.871 11.278 8.764 617 H ILE 80 H ILE 80 -8.291 11.833 4.990 618 HA ILE 80 HA ILE 80 -6.104 13.681 4.204 619 HB ILE 80 HB ILE 80 -7.430 11.578 2.408 620 HG12 ILE 80 1HG1 ILE 80 -4.556 11.795 3.421 621 HG13 ILE 80 2HG1 ILE 80 -5.782 10.715 4.021 622 HG21 ILE 80 1HG2 ILE 80 -5.252 13.607 1.701 623 HG22 ILE 80 2HG2 ILE 80 -5.910 12.355 0.627 624 HG23 ILE 80 3HG2 ILE 80 -6.940 13.672 1.158 625 HD11 ILE 80 3HD1 ILE 80 -4.557 9.401 2.569 626 HD12 ILE 80 1HD1 ILE 80 -5.988 9.805 1.639 627 HD13 ILE 80 2HD1 ILE 80 -4.448 10.658 1.321 628 H LEU 81 H LEU 81 -6.806 15.419 3.342 629 HA LEU 81 HA LEU 81 -9.752 15.800 2.954 630 HB2 LEU 81 1HB LEU 81 -7.710 17.863 3.811 631 HB3 LEU 81 2HB LEU 81 -9.417 18.154 3.517 632 HG LEU 81 HG LEU 81 -8.208 16.437 5.725 633 HD11 LEU 81 1HD1 LEU 81 -9.907 18.973 5.786 634 HD12 LEU 81 2HD1 LEU 81 -8.167 18.856 6.135 635 HD13 LEU 81 3HD1 LEU 81 -9.322 18.071 7.204 636 HD21 LEU 81 3HD2 LEU 81 -10.566 16.198 6.553 637 HD22 LEU 81 1HD2 LEU 81 -10.212 15.249 5.114 638 HD23 LEU 81 2HD2 LEU 81 -11.132 16.757 4.966 639 H GLY 82 H GLY 82 -10.564 16.871 1.229 640 HA2 GLY 82 1HA GLY 82 -8.801 17.269 -1.128 641 HA3 GLY 82 2HA GLY 82 -10.571 17.269 -1.108 642 H GLN 83 H GLN 83 -9.744 19.225 -2.465 643 HA GLN 83 HA GLN 83 -8.660 21.528 -1.177 644 HB2 GLN 83 1HB GLN 83 -10.162 21.389 -3.813 645 HB3 GLN 83 2HB GLN 83 -8.988 22.603 -3.332 646 HG2 GLN 83 1HG GLN 83 -7.657 20.040 -3.230 647 HG3 GLN 83 2HG GLN 83 -8.587 20.102 -4.720 648 HE21 GLN 83 1HE2 GLN 83 -6.099 21.834 -2.796 649 HE22 GLN 83 2HE2 GLN 83 -5.434 22.720 -4.143 650 H ASN 84 H ASN 84 -11.267 20.513 -0.072 651 HA ASN 84 HA ASN 84 -12.639 23.051 0.327 652 HB2 ASN 84 1HB ASN 84 -14.038 20.718 -1.065 653 HB3 ASN 84 2HB ASN 84 -14.927 21.913 -0.136 654 HD21 ASN 84 1HD2 ASN 84 -13.470 21.338 -3.214 655 HD22 ASN 84 2HD2 ASN 84 -13.647 22.983 -3.791 656 H LYS 85 H LYS 85 -11.023 20.971 1.848 657 HA LYS 85 HA LYS 85 -10.982 19.956 3.842 658 HB2 LYS 85 1HB LYS 85 -13.664 21.035 4.675 659 HB3 LYS 85 2HB LYS 85 -12.228 20.698 5.630 660 HG2 LYS 85 1HG LYS 85 -11.141 22.668 4.262 661 HG3 LYS 85 2HG LYS 85 -12.805 23.071 3.821 662 HD2 LYS 85 1HD LYS 85 -13.421 23.210 6.205 663 HD3 LYS 85 2HD LYS 85 -11.757 22.782 6.663 664 HE2 LYS 85 1HE LYS 85 -11.015 24.804 5.287 665 HE3 LYS 85 2HE LYS 85 -12.709 25.293 5.220 666 HZ1 LYS 85 3HZ LYS 85 -11.278 26.226 7.052 667 HZ2 LYS 85 1HZ LYS 85 -11.347 24.767 7.792 668 HZ3 LYS 85 2HZ LYS 85 -12.733 25.611 7.527 669 H VAL 86 H VAL 86 -12.741 18.880 1.507 670 HA VAL 86 HA VAL 86 -14.761 17.283 2.699 671 HB VAL 86 HB VAL 86 -15.219 18.157 0.644 672 HG11 VAL 86 1HG1 VAL 86 -13.891 17.468 -1.372 673 HG12 VAL 86 2HG1 VAL 86 -13.206 18.648 -0.225 674 HG13 VAL 86 3HG1 VAL 86 -12.662 16.965 -0.169 675 HG21 VAL 86 3HG2 VAL 86 -15.904 16.238 -0.646 676 HG22 VAL 86 1HG2 VAL 86 -14.719 15.191 0.155 677 HG23 VAL 86 2HG2 VAL 86 -16.102 15.838 1.066 678 H VAL 87 H VAL 87 -14.712 14.994 3.290 679 HA VAL 87 HA VAL 87 -12.097 13.775 3.610 680 HB VAL 87 HB VAL 87 -14.831 12.458 3.855 681 HG11 VAL 87 1HG1 VAL 87 -12.449 11.774 5.582 682 HG12 VAL 87 2HG1 VAL 87 -13.857 10.815 5.165 683 HG13 VAL 87 3HG1 VAL 87 -12.587 11.050 3.954 684 HG21 VAL 87 3HG2 VAL 87 -13.361 14.015 5.984 685 HG22 VAL 87 1HG2 VAL 87 -14.990 14.331 5.347 686 HG23 VAL 87 2HG2 VAL 87 -14.685 12.864 6.283 687 H ILE 88 H ILE 88 -11.208 13.612 1.531 688 HA ILE 88 HA ILE 88 -12.743 12.422 -0.672 689 HB ILE 88 HB ILE 88 -10.641 12.733 -1.962 690 HG12 ILE 88 1HG1 ILE 88 -9.530 14.201 0.457 691 HG13 ILE 88 2HG1 ILE 88 -9.034 12.584 0.010 692 HG21 ILE 88 1HG2 ILE 88 -12.499 14.409 -1.737 693 HG22 ILE 88 2HG2 ILE 88 -11.548 15.177 -0.447 694 HG23 ILE 88 3HG2 ILE 88 -10.932 15.130 -2.127 695 HD11 ILE 88 3HD1 ILE 88 -7.429 14.164 -0.930 696 HD12 ILE 88 1HD1 ILE 88 -8.338 13.433 -2.259 697 HD13 ILE 88 2HD1 ILE 88 -8.716 15.077 -1.721 698 H GLY 89 H GLY 89 -10.794 11.173 1.826 699 HA2 GLY 89 1HA GLY 89 -11.062 8.488 1.278 700 HA3 GLY 89 2HA GLY 89 -9.602 8.978 0.400 701 H TRP 90 H TRP 90 -8.771 7.276 2.172 702 HA TRP 90 HA TRP 90 -7.733 8.963 4.394 703 HB2 TRP 90 1HB TRP 90 -8.825 6.133 4.540 704 HB3 TRP 90 2HB TRP 90 -8.065 6.956 5.878 705 HD1 TRP 90 HD TRP 90 -9.561 9.008 6.922 706 HE1 TRP 90 1HE TRP 90 -12.081 9.514 6.844 707 HE3 TRP 90 3HE TRP 90 -10.808 5.866 3.179 708 HZ2 TRP 90 2HZ TRP 90 -14.401 8.559 5.382 709 HZ3 TRP 90 3HZ TRP 90 -13.232 5.686 2.359 710 HH2 TRP 90 HH TRP 90 -15.001 6.912 3.564 711 H ASP 91 H ASP 91 -5.673 7.853 5.324 712 HA ASP 91 HA ASP 91 -4.298 6.266 3.164 713 HB2 ASP 91 1HB ASP 91 -3.288 7.746 5.606 714 HB3 ASP 91 2HB ASP 91 -2.448 6.332 5.006 715 H LYS 92 H LYS 92 -5.155 4.213 3.413 716 HA LYS 92 HA LYS 92 -5.572 2.991 6.088 717 HB2 LYS 92 1HB LYS 92 -6.462 2.350 3.303 718 HB3 LYS 92 2HB LYS 92 -5.864 0.963 4.171 719 HG2 LYS 92 1HG LYS 92 -8.264 1.109 4.373 720 HG3 LYS 92 2HG LYS 92 -7.474 1.201 5.924 721 HD2 LYS 92 1HD LYS 92 -7.714 3.857 5.564 722 HD3 LYS 92 2HD LYS 92 -8.928 3.314 4.371 723 HE2 LYS 92 1HE LYS 92 -10.099 3.790 6.321 724 HE3 LYS 92 2HE LYS 92 -10.045 2.009 6.187 725 HZ1 LYS 92 3HZ LYS 92 -8.088 2.079 7.733 726 HZ2 LYS 92 1HZ LYS 92 -9.469 2.682 8.434 727 HZ3 LYS 92 2HZ LYS 92 -8.333 3.693 7.909 728 H TYR 93 H TYR 93 -3.760 2.297 7.127 729 HA TYR 93 HA TYR 93 -1.409 1.471 5.556 730 HB2 TYR 93 1HB TYR 93 -1.938 2.009 8.486 731 HB3 TYR 93 2HB TYR 93 -0.404 1.426 7.890 732 HD1 TYR 93 2HD TYR 93 -2.793 4.315 7.684 733 HD2 TYR 93 1HD TYR 93 1.217 2.890 6.937 734 HE1 TYR 93 2HE TYR 93 -2.026 6.632 7.348 735 HE2 TYR 93 1HE TYR 93 1.942 5.213 6.461 736 HH TYR 93 HH TYR 93 -0.085 8.021 7.078 737 H PHE 94 H PHE 94 -0.310 -0.501 6.199 738 HA PHE 94 HA PHE 94 -1.962 -2.775 7.109 739 HB2 PHE 94 1HB PHE 94 -0.897 -2.275 4.291 740 HB3 PHE 94 2HB PHE 94 -1.369 -3.847 4.862 741 HD1 PHE 94 1HD PHE 94 -3.834 -3.883 6.089 742 HD2 PHE 94 2HD PHE 94 -2.547 -1.040 3.098 743 HE1 PHE 94 1HE PHE 94 -6.194 -3.387 5.544 744 HE2 PHE 94 2HE PHE 94 -4.915 -0.574 2.566 745 HZ PHE 94 HZ PHE 94 -6.737 -1.708 3.811 746 H GLU 95 H GLU 95 -0.705 -4.492 7.868 747 HA GLU 95 HA GLU 95 2.231 -4.177 7.849 748 HB2 GLU 95 1HB GLU 95 0.718 -4.250 9.832 749 HB3 GLU 95 2HB GLU 95 0.405 -5.937 9.554 750 HG2 GLU 95 1HG GLU 95 2.616 -6.549 10.148 751 HG3 GLU 95 2HG GLU 95 3.259 -4.954 9.723 752 H ILE 96 H ILE 96 2.122 -5.119 5.467 753 HA ILE 96 HA ILE 96 1.209 -7.896 5.347 754 HB ILE 96 HB ILE 96 2.475 -6.107 3.284 755 HG12 ILE 96 1HG1 ILE 96 -0.417 -6.630 2.961 756 HG13 ILE 96 2HG1 ILE 96 -0.095 -5.770 4.441 757 HG21 ILE 96 1HG2 ILE 96 2.548 -8.467 2.565 758 HG22 ILE 96 2HG2 ILE 96 0.824 -8.664 2.939 759 HG23 ILE 96 3HG2 ILE 96 1.327 -7.590 1.625 760 HD11 ILE 96 3HD1 ILE 96 -0.521 -4.244 2.552 761 HD12 ILE 96 1HD1 ILE 96 1.092 -4.025 3.261 762 HD13 ILE 96 2HD1 ILE 96 0.905 -4.892 1.710 763 HA PRO 97 HA PRO 97 5.444 -9.441 6.000 764 HB2 PRO 97 1HB PRO 97 5.176 -11.981 4.879 765 HB3 PRO 97 2HB PRO 97 4.574 -11.539 6.504 766 HG2 PRO 97 1HG PRO 97 3.090 -11.590 3.863 767 HG3 PRO 97 2HG PRO 97 2.591 -12.306 5.441 768 HD2 PRO 97 1HD PRO 97 1.644 -9.939 4.594 769 HD3 PRO 97 2HD PRO 97 2.060 -10.159 6.309 770 H MET 98 H MET 98 7.164 -10.537 4.583 771 HA MET 98 HA MET 98 7.002 -9.553 1.760 772 HB2 MET 98 1HB MET 98 9.468 -10.507 3.257 773 HB3 MET 98 2HB MET 98 9.441 -9.781 1.643 774 HG2 MET 98 1HG MET 98 8.074 -7.954 3.412 775 HG3 MET 98 2HG MET 98 9.492 -8.538 4.261 776 HE1 MET 98 3HE MET 98 10.871 -6.161 4.429 777 HE2 MET 98 1HE MET 98 10.583 -4.974 3.148 778 HE3 MET 98 2HE MET 98 9.215 -5.655 4.070 779 H ASP 99 H ASP 99 7.777 -12.375 3.860 780 HA ASP 99 HA ASP 99 8.272 -14.175 1.688 781 HB2 ASP 99 1HB ASP 99 9.205 -13.943 4.197 782 HB3 ASP 99 2HB ASP 99 7.933 -15.094 4.528 783 H ALA 100 H ALA 100 5.363 -13.067 2.375 784 HA ALA 100 HA ALA 100 4.078 -15.670 1.689 785 HB1 ALA 100 1HB ALA 100 3.582 -15.042 4.105 786 HB2 ALA 100 2HB ALA 100 2.624 -13.689 3.436 787 HB3 ALA 100 3HB ALA 100 2.195 -15.352 3.042 788 H LEU 101 H LEU 101 5.055 -13.115 0.189 789 HA LEU 101 HA LEU 101 2.500 -12.366 -1.124 790 HB2 LEU 101 1HB LEU 101 5.356 -11.400 -1.481 791 HB3 LEU 101 2HB LEU 101 3.994 -10.839 -2.445 792 HG LEU 101 HG LEU 101 4.274 -10.534 0.582 793 HD11 LEU 101 1HD1 LEU 101 5.698 -9.155 -0.896 794 HD12 LEU 101 2HD1 LEU 101 4.610 -8.225 0.123 795 HD13 LEU 101 3HD1 LEU 101 4.245 -8.441 -1.619 796 HD21 LEU 101 3HD2 LEU 101 1.945 -10.709 0.259 797 HD22 LEU 101 1HD2 LEU 101 1.999 -9.880 -1.324 798 HD23 LEU 101 2HD2 LEU 101 2.237 -8.973 0.167 799 H GLN 102 H GLN 102 2.419 -12.438 -3.483 800 HA GLN 102 HA GLN 102 2.769 -15.183 -4.199 801 HB2 GLN 102 1HB GLN 102 0.831 -13.453 -4.645 802 HB3 GLN 102 2HB GLN 102 1.837 -12.915 -5.993 803 HG2 GLN 102 1HG GLN 102 1.863 -15.243 -6.857 804 HG3 GLN 102 2HG GLN 102 0.846 -15.749 -5.488 805 HE21 GLN 102 1HE2 GLN 102 -1.163 -16.242 -6.460 806 HE22 GLN 102 2HE2 GLN 102 -1.900 -15.244 -7.677 807 H ASP 103 H ASP 103 4.585 -12.356 -4.825 808 HA ASP 103 HA ASP 103 6.538 -13.650 -6.520 809 HB2 ASP 103 1HB ASP 103 4.514 -12.362 -7.866 810 HB3 ASP 103 2HB ASP 103 5.499 -10.962 -7.419 811 H ASN 104 H ASN 104 8.369 -11.585 -6.802 812 HA ASN 104 HA ASN 104 8.627 -10.351 -4.163 813 HB2 ASN 104 1HB ASN 104 10.345 -10.403 -6.674 814 HB3 ASN 104 2HB ASN 104 10.592 -9.184 -5.440 815 HD21 ASN 104 1HD2 ASN 104 12.418 -9.791 -4.742 816 HD22 ASN 104 2HD2 ASN 104 12.800 -11.257 -3.809 817 H SER 105 H SER 105 6.197 -9.634 -5.906 818 HA SER 105 HA SER 105 6.713 -6.731 -5.876 819 HB2 SER 105 1HB SER 105 5.125 -6.450 -7.772 820 HB3 SER 105 2HB SER 105 6.661 -7.203 -8.194 821 HG SER 105 HG SER 105 5.823 -9.073 -8.497 822 H ILE 106 H ILE 106 5.275 -5.481 -5.007 823 HA ILE 106 HA ILE 106 3.135 -6.746 -3.417 824 HB ILE 106 HB ILE 106 4.777 -5.302 -2.319 825 HG12 ILE 106 1HG1 ILE 106 2.391 -5.573 -1.526 826 HG13 ILE 106 2HG1 ILE 106 3.398 -4.293 -0.855 827 HG21 ILE 106 1HG2 ILE 106 5.387 -3.670 -3.946 828 HG22 ILE 106 2HG2 ILE 106 3.725 -3.040 -4.049 829 HG23 ILE 106 3HG2 ILE 106 4.677 -2.837 -2.568 830 HD11 ILE 106 3HD1 ILE 106 1.050 -3.623 -1.217 831 HD12 ILE 106 1HD1 ILE 106 2.255 -2.579 -1.984 832 HD13 ILE 106 2HD1 ILE 106 1.311 -3.715 -2.969 833 H GLN 107 H GLN 107 1.031 -6.253 -3.788 834 HA GLN 107 HA GLN 107 0.088 -4.200 -5.571 835 HB2 GLN 107 1HB GLN 107 0.757 -5.839 -7.271 836 HB3 GLN 107 2HB GLN 107 -0.124 -7.108 -6.434 837 HG2 GLN 107 1HG GLN 107 -2.263 -5.940 -6.918 838 HG3 GLN 107 2HG GLN 107 -1.373 -4.614 -7.661 839 HE21 GLN 107 1HE2 GLN 107 -2.620 -4.958 -9.640 840 HE22 GLN 107 2HE2 GLN 107 -2.490 -6.391 -10.592 841 H ILE 108 H ILE 108 -2.062 -3.775 -5.063 842 HA ILE 108 HA ILE 108 -3.396 -5.364 -2.929 843 HB ILE 108 HB ILE 108 -3.308 -2.337 -3.293 844 HG12 ILE 108 1HG1 ILE 108 -1.941 -3.856 -1.022 845 HG13 ILE 108 2HG1 ILE 108 -1.090 -3.362 -2.480 846 HG21 ILE 108 1HG2 ILE 108 -5.381 -2.955 -2.151 847 HG22 ILE 108 2HG2 ILE 108 -4.501 -4.033 -1.041 848 HG23 ILE 108 3HG2 ILE 108 -4.318 -2.275 -0.970 849 HD11 ILE 108 3HD1 ILE 108 -2.391 -1.464 -0.505 850 HD12 ILE 108 1HD1 ILE 108 -0.673 -1.687 -0.883 851 HD13 ILE 108 2HD1 ILE 108 -1.752 -1.016 -2.112 852 H LYS 109 H LYS 109 -5.875 -4.816 -3.029 853 HA LYS 109 HA LYS 109 -6.832 -3.536 -5.420 854 HB2 LYS 109 1HB LYS 109 -8.227 -5.633 -6.042 855 HB3 LYS 109 2HB LYS 109 -6.561 -5.574 -6.524 856 HG2 LYS 109 1HG LYS 109 -6.357 -6.982 -4.100 857 HG3 LYS 109 2HG LYS 109 -7.936 -7.453 -4.699 858 HD2 LYS 109 1HD LYS 109 -6.264 -9.014 -5.487 859 HD3 LYS 109 2HD LYS 109 -6.929 -8.130 -6.834 860 HE2 LYS 109 1HE LYS 109 -4.640 -8.247 -7.306 861 HE3 LYS 109 2HE LYS 109 -4.818 -6.591 -6.715 862 HZ1 LYS 109 3HZ LYS 109 -3.896 -8.926 -5.169 863 HZ2 LYS 109 1HZ LYS 109 -3.950 -7.372 -4.569 864 HZ3 LYS 109 2HZ LYS 109 -2.915 -7.845 -5.780 865 H ALA 110 H ALA 110 -9.042 -2.844 -4.964 866 HA ALA 110 HA ALA 110 -10.434 -4.264 -2.752 867 HB1 ALA 110 1HB ALA 110 -10.119 -1.244 -2.779 868 HB2 ALA 110 2HB ALA 110 -10.988 -2.235 -1.578 869 HB3 ALA 110 3HB ALA 110 -9.240 -2.371 -1.723 870 H LEU 111 H LEU 111 -12.701 -3.870 -2.602 871 HA LEU 111 HA LEU 111 -13.948 -3.789 -5.239 872 HB2 LEU 111 1HB LEU 111 -14.668 -5.429 -3.495 873 HB3 LEU 111 2HB LEU 111 -15.161 -4.092 -2.461 874 HG LEU 111 HG LEU 111 -16.786 -3.379 -4.314 875 HD11 LEU 111 1HD1 LEU 111 -15.712 -4.725 -6.188 876 HD12 LEU 111 2HD1 LEU 111 -17.444 -4.989 -5.994 877 HD13 LEU 111 3HD1 LEU 111 -16.293 -6.192 -5.385 878 HD21 LEU 111 3HD2 LEU 111 -17.184 -6.129 -3.096 879 HD22 LEU 111 1HD2 LEU 111 -18.445 -5.065 -3.742 880 HD23 LEU 111 2HD2 LEU 111 -17.518 -4.578 -2.304 881 H SER 112 H SER 112 -14.779 -1.990 -6.170 882 HA SER 112 HA SER 112 -14.977 0.531 -4.701 883 HB2 SER 112 1HB SER 112 -14.033 0.436 -6.982 884 HB3 SER 112 2HB SER 112 -15.542 -0.251 -7.593 885 HG SER 112 HG SER 112 -14.879 2.352 -6.915 886 H SER 113 H SER 113 -17.308 -1.166 -6.872 887 HA SER 113 HA SER 113 -19.487 -0.797 -4.959 888 HB2 SER 113 1HB SER 113 -18.901 1.043 -7.170 889 HB3 SER 113 2HB SER 113 -20.411 0.196 -7.483 890 HG SER 113 HG SER 113 -20.795 2.039 -6.309 891 H GLY 114 H GLY 114 -21.049 -2.323 -5.306 892 HA2 GLY 114 1HA GLY 114 -21.999 -4.256 -5.946 893 HA3 GLY 114 2HA GLY 114 -21.836 -3.552 -7.556 894 H THR 115 H THR 115 -20.173 -4.211 -8.902 895 HA THR 115 HA THR 115 -19.140 -6.922 -8.316 896 HB THR 115 HB THR 115 -19.236 -7.087 -10.817 897 HG1 THR 115 1HG THR 115 -20.402 -5.305 -11.852 898 HG21 THR 115 3HG2 THR 115 -21.890 -5.995 -9.733 899 HG22 THR 115 1HG2 THR 115 -21.290 -7.630 -9.419 900 HG23 THR 115 2HG2 THR 115 -21.664 -7.122 -11.074 901 H THR 116 H THR 116 -18.226 -3.636 -8.882 902 HA THR 116 HA THR 116 -16.073 -4.235 -10.672 903 HB THR 116 HB THR 116 -16.833 -1.530 -9.590 904 HG1 THR 116 1HG THR 116 -18.292 -3.176 -11.376 905 HG21 THR 116 3HG2 THR 116 -14.990 -1.640 -11.215 906 HG22 THR 116 1HG2 THR 116 -16.390 -0.803 -11.903 907 HG23 THR 116 2HG2 THR 116 -16.036 -2.478 -12.375 908 H PHE 117 H PHE 117 -14.045 -4.484 -10.131 909 HA PHE 117 HA PHE 117 -13.134 -3.884 -7.358 910 HB2 PHE 117 1HB PHE 117 -13.392 -6.356 -8.732 911 HB3 PHE 117 2HB PHE 117 -11.676 -6.010 -8.752 912 HD1 PHE 117 1HD PHE 117 -10.490 -5.501 -6.527 913 HD2 PHE 117 2HD PHE 117 -14.475 -7.122 -6.777 914 HE1 PHE 117 1HE PHE 117 -10.317 -6.306 -4.171 915 HE2 PHE 117 2HE PHE 117 -14.310 -7.899 -4.428 916 HZ PHE 117 HZ PHE 117 -12.271 -7.467 -3.123 917 H VAL 118 H VAL 118 -11.425 -2.526 -7.182 918 HA VAL 118 HA VAL 118 -9.994 -1.764 -9.660 919 HB VAL 118 HB VAL 118 -9.671 -0.487 -6.914 920 HG11 VAL 118 1HG1 VAL 118 -7.926 -0.021 -8.579 921 HG12 VAL 118 2HG1 VAL 118 -9.159 0.437 -9.783 922 HG13 VAL 118 3HG1 VAL 118 -8.864 1.434 -8.364 923 HG21 VAL 118 3HG2 VAL 118 -11.686 0.263 -9.056 924 HG22 VAL 118 1HG2 VAL 118 -12.049 -0.307 -7.416 925 HG23 VAL 118 2HG2 VAL 118 -11.295 1.264 -7.662 926 H TYR 119 H TYR 119 -7.863 -2.345 -9.929 927 HA TYR 119 HA TYR 119 -6.473 -3.815 -7.745 928 HB2 TYR 119 1HB TYR 119 -6.115 -3.959 -10.752 929 HB3 TYR 119 2HB TYR 119 -5.196 -4.868 -9.562 930 HD1 TYR 119 1HD TYR 119 -8.685 -4.377 -10.933 931 HD2 TYR 119 2HD TYR 119 -5.975 -6.980 -8.828 932 HE1 TYR 119 1HE TYR 119 -10.367 -6.129 -10.992 933 HE2 TYR 119 2HE TYR 119 -7.674 -8.806 -8.913 934 HH TYR 119 HH TYR 119 -10.850 -8.315 -10.482 935 H SER 120 H SER 120 -4.484 -2.984 -7.080 936 HA SER 120 HA SER 120 -3.684 -0.337 -8.034 937 HB2 SER 120 1HB SER 120 -2.200 -0.326 -6.310 938 HB3 SER 120 2HB SER 120 -3.425 -1.302 -5.645 939 HG SER 120 HG SER 120 -1.056 -2.340 -6.848 940 H GLN 121 H GLN 121 -1.292 -0.138 -8.782 941 HA GLN 121 HA GLN 121 -0.758 -1.970 -10.980 942 HB2 GLN 121 1HB GLN 121 1.241 -0.738 -11.323 943 HB3 GLN 121 2HB GLN 121 -0.026 0.434 -11.003 944 HG2 GLN 121 1HG GLN 121 1.887 -0.527 -8.841 945 HG3 GLN 121 2HG GLN 121 2.362 0.661 -10.030 946 HE21 GLN 121 1HE2 GLN 121 2.515 2.532 -8.939 947 HE22 GLN 121 2HE2 GLN 121 1.361 3.093 -7.769 948 H LYS 122 H LYS 122 1.439 -2.970 -11.059 949 HA LYS 122 HA LYS 122 2.097 -4.674 -8.718 950 HB2 LYS 122 1HB LYS 122 1.752 -5.317 -11.334 951 HB3 LYS 122 2HB LYS 122 3.338 -4.618 -11.509 952 HG2 LYS 122 1HG LYS 122 4.012 -6.716 -11.284 953 HG3 LYS 122 2HG LYS 122 3.896 -6.412 -9.551 954 HD2 LYS 122 1HD LYS 122 1.781 -7.604 -9.443 955 HD3 LYS 122 2HD LYS 122 1.608 -7.556 -11.209 956 HE2 LYS 122 1HE LYS 122 3.872 -8.887 -11.221 957 HE3 LYS 122 2HE LYS 122 3.452 -9.293 -9.556 958 HZ1 LYS 122 3HZ LYS 122 2.709 -10.962 -11.100 959 HZ2 LYS 122 1HZ LYS 122 1.830 -9.904 -11.964 960 HZ3 LYS 122 2HZ LYS 122 1.390 -10.312 -10.429 961 H ILE 123 H ILE 123 3.935 -4.138 -7.475 962 HA ILE 123 HA ILE 123 6.040 -2.458 -8.713 963 HB ILE 123 HB ILE 123 4.980 -2.184 -5.880 964 HG12 ILE 123 1HG1 ILE 123 3.461 -1.048 -7.439 965 HG13 ILE 123 2HG1 ILE 123 4.205 0.005 -6.246 966 HG21 ILE 123 1HG2 ILE 123 7.407 -1.778 -5.937 967 HG22 ILE 123 2HG2 ILE 123 7.201 -0.623 -7.271 968 HG23 ILE 123 3HG2 ILE 123 6.562 -0.242 -5.664 969 HD11 ILE 123 3HD1 ILE 123 5.093 -0.213 -9.135 970 HD12 ILE 123 1HD1 ILE 123 4.081 1.081 -8.466 971 HD13 ILE 123 2HD1 ILE 123 5.744 0.923 -7.935 972 H ASP 124 H ASP 124 7.533 -3.881 -9.021 973 HA ASP 124 HA ASP 124 8.108 -6.166 -7.245 974 HB2 ASP 124 1HB ASP 124 9.174 -5.011 -9.731 975 HB3 ASP 124 2HB ASP 124 10.426 -5.643 -8.656 976 H PHE 125 H PHE 125 9.734 -6.306 -5.765 977 HA PHE 125 HA PHE 125 11.184 -3.877 -4.980 978 HB2 PHE 125 1HB PHE 125 10.550 -4.108 -2.651 979 HB3 PHE 125 2HB PHE 125 9.103 -3.901 -3.626 980 HD1 PHE 125 2HD PHE 125 11.088 -6.397 -1.680 981 HD2 PHE 125 1HD PHE 125 7.368 -5.555 -3.664 982 HE1 PHE 125 2HE PHE 125 10.041 -8.312 -0.515 983 HE2 PHE 125 1HE PHE 125 6.359 -7.555 -2.596 984 HZ PHE 125 HZ PHE 125 7.757 -8.969 -1.041 985 H GLU 126 H GLU 126 12.736 -4.668 -3.073 986 HA GLU 126 HA GLU 126 13.751 -7.390 -3.513 987 HB2 GLU 126 1HB GLU 126 15.257 -4.783 -3.550 988 HB3 GLU 126 2HB GLU 126 16.055 -6.381 -3.432 989 HG2 GLU 126 1HG GLU 126 14.981 -6.977 -5.591 990 HG3 GLU 126 2HG GLU 126 14.281 -5.336 -5.715 991 H ARG 127 H ARG 127 14.622 -8.226 -1.491 992 HA ARG 127 HA ARG 127 13.651 -6.661 0.837 993 HB2 ARG 127 1HB ARG 127 12.772 -8.941 1.680 994 HB3 ARG 127 2HB ARG 127 11.877 -7.765 0.740 995 HG2 ARG 127 1HG ARG 127 11.312 -9.964 0.083 996 HG3 ARG 127 2HG ARG 127 11.982 -8.956 -1.215 997 HD2 ARG 127 1HD ARG 127 12.491 -11.323 -1.334 998 HD3 ARG 127 2HD ARG 127 13.854 -10.200 -1.417 999 HE ARG 127 HE ARG 127 14.434 -10.729 0.879 1000 HH11 ARG 127 1HH1 ARG 127 12.756 -13.292 -1.037 1001 HH12 ARG 127 2HH1 ARG 127 13.314 -14.534 0.035 1002 HH21 ARG 127 1HH2 ARG 127 15.113 -12.432 2.178 1003 HH22 ARG 127 2HH2 ARG 127 14.658 -14.071 1.832 1004 H GLU 128 H GLU 128 15.771 -6.225 0.946 1005 HA GLU 128 HA GLU 128 17.928 -6.379 1.341 1006 HB2 GLU 128 1HB GLU 128 17.128 -7.164 3.662 1007 HB3 GLU 128 2HB GLU 128 17.593 -8.786 3.101 1008 HG2 GLU 128 1HG GLU 128 19.760 -7.370 2.379 1009 HG3 GLU 128 2HG GLU 128 19.251 -6.353 3.688 Start of MODEL 6 1 H1 GLY 1 H GLY 1 -21.491 17.662 -5.445 2 HA2 GLY 1 1HA GLY 1 -20.978 19.043 -3.448 3 HA3 GLY 1 2HA GLY 1 -22.318 18.188 -2.655 4 H ALA 2 H ALA 2 -21.551 16.657 -1.275 5 HA ALA 2 HA ALA 2 -19.515 14.712 -2.271 6 HB1 ALA 2 1HB ALA 2 -18.736 14.426 0.000 7 HB2 ALA 2 2HB ALA 2 -18.672 16.157 -0.333 8 HB3 ALA 2 3HB ALA 2 -20.001 15.501 0.641 9 H GLU 3 H GLU 3 -20.085 12.482 -1.634 10 HA GLU 3 HA GLU 3 -22.885 12.007 -0.894 11 HB2 GLU 3 1HB GLU 3 -22.375 12.724 -3.499 12 HB3 GLU 3 2HB GLU 3 -22.091 11.006 -3.618 13 HG2 GLU 3 1HG GLU 3 -24.312 10.708 -3.793 14 HG3 GLU 3 2HG GLU 3 -24.500 11.237 -2.128 15 H ALA 4 H ALA 4 -20.185 11.158 0.074 16 HA ALA 4 HA ALA 4 -18.800 9.425 0.439 17 HB1 ALA 4 1HB ALA 4 -19.879 7.290 1.183 18 HB2 ALA 4 2HB ALA 4 -20.506 8.749 1.994 19 HB3 ALA 4 3HB ALA 4 -21.444 7.954 0.699 20 H LEU 5 H LEU 5 -18.624 9.972 -2.141 21 HA LEU 5 HA LEU 5 -19.525 8.103 -4.017 22 HB2 LEU 5 1HB LEU 5 -16.744 9.257 -4.192 23 HB3 LEU 5 2HB LEU 5 -17.761 8.789 -5.527 24 HG LEU 5 HG LEU 5 -18.280 11.129 -3.673 25 HD11 LEU 5 1HD1 LEU 5 -17.546 12.536 -5.544 26 HD12 LEU 5 2HD1 LEU 5 -17.071 11.092 -6.449 27 HD13 LEU 5 3HD1 LEU 5 -16.247 11.529 -4.927 28 HD21 LEU 5 3HD2 LEU 5 -19.490 10.396 -6.357 29 HD22 LEU 5 1HD2 LEU 5 -19.897 11.835 -5.385 30 HD23 LEU 5 2HD2 LEU 5 -20.297 10.209 -4.777 31 HA PRO 6 HA PRO 6 -17.048 4.536 -2.937 32 HB2 PRO 6 1HB PRO 6 -17.504 2.882 -5.017 33 HB3 PRO 6 2HB PRO 6 -18.838 3.443 -3.962 34 HG2 PRO 6 1HG PRO 6 -18.020 4.576 -6.648 35 HG3 PRO 6 2HG PRO 6 -19.652 4.086 -6.094 36 HD2 PRO 6 1HD PRO 6 -18.673 6.718 -5.932 37 HD3 PRO 6 2HD PRO 6 -19.903 6.035 -4.816 38 H LEU 7 H LEU 7 -15.241 3.302 -3.688 39 HA LEU 7 HA LEU 7 -12.995 4.660 -4.076 40 HB2 LEU 7 1HB LEU 7 -13.232 2.326 -3.346 41 HB3 LEU 7 2HB LEU 7 -13.519 1.838 -5.016 42 HG LEU 7 HG LEU 7 -11.181 2.712 -5.584 43 HD11 LEU 7 1HD1 LEU 7 -10.824 4.196 -3.695 44 HD12 LEU 7 2HD1 LEU 7 -9.634 2.902 -3.635 45 HD13 LEU 7 3HD1 LEU 7 -11.060 2.877 -2.551 46 HD21 LEU 7 3HD2 LEU 7 -11.627 0.367 -5.413 47 HD22 LEU 7 1HD2 LEU 7 -11.605 0.412 -3.655 48 HD23 LEU 7 2HD2 LEU 7 -10.103 0.686 -4.578 49 H TYR 8 H TYR 8 -12.831 6.239 -5.703 50 HA TYR 8 HA TYR 8 -12.989 5.362 -8.507 51 HB2 TYR 8 1HB TYR 8 -12.358 7.779 -8.976 52 HB3 TYR 8 2HB TYR 8 -13.945 7.388 -8.380 53 HD1 TYR 8 2HD TYR 8 -10.770 9.106 -7.558 54 HD2 TYR 8 1HD TYR 8 -14.769 8.143 -6.254 55 HE1 TYR 8 2HE TYR 8 -10.663 10.918 -5.857 56 HE2 TYR 8 1HE TYR 8 -14.682 9.935 -4.580 57 HH TYR 8 HH TYR 8 -13.424 11.719 -3.749 58 H TYR 9 H TYR 9 -10.467 5.636 -6.091 59 HA TYR 9 HA TYR 9 -8.409 5.128 -8.195 60 HB2 TYR 9 1HB TYR 9 -8.538 7.530 -7.838 61 HB3 TYR 9 2HB TYR 9 -8.325 7.229 -6.125 62 HD1 TYR 9 1HD TYR 9 -6.648 7.007 -9.432 63 HD2 TYR 9 2HD TYR 9 -6.106 6.877 -5.162 64 HE1 TYR 9 1HE TYR 9 -4.267 7.500 -9.746 65 HE2 TYR 9 2HE TYR 9 -3.725 7.566 -5.453 66 HH TYR 9 HH TYR 9 -2.258 8.639 -7.083 67 H LEU 10 H LEU 10 -6.906 3.654 -7.522 68 HA LEU 10 HA LEU 10 -6.547 3.085 -4.646 69 HB2 LEU 10 1HB LEU 10 -8.093 1.364 -5.426 70 HB3 LEU 10 2HB LEU 10 -7.173 1.111 -6.865 71 HG LEU 10 HG LEU 10 -5.851 -0.281 -5.873 72 HD11 LEU 10 1HD1 LEU 10 -4.696 0.937 -4.087 73 HD12 LEU 10 2HD1 LEU 10 -5.401 -0.517 -3.366 74 HD13 LEU 10 3HD1 LEU 10 -6.215 1.048 -3.168 75 HD21 LEU 10 3HD2 LEU 10 -8.132 -0.540 -3.996 76 HD22 LEU 10 1HD2 LEU 10 -6.890 -1.761 -4.399 77 HD23 LEU 10 2HD2 LEU 10 -8.003 -1.164 -5.655 78 H GLN 11 H GLN 11 -4.421 3.896 -4.539 79 HA GLN 11 HA GLN 11 -2.451 2.516 -6.278 80 HB2 GLN 11 1HB GLN 11 -3.211 5.165 -6.725 81 HB3 GLN 11 2HB GLN 11 -1.796 5.344 -5.722 82 HG2 GLN 11 1HG GLN 11 -0.980 5.422 -7.917 83 HG3 GLN 11 2HG GLN 11 -0.557 3.822 -7.353 84 HE21 GLN 11 1HE2 GLN 11 -2.978 2.305 -7.927 85 HE22 GLN 11 2HE2 GLN 11 -2.963 2.199 -9.651 86 H ILE 12 H ILE 12 -0.378 2.337 -5.375 87 HA ILE 12 HA ILE 12 -0.617 2.026 -2.552 88 HB ILE 12 HB ILE 12 1.799 1.470 -4.305 89 HG12 ILE 12 1HG1 ILE 12 -0.007 0.113 -5.146 90 HG13 ILE 12 2HG1 ILE 12 0.946 -0.902 -4.084 91 HG21 ILE 12 1HG2 ILE 12 0.982 0.865 -1.479 92 HG22 ILE 12 2HG2 ILE 12 2.123 -0.218 -2.280 93 HG23 ILE 12 3HG2 ILE 12 2.542 1.480 -2.024 94 HD11 ILE 12 3HD1 ILE 12 -0.784 -0.397 -2.237 95 HD12 ILE 12 1HD1 ILE 12 -1.807 0.214 -3.571 96 HD13 ILE 12 2HD1 ILE 12 -1.249 -1.466 -3.547 97 H THR 13 H THR 13 0.838 4.674 -4.364 98 HA THR 13 HA THR 13 1.379 6.679 -3.721 99 HB THR 13 HB THR 13 0.743 6.658 -0.864 100 HG1 THR 13 1HG THR 13 -0.803 5.424 -0.882 101 HG21 THR 13 3HG2 THR 13 0.797 8.623 -2.346 102 HG22 THR 13 1HG2 THR 13 -0.753 8.409 -1.504 103 HG23 THR 13 2HG2 THR 13 -0.609 7.969 -3.239 104 H GLY 14 H GLY 14 2.278 4.687 -0.889 105 HA2 GLY 14 1HA GLY 14 5.094 5.261 -1.262 106 HA3 GLY 14 2HA GLY 14 4.433 5.976 0.206 107 H ILE 15 H ILE 15 6.391 4.098 0.392 108 HA ILE 15 HA ILE 15 5.167 1.717 1.583 109 HB ILE 15 HB ILE 15 5.390 1.248 -0.847 110 HG12 ILE 15 1HG1 ILE 15 7.437 -0.348 0.738 111 HG13 ILE 15 2HG1 ILE 15 5.682 -0.552 0.848 112 HG21 ILE 15 1HG2 ILE 15 7.530 1.199 -2.005 113 HG22 ILE 15 2HG2 ILE 15 7.344 2.803 -1.300 114 HG23 ILE 15 3HG2 ILE 15 8.403 1.625 -0.522 115 HD11 ILE 15 3HD1 ILE 15 7.354 -0.946 -1.671 116 HD12 ILE 15 1HD1 ILE 15 6.637 -2.212 -0.701 117 HD13 ILE 15 2HD1 ILE 15 5.582 -1.087 -1.569 118 H THR 16 H THR 16 6.739 0.709 3.026 119 HA THR 16 HA THR 16 9.473 1.435 2.903 120 HB THR 16 HB THR 16 8.845 3.457 4.037 121 HG1 THR 16 1HG THR 16 9.849 1.740 6.059 122 HG21 THR 16 3HG2 THR 16 7.656 1.908 6.360 123 HG22 THR 16 1HG2 THR 16 6.673 2.657 5.095 124 HG23 THR 16 2HG2 THR 16 7.716 3.662 6.111 125 H SER 17 H SER 17 10.569 0.244 4.901 126 HA SER 17 HA SER 17 8.982 -2.036 5.888 127 HB2 SER 17 1HB SER 17 11.534 -2.236 4.315 128 HB3 SER 17 2HB SER 17 11.117 -3.426 5.576 129 HG SER 17 HG SER 17 9.352 -3.987 4.580 130 H ASP 18 H ASP 18 10.266 -3.009 7.762 131 HA ASP 18 HA ASP 18 11.066 -0.962 9.597 132 HB2 ASP 18 1HB ASP 18 10.110 -3.051 10.352 133 HB3 ASP 18 2HB ASP 18 11.448 -3.974 9.661 134 H GLY 19 H GLY 19 12.988 -3.061 7.358 135 HA2 GLY 19 1HA GLY 19 15.536 -1.901 8.224 136 HA3 GLY 19 2HA GLY 19 15.262 -3.047 6.925 137 H ASN 20 H ASN 20 13.741 0.109 7.557 138 HA ASN 20 HA ASN 20 15.064 1.306 5.194 139 HB2 ASN 20 1HB ASN 20 12.446 0.147 5.023 140 HB3 ASN 20 2HB ASN 20 12.251 1.906 4.995 141 HD21 ASN 20 1HD2 ASN 20 14.697 -0.376 3.710 142 HD22 ASN 20 2HD2 ASN 20 14.569 0.207 2.042 143 H ASP 21 H ASP 21 14.477 1.779 8.336 144 HA ASP 21 HA ASP 21 14.305 3.611 9.672 145 HB2 ASP 21 1HB ASP 21 16.247 4.060 7.804 146 HB3 ASP 21 2HB ASP 21 15.289 5.510 7.592 147 H PHE 22 H PHE 22 11.967 2.948 8.121 148 HA PHE 22 HA PHE 22 9.953 3.637 7.454 149 HB2 PHE 22 1HB PHE 22 10.462 5.650 9.627 150 HB3 PHE 22 2HB PHE 22 8.933 5.535 8.779 151 HD1 PHE 22 2HD PHE 22 11.332 3.293 10.673 152 HD2 PHE 22 1HD PHE 22 7.243 4.090 9.521 153 HE1 PHE 22 2HE PHE 22 10.537 1.602 12.283 154 HE2 PHE 22 1HE PHE 22 6.472 2.473 11.203 155 HZ PHE 22 HZ PHE 22 8.105 1.197 12.574 156 H ALA 23 H ALA 23 12.182 4.610 5.805 157 HA ALA 23 HA ALA 23 11.552 7.185 4.698 158 HB1 ALA 23 1HB ALA 23 13.731 6.117 4.376 159 HB2 ALA 23 2HB ALA 23 12.963 4.740 3.546 160 HB3 ALA 23 3HB ALA 23 12.937 6.357 2.804 161 H TRP 24 H TRP 24 9.254 7.190 4.471 162 HA TRP 24 HA TRP 24 7.702 5.195 3.307 163 HB2 TRP 24 1HB TRP 24 7.347 8.112 3.992 164 HB3 TRP 24 2HB TRP 24 6.104 7.344 3.024 165 HD1 TRP 24 HD TRP 24 6.969 7.798 6.545 166 HE1 TRP 24 1HE TRP 24 5.562 6.306 8.020 167 HE3 TRP 24 3HE TRP 24 5.305 4.587 2.963 168 HZ2 TRP 24 2HZ TRP 24 3.826 3.941 7.668 169 HZ3 TRP 24 3HZ TRP 24 3.888 2.658 3.548 170 HH2 TRP 24 HH TRP 24 3.117 2.334 5.899 171 H ASP 25 H ASP 25 9.709 7.027 1.581 172 HA ASP 25 HA ASP 25 9.878 7.731 -0.676 173 HB2 ASP 25 1HB ASP 25 10.336 5.013 0.073 174 HB3 ASP 25 2HB ASP 25 9.679 5.061 -1.546 175 H ASN 26 H ASN 26 8.196 8.929 -1.372 176 HA ASN 26 HA ASN 26 5.665 7.932 -2.056 177 HB2 ASN 26 1HB ASN 26 7.034 10.529 -2.715 178 HB3 ASN 26 2HB ASN 26 5.606 10.098 -3.632 179 HD21 ASN 26 1HD2 ASN 26 3.713 9.149 -2.253 180 HD22 ASN 26 2HD2 ASN 26 3.318 10.107 -0.849 181 H LEU 27 H LEU 27 5.280 6.403 -3.361 182 HA LEU 27 HA LEU 27 6.757 5.766 -5.746 183 HB2 LEU 27 1HB LEU 27 3.996 4.821 -4.858 184 HB3 LEU 27 2HB LEU 27 4.989 4.088 -6.124 185 HG LEU 27 HG LEU 27 5.638 4.236 -3.157 186 HD11 LEU 27 1HD1 LEU 27 4.887 1.889 -4.941 187 HD12 LEU 27 2HD1 LEU 27 3.847 2.662 -3.722 188 HD13 LEU 27 3HD1 LEU 27 5.296 1.791 -3.221 189 HD21 LEU 27 3HD2 LEU 27 7.526 2.721 -3.684 190 HD22 LEU 27 1HD2 LEU 27 7.731 4.330 -4.321 191 HD23 LEU 27 2HD2 LEU 27 7.249 2.981 -5.417 192 H THR 28 H THR 28 6.567 6.611 -7.670 193 HA THR 28 HA THR 28 4.985 8.801 -8.174 194 HB THR 28 HB THR 28 5.853 7.602 -10.653 195 HG1 THR 28 1HG THR 28 7.983 7.200 -10.188 196 HG21 THR 28 3HG2 THR 28 7.006 9.756 -8.823 197 HG22 THR 28 1HG2 THR 28 5.855 9.995 -10.147 198 HG23 THR 28 2HG2 THR 28 7.519 9.488 -10.499 199 H SER 29 H SER 29 3.474 9.154 -9.974 200 HA SER 29 HA SER 29 1.112 7.887 -9.312 201 HB2 SER 29 1HB SER 29 1.638 9.480 -11.845 202 HB3 SER 29 2HB SER 29 0.113 9.338 -10.949 203 HG SER 29 HG SER 29 1.481 11.281 -10.671 204 H SER 30 H SER 30 3.376 6.877 -11.817 205 HA SER 30 HA SER 30 1.486 4.691 -12.505 206 HB2 SER 30 1HB SER 30 3.259 6.131 -14.493 207 HB3 SER 30 2HB SER 30 2.011 4.931 -14.831 208 HG SER 30 HG SER 30 0.561 6.566 -13.746 209 H GLN 31 H GLN 31 3.959 5.049 -10.720 210 HA GLN 31 HA GLN 31 6.311 3.881 -11.672 211 HB2 GLN 31 1HB GLN 31 5.847 4.962 -9.417 212 HB3 GLN 31 2HB GLN 31 5.028 3.469 -8.961 213 HG2 GLN 31 1HG GLN 31 6.935 2.803 -8.114 214 HG3 GLN 31 2HG GLN 31 7.471 2.521 -9.745 215 HE21 GLN 31 1HE2 GLN 31 7.929 4.354 -6.850 216 HE22 GLN 31 2HE2 GLN 31 9.280 5.305 -7.440 217 H THR 32 H THR 32 7.065 1.733 -11.884 218 HA THR 32 HA THR 32 5.152 -0.484 -11.347 219 HB THR 32 HB THR 32 6.047 -1.489 -13.420 220 HG1 THR 32 1HG THR 32 7.375 -0.352 -14.693 221 HG21 THR 32 3HG2 THR 32 4.792 -0.180 -14.988 222 HG22 THR 32 1HG2 THR 32 4.923 1.275 -13.980 223 HG23 THR 32 2HG2 THR 32 3.947 -0.108 -13.429 224 H LYS 33 H LYS 33 8.055 0.807 -10.289 225 HA LYS 33 HA LYS 33 8.830 -1.794 -9.188 226 HB2 LYS 33 1HB LYS 33 10.137 -1.145 -11.469 227 HB3 LYS 33 2HB LYS 33 11.120 -0.213 -10.341 228 HG2 LYS 33 1HG LYS 33 10.434 -3.074 -9.679 229 HG3 LYS 33 2HG LYS 33 11.556 -2.816 -10.984 230 HD2 LYS 33 1HD LYS 33 12.127 -1.520 -8.303 231 HD3 LYS 33 2HD LYS 33 12.380 -3.236 -8.546 232 HE2 LYS 33 1HE LYS 33 14.467 -2.458 -9.062 233 HE3 LYS 33 2HE LYS 33 13.736 -2.552 -10.669 234 HZ1 LYS 33 3HZ LYS 33 14.141 -0.131 -9.019 235 HZ2 LYS 33 1HZ LYS 33 13.293 -0.142 -10.469 236 HZ3 LYS 33 2HZ LYS 33 14.867 -0.490 -10.436 237 H ALA 34 H ALA 34 10.189 -1.517 -7.342 238 HA ALA 34 HA ALA 34 9.426 0.717 -5.723 239 HB1 ALA 34 1HB ALA 34 11.521 -1.474 -5.319 240 HB2 ALA 34 2HB ALA 34 10.927 -0.419 -4.038 241 HB3 ALA 34 3HB ALA 34 9.813 -1.552 -4.817 242 HA PRO 35 HA PRO 35 12.922 3.370 -6.421 243 HB2 PRO 35 1HB PRO 35 13.530 4.295 -3.890 244 HB3 PRO 35 2HB PRO 35 12.180 4.900 -4.900 245 HG2 PRO 35 1HG PRO 35 12.081 2.870 -2.653 246 HG3 PRO 35 2HG PRO 35 10.930 4.185 -3.044 247 HD2 PRO 35 1HD PRO 35 10.428 1.637 -3.715 248 HD3 PRO 35 2HD PRO 35 9.924 3.018 -4.722 249 H ASN 36 H ASN 36 13.346 1.301 -3.398 250 HA ASN 36 HA ASN 36 16.004 0.486 -4.328 251 HB2 ASN 36 1HB ASN 36 15.505 1.838 -1.650 252 HB3 ASN 36 2HB ASN 36 17.031 1.208 -2.199 253 HD21 ASN 36 1HD2 ASN 36 17.783 2.271 -4.388 254 HD22 ASN 36 2HD2 ASN 36 17.663 4.035 -4.330 255 H VAL 37 H VAL 37 16.884 -0.927 -2.407 256 HA VAL 37 HA VAL 37 14.954 -3.007 -1.972 257 HB VAL 37 HB VAL 37 16.762 -3.809 -2.801 258 HG11 VAL 37 1HG1 VAL 37 18.558 -2.427 -0.911 259 HG12 VAL 37 2HG1 VAL 37 18.967 -3.712 -2.126 260 HG13 VAL 37 3HG1 VAL 37 18.303 -2.175 -2.679 261 HG21 VAL 37 3HG2 VAL 37 17.498 -5.499 -1.345 262 HG22 VAL 37 1HG2 VAL 37 17.496 -4.395 0.064 263 HG23 VAL 37 2HG2 VAL 37 15.987 -4.987 -0.606 264 H LEU 38 H LEU 38 13.545 -2.730 -0.621 265 HA LEU 38 HA LEU 38 13.525 -1.908 2.078 266 HB2 LEU 38 1HB LEU 38 11.971 -4.137 0.725 267 HB3 LEU 38 2HB LEU 38 11.562 -3.357 2.236 268 HG LEU 38 HG LEU 38 11.556 -2.116 -0.540 269 HD11 LEU 38 1HD1 LEU 38 9.268 -2.633 1.401 270 HD12 LEU 38 2HD1 LEU 38 9.665 -3.640 -0.010 271 HD13 LEU 38 3HD1 LEU 38 9.151 -1.962 -0.244 272 HD21 LEU 38 3HD2 LEU 38 12.237 -0.361 0.938 273 HD22 LEU 38 1HD2 LEU 38 10.967 -0.775 2.122 274 HD23 LEU 38 2HD2 LEU 38 10.548 -0.101 0.527 275 H LYS 39 H LYS 39 15.201 -2.595 3.438 276 HA LYS 39 HA LYS 39 15.861 -5.466 3.582 277 HB2 LYS 39 1HB LYS 39 16.801 -3.027 5.156 278 HB3 LYS 39 2HB LYS 39 17.250 -4.654 5.594 279 HG2 LYS 39 1HG LYS 39 18.717 -4.912 3.937 280 HG3 LYS 39 2HG LYS 39 17.717 -4.137 2.721 281 HD2 LYS 39 1HD LYS 39 19.048 -2.383 4.797 282 HD3 LYS 39 2HD LYS 39 20.029 -3.150 3.545 283 HE2 LYS 39 1HE LYS 39 18.395 -2.241 1.814 284 HE3 LYS 39 2HE LYS 39 17.683 -1.252 3.094 285 HZ1 LYS 39 3HZ LYS 39 19.459 -0.126 1.764 286 HZ2 LYS 39 1HZ LYS 39 20.546 -1.205 2.333 287 HZ3 LYS 39 2HZ LYS 39 19.829 -0.172 3.366 288 H GLY 40 H GLY 40 15.730 -6.499 5.842 289 HA2 GLY 40 1HA GLY 40 14.576 -6.847 7.861 290 HA3 GLY 40 2HA GLY 40 13.402 -5.604 7.434 291 H ASN 41 H ASN 41 11.961 -7.371 8.181 292 HA ASN 41 HA ASN 41 11.125 -9.177 5.924 293 HB2 ASN 41 1HB ASN 41 11.845 -10.332 8.017 294 HB3 ASN 41 2HB ASN 41 10.542 -9.495 8.891 295 HD21 ASN 41 1HD2 ASN 41 8.327 -10.302 8.626 296 HD22 ASN 41 2HD2 ASN 41 8.061 -11.744 7.662 297 H LYS 42 H LYS 42 10.047 -6.387 7.931 298 HA LYS 42 HA LYS 42 7.265 -7.269 7.635 299 HB2 LYS 42 1HB LYS 42 8.534 -4.965 9.171 300 HB3 LYS 42 2HB LYS 42 6.794 -5.176 8.924 301 HG2 LYS 42 1HG LYS 42 7.263 -6.080 11.046 302 HG3 LYS 42 2HG LYS 42 6.925 -7.456 9.968 303 HD2 LYS 42 1HD LYS 42 9.034 -8.276 10.052 304 HD3 LYS 42 2HD LYS 42 9.750 -6.671 10.244 305 HE2 LYS 42 1HE LYS 42 8.809 -6.657 12.616 306 HE3 LYS 42 2HE LYS 42 8.296 -8.337 12.368 307 HZ1 LYS 42 3HZ LYS 42 10.436 -8.193 13.507 308 HZ2 LYS 42 1HZ LYS 42 11.067 -7.308 12.301 309 HZ3 LYS 42 2HZ LYS 42 10.685 -8.886 12.035 310 H LEU 43 H LEU 43 5.824 -5.990 6.346 311 HA LEU 43 HA LEU 43 7.138 -4.047 4.509 312 HB2 LEU 43 1HB LEU 43 6.175 -6.462 3.767 313 HB3 LEU 43 2HB LEU 43 4.669 -5.572 3.777 314 HG LEU 43 HG LEU 43 5.257 -5.367 1.642 315 HD11 LEU 43 1HD1 LEU 43 6.866 -2.977 2.570 316 HD12 LEU 43 2HD1 LEU 43 5.074 -3.034 2.557 317 HD13 LEU 43 3HD1 LEU 43 5.983 -3.196 1.056 318 HD21 LEU 43 3HD2 LEU 43 7.426 -6.508 1.742 319 HD22 LEU 43 1HD2 LEU 43 8.193 -5.001 2.299 320 HD23 LEU 43 2HD2 LEU 43 7.499 -5.109 0.675 321 H TYR 44 H TYR 44 6.375 -1.997 4.773 322 HA TYR 44 HA TYR 44 3.705 -1.584 6.029 323 HB2 TYR 44 1HB TYR 44 6.038 0.350 5.998 324 HB3 TYR 44 2HB TYR 44 4.481 0.592 6.749 325 HD1 TYR 44 1HD TYR 44 3.909 -1.725 8.340 326 HD2 TYR 44 2HD TYR 44 7.740 0.088 7.595 327 HE1 TYR 44 1HE TYR 44 4.756 -2.642 10.470 328 HE2 TYR 44 2HE TYR 44 8.629 -0.928 9.696 329 HH TYR 44 HH TYR 44 6.437 -2.545 12.058 330 H VAL 45 H VAL 45 2.244 -0.677 4.744 331 HA VAL 45 HA VAL 45 3.092 0.740 2.240 332 HB VAL 45 HB VAL 45 0.733 -1.170 2.608 333 HG11 VAL 45 1HG1 VAL 45 1.883 0.352 0.309 334 HG12 VAL 45 2HG1 VAL 45 0.735 -0.996 0.075 335 HG13 VAL 45 3HG1 VAL 45 0.215 0.463 0.933 336 HG21 VAL 45 3HG2 VAL 45 1.987 -2.664 1.079 337 HG22 VAL 45 1HG2 VAL 45 3.387 -1.563 1.141 338 HG23 VAL 45 2HG2 VAL 45 2.852 -2.429 2.596 339 H LYS 46 H LYS 46 1.666 2.485 1.583 340 HA LYS 46 HA LYS 46 -0.379 3.411 3.548 341 HB2 LYS 46 1HB LYS 46 1.825 4.585 3.845 342 HB3 LYS 46 2HB LYS 46 1.772 5.065 2.156 343 HG2 LYS 46 1HG LYS 46 -0.733 5.874 3.289 344 HG3 LYS 46 2HG LYS 46 0.480 6.259 4.497 345 HD2 LYS 46 1HD LYS 46 0.488 7.182 1.598 346 HD3 LYS 46 2HD LYS 46 0.028 8.119 3.022 347 HE2 LYS 46 1HE LYS 46 2.363 7.764 3.940 348 HE3 LYS 46 2HE LYS 46 2.806 7.036 2.391 349 HZ1 LYS 46 3HZ LYS 46 2.148 9.184 1.341 350 HZ2 LYS 46 1HZ LYS 46 3.376 9.372 2.400 351 HZ3 LYS 46 2HZ LYS 46 1.824 9.810 2.790 352 H ALA 47 H ALA 47 -1.747 2.292 1.908 353 HA ALA 47 HA ALA 47 -1.543 3.187 -0.889 354 HB1 ALA 47 1HB ALA 47 -3.265 1.127 0.503 355 HB2 ALA 47 2HB ALA 47 -3.403 1.515 -1.234 356 HB3 ALA 47 3HB ALA 47 -1.885 0.859 -0.571 357 H ARG 48 H ARG 48 -2.749 4.692 -1.870 358 HA ARG 48 HA ARG 48 -4.599 6.318 -0.351 359 HB2 ARG 48 1HB ARG 48 -2.908 7.109 -2.115 360 HB3 ARG 48 2HB ARG 48 -3.896 6.333 -3.340 361 HG2 ARG 48 1HG ARG 48 -4.811 8.448 -3.451 362 HG3 ARG 48 2HG ARG 48 -5.801 7.845 -2.121 363 HD2 ARG 48 1HD ARG 48 -5.008 9.906 -1.380 364 HD3 ARG 48 2HD ARG 48 -3.963 8.732 -0.550 365 HE ARG 48 HE ARG 48 -2.399 9.206 -2.588 366 HH11 ARG 48 1HH1 ARG 48 -4.009 11.512 -0.479 367 HH12 ARG 48 2HH1 ARG 48 -3.360 12.923 -1.224 368 HH21 ARG 48 1HH2 ARG 48 -1.147 11.071 -3.317 369 HH22 ARG 48 2HH2 ARG 48 -1.596 12.638 -2.786 370 H PHE 49 H PHE 49 -6.698 5.608 -0.109 371 HA PHE 49 HA PHE 49 -8.037 4.316 -2.460 372 HB2 PHE 49 1HB PHE 49 -8.730 4.089 0.495 373 HB3 PHE 49 2HB PHE 49 -9.701 3.499 -0.850 374 HD1 PHE 49 2HD PHE 49 -6.486 3.046 0.887 375 HD2 PHE 49 1HD PHE 49 -9.259 1.375 -1.934 376 HE1 PHE 49 2HE PHE 49 -5.317 0.850 1.024 377 HE2 PHE 49 1HE PHE 49 -8.110 -0.810 -1.768 378 HZ PHE 49 HZ PHE 49 -6.137 -1.071 -0.287 379 H MET 50 H MET 50 -8.742 6.131 -3.508 380 HA MET 50 HA MET 50 -9.879 8.388 -1.952 381 HB2 MET 50 1HB MET 50 -9.795 8.252 -4.959 382 HB3 MET 50 2HB MET 50 -9.919 9.663 -3.925 383 HG2 MET 50 1HG MET 50 -7.427 8.069 -3.673 384 HG3 MET 50 2HG MET 50 -7.669 8.858 -5.218 385 HE1 MET 50 3HE MET 50 -7.298 11.070 -1.183 386 HE2 MET 50 1HE MET 50 -8.873 10.506 -1.793 387 HE3 MET 50 2HE MET 50 -7.599 9.326 -1.398 388 H GLY 51 H GLY 51 -11.939 8.342 -1.543 389 HA2 GLY 51 1HA GLY 51 -14.265 7.965 -1.880 390 HA3 GLY 51 2HA GLY 51 -13.920 6.922 -3.250 391 H TYR 52 H TYR 52 -15.792 6.233 -1.309 392 HA TYR 52 HA TYR 52 -14.837 4.729 0.855 393 HB2 TYR 52 1HB TYR 52 -17.415 5.292 -0.444 394 HB3 TYR 52 2HB TYR 52 -17.364 3.683 0.214 395 HD1 TYR 52 2HD TYR 52 -16.784 3.280 2.670 396 HD2 TYR 52 1HD TYR 52 -17.532 7.195 1.000 397 HE1 TYR 52 2HE TYR 52 -17.199 4.165 4.923 398 HE2 TYR 52 1HE TYR 52 -18.000 8.087 3.251 399 HH TYR 52 HH TYR 52 -17.648 6.089 6.213 400 H THR 53 H THR 53 -13.701 2.947 0.913 401 HA THR 53 HA THR 53 -15.170 0.713 0.069 402 HB THR 53 HB THR 53 -13.553 0.841 -1.875 403 HG1 THR 53 1HG THR 53 -13.780 -1.188 -1.834 404 HG21 THR 53 3HG2 THR 53 -11.208 0.248 -1.519 405 HG22 THR 53 1HG2 THR 53 -11.425 0.195 0.221 406 HG23 THR 53 2HG2 THR 53 -11.567 1.748 -0.630 407 H LYS 54 H LYS 54 -14.906 -0.889 1.540 408 HA LYS 54 HA LYS 54 -12.535 -0.962 3.251 409 HB2 LYS 54 1HB LYS 54 -15.399 -1.136 4.253 410 HB3 LYS 54 2HB LYS 54 -14.046 -1.867 5.131 411 HG2 LYS 54 1HG LYS 54 -13.184 0.785 4.614 412 HG3 LYS 54 2HG LYS 54 -14.869 0.957 4.954 413 HD2 LYS 54 1HD LYS 54 -12.925 -0.573 6.738 414 HD3 LYS 54 2HD LYS 54 -13.275 1.157 6.911 415 HE2 LYS 54 1HE LYS 54 -15.643 0.701 7.286 416 HE3 LYS 54 2HE LYS 54 -15.386 -1.032 7.067 417 HZ1 LYS 54 3HZ LYS 54 -15.471 -0.207 9.410 418 HZ2 LYS 54 1HZ LYS 54 -13.992 0.493 9.187 419 HZ3 LYS 54 2HZ LYS 54 -14.198 -1.156 9.031 420 H LEU 55 H LEU 55 -13.105 -2.118 0.718 421 HA LEU 55 HA LEU 55 -13.471 -5.007 1.333 422 HB2 LEU 55 1HB LEU 55 -14.216 -3.513 -1.188 423 HB3 LEU 55 2HB LEU 55 -14.336 -5.244 -0.922 424 HG LEU 55 HG LEU 55 -15.786 -4.128 1.237 425 HD11 LEU 55 1HD1 LEU 55 -15.820 -1.946 0.063 426 HD12 LEU 55 2HD1 LEU 55 -17.435 -2.665 0.153 427 HD13 LEU 55 3HD1 LEU 55 -16.520 -2.724 -1.367 428 HD21 LEU 55 3HD2 LEU 55 -16.402 -6.182 0.189 429 HD22 LEU 55 1HD2 LEU 55 -16.659 -5.398 -1.376 430 HD23 LEU 55 2HD2 LEU 55 -17.754 -5.047 -0.030 431 H THR 56 H THR 56 -11.005 -3.941 1.702 432 HA THR 56 HA THR 56 -9.307 -4.106 -0.638 433 HB THR 56 HB THR 56 -8.399 -4.513 2.237 434 HG1 THR 56 1HG THR 56 -9.297 -2.761 2.778 435 HG21 THR 56 3HG2 THR 56 -6.527 -3.030 1.409 436 HG22 THR 56 1HG2 THR 56 -7.287 -3.064 -0.196 437 HG23 THR 56 2HG2 THR 56 -6.674 -4.560 0.544 438 H VAL 57 H VAL 57 -7.797 -5.998 -1.184 439 HA VAL 57 HA VAL 57 -8.046 -8.245 0.652 440 HB VAL 57 HB VAL 57 -9.176 -8.207 -1.867 441 HG11 VAL 57 1HG1 VAL 57 -6.763 -9.665 -2.517 442 HG12 VAL 57 2HG1 VAL 57 -8.120 -9.102 -3.542 443 HG13 VAL 57 3HG1 VAL 57 -6.974 -7.919 -2.852 444 HG21 VAL 57 3HG2 VAL 57 -9.356 -10.107 -0.133 445 HG22 VAL 57 1HG2 VAL 57 -9.329 -10.615 -1.827 446 HG23 VAL 57 2HG2 VAL 57 -7.834 -10.724 -0.883 447 H ILE 58 H ILE 58 -5.920 -9.366 0.293 448 HA ILE 58 HA ILE 58 -3.917 -8.189 -1.436 449 HB ILE 58 HB ILE 58 -3.179 -8.742 1.487 450 HG12 ILE 58 1HG1 ILE 58 -3.481 -6.016 0.167 451 HG13 ILE 58 2HG1 ILE 58 -4.557 -6.682 1.395 452 HG21 ILE 58 1HG2 ILE 58 -1.455 -9.157 -0.312 453 HG22 ILE 58 2HG2 ILE 58 -1.592 -7.448 -0.778 454 HG23 ILE 58 3HG2 ILE 58 -0.985 -7.891 0.828 455 HD11 ILE 58 3HD1 ILE 58 -3.176 -5.164 2.504 456 HD12 ILE 58 1HD1 ILE 58 -2.653 -6.789 2.994 457 HD13 ILE 58 2HD1 ILE 58 -1.705 -5.847 1.798 458 H THR 59 H THR 59 -4.019 -10.110 -2.653 459 HA THR 59 HA THR 59 -4.961 -12.560 -1.859 460 HB THR 59 HB THR 59 -2.993 -11.848 -4.044 461 HG1 THR 59 1HG THR 59 -5.820 -11.624 -4.104 462 HG21 THR 59 3HG2 THR 59 -3.378 -14.256 -3.985 463 HG22 THR 59 1HG2 THR 59 -4.033 -13.510 -5.443 464 HG23 THR 59 2HG2 THR 59 -5.130 -13.990 -4.142 465 H GLY 60 H GLY 60 -1.582 -12.313 -2.806 466 HA2 GLY 60 1HA GLY 60 0.455 -12.750 -1.741 467 HA3 GLY 60 2HA GLY 60 -0.367 -13.422 -0.350 468 H LYS 61 H LYS 61 1.575 -14.976 -1.054 469 HA LYS 61 HA LYS 61 1.438 -16.476 -3.455 470 HB2 LYS 61 1HB LYS 61 3.112 -17.917 -2.506 471 HB3 LYS 61 2HB LYS 61 3.454 -16.242 -2.080 472 HG2 LYS 61 1HG LYS 61 2.541 -16.648 0.211 473 HG3 LYS 61 2HG LYS 61 2.225 -18.317 -0.225 474 HD2 LYS 61 1HD LYS 61 4.226 -18.121 1.103 475 HD3 LYS 61 2HD LYS 61 4.567 -18.796 -0.499 476 HE2 LYS 61 1HE LYS 61 5.472 -16.647 -1.247 477 HE3 LYS 61 2HE LYS 61 5.042 -15.892 0.292 478 HZ1 LYS 61 3HZ LYS 61 7.333 -16.453 0.162 479 HZ2 LYS 61 1HZ LYS 61 7.013 -18.056 -0.045 480 HZ3 LYS 61 2HZ LYS 61 6.633 -17.291 1.390 481 H ASP 62 H ASP 62 0.154 -17.070 -0.291 482 HA ASP 62 HA ASP 62 -0.828 -19.652 -0.526 483 HB2 ASP 62 1HB ASP 62 -0.498 -17.792 1.392 484 HB3 ASP 62 2HB ASP 62 -2.194 -17.516 1.070 485 H GLY 63 H GLY 63 -1.996 -16.739 -1.989 486 HA2 GLY 63 1HA GLY 63 -3.704 -16.410 -3.505 487 HA3 GLY 63 2HA GLY 63 -3.956 -18.151 -3.448 488 H LYS 64 H LYS 64 -4.271 -16.567 -0.364 489 HA LYS 64 HA LYS 64 -7.200 -16.935 -0.523 490 HB2 LYS 64 1HB LYS 64 -7.372 -18.197 1.317 491 HB3 LYS 64 2HB LYS 64 -6.561 -18.959 -0.053 492 HG2 LYS 64 1HG LYS 64 -4.427 -18.513 1.084 493 HG3 LYS 64 2HG LYS 64 -5.276 -18.050 2.577 494 HD2 LYS 64 1HD LYS 64 -5.952 -20.609 1.122 495 HD3 LYS 64 2HD LYS 64 -4.524 -20.573 2.142 496 HE2 LYS 64 1HE LYS 64 -6.399 -21.575 3.326 497 HE3 LYS 64 2HE LYS 64 -5.844 -20.110 4.140 498 HZ1 LYS 64 3HZ LYS 64 -7.732 -18.957 3.452 499 HZ2 LYS 64 1HZ LYS 64 -8.348 -20.386 3.908 500 HZ3 LYS 64 2HZ LYS 64 -8.165 -20.074 2.309 501 H ASN 65 H ASN 65 -5.978 -14.560 -0.526 502 HA ASN 65 HA ASN 65 -5.585 -12.596 0.367 503 HB2 ASN 65 1HB ASN 65 -7.943 -12.562 0.111 504 HB3 ASN 65 2HB ASN 65 -8.201 -13.295 1.617 505 HD21 ASN 65 1HD2 ASN 65 -5.897 -10.653 1.267 506 HD22 ASN 65 2HD2 ASN 65 -6.857 -9.530 2.265 507 H LEU 66 H LEU 66 -3.772 -12.285 1.515 508 HA LEU 66 HA LEU 66 -2.962 -13.398 3.953 509 HB2 LEU 66 1HB LEU 66 -2.380 -10.586 2.917 510 HB3 LEU 66 2HB LEU 66 -1.474 -11.428 4.173 511 HG LEU 66 HG LEU 66 -1.673 -12.258 1.249 512 HD11 LEU 66 1HD1 LEU 66 0.671 -11.173 2.850 513 HD12 LEU 66 2HD1 LEU 66 -0.250 -10.286 1.608 514 HD13 LEU 66 3HD1 LEU 66 0.717 -11.702 1.163 515 HD21 LEU 66 3HD2 LEU 66 -0.182 -13.508 3.596 516 HD22 LEU 66 1HD2 LEU 66 0.096 -13.925 1.890 517 HD23 LEU 66 2HD2 LEU 66 -1.466 -14.240 2.625 518 H LEU 67 H LEU 67 -5.117 -10.590 3.505 519 HA LEU 67 HA LEU 67 -5.193 -9.802 6.250 520 HB2 LEU 67 1HB LEU 67 -7.406 -9.533 4.184 521 HB3 LEU 67 2HB LEU 67 -7.207 -8.637 5.653 522 HG LEU 67 HG LEU 67 -5.314 -8.364 3.315 523 HD11 LEU 67 1HD1 LEU 67 -7.608 -6.549 4.180 524 HD12 LEU 67 2HD1 LEU 67 -7.647 -7.614 2.775 525 HD13 LEU 67 3HD1 LEU 67 -6.491 -6.265 2.832 526 HD21 LEU 67 3HD2 LEU 67 -4.603 -6.304 4.462 527 HD22 LEU 67 1HD2 LEU 67 -4.348 -7.708 5.507 528 HD23 LEU 67 2HD2 LEU 67 -5.724 -6.640 5.807 529 H TYR 68 H TYR 68 -7.017 -12.151 4.259 530 HA TYR 68 HA TYR 68 -9.072 -12.636 6.132 531 HB2 TYR 68 1HB TYR 68 -9.010 -12.936 3.582 532 HB3 TYR 68 2HB TYR 68 -8.057 -14.357 3.840 533 HD1 TYR 68 2HD TYR 68 -11.031 -13.426 5.959 534 HD2 TYR 68 1HD TYR 68 -9.385 -16.075 2.966 535 HE1 TYR 68 2HE TYR 68 -12.920 -14.955 6.278 536 HE2 TYR 68 1HE TYR 68 -11.334 -17.568 3.229 537 HH TYR 68 HH TYR 68 -13.639 -17.277 5.857 538 H ASN 69 H ASN 69 -5.882 -14.070 5.616 539 HA ASN 69 HA ASN 69 -6.315 -16.132 7.707 540 HB2 ASN 69 1HB ASN 69 -3.910 -15.242 6.096 541 HB3 ASN 69 2HB ASN 69 -3.657 -15.965 7.682 542 HD21 ASN 69 1HD2 ASN 69 -2.707 -17.218 5.346 543 HD22 ASN 69 2HD2 ASN 69 -3.441 -18.792 5.345 544 H GLY 70 H GLY 70 -4.190 -13.195 7.546 545 HA2 GLY 70 1HA GLY 70 -5.074 -11.511 9.239 546 HA3 GLY 70 2HA GLY 70 -4.791 -12.773 10.437 547 H THR 71 H THR 71 -2.184 -13.049 8.225 548 HA THR 71 HA THR 71 -0.339 -11.899 10.059 549 HB THR 71 HB THR 71 0.312 -11.943 7.120 550 HG1 THR 71 1HG THR 71 -0.191 -14.297 8.581 551 HG21 THR 71 3HG2 THR 71 2.381 -13.052 7.980 552 HG22 THR 71 1HG2 THR 71 1.736 -12.931 9.625 553 HG23 THR 71 2HG2 THR 71 2.084 -11.457 8.687 554 H ALA 72 H ALA 72 -1.754 -10.741 7.013 555 HA ALA 72 HA ALA 72 -0.773 -7.978 7.462 556 HB1 ALA 72 1HB ALA 72 -0.790 -8.972 5.140 557 HB2 ALA 72 2HB ALA 72 -2.547 -9.159 5.257 558 HB3 ALA 72 3HB ALA 72 -1.817 -7.531 5.276 559 H LYS 73 H LYS 73 -1.909 -6.399 8.170 560 HA LYS 73 HA LYS 73 -4.811 -6.707 8.619 561 HB2 LYS 73 1HB LYS 73 -3.739 -7.677 10.538 562 HB3 LYS 73 2HB LYS 73 -2.651 -6.294 10.728 563 HG2 LYS 73 1HG LYS 73 -4.135 -5.154 11.922 564 HG3 LYS 73 2HG LYS 73 -5.446 -5.469 10.772 565 HD2 LYS 73 1HD LYS 73 -5.881 -7.666 11.680 566 HD3 LYS 73 2HD LYS 73 -4.557 -7.507 12.844 567 HE2 LYS 73 1HE LYS 73 -5.693 -5.838 14.097 568 HE3 LYS 73 2HE LYS 73 -6.884 -5.550 12.821 569 HZ1 LYS 73 3HZ LYS 73 -7.912 -7.579 13.256 570 HZ2 LYS 73 1HZ LYS 73 -7.622 -6.954 14.751 571 HZ3 LYS 73 2HZ LYS 73 -6.667 -8.153 14.193 572 H MET 74 H MET 74 -5.872 -4.786 8.611 573 HA MET 74 HA MET 74 -4.414 -2.318 8.007 574 HB2 MET 74 1HB MET 74 -6.877 -2.890 7.170 575 HB3 MET 74 2HB MET 74 -7.328 -2.687 8.809 576 HG2 MET 74 1HG MET 74 -5.659 -0.678 7.240 577 HG3 MET 74 2HG MET 74 -7.414 -0.656 7.160 578 HE1 MET 74 3HE MET 74 -8.935 0.554 8.964 579 HE2 MET 74 1HE MET 74 -8.629 -1.203 9.142 580 HE3 MET 74 2HE MET 74 -8.621 -0.127 10.586 581 H PHE 75 H PHE 75 -3.394 -1.358 9.753 582 HA PHE 75 HA PHE 75 -4.520 -1.843 12.479 583 HB2 PHE 75 1HB PHE 75 -2.376 -2.054 13.359 584 HB3 PHE 75 2HB PHE 75 -2.459 -3.131 11.983 585 HD1 PHE 75 1HD PHE 75 -1.367 -2.335 9.740 586 HD2 PHE 75 2HD PHE 75 -0.636 -0.467 13.568 587 HE1 PHE 75 1HE PHE 75 0.787 -1.417 8.901 588 HE2 PHE 75 2HE PHE 75 1.516 0.391 12.728 589 HZ PHE 75 HZ PHE 75 2.254 -0.124 10.414 590 H LYS 76 H LYS 76 -3.996 0.661 10.203 591 HA LYS 76 HA LYS 76 -4.151 2.774 12.221 592 HB2 LYS 76 1HB LYS 76 -1.765 2.328 12.217 593 HB3 LYS 76 2HB LYS 76 -1.734 2.162 10.476 594 HG2 LYS 76 1HG LYS 76 -2.284 4.663 10.336 595 HG3 LYS 76 2HG LYS 76 -2.000 4.723 12.083 596 HD2 LYS 76 1HD LYS 76 0.294 3.849 11.771 597 HD3 LYS 76 2HD LYS 76 -0.010 3.598 10.058 598 HE2 LYS 76 1HE LYS 76 1.243 5.527 10.052 599 HE3 LYS 76 2HE LYS 76 -0.409 6.125 9.859 600 HZ1 LYS 76 3HZ LYS 76 1.076 6.019 12.404 601 HZ2 LYS 76 1HZ LYS 76 -0.400 6.740 12.185 602 HZ3 LYS 76 2HZ LYS 76 0.970 7.344 11.472 603 H SER 77 H SER 77 -5.435 4.414 11.167 604 HA SER 77 HA SER 77 -5.703 4.376 8.206 605 HB2 SER 77 1HB SER 77 -8.202 4.291 8.562 606 HB3 SER 77 2HB SER 77 -7.327 2.778 8.733 607 HG SER 77 HG SER 77 -7.589 4.173 11.097 608 H ASP 78 H ASP 78 -5.365 6.653 7.697 609 HA ASP 78 HA ASP 78 -6.364 8.605 9.736 610 HB2 ASP 78 1HB ASP 78 -3.753 8.298 8.881 611 HB3 ASP 78 2HB ASP 78 -4.384 9.357 7.639 612 H ALA 79 H ALA 79 -6.890 10.663 8.681 613 HA ALA 79 HA ALA 79 -8.738 10.237 6.391 614 HB1 ALA 79 1HB ALA 79 -8.179 12.626 8.208 615 HB2 ALA 79 2HB ALA 79 -9.479 12.528 6.989 616 HB3 ALA 79 3HB ALA 79 -9.501 11.462 8.420 617 H ILE 80 H ILE 80 -8.526 11.406 4.489 618 HA ILE 80 HA ILE 80 -6.031 12.998 4.104 619 HB ILE 80 HB ILE 80 -7.652 11.599 1.959 620 HG12 ILE 80 1HG1 ILE 80 -5.009 10.729 3.199 621 HG13 ILE 80 2HG1 ILE 80 -6.552 9.894 3.345 622 HG21 ILE 80 1HG2 ILE 80 -5.855 12.294 0.464 623 HG22 ILE 80 2HG2 ILE 80 -6.425 13.707 1.331 624 HG23 ILE 80 3HG2 ILE 80 -4.911 12.940 1.834 625 HD11 ILE 80 3HD1 ILE 80 -6.605 9.670 0.821 626 HD12 ILE 80 1HD1 ILE 80 -4.904 10.228 0.854 627 HD13 ILE 80 2HD1 ILE 80 -5.373 8.722 1.653 628 H LEU 81 H LEU 81 -6.840 14.917 4.726 629 HA LEU 81 HA LEU 81 -9.475 15.846 3.778 630 HB2 LEU 81 1HB LEU 81 -7.287 17.482 5.097 631 HB3 LEU 81 2HB LEU 81 -8.933 17.979 4.749 632 HG LEU 81 HG LEU 81 -7.947 16.045 6.865 633 HD11 LEU 81 1HD1 LEU 81 -9.853 18.428 6.986 634 HD12 LEU 81 2HD1 LEU 81 -8.107 18.511 7.312 635 HD13 LEU 81 3HD1 LEU 81 -9.160 17.538 8.356 636 HD21 LEU 81 3HD2 LEU 81 -9.863 14.862 5.889 637 HD22 LEU 81 1HD2 LEU 81 -10.849 16.336 5.969 638 HD23 LEU 81 2HD2 LEU 81 -10.300 15.532 7.454 639 H GLY 82 H GLY 82 -9.688 16.930 1.890 640 HA2 GLY 82 1HA GLY 82 -7.425 17.472 0.102 641 HA3 GLY 82 2HA GLY 82 -9.124 17.908 -0.169 642 H GLN 83 H GLN 83 -9.013 20.084 -0.566 643 HA GLN 83 HA GLN 83 -7.592 21.849 1.351 644 HB2 GLN 83 1HB GLN 83 -7.434 23.435 -0.427 645 HB3 GLN 83 2HB GLN 83 -6.709 21.917 -0.908 646 HG2 GLN 83 1HG GLN 83 -9.551 22.549 -1.733 647 HG3 GLN 83 2HG GLN 83 -8.211 23.328 -2.544 648 HE21 GLN 83 1HE2 GLN 83 -8.399 22.376 -4.601 649 HE22 GLN 83 2HE2 GLN 83 -8.000 20.713 -4.865 650 H ASN 84 H ASN 84 -10.559 20.712 1.143 651 HA ASN 84 HA ASN 84 -11.753 23.143 2.339 652 HB2 ASN 84 1HB ASN 84 -13.274 21.518 0.248 653 HB3 ASN 84 2HB ASN 84 -13.896 22.844 1.210 654 HD21 ASN 84 1HD2 ASN 84 -11.867 22.000 -1.552 655 HD22 ASN 84 2HD2 ASN 84 -11.679 23.640 -2.140 656 H LYS 85 H LYS 85 -10.618 20.987 3.662 657 HA LYS 85 HA LYS 85 -10.857 19.328 5.138 658 HB2 LYS 85 1HB LYS 85 -13.645 20.431 5.525 659 HB3 LYS 85 2HB LYS 85 -12.772 19.397 6.658 660 HG2 LYS 85 1HG LYS 85 -11.009 21.090 6.941 661 HG3 LYS 85 2HG LYS 85 -11.842 22.164 5.808 662 HD2 LYS 85 1HD LYS 85 -12.883 21.276 8.517 663 HD3 LYS 85 2HD LYS 85 -12.259 22.878 8.082 664 HE2 LYS 85 1HE LYS 85 -14.075 23.044 6.319 665 HE3 LYS 85 2HE LYS 85 -14.729 21.515 6.928 666 HZ1 LYS 85 3HZ LYS 85 -14.908 22.705 9.129 667 HZ2 LYS 85 1HZ LYS 85 -15.947 23.116 7.924 668 HZ3 LYS 85 2HZ LYS 85 -14.691 24.112 8.273 669 H VAL 86 H VAL 86 -12.021 18.905 2.313 670 HA VAL 86 HA VAL 86 -14.091 16.982 2.464 671 HB VAL 86 HB VAL 86 -12.045 17.075 0.205 672 HG11 VAL 86 1HG1 VAL 86 -15.068 16.690 0.256 673 HG12 VAL 86 2HG1 VAL 86 -14.035 16.643 -1.187 674 HG13 VAL 86 3HG1 VAL 86 -13.857 15.404 0.061 675 HG21 VAL 86 3HG2 VAL 86 -12.346 19.376 0.497 676 HG22 VAL 86 1HG2 VAL 86 -13.363 18.896 -0.844 677 HG23 VAL 86 2HG2 VAL 86 -14.100 19.202 0.747 678 H VAL 87 H VAL 87 -13.818 14.984 3.527 679 HA VAL 87 HA VAL 87 -11.267 13.621 3.631 680 HB VAL 87 HB VAL 87 -14.061 12.525 4.130 681 HG11 VAL 87 1HG1 VAL 87 -12.290 10.784 3.828 682 HG12 VAL 87 2HG1 VAL 87 -11.306 11.580 5.069 683 HG13 VAL 87 3HG1 VAL 87 -12.877 10.865 5.491 684 HG21 VAL 87 3HG2 VAL 87 -13.676 14.426 5.652 685 HG22 VAL 87 1HG2 VAL 87 -13.566 12.898 6.526 686 HG23 VAL 87 2HG2 VAL 87 -12.086 13.770 6.095 687 H ILE 88 H ILE 88 -10.637 13.720 1.410 688 HA ILE 88 HA ILE 88 -12.283 12.603 -0.718 689 HB ILE 88 HB ILE 88 -10.195 12.798 -2.083 690 HG12 ILE 88 1HG1 ILE 88 -8.969 14.255 0.301 691 HG13 ILE 88 2HG1 ILE 88 -8.565 12.590 -0.105 692 HG21 ILE 88 1HG2 ILE 88 -11.948 14.550 -1.849 693 HG22 ILE 88 2HG2 ILE 88 -10.998 15.282 -0.533 694 HG23 ILE 88 3HG2 ILE 88 -10.341 15.233 -2.178 695 HD11 ILE 88 3HD1 ILE 88 -6.885 14.059 -1.049 696 HD12 ILE 88 1HD1 ILE 88 -7.821 13.356 -2.381 697 HD13 ILE 88 2HD1 ILE 88 -8.108 15.034 -1.866 698 H GLY 89 H GLY 89 -10.067 11.242 1.596 699 HA2 GLY 89 1HA GLY 89 -10.785 8.577 0.890 700 HA3 GLY 89 2HA GLY 89 -9.151 8.946 0.310 701 H TRP 90 H TRP 90 -8.783 7.172 1.906 702 HA TRP 90 HA TRP 90 -7.815 8.403 4.380 703 HB2 TRP 90 1HB TRP 90 -9.180 5.712 4.237 704 HB3 TRP 90 2HB TRP 90 -8.360 6.340 5.653 705 HD1 TRP 90 HD TRP 90 -9.652 8.330 6.946 706 HE1 TRP 90 1HE TRP 90 -12.105 9.197 6.893 707 HE3 TRP 90 3HE TRP 90 -11.198 5.995 2.725 708 HZ2 TRP 90 2HZ TRP 90 -14.448 8.784 5.268 709 HZ3 TRP 90 3HZ TRP 90 -13.537 6.264 1.885 710 HH2 TRP 90 HH TRP 90 -15.163 7.645 3.162 711 H ASP 91 H ASP 91 -5.722 7.570 4.858 712 HA ASP 91 HA ASP 91 -4.480 6.650 2.358 713 HB2 ASP 91 1HB ASP 91 -3.958 8.768 4.137 714 HB3 ASP 91 2HB ASP 91 -2.663 7.640 4.408 715 H LYS 92 H LYS 92 -5.361 4.635 2.941 716 HA LYS 92 HA LYS 92 -5.182 3.433 5.418 717 HB2 LYS 92 1HB LYS 92 -5.585 2.255 2.671 718 HB3 LYS 92 2HB LYS 92 -5.329 1.144 3.977 719 HG2 LYS 92 1HG LYS 92 -7.628 1.252 3.381 720 HG3 LYS 92 2HG LYS 92 -7.368 1.655 5.055 721 HD2 LYS 92 1HD LYS 92 -7.767 3.966 4.668 722 HD3 LYS 92 2HD LYS 92 -7.881 3.746 2.905 723 HE2 LYS 92 1HE LYS 92 -9.695 2.210 4.811 724 HE3 LYS 92 2HE LYS 92 -10.106 3.864 4.360 725 HZ1 LYS 92 3HZ LYS 92 -10.376 3.207 2.099 726 HZ2 LYS 92 1HZ LYS 92 -11.171 2.108 2.993 727 HZ3 LYS 92 2HZ LYS 92 -9.729 1.699 2.380 728 H TYR 93 H TYR 93 -3.663 2.537 6.632 729 HA TYR 93 HA TYR 93 -1.151 1.664 5.412 730 HB2 TYR 93 1HB TYR 93 -1.948 1.996 8.306 731 HB3 TYR 93 2HB TYR 93 -0.354 1.579 7.755 732 HD1 TYR 93 1HD TYR 93 -2.883 4.308 7.875 733 HD2 TYR 93 2HD TYR 93 1.165 3.261 6.822 734 HE1 TYR 93 1HE TYR 93 -2.237 6.689 7.959 735 HE2 TYR 93 2HE TYR 93 1.761 5.651 6.687 736 HH TYR 93 HH TYR 93 -0.688 8.231 7.010 737 H PHE 94 H PHE 94 -0.438 -0.463 5.585 738 HA PHE 94 HA PHE 94 -2.092 -2.492 6.951 739 HB2 PHE 94 1HB PHE 94 -1.163 -2.542 4.039 740 HB3 PHE 94 2HB PHE 94 -1.594 -3.994 4.925 741 HD1 PHE 94 2HD PHE 94 -3.895 -4.377 5.780 742 HD2 PHE 94 1HD PHE 94 -2.959 -1.020 3.237 743 HE1 PHE 94 2HE PHE 94 -6.302 -4.105 5.263 744 HE2 PHE 94 1HE PHE 94 -5.376 -0.755 2.728 745 HZ PHE 94 HZ PHE 94 -7.050 -2.260 3.775 746 H GLU 95 H GLU 95 -0.817 -4.263 7.762 747 HA GLU 95 HA GLU 95 2.138 -3.927 7.475 748 HB2 GLU 95 1HB GLU 95 0.890 -3.858 9.727 749 HB3 GLU 95 2HB GLU 95 0.655 -5.549 9.602 750 HG2 GLU 95 1HG GLU 95 3.077 -5.975 9.408 751 HG3 GLU 95 2HG GLU 95 3.407 -4.247 9.252 752 H ILE 96 H ILE 96 2.456 -5.169 5.483 753 HA ILE 96 HA ILE 96 1.177 -7.834 5.484 754 HB ILE 96 HB ILE 96 2.859 -6.778 3.200 755 HG12 ILE 96 1HG1 ILE 96 0.455 -6.292 2.204 756 HG13 ILE 96 2HG1 ILE 96 -0.035 -6.092 3.886 757 HG21 ILE 96 1HG2 ILE 96 1.367 -8.263 1.889 758 HG22 ILE 96 2HG2 ILE 96 2.226 -9.158 3.130 759 HG23 ILE 96 3HG2 ILE 96 0.519 -8.724 3.366 760 HD11 ILE 96 3HD1 ILE 96 1.576 -4.196 4.071 761 HD12 ILE 96 1HD1 ILE 96 2.199 -4.600 2.456 762 HD13 ILE 96 2HD1 ILE 96 0.540 -3.989 2.657 763 HA PRO 97 HA PRO 97 5.222 -9.755 6.638 764 HB2 PRO 97 1HB PRO 97 4.768 -12.209 5.453 765 HB3 PRO 97 2HB PRO 97 4.107 -11.762 7.060 766 HG2 PRO 97 1HG PRO 97 2.789 -11.559 4.332 767 HG3 PRO 97 2HG PRO 97 2.135 -12.367 5.788 768 HD2 PRO 97 1HD PRO 97 1.432 -9.889 5.175 769 HD3 PRO 97 2HD PRO 97 1.810 -10.217 6.875 770 H MET 98 H MET 98 6.995 -10.377 5.332 771 HA MET 98 HA MET 98 6.806 -9.814 2.420 772 HB2 MET 98 1HB MET 98 9.171 -10.394 4.222 773 HB3 MET 98 2HB MET 98 9.290 -10.502 2.458 774 HG2 MET 98 1HG MET 98 8.690 -8.213 2.144 775 HG3 MET 98 2HG MET 98 8.260 -8.001 3.840 776 HE1 MET 98 3HE MET 98 10.374 -5.904 2.335 777 HE2 MET 98 1HE MET 98 9.544 -5.877 3.898 778 HE3 MET 98 2HE MET 98 11.301 -5.690 3.836 779 H ASP 99 H ASP 99 7.455 -12.591 4.710 780 HA ASP 99 HA ASP 99 8.080 -14.409 2.634 781 HB2 ASP 99 1HB ASP 99 8.786 -14.400 5.091 782 HB3 ASP 99 2HB ASP 99 7.237 -15.161 5.444 783 H ALA 100 H ALA 100 5.123 -13.237 3.047 784 HA ALA 100 HA ALA 100 3.832 -15.753 2.065 785 HB1 ALA 100 1HB ALA 100 2.307 -13.615 3.550 786 HB2 ALA 100 2HB ALA 100 1.767 -15.230 3.051 787 HB3 ALA 100 3HB ALA 100 2.982 -15.074 4.321 788 H LEU 101 H LEU 101 5.139 -12.984 0.924 789 HA LEU 101 HA LEU 101 2.943 -12.095 -0.808 790 HB2 LEU 101 1HB LEU 101 5.926 -11.500 -0.771 791 HB3 LEU 101 2HB LEU 101 4.808 -10.789 -1.929 792 HG LEU 101 HG LEU 101 4.568 -10.499 1.093 793 HD11 LEU 101 1HD1 LEU 101 5.552 -8.514 -0.995 794 HD12 LEU 101 2HD1 LEU 101 6.549 -9.378 0.198 795 HD13 LEU 101 3HD1 LEU 101 5.354 -8.202 0.755 796 HD21 LEU 101 3HD2 LEU 101 3.021 -9.191 -1.189 797 HD22 LEU 101 1HD2 LEU 101 2.984 -8.651 0.498 798 HD23 LEU 101 2HD2 LEU 101 2.360 -10.256 0.083 799 H GLN 102 H GLN 102 2.892 -12.340 -3.060 800 HA GLN 102 HA GLN 102 3.188 -15.052 -3.853 801 HB2 GLN 102 1HB GLN 102 1.357 -13.308 -4.313 802 HB3 GLN 102 2HB GLN 102 2.490 -12.556 -5.451 803 HG2 GLN 102 1HG GLN 102 2.562 -14.719 -6.707 804 HG3 GLN 102 2HG GLN 102 1.401 -15.374 -5.535 805 HE21 GLN 102 1HE2 GLN 102 -0.679 -15.403 -6.499 806 HE22 GLN 102 2HE2 GLN 102 -1.242 -14.126 -7.588 807 H ASP 103 H ASP 103 5.260 -12.285 -4.132 808 HA ASP 103 HA ASP 103 7.180 -13.544 -5.898 809 HB2 ASP 103 1HB ASP 103 5.168 -12.503 -7.288 810 HB3 ASP 103 2HB ASP 103 5.875 -10.961 -6.829 811 H ASN 104 H ASN 104 8.826 -11.503 -6.430 812 HA ASN 104 HA ASN 104 9.505 -10.023 -4.018 813 HB2 ASN 104 1HB ASN 104 10.525 -9.978 -6.899 814 HB3 ASN 104 2HB ASN 104 11.060 -8.847 -5.670 815 HD21 ASN 104 1HD2 ASN 104 12.999 -9.312 -5.193 816 HD22 ASN 104 2HD2 ASN 104 13.699 -10.858 -4.772 817 H SER 105 H SER 105 6.679 -9.559 -5.262 818 HA SER 105 HA SER 105 6.945 -6.644 -5.378 819 HB2 SER 105 1HB SER 105 5.525 -6.372 -7.355 820 HB3 SER 105 2HB SER 105 6.973 -7.295 -7.714 821 HG SER 105 HG SER 105 5.993 -8.950 -8.157 822 H ILE 106 H ILE 106 5.084 -5.538 -4.936 823 HA ILE 106 HA ILE 106 2.986 -7.066 -3.458 824 HB ILE 106 HB ILE 106 4.503 -5.972 -1.995 825 HG12 ILE 106 1HG1 ILE 106 2.020 -6.076 -1.490 826 HG13 ILE 106 2HG1 ILE 106 3.084 -5.093 -0.497 827 HG21 ILE 106 1HG2 ILE 106 4.702 -3.497 -1.858 828 HG22 ILE 106 2HG2 ILE 106 5.444 -4.226 -3.274 829 HG23 ILE 106 3HG2 ILE 106 3.886 -3.391 -3.438 830 HD11 ILE 106 3HD1 ILE 106 1.333 -3.919 -2.688 831 HD12 ILE 106 1HD1 ILE 106 0.893 -4.016 -0.970 832 HD13 ILE 106 2HD1 ILE 106 2.276 -3.037 -1.479 833 H GLN 107 H GLN 107 0.920 -6.223 -3.573 834 HA GLN 107 HA GLN 107 0.056 -4.113 -5.269 835 HB2 GLN 107 1HB GLN 107 0.209 -5.753 -7.077 836 HB3 GLN 107 2HB GLN 107 -0.537 -7.012 -6.078 837 HG2 GLN 107 1HG GLN 107 -2.671 -5.824 -6.079 838 HG3 GLN 107 2HG GLN 107 -1.943 -4.445 -6.924 839 HE21 GLN 107 1HE2 GLN 107 -2.602 -4.413 -9.027 840 HE22 GLN 107 2HE2 GLN 107 -2.883 -5.825 -10.019 841 H ILE 108 H ILE 108 -2.256 -3.776 -4.761 842 HA ILE 108 HA ILE 108 -3.511 -5.470 -2.725 843 HB ILE 108 HB ILE 108 -3.352 -2.409 -2.675 844 HG12 ILE 108 1HG1 ILE 108 -2.089 -4.487 -0.822 845 HG13 ILE 108 2HG1 ILE 108 -1.255 -3.326 -1.848 846 HG21 ILE 108 1HG2 ILE 108 -4.753 -4.330 -0.788 847 HG22 ILE 108 2HG2 ILE 108 -4.656 -2.580 -0.595 848 HG23 ILE 108 3HG2 ILE 108 -5.554 -3.245 -1.954 849 HD11 ILE 108 3HD1 ILE 108 -2.817 -2.695 0.666 850 HD12 ILE 108 1HD1 ILE 108 -1.088 -2.523 0.369 851 HD13 ILE 108 2HD1 ILE 108 -2.235 -1.466 -0.485 852 H LYS 109 H LYS 109 -6.023 -5.432 -3.233 853 HA LYS 109 HA LYS 109 -6.695 -3.579 -5.414 854 HB2 LYS 109 1HB LYS 109 -7.788 -5.307 -6.761 855 HB3 LYS 109 2HB LYS 109 -6.049 -5.552 -6.686 856 HG2 LYS 109 1HG LYS 109 -7.197 -7.033 -4.568 857 HG3 LYS 109 2HG LYS 109 -8.246 -7.302 -5.885 858 HD2 LYS 109 1HD LYS 109 -6.592 -9.055 -5.738 859 HD3 LYS 109 2HD LYS 109 -6.377 -8.206 -7.245 860 HE2 LYS 109 1HE LYS 109 -4.353 -7.105 -6.444 861 HE3 LYS 109 2HE LYS 109 -4.689 -7.656 -4.775 862 HZ1 LYS 109 3HZ LYS 109 -3.043 -9.094 -5.865 863 HZ2 LYS 109 1HZ LYS 109 -4.080 -9.467 -7.043 864 HZ3 LYS 109 2HZ LYS 109 -4.390 -9.943 -5.504 865 H ALA 110 H ALA 110 -8.968 -3.059 -5.198 866 HA ALA 110 HA ALA 110 -10.409 -4.580 -3.090 867 HB1 ALA 110 1HB ALA 110 -9.433 -2.535 -2.008 868 HB2 ALA 110 2HB ALA 110 -10.244 -1.518 -3.217 869 HB3 ALA 110 3HB ALA 110 -11.204 -2.443 -2.051 870 H LEU 111 H LEU 111 -12.714 -4.314 -3.098 871 HA LEU 111 HA LEU 111 -13.931 -3.888 -5.729 872 HB2 LEU 111 1HB LEU 111 -14.794 -5.552 -3.984 873 HB3 LEU 111 2HB LEU 111 -15.292 -4.160 -3.032 874 HG LEU 111 HG LEU 111 -16.662 -3.419 -5.117 875 HD11 LEU 111 1HD1 LEU 111 -15.623 -5.022 -6.728 876 HD12 LEU 111 2HD1 LEU 111 -17.375 -5.221 -6.596 877 HD13 LEU 111 3HD1 LEU 111 -16.289 -6.369 -5.787 878 HD21 LEU 111 3HD2 LEU 111 -17.727 -4.246 -3.086 879 HD22 LEU 111 1HD2 LEU 111 -17.462 -5.928 -3.606 880 HD23 LEU 111 2HD2 LEU 111 -18.548 -4.868 -4.526 881 H SER 112 H SER 112 -14.830 -2.015 -6.463 882 HA SER 112 HA SER 112 -15.059 0.350 -4.700 883 HB2 SER 112 1HB SER 112 -14.191 0.691 -6.986 884 HB3 SER 112 2HB SER 112 -15.658 -0.027 -7.675 885 HG SER 112 HG SER 112 -15.689 2.291 -7.575 886 H SER 113 H SER 113 -17.319 -1.157 -7.082 887 HA SER 113 HA SER 113 -19.507 -1.210 -5.115 888 HB2 SER 113 1HB SER 113 -19.037 1.171 -6.246 889 HB3 SER 113 2HB SER 113 -19.785 0.418 -7.658 890 HG SER 113 HG SER 113 -20.779 0.934 -5.066 891 H GLY 114 H GLY 114 -21.430 -2.287 -6.116 892 HA2 GLY 114 1HA GLY 114 -22.356 -4.043 -7.274 893 HA3 GLY 114 2HA GLY 114 -21.590 -3.343 -8.705 894 H THR 115 H THR 115 -20.135 -4.687 -9.748 895 HA THR 115 HA THR 115 -18.732 -6.819 -8.231 896 HB THR 115 HB THR 115 -18.316 -7.583 -10.654 897 HG1 THR 115 1HG THR 115 -19.809 -6.756 -12.141 898 HG21 THR 115 3HG2 THR 115 -21.210 -7.428 -9.700 899 HG22 THR 115 1HG2 THR 115 -19.994 -8.623 -9.149 900 HG23 THR 115 2HG2 THR 115 -20.544 -8.619 -10.825 901 H THR 116 H THR 116 -18.316 -3.789 -9.633 902 HA THR 116 HA THR 116 -16.004 -3.794 -11.091 903 HB THR 116 HB THR 116 -16.714 -1.398 -9.469 904 HG1 THR 116 1HG THR 116 -18.706 -2.033 -9.632 905 HG21 THR 116 3HG2 THR 116 -15.301 -0.966 -11.294 906 HG22 THR 116 1HG2 THR 116 -16.874 -0.295 -11.711 907 HG23 THR 116 2HG2 THR 116 -16.365 -1.840 -12.436 908 H PHE 117 H PHE 117 -14.089 -4.418 -10.426 909 HA PHE 117 HA PHE 117 -13.131 -3.834 -7.664 910 HB2 PHE 117 1HB PHE 117 -13.376 -6.283 -9.046 911 HB3 PHE 117 2HB PHE 117 -11.678 -5.887 -9.159 912 HD1 PHE 117 1HD PHE 117 -10.327 -5.558 -6.991 913 HD2 PHE 117 2HD PHE 117 -14.337 -7.133 -7.075 914 HE1 PHE 117 1HE PHE 117 -10.031 -6.491 -4.693 915 HE2 PHE 117 2HE PHE 117 -14.039 -8.033 -4.779 916 HZ PHE 117 HZ PHE 117 -11.882 -7.677 -3.573 917 H VAL 118 H VAL 118 -11.027 -3.000 -7.465 918 HA VAL 118 HA VAL 118 -9.874 -1.773 -9.918 919 HB VAL 118 HB VAL 118 -10.023 -0.555 -7.128 920 HG11 VAL 118 1HG1 VAL 118 -9.389 0.712 -9.824 921 HG12 VAL 118 2HG1 VAL 118 -9.325 1.506 -8.233 922 HG13 VAL 118 3HG1 VAL 118 -8.171 0.226 -8.640 923 HG21 VAL 118 3HG2 VAL 118 -11.834 0.024 -9.509 924 HG22 VAL 118 1HG2 VAL 118 -12.330 -0.630 -7.930 925 HG23 VAL 118 2HG2 VAL 118 -11.723 1.024 -8.043 926 H TYR 119 H TYR 119 -7.684 -2.109 -10.097 927 HA TYR 119 HA TYR 119 -6.355 -3.654 -7.923 928 HB2 TYR 119 1HB TYR 119 -6.050 -3.838 -10.939 929 HB3 TYR 119 2HB TYR 119 -5.153 -4.773 -9.757 930 HD1 TYR 119 2HD TYR 119 -8.606 -4.114 -11.022 931 HD2 TYR 119 1HD TYR 119 -6.023 -6.860 -8.984 932 HE1 TYR 119 2HE TYR 119 -10.384 -5.767 -11.104 933 HE2 TYR 119 1HE TYR 119 -7.836 -8.574 -9.005 934 HH TYR 119 HH TYR 119 -11.055 -7.858 -10.468 935 H SER 120 H SER 120 -4.496 -2.788 -7.063 936 HA SER 120 HA SER 120 -3.741 -0.151 -7.994 937 HB2 SER 120 1HB SER 120 -2.472 -0.028 -6.050 938 HB3 SER 120 2HB SER 120 -3.740 -1.030 -5.544 939 HG SER 120 HG SER 120 -1.234 -2.023 -6.474 940 H GLN 121 H GLN 121 -1.524 0.387 -8.536 941 HA GLN 121 HA GLN 121 -0.478 -1.237 -10.619 942 HB2 GLN 121 1HB GLN 121 1.448 0.329 -10.654 943 HB3 GLN 121 2HB GLN 121 -0.137 1.095 -10.726 944 HG2 GLN 121 1HG GLN 121 0.069 1.675 -8.284 945 HG3 GLN 121 2HG GLN 121 1.679 0.958 -8.294 946 HE21 GLN 121 1HE2 GLN 121 2.527 3.076 -7.645 947 HE22 GLN 121 2HE2 GLN 121 2.664 4.324 -8.881 948 H LYS 122 H LYS 122 1.368 -2.473 -10.804 949 HA LYS 122 HA LYS 122 1.993 -4.155 -8.470 950 HB2 LYS 122 1HB LYS 122 1.598 -4.818 -11.036 951 HB3 LYS 122 2HB LYS 122 3.272 -4.296 -11.219 952 HG2 LYS 122 1HG LYS 122 3.840 -5.942 -9.316 953 HG3 LYS 122 2HG LYS 122 2.183 -6.545 -9.478 954 HD2 LYS 122 1HD LYS 122 2.612 -7.087 -11.864 955 HD3 LYS 122 2HD LYS 122 4.260 -6.452 -11.713 956 HE2 LYS 122 1HE LYS 122 4.660 -8.145 -9.886 957 HE3 LYS 122 2HE LYS 122 3.078 -8.850 -10.260 958 HZ1 LYS 122 3HZ LYS 122 5.519 -8.810 -11.900 959 HZ2 LYS 122 1HZ LYS 122 4.061 -9.050 -12.622 960 HZ3 LYS 122 2HZ LYS 122 4.599 -10.077 -11.462 961 H ILE 123 H ILE 123 4.054 -4.057 -7.382 962 HA ILE 123 HA ILE 123 6.141 -2.400 -8.592 963 HB ILE 123 HB ILE 123 5.170 -1.957 -5.755 964 HG12 ILE 123 1HG1 ILE 123 3.491 -0.976 -7.386 965 HG13 ILE 123 2HG1 ILE 123 4.175 0.123 -6.226 966 HG21 ILE 123 1HG2 ILE 123 7.125 -0.269 -7.353 967 HG22 ILE 123 2HG2 ILE 123 6.697 -0.071 -5.645 968 HG23 ILE 123 3HG2 ILE 123 7.609 -1.496 -6.202 969 HD11 ILE 123 3HD1 ILE 123 5.299 -0.077 -9.018 970 HD12 ILE 123 1HD1 ILE 123 3.920 0.968 -8.593 971 HD13 ILE 123 2HD1 ILE 123 5.483 1.226 -7.828 972 H ASP 124 H ASP 124 7.494 -3.866 -8.869 973 HA ASP 124 HA ASP 124 8.340 -5.980 -7.093 974 HB2 ASP 124 1HB ASP 124 9.006 -4.845 -9.764 975 HB3 ASP 124 2HB ASP 124 10.374 -5.521 -8.909 976 H PHE 125 H PHE 125 10.146 -6.111 -5.733 977 HA PHE 125 HA PHE 125 11.753 -3.696 -5.223 978 HB2 PHE 125 1HB PHE 125 11.300 -3.847 -2.817 979 HB3 PHE 125 2HB PHE 125 9.840 -3.509 -3.715 980 HD1 PHE 125 1HD PHE 125 11.665 -6.161 -1.871 981 HD2 PHE 125 2HD PHE 125 7.882 -4.967 -3.554 982 HE1 PHE 125 1HE PHE 125 10.580 -8.011 -0.707 983 HE2 PHE 125 2HE PHE 125 6.789 -6.853 -2.389 984 HZ PHE 125 HZ PHE 125 8.139 -8.414 -0.997 985 H GLU 126 H GLU 126 13.518 -4.502 -3.265 986 HA GLU 126 HA GLU 126 14.420 -7.208 -4.107 987 HB2 GLU 126 1HB GLU 126 15.720 -4.657 -4.312 988 HB3 GLU 126 2HB GLU 126 16.677 -5.892 -3.432 989 HG2 GLU 126 1HG GLU 126 15.361 -6.381 -6.116 990 HG3 GLU 126 2HG GLU 126 16.960 -5.667 -5.942 991 H ARG 127 H ARG 127 15.409 -8.521 -2.555 992 HA ARG 127 HA ARG 127 14.629 -7.974 0.192 993 HB2 ARG 127 1HB ARG 127 14.837 -10.410 -1.515 994 HB3 ARG 127 2HB ARG 127 15.334 -10.567 0.171 995 HG2 ARG 127 1HG ARG 127 13.206 -10.998 0.518 996 HG3 ARG 127 2HG ARG 127 13.099 -9.245 0.607 997 HD2 ARG 127 1HD ARG 127 11.242 -10.070 -0.711 998 HD3 ARG 127 2HD ARG 127 12.354 -9.148 -1.728 999 HE ARG 127 HE ARG 127 12.852 -10.974 -2.899 1000 HH11 ARG 127 1HH1 ARG 127 11.477 -12.219 0.190 1001 HH12 ARG 127 2HH1 ARG 127 11.348 -13.812 -0.384 1002 HH21 ARG 127 1HH2 ARG 127 12.058 -13.037 -3.773 1003 HH22 ARG 127 2HH2 ARG 127 11.416 -14.231 -2.738 1004 H GLU 128 H GLU 128 16.273 -6.681 0.717 1005 HA GLU 128 HA GLU 128 18.214 -5.969 1.503 1006 HB2 GLU 128 1HB GLU 128 19.122 -7.562 3.318 1007 HB3 GLU 128 2HB GLU 128 17.535 -6.830 3.427 1008 HG2 GLU 128 1HG GLU 128 16.440 -8.852 2.664 1009 HG3 GLU 128 2HG GLU 128 17.999 -9.622 2.432 Start of MODEL 7 1 H1 GLY 1 H GLY 1 -22.914 14.983 -7.481 2 HA2 GLY 1 1HA GLY 1 -21.550 16.775 -6.550 3 HA3 GLY 1 2HA GLY 1 -22.563 16.016 -5.305 4 H ALA 2 H ALA 2 -21.574 15.107 -3.544 5 HA ALA 2 HA ALA 2 -18.691 14.518 -3.551 6 HB1 ALA 2 1HB ALA 2 -18.902 16.978 -3.095 7 HB2 ALA 2 2HB ALA 2 -19.911 16.603 -1.683 8 HB3 ALA 2 3HB ALA 2 -18.217 16.069 -1.736 9 H GLU 3 H GLU 3 -21.235 13.008 -3.273 10 HA GLU 3 HA GLU 3 -21.749 12.460 -0.516 11 HB2 GLU 3 1HB GLU 3 -23.050 12.029 -2.935 12 HB3 GLU 3 2HB GLU 3 -22.452 10.420 -2.589 13 HG2 GLU 3 1HG GLU 3 -24.637 10.572 -1.653 14 HG3 GLU 3 2HG GLU 3 -23.522 10.637 -0.280 15 H ALA 4 H ALA 4 -21.754 9.798 -0.141 16 HA ALA 4 HA ALA 4 -19.006 9.037 0.255 17 HB1 ALA 4 1HB ALA 4 -20.059 6.966 1.199 18 HB2 ALA 4 2HB ALA 4 -20.690 8.460 1.896 19 HB3 ALA 4 3HB ALA 4 -21.643 7.587 0.668 20 H LEU 5 H LEU 5 -18.903 9.404 -2.285 21 HA LEU 5 HA LEU 5 -19.563 7.545 -4.220 22 HB2 LEU 5 1HB LEU 5 -16.867 8.893 -3.924 23 HB3 LEU 5 2HB LEU 5 -17.501 8.251 -5.415 24 HG LEU 5 HG LEU 5 -18.639 10.620 -3.887 25 HD11 LEU 5 1HD1 LEU 5 -17.003 10.514 -6.447 26 HD12 LEU 5 2HD1 LEU 5 -16.479 11.158 -4.869 27 HD13 LEU 5 3HD1 LEU 5 -17.784 11.951 -5.748 28 HD21 LEU 5 3HD2 LEU 5 -19.854 10.927 -6.147 29 HD22 LEU 5 1HD2 LEU 5 -20.439 9.591 -5.119 30 HD23 LEU 5 2HD2 LEU 5 -19.359 9.273 -6.500 31 HA PRO 6 HA PRO 6 -17.171 3.931 -3.030 32 HB2 PRO 6 1HB PRO 6 -16.984 2.582 -5.382 33 HB3 PRO 6 2HB PRO 6 -18.558 2.783 -4.540 34 HG2 PRO 6 1HG PRO 6 -17.444 4.365 -6.863 35 HG3 PRO 6 2HG PRO 6 -19.086 3.684 -6.635 36 HD2 PRO 6 1HD PRO 6 -18.313 6.340 -6.064 37 HD3 PRO 6 2HD PRO 6 -19.718 5.535 -5.311 38 H LEU 7 H LEU 7 -15.138 2.977 -3.484 39 HA LEU 7 HA LEU 7 -12.933 4.582 -3.772 40 HB2 LEU 7 1HB LEU 7 -12.884 2.497 -2.716 41 HB3 LEU 7 2HB LEU 7 -13.292 1.632 -4.180 42 HG LEU 7 HG LEU 7 -11.010 2.394 -5.134 43 HD11 LEU 7 1HD1 LEU 7 -10.546 4.259 -3.698 44 HD12 LEU 7 2HD1 LEU 7 -9.386 2.993 -3.256 45 HD13 LEU 7 3HD1 LEU 7 -10.823 3.297 -2.243 46 HD21 LEU 7 3HD2 LEU 7 -9.760 0.714 -3.878 47 HD22 LEU 7 1HD2 LEU 7 -11.384 0.120 -4.246 48 HD23 LEU 7 2HD2 LEU 7 -11.002 0.692 -2.612 49 H TYR 8 H TYR 8 -12.706 5.940 -5.468 50 HA TYR 8 HA TYR 8 -12.717 4.900 -8.244 51 HB2 TYR 8 1HB TYR 8 -12.851 7.278 -8.881 52 HB3 TYR 8 2HB TYR 8 -14.206 6.684 -7.948 53 HD1 TYR 8 2HD TYR 8 -11.033 8.675 -7.615 54 HD2 TYR 8 1HD TYR 8 -14.938 7.814 -6.018 55 HE1 TYR 8 2HE TYR 8 -10.806 10.570 -6.001 56 HE2 TYR 8 1HE TYR 8 -14.733 9.691 -4.436 57 HH TYR 8 HH TYR 8 -13.381 11.479 -3.710 58 H TYR 9 H TYR 9 -10.407 5.120 -5.912 59 HA TYR 9 HA TYR 9 -8.279 5.167 -7.930 60 HB2 TYR 9 1HB TYR 9 -8.567 7.569 -7.302 61 HB3 TYR 9 2HB TYR 9 -8.336 7.078 -5.630 62 HD1 TYR 9 1HD TYR 9 -6.662 7.323 -8.907 63 HD2 TYR 9 2HD TYR 9 -6.115 6.742 -4.682 64 HE1 TYR 9 1HE TYR 9 -4.290 7.885 -9.165 65 HE2 TYR 9 2HE TYR 9 -3.744 7.485 -4.887 66 HH TYR 9 HH TYR 9 -2.245 8.750 -6.408 67 H LEU 10 H LEU 10 -6.956 3.491 -7.344 68 HA LEU 10 HA LEU 10 -6.532 2.920 -4.467 69 HB2 LEU 10 1HB LEU 10 -8.065 1.219 -5.577 70 HB3 LEU 10 2HB LEU 10 -6.837 0.890 -6.749 71 HG LEU 10 HG LEU 10 -5.694 -0.249 -5.149 72 HD11 LEU 10 1HD1 LEU 10 -6.327 -0.427 -2.729 73 HD12 LEU 10 2HD1 LEU 10 -7.533 0.841 -3.029 74 HD13 LEU 10 3HD1 LEU 10 -5.797 1.209 -3.146 75 HD21 LEU 10 3HD2 LEU 10 -7.196 -1.566 -5.972 76 HD22 LEU 10 1HD2 LEU 10 -8.537 -0.921 -4.976 77 HD23 LEU 10 2HD2 LEU 10 -7.219 -1.844 -4.219 78 H GLN 11 H GLN 11 -4.357 3.534 -4.172 79 HA GLN 11 HA GLN 11 -2.441 2.572 -6.193 80 HB2 GLN 11 1HB GLN 11 -3.606 5.098 -6.406 81 HB3 GLN 11 2HB GLN 11 -2.140 5.474 -5.537 82 HG2 GLN 11 1HG GLN 11 -0.962 5.352 -7.445 83 HG3 GLN 11 2HG GLN 11 -1.494 3.678 -7.690 84 HE21 GLN 11 1HE2 GLN 11 -4.010 3.559 -8.384 85 HE22 GLN 11 2HE2 GLN 11 -4.325 4.599 -9.762 86 H ILE 12 H ILE 12 -0.419 2.180 -5.388 87 HA ILE 12 HA ILE 12 -0.323 1.783 -2.596 88 HB ILE 12 HB ILE 12 1.754 1.554 -4.786 89 HG12 ILE 12 1HG1 ILE 12 -0.026 0.011 -5.226 90 HG13 ILE 12 2HG1 ILE 12 1.241 -0.912 -4.481 91 HG21 ILE 12 1HG2 ILE 12 2.637 1.492 -2.213 92 HG22 ILE 12 2HG2 ILE 12 2.087 -0.176 -2.376 93 HG23 ILE 12 3HG2 ILE 12 3.263 0.428 -3.497 94 HD11 ILE 12 3HD1 ILE 12 -0.120 -0.552 -2.250 95 HD12 ILE 12 1HD1 ILE 12 -1.446 -0.148 -3.344 96 HD13 ILE 12 2HD1 ILE 12 -0.657 -1.741 -3.427 97 H THR 13 H THR 13 1.232 4.418 -4.480 98 HA THR 13 HA THR 13 1.678 6.478 -3.933 99 HB THR 13 HB THR 13 -0.131 5.956 -1.561 100 HG1 THR 13 1HG THR 13 -1.260 5.337 -3.243 101 HG21 THR 13 3HG2 THR 13 -0.880 8.276 -1.929 102 HG22 THR 13 1HG2 THR 13 0.398 8.493 -3.150 103 HG23 THR 13 2HG2 THR 13 0.813 8.203 -1.432 104 H GLY 14 H GLY 14 2.499 4.433 -1.082 105 HA2 GLY 14 1HA GLY 14 5.165 5.398 -1.462 106 HA3 GLY 14 2HA GLY 14 4.578 5.887 0.089 107 H ILE 15 H ILE 15 6.715 4.011 -0.138 108 HA ILE 15 HA ILE 15 5.512 1.613 1.058 109 HB ILE 15 HB ILE 15 5.858 1.312 -1.428 110 HG12 ILE 15 1HG1 ILE 15 7.434 -0.579 0.314 111 HG13 ILE 15 2HG1 ILE 15 5.681 -0.542 0.151 112 HG21 ILE 15 1HG2 ILE 15 8.050 2.645 -1.543 113 HG22 ILE 15 2HG2 ILE 15 8.843 1.277 -0.790 114 HG23 ILE 15 3HG2 ILE 15 8.085 1.081 -2.378 115 HD11 ILE 15 3HD1 ILE 15 5.901 -0.928 -2.317 116 HD12 ILE 15 1HD1 ILE 15 7.656 -1.141 -2.079 117 HD13 ILE 15 2HD1 ILE 15 6.522 -2.262 -1.331 118 H THR 16 H THR 16 6.992 0.583 2.502 119 HA THR 16 HA THR 16 9.741 1.241 2.553 120 HB THR 16 HB THR 16 9.021 3.369 3.509 121 HG1 THR 16 1HG THR 16 9.998 1.995 5.739 122 HG21 THR 16 3HG2 THR 16 7.847 1.903 5.863 123 HG22 THR 16 1HG2 THR 16 6.863 2.534 4.535 124 HG23 THR 16 2HG2 THR 16 7.810 3.648 5.514 125 H SER 17 H SER 17 10.526 0.348 4.934 126 HA SER 17 HA SER 17 8.697 -1.657 6.018 127 HB2 SER 17 1HB SER 17 10.664 -3.275 6.078 128 HB3 SER 17 2HB SER 17 10.040 -2.926 4.459 129 HG SER 17 HG SER 17 12.425 -2.849 5.019 130 H ASP 18 H ASP 18 9.771 -2.510 8.089 131 HA ASP 18 HA ASP 18 10.151 -0.253 9.767 132 HB2 ASP 18 1HB ASP 18 9.265 -2.618 10.318 133 HB3 ASP 18 2HB ASP 18 10.940 -3.039 10.621 134 H GLY 19 H GLY 19 12.507 -2.772 8.620 135 HA2 GLY 19 1HA GLY 19 14.798 -1.403 9.599 136 HA3 GLY 19 2HA GLY 19 14.741 -2.732 8.444 137 H ASN 20 H ASN 20 12.861 0.055 7.452 138 HA ASN 20 HA ASN 20 15.248 1.163 6.055 139 HB2 ASN 20 1HB ASN 20 13.166 0.114 4.614 140 HB3 ASN 20 2HB ASN 20 12.624 1.785 4.776 141 HD21 ASN 20 1HD2 ASN 20 13.260 0.878 2.208 142 HD22 ASN 20 2HD2 ASN 20 14.862 1.328 1.734 143 H ASP 21 H ASP 21 13.801 1.656 8.737 144 HA ASP 21 HA ASP 21 13.428 3.448 10.062 145 HB2 ASP 21 1HB ASP 21 15.629 4.093 8.852 146 HB3 ASP 21 2HB ASP 21 14.674 5.252 7.971 147 H PHE 22 H PHE 22 11.397 2.658 8.142 148 HA PHE 22 HA PHE 22 9.396 3.282 7.298 149 HB2 PHE 22 1HB PHE 22 9.673 5.492 9.360 150 HB3 PHE 22 2HB PHE 22 8.229 5.181 8.438 151 HD1 PHE 22 2HD PHE 22 10.630 3.272 10.696 152 HD2 PHE 22 1HD PHE 22 6.581 3.890 9.364 153 HE1 PHE 22 2HE PHE 22 9.809 1.623 12.355 154 HE2 PHE 22 1HE PHE 22 5.788 2.221 10.999 155 HZ PHE 22 HZ PHE 22 7.414 1.093 12.518 156 H ALA 23 H ALA 23 12.006 4.577 6.102 157 HA ALA 23 HA ALA 23 11.341 7.017 4.867 158 HB1 ALA 23 1HB ALA 23 13.163 4.800 3.874 159 HB2 ALA 23 2HB ALA 23 13.148 6.487 3.319 160 HB3 ALA 23 3HB ALA 23 13.610 6.116 4.987 161 H TRP 24 H TRP 24 9.219 7.018 4.081 162 HA TRP 24 HA TRP 24 7.928 5.046 2.611 163 HB2 TRP 24 1HB TRP 24 7.484 8.055 2.804 164 HB3 TRP 24 2HB TRP 24 6.411 7.017 1.887 165 HD1 TRP 24 HD TRP 24 6.783 8.300 5.299 166 HE1 TRP 24 1HE TRP 24 5.407 7.016 6.980 167 HE3 TRP 24 3HE TRP 24 5.604 4.337 2.376 168 HZ2 TRP 24 2HZ TRP 24 3.895 4.467 7.023 169 HZ3 TRP 24 3HZ TRP 24 4.226 2.469 3.237 170 HH2 TRP 24 HH TRP 24 3.364 2.546 5.586 171 H ASP 25 H ASP 25 10.308 7.045 1.455 172 HA ASP 25 HA ASP 25 11.050 7.891 -0.501 173 HB2 ASP 25 1HB ASP 25 10.786 4.942 -0.485 174 HB3 ASP 25 2HB ASP 25 11.109 5.581 -2.073 175 H ASN 26 H ASN 26 8.250 8.040 -0.404 176 HA ASN 26 HA ASN 26 6.361 8.655 -1.631 177 HB2 ASN 26 1HB ASN 26 8.590 10.476 -2.489 178 HB3 ASN 26 2HB ASN 26 6.891 10.696 -2.959 179 HD21 ASN 26 1HD2 ASN 26 8.831 10.062 0.010 180 HD22 ASN 26 2HD2 ASN 26 7.816 10.996 1.097 181 H LEU 27 H LEU 27 5.759 6.951 -2.728 182 HA LEU 27 HA LEU 27 7.049 6.047 -5.182 183 HB2 LEU 27 1HB LEU 27 4.221 5.497 -4.218 184 HB3 LEU 27 2HB LEU 27 4.914 4.799 -5.669 185 HG LEU 27 HG LEU 27 6.049 4.315 -2.900 186 HD11 LEU 27 1HD1 LEU 27 3.794 3.370 -3.083 187 HD12 LEU 27 2HD1 LEU 27 4.970 2.056 -3.219 188 HD13 LEU 27 3HD1 LEU 27 4.174 2.666 -4.667 189 HD21 LEU 27 3HD2 LEU 27 7.223 2.502 -3.929 190 HD22 LEU 27 1HD2 LEU 27 7.650 3.981 -4.758 191 HD23 LEU 27 2HD2 LEU 27 6.497 2.831 -5.518 192 H THR 28 H THR 28 6.689 6.546 -7.348 193 HA THR 28 HA THR 28 4.988 8.703 -8.059 194 HB THR 28 HB THR 28 5.550 6.877 -10.225 195 HG1 THR 28 1HG THR 28 7.721 6.639 -10.076 196 HG21 THR 28 3HG2 THR 28 6.926 9.456 -9.358 197 HG22 THR 28 1HG2 THR 28 5.431 9.367 -10.322 198 HG23 THR 28 2HG2 THR 28 6.955 8.740 -10.983 199 H SER 29 H SER 29 2.976 8.555 -9.220 200 HA SER 29 HA SER 29 1.180 6.427 -8.621 201 HB2 SER 29 1HB SER 29 1.158 8.583 -10.754 202 HB3 SER 29 2HB SER 29 -0.186 7.454 -10.482 203 HG SER 29 HG SER 29 -0.587 8.306 -8.573 204 H SER 30 H SER 30 2.765 7.070 -11.891 205 HA SER 30 HA SER 30 2.199 4.310 -12.596 206 HB2 SER 30 1HB SER 30 2.170 6.348 -14.119 207 HB3 SER 30 2HB SER 30 3.938 6.233 -14.144 208 HG SER 30 HG SER 30 3.755 4.203 -15.076 209 H GLN 31 H GLN 31 4.055 4.610 -10.233 210 HA GLN 31 HA GLN 31 6.718 3.796 -11.062 211 HB2 GLN 31 1HB GLN 31 6.005 4.689 -8.736 212 HB3 GLN 31 2HB GLN 31 5.281 3.103 -8.460 213 HG2 GLN 31 1HG GLN 31 7.269 2.655 -7.538 214 HG3 GLN 31 2HG GLN 31 7.705 2.314 -9.191 215 HE21 GLN 31 1HE2 GLN 31 8.397 4.243 -6.440 216 HE22 GLN 31 2HE2 GLN 31 9.754 5.080 -7.154 217 H THR 32 H THR 32 7.425 1.599 -11.466 218 HA THR 32 HA THR 32 5.395 -0.540 -11.027 219 HB THR 32 HB THR 32 5.893 -1.618 -13.047 220 HG1 THR 32 1HG THR 32 7.907 0.358 -13.477 221 HG21 THR 32 3HG2 THR 32 4.266 0.280 -13.189 222 HG22 THR 32 1HG2 THR 32 5.069 -0.083 -14.725 223 HG23 THR 32 2HG2 THR 32 5.578 1.320 -13.783 224 H LYS 33 H LYS 33 8.324 0.575 -9.941 225 HA LYS 33 HA LYS 33 9.040 -2.106 -8.963 226 HB2 LYS 33 1HB LYS 33 10.496 -0.768 -11.080 227 HB3 LYS 33 2HB LYS 33 11.409 -0.528 -9.611 228 HG2 LYS 33 1HG LYS 33 12.275 -2.551 -9.978 229 HG3 LYS 33 2HG LYS 33 10.733 -3.177 -9.344 230 HD2 LYS 33 1HD LYS 33 9.916 -3.655 -11.541 231 HD3 LYS 33 2HD LYS 33 11.090 -2.572 -12.296 232 HE2 LYS 33 1HE LYS 33 11.762 -4.838 -12.743 233 HE3 LYS 33 2HE LYS 33 12.947 -4.023 -11.720 234 HZ1 LYS 33 3HZ LYS 33 10.936 -6.007 -10.814 235 HZ2 LYS 33 1HZ LYS 33 11.983 -5.177 -9.813 236 HZ3 LYS 33 2HZ LYS 33 12.560 -6.223 -10.910 237 H ALA 34 H ALA 34 10.472 -1.884 -7.045 238 HA ALA 34 HA ALA 34 9.519 0.174 -5.327 239 HB1 ALA 34 1HB ALA 34 11.039 -0.977 -3.688 240 HB2 ALA 34 2HB ALA 34 10.038 -2.115 -4.606 241 HB3 ALA 34 3HB ALA 34 11.755 -1.887 -5.024 242 HA PRO 35 HA PRO 35 12.881 3.120 -5.690 243 HB2 PRO 35 1HB PRO 35 13.390 3.761 -3.051 244 HB3 PRO 35 2HB PRO 35 11.998 4.412 -3.997 245 HG2 PRO 35 1HG PRO 35 12.009 2.037 -2.095 246 HG3 PRO 35 2HG PRO 35 10.812 3.351 -2.180 247 HD2 PRO 35 1HD PRO 35 10.288 1.031 -3.363 248 HD3 PRO 35 2HD PRO 35 9.884 2.522 -4.222 249 H ASN 36 H ASN 36 13.140 0.274 -3.448 250 HA ASN 36 HA ASN 36 15.945 -0.056 -3.998 251 HB2 ASN 36 1HB ASN 36 15.057 1.599 -1.726 252 HB3 ASN 36 2HB ASN 36 15.802 0.134 -1.122 253 HD21 ASN 36 1HD2 ASN 36 16.429 3.222 -2.425 254 HD22 ASN 36 2HD2 ASN 36 18.088 3.019 -2.822 255 H VAL 37 H VAL 37 16.780 -1.864 -2.650 256 HA VAL 37 HA VAL 37 14.924 -3.898 -1.897 257 HB VAL 37 HB VAL 37 16.824 -4.746 -2.582 258 HG11 VAL 37 1HG1 VAL 37 18.271 -3.045 -2.668 259 HG12 VAL 37 2HG1 VAL 37 18.453 -2.990 -0.876 260 HG13 VAL 37 3HG1 VAL 37 19.012 -4.423 -1.862 261 HG21 VAL 37 3HG2 VAL 37 17.136 -6.327 -1.028 262 HG22 VAL 37 1HG2 VAL 37 17.846 -5.153 0.120 263 HG23 VAL 37 2HG2 VAL 37 16.123 -5.354 0.045 264 H LEU 38 H LEU 38 13.528 -3.598 -0.473 265 HA LEU 38 HA LEU 38 13.732 -1.872 1.855 266 HB2 LEU 38 1HB LEU 38 11.733 -4.052 1.144 267 HB3 LEU 38 2HB LEU 38 11.541 -2.845 2.414 268 HG LEU 38 HG LEU 38 11.611 -2.324 -0.591 269 HD11 LEU 38 1HD1 LEU 38 9.309 -1.703 -0.313 270 HD12 LEU 38 2HD1 LEU 38 9.391 -1.984 1.449 271 HD13 LEU 38 3HD1 LEU 38 9.542 -3.349 0.309 272 HD21 LEU 38 3HD2 LEU 38 10.991 0.033 0.055 273 HD22 LEU 38 1HD2 LEU 38 12.642 -0.422 0.459 274 HD23 LEU 38 2HD2 LEU 38 11.388 -0.371 1.739 275 H LYS 39 H LYS 39 14.966 -2.419 3.521 276 HA LYS 39 HA LYS 39 15.764 -5.205 3.996 277 HB2 LYS 39 1HB LYS 39 16.083 -2.885 5.910 278 HB3 LYS 39 2HB LYS 39 16.965 -4.371 5.912 279 HG2 LYS 39 1HG LYS 39 18.559 -3.351 4.708 280 HG3 LYS 39 2HG LYS 39 17.463 -3.435 3.332 281 HD2 LYS 39 1HD LYS 39 16.481 -1.162 4.338 282 HD3 LYS 39 2HD LYS 39 18.047 -1.055 5.118 283 HE2 LYS 39 1HE LYS 39 17.522 -1.371 2.119 284 HE3 LYS 39 2HE LYS 39 17.944 0.137 2.942 285 HZ1 LYS 39 3HZ LYS 39 19.813 -0.877 1.858 286 HZ2 LYS 39 1HZ LYS 39 19.660 -2.264 2.688 287 HZ3 LYS 39 2HZ LYS 39 20.104 -0.857 3.475 288 H GLY 40 H GLY 40 15.424 -6.185 6.323 289 HA2 GLY 40 1HA GLY 40 14.055 -6.583 8.174 290 HA3 GLY 40 2HA GLY 40 12.953 -5.316 7.663 291 H ASN 41 H ASN 41 11.270 -6.821 8.146 292 HA ASN 41 HA ASN 41 10.634 -8.773 5.967 293 HB2 ASN 41 1HB ASN 41 11.439 -9.857 8.073 294 HB3 ASN 41 2HB ASN 41 10.120 -9.081 8.955 295 HD21 ASN 41 1HD2 ASN 41 8.196 -9.814 6.515 296 HD22 ASN 41 2HD2 ASN 41 7.895 -11.512 6.950 297 H LYS 42 H LYS 42 9.530 -6.305 8.323 298 HA LYS 42 HA LYS 42 6.711 -6.626 7.577 299 HB2 LYS 42 1HB LYS 42 8.211 -4.574 9.300 300 HB3 LYS 42 2HB LYS 42 6.507 -4.485 8.987 301 HG2 LYS 42 1HG LYS 42 7.898 -6.741 10.484 302 HG3 LYS 42 2HG LYS 42 6.777 -5.527 11.124 303 HD2 LYS 42 1HD LYS 42 5.118 -6.551 9.340 304 HD3 LYS 42 2HD LYS 42 6.202 -7.947 9.396 305 HE2 LYS 42 1HE LYS 42 5.872 -8.178 11.795 306 HE3 LYS 42 2HE LYS 42 4.913 -6.692 11.856 307 HZ1 LYS 42 3HZ LYS 42 3.523 -8.668 11.853 308 HZ2 LYS 42 1HZ LYS 42 4.127 -9.164 10.435 309 HZ3 LYS 42 2HZ LYS 42 3.206 -7.760 10.571 310 H LEU 43 H LEU 43 6.000 -5.941 5.721 311 HA LEU 43 HA LEU 43 7.296 -3.713 4.281 312 HB2 LEU 43 1HB LEU 43 6.299 -6.168 3.432 313 HB3 LEU 43 2HB LEU 43 4.945 -5.096 3.088 314 HG LEU 43 HG LEU 43 7.813 -4.677 2.153 315 HD11 LEU 43 1HD1 LEU 43 5.367 -5.719 0.664 316 HD12 LEU 43 2HD1 LEU 43 6.787 -6.660 1.114 317 HD13 LEU 43 3HD1 LEU 43 6.953 -5.353 -0.069 318 HD21 LEU 43 3HD2 LEU 43 6.507 -2.553 2.309 319 HD22 LEU 43 1HD2 LEU 43 5.254 -3.271 1.268 320 HD23 LEU 43 2HD2 LEU 43 6.915 -2.999 0.673 321 H TYR 44 H TYR 44 6.416 -1.701 4.589 322 HA TYR 44 HA TYR 44 3.612 -1.480 5.576 323 HB2 TYR 44 1HB TYR 44 5.842 0.558 5.755 324 HB3 TYR 44 2HB TYR 44 4.251 0.655 6.439 325 HD1 TYR 44 1HD TYR 44 3.844 -2.016 7.730 326 HD2 TYR 44 2HD TYR 44 7.335 0.514 7.567 327 HE1 TYR 44 1HE TYR 44 4.608 -2.911 9.911 328 HE2 TYR 44 2HE TYR 44 8.046 -0.318 9.749 329 HH TYR 44 HH TYR 44 7.542 -1.748 11.628 330 H VAL 45 H VAL 45 2.208 -0.400 4.278 331 HA VAL 45 HA VAL 45 3.204 0.896 1.768 332 HB VAL 45 HB VAL 45 0.828 -1.001 1.890 333 HG11 VAL 45 1HG1 VAL 45 2.462 0.238 -0.291 334 HG12 VAL 45 2HG1 VAL 45 1.165 -0.981 -0.526 335 HG13 VAL 45 3HG1 VAL 45 0.780 0.632 0.112 336 HG21 VAL 45 3HG2 VAL 45 3.698 -1.594 1.069 337 HG22 VAL 45 1HG2 VAL 45 2.775 -2.386 2.374 338 HG23 VAL 45 2HG2 VAL 45 2.297 -2.626 0.690 339 H LYS 46 H LYS 46 2.455 2.971 1.690 340 HA LYS 46 HA LYS 46 0.129 3.717 3.398 341 HB2 LYS 46 1HB LYS 46 2.407 4.982 3.375 342 HB3 LYS 46 2HB LYS 46 1.891 5.630 1.818 343 HG2 LYS 46 1HG LYS 46 -0.251 6.355 3.026 344 HG3 LYS 46 2HG LYS 46 0.503 5.861 4.527 345 HD2 LYS 46 1HD LYS 46 1.625 7.999 2.650 346 HD3 LYS 46 2HD LYS 46 0.542 8.317 4.011 347 HE2 LYS 46 1HE LYS 46 2.282 7.097 5.480 348 HE3 LYS 46 2HE LYS 46 3.395 7.265 4.115 349 HZ1 LYS 46 3HZ LYS 46 3.585 9.106 5.685 350 HZ2 LYS 46 1HZ LYS 46 2.005 9.494 5.504 351 HZ3 LYS 46 2HZ LYS 46 3.038 9.675 4.246 352 H ALA 47 H ALA 47 -1.082 2.283 1.857 353 HA ALA 47 HA ALA 47 -1.321 3.073 -0.935 354 HB1 ALA 47 1HB ALA 47 -1.541 0.743 -0.393 355 HB2 ALA 47 2HB ALA 47 -2.841 1.062 0.773 356 HB3 ALA 47 3HB ALA 47 -3.118 1.318 -0.968 357 H ARG 48 H ARG 48 -2.540 4.703 -1.661 358 HA ARG 48 HA ARG 48 -4.475 5.981 0.136 359 HB2 ARG 48 1HB ARG 48 -2.934 7.234 -1.354 360 HB3 ARG 48 2HB ARG 48 -3.788 6.611 -2.768 361 HG2 ARG 48 1HG ARG 48 -5.796 7.841 -2.239 362 HG3 ARG 48 2HG ARG 48 -5.323 8.011 -0.551 363 HD2 ARG 48 1HD ARG 48 -3.736 9.303 -2.797 364 HD3 ARG 48 2HD ARG 48 -5.075 10.106 -1.960 365 HE ARG 48 HE ARG 48 -3.288 9.066 0.008 366 HH11 ARG 48 1HH1 ARG 48 -3.365 11.625 -2.493 367 HH12 ARG 48 2HH1 ARG 48 -2.591 12.805 -1.528 368 HH21 ARG 48 1HH2 ARG 48 -2.243 10.559 1.300 369 HH22 ARG 48 2HH2 ARG 48 -1.711 12.085 0.666 370 H PHE 49 H PHE 49 -6.647 5.974 -0.149 371 HA PHE 49 HA PHE 49 -7.916 4.420 -2.327 372 HB2 PHE 49 1HB PHE 49 -8.617 4.437 0.605 373 HB3 PHE 49 2HB PHE 49 -9.605 3.705 -0.579 374 HD1 PHE 49 1HD PHE 49 -6.219 3.503 1.002 375 HD2 PHE 49 2HD PHE 49 -9.247 1.354 -1.192 376 HE1 PHE 49 1HE PHE 49 -4.952 1.427 1.307 377 HE2 PHE 49 2HE PHE 49 -8.128 -0.765 -0.648 378 HZ PHE 49 HZ PHE 49 -5.939 -0.750 0.565 379 H MET 50 H MET 50 -8.952 6.093 -3.404 380 HA MET 50 HA MET 50 -9.967 8.394 -1.808 381 HB2 MET 50 1HB MET 50 -9.927 8.244 -4.823 382 HB3 MET 50 2HB MET 50 -10.184 9.651 -3.806 383 HG2 MET 50 1HG MET 50 -7.578 8.282 -3.466 384 HG3 MET 50 2HG MET 50 -7.847 9.011 -5.043 385 HE1 MET 50 3HE MET 50 -9.356 10.614 -1.729 386 HE2 MET 50 1HE MET 50 -7.986 9.591 -1.210 387 HE3 MET 50 2HE MET 50 -7.884 11.358 -1.055 388 H GLY 51 H GLY 51 -12.096 8.210 -1.330 389 HA2 GLY 51 1HA GLY 51 -14.430 7.767 -1.849 390 HA3 GLY 51 2HA GLY 51 -13.938 6.574 -3.032 391 H TYR 52 H TYR 52 -15.896 6.004 -1.189 392 HA TYR 52 HA TYR 52 -14.974 4.692 1.201 393 HB2 TYR 52 1HB TYR 52 -17.572 5.206 -0.143 394 HB3 TYR 52 2HB TYR 52 -17.483 3.635 0.610 395 HD1 TYR 52 2HD TYR 52 -17.424 7.252 1.262 396 HD2 TYR 52 1HD TYR 52 -17.321 3.300 3.007 397 HE1 TYR 52 2HE TYR 52 -17.845 8.241 3.472 398 HE2 TYR 52 1HE TYR 52 -17.823 4.290 5.228 399 HH TYR 52 HH TYR 52 -17.698 6.167 6.414 400 H THR 53 H THR 53 -13.585 3.067 0.900 401 HA THR 53 HA THR 53 -15.048 0.643 0.489 402 HB THR 53 HB THR 53 -12.502 1.138 -1.078 403 HG1 THR 53 1HG THR 53 -14.113 -0.318 -2.426 404 HG21 THR 53 3HG2 THR 53 -12.003 -0.943 0.050 405 HG22 THR 53 1HG2 THR 53 -12.472 -1.253 -1.614 406 HG23 THR 53 2HG2 THR 53 -13.641 -1.580 -0.324 407 H LYS 54 H LYS 54 -14.843 -0.261 2.410 408 HA LYS 54 HA LYS 54 -12.215 -0.144 3.825 409 HB2 LYS 54 1HB LYS 54 -15.049 -0.688 4.722 410 HB3 LYS 54 2HB LYS 54 -13.653 -1.089 5.748 411 HG2 LYS 54 1HG LYS 54 -13.645 1.673 4.595 412 HG3 LYS 54 2HG LYS 54 -14.994 1.323 5.652 413 HD2 LYS 54 1HD LYS 54 -13.580 0.826 7.500 414 HD3 LYS 54 2HD LYS 54 -12.114 0.937 6.497 415 HE2 LYS 54 1HE LYS 54 -12.725 3.329 6.006 416 HE3 LYS 54 2HE LYS 54 -14.105 3.171 7.085 417 HZ1 LYS 54 3HZ LYS 54 -12.218 4.250 8.102 418 HZ2 LYS 54 1HZ LYS 54 -11.306 2.877 7.968 419 HZ3 LYS 54 2HZ LYS 54 -12.626 2.882 8.921 420 H LEU 55 H LEU 55 -13.988 -2.152 1.711 421 HA LEU 55 HA LEU 55 -13.112 -4.705 2.807 422 HB2 LEU 55 1HB LEU 55 -15.312 -4.076 1.531 423 HB3 LEU 55 2HB LEU 55 -14.362 -4.198 0.076 424 HG LEU 55 HG LEU 55 -15.529 -6.227 0.366 425 HD11 LEU 55 1HD1 LEU 55 -13.871 -7.979 0.540 426 HD12 LEU 55 2HD1 LEU 55 -12.726 -6.893 1.343 427 HD13 LEU 55 3HD1 LEU 55 -13.203 -6.610 -0.353 428 HD21 LEU 55 3HD2 LEU 55 -15.521 -7.594 2.378 429 HD22 LEU 55 1HD2 LEU 55 -16.103 -5.969 2.744 430 HD23 LEU 55 2HD2 LEU 55 -14.456 -6.452 3.211 431 H THR 56 H THR 56 -10.767 -4.224 2.802 432 HA THR 56 HA THR 56 -9.461 -3.936 0.157 433 HB THR 56 HB THR 56 -8.115 -4.234 2.866 434 HG1 THR 56 1HG THR 56 -9.051 -2.501 3.377 435 HG21 THR 56 3HG2 THR 56 -6.627 -4.393 0.918 436 HG22 THR 56 1HG2 THR 56 -6.344 -2.872 1.756 437 HG23 THR 56 2HG2 THR 56 -7.294 -2.885 0.254 438 H VAL 57 H VAL 57 -8.214 -5.659 -0.806 439 HA VAL 57 HA VAL 57 -8.063 -8.224 0.655 440 HB VAL 57 HB VAL 57 -8.985 -7.805 -2.217 441 HG11 VAL 57 1HG1 VAL 57 -9.395 -10.308 -2.150 442 HG12 VAL 57 2HG1 VAL 57 -7.700 -9.837 -2.215 443 HG13 VAL 57 3HG1 VAL 57 -8.419 -10.382 -0.687 444 HG21 VAL 57 3HG2 VAL 57 -10.823 -7.312 -0.744 445 HG22 VAL 57 1HG2 VAL 57 -11.084 -8.951 -1.343 446 HG23 VAL 57 2HG2 VAL 57 -10.464 -8.708 0.289 447 H ILE 58 H ILE 58 -6.307 -9.519 -0.046 448 HA ILE 58 HA ILE 58 -4.186 -8.386 -1.710 449 HB ILE 58 HB ILE 58 -3.754 -9.054 1.250 450 HG12 ILE 58 1HG1 ILE 58 -3.722 -6.351 -0.157 451 HG13 ILE 58 2HG1 ILE 58 -4.843 -6.886 1.090 452 HG21 ILE 58 1HG2 ILE 58 -1.745 -7.936 -0.754 453 HG22 ILE 58 2HG2 ILE 58 -1.427 -8.456 0.912 454 HG23 ILE 58 3HG2 ILE 58 -1.852 -9.652 -0.307 455 HD11 ILE 58 3HD1 ILE 58 -3.356 -5.426 2.166 456 HD12 ILE 58 1HD1 ILE 58 -2.883 -7.063 2.683 457 HD13 ILE 58 2HD1 ILE 58 -1.948 -6.194 1.437 458 H THR 59 H THR 59 -4.119 -10.243 -3.082 459 HA THR 59 HA THR 59 -5.159 -12.729 -2.347 460 HB THR 59 HB THR 59 -3.752 -13.086 -4.675 461 HG1 THR 59 1HG THR 59 -3.650 -11.298 -5.809 462 HG21 THR 59 3HG2 THR 59 -5.737 -12.599 -5.908 463 HG22 THR 59 1HG2 THR 59 -6.349 -11.499 -4.630 464 HG23 THR 59 2HG2 THR 59 -6.278 -13.244 -4.357 465 H GLY 60 H GLY 60 -2.065 -11.386 -2.052 466 HA2 GLY 60 1HA GLY 60 0.049 -12.216 -1.451 467 HA3 GLY 60 2HA GLY 60 -0.763 -13.588 -0.729 468 H LYS 61 H LYS 61 -0.100 -15.422 -1.424 469 HA LYS 61 HA LYS 61 1.079 -15.824 -4.086 470 HB2 LYS 61 1HB LYS 61 0.831 -17.560 -1.618 471 HB3 LYS 61 2HB LYS 61 1.346 -18.204 -3.177 472 HG2 LYS 61 1HG LYS 61 3.287 -16.816 -3.237 473 HG3 LYS 61 2HG LYS 61 2.732 -15.865 -1.860 474 HD2 LYS 61 1HD LYS 61 3.045 -17.839 -0.386 475 HD3 LYS 61 2HD LYS 61 3.615 -18.759 -1.789 476 HE2 LYS 61 1HE LYS 61 5.407 -16.985 -2.142 477 HE3 LYS 61 2HE LYS 61 4.901 -16.242 -0.624 478 HZ1 LYS 61 3HZ LYS 61 6.721 -17.645 -0.186 479 HZ2 LYS 61 1HZ LYS 61 6.135 -18.888 -1.022 480 HZ3 LYS 61 2HZ LYS 61 5.445 -18.456 0.427 481 H ASP 62 H ASP 62 -1.210 -17.820 -2.297 482 HA ASP 62 HA ASP 62 -2.102 -18.951 -4.794 483 HB2 ASP 62 1HB ASP 62 -1.594 -20.198 -2.678 484 HB3 ASP 62 2HB ASP 62 -3.023 -19.505 -1.939 485 H GLY 63 H GLY 63 -3.020 -16.104 -4.123 486 HA2 GLY 63 1HA GLY 63 -4.912 -14.904 -4.590 487 HA3 GLY 63 2HA GLY 63 -5.831 -16.362 -4.892 488 H LYS 64 H LYS 64 -4.146 -16.546 -1.912 489 HA LYS 64 HA LYS 64 -6.711 -16.569 -0.507 490 HB2 LYS 64 1HB LYS 64 -3.882 -17.213 0.416 491 HB3 LYS 64 2HB LYS 64 -5.268 -17.147 1.506 492 HG2 LYS 64 1HG LYS 64 -6.434 -18.872 0.100 493 HG3 LYS 64 2HG LYS 64 -4.963 -19.035 -0.868 494 HD2 LYS 64 1HD LYS 64 -3.722 -19.583 1.272 495 HD3 LYS 64 2HD LYS 64 -5.255 -19.559 2.136 496 HE2 LYS 64 1HE LYS 64 -4.509 -21.445 -0.155 497 HE3 LYS 64 2HE LYS 64 -4.494 -21.828 1.573 498 HZ1 LYS 64 3HZ LYS 64 -6.455 -22.667 0.788 499 HZ2 LYS 64 1HZ LYS 64 -6.807 -21.379 -0.156 500 HZ3 LYS 64 2HZ LYS 64 -6.940 -21.297 1.521 501 H ASN 65 H ASN 65 -7.498 -15.002 0.701 502 HA ASN 65 HA ASN 65 -6.507 -12.354 0.499 503 HB2 ASN 65 1HB ASN 65 -8.931 -13.237 0.842 504 HB3 ASN 65 2HB ASN 65 -8.513 -13.355 2.555 505 HD21 ASN 65 1HD2 ASN 65 -7.348 -11.089 3.308 506 HD22 ASN 65 2HD2 ASN 65 -8.485 -9.781 2.935 507 H LEU 66 H LEU 66 -4.397 -12.148 1.444 508 HA LEU 66 HA LEU 66 -3.566 -13.306 3.820 509 HB2 LEU 66 1HB LEU 66 -2.604 -10.623 2.773 510 HB3 LEU 66 2HB LEU 66 -1.767 -11.670 3.915 511 HG LEU 66 HG LEU 66 -2.301 -12.182 0.961 512 HD11 LEU 66 1HD1 LEU 66 0.261 -11.981 2.633 513 HD12 LEU 66 2HD1 LEU 66 -0.400 -10.687 1.602 514 HD13 LEU 66 3HD1 LEU 66 0.182 -12.194 0.884 515 HD21 LEU 66 3HD2 LEU 66 -2.580 -14.359 1.922 516 HD22 LEU 66 1HD2 LEU 66 -1.224 -14.127 3.051 517 HD23 LEU 66 2HD2 LEU 66 -0.933 -14.297 1.309 518 H LEU 67 H LEU 67 -5.322 -10.231 3.468 519 HA LEU 67 HA LEU 67 -5.178 -9.442 6.219 520 HB2 LEU 67 1HB LEU 67 -6.991 -8.737 3.895 521 HB3 LEU 67 2HB LEU 67 -7.347 -8.138 5.496 522 HG LEU 67 HG LEU 67 -4.674 -7.653 4.169 523 HD11 LEU 67 1HD1 LEU 67 -6.478 -6.764 2.709 524 HD12 LEU 67 2HD1 LEU 67 -5.581 -5.442 3.484 525 HD13 LEU 67 3HD1 LEU 67 -7.184 -5.919 4.090 526 HD21 LEU 67 3HD2 LEU 67 -5.032 -7.295 6.684 527 HD22 LEU 67 1HD2 LEU 67 -6.155 -6.009 6.274 528 HD23 LEU 67 2HD2 LEU 67 -4.445 -5.887 5.780 529 H TYR 68 H TYR 68 -6.802 -12.222 4.908 530 HA TYR 68 HA TYR 68 -8.341 -12.409 7.419 531 HB2 TYR 68 1HB TYR 68 -9.642 -11.971 5.202 532 HB3 TYR 68 2HB TYR 68 -9.144 -13.590 4.753 533 HD1 TYR 68 2HD TYR 68 -10.864 -11.753 7.617 534 HD2 TYR 68 1HD TYR 68 -10.606 -15.338 5.227 535 HE1 TYR 68 2HE TYR 68 -13.038 -12.511 8.504 536 HE2 TYR 68 1HE TYR 68 -12.740 -16.101 6.112 537 HH TYR 68 HH TYR 68 -14.492 -15.656 7.501 538 H ASN 69 H ASN 69 -5.521 -13.195 6.365 539 HA ASN 69 HA ASN 69 -5.632 -16.109 7.038 540 HB2 ASN 69 1HB ASN 69 -3.461 -14.416 5.707 541 HB3 ASN 69 2HB ASN 69 -3.116 -15.888 6.581 542 HD21 ASN 69 1HD2 ASN 69 -5.872 -15.169 4.319 543 HD22 ASN 69 2HD2 ASN 69 -5.552 -16.570 3.325 544 H GLY 70 H GLY 70 -3.681 -13.114 7.621 545 HA2 GLY 70 1HA GLY 70 -4.295 -12.600 10.182 546 HA3 GLY 70 2HA GLY 70 -3.155 -13.938 10.403 547 H THR 71 H THR 71 -1.489 -13.090 8.021 548 HA THR 71 HA THR 71 0.362 -11.622 9.528 549 HB THR 71 HB THR 71 0.633 -11.719 6.540 550 HG1 THR 71 1HG THR 71 0.289 -14.050 8.101 551 HG21 THR 71 3HG2 THR 71 2.475 -12.688 8.761 552 HG22 THR 71 1HG2 THR 71 2.523 -11.088 7.990 553 HG23 THR 71 2HG2 THR 71 2.847 -12.539 7.025 554 H ALA 72 H ALA 72 -1.258 -10.621 6.457 555 HA ALA 72 HA ALA 72 -0.578 -7.838 6.835 556 HB1 ALA 72 1HB ALA 72 -0.980 -8.800 4.579 557 HB2 ALA 72 2HB ALA 72 -2.671 -9.132 5.041 558 HB3 ALA 72 3HB ALA 72 -2.090 -7.457 4.944 559 H LYS 73 H LYS 73 -1.602 -6.323 7.923 560 HA LYS 73 HA LYS 73 -4.399 -6.587 8.790 561 HB2 LYS 73 1HB LYS 73 -3.165 -7.769 10.491 562 HB3 LYS 73 2HB LYS 73 -1.918 -6.531 10.580 563 HG2 LYS 73 1HG LYS 73 -3.252 -6.415 12.540 564 HG3 LYS 73 2HG LYS 73 -3.547 -4.987 11.568 565 HD2 LYS 73 1HD LYS 73 -5.729 -5.445 11.980 566 HD3 LYS 73 2HD LYS 73 -5.612 -6.628 10.695 567 HE2 LYS 73 1HE LYS 73 -5.326 -7.104 13.702 568 HE3 LYS 73 2HE LYS 73 -6.710 -7.534 12.701 569 HZ1 LYS 73 3HZ LYS 73 -4.029 -8.783 12.578 570 HZ2 LYS 73 1HZ LYS 73 -5.274 -9.161 11.557 571 HZ3 LYS 73 2HZ LYS 73 -5.418 -9.421 13.156 572 H MET 74 H MET 74 -5.186 -4.366 9.507 573 HA MET 74 HA MET 74 -3.267 -2.189 8.878 574 HB2 MET 74 1HB MET 74 -5.239 -1.874 7.595 575 HB3 MET 74 2HB MET 74 -6.289 -2.267 8.944 576 HG2 MET 74 1HG MET 74 -5.606 -0.222 10.118 577 HG3 MET 74 2HG MET 74 -4.318 0.062 8.970 578 HE1 MET 74 3HE MET 74 -8.777 0.724 8.511 579 HE2 MET 74 1HE MET 74 -7.963 -0.780 9.091 580 HE3 MET 74 2HE MET 74 -7.792 0.745 10.006 581 H PHE 75 H PHE 75 -2.532 -1.104 10.521 582 HA PHE 75 HA PHE 75 -3.703 -1.427 13.243 583 HB2 PHE 75 1HB PHE 75 -1.414 -1.417 14.069 584 HB3 PHE 75 2HB PHE 75 -1.657 -2.746 12.949 585 HD1 PHE 75 1HD PHE 75 -0.603 -2.688 10.663 586 HD2 PHE 75 2HD PHE 75 0.076 0.443 13.565 587 HE1 PHE 75 1HE PHE 75 1.368 -1.839 9.323 588 HE2 PHE 75 2HE PHE 75 2.024 1.225 12.223 589 HZ PHE 75 HZ PHE 75 2.681 0.024 10.181 590 H LYS 76 H LYS 76 -3.395 0.825 10.801 591 HA LYS 76 HA LYS 76 -3.564 3.071 12.599 592 HB2 LYS 76 1HB LYS 76 -1.139 2.989 12.472 593 HB3 LYS 76 2HB LYS 76 -1.162 2.728 10.734 594 HG2 LYS 76 1HG LYS 76 -2.005 4.982 10.338 595 HG3 LYS 76 2HG LYS 76 -2.202 5.254 12.071 596 HD2 LYS 76 1HD LYS 76 0.328 5.012 12.288 597 HD3 LYS 76 2HD LYS 76 0.400 4.866 10.525 598 HE2 LYS 76 1HE LYS 76 0.695 7.177 10.758 599 HE3 LYS 76 2HE LYS 76 -1.057 7.065 10.540 600 HZ1 LYS 76 3HZ LYS 76 -0.895 6.894 13.169 601 HZ2 LYS 76 1HZ LYS 76 -0.992 8.339 12.384 602 HZ3 LYS 76 2HZ LYS 76 0.468 7.790 12.887 603 H SER 77 H SER 77 -4.458 4.918 11.406 604 HA SER 77 HA SER 77 -4.749 4.661 8.521 605 HB2 SER 77 1HB SER 77 -7.131 5.114 8.513 606 HB3 SER 77 2HB SER 77 -6.751 3.544 9.223 607 HG SER 77 HG SER 77 -7.047 4.369 11.251 608 H ASP 78 H ASP 78 -5.342 6.881 7.655 609 HA ASP 78 HA ASP 78 -5.553 9.078 9.612 610 HB2 ASP 78 1HB ASP 78 -3.098 8.644 8.455 611 HB3 ASP 78 2HB ASP 78 -3.851 9.654 7.222 612 H ALA 79 H ALA 79 -6.231 11.125 8.172 613 HA ALA 79 HA ALA 79 -8.223 10.178 6.151 614 HB1 ALA 79 1HB ALA 79 -9.262 10.962 8.225 615 HB2 ALA 79 2HB ALA 79 -8.390 12.503 8.094 616 HB3 ALA 79 3HB ALA 79 -9.614 12.057 6.874 617 H ILE 80 H ILE 80 -8.639 11.592 4.337 618 HA ILE 80 HA ILE 80 -6.429 13.484 3.717 619 HB ILE 80 HB ILE 80 -7.937 11.693 1.767 620 HG12 ILE 80 1HG1 ILE 80 -5.096 11.250 2.738 621 HG13 ILE 80 2HG1 ILE 80 -6.459 10.340 3.375 622 HG21 ILE 80 1HG2 ILE 80 -6.962 13.852 0.912 623 HG22 ILE 80 2HG2 ILE 80 -5.361 13.306 1.437 624 HG23 ILE 80 3HG2 ILE 80 -6.241 12.439 0.161 625 HD11 ILE 80 3HD1 ILE 80 -7.066 9.531 1.126 626 HD12 ILE 80 1HD1 ILE 80 -5.634 10.335 0.465 627 HD13 ILE 80 2HD1 ILE 80 -5.457 9.018 1.637 628 H LEU 81 H LEU 81 -7.306 15.435 3.776 629 HA LEU 81 HA LEU 81 -10.124 15.805 2.907 630 HB2 LEU 81 1HB LEU 81 -8.248 17.845 4.134 631 HB3 LEU 81 2HB LEU 81 -9.934 18.096 3.708 632 HG LEU 81 HG LEU 81 -8.958 16.152 5.843 633 HD11 LEU 81 1HD1 LEU 81 -8.625 18.463 6.543 634 HD12 LEU 81 2HD1 LEU 81 -9.933 17.724 7.456 635 HD13 LEU 81 3HD1 LEU 81 -10.300 18.874 6.146 636 HD21 LEU 81 3HD2 LEU 81 -11.033 15.347 4.925 637 HD22 LEU 81 1HD2 LEU 81 -11.778 16.957 4.992 638 HD23 LEU 81 2HD2 LEU 81 -11.390 16.075 6.482 639 H GLY 82 H GLY 82 -10.543 16.936 1.033 640 HA2 GLY 82 1HA GLY 82 -8.367 17.876 -0.748 641 HA3 GLY 82 2HA GLY 82 -10.117 18.094 -0.974 642 H GLN 83 H GLN 83 -8.701 20.337 -1.328 643 HA GLN 83 HA GLN 83 -8.049 21.917 0.937 644 HB2 GLN 83 1HB GLN 83 -8.871 22.668 -1.887 645 HB3 GLN 83 2HB GLN 83 -8.155 23.795 -0.711 646 HG2 GLN 83 1HG GLN 83 -6.142 22.329 -0.604 647 HG3 GLN 83 2HG GLN 83 -6.852 21.316 -1.867 648 HE21 GLN 83 1HE2 GLN 83 -7.811 24.434 -2.717 649 HE22 GLN 83 2HE2 GLN 83 -6.465 24.865 -3.731 650 H ASN 84 H ASN 84 -10.971 20.768 0.810 651 HA ASN 84 HA ASN 84 -12.421 23.310 1.410 652 HB2 ASN 84 1HB ASN 84 -13.295 21.095 -0.486 653 HB3 ASN 84 2HB ASN 84 -14.388 22.271 0.212 654 HD21 ASN 84 1HD2 ASN 84 -11.917 21.799 -2.216 655 HD22 ASN 84 2HD2 ASN 84 -12.344 23.258 -3.053 656 H LYS 85 H LYS 85 -11.250 21.027 3.121 657 HA LYS 85 HA LYS 85 -11.801 19.489 4.651 658 HB2 LYS 85 1HB LYS 85 -14.240 21.216 5.173 659 HB3 LYS 85 2HB LYS 85 -13.509 20.049 6.278 660 HG2 LYS 85 1HG LYS 85 -11.428 21.418 6.363 661 HG3 LYS 85 2HG LYS 85 -12.166 22.588 5.249 662 HD2 LYS 85 1HD LYS 85 -14.089 22.789 6.927 663 HD3 LYS 85 2HD LYS 85 -13.072 21.918 8.085 664 HE2 LYS 85 1HE LYS 85 -12.254 24.463 6.601 665 HE3 LYS 85 2HE LYS 85 -13.021 24.446 8.198 666 HZ1 LYS 85 3HZ LYS 85 -11.158 23.418 9.133 667 HZ2 LYS 85 1HZ LYS 85 -10.566 24.624 8.181 668 HZ3 LYS 85 2HZ LYS 85 -10.466 23.058 7.703 669 H VAL 86 H VAL 86 -12.433 18.742 2.125 670 HA VAL 86 HA VAL 86 -14.888 17.170 2.346 671 HB VAL 86 HB VAL 86 -15.005 18.520 0.551 672 HG11 VAL 86 1HG1 VAL 86 -13.443 18.502 -1.269 673 HG12 VAL 86 2HG1 VAL 86 -12.707 18.998 0.276 674 HG13 VAL 86 3HG1 VAL 86 -12.414 17.369 -0.359 675 HG21 VAL 86 3HG2 VAL 86 -15.402 16.896 -1.230 676 HG22 VAL 86 1HG2 VAL 86 -14.342 15.711 -0.443 677 HG23 VAL 86 2HG2 VAL 86 -15.873 16.164 0.318 678 H VAL 87 H VAL 87 -14.441 15.195 3.418 679 HA VAL 87 HA VAL 87 -11.788 14.067 3.280 680 HB VAL 87 HB VAL 87 -13.012 13.951 5.275 681 HG11 VAL 87 1HG1 VAL 87 -14.935 11.915 4.107 682 HG12 VAL 87 2HG1 VAL 87 -14.925 12.648 5.734 683 HG13 VAL 87 3HG1 VAL 87 -15.326 13.621 4.332 684 HG21 VAL 87 3HG2 VAL 87 -12.425 11.747 5.915 685 HG22 VAL 87 1HG2 VAL 87 -12.517 11.161 4.228 686 HG23 VAL 87 2HG2 VAL 87 -11.254 12.304 4.717 687 H ILE 88 H ILE 88 -11.528 14.060 1.058 688 HA ILE 88 HA ILE 88 -12.984 12.506 -0.796 689 HB ILE 88 HB ILE 88 -10.836 12.641 -2.153 690 HG12 ILE 88 1HG1 ILE 88 -9.873 14.468 0.097 691 HG13 ILE 88 2HG1 ILE 88 -9.253 12.848 -0.184 692 HG21 ILE 88 1HG2 ILE 88 -11.945 15.230 -1.009 693 HG22 ILE 88 2HG2 ILE 88 -11.230 15.011 -2.622 694 HG23 ILE 88 3HG2 ILE 88 -12.765 14.237 -2.231 695 HD11 ILE 88 3HD1 ILE 88 -7.739 14.449 -1.186 696 HD12 ILE 88 1HD1 ILE 88 -8.544 13.556 -2.490 697 HD13 ILE 88 2HD1 ILE 88 -9.043 15.215 -2.088 698 H GLY 89 H GLY 89 -10.469 11.558 1.510 699 HA2 GLY 89 1HA GLY 89 -11.172 8.790 1.190 700 HA3 GLY 89 2HA GLY 89 -9.619 9.123 0.412 701 H TRP 90 H TRP 90 -8.893 7.513 2.082 702 HA TRP 90 HA TRP 90 -7.998 8.898 4.498 703 HB2 TRP 90 1HB TRP 90 -9.288 6.142 4.633 704 HB3 TRP 90 2HB TRP 90 -8.630 7.022 5.970 705 HD1 TRP 90 HD TRP 90 -10.125 8.960 6.984 706 HE1 TRP 90 1HE TRP 90 -12.603 9.693 6.641 707 HE3 TRP 90 3HE TRP 90 -11.233 6.443 2.590 708 HZ2 TRP 90 2HZ TRP 90 -14.769 9.123 4.843 709 HZ3 TRP 90 3HZ TRP 90 -13.464 6.659 1.601 710 HH2 TRP 90 HH TRP 90 -15.222 8.006 2.700 711 H ASP 91 H ASP 91 -5.967 8.202 5.030 712 HA ASP 91 HA ASP 91 -4.624 6.495 3.030 713 HB2 ASP 91 1HB ASP 91 -3.681 8.598 4.967 714 HB3 ASP 91 2HB ASP 91 -2.581 7.292 4.554 715 H LYS 92 H LYS 92 -5.297 4.506 3.499 716 HA LYS 92 HA LYS 92 -5.455 3.365 6.236 717 HB2 LYS 92 1HB LYS 92 -5.935 2.384 3.413 718 HB3 LYS 92 2HB LYS 92 -5.590 1.210 4.668 719 HG2 LYS 92 1HG LYS 92 -7.970 1.517 4.128 720 HG3 LYS 92 2HG LYS 92 -7.565 1.575 5.828 721 HD2 LYS 92 1HD LYS 92 -7.866 3.933 5.957 722 HD3 LYS 92 2HD LYS 92 -7.942 4.097 4.209 723 HE2 LYS 92 1HE LYS 92 -9.950 2.489 5.864 724 HE3 LYS 92 2HE LYS 92 -10.188 4.198 5.393 725 HZ1 LYS 92 3HZ LYS 92 -11.333 2.915 3.824 726 HZ2 LYS 92 1HZ LYS 92 -10.045 1.888 3.556 727 HZ3 LYS 92 2HZ LYS 92 -10.009 3.471 3.096 728 H TYR 93 H TYR 93 -3.702 2.439 7.267 729 HA TYR 93 HA TYR 93 -1.277 1.966 5.666 730 HB2 TYR 93 1HB TYR 93 -1.787 2.145 8.662 731 HB3 TYR 93 2HB TYR 93 -0.262 1.658 7.989 732 HD1 TYR 93 1HD TYR 93 -2.716 4.526 7.477 733 HD2 TYR 93 2HD TYR 93 1.417 3.317 7.934 734 HE1 TYR 93 1HE TYR 93 -2.030 6.788 6.979 735 HE2 TYR 93 2HE TYR 93 2.099 5.669 7.572 736 HH TYR 93 HH TYR 93 -0.205 8.321 7.033 737 H PHE 94 H PHE 94 -0.126 -0.129 5.974 738 HA PHE 94 HA PHE 94 -1.743 -2.327 7.070 739 HB2 PHE 94 1HB PHE 94 -0.861 -2.202 4.156 740 HB3 PHE 94 2HB PHE 94 -1.412 -3.665 4.959 741 HD1 PHE 94 1HD PHE 94 -3.805 -3.627 6.092 742 HD2 PHE 94 2HD PHE 94 -2.471 -0.717 3.180 743 HE1 PHE 94 1HE PHE 94 -6.153 -3.114 5.533 744 HE2 PHE 94 2HE PHE 94 -4.827 -0.177 2.694 745 HZ PHE 94 HZ PHE 94 -6.674 -1.365 3.849 746 H GLU 95 H GLU 95 -0.559 -4.200 7.456 747 HA GLU 95 HA GLU 95 2.408 -3.954 7.379 748 HB2 GLU 95 1HB GLU 95 1.024 -3.990 9.546 749 HB3 GLU 95 2HB GLU 95 0.603 -5.640 9.197 750 HG2 GLU 95 1HG GLU 95 2.944 -6.306 9.191 751 HG3 GLU 95 2HG GLU 95 3.488 -4.633 9.274 752 H ILE 96 H ILE 96 2.489 -4.929 5.134 753 HA ILE 96 HA ILE 96 1.342 -7.651 4.946 754 HB ILE 96 HB ILE 96 2.716 -6.005 2.791 755 HG12 ILE 96 1HG1 ILE 96 0.133 -6.187 1.981 756 HG13 ILE 96 2HG1 ILE 96 -0.165 -6.211 3.716 757 HG21 ILE 96 1HG2 ILE 96 0.997 -8.514 2.538 758 HG22 ILE 96 2HG2 ILE 96 1.694 -7.565 1.215 759 HG23 ILE 96 3HG2 ILE 96 2.760 -8.448 2.303 760 HD11 ILE 96 3HD1 ILE 96 1.332 -4.105 2.123 761 HD12 ILE 96 1HD1 ILE 96 -0.331 -3.967 2.698 762 HD13 ILE 96 2HD1 ILE 96 1.012 -3.990 3.866 763 HA PRO 97 HA PRO 97 5.501 -9.485 5.605 764 HB2 PRO 97 1HB PRO 97 5.123 -11.689 3.858 765 HB3 PRO 97 2HB PRO 97 4.710 -11.648 5.578 766 HG2 PRO 97 1HG PRO 97 2.976 -11.126 3.179 767 HG3 PRO 97 2HG PRO 97 2.579 -12.099 4.645 768 HD2 PRO 97 1HD PRO 97 1.668 -9.638 4.332 769 HD3 PRO 97 2HD PRO 97 2.256 -10.117 5.929 770 H MET 98 H MET 98 7.184 -10.407 4.110 771 HA MET 98 HA MET 98 7.202 -9.221 1.373 772 HB2 MET 98 1HB MET 98 9.488 -9.721 3.378 773 HB3 MET 98 2HB MET 98 9.773 -9.261 1.707 774 HG2 MET 98 1HG MET 98 8.732 -7.110 2.035 775 HG3 MET 98 2HG MET 98 8.310 -7.522 3.710 776 HE1 MET 98 3HE MET 98 9.907 -4.967 2.824 777 HE2 MET 98 1HE MET 98 9.513 -5.349 4.522 778 HE3 MET 98 2HE MET 98 11.180 -4.910 4.062 779 H ASP 99 H ASP 99 6.723 -12.056 2.905 780 HA ASP 99 HA ASP 99 8.172 -13.623 0.847 781 HB2 ASP 99 1HB ASP 99 8.646 -13.452 3.701 782 HB3 ASP 99 2HB ASP 99 8.010 -15.049 3.352 783 H ALA 100 H ALA 100 5.186 -12.624 1.221 784 HA ALA 100 HA ALA 100 4.063 -15.409 1.236 785 HB1 ALA 100 1HB ALA 100 2.533 -13.195 2.551 786 HB2 ALA 100 2HB ALA 100 2.326 -14.926 2.671 787 HB3 ALA 100 3HB ALA 100 3.712 -14.178 3.483 788 H LEU 101 H LEU 101 4.738 -12.828 -0.560 789 HA LEU 101 HA LEU 101 2.224 -12.503 -1.990 790 HB2 LEU 101 1HB LEU 101 5.082 -11.513 -2.462 791 HB3 LEU 101 2HB LEU 101 3.619 -10.913 -3.242 792 HG LEU 101 HG LEU 101 4.398 -9.450 -1.601 793 HD11 LEU 101 1HD1 LEU 101 2.061 -10.824 -0.256 794 HD12 LEU 101 2HD1 LEU 101 1.906 -9.775 -1.684 795 HD13 LEU 101 3HD1 LEU 101 2.506 -9.101 -0.152 796 HD21 LEU 101 3HD2 LEU 101 5.748 -11.061 -0.438 797 HD22 LEU 101 1HD2 LEU 101 4.380 -11.086 0.757 798 HD23 LEU 101 2HD2 LEU 101 5.201 -9.562 0.318 799 H GLN 102 H GLN 102 1.935 -13.254 -4.034 800 HA GLN 102 HA GLN 102 3.048 -15.647 -4.903 801 HB2 GLN 102 1HB GLN 102 0.951 -14.315 -5.738 802 HB3 GLN 102 2HB GLN 102 2.048 -13.598 -6.914 803 HG2 GLN 102 1HG GLN 102 2.690 -15.861 -7.537 804 HG3 GLN 102 2HG GLN 102 1.503 -16.576 -6.427 805 HE21 GLN 102 1HE2 GLN 102 -0.817 -16.253 -6.887 806 HE22 GLN 102 2HE2 GLN 102 -1.326 -15.890 -8.521 807 H ASP 103 H ASP 103 4.677 -12.726 -5.026 808 HA ASP 103 HA ASP 103 6.838 -13.721 -6.682 809 HB2 ASP 103 1HB ASP 103 4.955 -12.609 -8.213 810 HB3 ASP 103 2HB ASP 103 5.670 -11.108 -7.629 811 H ASN 104 H ASN 104 8.536 -11.713 -6.835 812 HA ASN 104 HA ASN 104 8.948 -10.654 -4.154 813 HB2 ASN 104 1HB ASN 104 10.458 -10.388 -6.800 814 HB3 ASN 104 2HB ASN 104 10.802 -9.341 -5.467 815 HD21 ASN 104 1HD2 ASN 104 12.795 -10.038 -5.163 816 HD22 ASN 104 2HD2 ASN 104 13.261 -11.565 -4.465 817 H SER 105 H SER 105 6.402 -9.744 -5.521 818 HA SER 105 HA SER 105 6.860 -6.864 -5.247 819 HB2 SER 105 1HB SER 105 5.227 -6.466 -7.210 820 HB3 SER 105 2HB SER 105 6.862 -6.839 -7.586 821 HG SER 105 HG SER 105 6.566 -8.580 -8.393 822 H ILE 106 H ILE 106 5.468 -5.859 -4.084 823 HA ILE 106 HA ILE 106 3.299 -7.374 -2.798 824 HB ILE 106 HB ILE 106 4.905 -5.691 -1.740 825 HG12 ILE 106 1HG1 ILE 106 3.148 -6.482 -0.440 826 HG13 ILE 106 2HG1 ILE 106 3.412 -4.775 -0.142 827 HG21 ILE 106 1HG2 ILE 106 4.431 -3.328 -1.778 828 HG22 ILE 106 2HG2 ILE 106 4.825 -3.911 -3.401 829 HG23 ILE 106 3HG2 ILE 106 3.141 -3.556 -2.972 830 HD11 ILE 106 3HD1 ILE 106 1.030 -6.098 -1.445 831 HD12 ILE 106 1HD1 ILE 106 1.081 -5.024 -0.062 832 HD13 ILE 106 2HD1 ILE 106 1.350 -4.354 -1.675 833 H GLN 107 H GLN 107 0.984 -6.714 -3.178 834 HA GLN 107 HA GLN 107 0.393 -4.496 -4.890 835 HB2 GLN 107 1HB GLN 107 0.761 -6.597 -6.471 836 HB3 GLN 107 2HB GLN 107 -0.769 -7.157 -5.793 837 HG2 GLN 107 1HG GLN 107 -1.780 -4.930 -6.529 838 HG3 GLN 107 2HG GLN 107 -0.236 -4.600 -7.326 839 HE21 GLN 107 1HE2 GLN 107 -2.412 -4.508 -8.867 840 HE22 GLN 107 2HE2 GLN 107 -2.483 -5.813 -9.963 841 H ILE 108 H ILE 108 -1.754 -3.748 -4.381 842 HA ILE 108 HA ILE 108 -3.339 -5.371 -2.445 843 HB ILE 108 HB ILE 108 -2.855 -2.367 -2.583 844 HG12 ILE 108 1HG1 ILE 108 -2.459 -4.373 -0.310 845 HG13 ILE 108 2HG1 ILE 108 -1.171 -3.791 -1.357 846 HG21 ILE 108 1HG2 ILE 108 -4.470 -2.135 -0.697 847 HG22 ILE 108 2HG2 ILE 108 -5.245 -2.633 -2.173 848 HG23 ILE 108 3HG2 ILE 108 -4.924 -3.841 -0.899 849 HD11 ILE 108 3HD1 ILE 108 -2.741 -2.098 0.630 850 HD12 ILE 108 1HD1 ILE 108 -1.045 -2.592 0.703 851 HD13 ILE 108 2HD1 ILE 108 -1.578 -1.473 -0.558 852 H LYS 109 H LYS 109 -5.748 -5.024 -2.771 853 HA LYS 109 HA LYS 109 -6.576 -3.581 -5.129 854 HB2 LYS 109 1HB LYS 109 -7.723 -5.575 -6.153 855 HB3 LYS 109 2HB LYS 109 -5.984 -5.640 -6.252 856 HG2 LYS 109 1HG LYS 109 -6.851 -7.046 -3.842 857 HG3 LYS 109 2HG LYS 109 -7.796 -7.586 -5.212 858 HD2 LYS 109 1HD LYS 109 -5.816 -8.974 -4.810 859 HD3 LYS 109 2HD LYS 109 -5.867 -8.310 -6.422 860 HE2 LYS 109 1HE LYS 109 -4.206 -6.589 -5.836 861 HE3 LYS 109 2HE LYS 109 -4.202 -7.150 -4.125 862 HZ1 LYS 109 3HZ LYS 109 -3.270 -8.577 -6.530 863 HZ2 LYS 109 1HZ LYS 109 -3.422 -9.318 -5.077 864 HZ3 LYS 109 2HZ LYS 109 -2.356 -8.117 -5.255 865 H ALA 110 H ALA 110 -9.088 -3.538 -5.148 866 HA ALA 110 HA ALA 110 -10.395 -4.705 -2.809 867 HB1 ALA 110 1HB ALA 110 -10.252 -1.678 -3.049 868 HB2 ALA 110 2HB ALA 110 -10.952 -2.660 -1.737 869 HB3 ALA 110 3HB ALA 110 -9.217 -2.612 -1.948 870 H LEU 111 H LEU 111 -12.664 -4.407 -2.811 871 HA LEU 111 HA LEU 111 -14.008 -4.136 -5.411 872 HB2 LEU 111 1HB LEU 111 -14.804 -5.832 -3.886 873 HB3 LEU 111 2HB LEU 111 -14.823 -4.697 -2.535 874 HG LEU 111 HG LEU 111 -16.723 -3.460 -3.595 875 HD11 LEU 111 1HD1 LEU 111 -16.472 -4.063 -5.963 876 HD12 LEU 111 2HD1 LEU 111 -18.041 -4.596 -5.364 877 HD13 LEU 111 3HD1 LEU 111 -16.732 -5.776 -5.578 878 HD21 LEU 111 3HD2 LEU 111 -17.025 -5.192 -1.884 879 HD22 LEU 111 1HD2 LEU 111 -17.164 -6.418 -3.159 880 HD23 LEU 111 2HD2 LEU 111 -18.379 -5.128 -3.030 881 H SER 112 H SER 112 -14.937 -2.304 -6.119 882 HA SER 112 HA SER 112 -14.982 0.093 -4.326 883 HB2 SER 112 1HB SER 112 -14.779 -0.040 -7.365 884 HB3 SER 112 2HB SER 112 -14.831 1.410 -6.363 885 HG SER 112 HG SER 112 -12.758 1.082 -6.570 886 H SER 113 H SER 113 -16.606 -0.865 -7.290 887 HA SER 113 HA SER 113 -19.195 0.259 -6.407 888 HB2 SER 113 1HB SER 113 -18.186 1.669 -8.059 889 HB3 SER 113 2HB SER 113 -17.602 0.302 -9.000 890 HG SER 113 HG SER 113 -20.308 1.150 -8.768 891 H GLY 114 H GLY 114 -20.963 -0.902 -7.957 892 HA2 GLY 114 1HA GLY 114 -21.397 -3.430 -6.984 893 HA3 GLY 114 2HA GLY 114 -22.047 -2.893 -8.538 894 H THR 115 H THR 115 -20.357 -5.259 -7.152 895 HA THR 115 HA THR 115 -19.236 -7.010 -7.877 896 HB THR 115 HB THR 115 -19.937 -6.790 -10.720 897 HG1 THR 115 1HG THR 115 -21.807 -5.981 -10.454 898 HG21 THR 115 3HG2 THR 115 -20.849 -8.955 -10.328 899 HG22 THR 115 1HG2 THR 115 -20.919 -8.680 -8.559 900 HG23 THR 115 2HG2 THR 115 -19.355 -8.875 -9.395 901 H THR 116 H THR 116 -17.615 -4.284 -8.311 902 HA THR 116 HA THR 116 -15.991 -5.126 -10.626 903 HB THR 116 HB THR 116 -17.175 -2.796 -10.278 904 HG1 THR 116 1HG THR 116 -15.180 -1.830 -11.195 905 HG21 THR 116 3HG2 THR 116 -15.961 -1.132 -9.104 906 HG22 THR 116 1HG2 THR 116 -14.573 -2.187 -8.809 907 HG23 THR 116 2HG2 THR 116 -16.090 -2.491 -7.951 908 H PHE 117 H PHE 117 -13.535 -4.589 -10.246 909 HA PHE 117 HA PHE 117 -12.730 -4.368 -7.446 910 HB2 PHE 117 1HB PHE 117 -12.675 -6.830 -8.862 911 HB3 PHE 117 2HB PHE 117 -11.006 -6.246 -8.825 912 HD1 PHE 117 2HD PHE 117 -13.900 -7.341 -6.878 913 HD2 PHE 117 1HD PHE 117 -9.843 -6.009 -6.653 914 HE1 PHE 117 2HE PHE 117 -13.811 -8.117 -4.502 915 HE2 PHE 117 1HE PHE 117 -9.723 -6.774 -4.256 916 HZ PHE 117 HZ PHE 117 -11.717 -7.831 -3.204 917 H VAL 118 H VAL 118 -11.132 -2.859 -7.311 918 HA VAL 118 HA VAL 118 -9.675 -2.077 -9.796 919 HB VAL 118 HB VAL 118 -9.802 -0.598 -7.126 920 HG11 VAL 118 1HG1 VAL 118 -8.764 0.343 -9.843 921 HG12 VAL 118 2HG1 VAL 118 -8.780 1.282 -8.334 922 HG13 VAL 118 3HG1 VAL 118 -7.743 -0.148 -8.483 923 HG21 VAL 118 3HG2 VAL 118 -11.229 1.052 -8.306 924 HG22 VAL 118 1HG2 VAL 118 -11.190 0.062 -9.785 925 HG23 VAL 118 2HG2 VAL 118 -12.020 -0.529 -8.345 926 H TYR 119 H TYR 119 -7.466 -2.384 -9.745 927 HA TYR 119 HA TYR 119 -6.328 -3.749 -7.374 928 HB2 TYR 119 1HB TYR 119 -5.446 -4.180 -10.238 929 HB3 TYR 119 2HB TYR 119 -4.956 -5.095 -8.817 930 HD1 TYR 119 1HD TYR 119 -7.600 -4.512 -11.315 931 HD2 TYR 119 2HD TYR 119 -6.403 -6.950 -8.009 932 HE1 TYR 119 1HE TYR 119 -9.456 -6.043 -11.806 933 HE2 TYR 119 2HE TYR 119 -8.257 -8.503 -8.442 934 HH TYR 119 HH TYR 119 -10.628 -7.843 -11.082 935 H SER 120 H SER 120 -4.238 -2.975 -6.781 936 HA SER 120 HA SER 120 -3.705 -0.242 -7.688 937 HB2 SER 120 1HB SER 120 -2.321 -0.157 -5.829 938 HB3 SER 120 2HB SER 120 -3.556 -1.226 -5.309 939 HG SER 120 HG SER 120 -1.014 -2.084 -6.296 940 H GLN 121 H GLN 121 -1.269 0.179 -8.259 941 HA GLN 121 HA GLN 121 -0.412 -1.606 -10.399 942 HB2 GLN 121 1HB GLN 121 1.608 -0.321 -10.511 943 HB3 GLN 121 2HB GLN 121 0.232 0.770 -10.430 944 HG2 GLN 121 1HG GLN 121 1.920 0.050 -7.987 945 HG3 GLN 121 2HG GLN 121 2.359 1.315 -9.129 946 HE21 GLN 121 1HE2 GLN 121 1.450 3.331 -9.014 947 HE22 GLN 121 2HE2 GLN 121 0.472 3.737 -7.634 948 H LYS 122 H LYS 122 1.771 -2.634 -10.344 949 HA LYS 122 HA LYS 122 2.204 -4.284 -7.897 950 HB2 LYS 122 1HB LYS 122 1.564 -5.382 -10.075 951 HB3 LYS 122 2HB LYS 122 3.038 -4.718 -10.807 952 HG2 LYS 122 1HG LYS 122 4.409 -6.026 -9.176 953 HG3 LYS 122 2HG LYS 122 2.908 -6.666 -8.474 954 HD2 LYS 122 1HD LYS 122 3.480 -8.391 -9.928 955 HD3 LYS 122 2HD LYS 122 2.383 -7.435 -10.938 956 HE2 LYS 122 1HE LYS 122 4.446 -6.267 -11.894 957 HE3 LYS 122 2HE LYS 122 5.441 -7.398 -10.965 958 HZ1 LYS 122 3HZ LYS 122 5.107 -8.136 -13.250 959 HZ2 LYS 122 1HZ LYS 122 3.466 -8.217 -13.015 960 HZ3 LYS 122 2HZ LYS 122 4.468 -9.211 -12.182 961 H ILE 123 H ILE 123 4.376 -4.332 -7.030 962 HA ILE 123 HA ILE 123 6.433 -2.552 -8.164 963 HB ILE 123 HB ILE 123 5.231 -2.317 -5.336 964 HG12 ILE 123 1HG1 ILE 123 3.709 -1.220 -6.967 965 HG13 ILE 123 2HG1 ILE 123 4.370 -0.156 -5.759 966 HG21 ILE 123 1HG2 ILE 123 7.645 -1.817 -5.338 967 HG22 ILE 123 2HG2 ILE 123 7.371 -0.577 -6.582 968 HG23 ILE 123 3HG2 ILE 123 6.680 -0.379 -4.969 969 HD11 ILE 123 3HD1 ILE 123 4.239 0.827 -8.039 970 HD12 ILE 123 1HD1 ILE 123 5.865 0.878 -7.353 971 HD13 ILE 123 2HD1 ILE 123 5.460 -0.330 -8.593 972 H ASP 124 H ASP 124 7.709 -4.105 -8.553 973 HA ASP 124 HA ASP 124 8.533 -6.311 -6.875 974 HB2 ASP 124 1HB ASP 124 9.415 -4.884 -9.351 975 HB3 ASP 124 2HB ASP 124 10.620 -5.810 -8.508 976 H PHE 125 H PHE 125 9.895 -6.361 -5.231 977 HA PHE 125 HA PHE 125 11.965 -4.242 -4.935 978 HB2 PHE 125 1HB PHE 125 11.582 -4.152 -2.537 979 HB3 PHE 125 2HB PHE 125 10.053 -3.820 -3.310 980 HD1 PHE 125 2HD PHE 125 8.239 -5.657 -3.461 981 HD2 PHE 125 1HD PHE 125 11.743 -5.897 -0.931 982 HE1 PHE 125 2HE PHE 125 7.189 -7.476 -2.179 983 HE2 PHE 125 1HE PHE 125 10.688 -7.677 0.368 984 HZ PHE 125 HZ PHE 125 8.409 -8.506 -0.271 985 H GLU 126 H GLU 126 13.499 -5.122 -3.061 986 HA GLU 126 HA GLU 126 14.229 -7.932 -3.567 987 HB2 GLU 126 1HB GLU 126 15.794 -5.575 -4.212 988 HB3 GLU 126 2HB GLU 126 16.649 -6.776 -3.194 989 HG2 GLU 126 1HG GLU 126 15.184 -7.523 -5.713 990 HG3 GLU 126 2HG GLU 126 16.830 -6.921 -5.757 991 H ARG 127 H ARG 127 15.016 -9.083 -1.935 992 HA ARG 127 HA ARG 127 14.287 -8.015 0.732 993 HB2 ARG 127 1HB ARG 127 14.432 -10.845 -0.397 994 HB3 ARG 127 2HB ARG 127 14.457 -10.499 1.321 995 HG2 ARG 127 1HG ARG 127 12.245 -10.928 1.040 996 HG3 ARG 127 2HG ARG 127 12.286 -9.170 0.920 997 HD2 ARG 127 1HD ARG 127 10.776 -10.152 -0.757 998 HD3 ARG 127 2HD ARG 127 12.136 -9.323 -1.526 999 HE ARG 127 HE ARG 127 12.972 -11.290 -2.284 1000 HH11 ARG 127 1HH1 ARG 127 10.455 -12.202 0.128 1001 HH12 ARG 127 2HH1 ARG 127 10.640 -13.892 -0.245 1002 HH21 ARG 127 1HH2 ARG 127 12.542 -13.532 -3.105 1003 HH22 ARG 127 2HH2 ARG 127 11.804 -14.621 -1.976 1004 H GLU 128 H GLU 128 15.998 -7.070 1.440 1005 HA GLU 128 HA GLU 128 18.659 -7.425 1.013 1006 HB2 GLU 128 1HB GLU 128 17.450 -5.571 2.316 1007 HB3 GLU 128 2HB GLU 128 17.379 -6.685 3.674 1008 HG2 GLU 128 1HG GLU 128 19.254 -5.455 4.163 1009 HG3 GLU 128 2HG GLU 128 19.926 -6.887 3.407 Start of MODEL 8 1 H1 GLY 1 H GLY 1 -25.148 8.945 -0.985 2 HA2 GLY 1 1HA GLY 1 -26.073 8.545 -3.763 3 HA3 GLY 1 2HA GLY 1 -26.748 9.733 -2.634 4 H ALA 2 H ALA 2 -25.350 11.608 -2.015 5 HA ALA 2 HA ALA 2 -23.509 12.306 -4.234 6 HB1 ALA 2 1HB ALA 2 -24.741 14.046 -2.053 7 HB2 ALA 2 2HB ALA 2 -23.759 14.605 -3.414 8 HB3 ALA 2 3HB ALA 2 -25.350 13.889 -3.723 9 H GLU 3 H GLU 3 -23.508 12.203 -0.622 10 HA GLU 3 HA GLU 3 -20.573 12.523 -0.775 11 HB2 GLU 3 1HB GLU 3 -21.952 12.108 1.849 12 HB3 GLU 3 2HB GLU 3 -20.500 12.991 1.391 13 HG2 GLU 3 1HG GLU 3 -21.839 14.752 1.867 14 HG3 GLU 3 2HG GLU 3 -22.209 14.609 0.150 15 H ALA 4 H ALA 4 -19.439 11.131 1.050 16 HA ALA 4 HA ALA 4 -18.317 9.193 1.191 17 HB1 ALA 4 1HB ALA 4 -19.534 7.388 2.283 18 HB2 ALA 4 2HB ALA 4 -19.909 8.972 2.998 19 HB3 ALA 4 3HB ALA 4 -21.082 8.189 1.909 20 H LEU 5 H LEU 5 -18.639 9.738 -1.411 21 HA LEU 5 HA LEU 5 -19.934 7.783 -3.007 22 HB2 LEU 5 1HB LEU 5 -17.642 9.676 -3.459 23 HB3 LEU 5 2HB LEU 5 -18.148 8.646 -4.761 24 HG LEU 5 HG LEU 5 -19.985 10.502 -3.279 25 HD11 LEU 5 1HD1 LEU 5 -18.319 11.143 -5.731 26 HD12 LEU 5 2HD1 LEU 5 -18.223 11.885 -4.115 27 HD13 LEU 5 3HD1 LEU 5 -19.655 12.137 -5.115 28 HD21 LEU 5 3HD2 LEU 5 -21.064 8.743 -4.716 29 HD22 LEU 5 1HD2 LEU 5 -20.134 9.403 -6.102 30 HD23 LEU 5 2HD2 LEU 5 -21.384 10.383 -5.305 31 HA PRO 6 HA PRO 6 -17.325 4.333 -2.435 32 HB2 PRO 6 1HB PRO 6 -17.509 2.993 -4.814 33 HB3 PRO 6 2HB PRO 6 -18.902 3.201 -3.703 34 HG2 PRO 6 1HG PRO 6 -18.202 4.818 -6.164 35 HG3 PRO 6 2HG PRO 6 -19.788 4.123 -5.678 36 HD2 PRO 6 1HD PRO 6 -19.039 6.783 -5.174 37 HD3 PRO 6 2HD PRO 6 -20.159 5.852 -4.122 38 H LEU 7 H LEU 7 -15.474 3.204 -3.135 39 HA LEU 7 HA LEU 7 -13.199 4.734 -3.577 40 HB2 LEU 7 1HB LEU 7 -13.196 2.595 -2.493 41 HB3 LEU 7 2HB LEU 7 -13.803 1.797 -3.922 42 HG LEU 7 HG LEU 7 -11.583 2.556 -5.090 43 HD11 LEU 7 1HD1 LEU 7 -10.874 2.946 -2.153 44 HD12 LEU 7 2HD1 LEU 7 -10.881 4.196 -3.407 45 HD13 LEU 7 3HD1 LEU 7 -9.718 2.874 -3.500 46 HD21 LEU 7 3HD2 LEU 7 -12.071 0.269 -4.604 47 HD22 LEU 7 1HD2 LEU 7 -11.750 0.475 -2.889 48 HD23 LEU 7 2HD2 LEU 7 -10.417 0.606 -4.056 49 H TYR 8 H TYR 8 -12.683 5.891 -5.359 50 HA TYR 8 HA TYR 8 -13.256 4.744 -8.060 51 HB2 TYR 8 1HB TYR 8 -13.402 7.138 -8.805 52 HB3 TYR 8 2HB TYR 8 -14.692 6.486 -7.829 53 HD1 TYR 8 2HD TYR 8 -11.479 8.454 -7.337 54 HD2 TYR 8 1HD TYR 8 -15.585 7.818 -6.181 55 HE1 TYR 8 2HE TYR 8 -11.367 10.414 -5.797 56 HE2 TYR 8 1HE TYR 8 -15.480 9.742 -4.659 57 HH TYR 8 HH TYR 8 -14.174 11.393 -3.788 58 H TYR 9 H TYR 9 -10.593 5.183 -6.119 59 HA TYR 9 HA TYR 9 -8.750 5.239 -8.429 60 HB2 TYR 9 1HB TYR 9 -8.912 7.601 -7.572 61 HB3 TYR 9 2HB TYR 9 -8.619 6.967 -5.972 62 HD1 TYR 9 2HD TYR 9 -6.941 7.204 -9.330 63 HD2 TYR 9 1HD TYR 9 -6.461 6.798 -5.064 64 HE1 TYR 9 2HE TYR 9 -4.515 7.604 -9.565 65 HE2 TYR 9 1HE TYR 9 -4.082 7.328 -5.262 66 HH TYR 9 HH TYR 9 -2.510 8.124 -8.416 67 H LEU 10 H LEU 10 -6.806 3.837 -7.931 68 HA LEU 10 HA LEU 10 -6.509 3.264 -5.110 69 HB2 LEU 10 1HB LEU 10 -7.835 1.525 -6.431 70 HB3 LEU 10 2HB LEU 10 -6.334 1.258 -7.314 71 HG LEU 10 HG LEU 10 -6.538 -0.493 -6.003 72 HD11 LEU 10 1HD1 LEU 10 -4.719 -0.368 -4.279 73 HD12 LEU 10 2HD1 LEU 10 -4.936 1.362 -4.125 74 HD13 LEU 10 3HD1 LEU 10 -4.341 0.755 -5.648 75 HD21 LEU 10 3HD2 LEU 10 -8.196 0.841 -4.240 76 HD22 LEU 10 1HD2 LEU 10 -6.769 0.549 -3.239 77 HD23 LEU 10 2HD2 LEU 10 -7.573 -0.819 -4.028 78 H GLN 11 H GLN 11 -4.446 3.364 -4.488 79 HA GLN 11 HA GLN 11 -2.331 2.847 -6.383 80 HB2 GLN 11 1HB GLN 11 -3.050 5.323 -6.592 81 HB3 GLN 11 2HB GLN 11 -2.421 5.543 -4.996 82 HG2 GLN 11 1HG GLN 11 -0.702 6.247 -6.435 83 HG3 GLN 11 2HG GLN 11 -0.176 4.656 -5.933 84 HE21 GLN 11 1HE2 GLN 11 -2.682 4.035 -8.218 85 HE22 GLN 11 2HE2 GLN 11 -1.609 3.884 -9.590 86 H ILE 12 H ILE 12 -0.609 2.039 -5.333 87 HA ILE 12 HA ILE 12 -0.514 1.587 -2.514 88 HB ILE 12 HB ILE 12 1.643 1.488 -4.653 89 HG12 ILE 12 1HG1 ILE 12 -0.024 -0.053 -5.314 90 HG13 ILE 12 2HG1 ILE 12 1.198 -0.997 -4.484 91 HG21 ILE 12 1HG2 ILE 12 2.618 1.413 -2.260 92 HG22 ILE 12 2HG2 ILE 12 1.778 -0.128 -2.075 93 HG23 ILE 12 3HG2 ILE 12 3.001 0.066 -3.332 94 HD11 ILE 12 3HD1 ILE 12 -0.866 -1.867 -3.773 95 HD12 ILE 12 1HD1 ILE 12 -0.271 -0.942 -2.402 96 HD13 ILE 12 2HD1 ILE 12 -1.550 -0.265 -3.436 97 H THR 13 H THR 13 0.372 4.418 -4.250 98 HA THR 13 HA THR 13 1.251 6.386 -3.801 99 HB THR 13 HB THR 13 -0.257 5.847 -1.253 100 HG1 THR 13 1HG THR 13 -1.354 7.015 -3.527 101 HG21 THR 13 3HG2 THR 13 -0.850 8.218 -1.313 102 HG22 THR 13 1HG2 THR 13 0.221 8.470 -2.711 103 HG23 THR 13 2HG2 THR 13 0.885 8.026 -1.124 104 H GLY 14 H GLY 14 2.227 4.473 -0.848 105 HA2 GLY 14 1HA GLY 14 4.918 5.603 -1.106 106 HA3 GLY 14 2HA GLY 14 4.084 6.048 0.379 107 H ILE 15 H ILE 15 6.437 4.369 0.409 108 HA ILE 15 HA ILE 15 5.343 1.838 1.364 109 HB ILE 15 HB ILE 15 5.667 1.634 -1.172 110 HG12 ILE 15 1HG1 ILE 15 7.159 -0.363 0.547 111 HG13 ILE 15 2HG1 ILE 15 5.406 -0.274 0.381 112 HG21 ILE 15 1HG2 ILE 15 8.619 1.271 -0.540 113 HG22 ILE 15 2HG2 ILE 15 7.831 1.395 -2.129 114 HG23 ILE 15 3HG2 ILE 15 7.998 2.821 -1.096 115 HD11 ILE 15 3HD1 ILE 15 5.547 -0.757 -2.020 116 HD12 ILE 15 1HD1 ILE 15 7.325 -0.792 -1.951 117 HD13 ILE 15 2HD1 ILE 15 6.401 -2.010 -1.097 118 H THR 16 H THR 16 6.794 0.803 2.736 119 HA THR 16 HA THR 16 9.559 1.413 2.667 120 HB THR 16 HB THR 16 8.944 3.406 3.908 121 HG1 THR 16 1HG THR 16 10.020 1.797 5.921 122 HG21 THR 16 3HG2 THR 16 7.878 1.634 6.158 123 HG22 THR 16 1HG2 THR 16 6.842 2.521 5.028 124 HG23 THR 16 2HG2 THR 16 7.929 3.412 6.092 125 H SER 17 H SER 17 10.444 0.170 4.870 126 HA SER 17 HA SER 17 8.664 -1.912 5.783 127 HB2 SER 17 1HB SER 17 11.224 -2.537 4.271 128 HB3 SER 17 2HB SER 17 10.420 -3.714 5.322 129 HG SER 17 HG SER 17 8.799 -2.330 3.522 130 H ASP 18 H ASP 18 9.900 -3.148 7.548 131 HA ASP 18 HA ASP 18 10.572 -1.129 9.430 132 HB2 ASP 18 1HB ASP 18 10.557 -2.828 11.025 133 HB3 ASP 18 2HB ASP 18 9.321 -3.208 9.873 134 H GLY 19 H GLY 19 12.649 -3.047 7.360 135 HA2 GLY 19 1HA GLY 19 15.046 -2.272 8.893 136 HA3 GLY 19 2HA GLY 19 14.983 -3.258 7.441 137 H ASN 20 H ASN 20 13.012 -0.483 6.975 138 HA ASN 20 HA ASN 20 15.198 0.758 5.400 139 HB2 ASN 20 1HB ASN 20 12.512 -0.013 4.653 140 HB3 ASN 20 2HB ASN 20 12.746 1.716 4.375 141 HD21 ASN 20 1HD2 ASN 20 13.019 1.694 2.023 142 HD22 ASN 20 2HD2 ASN 20 14.282 0.752 1.301 143 H ASP 21 H ASP 21 14.476 1.315 8.290 144 HA ASP 21 HA ASP 21 14.320 3.038 9.679 145 HB2 ASP 21 1HB ASP 21 16.298 3.769 8.206 146 HB3 ASP 21 2HB ASP 21 15.180 4.907 7.461 147 H PHE 22 H PHE 22 12.020 2.334 8.101 148 HA PHE 22 HA PHE 22 9.913 2.962 7.575 149 HB2 PHE 22 1HB PHE 22 10.400 4.944 9.809 150 HB3 PHE 22 2HB PHE 22 8.834 4.588 9.106 151 HD1 PHE 22 2HD PHE 22 11.753 2.789 10.763 152 HD2 PHE 22 1HD PHE 22 7.480 2.914 10.094 153 HE1 PHE 22 2HE PHE 22 11.478 0.795 12.164 154 HE2 PHE 22 1HE PHE 22 7.219 0.974 11.602 155 HZ PHE 22 HZ PHE 22 9.195 -0.135 12.587 156 H ALA 23 H ALA 23 12.254 4.308 6.142 157 HA ALA 23 HA ALA 23 11.546 6.894 5.269 158 HB1 ALA 23 1HB ALA 23 13.792 6.006 5.020 159 HB2 ALA 23 2HB ALA 23 13.200 4.759 3.893 160 HB3 ALA 23 3HB ALA 23 13.119 6.474 3.450 161 H TRP 24 H TRP 24 9.401 6.990 4.832 162 HA TRP 24 HA TRP 24 7.822 5.167 3.467 163 HB2 TRP 24 1HB TRP 24 7.698 8.048 4.381 164 HB3 TRP 24 2HB TRP 24 6.479 7.537 3.250 165 HD1 TRP 24 HD TRP 24 6.970 7.711 6.806 166 HE1 TRP 24 1HE TRP 24 5.498 6.081 8.117 167 HE3 TRP 24 3HE TRP 24 5.613 4.683 2.937 168 HZ2 TRP 24 2HZ TRP 24 3.859 3.766 7.488 169 HZ3 TRP 24 3HZ TRP 24 4.096 2.771 3.296 170 HH2 TRP 24 HH TRP 24 3.240 2.267 5.567 171 H ASP 25 H ASP 25 9.906 7.262 1.971 172 HA ASP 25 HA ASP 25 10.075 8.258 -0.109 173 HB2 ASP 25 1HB ASP 25 9.447 5.339 -0.414 174 HB3 ASP 25 2HB ASP 25 9.523 6.303 -1.894 175 H ASN 26 H ASN 26 8.884 8.312 -2.502 176 HA ASN 26 HA ASN 26 5.950 8.542 -2.138 177 HB2 ASN 26 1HB ASN 26 7.692 10.587 -3.624 178 HB3 ASN 26 2HB ASN 26 5.944 10.665 -3.413 179 HD21 ASN 26 1HD2 ASN 26 5.212 10.691 -0.995 180 HD22 ASN 26 2HD2 ASN 26 6.319 11.390 0.174 181 H LEU 27 H LEU 27 5.154 7.030 -3.474 182 HA LEU 27 HA LEU 27 6.811 5.906 -5.560 183 HB2 LEU 27 1HB LEU 27 3.843 5.542 -5.081 184 HB3 LEU 27 2HB LEU 27 4.877 4.517 -6.083 185 HG LEU 27 HG LEU 27 4.774 4.822 -3.101 186 HD11 LEU 27 1HD1 LEU 27 4.483 2.398 -3.110 187 HD12 LEU 27 2HD1 LEU 27 4.684 2.367 -4.872 188 HD13 LEU 27 3HD1 LEU 27 3.286 3.188 -4.151 189 HD21 LEU 27 3HD2 LEU 27 7.013 3.246 -4.357 190 HD22 LEU 27 1HD2 LEU 27 6.634 3.498 -2.657 191 HD23 LEU 27 2HD2 LEU 27 7.215 4.849 -3.601 192 H THR 28 H THR 28 6.645 6.106 -7.748 193 HA THR 28 HA THR 28 5.650 8.694 -8.627 194 HB THR 28 HB THR 28 6.877 7.487 -10.817 195 HG1 THR 28 1HG THR 28 8.327 6.766 -8.482 196 HG21 THR 28 3HG2 THR 28 8.059 9.063 -8.476 197 HG22 THR 28 1HG2 THR 28 7.325 9.743 -9.928 198 HG23 THR 28 2HG2 THR 28 8.854 8.862 -10.044 199 H SER 29 H SER 29 4.668 8.893 -10.866 200 HA SER 29 HA SER 29 2.081 8.263 -10.429 201 HB2 SER 29 1HB SER 29 3.345 9.910 -12.129 202 HB3 SER 29 2HB SER 29 2.825 8.695 -13.303 203 HG SER 29 HG SER 29 1.217 10.166 -13.122 204 H SER 30 H SER 30 4.202 6.432 -12.739 205 HA SER 30 HA SER 30 2.243 4.245 -12.513 206 HB2 SER 30 1HB SER 30 2.458 3.710 -14.845 207 HB3 SER 30 2HB SER 30 1.788 5.329 -14.613 208 HG SER 30 HG SER 30 4.213 4.496 -15.660 209 H GLN 31 H GLN 31 4.563 4.756 -10.973 210 HA GLN 31 HA GLN 31 6.942 3.469 -11.573 211 HB2 GLN 31 1HB GLN 31 6.186 4.646 -9.403 212 HB3 GLN 31 2HB GLN 31 5.399 3.130 -8.970 213 HG2 GLN 31 1HG GLN 31 7.582 2.038 -9.104 214 HG3 GLN 31 2HG GLN 31 8.369 3.596 -9.329 215 HE21 GLN 31 1HE2 GLN 31 9.139 4.500 -7.330 216 HE22 GLN 31 2HE2 GLN 31 8.380 4.146 -5.804 217 H THR 32 H THR 32 7.669 1.299 -11.520 218 HA THR 32 HA THR 32 5.661 -0.819 -10.942 219 HB THR 32 HB THR 32 6.557 -2.189 -12.776 220 HG1 THR 32 1HG THR 32 7.835 0.232 -13.565 221 HG21 THR 32 3HG2 THR 32 5.358 0.451 -13.687 222 HG22 THR 32 1HG2 THR 32 4.450 -0.896 -12.966 223 HG23 THR 32 2HG2 THR 32 5.255 -1.102 -14.525 224 H LYS 33 H LYS 33 8.568 0.522 -10.039 225 HA LYS 33 HA LYS 33 9.220 -1.960 -8.596 226 HB2 LYS 33 1HB LYS 33 11.215 -0.333 -10.207 227 HB3 LYS 33 2HB LYS 33 11.705 -1.306 -8.820 228 HG2 LYS 33 1HG LYS 33 11.727 -3.186 -10.002 229 HG3 LYS 33 2HG LYS 33 10.037 -2.978 -10.419 230 HD2 LYS 33 1HD LYS 33 11.359 -3.163 -12.468 231 HD3 LYS 33 2HD LYS 33 10.738 -1.503 -12.346 232 HE2 LYS 33 1HE LYS 33 12.957 -0.798 -11.356 233 HE3 LYS 33 2HE LYS 33 13.537 -2.452 -11.554 234 HZ1 LYS 33 3HZ LYS 33 14.288 -1.136 -13.347 235 HZ2 LYS 33 1HZ LYS 33 12.782 -0.613 -13.744 236 HZ3 LYS 33 2HZ LYS 33 13.198 -2.189 -13.954 237 H ALA 34 H ALA 34 10.042 -1.632 -6.621 238 HA ALA 34 HA ALA 34 9.236 0.633 -5.185 239 HB1 ALA 34 1HB ALA 34 11.286 -1.552 -4.550 240 HB2 ALA 34 2HB ALA 34 10.649 -0.431 -3.344 241 HB3 ALA 34 3HB ALA 34 9.548 -1.559 -4.151 242 HA PRO 35 HA PRO 35 12.538 3.536 -5.688 243 HB2 PRO 35 1HB PRO 35 13.037 4.366 -3.074 244 HB3 PRO 35 2HB PRO 35 11.723 4.974 -4.122 245 HG2 PRO 35 1HG PRO 35 11.558 2.868 -1.968 246 HG3 PRO 35 2HG PRO 35 10.372 4.144 -2.390 247 HD2 PRO 35 1HD PRO 35 10.013 1.611 -3.153 248 HD3 PRO 35 2HD PRO 35 9.539 2.972 -4.204 249 H ASN 36 H ASN 36 12.865 0.958 -3.250 250 HA ASN 36 HA ASN 36 15.775 0.810 -3.584 251 HB2 ASN 36 1HB ASN 36 14.457 2.264 -1.431 252 HB3 ASN 36 2HB ASN 36 15.109 0.775 -0.754 253 HD21 ASN 36 1HD2 ASN 36 15.884 3.910 -1.928 254 HD22 ASN 36 2HD2 ASN 36 17.606 3.771 -1.887 255 H VAL 37 H VAL 37 16.594 -1.098 -2.331 256 HA VAL 37 HA VAL 37 14.736 -3.285 -2.017 257 HB VAL 37 HB VAL 37 16.740 -4.008 -2.664 258 HG11 VAL 37 1HG1 VAL 37 18.811 -3.758 -1.710 259 HG12 VAL 37 2HG1 VAL 37 18.114 -2.293 -2.421 260 HG13 VAL 37 3HG1 VAL 37 18.151 -2.464 -0.626 261 HG21 VAL 37 3HG2 VAL 37 17.107 -5.705 -1.248 262 HG22 VAL 37 1HG2 VAL 37 17.230 -4.635 0.182 263 HG23 VAL 37 2HG2 VAL 37 15.655 -5.072 -0.466 264 H LEU 38 H LEU 38 13.253 -3.126 -0.596 265 HA LEU 38 HA LEU 38 13.414 -1.602 1.835 266 HB2 LEU 38 1HB LEU 38 11.307 -3.667 1.220 267 HB3 LEU 38 2HB LEU 38 11.210 -2.211 2.193 268 HG LEU 38 HG LEU 38 11.405 -2.239 -0.838 269 HD11 LEU 38 1HD1 LEU 38 9.304 -3.160 -0.016 270 HD12 LEU 38 2HD1 LEU 38 9.066 -1.578 -0.764 271 HD13 LEU 38 3HD1 LEU 38 9.049 -1.739 1.017 272 HD21 LEU 38 3HD2 LEU 38 10.976 0.027 1.164 273 HD22 LEU 38 1HD2 LEU 38 10.765 0.169 -0.603 274 HD23 LEU 38 2HD2 LEU 38 12.357 -0.188 0.062 275 H LYS 39 H LYS 39 14.944 -2.354 3.258 276 HA LYS 39 HA LYS 39 15.434 -5.195 3.612 277 HB2 LYS 39 1HB LYS 39 16.391 -2.616 4.857 278 HB3 LYS 39 2HB LYS 39 16.730 -4.124 5.709 279 HG2 LYS 39 1HG LYS 39 18.137 -4.932 4.108 280 HG3 LYS 39 2HG LYS 39 17.306 -4.139 2.776 281 HD2 LYS 39 1HD LYS 39 18.843 -2.377 4.675 282 HD3 LYS 39 2HD LYS 39 19.711 -3.438 3.554 283 HE2 LYS 39 1HE LYS 39 18.209 -2.585 1.699 284 HE3 LYS 39 2HE LYS 39 17.706 -1.287 2.795 285 HZ1 LYS 39 3HZ LYS 39 19.576 -0.674 1.334 286 HZ2 LYS 39 1HZ LYS 39 20.471 -1.903 1.939 287 HZ3 LYS 39 2HZ LYS 39 20.091 -0.645 2.908 288 H GLY 40 H GLY 40 15.258 -6.279 5.722 289 HA2 GLY 40 1HA GLY 40 14.191 -6.669 7.803 290 HA3 GLY 40 2HA GLY 40 12.994 -5.422 7.433 291 H ASN 41 H ASN 41 11.289 -6.825 7.817 292 HA ASN 41 HA ASN 41 10.638 -8.749 5.610 293 HB2 ASN 41 1HB ASN 41 11.348 -10.214 7.389 294 HB3 ASN 41 2HB ASN 41 10.327 -9.368 8.547 295 HD21 ASN 41 1HD2 ASN 41 8.125 -10.202 8.877 296 HD22 ASN 41 2HD2 ASN 41 7.556 -11.462 7.836 297 H LYS 42 H LYS 42 9.671 -6.174 7.747 298 HA LYS 42 HA LYS 42 6.822 -6.921 7.483 299 HB2 LYS 42 1HB LYS 42 8.285 -4.967 9.253 300 HB3 LYS 42 2HB LYS 42 6.553 -5.080 9.192 301 HG2 LYS 42 1HG LYS 42 7.203 -6.306 11.058 302 HG3 LYS 42 2HG LYS 42 6.718 -7.509 9.869 303 HD2 LYS 42 1HD LYS 42 8.757 -8.469 9.809 304 HD3 LYS 42 2HD LYS 42 9.598 -6.925 9.804 305 HE2 LYS 42 1HE LYS 42 8.826 -6.856 12.329 306 HE3 LYS 42 2HE LYS 42 8.762 -8.616 12.136 307 HZ1 LYS 42 3HZ LYS 42 11.107 -8.483 11.375 308 HZ2 LYS 42 1HZ LYS 42 10.959 -7.864 12.896 309 HZ3 LYS 42 2HZ LYS 42 11.081 -6.849 11.599 310 H LEU 43 H LEU 43 5.972 -6.222 5.707 311 HA LEU 43 HA LEU 43 7.094 -3.988 4.204 312 HB2 LEU 43 1HB LEU 43 6.333 -6.336 3.305 313 HB3 LEU 43 2HB LEU 43 4.723 -5.687 3.428 314 HG LEU 43 HG LEU 43 5.123 -5.207 1.260 315 HD11 LEU 43 1HD1 LEU 43 4.788 -2.966 2.273 316 HD12 LEU 43 2HD1 LEU 43 5.718 -2.956 0.779 317 HD13 LEU 43 3HD1 LEU 43 6.577 -2.783 2.308 318 HD21 LEU 43 3HD2 LEU 43 7.391 -6.161 1.170 319 HD22 LEU 43 1HD2 LEU 43 8.055 -4.655 1.856 320 HD23 LEU 43 2HD2 LEU 43 7.311 -4.655 0.254 321 H TYR 44 H TYR 44 6.312 -1.977 4.501 322 HA TYR 44 HA TYR 44 3.592 -1.597 5.665 323 HB2 TYR 44 1HB TYR 44 6.043 0.154 5.894 324 HB3 TYR 44 2HB TYR 44 4.472 0.508 6.579 325 HD1 TYR 44 1HD TYR 44 3.577 -1.954 7.868 326 HD2 TYR 44 2HD TYR 44 7.536 -0.276 7.617 327 HE1 TYR 44 1HE TYR 44 4.231 -3.229 9.891 328 HE2 TYR 44 2HE TYR 44 8.159 -1.397 9.699 329 HH TYR 44 HH TYR 44 7.522 -3.278 11.211 330 H VAL 45 H VAL 45 2.287 -1.188 4.012 331 HA VAL 45 HA VAL 45 3.135 0.698 1.857 332 HB VAL 45 HB VAL 45 0.580 -0.951 2.113 333 HG11 VAL 45 1HG1 VAL 45 1.698 0.791 -0.090 334 HG12 VAL 45 2HG1 VAL 45 0.336 -0.355 -0.298 335 HG13 VAL 45 3HG1 VAL 45 0.196 1.014 0.793 336 HG21 VAL 45 3HG2 VAL 45 2.473 -2.462 1.768 337 HG22 VAL 45 1HG2 VAL 45 1.511 -2.341 0.296 338 HG23 VAL 45 2HG2 VAL 45 3.055 -1.460 0.418 339 H LYS 46 H LYS 46 1.904 2.627 1.526 340 HA LYS 46 HA LYS 46 -0.042 3.466 3.601 341 HB2 LYS 46 1HB LYS 46 2.082 4.670 3.969 342 HB3 LYS 46 2HB LYS 46 2.156 5.119 2.257 343 HG2 LYS 46 1HG LYS 46 -0.100 6.320 2.689 344 HG3 LYS 46 2HG LYS 46 0.207 6.058 4.379 345 HD2 LYS 46 1HD LYS 46 1.615 7.841 2.388 346 HD3 LYS 46 2HD LYS 46 0.841 8.257 3.909 347 HE2 LYS 46 1HE LYS 46 2.921 8.324 4.744 348 HE3 LYS 46 2HE LYS 46 2.781 6.581 4.848 349 HZ1 LYS 46 3HZ LYS 46 4.002 8.062 2.579 350 HZ2 LYS 46 1HZ LYS 46 3.869 6.423 2.706 351 HZ3 LYS 46 2HZ LYS 46 4.797 7.259 3.761 352 H ALA 47 H ALA 47 -1.900 3.031 2.228 353 HA ALA 47 HA ALA 47 -1.549 3.599 -0.678 354 HB1 ALA 47 1HB ALA 47 -3.507 1.591 0.450 355 HB2 ALA 47 2HB ALA 47 -2.791 1.662 -1.175 356 HB3 ALA 47 3HB ALA 47 -1.823 1.165 0.185 357 H ARG 48 H ARG 48 -2.956 4.976 -1.714 358 HA ARG 48 HA ARG 48 -4.687 6.561 0.018 359 HB2 ARG 48 1HB ARG 48 -3.075 7.602 -1.446 360 HB3 ARG 48 2HB ARG 48 -3.773 6.828 -2.863 361 HG2 ARG 48 1HG ARG 48 -5.156 8.527 -3.185 362 HG3 ARG 48 2HG ARG 48 -5.908 8.308 -1.617 363 HD2 ARG 48 1HD ARG 48 -5.072 10.589 -1.765 364 HD3 ARG 48 2HD ARG 48 -4.133 9.690 -0.567 365 HE ARG 48 HE ARG 48 -2.276 10.136 -1.640 366 HH11 ARG 48 1HH1 ARG 48 -4.767 10.548 -4.163 367 HH12 ARG 48 2HH1 ARG 48 -3.679 11.397 -5.220 368 HH21 ARG 48 1HH2 ARG 48 -1.022 11.358 -2.859 369 HH22 ARG 48 2HH2 ARG 48 -1.503 11.988 -4.404 370 H PHE 49 H PHE 49 -6.735 5.716 0.355 371 HA PHE 49 HA PHE 49 -8.273 4.581 -1.937 372 HB2 PHE 49 1HB PHE 49 -8.859 4.387 1.031 373 HB3 PHE 49 2HB PHE 49 -9.806 3.703 -0.298 374 HD1 PHE 49 2HD PHE 49 -6.672 3.551 1.570 375 HD2 PHE 49 1HD PHE 49 -8.925 1.555 -1.548 376 HE1 PHE 49 2HE PHE 49 -5.251 1.580 1.785 377 HE2 PHE 49 1HE PHE 49 -7.647 -0.469 -1.164 378 HZ PHE 49 HZ PHE 49 -5.792 -0.514 0.470 379 H MET 50 H MET 50 -8.855 6.259 -3.149 380 HA MET 50 HA MET 50 -10.113 8.579 -1.869 381 HB2 MET 50 1HB MET 50 -10.058 8.095 -4.848 382 HB3 MET 50 2HB MET 50 -10.218 9.604 -3.986 383 HG2 MET 50 1HG MET 50 -7.684 8.102 -3.619 384 HG3 MET 50 2HG MET 50 -7.981 8.771 -5.226 385 HE1 MET 50 3HE MET 50 -7.653 11.248 -1.349 386 HE2 MET 50 1HE MET 50 -9.220 10.648 -1.946 387 HE3 MET 50 2HE MET 50 -7.948 9.498 -1.464 388 H GLY 51 H GLY 51 -12.080 8.195 -1.233 389 HA2 GLY 51 1HA GLY 51 -14.428 7.821 -1.547 390 HA3 GLY 51 2HA GLY 51 -14.090 6.808 -2.936 391 H TYR 52 H TYR 52 -15.868 6.104 -0.751 392 HA TYR 52 HA TYR 52 -14.582 4.678 1.309 393 HB2 TYR 52 1HB TYR 52 -17.275 5.408 0.537 394 HB3 TYR 52 2HB TYR 52 -17.279 3.733 0.994 395 HD1 TYR 52 2HD TYR 52 -16.283 3.060 3.332 396 HD2 TYR 52 1HD TYR 52 -17.229 7.107 2.157 397 HE1 TYR 52 2HE TYR 52 -16.381 3.724 5.712 398 HE2 TYR 52 1HE TYR 52 -17.333 7.781 4.516 399 HH TYR 52 HH TYR 52 -16.346 5.725 7.216 400 H THR 53 H THR 53 -14.036 2.633 1.667 401 HA THR 53 HA THR 53 -15.346 0.415 0.462 402 HB THR 53 HB THR 53 -13.728 0.615 -1.315 403 HG1 THR 53 1HG THR 53 -12.288 -1.222 0.145 404 HG21 THR 53 3HG2 THR 53 -11.647 0.939 0.869 405 HG22 THR 53 1HG2 THR 53 -12.068 2.105 -0.391 406 HG23 THR 53 2HG2 THR 53 -11.230 0.601 -0.804 407 H LYS 54 H LYS 54 -14.821 -1.488 1.574 408 HA LYS 54 HA LYS 54 -12.997 -1.441 3.783 409 HB2 LYS 54 1HB LYS 54 -15.905 -1.212 4.254 410 HB3 LYS 54 2HB LYS 54 -15.259 -2.604 5.074 411 HG2 LYS 54 1HG LYS 54 -13.593 -0.148 5.405 412 HG3 LYS 54 2HG LYS 54 -15.226 -0.010 6.034 413 HD2 LYS 54 1HD LYS 54 -13.488 -2.409 6.720 414 HD3 LYS 54 2HD LYS 54 -13.368 -0.875 7.616 415 HE2 LYS 54 1HE LYS 54 -15.697 -0.923 8.216 416 HE3 LYS 54 2HE LYS 54 -16.009 -2.336 7.207 417 HZ1 LYS 54 3HZ LYS 54 -14.027 -2.596 9.343 418 HZ2 LYS 54 1HZ LYS 54 -15.038 -3.727 8.732 419 HZ3 LYS 54 2HZ LYS 54 -15.643 -2.572 9.732 420 H LEU 55 H LEU 55 -13.227 -2.683 1.149 421 HA LEU 55 HA LEU 55 -13.166 -5.539 1.904 422 HB2 LEU 55 1HB LEU 55 -14.356 -4.426 -0.658 423 HB3 LEU 55 2HB LEU 55 -14.082 -6.103 -0.255 424 HG LEU 55 HG LEU 55 -15.749 -5.599 1.762 425 HD11 LEU 55 1HD1 LEU 55 -16.084 -3.213 1.463 426 HD12 LEU 55 2HD1 LEU 55 -17.561 -4.013 0.953 427 HD13 LEU 55 3HD1 LEU 55 -16.430 -3.418 -0.266 428 HD21 LEU 55 3HD2 LEU 55 -16.333 -6.129 -1.158 429 HD22 LEU 55 1HD2 LEU 55 -17.632 -6.136 0.044 430 HD23 LEU 55 2HD2 LEU 55 -16.271 -7.265 0.191 431 H THR 56 H THR 56 -10.894 -4.986 2.156 432 HA THR 56 HA THR 56 -9.403 -4.317 -0.315 433 HB THR 56 HB THR 56 -8.341 -5.024 2.447 434 HG1 THR 56 1HG THR 56 -9.188 -3.237 3.086 435 HG21 THR 56 3HG2 THR 56 -6.408 -3.642 1.766 436 HG22 THR 56 1HG2 THR 56 -7.176 -3.338 0.192 437 HG23 THR 56 2HG2 THR 56 -6.645 -4.980 0.641 438 H VAL 57 H VAL 57 -7.975 -5.973 -1.249 439 HA VAL 57 HA VAL 57 -7.836 -8.564 0.163 440 HB VAL 57 HB VAL 57 -8.494 -8.282 -2.811 441 HG11 VAL 57 1HG1 VAL 57 -8.604 -10.773 -2.811 442 HG12 VAL 57 2HG1 VAL 57 -6.973 -10.167 -2.527 443 HG13 VAL 57 3HG1 VAL 57 -7.943 -10.803 -1.179 444 HG21 VAL 57 3HG2 VAL 57 -10.200 -9.470 -0.597 445 HG22 VAL 57 1HG2 VAL 57 -10.523 -7.978 -1.470 446 HG23 VAL 57 2HG2 VAL 57 -10.561 -9.519 -2.328 447 H ILE 58 H ILE 58 -5.800 -9.418 0.040 448 HA ILE 58 HA ILE 58 -3.701 -8.117 -1.607 449 HB ILE 58 HB ILE 58 -3.464 -8.807 1.358 450 HG12 ILE 58 1HG1 ILE 58 -3.731 -6.034 0.109 451 HG13 ILE 58 2HG1 ILE 58 -4.935 -6.838 1.118 452 HG21 ILE 58 1HG2 ILE 58 -1.396 -9.017 -0.030 453 HG22 ILE 58 2HG2 ILE 58 -1.551 -7.314 -0.499 454 HG23 ILE 58 3HG2 ILE 58 -1.257 -7.769 1.191 455 HD11 ILE 58 3HD1 ILE 58 -3.858 -5.304 2.531 456 HD12 ILE 58 1HD1 ILE 58 -3.244 -6.901 3.000 457 HD13 ILE 58 2HD1 ILE 58 -2.243 -5.803 2.014 458 H THR 59 H THR 59 -3.146 -9.934 -2.946 459 HA THR 59 HA THR 59 -4.524 -12.262 -2.249 460 HB THR 59 HB THR 59 -3.019 -12.555 -4.699 461 HG1 THR 59 1HG THR 59 -3.160 -10.702 -5.635 462 HG21 THR 59 3HG2 THR 59 -5.867 -11.605 -4.255 463 HG22 THR 59 1HG2 THR 59 -5.362 -13.289 -4.102 464 HG23 THR 59 2HG2 THR 59 -5.215 -12.481 -5.684 465 H GLY 60 H GLY 60 -1.322 -11.453 -1.821 466 HA2 GLY 60 1HA GLY 60 0.588 -12.582 -1.188 467 HA3 GLY 60 2HA GLY 60 -0.465 -13.802 -0.481 468 H LYS 61 H LYS 61 0.605 -15.611 -1.062 469 HA LYS 61 HA LYS 61 1.677 -16.099 -3.723 470 HB2 LYS 61 1HB LYS 61 1.298 -17.798 -1.233 471 HB3 LYS 61 2HB LYS 61 1.917 -18.470 -2.723 472 HG2 LYS 61 1HG LYS 61 3.869 -17.065 -2.674 473 HG3 LYS 61 2HG LYS 61 3.143 -16.041 -1.415 474 HD2 LYS 61 1HD LYS 61 3.238 -18.116 0.064 475 HD3 LYS 61 2HD LYS 61 4.332 -18.809 -1.137 476 HE2 LYS 61 1HE LYS 61 4.727 -16.041 0.091 477 HE3 LYS 61 2HE LYS 61 5.320 -17.503 0.892 478 HZ1 LYS 61 3HZ LYS 61 7.075 -16.751 -0.265 479 HZ2 LYS 61 1HZ LYS 61 6.210 -16.280 -1.593 480 HZ3 LYS 61 2HZ LYS 61 6.531 -17.882 -1.313 481 H ASP 62 H ASP 62 -0.684 -18.023 -1.956 482 HA ASP 62 HA ASP 62 -1.599 -19.138 -4.472 483 HB2 ASP 62 1HB ASP 62 -1.020 -20.441 -2.474 484 HB3 ASP 62 2HB ASP 62 -2.354 -19.726 -1.588 485 H GLY 63 H GLY 63 -2.413 -16.295 -4.035 486 HA2 GLY 63 1HA GLY 63 -4.296 -15.051 -4.394 487 HA3 GLY 63 2HA GLY 63 -5.242 -16.522 -4.595 488 H LYS 64 H LYS 64 -3.508 -16.558 -1.685 489 HA LYS 64 HA LYS 64 -5.949 -16.625 -0.112 490 HB2 LYS 64 1HB LYS 64 -3.008 -16.993 0.569 491 HB3 LYS 64 2HB LYS 64 -4.296 -17.012 1.795 492 HG2 LYS 64 1HG LYS 64 -5.466 -18.806 0.615 493 HG3 LYS 64 2HG LYS 64 -4.291 -18.783 -0.691 494 HD2 LYS 64 1HD LYS 64 -2.542 -19.605 0.806 495 HD3 LYS 64 2HD LYS 64 -3.668 -19.584 2.187 496 HE2 LYS 64 1HE LYS 64 -5.027 -21.295 1.279 497 HE3 LYS 64 2HE LYS 64 -4.495 -20.955 -0.370 498 HZ1 LYS 64 3HZ LYS 64 -3.580 -22.949 0.213 499 HZ2 LYS 64 1HZ LYS 64 -2.937 -22.428 1.640 500 HZ3 LYS 64 2HZ LYS 64 -2.338 -21.894 0.196 501 H ASN 65 H ASN 65 -6.913 -14.880 0.562 502 HA ASN 65 HA ASN 65 -5.972 -12.244 0.434 503 HB2 ASN 65 1HB ASN 65 -8.399 -13.131 0.729 504 HB3 ASN 65 2HB ASN 65 -8.053 -13.200 2.470 505 HD21 ASN 65 1HD2 ASN 65 -6.984 -10.939 3.255 506 HD22 ASN 65 2HD2 ASN 65 -8.061 -9.634 2.753 507 H LEU 66 H LEU 66 -3.885 -12.069 1.414 508 HA LEU 66 HA LEU 66 -3.076 -13.068 3.851 509 HB2 LEU 66 1HB LEU 66 -2.219 -10.399 2.685 510 HB3 LEU 66 2HB LEU 66 -1.378 -11.290 3.952 511 HG LEU 66 HG LEU 66 -1.789 -12.182 1.070 512 HD11 LEU 66 1HD1 LEU 66 -0.051 -10.477 1.350 513 HD12 LEU 66 2HD1 LEU 66 0.725 -12.039 1.068 514 HD13 LEU 66 3HD1 LEU 66 0.674 -11.370 2.702 515 HD21 LEU 66 3HD2 LEU 66 -0.528 -13.664 3.416 516 HD22 LEU 66 1HD2 LEU 66 -0.234 -14.083 1.717 517 HD23 LEU 66 2HD2 LEU 66 -1.861 -14.210 2.370 518 H LEU 67 H LEU 67 -4.877 -10.125 3.331 519 HA LEU 67 HA LEU 67 -4.755 -9.115 5.993 520 HB2 LEU 67 1HB LEU 67 -5.298 -7.975 3.678 521 HB3 LEU 67 2HB LEU 67 -6.936 -8.516 4.010 522 HG LEU 67 HG LEU 67 -6.840 -7.208 6.190 523 HD11 LEU 67 1HD1 LEU 67 -5.195 -5.463 6.406 524 HD12 LEU 67 2HD1 LEU 67 -4.406 -5.918 4.879 525 HD13 LEU 67 3HD1 LEU 67 -4.322 -6.997 6.280 526 HD21 LEU 67 3HD2 LEU 67 -7.277 -5.091 5.035 527 HD22 LEU 67 1HD2 LEU 67 -7.954 -6.446 4.121 528 HD23 LEU 67 2HD2 LEU 67 -6.443 -5.699 3.574 529 H TYR 68 H TYR 68 -6.479 -11.895 4.835 530 HA TYR 68 HA TYR 68 -8.000 -11.944 7.340 531 HB2 TYR 68 1HB TYR 68 -9.344 -11.472 5.117 532 HB3 TYR 68 2HB TYR 68 -9.015 -13.155 4.740 533 HD1 TYR 68 1HD TYR 68 -10.240 -10.943 7.543 534 HD2 TYR 68 2HD TYR 68 -10.556 -14.801 5.623 535 HE1 TYR 68 1HE TYR 68 -12.083 -11.516 9.042 536 HE2 TYR 68 2HE TYR 68 -12.453 -15.380 7.133 537 HH TYR 68 HH TYR 68 -13.821 -12.976 9.393 538 H ASN 69 H ASN 69 -5.313 -12.966 6.129 539 HA ASN 69 HA ASN 69 -5.753 -15.879 6.066 540 HB2 ASN 69 1HB ASN 69 -4.308 -14.892 4.377 541 HB3 ASN 69 2HB ASN 69 -3.199 -14.320 5.651 542 HD21 ASN 69 1HD2 ASN 69 -1.487 -15.667 5.940 543 HD22 ASN 69 2HD2 ASN 69 -1.535 -17.404 5.770 544 H GLY 70 H GLY 70 -3.826 -13.449 7.817 545 HA2 GLY 70 1HA GLY 70 -4.405 -14.014 10.341 546 HA3 GLY 70 2HA GLY 70 -3.159 -15.229 10.050 547 H THR 71 H THR 71 -1.748 -13.186 8.131 548 HA THR 71 HA THR 71 -0.227 -11.987 10.372 549 HB THR 71 HB THR 71 0.610 -12.097 7.469 550 HG1 THR 71 1HG THR 71 0.603 -14.130 9.406 551 HG21 THR 71 3HG2 THR 71 2.140 -10.773 8.737 552 HG22 THR 71 1HG2 THR 71 2.896 -12.352 8.540 553 HG23 THR 71 2HG2 THR 71 2.148 -11.932 10.090 554 H ALA 72 H ALA 72 -1.413 -10.890 7.104 555 HA ALA 72 HA ALA 72 -0.545 -8.168 7.734 556 HB1 ALA 72 1HB ALA 72 -1.549 -7.605 5.567 557 HB2 ALA 72 2HB ALA 72 -0.631 -9.115 5.365 558 HB3 ALA 72 3HB ALA 72 -2.395 -9.158 5.499 559 H LYS 73 H LYS 73 -1.772 -6.549 8.487 560 HA LYS 73 HA LYS 73 -4.690 -6.720 8.570 561 HB2 LYS 73 1HB LYS 73 -4.588 -5.907 11.007 562 HB3 LYS 73 2HB LYS 73 -4.368 -7.645 10.691 563 HG2 LYS 73 1HG LYS 73 -1.846 -7.187 10.865 564 HG3 LYS 73 2HG LYS 73 -2.314 -5.554 11.391 565 HD2 LYS 73 1HD LYS 73 -3.522 -7.874 12.840 566 HD3 LYS 73 2HD LYS 73 -1.789 -7.703 13.010 567 HE2 LYS 73 1HE LYS 73 -3.669 -5.360 13.547 568 HE3 LYS 73 2HE LYS 73 -3.254 -6.561 14.776 569 HZ1 LYS 73 3HZ LYS 73 -1.675 -4.869 15.052 570 HZ2 LYS 73 1HZ LYS 73 -1.357 -4.754 13.411 571 HZ3 LYS 73 2HZ LYS 73 -0.869 -6.037 14.218 572 H MET 74 H MET 74 -5.457 -4.438 9.458 573 HA MET 74 HA MET 74 -3.448 -2.385 8.789 574 HB2 MET 74 1HB MET 74 -5.132 -0.760 8.764 575 HB3 MET 74 2HB MET 74 -5.591 -2.044 7.638 576 HG2 MET 74 1HG MET 74 -7.228 -2.896 9.250 577 HG3 MET 74 2HG MET 74 -6.632 -1.790 10.487 578 HE1 MET 74 3HE MET 74 -7.645 -1.303 6.717 579 HE2 MET 74 1HE MET 74 -8.384 0.310 6.818 580 HE3 MET 74 2HE MET 74 -6.655 0.098 7.231 581 H PHE 75 H PHE 75 -3.047 -0.924 10.331 582 HA PHE 75 HA PHE 75 -4.039 -1.219 13.083 583 HB2 PHE 75 1HB PHE 75 -1.795 -0.866 13.887 584 HB3 PHE 75 2HB PHE 75 -1.890 -2.298 12.885 585 HD1 PHE 75 1HD PHE 75 -0.720 -2.311 10.542 586 HD2 PHE 75 2HD PHE 75 -0.436 1.001 13.321 587 HE1 PHE 75 1HE PHE 75 1.259 -1.443 9.341 588 HE2 PHE 75 2HE PHE 75 1.614 1.767 12.161 589 HZ PHE 75 HZ PHE 75 2.506 0.448 10.228 590 H LYS 76 H LYS 76 -3.677 0.846 10.293 591 HA LYS 76 HA LYS 76 -4.184 3.227 11.938 592 HB2 LYS 76 1HB LYS 76 -1.664 2.926 11.774 593 HB3 LYS 76 2HB LYS 76 -1.800 3.096 10.020 594 HG2 LYS 76 1HG LYS 76 -2.771 5.369 10.335 595 HG3 LYS 76 2HG LYS 76 -2.672 5.128 12.091 596 HD2 LYS 76 1HD LYS 76 -0.231 5.121 12.002 597 HD3 LYS 76 2HD LYS 76 -0.267 5.141 10.240 598 HE2 LYS 76 1HE LYS 76 0.210 7.378 11.078 599 HE3 LYS 76 2HE LYS 76 -1.355 7.368 10.266 600 HZ1 LYS 76 3HZ LYS 76 -2.409 7.310 12.483 601 HZ2 LYS 76 1HZ LYS 76 -1.430 8.607 12.285 602 HZ3 LYS 76 2HZ LYS 76 -0.930 7.342 13.199 603 H SER 77 H SER 77 -5.350 4.799 10.840 604 HA SER 77 HA SER 77 -5.516 4.853 7.917 605 HB2 SER 77 1HB SER 77 -8.025 4.554 8.042 606 HB3 SER 77 2HB SER 77 -7.079 3.085 8.391 607 HG SER 77 HG SER 77 -8.003 4.829 10.409 608 H ASP 78 H ASP 78 -4.858 7.052 7.942 609 HA ASP 78 HA ASP 78 -6.303 9.009 9.618 610 HB2 ASP 78 1HB ASP 78 -3.702 8.927 8.644 611 HB3 ASP 78 2HB ASP 78 -4.495 9.913 7.420 612 H ALA 79 H ALA 79 -7.092 10.919 8.467 613 HA ALA 79 HA ALA 79 -8.791 10.185 6.139 614 HB1 ALA 79 1HB ALA 79 -9.863 11.237 8.119 615 HB2 ALA 79 2HB ALA 79 -8.739 12.607 8.005 616 HB3 ALA 79 3HB ALA 79 -9.932 12.326 6.711 617 H ILE 80 H ILE 80 -8.636 11.226 4.206 618 HA ILE 80 HA ILE 80 -6.191 12.845 3.725 619 HB ILE 80 HB ILE 80 -7.916 11.372 1.695 620 HG12 ILE 80 1HG1 ILE 80 -5.213 10.446 2.741 621 HG13 ILE 80 2HG1 ILE 80 -6.722 9.784 3.316 622 HG21 ILE 80 1HG2 ILE 80 -6.058 11.884 0.158 623 HG22 ILE 80 2HG2 ILE 80 -6.579 13.364 0.932 624 HG23 ILE 80 3HG2 ILE 80 -5.107 12.565 1.489 625 HD11 ILE 80 3HD1 ILE 80 -7.361 8.968 1.126 626 HD12 ILE 80 1HD1 ILE 80 -5.968 9.719 0.395 627 HD13 ILE 80 2HD1 ILE 80 -5.735 8.383 1.524 628 H LEU 81 H LEU 81 -6.701 14.936 3.722 629 HA LEU 81 HA LEU 81 -9.460 15.800 3.146 630 HB2 LEU 81 1HB LEU 81 -7.021 17.504 3.713 631 HB3 LEU 81 2HB LEU 81 -8.682 18.062 3.581 632 HG LEU 81 HG LEU 81 -7.508 16.271 5.755 633 HD11 LEU 81 1HD1 LEU 81 -6.925 18.675 5.818 634 HD12 LEU 81 2HD1 LEU 81 -7.932 18.213 7.182 635 HD13 LEU 81 3HD1 LEU 81 -8.646 19.102 5.800 636 HD21 LEU 81 3HD2 LEU 81 -9.702 16.461 6.888 637 HD22 LEU 81 1HD2 LEU 81 -9.833 15.560 5.386 638 HD23 LEU 81 2HD2 LEU 81 -10.395 17.241 5.444 639 H GLY 82 H GLY 82 -9.966 17.129 1.366 640 HA2 GLY 82 1HA GLY 82 -7.965 17.318 -0.865 641 HA3 GLY 82 2HA GLY 82 -9.711 17.184 -1.075 642 H GLN 83 H GLN 83 -7.367 19.121 0.779 643 HA GLN 83 HA GLN 83 -7.022 21.248 1.185 644 HB2 GLN 83 1HB GLN 83 -8.448 22.117 -1.296 645 HB3 GLN 83 2HB GLN 83 -7.000 22.771 -0.546 646 HG2 GLN 83 1HG GLN 83 -7.233 20.131 -2.076 647 HG3 GLN 83 2HG GLN 83 -6.636 21.657 -2.671 648 HE21 GLN 83 1HE2 GLN 83 -4.540 21.170 -3.142 649 HE22 GLN 83 2HE2 GLN 83 -3.341 20.693 -1.954 650 H ASN 84 H ASN 84 -10.307 21.386 -0.210 651 HA ASN 84 HA ASN 84 -11.214 23.360 1.704 652 HB2 ASN 84 1HB ASN 84 -13.343 23.243 0.671 653 HB3 ASN 84 2HB ASN 84 -12.102 23.330 -0.567 654 HD21 ASN 84 1HD2 ASN 84 -11.990 21.642 -2.096 655 HD22 ASN 84 2HD2 ASN 84 -13.212 20.424 -2.221 656 H LYS 85 H LYS 85 -10.187 20.961 2.931 657 HA LYS 85 HA LYS 85 -10.537 19.470 4.578 658 HB2 LYS 85 1HB LYS 85 -12.994 21.148 5.205 659 HB3 LYS 85 2HB LYS 85 -12.152 20.053 6.309 660 HG2 LYS 85 1HG LYS 85 -10.068 21.509 5.959 661 HG3 LYS 85 2HG LYS 85 -11.127 22.685 5.168 662 HD2 LYS 85 1HD LYS 85 -11.334 21.676 8.036 663 HD3 LYS 85 2HD LYS 85 -10.765 23.267 7.515 664 HE2 LYS 85 1HE LYS 85 -13.037 23.736 6.554 665 HE3 LYS 85 2HE LYS 85 -13.584 22.158 7.157 666 HZ1 LYS 85 3HZ LYS 85 -12.908 22.977 9.402 667 HZ2 LYS 85 1HZ LYS 85 -14.200 23.789 8.742 668 HZ3 LYS 85 2HZ LYS 85 -12.722 24.469 8.769 669 H VAL 86 H VAL 86 -12.093 19.101 1.943 670 HA VAL 86 HA VAL 86 -14.335 17.436 2.621 671 HB VAL 86 HB VAL 86 -14.573 18.489 0.672 672 HG11 VAL 86 1HG1 VAL 86 -11.903 17.420 -0.077 673 HG12 VAL 86 2HG1 VAL 86 -13.014 18.219 -1.236 674 HG13 VAL 86 3HG1 VAL 86 -12.403 19.096 0.184 675 HG21 VAL 86 3HG2 VAL 86 -15.376 16.110 0.674 676 HG22 VAL 86 1HG2 VAL 86 -14.965 16.698 -0.942 677 HG23 VAL 86 2HG2 VAL 86 -13.852 15.617 -0.087 678 H VAL 87 H VAL 87 -14.226 15.259 3.296 679 HA VAL 87 HA VAL 87 -11.606 13.965 3.453 680 HB VAL 87 HB VAL 87 -14.336 12.876 4.169 681 HG11 VAL 87 1HG1 VAL 87 -11.477 12.073 4.922 682 HG12 VAL 87 2HG1 VAL 87 -12.966 11.364 5.588 683 HG13 VAL 87 3HG1 VAL 87 -12.577 11.155 3.878 684 HG21 VAL 87 3HG2 VAL 87 -12.293 14.349 5.887 685 HG22 VAL 87 1HG2 VAL 87 -13.964 14.858 5.534 686 HG23 VAL 87 2HG2 VAL 87 -13.681 13.427 6.516 687 H ILE 88 H ILE 88 -11.070 13.975 1.253 688 HA ILE 88 HA ILE 88 -12.716 12.768 -0.803 689 HB ILE 88 HB ILE 88 -10.587 12.795 -2.141 690 HG12 ILE 88 1HG1 ILE 88 -9.383 14.295 0.220 691 HG13 ILE 88 2HG1 ILE 88 -8.995 12.624 -0.163 692 HG21 ILE 88 1HG2 ILE 88 -10.658 15.226 -2.402 693 HG22 ILE 88 2HG2 ILE 88 -12.279 14.633 -2.055 694 HG23 ILE 88 3HG2 ILE 88 -11.338 15.398 -0.761 695 HD11 ILE 88 3HD1 ILE 88 -8.474 15.044 -1.934 696 HD12 ILE 88 1HD1 ILE 88 -7.277 14.057 -1.096 697 HD13 ILE 88 2HD1 ILE 88 -8.211 13.356 -2.424 698 H GLY 89 H GLY 89 -10.489 11.462 1.599 699 HA2 GLY 89 1HA GLY 89 -11.310 8.784 1.016 700 HA3 GLY 89 2HA GLY 89 -9.698 9.114 0.342 701 H TRP 90 H TRP 90 -9.206 7.310 1.947 702 HA TRP 90 HA TRP 90 -8.214 8.552 4.406 703 HB2 TRP 90 1HB TRP 90 -9.629 5.866 4.366 704 HB3 TRP 90 2HB TRP 90 -8.831 6.617 5.753 705 HD1 TRP 90 HD TRP 90 -10.110 8.574 6.976 706 HE1 TRP 90 1HE TRP 90 -12.501 9.580 6.776 707 HE3 TRP 90 3HE TRP 90 -11.581 6.346 2.649 708 HZ2 TRP 90 2HZ TRP 90 -14.706 9.440 4.946 709 HZ3 TRP 90 3HZ TRP 90 -13.783 6.912 1.604 710 HH2 TRP 90 HH TRP 90 -15.324 8.471 2.748 711 H ASP 91 H ASP 91 -6.174 7.696 4.909 712 HA ASP 91 HA ASP 91 -4.994 6.146 2.630 713 HB2 ASP 91 1HB ASP 91 -4.070 8.473 4.048 714 HB3 ASP 91 2HB ASP 91 -2.990 7.140 4.412 715 H LYS 92 H LYS 92 -5.704 4.117 3.168 716 HA LYS 92 HA LYS 92 -5.395 3.204 5.987 717 HB2 LYS 92 1HB LYS 92 -6.125 1.346 3.706 718 HB3 LYS 92 2HB LYS 92 -6.409 1.161 5.390 719 HG2 LYS 92 1HG LYS 92 -7.918 3.017 3.503 720 HG3 LYS 92 2HG LYS 92 -8.445 1.488 4.193 721 HD2 LYS 92 1HD LYS 92 -8.067 2.705 6.477 722 HD3 LYS 92 2HD LYS 92 -8.243 4.172 5.446 723 HE2 LYS 92 1HE LYS 92 -10.434 3.479 4.731 724 HE3 LYS 92 2HE LYS 92 -10.225 1.859 5.384 725 HZ1 LYS 92 3HZ LYS 92 -11.719 3.192 6.678 726 HZ2 LYS 92 1HZ LYS 92 -10.650 4.321 7.005 727 HZ3 LYS 92 2HZ LYS 92 -10.463 2.795 7.630 728 H TYR 93 H TYR 93 -3.546 2.625 6.685 729 HA TYR 93 HA TYR 93 -1.296 1.827 4.984 730 HB2 TYR 93 1HB TYR 93 -1.834 2.107 7.971 731 HB3 TYR 93 2HB TYR 93 -0.295 1.591 7.353 732 HD1 TYR 93 1HD TYR 93 -2.643 4.420 7.733 733 HD2 TYR 93 2HD TYR 93 1.222 3.194 6.259 734 HE1 TYR 93 1HE TYR 93 -1.796 6.749 7.957 735 HE2 TYR 93 2HE TYR 93 2.000 5.541 6.320 736 HH TYR 93 HH TYR 93 -0.032 8.272 7.329 737 H PHE 94 H PHE 94 -0.210 -0.361 5.533 738 HA PHE 94 HA PHE 94 -1.919 -2.336 6.936 739 HB2 PHE 94 1HB PHE 94 -0.752 -2.771 4.163 740 HB3 PHE 94 2HB PHE 94 -1.571 -3.994 5.139 741 HD1 PHE 94 2HD PHE 94 -4.026 -3.615 5.781 742 HD2 PHE 94 1HD PHE 94 -2.014 -1.208 2.832 743 HE1 PHE 94 2HE PHE 94 -6.228 -2.834 4.914 744 HE2 PHE 94 1HE PHE 94 -4.171 -0.398 2.014 745 HZ PHE 94 HZ PHE 94 -6.312 -1.217 3.032 746 H GLU 95 H GLU 95 -0.715 -4.211 7.724 747 HA GLU 95 HA GLU 95 2.254 -3.908 7.667 748 HB2 GLU 95 1HB GLU 95 2.357 -4.723 9.849 749 HB3 GLU 95 2HB GLU 95 1.128 -3.504 9.837 750 HG2 GLU 95 1HG GLU 95 -0.507 -5.499 9.654 751 HG3 GLU 95 2HG GLU 95 0.884 -6.471 10.175 752 H ILE 96 H ILE 96 2.064 -5.021 5.556 753 HA ILE 96 HA ILE 96 1.130 -7.804 5.555 754 HB ILE 96 HB ILE 96 2.635 -6.306 3.387 755 HG12 ILE 96 1HG1 ILE 96 -0.199 -6.504 2.787 756 HG13 ILE 96 2HG1 ILE 96 -0.050 -5.715 4.331 757 HG21 ILE 96 1HG2 ILE 96 1.480 -7.839 1.833 758 HG22 ILE 96 2HG2 ILE 96 2.530 -8.699 2.950 759 HG23 ILE 96 3HG2 ILE 96 0.773 -8.710 3.209 760 HD11 ILE 96 3HD1 ILE 96 -0.024 -4.129 2.414 761 HD12 ILE 96 1HD1 ILE 96 1.475 -4.035 3.375 762 HD13 ILE 96 2HD1 ILE 96 1.461 -4.888 1.810 763 HA PRO 97 HA PRO 97 5.366 -9.348 6.393 764 HB2 PRO 97 1HB PRO 97 5.115 -11.980 5.843 765 HB3 PRO 97 2HB PRO 97 4.393 -11.242 7.300 766 HG2 PRO 97 1HG PRO 97 3.055 -11.796 4.630 767 HG3 PRO 97 2HG PRO 97 2.467 -12.275 6.234 768 HD2 PRO 97 1HD PRO 97 1.600 -10.020 4.995 769 HD3 PRO 97 2HD PRO 97 1.837 -10.012 6.751 770 H MET 98 H MET 98 7.158 -9.668 4.940 771 HA MET 98 HA MET 98 6.693 -9.634 2.080 772 HB2 MET 98 1HB MET 98 9.170 -10.148 3.760 773 HB3 MET 98 2HB MET 98 9.189 -10.187 1.986 774 HG2 MET 98 1HG MET 98 8.546 -7.899 1.806 775 HG3 MET 98 2HG MET 98 8.191 -7.770 3.525 776 HE1 MET 98 3HE MET 98 11.100 -5.401 3.514 777 HE2 MET 98 1HE MET 98 9.937 -5.575 2.185 778 HE3 MET 98 2HE MET 98 9.386 -5.728 3.882 779 H ASP 99 H ASP 99 7.441 -12.247 4.424 780 HA ASP 99 HA ASP 99 8.147 -14.258 2.690 781 HB2 ASP 99 1HB ASP 99 8.112 -14.772 5.049 782 HB3 ASP 99 2HB ASP 99 6.354 -14.575 5.122 783 H ALA 100 H ALA 100 4.788 -13.459 3.590 784 HA ALA 100 HA ALA 100 3.726 -15.699 2.210 785 HB1 ALA 100 1HB ALA 100 1.605 -14.970 3.020 786 HB2 ALA 100 2HB ALA 100 2.795 -14.588 4.271 787 HB3 ALA 100 3HB ALA 100 2.170 -13.297 3.197 788 H LEU 101 H LEU 101 4.954 -13.214 0.586 789 HA LEU 101 HA LEU 101 2.737 -12.667 -1.288 790 HB2 LEU 101 1HB LEU 101 5.613 -11.699 -1.273 791 HB3 LEU 101 2HB LEU 101 4.329 -11.090 -2.316 792 HG LEU 101 HG LEU 101 4.323 -10.891 0.737 793 HD11 LEU 101 1HD1 LEU 101 4.824 -8.500 0.375 794 HD12 LEU 101 2HD1 LEU 101 5.014 -8.818 -1.366 795 HD13 LEU 101 3HD1 LEU 101 6.109 -9.600 -0.199 796 HD21 LEU 101 3HD2 LEU 101 2.564 -9.435 -1.255 797 HD22 LEU 101 1HD2 LEU 101 2.490 -9.368 0.510 798 HD23 LEU 101 2HD2 LEU 101 2.039 -10.848 -0.330 799 H GLN 102 H GLN 102 2.641 -13.328 -3.377 800 HA GLN 102 HA GLN 102 3.660 -15.769 -4.214 801 HB2 GLN 102 1HB GLN 102 1.789 -14.258 -5.229 802 HB3 GLN 102 2HB GLN 102 3.078 -13.555 -6.193 803 HG2 GLN 102 1HG GLN 102 3.515 -15.778 -7.171 804 HG3 GLN 102 2HG GLN 102 2.321 -16.495 -6.079 805 HE21 GLN 102 1HE2 GLN 102 0.012 -16.072 -6.444 806 HE22 GLN 102 2HE2 GLN 102 -0.476 -15.606 -8.056 807 H ASP 103 H ASP 103 5.194 -12.595 -4.596 808 HA ASP 103 HA ASP 103 7.502 -13.780 -5.943 809 HB2 ASP 103 1HB ASP 103 5.683 -13.170 -7.659 810 HB3 ASP 103 2HB ASP 103 5.896 -11.499 -7.116 811 H ASN 104 H ASN 104 8.917 -11.662 -6.493 812 HA ASN 104 HA ASN 104 9.240 -10.108 -4.025 813 HB2 ASN 104 1HB ASN 104 10.791 -10.289 -6.636 814 HB3 ASN 104 2HB ASN 104 11.123 -9.073 -5.412 815 HD21 ASN 104 1HD2 ASN 104 13.132 -9.778 -4.920 816 HD22 ASN 104 2HD2 ASN 104 13.492 -11.293 -4.086 817 H SER 105 H SER 105 6.672 -9.609 -5.034 818 HA SER 105 HA SER 105 7.002 -6.770 -5.495 819 HB2 SER 105 1HB SER 105 5.600 -6.514 -7.398 820 HB3 SER 105 2HB SER 105 6.721 -7.817 -7.815 821 HG SER 105 HG SER 105 5.075 -9.031 -8.153 822 H ILE 106 H ILE 106 5.169 -5.580 -4.947 823 HA ILE 106 HA ILE 106 3.136 -7.062 -3.345 824 HB ILE 106 HB ILE 106 4.644 -5.793 -1.946 825 HG12 ILE 106 1HG1 ILE 106 3.154 -4.761 -0.492 826 HG13 ILE 106 2HG1 ILE 106 1.943 -4.442 -1.756 827 HG21 ILE 106 1HG2 ILE 106 4.587 -3.324 -1.896 828 HG22 ILE 106 2HG2 ILE 106 5.240 -3.934 -3.422 829 HG23 ILE 106 3HG2 ILE 106 3.578 -3.307 -3.360 830 HD11 ILE 106 3HD1 ILE 106 2.737 -7.158 -0.634 831 HD12 ILE 106 1HD1 ILE 106 1.269 -6.245 -0.230 832 HD13 ILE 106 2HD1 ILE 106 1.468 -6.888 -1.863 833 H GLN 107 H GLN 107 0.965 -6.105 -3.334 834 HA GLN 107 HA GLN 107 0.108 -4.068 -5.147 835 HB2 GLN 107 1HB GLN 107 0.300 -5.735 -6.891 836 HB3 GLN 107 2HB GLN 107 -0.372 -6.999 -5.856 837 HG2 GLN 107 1HG GLN 107 -2.575 -5.974 -5.927 838 HG3 GLN 107 2HG GLN 107 -1.938 -4.585 -6.825 839 HE21 GLN 107 1HE2 GLN 107 -2.638 -4.674 -8.893 840 HE22 GLN 107 2HE2 GLN 107 -2.731 -6.049 -9.899 841 H ILE 108 H ILE 108 -2.169 -3.638 -4.680 842 HA ILE 108 HA ILE 108 -3.537 -5.287 -2.636 843 HB ILE 108 HB ILE 108 -3.479 -2.236 -2.867 844 HG12 ILE 108 1HG1 ILE 108 -2.322 -4.172 -0.822 845 HG13 ILE 108 2HG1 ILE 108 -1.423 -3.094 -1.851 846 HG21 ILE 108 1HG2 ILE 108 -4.904 -2.276 -0.812 847 HG22 ILE 108 2HG2 ILE 108 -5.716 -2.948 -2.184 848 HG23 ILE 108 3HG2 ILE 108 -5.026 -4.040 -0.957 849 HD11 ILE 108 3HD1 ILE 108 -3.116 -2.293 0.508 850 HD12 ILE 108 1HD1 ILE 108 -1.374 -2.119 0.295 851 HD13 ILE 108 2HD1 ILE 108 -2.483 -1.130 -0.685 852 H LYS 109 H LYS 109 -6.007 -5.105 -2.989 853 HA LYS 109 HA LYS 109 -6.772 -3.579 -5.253 854 HB2 LYS 109 1HB LYS 109 -8.249 -5.298 -6.309 855 HB3 LYS 109 2HB LYS 109 -6.549 -5.571 -6.507 856 HG2 LYS 109 1HG LYS 109 -7.280 -7.029 -4.153 857 HG3 LYS 109 2HG LYS 109 -8.522 -7.338 -5.354 858 HD2 LYS 109 1HD LYS 109 -6.760 -9.015 -5.536 859 HD3 LYS 109 2HD LYS 109 -6.830 -8.048 -6.983 860 HE2 LYS 109 1HE LYS 109 -4.515 -8.270 -6.486 861 HE3 LYS 109 2HE LYS 109 -4.879 -6.619 -6.033 862 HZ1 LYS 109 3HZ LYS 109 -4.667 -9.019 -4.325 863 HZ2 LYS 109 1HZ LYS 109 -5.159 -7.551 -3.696 864 HZ3 LYS 109 2HZ LYS 109 -3.625 -7.811 -4.317 865 H ALA 110 H ALA 110 -9.268 -3.009 -5.099 866 HA ALA 110 HA ALA 110 -10.514 -4.120 -2.689 867 HB1 ALA 110 1HB ALA 110 -10.970 -1.864 -1.718 868 HB2 ALA 110 2HB ALA 110 -9.267 -2.330 -1.646 869 HB3 ALA 110 3HB ALA 110 -9.809 -1.173 -2.867 870 H LEU 111 H LEU 111 -12.778 -3.510 -2.455 871 HA LEU 111 HA LEU 111 -14.064 -3.598 -5.049 872 HB2 LEU 111 1HB LEU 111 -14.886 -4.865 -3.032 873 HB3 LEU 111 2HB LEU 111 -15.350 -3.305 -2.333 874 HG LEU 111 HG LEU 111 -16.767 -2.965 -4.508 875 HD11 LEU 111 1HD1 LEU 111 -17.500 -4.980 -5.653 876 HD12 LEU 111 2HD1 LEU 111 -16.477 -6.002 -4.624 877 HD13 LEU 111 3HD1 LEU 111 -15.741 -4.886 -5.784 878 HD21 LEU 111 3HD2 LEU 111 -17.736 -3.446 -2.273 879 HD22 LEU 111 1HD2 LEU 111 -17.629 -5.189 -2.630 880 HD23 LEU 111 2HD2 LEU 111 -18.658 -4.153 -3.605 881 H SER 112 H SER 112 -14.481 -2.008 -6.234 882 HA SER 112 HA SER 112 -14.743 0.789 -5.389 883 HB2 SER 112 1HB SER 112 -13.394 0.672 -7.196 884 HB3 SER 112 2HB SER 112 -14.137 -0.781 -7.821 885 HG SER 112 HG SER 112 -15.510 1.685 -8.053 886 H SER 113 H SER 113 -16.727 -1.028 -7.743 887 HA SER 113 HA SER 113 -19.189 -0.440 -6.251 888 HB2 SER 113 1HB SER 113 -18.653 1.663 -7.438 889 HB3 SER 113 2HB SER 113 -18.473 0.774 -8.962 890 HG SER 113 HG SER 113 -20.445 1.800 -8.795 891 H GLY 114 H GLY 114 -20.933 -1.668 -7.074 892 HA2 GLY 114 1HA GLY 114 -21.871 -3.626 -7.756 893 HA3 GLY 114 2HA GLY 114 -21.028 -3.390 -9.293 894 H THR 115 H THR 115 -19.294 -4.698 -9.763 895 HA THR 115 HA THR 115 -18.187 -6.502 -7.665 896 HB THR 115 HB THR 115 -17.734 -7.968 -9.720 897 HG1 THR 115 1HG THR 115 -19.353 -7.409 -11.441 898 HG21 THR 115 3HG2 THR 115 -20.644 -7.379 -9.039 899 HG22 THR 115 1HG2 THR 115 -19.546 -8.428 -8.112 900 HG23 THR 115 2HG2 THR 115 -20.014 -8.871 -9.763 901 H THR 116 H THR 116 -17.352 -3.746 -9.350 902 HA THR 116 HA THR 116 -14.849 -4.402 -10.561 903 HB THR 116 HB THR 116 -15.852 -1.804 -9.383 904 HG1 THR 116 1HG THR 116 -16.642 -3.135 -11.547 905 HG21 THR 116 3HG2 THR 116 -14.303 -0.663 -10.874 906 HG22 THR 116 1HG2 THR 116 -13.645 -2.224 -11.417 907 HG23 THR 116 2HG2 THR 116 -13.414 -1.686 -9.727 908 H PHE 117 H PHE 117 -13.021 -4.772 -9.661 909 HA PHE 117 HA PHE 117 -12.503 -4.183 -6.800 910 HB2 PHE 117 1HB PHE 117 -12.832 -6.722 -8.005 911 HB3 PHE 117 2HB PHE 117 -11.085 -6.539 -7.763 912 HD1 PHE 117 1HD PHE 117 -10.269 -5.860 -5.441 913 HD2 PHE 117 2HD PHE 117 -14.308 -7.113 -6.181 914 HE1 PHE 117 1HE PHE 117 -10.562 -6.324 -3.010 915 HE2 PHE 117 2HE PHE 117 -14.609 -7.578 -3.758 916 HZ PHE 117 HZ PHE 117 -12.743 -7.175 -2.171 917 H VAL 118 H VAL 118 -11.202 -2.404 -7.114 918 HA VAL 118 HA VAL 118 -9.625 -2.096 -9.546 919 HB VAL 118 HB VAL 118 -10.438 -0.148 -8.441 920 HG11 VAL 118 1HG1 VAL 118 -10.860 -0.615 -6.381 921 HG12 VAL 118 2HG1 VAL 118 -9.141 -0.751 -5.929 922 HG13 VAL 118 3HG1 VAL 118 -9.873 0.816 -6.411 923 HG21 VAL 118 3HG2 VAL 118 -8.556 1.325 -8.508 924 HG22 VAL 118 1HG2 VAL 118 -7.487 -0.121 -8.455 925 HG23 VAL 118 2HG2 VAL 118 -8.566 0.145 -9.823 926 H TYR 119 H TYR 119 -8.003 -3.222 -9.966 927 HA TYR 119 HA TYR 119 -6.158 -4.202 -7.969 928 HB2 TYR 119 1HB TYR 119 -5.836 -4.011 -11.003 929 HB3 TYR 119 2HB TYR 119 -5.007 -5.124 -9.923 930 HD1 TYR 119 2HD TYR 119 -6.367 -6.863 -8.706 931 HD2 TYR 119 1HD TYR 119 -8.110 -4.458 -11.801 932 HE1 TYR 119 2HE TYR 119 -8.384 -8.382 -8.776 933 HE2 TYR 119 1HE TYR 119 -9.969 -6.062 -12.038 934 HH TYR 119 HH TYR 119 -11.149 -7.657 -10.817 935 H SER 120 H SER 120 -4.587 -3.025 -7.058 936 HA SER 120 HA SER 120 -4.004 -0.320 -7.965 937 HB2 SER 120 1HB SER 120 -2.720 -0.284 -6.106 938 HB3 SER 120 2HB SER 120 -3.730 -1.549 -5.626 939 HG SER 120 HG SER 120 -1.282 -2.269 -6.832 940 H GLN 121 H GLN 121 -1.383 -0.033 -8.443 941 HA GLN 121 HA GLN 121 -0.650 -1.600 -10.749 942 HB2 GLN 121 1HB GLN 121 1.454 -0.451 -10.538 943 HB3 GLN 121 2HB GLN 121 0.156 0.699 -10.261 944 HG2 GLN 121 1HG GLN 121 1.194 -0.564 -7.751 945 HG3 GLN 121 2HG GLN 121 2.384 0.285 -8.710 946 HE21 GLN 121 1HE2 GLN 121 2.598 2.428 -8.371 947 HE22 GLN 121 2HE2 GLN 121 1.305 3.490 -7.877 948 H LYS 122 H LYS 122 1.596 -2.765 -10.672 949 HA LYS 122 HA LYS 122 1.933 -4.438 -8.232 950 HB2 LYS 122 1HB LYS 122 1.479 -5.492 -10.592 951 HB3 LYS 122 2HB LYS 122 3.129 -4.983 -10.966 952 HG2 LYS 122 1HG LYS 122 3.948 -6.364 -9.040 953 HG3 LYS 122 2HG LYS 122 2.278 -6.730 -8.628 954 HD2 LYS 122 1HD LYS 122 2.881 -8.643 -9.731 955 HD3 LYS 122 2HD LYS 122 2.078 -7.755 -11.005 956 HE2 LYS 122 1HE LYS 122 5.109 -7.975 -10.586 957 HE3 LYS 122 2HE LYS 122 4.154 -8.966 -11.687 958 HZ1 LYS 122 3HZ LYS 122 3.534 -6.756 -12.764 959 HZ2 LYS 122 1HZ LYS 122 5.056 -7.338 -12.998 960 HZ3 LYS 122 2HZ LYS 122 4.820 -6.130 -11.920 961 H ILE 123 H ILE 123 3.974 -4.143 -7.184 962 HA ILE 123 HA ILE 123 6.008 -2.472 -8.492 963 HB ILE 123 HB ILE 123 5.048 -2.166 -5.601 964 HG12 ILE 123 1HG1 ILE 123 3.498 -0.976 -7.092 965 HG13 ILE 123 2HG1 ILE 123 4.372 0.068 -6.003 966 HG21 ILE 123 1HG2 ILE 123 6.667 -0.231 -5.497 967 HG22 ILE 123 2HG2 ILE 123 7.440 -1.821 -5.683 968 HG23 ILE 123 3HG2 ILE 123 7.278 -0.729 -7.070 969 HD11 ILE 123 3HD1 ILE 123 5.916 0.641 -7.996 970 HD12 ILE 123 1HD1 ILE 123 4.765 -0.271 -8.984 971 HD13 ILE 123 2HD1 ILE 123 4.250 1.180 -8.109 972 H ASP 124 H ASP 124 7.428 -3.830 -8.883 973 HA ASP 124 HA ASP 124 8.167 -6.142 -7.340 974 HB2 ASP 124 1HB ASP 124 8.926 -4.750 -9.828 975 HB3 ASP 124 2HB ASP 124 10.299 -5.408 -8.980 976 H PHE 125 H PHE 125 10.164 -6.361 -6.101 977 HA PHE 125 HA PHE 125 11.660 -3.912 -5.492 978 HB2 PHE 125 1HB PHE 125 11.326 -4.218 -3.014 979 HB3 PHE 125 2HB PHE 125 9.894 -3.786 -3.892 980 HD1 PHE 125 2HD PHE 125 11.357 -7.287 -3.337 981 HD2 PHE 125 1HD PHE 125 8.132 -4.504 -2.580 982 HE1 PHE 125 2HE PHE 125 10.086 -9.056 -2.294 983 HE2 PHE 125 1HE PHE 125 6.880 -6.322 -1.449 984 HZ PHE 125 HZ PHE 125 7.836 -8.618 -1.335 985 H GLU 126 H GLU 126 13.522 -4.609 -3.686 986 HA GLU 126 HA GLU 126 14.583 -7.302 -4.358 987 HB2 GLU 126 1HB GLU 126 15.754 -4.618 -4.208 988 HB3 GLU 126 2HB GLU 126 16.751 -6.062 -3.833 989 HG2 GLU 126 1HG GLU 126 15.117 -6.136 -6.360 990 HG3 GLU 126 2HG GLU 126 16.224 -4.791 -6.288 991 H ARG 127 H ARG 127 15.490 -8.452 -2.531 992 HA ARG 127 HA ARG 127 14.078 -7.801 -0.016 993 HB2 ARG 127 1HB ARG 127 14.769 -10.370 -1.484 994 HB3 ARG 127 2HB ARG 127 14.314 -10.376 0.202 995 HG2 ARG 127 1HG ARG 127 12.552 -9.145 -1.965 996 HG3 ARG 127 2HG ARG 127 12.478 -10.855 -1.531 997 HD2 ARG 127 1HD ARG 127 12.044 -8.545 0.402 998 HD3 ARG 127 2HD ARG 127 10.777 -9.496 -0.360 999 HE ARG 127 HE ARG 127 12.479 -10.272 1.883 1000 HH11 ARG 127 1HH1 ARG 127 10.053 -11.573 -0.447 1001 HH12 ARG 127 2HH1 ARG 127 10.190 -13.158 0.242 1002 HH21 ARG 127 1HH2 ARG 127 12.718 -12.424 2.537 1003 HH22 ARG 127 2HH2 ARG 127 11.869 -13.678 1.722 1004 H GLU 128 H GLU 128 15.767 -6.621 0.791 1005 HA GLU 128 HA GLU 128 17.514 -6.072 1.990 1006 HB2 GLU 128 1HB GLU 128 18.021 -8.975 2.560 1007 HB3 GLU 128 2HB GLU 128 18.876 -7.581 3.257 1008 HG2 GLU 128 1HG GLU 128 16.700 -6.781 4.202 1009 HG3 GLU 128 2HG GLU 128 15.954 -8.280 3.674 Start of MODEL 9 1 H1 GLY 1 H GLY 1 -21.903 19.207 -3.414 2 HA2 GLY 1 1HA GLY 1 -22.191 17.343 -1.934 3 HA3 GLY 1 2HA GLY 1 -22.658 16.801 -3.558 4 H ALA 2 H ALA 2 -19.923 16.887 -1.172 5 HA ALA 2 HA ALA 2 -18.578 14.681 -2.574 6 HB1 ALA 2 1HB ALA 2 -17.223 16.339 -1.447 7 HB2 ALA 2 2HB ALA 2 -18.073 16.054 0.088 8 HB3 ALA 2 3HB ALA 2 -17.089 14.758 -0.636 9 H GLU 3 H GLU 3 -20.354 13.331 -2.669 10 HA GLU 3 HA GLU 3 -21.824 12.312 -0.413 11 HB2 GLU 3 1HB GLU 3 -21.391 11.462 -3.290 12 HB3 GLU 3 2HB GLU 3 -22.529 10.629 -2.227 13 HG2 GLU 3 1HG GLU 3 -23.985 12.412 -2.071 14 HG3 GLU 3 2HG GLU 3 -22.777 13.638 -2.381 15 H ALA 4 H ALA 4 -21.783 9.692 -0.267 16 HA ALA 4 HA ALA 4 -19.098 8.873 0.630 17 HB1 ALA 4 1HB ALA 4 -21.704 7.382 0.530 18 HB2 ALA 4 2HB ALA 4 -20.153 6.804 1.196 19 HB3 ALA 4 3HB ALA 4 -20.969 8.198 1.946 20 H LEU 5 H LEU 5 -18.922 9.550 -1.997 21 HA LEU 5 HA LEU 5 -19.535 7.776 -4.048 22 HB2 LEU 5 1HB LEU 5 -16.921 9.275 -3.753 23 HB3 LEU 5 2HB LEU 5 -17.598 8.730 -5.266 24 HG LEU 5 HG LEU 5 -18.825 10.838 -3.466 25 HD11 LEU 5 1HD1 LEU 5 -17.182 11.192 -5.991 26 HD12 LEU 5 2HD1 LEU 5 -16.628 11.536 -4.340 27 HD13 LEU 5 3HD1 LEU 5 -17.951 12.481 -5.028 28 HD21 LEU 5 3HD2 LEU 5 -19.379 10.072 -6.369 29 HD22 LEU 5 1HD2 LEU 5 -20.169 11.398 -5.489 30 HD23 LEU 5 2HD2 LEU 5 -20.461 9.727 -4.988 31 HA PRO 6 HA PRO 6 -16.961 4.278 -3.031 32 HB2 PRO 6 1HB PRO 6 -16.758 2.985 -5.419 33 HB3 PRO 6 2HB PRO 6 -18.322 3.134 -4.562 34 HG2 PRO 6 1HG PRO 6 -17.259 4.837 -6.829 35 HG3 PRO 6 2HG PRO 6 -18.878 4.085 -6.655 36 HD2 PRO 6 1HD PRO 6 -18.281 6.734 -5.963 37 HD3 PRO 6 2HD PRO 6 -19.582 5.788 -5.180 38 H LEU 7 H LEU 7 -14.929 3.315 -3.577 39 HA LEU 7 HA LEU 7 -12.699 4.976 -3.835 40 HB2 LEU 7 1HB LEU 7 -12.831 2.844 -2.727 41 HB3 LEU 7 2HB LEU 7 -13.146 2.006 -4.229 42 HG LEU 7 HG LEU 7 -10.733 3.102 -4.844 43 HD11 LEU 7 1HD1 LEU 7 -10.694 4.118 -2.500 44 HD12 LEU 7 2HD1 LEU 7 -9.293 3.131 -2.945 45 HD13 LEU 7 3HD1 LEU 7 -10.590 2.472 -1.887 46 HD21 LEU 7 3HD2 LEU 7 -11.214 0.527 -3.315 47 HD22 LEU 7 1HD2 LEU 7 -9.703 0.954 -4.169 48 HD23 LEU 7 2HD2 LEU 7 -11.209 0.746 -5.077 49 H TYR 8 H TYR 8 -12.662 6.292 -5.673 50 HA TYR 8 HA TYR 8 -12.614 5.055 -8.359 51 HB2 TYR 8 1HB TYR 8 -12.603 7.455 -9.118 52 HB3 TYR 8 2HB TYR 8 -14.006 6.890 -8.257 53 HD1 TYR 8 1HD TYR 8 -10.830 8.864 -7.738 54 HD2 TYR 8 2HD TYR 8 -14.837 8.019 -6.390 55 HE1 TYR 8 1HE TYR 8 -10.643 10.670 -6.031 56 HE2 TYR 8 2HE TYR 8 -14.684 9.817 -4.718 57 HH TYR 8 HH TYR 8 -13.219 11.237 -3.637 58 H TYR 9 H TYR 9 -10.266 4.767 -6.388 59 HA TYR 9 HA TYR 9 -8.060 5.230 -8.224 60 HB2 TYR 9 1HB TYR 9 -8.458 7.526 -7.262 61 HB3 TYR 9 2HB TYR 9 -8.137 6.853 -5.665 62 HD1 TYR 9 2HD TYR 9 -6.640 7.441 -9.047 63 HD2 TYR 9 1HD TYR 9 -5.877 6.597 -4.888 64 HE1 TYR 9 2HE TYR 9 -4.262 8.020 -9.368 65 HE2 TYR 9 1HE TYR 9 -3.526 7.284 -5.172 66 HH TYR 9 HH TYR 9 -1.845 7.903 -6.747 67 H LEU 10 H LEU 10 -6.467 3.599 -7.667 68 HA LEU 10 HA LEU 10 -6.341 2.790 -4.820 69 HB2 LEU 10 1HB LEU 10 -7.884 1.189 -5.983 70 HB3 LEU 10 2HB LEU 10 -6.633 0.799 -7.127 71 HG LEU 10 HG LEU 10 -5.599 -0.400 -5.524 72 HD11 LEU 10 1HD1 LEU 10 -7.171 0.975 -3.380 73 HD12 LEU 10 2HD1 LEU 10 -5.387 0.873 -3.572 74 HD13 LEU 10 3HD1 LEU 10 -6.297 -0.547 -3.079 75 HD21 LEU 10 3HD2 LEU 10 -8.477 -0.853 -5.106 76 HD22 LEU 10 1HD2 LEU 10 -7.163 -1.910 -4.553 77 HD23 LEU 10 2HD2 LEU 10 -7.319 -1.553 -6.288 78 H GLN 11 H GLN 11 -4.229 3.377 -4.364 79 HA GLN 11 HA GLN 11 -2.131 2.492 -6.255 80 HB2 GLN 11 1HB GLN 11 -3.349 4.897 -6.694 81 HB3 GLN 11 2HB GLN 11 -2.182 5.380 -5.490 82 HG2 GLN 11 1HG GLN 11 -0.881 5.692 -7.283 83 HG3 GLN 11 2HG GLN 11 -0.505 3.990 -7.105 84 HE21 GLN 11 1HE2 GLN 11 -3.083 2.944 -8.352 85 HE22 GLN 11 2HE2 GLN 11 -2.815 3.322 -10.030 86 H ILE 12 H ILE 12 -0.198 2.157 -5.263 87 HA ILE 12 HA ILE 12 -0.246 1.852 -2.463 88 HB ILE 12 HB ILE 12 2.085 1.772 -4.380 89 HG12 ILE 12 1HG1 ILE 12 0.685 0.191 -5.283 90 HG13 ILE 12 2HG1 ILE 12 1.720 -0.729 -4.196 91 HG21 ILE 12 1HG2 ILE 12 1.910 0.215 -1.763 92 HG22 ILE 12 2HG2 ILE 12 3.291 0.404 -2.835 93 HG23 ILE 12 3HG2 ILE 12 2.746 1.782 -1.881 94 HD11 ILE 12 3HD1 ILE 12 -0.167 -0.703 -2.495 95 HD12 ILE 12 1HD1 ILE 12 -1.199 -0.016 -3.780 96 HD13 ILE 12 2HD1 ILE 12 -0.468 -1.611 -3.979 97 H THR 13 H THR 13 1.056 4.591 -4.370 98 HA THR 13 HA THR 13 1.469 6.661 -3.829 99 HB THR 13 HB THR 13 0.007 6.034 -1.254 100 HG1 THR 13 1HG THR 13 -1.213 5.386 -2.991 101 HG21 THR 13 3HG2 THR 13 1.044 8.319 -1.338 102 HG22 THR 13 1HG2 THR 13 -0.724 8.327 -1.351 103 HG23 THR 13 2HG2 THR 13 0.166 8.611 -2.858 104 H GLY 14 H GLY 14 2.284 4.920 -0.729 105 HA2 GLY 14 1HA GLY 14 5.051 5.738 -1.172 106 HA3 GLY 14 2HA GLY 14 4.339 6.281 0.359 107 H ILE 15 H ILE 15 6.508 4.372 0.095 108 HA ILE 15 HA ILE 15 5.281 2.048 1.393 109 HB ILE 15 HB ILE 15 5.393 1.646 -1.082 110 HG12 ILE 15 1HG1 ILE 15 7.038 -0.269 0.613 111 HG13 ILE 15 2HG1 ILE 15 5.263 -0.109 0.649 112 HG21 ILE 15 1HG2 ILE 15 8.406 1.332 -0.757 113 HG22 ILE 15 2HG2 ILE 15 7.451 1.252 -2.249 114 HG23 ILE 15 3HG2 ILE 15 7.674 2.800 -1.423 115 HD11 ILE 15 3HD1 ILE 15 5.356 -0.537 -1.910 116 HD12 ILE 15 1HD1 ILE 15 7.025 -1.083 -1.576 117 HD13 ILE 15 2HD1 ILE 15 5.644 -1.903 -0.827 118 H THR 16 H THR 16 6.678 1.041 2.826 119 HA THR 16 HA THR 16 9.483 1.479 2.712 120 HB THR 16 HB THR 16 8.885 3.650 3.719 121 HG1 THR 16 1HG THR 16 10.789 2.615 4.307 122 HG21 THR 16 3HG2 THR 16 7.899 3.887 5.900 123 HG22 THR 16 1HG2 THR 16 7.855 2.131 6.147 124 HG23 THR 16 2HG2 THR 16 6.784 2.892 4.952 125 H SER 17 H SER 17 10.356 0.576 5.096 126 HA SER 17 HA SER 17 8.772 -1.713 5.916 127 HB2 SER 17 1HB SER 17 10.644 -3.272 5.532 128 HB3 SER 17 2HB SER 17 10.175 -2.559 3.955 129 HG SER 17 HG SER 17 12.502 -2.537 5.221 130 H ASP 18 H ASP 18 9.868 -2.730 7.830 131 HA ASP 18 HA ASP 18 10.341 -0.720 9.829 132 HB2 ASP 18 1HB ASP 18 10.423 -2.662 11.314 133 HB3 ASP 18 2HB ASP 18 9.113 -2.867 10.190 134 H GLY 19 H GLY 19 12.468 -2.564 7.752 135 HA2 GLY 19 1HA GLY 19 14.822 -1.943 9.410 136 HA3 GLY 19 2HA GLY 19 14.766 -2.944 7.973 137 H ASN 20 H ASN 20 13.104 -0.161 7.039 138 HA ASN 20 HA ASN 20 15.611 0.951 5.859 139 HB2 ASN 20 1HB ASN 20 12.887 0.513 4.709 140 HB3 ASN 20 2HB ASN 20 13.727 1.971 4.229 141 HD21 ASN 20 1HD2 ASN 20 14.094 1.250 1.996 142 HD22 ASN 20 2HD2 ASN 20 15.255 0.007 1.661 143 H ASP 21 H ASP 21 14.295 1.696 8.523 144 HA ASP 21 HA ASP 21 14.160 3.516 9.760 145 HB2 ASP 21 1HB ASP 21 16.246 4.126 8.224 146 HB3 ASP 21 2HB ASP 21 15.183 5.359 7.603 147 H PHE 22 H PHE 22 11.937 2.766 8.004 148 HA PHE 22 HA PHE 22 9.912 3.449 7.324 149 HB2 PHE 22 1HB PHE 22 10.345 5.606 9.408 150 HB3 PHE 22 2HB PHE 22 8.833 5.296 8.581 151 HD1 PHE 22 2HD PHE 22 11.402 3.460 10.704 152 HD2 PHE 22 1HD PHE 22 7.277 3.811 9.481 153 HE1 PHE 22 2HE PHE 22 10.757 1.832 12.407 154 HE2 PHE 22 1HE PHE 22 6.633 2.163 11.191 155 HZ PHE 22 HZ PHE 22 8.366 1.145 12.659 156 H ALA 23 H ALA 23 12.330 4.454 5.874 157 HA ALA 23 HA ALA 23 11.784 6.983 4.768 158 HB1 ALA 23 1HB ALA 23 13.949 5.905 4.617 159 HB2 ALA 23 2HB ALA 23 13.271 4.644 3.553 160 HB3 ALA 23 3HB ALA 23 13.337 6.342 3.019 161 H TRP 24 H TRP 24 9.545 7.020 4.489 162 HA TRP 24 HA TRP 24 7.897 5.308 3.091 163 HB2 TRP 24 1HB TRP 24 7.788 8.198 3.922 164 HB3 TRP 24 2HB TRP 24 6.543 7.610 2.840 165 HD1 TRP 24 HD TRP 24 7.189 7.886 6.399 166 HE1 TRP 24 1HE TRP 24 5.546 6.536 7.748 167 HE3 TRP 24 3HE TRP 24 5.566 4.830 2.684 168 HZ2 TRP 24 2HZ TRP 24 3.684 4.305 7.250 169 HZ3 TRP 24 3HZ TRP 24 3.894 3.054 3.134 170 HH2 TRP 24 HH TRP 24 2.982 2.746 5.435 171 H ASP 25 H ASP 25 9.994 7.388 1.626 172 HA ASP 25 HA ASP 25 10.340 8.134 -0.595 173 HB2 ASP 25 1HB ASP 25 10.285 5.182 -0.212 174 HB3 ASP 25 2HB ASP 25 10.557 5.806 -1.833 175 H ASN 26 H ASN 26 8.528 9.348 -1.287 176 HA ASN 26 HA ASN 26 6.021 8.203 -2.093 177 HB2 ASN 26 1HB ASN 26 7.341 10.876 -2.625 178 HB3 ASN 26 2HB ASN 26 5.991 10.374 -3.637 179 HD21 ASN 26 1HD2 ASN 26 6.786 10.376 -0.059 180 HD22 ASN 26 2HD2 ASN 26 5.106 10.631 0.352 181 H LEU 27 H LEU 27 5.358 7.122 -3.747 182 HA LEU 27 HA LEU 27 7.310 6.081 -5.557 183 HB2 LEU 27 1HB LEU 27 4.301 5.988 -5.871 184 HB3 LEU 27 2HB LEU 27 5.479 4.887 -6.600 185 HG LEU 27 HG LEU 27 4.510 5.097 -3.775 186 HD11 LEU 27 1HD1 LEU 27 4.702 2.747 -5.666 187 HD12 LEU 27 2HD1 LEU 27 3.236 3.701 -5.315 188 HD13 LEU 27 3HD1 LEU 27 4.017 2.737 -4.027 189 HD21 LEU 27 3HD2 LEU 27 6.849 4.820 -3.390 190 HD22 LEU 27 1HD2 LEU 27 6.937 3.460 -4.518 191 HD23 LEU 27 2HD2 LEU 27 6.010 3.328 -3.016 192 H THR 28 H THR 28 7.542 6.412 -7.771 193 HA THR 28 HA THR 28 6.742 8.973 -8.886 194 HB THR 28 HB THR 28 7.274 7.596 -11.077 195 HG1 THR 28 1HG THR 28 8.572 6.146 -11.039 196 HG21 THR 28 3HG2 THR 28 9.597 8.444 -10.970 197 HG22 THR 28 1HG2 THR 28 9.445 8.637 -9.209 198 HG23 THR 28 2HG2 THR 28 8.467 9.626 -10.315 199 H SER 29 H SER 29 5.192 9.310 -10.519 200 HA SER 29 HA SER 29 2.694 8.170 -9.861 201 HB2 SER 29 1HB SER 29 3.289 9.815 -12.330 202 HB3 SER 29 2HB SER 29 1.809 9.763 -11.367 203 HG SER 29 HG SER 29 2.857 11.571 -10.818 204 H SER 30 H SER 30 5.046 6.940 -11.987 205 HA SER 30 HA SER 30 3.158 4.888 -12.863 206 HB2 SER 30 1HB SER 30 4.995 6.218 -14.888 207 HB3 SER 30 2HB SER 30 3.795 4.934 -15.157 208 HG SER 30 HG SER 30 2.360 6.703 -14.097 209 H GLN 31 H GLN 31 4.982 4.977 -10.777 210 HA GLN 31 HA GLN 31 7.485 3.705 -11.423 211 HB2 GLN 31 1HB GLN 31 6.782 4.769 -9.157 212 HB3 GLN 31 2HB GLN 31 5.816 3.354 -8.909 213 HG2 GLN 31 1HG GLN 31 7.864 1.999 -9.081 214 HG3 GLN 31 2HG GLN 31 8.832 3.444 -9.293 215 HE21 GLN 31 1HE2 GLN 31 9.194 4.863 -7.362 216 HE22 GLN 31 2HE2 GLN 31 8.787 4.254 -5.789 217 H THR 32 H THR 32 7.891 1.530 -11.611 218 HA THR 32 HA THR 32 5.705 -0.449 -11.291 219 HB THR 32 HB THR 32 6.768 -1.532 -13.377 220 HG1 THR 32 1HG THR 32 7.569 0.179 -14.808 221 HG21 THR 32 3HG2 THR 32 5.278 1.108 -13.713 222 HG22 THR 32 1HG2 THR 32 4.536 -0.415 -13.199 223 HG23 THR 32 2HG2 THR 32 5.245 -0.301 -14.813 224 H LYS 33 H LYS 33 8.725 0.567 -10.268 225 HA LYS 33 HA LYS 33 9.123 -2.007 -9.017 226 HB2 LYS 33 1HB LYS 33 10.495 -1.876 -11.304 227 HB3 LYS 33 2HB LYS 33 11.633 -0.918 -10.360 228 HG2 LYS 33 1HG LYS 33 10.550 -3.471 -9.252 229 HG3 LYS 33 2HG LYS 33 11.694 -3.624 -10.564 230 HD2 LYS 33 1HD LYS 33 12.753 -1.813 -8.523 231 HD3 LYS 33 2HD LYS 33 12.334 -3.363 -7.806 232 HE2 LYS 33 1HE LYS 33 13.915 -3.301 -10.386 233 HE3 LYS 33 2HE LYS 33 14.737 -2.887 -8.886 234 HZ1 LYS 33 3HZ LYS 33 14.394 -5.395 -9.828 235 HZ2 LYS 33 1HZ LYS 33 13.264 -5.346 -8.666 236 HZ3 LYS 33 2HZ LYS 33 14.843 -5.029 -8.321 237 H ALA 34 H ALA 34 10.290 -1.900 -7.132 238 HA ALA 34 HA ALA 34 9.861 0.457 -5.645 239 HB1 ALA 34 1HB ALA 34 11.129 -0.784 -3.858 240 HB2 ALA 34 2HB ALA 34 9.964 -1.828 -4.677 241 HB3 ALA 34 3HB ALA 34 11.699 -1.938 -5.071 242 HA PRO 35 HA PRO 35 13.496 2.857 -6.390 243 HB2 PRO 35 1HB PRO 35 14.026 4.022 -3.958 244 HB3 PRO 35 2HB PRO 35 12.658 4.484 -5.015 245 HG2 PRO 35 1HG PRO 35 12.615 2.596 -2.633 246 HG3 PRO 35 2HG PRO 35 11.481 3.938 -3.005 247 HD2 PRO 35 1HD PRO 35 10.857 1.391 -3.640 248 HD3 PRO 35 2HD PRO 35 10.452 2.715 -4.758 249 H ASN 36 H ASN 36 13.703 0.760 -3.420 250 HA ASN 36 HA ASN 36 16.128 -0.401 -4.338 251 HB2 ASN 36 1HB ASN 36 17.493 0.107 -2.422 252 HB3 ASN 36 2HB ASN 36 16.935 1.653 -3.077 253 HD21 ASN 36 1HD2 ASN 36 15.441 2.974 -1.727 254 HD22 ASN 36 2HD2 ASN 36 14.957 2.407 -0.154 255 H VAL 37 H VAL 37 16.653 -2.180 -2.602 256 HA VAL 37 HA VAL 37 14.214 -3.524 -1.698 257 HB VAL 37 HB VAL 37 15.774 -4.911 -2.551 258 HG11 VAL 37 1HG1 VAL 37 17.863 -3.698 -0.957 259 HG12 VAL 37 2HG1 VAL 37 17.960 -5.303 -1.788 260 HG13 VAL 37 3HG1 VAL 37 17.600 -3.870 -2.743 261 HG21 VAL 37 3HG2 VAL 37 16.418 -5.468 0.289 262 HG22 VAL 37 1HG2 VAL 37 14.728 -5.506 -0.199 263 HG23 VAL 37 2HG2 VAL 37 15.881 -6.583 -1.021 264 H LEU 38 H LEU 38 13.275 -2.974 -0.267 265 HA LEU 38 HA LEU 38 13.536 -1.682 2.165 266 HB2 LEU 38 1HB LEU 38 11.532 -3.790 1.680 267 HB3 LEU 38 2HB LEU 38 11.439 -2.209 2.434 268 HG LEU 38 HG LEU 38 10.277 -2.178 0.553 269 HD11 LEU 38 1HD1 LEU 38 11.020 -0.239 -0.682 270 HD12 LEU 38 2HD1 LEU 38 12.665 -0.488 -0.080 271 HD13 LEU 38 3HD1 LEU 38 11.375 -0.070 1.054 272 HD21 LEU 38 3HD2 LEU 38 11.376 -4.008 -0.516 273 HD22 LEU 38 1HD2 LEU 38 12.122 -2.734 -1.532 274 HD23 LEU 38 2HD2 LEU 38 10.348 -2.838 -1.369 275 H LYS 39 H LYS 39 14.873 -2.526 3.914 276 HA LYS 39 HA LYS 39 15.159 -5.471 4.178 277 HB2 LYS 39 1HB LYS 39 16.440 -3.112 5.592 278 HB3 LYS 39 2HB LYS 39 16.484 -4.704 6.315 279 HG2 LYS 39 1HG LYS 39 18.177 -5.344 5.070 280 HG3 LYS 39 2HG LYS 39 17.286 -5.094 3.597 281 HD2 LYS 39 1HD LYS 39 18.768 -2.822 5.007 282 HD3 LYS 39 2HD LYS 39 19.503 -3.847 3.766 283 HE2 LYS 39 1HE LYS 39 16.969 -3.113 2.756 284 HE3 LYS 39 2HE LYS 39 17.629 -1.619 3.445 285 HZ1 LYS 39 3HZ LYS 39 19.503 -1.845 1.967 286 HZ2 LYS 39 1HZ LYS 39 18.135 -2.077 1.077 287 HZ3 LYS 39 2HZ LYS 39 19.026 -3.373 1.505 288 H GLY 40 H GLY 40 14.646 -6.536 6.260 289 HA2 GLY 40 1HA GLY 40 13.957 -6.340 8.509 290 HA3 GLY 40 2HA GLY 40 12.918 -5.009 8.117 291 H ASN 41 H ASN 41 11.870 -6.678 5.754 292 HA ASN 41 HA ASN 41 10.421 -8.294 5.149 293 HB2 ASN 41 1HB ASN 41 11.626 -9.734 6.969 294 HB3 ASN 41 2HB ASN 41 10.141 -9.430 7.876 295 HD21 ASN 41 1HD2 ASN 41 8.090 -10.206 6.893 296 HD22 ASN 41 2HD2 ASN 41 8.182 -11.763 6.075 297 H LYS 42 H LYS 42 9.714 -5.989 7.706 298 HA LYS 42 HA LYS 42 6.799 -6.539 7.476 299 HB2 LYS 42 1HB LYS 42 8.277 -4.121 8.608 300 HB3 LYS 42 2HB LYS 42 6.575 -4.348 8.715 301 HG2 LYS 42 1HG LYS 42 8.484 -6.358 9.957 302 HG3 LYS 42 2HG LYS 42 7.999 -4.892 10.793 303 HD2 LYS 42 1HD LYS 42 5.637 -5.491 10.645 304 HD3 LYS 42 2HD LYS 42 6.026 -6.975 9.754 305 HE2 LYS 42 1HE LYS 42 7.185 -6.337 12.504 306 HE3 LYS 42 2HE LYS 42 5.633 -7.166 12.303 307 HZ1 LYS 42 3HZ LYS 42 6.702 -8.899 11.126 308 HZ2 LYS 42 1HZ LYS 42 7.461 -8.703 12.571 309 HZ3 LYS 42 2HZ LYS 42 8.203 -8.172 11.212 310 H LEU 43 H LEU 43 5.631 -5.670 5.758 311 HA LEU 43 HA LEU 43 7.022 -3.602 4.135 312 HB2 LEU 43 1HB LEU 43 6.149 -6.093 3.303 313 HB3 LEU 43 2HB LEU 43 4.787 -5.076 2.862 314 HG LEU 43 HG LEU 43 7.718 -4.731 2.079 315 HD11 LEU 43 1HD1 LEU 43 5.311 -5.164 0.284 316 HD12 LEU 43 2HD1 LEU 43 6.380 -6.478 0.861 317 HD13 LEU 43 3HD1 LEU 43 7.020 -5.189 -0.166 318 HD21 LEU 43 3HD2 LEU 43 5.392 -2.910 1.327 319 HD22 LEU 43 1HD2 LEU 43 7.046 -2.870 0.646 320 HD23 LEU 43 2HD2 LEU 43 6.792 -2.460 2.324 321 H TYR 44 H TYR 44 6.303 -1.664 4.779 322 HA TYR 44 HA TYR 44 3.519 -1.368 5.732 323 HB2 TYR 44 1HB TYR 44 5.848 0.571 5.857 324 HB3 TYR 44 2HB TYR 44 4.264 0.796 6.555 325 HD1 TYR 44 2HD TYR 44 3.605 -1.683 7.955 326 HD2 TYR 44 1HD TYR 44 7.404 0.358 7.601 327 HE1 TYR 44 2HE TYR 44 4.380 -2.724 10.065 328 HE2 TYR 44 1HE TYR 44 8.143 -0.620 9.697 329 HH TYR 44 HH TYR 44 7.573 -1.983 11.505 330 H VAL 45 H VAL 45 2.158 -0.986 4.138 331 HA VAL 45 HA VAL 45 2.941 0.824 1.893 332 HB VAL 45 HB VAL 45 0.587 -1.075 2.258 333 HG11 VAL 45 1HG1 VAL 45 0.292 -0.542 -0.251 334 HG12 VAL 45 2HG1 VAL 45 -0.332 0.580 0.962 335 HG13 VAL 45 3HG1 VAL 45 1.198 0.948 0.134 336 HG21 VAL 45 3HG2 VAL 45 2.956 -1.270 0.371 337 HG22 VAL 45 1HG2 VAL 45 2.707 -2.251 1.831 338 HG23 VAL 45 2HG2 VAL 45 1.582 -2.397 0.497 339 H LYS 46 H LYS 46 1.753 2.731 1.515 340 HA LYS 46 HA LYS 46 -0.264 3.559 3.555 341 HB2 LYS 46 1HB LYS 46 1.893 4.725 3.853 342 HB3 LYS 46 2HB LYS 46 1.848 5.283 2.183 343 HG2 LYS 46 1HG LYS 46 0.444 6.945 2.727 344 HG3 LYS 46 2HG LYS 46 -0.653 5.862 3.593 345 HD2 LYS 46 1HD LYS 46 -0.152 6.869 5.397 346 HD3 LYS 46 2HD LYS 46 1.406 6.042 5.398 347 HE2 LYS 46 1HE LYS 46 2.543 7.892 5.006 348 HE3 LYS 46 2HE LYS 46 1.464 8.416 3.701 349 HZ1 LYS 46 3HZ LYS 46 0.892 8.827 6.572 350 HZ2 LYS 46 1HZ LYS 46 -0.135 9.147 5.340 351 HZ3 LYS 46 2HZ LYS 46 1.273 9.997 5.466 352 H ALA 47 H ALA 47 -1.332 2.244 1.563 353 HA ALA 47 HA ALA 47 -1.459 3.611 -0.950 354 HB1 ALA 47 1HB ALA 47 -1.795 1.212 -0.853 355 HB2 ALA 47 2HB ALA 47 -3.234 1.412 0.162 356 HB3 ALA 47 3HB ALA 47 -3.231 1.971 -1.526 357 H ARG 48 H ARG 48 -2.898 5.065 -1.817 358 HA ARG 48 HA ARG 48 -4.453 6.588 0.173 359 HB2 ARG 48 1HB ARG 48 -2.800 7.642 -1.249 360 HB3 ARG 48 2HB ARG 48 -3.602 7.093 -2.711 361 HG2 ARG 48 1HG ARG 48 -4.796 8.955 -2.758 362 HG3 ARG 48 2HG ARG 48 -5.577 8.551 -1.248 363 HD2 ARG 48 1HD ARG 48 -4.547 10.757 -1.045 364 HD3 ARG 48 2HD ARG 48 -3.668 9.631 0.001 365 HE ARG 48 HE ARG 48 -1.784 10.067 -1.131 366 HH11 ARG 48 1HH1 ARG 48 -4.441 11.082 -3.297 367 HH12 ARG 48 2HH1 ARG 48 -3.425 12.136 -4.209 368 HH21 ARG 48 1HH2 ARG 48 -0.444 11.255 -2.473 369 HH22 ARG 48 2HH2 ARG 48 -1.058 12.085 -3.865 370 H PHE 49 H PHE 49 -6.608 5.882 0.440 371 HA PHE 49 HA PHE 49 -7.964 4.717 -1.972 372 HB2 PHE 49 1HB PHE 49 -8.594 4.420 0.981 373 HB3 PHE 49 2HB PHE 49 -9.503 3.720 -0.349 374 HD1 PHE 49 1HD PHE 49 -6.274 3.714 1.413 375 HD2 PHE 49 2HD PHE 49 -8.701 1.531 -1.448 376 HE1 PHE 49 1HE PHE 49 -4.903 1.756 1.713 377 HE2 PHE 49 2HE PHE 49 -7.455 -0.469 -0.983 378 HZ PHE 49 HZ PHE 49 -5.493 -0.421 0.520 379 H MET 50 H MET 50 -8.625 6.496 -3.003 380 HA MET 50 HA MET 50 -9.760 8.836 -1.741 381 HB2 MET 50 1HB MET 50 -9.577 8.241 -4.716 382 HB3 MET 50 2HB MET 50 -9.724 9.803 -3.948 383 HG2 MET 50 1HG MET 50 -7.292 8.169 -3.313 384 HG3 MET 50 2HG MET 50 -7.484 8.729 -4.963 385 HE1 MET 50 3HE MET 50 -7.326 11.486 -1.280 386 HE2 MET 50 1HE MET 50 -8.856 10.893 -1.985 387 HE3 MET 50 2HE MET 50 -7.685 9.735 -1.313 388 H GLY 51 H GLY 51 -11.570 7.335 -0.872 389 HA2 GLY 51 1HA GLY 51 -14.079 7.924 -1.588 390 HA3 GLY 51 2HA GLY 51 -13.725 6.780 -2.866 391 H TYR 52 H TYR 52 -15.848 6.190 -1.153 392 HA TYR 52 HA TYR 52 -15.174 4.821 1.142 393 HB2 TYR 52 1HB TYR 52 -17.468 5.663 -0.061 394 HB3 TYR 52 2HB TYR 52 -17.597 3.939 -0.335 395 HD1 TYR 52 2HD TYR 52 -17.055 2.403 1.828 396 HD2 TYR 52 1HD TYR 52 -18.112 6.582 1.933 397 HE1 TYR 52 2HE TYR 52 -17.622 2.188 4.201 398 HE2 TYR 52 1HE TYR 52 -18.837 6.385 4.223 399 HH TYR 52 HH TYR 52 -17.789 4.564 6.254 400 H THR 53 H THR 53 -13.983 3.111 1.375 401 HA THR 53 HA THR 53 -14.884 0.612 0.433 402 HB THR 53 HB THR 53 -12.195 1.675 -0.502 403 HG1 THR 53 1HG THR 53 -14.259 1.542 -1.681 404 HG21 THR 53 3HG2 THR 53 -11.633 -0.503 0.632 405 HG22 THR 53 1HG2 THR 53 -11.426 -0.511 -1.105 406 HG23 THR 53 2HG2 THR 53 -12.858 -1.302 -0.406 407 H LYS 54 H LYS 54 -14.083 -1.002 1.809 408 HA LYS 54 HA LYS 54 -12.232 -0.298 3.909 409 HB2 LYS 54 1HB LYS 54 -13.599 -0.995 5.765 410 HB3 LYS 54 2HB LYS 54 -14.379 0.349 4.961 411 HG2 LYS 54 1HG LYS 54 -16.249 -0.859 4.486 412 HG3 LYS 54 2HG LYS 54 -15.337 -2.239 3.885 413 HD2 LYS 54 1HD LYS 54 -14.828 -2.843 6.311 414 HD3 LYS 54 2HD LYS 54 -16.008 -1.590 6.774 415 HE2 LYS 54 1HE LYS 54 -17.721 -2.801 5.404 416 HE3 LYS 54 2HE LYS 54 -16.525 -4.065 5.065 417 HZ1 LYS 54 3HZ LYS 54 -17.690 -3.350 7.676 418 HZ2 LYS 54 1HZ LYS 54 -16.413 -4.377 7.539 419 HZ3 LYS 54 2HZ LYS 54 -17.869 -4.758 6.888 420 H LEU 55 H LEU 55 -12.568 -2.121 1.480 421 HA LEU 55 HA LEU 55 -12.478 -4.796 2.747 422 HB2 LEU 55 1HB LEU 55 -14.710 -3.782 1.495 423 HB3 LEU 55 2HB LEU 55 -13.918 -4.514 0.130 424 HG LEU 55 HG LEU 55 -15.375 -6.138 0.969 425 HD11 LEU 55 1HD1 LEU 55 -12.770 -6.975 2.306 426 HD12 LEU 55 2HD1 LEU 55 -13.085 -7.075 0.557 427 HD13 LEU 55 3HD1 LEU 55 -14.074 -8.007 1.693 428 HD21 LEU 55 3HD2 LEU 55 -14.342 -5.595 3.786 429 HD22 LEU 55 1HD2 LEU 55 -15.571 -6.794 3.328 430 HD23 LEU 55 2HD2 LEU 55 -15.896 -5.069 3.105 431 H THR 56 H THR 56 -10.177 -3.855 2.421 432 HA THR 56 HA THR 56 -9.049 -3.989 -0.234 433 HB THR 56 HB THR 56 -7.678 -4.167 2.495 434 HG1 THR 56 1HG THR 56 -8.733 -2.329 2.675 435 HG21 THR 56 3HG2 THR 56 -6.202 -4.607 0.570 436 HG22 THR 56 1HG2 THR 56 -5.821 -3.041 1.284 437 HG23 THR 56 2HG2 THR 56 -6.791 -3.108 -0.202 438 H VAL 57 H VAL 57 -7.902 -5.806 -1.185 439 HA VAL 57 HA VAL 57 -7.570 -8.191 0.510 440 HB VAL 57 HB VAL 57 -8.698 -8.261 -2.313 441 HG11 VAL 57 1HG1 VAL 57 -8.167 -10.483 -0.266 442 HG12 VAL 57 2HG1 VAL 57 -9.071 -10.699 -1.758 443 HG13 VAL 57 3HG1 VAL 57 -7.353 -10.292 -1.828 444 HG21 VAL 57 3HG2 VAL 57 -10.059 -8.916 0.360 445 HG22 VAL 57 1HG2 VAL 57 -10.470 -7.542 -0.711 446 HG23 VAL 57 2HG2 VAL 57 -10.749 -9.192 -1.245 447 H ILE 58 H ILE 58 -5.917 -9.495 -0.077 448 HA ILE 58 HA ILE 58 -3.900 -8.753 -2.058 449 HB ILE 58 HB ILE 58 -3.068 -9.142 0.853 450 HG12 ILE 58 1HG1 ILE 58 -3.450 -6.397 -0.394 451 HG13 ILE 58 2HG1 ILE 58 -4.480 -7.091 0.862 452 HG21 ILE 58 1HG2 ILE 58 -1.476 -9.556 -1.027 453 HG22 ILE 58 2HG2 ILE 58 -1.639 -7.837 -1.470 454 HG23 ILE 58 3HG2 ILE 58 -0.951 -8.319 0.102 455 HD11 ILE 58 3HD1 ILE 58 -2.457 -7.318 2.355 456 HD12 ILE 58 1HD1 ILE 58 -1.596 -6.332 1.137 457 HD13 ILE 58 2HD1 ILE 58 -2.988 -5.662 1.985 458 H THR 59 H THR 59 -4.032 -10.904 -3.055 459 HA THR 59 HA THR 59 -5.276 -12.957 -1.633 460 HB THR 59 HB THR 59 -5.165 -12.454 -4.109 461 HG1 THR 59 1HG THR 59 -5.844 -14.552 -4.439 462 HG21 THR 59 3HG2 THR 59 -2.937 -14.480 -4.080 463 HG22 THR 59 1HG2 THR 59 -2.688 -12.751 -4.371 464 HG23 THR 59 2HG2 THR 59 -3.680 -13.710 -5.489 465 H GLY 60 H GLY 60 -1.970 -12.461 -2.527 466 HA2 GLY 60 1HA GLY 60 0.053 -12.883 -1.373 467 HA3 GLY 60 2HA GLY 60 -0.863 -13.721 -0.109 468 H LYS 61 H LYS 61 1.325 -15.095 -0.704 469 HA LYS 61 HA LYS 61 1.307 -16.749 -2.948 470 HB2 LYS 61 1HB LYS 61 2.901 -16.311 -0.719 471 HB3 LYS 61 2HB LYS 61 2.230 -17.888 -0.337 472 HG2 LYS 61 1HG LYS 61 3.023 -18.705 -2.557 473 HG3 LYS 61 2HG LYS 61 3.698 -17.098 -2.894 474 HD2 LYS 61 1HD LYS 61 4.376 -18.619 -0.374 475 HD3 LYS 61 2HD LYS 61 5.255 -18.935 -1.894 476 HE2 LYS 61 1HE LYS 61 5.824 -16.430 -1.899 477 HE3 LYS 61 2HE LYS 61 5.165 -16.370 -0.270 478 HZ1 LYS 61 3HZ LYS 61 6.817 -18.335 0.120 479 HZ2 LYS 61 1HZ LYS 61 7.409 -16.807 0.085 480 HZ3 LYS 61 2HZ LYS 61 7.545 -17.730 -1.250 481 H ASP 62 H ASP 62 -0.088 -17.223 0.237 482 HA ASP 62 HA ASP 62 -1.240 -19.724 -0.042 483 HB2 ASP 62 1HB ASP 62 -1.227 -17.892 1.946 484 HB3 ASP 62 2HB ASP 62 -2.855 -17.610 1.377 485 H GLY 63 H GLY 63 -2.284 -16.788 -1.646 486 HA2 GLY 63 1HA GLY 63 -3.922 -16.428 -3.171 487 HA3 GLY 63 2HA GLY 63 -4.251 -18.161 -3.152 488 H LYS 64 H LYS 64 -4.492 -16.745 -0.038 489 HA LYS 64 HA LYS 64 -7.456 -16.544 -0.178 490 HB2 LYS 64 1HB LYS 64 -5.908 -18.297 1.765 491 HB3 LYS 64 2HB LYS 64 -7.659 -18.042 1.731 492 HG2 LYS 64 1HG LYS 64 -7.680 -18.974 -0.622 493 HG3 LYS 64 2HG LYS 64 -5.986 -19.396 -0.395 494 HD2 LYS 64 1HD LYS 64 -6.787 -20.554 1.799 495 HD3 LYS 64 2HD LYS 64 -8.389 -20.543 1.037 496 HE2 LYS 64 1HE LYS 64 -7.575 -21.852 -0.840 497 HE3 LYS 64 2HE LYS 64 -5.888 -21.561 -0.376 498 HZ1 LYS 64 3HZ LYS 64 -6.233 -22.831 1.604 499 HZ2 LYS 64 1HZ LYS 64 -6.528 -23.726 0.257 500 HZ3 LYS 64 2HZ LYS 64 -7.805 -23.193 1.158 501 H ASN 65 H ASN 65 -5.854 -14.351 0.013 502 HA ASN 65 HA ASN 65 -6.189 -12.314 1.011 503 HB2 ASN 65 1HB ASN 65 -8.505 -13.625 1.273 504 HB3 ASN 65 2HB ASN 65 -8.153 -13.478 2.985 505 HD21 ASN 65 1HD2 ASN 65 -7.001 -10.566 2.638 506 HD22 ASN 65 2HD2 ASN 65 -8.557 -9.776 2.641 507 H LEU 66 H LEU 66 -3.993 -12.451 1.850 508 HA LEU 66 HA LEU 66 -3.183 -13.423 4.302 509 HB2 LEU 66 1HB LEU 66 -2.298 -10.743 3.172 510 HB3 LEU 66 2HB LEU 66 -1.429 -11.742 4.339 511 HG LEU 66 HG LEU 66 -1.978 -12.382 1.416 512 HD11 LEU 66 1HD1 LEU 66 -0.153 -10.769 1.860 513 HD12 LEU 66 2HD1 LEU 66 0.497 -12.305 1.264 514 HD13 LEU 66 3HD1 LEU 66 0.602 -11.921 2.989 515 HD21 LEU 66 3HD2 LEU 66 -0.418 -14.416 1.948 516 HD22 LEU 66 1HD2 LEU 66 -2.115 -14.524 2.424 517 HD23 LEU 66 2HD2 LEU 66 -0.885 -14.140 3.633 518 H LEU 67 H LEU 67 -4.999 -10.436 3.807 519 HA LEU 67 HA LEU 67 -4.808 -9.395 6.457 520 HB2 LEU 67 1HB LEU 67 -6.812 -8.966 4.203 521 HB3 LEU 67 2HB LEU 67 -6.872 -8.070 5.695 522 HG LEU 67 HG LEU 67 -4.427 -8.008 3.899 523 HD11 LEU 67 1HD1 LEU 67 -6.393 -7.184 2.641 524 HD12 LEU 67 2HD1 LEU 67 -5.292 -5.848 3.051 525 HD13 LEU 67 3HD1 LEU 67 -6.792 -6.086 3.968 526 HD21 LEU 67 3HD2 LEU 67 -4.145 -7.281 6.281 527 HD22 LEU 67 1HD2 LEU 67 -5.395 -6.054 6.034 528 HD23 LEU 67 2HD2 LEU 67 -3.864 -5.988 5.114 529 H TYR 68 H TYR 68 -6.579 -12.172 5.342 530 HA TYR 68 HA TYR 68 -8.042 -12.108 7.913 531 HB2 TYR 68 1HB TYR 68 -9.543 -11.947 5.929 532 HB3 TYR 68 2HB TYR 68 -8.883 -13.466 5.335 533 HD1 TYR 68 2HD TYR 68 -10.051 -12.316 8.774 534 HD2 TYR 68 1HD TYR 68 -10.506 -15.192 5.571 535 HE1 TYR 68 2HE TYR 68 -11.637 -13.550 10.138 536 HE2 TYR 68 1HE TYR 68 -12.129 -16.436 6.939 537 HH TYR 68 HH TYR 68 -13.195 -15.305 10.189 538 H ASN 69 H ASN 69 -5.372 -13.359 6.450 539 HA ASN 69 HA ASN 69 -5.562 -16.065 7.645 540 HB2 ASN 69 1HB ASN 69 -3.161 -14.662 6.438 541 HB3 ASN 69 2HB ASN 69 -3.219 -16.312 7.047 542 HD21 ASN 69 1HD2 ASN 69 -6.055 -16.774 5.842 543 HD22 ASN 69 2HD2 ASN 69 -5.788 -16.681 4.116 544 H GLY 70 H GLY 70 -3.736 -13.029 8.142 545 HA2 GLY 70 1HA GLY 70 -4.207 -12.316 10.571 546 HA3 GLY 70 2HA GLY 70 -3.301 -13.775 10.993 547 H THR 71 H THR 71 -1.486 -13.283 8.498 548 HA THR 71 HA THR 71 0.543 -11.990 9.933 549 HB THR 71 HB THR 71 0.651 -12.087 6.913 550 HG1 THR 71 1HG THR 71 0.521 -14.163 6.785 551 HG21 THR 71 3HG2 THR 71 2.587 -12.863 9.143 552 HG22 THR 71 1HG2 THR 71 2.664 -11.380 8.171 553 HG23 THR 71 2HG2 THR 71 2.950 -12.956 7.415 554 H ALA 72 H ALA 72 -1.445 -10.788 7.157 555 HA ALA 72 HA ALA 72 -0.453 -8.043 7.609 556 HB1 ALA 72 1HB ALA 72 -0.710 -8.952 5.258 557 HB2 ALA 72 2HB ALA 72 -2.448 -9.145 5.572 558 HB3 ALA 72 3HB ALA 72 -1.713 -7.524 5.585 559 H LYS 73 H LYS 73 -1.729 -6.500 8.462 560 HA LYS 73 HA LYS 73 -4.610 -6.902 8.643 561 HB2 LYS 73 1HB LYS 73 -4.522 -5.840 10.979 562 HB3 LYS 73 2HB LYS 73 -4.320 -7.575 10.845 563 HG2 LYS 73 1HG LYS 73 -1.878 -5.773 11.028 564 HG3 LYS 73 2HG LYS 73 -2.837 -6.128 12.460 565 HD2 LYS 73 1HD LYS 73 -2.549 -8.610 11.997 566 HD3 LYS 73 2HD LYS 73 -1.432 -8.182 10.713 567 HE2 LYS 73 1HE LYS 73 -0.123 -8.765 12.563 568 HE3 LYS 73 2HE LYS 73 0.021 -7.010 12.408 569 HZ1 LYS 73 3HZ LYS 73 -1.374 -6.725 14.261 570 HZ2 LYS 73 1HZ LYS 73 -0.352 -7.909 14.718 571 HZ3 LYS 73 2HZ LYS 73 -1.888 -8.296 14.281 572 H MET 74 H MET 74 -5.699 -4.710 8.641 573 HA MET 74 HA MET 74 -3.860 -2.455 8.371 574 HB2 MET 74 1HB MET 74 -5.702 -1.135 8.055 575 HB3 MET 74 2HB MET 74 -6.032 -2.595 7.109 576 HG2 MET 74 1HG MET 74 -7.469 -3.391 9.047 577 HG3 MET 74 2HG MET 74 -7.183 -1.836 9.802 578 HE1 MET 74 3HE MET 74 -7.305 -0.986 6.273 579 HE2 MET 74 1HE MET 74 -8.742 0.059 6.364 580 HE3 MET 74 2HE MET 74 -7.412 0.251 7.556 581 H PHE 75 H PHE 75 -3.341 -1.190 10.057 582 HA PHE 75 HA PHE 75 -4.498 -1.764 12.755 583 HB2 PHE 75 1HB PHE 75 -2.244 -1.829 13.637 584 HB3 PHE 75 2HB PHE 75 -2.407 -3.034 12.365 585 HD1 PHE 75 2HD PHE 75 -1.388 -2.571 10.055 586 HD2 PHE 75 1HD PHE 75 -0.700 -0.008 13.460 587 HE1 PHE 75 2HE PHE 75 0.435 -1.379 8.822 588 HE2 PHE 75 1HE PHE 75 1.092 1.149 12.192 589 HZ PHE 75 HZ PHE 75 1.619 0.480 9.866 590 H LYS 76 H LYS 76 -4.156 0.617 10.424 591 HA LYS 76 HA LYS 76 -4.448 2.766 12.312 592 HB2 LYS 76 1HB LYS 76 -2.003 2.504 12.333 593 HB3 LYS 76 2HB LYS 76 -1.925 2.595 10.580 594 HG2 LYS 76 1HG LYS 76 -2.618 4.916 10.608 595 HG3 LYS 76 2HG LYS 76 -3.026 4.816 12.314 596 HD2 LYS 76 1HD LYS 76 -0.950 5.300 12.969 597 HD3 LYS 76 2HD LYS 76 -0.226 4.051 11.948 598 HE2 LYS 76 1HE LYS 76 0.024 5.467 10.109 599 HE3 LYS 76 2HE LYS 76 -1.189 6.629 10.695 600 HZ1 LYS 76 3HZ LYS 76 0.326 7.334 12.379 601 HZ2 LYS 76 1HZ LYS 76 1.100 7.411 10.898 602 HZ3 LYS 76 2HZ LYS 76 1.453 6.221 11.944 603 H SER 77 H SER 77 -5.310 4.643 11.147 604 HA SER 77 HA SER 77 -5.968 4.393 8.305 605 HB2 SER 77 1HB SER 77 -8.443 4.523 8.986 606 HB3 SER 77 2HB SER 77 -7.630 2.954 9.098 607 HG SER 77 HG SER 77 -8.059 4.755 11.260 608 H ASP 78 H ASP 78 -5.175 6.498 7.880 609 HA ASP 78 HA ASP 78 -6.018 8.681 9.750 610 HB2 ASP 78 1HB ASP 78 -3.502 8.284 9.021 611 HB3 ASP 78 2HB ASP 78 -4.001 9.218 7.614 612 H ALA 79 H ALA 79 -6.422 10.853 8.382 613 HA ALA 79 HA ALA 79 -8.595 10.051 6.490 614 HB1 ALA 79 1HB ALA 79 -8.685 12.117 8.717 615 HB2 ALA 79 2HB ALA 79 -10.032 11.586 7.699 616 HB3 ALA 79 3HB ALA 79 -9.304 10.458 8.843 617 H ILE 80 H ILE 80 -8.145 10.805 4.494 618 HA ILE 80 HA ILE 80 -6.408 13.137 4.125 619 HB ILE 80 HB ILE 80 -7.831 11.494 2.002 620 HG12 ILE 80 1HG1 ILE 80 -4.902 11.119 2.672 621 HG13 ILE 80 2HG1 ILE 80 -6.113 10.290 3.612 622 HG21 ILE 80 1HG2 ILE 80 -6.086 12.448 0.499 623 HG22 ILE 80 2HG2 ILE 80 -7.026 13.723 1.265 624 HG23 ILE 80 3HG2 ILE 80 -5.404 13.354 1.865 625 HD11 ILE 80 3HD1 ILE 80 -5.973 10.180 0.569 626 HD12 ILE 80 1HD1 ILE 80 -5.327 8.919 1.643 627 HD13 ILE 80 2HD1 ILE 80 -7.059 9.249 1.569 628 H LEU 81 H LEU 81 -7.443 14.852 4.643 629 HA LEU 81 HA LEU 81 -10.111 15.546 3.570 630 HB2 LEU 81 1HB LEU 81 -8.101 17.387 4.897 631 HB3 LEU 81 2HB LEU 81 -9.713 17.844 4.391 632 HG LEU 81 HG LEU 81 -9.075 15.715 6.485 633 HD11 LEU 81 1HD1 LEU 81 -10.023 18.594 6.815 634 HD12 LEU 81 2HD1 LEU 81 -8.411 17.966 7.218 635 HD13 LEU 81 3HD1 LEU 81 -9.824 17.394 8.115 636 HD21 LEU 81 3HD2 LEU 81 -11.431 15.793 7.049 637 HD22 LEU 81 1HD2 LEU 81 -11.322 15.417 5.341 638 HD23 LEU 81 2HD2 LEU 81 -11.740 17.052 5.859 639 H GLY 82 H GLY 82 -10.497 16.930 1.835 640 HA2 GLY 82 1HA GLY 82 -8.292 17.267 -0.140 641 HA3 GLY 82 2HA GLY 82 -10.004 17.056 -0.493 642 H GLN 83 H GLN 83 -8.051 19.214 1.583 643 HA GLN 83 HA GLN 83 -7.825 21.396 1.811 644 HB2 GLN 83 1HB GLN 83 -7.743 21.337 -0.767 645 HB3 GLN 83 2HB GLN 83 -9.406 21.908 -0.737 646 HG2 GLN 83 1HG GLN 83 -8.110 23.856 -0.948 647 HG3 GLN 83 2HG GLN 83 -8.569 23.845 0.755 648 HE21 GLN 83 1HE2 GLN 83 -5.925 23.207 -1.565 649 HE22 GLN 83 2HE2 GLN 83 -4.643 23.307 -0.350 650 H ASN 84 H ASN 84 -11.027 20.933 0.423 651 HA ASN 84 HA ASN 84 -12.278 23.016 2.000 652 HB2 ASN 84 1HB ASN 84 -13.480 20.969 0.055 653 HB3 ASN 84 2HB ASN 84 -14.326 22.338 0.742 654 HD21 ASN 84 1HD2 ASN 84 -11.751 21.405 -1.598 655 HD22 ASN 84 2HD2 ASN 84 -11.657 22.993 -2.296 656 H LYS 85 H LYS 85 -11.213 20.937 3.691 657 HA LYS 85 HA LYS 85 -11.688 19.359 5.286 658 HB2 LYS 85 1HB LYS 85 -14.417 20.666 5.420 659 HB3 LYS 85 2HB LYS 85 -13.608 19.782 6.703 660 HG2 LYS 85 1HG LYS 85 -11.984 21.496 7.050 661 HG3 LYS 85 2HG LYS 85 -12.451 22.390 5.596 662 HD2 LYS 85 1HD LYS 85 -14.354 21.862 7.897 663 HD3 LYS 85 2HD LYS 85 -13.348 23.304 7.805 664 HE2 LYS 85 1HE LYS 85 -15.285 22.504 5.570 665 HE3 LYS 85 2HE LYS 85 -15.779 23.489 6.946 666 HZ1 LYS 85 3HZ LYS 85 -13.567 24.285 5.144 667 HZ2 LYS 85 1HZ LYS 85 -14.236 25.149 6.337 668 HZ3 LYS 85 2HZ LYS 85 -15.132 24.823 5.011 669 H VAL 86 H VAL 86 -12.686 18.821 2.401 670 HA VAL 86 HA VAL 86 -14.893 17.022 2.747 671 HB VAL 86 HB VAL 86 -15.090 18.119 0.819 672 HG11 VAL 86 1HG1 VAL 86 -13.362 18.257 -0.898 673 HG12 VAL 86 2HG1 VAL 86 -12.902 18.982 0.654 674 HG13 VAL 86 3HG1 VAL 86 -12.249 17.406 0.213 675 HG21 VAL 86 3HG2 VAL 86 -13.862 15.435 0.024 676 HG22 VAL 86 1HG2 VAL 86 -15.499 15.665 0.650 677 HG23 VAL 86 2HG2 VAL 86 -15.016 16.400 -0.908 678 H VAL 87 H VAL 87 -14.562 14.926 3.581 679 HA VAL 87 HA VAL 87 -11.950 13.693 3.590 680 HB VAL 87 HB VAL 87 -13.300 13.169 5.330 681 HG11 VAL 87 1HG1 VAL 87 -15.587 12.473 3.489 682 HG12 VAL 87 2HG1 VAL 87 -15.526 12.088 5.220 683 HG13 VAL 87 3HG1 VAL 87 -15.477 13.772 4.708 684 HG21 VAL 87 3HG2 VAL 87 -12.035 11.246 4.409 685 HG22 VAL 87 1HG2 VAL 87 -13.452 10.817 5.383 686 HG23 VAL 87 2HG2 VAL 87 -13.530 10.699 3.608 687 H ILE 88 H ILE 88 -11.191 13.784 1.490 688 HA ILE 88 HA ILE 88 -12.712 12.583 -0.703 689 HB ILE 88 HB ILE 88 -10.671 12.897 -2.031 690 HG12 ILE 88 1HG1 ILE 88 -9.431 14.284 0.390 691 HG13 ILE 88 2HG1 ILE 88 -9.003 12.654 -0.124 692 HG21 ILE 88 1HG2 ILE 88 -12.434 14.620 -1.792 693 HG22 ILE 88 2HG2 ILE 88 -11.524 15.344 -0.447 694 HG23 ILE 88 3HG2 ILE 88 -10.848 15.330 -2.094 695 HD11 ILE 88 3HD1 ILE 88 -8.396 13.590 -2.402 696 HD12 ILE 88 1HD1 ILE 88 -8.599 15.215 -1.712 697 HD13 ILE 88 2HD1 ILE 88 -7.366 14.124 -1.065 698 H GLY 89 H GLY 89 -10.546 11.395 1.777 699 HA2 GLY 89 1HA GLY 89 -11.072 8.680 1.092 700 HA3 GLY 89 2HA GLY 89 -9.488 9.169 0.438 701 H TRP 90 H TRP 90 -8.895 7.339 2.005 702 HA TRP 90 HA TRP 90 -7.985 8.627 4.488 703 HB2 TRP 90 1HB TRP 90 -9.308 5.877 4.359 704 HB3 TRP 90 2HB TRP 90 -8.577 6.571 5.785 705 HD1 TRP 90 HD TRP 90 -9.975 8.484 7.038 706 HE1 TRP 90 1HE TRP 90 -12.424 9.264 6.920 707 HE3 TRP 90 3HE TRP 90 -11.312 6.176 2.723 708 HZ2 TRP 90 2HZ TRP 90 -14.752 8.693 5.259 709 HZ3 TRP 90 3HZ TRP 90 -13.635 6.300 1.857 710 HH2 TRP 90 HH TRP 90 -15.374 7.512 3.107 711 H ASP 91 H ASP 91 -6.097 7.679 5.267 712 HA ASP 91 HA ASP 91 -4.405 6.187 3.309 713 HB2 ASP 91 1HB ASP 91 -3.876 7.612 5.967 714 HB3 ASP 91 2HB ASP 91 -2.777 6.410 5.314 715 H LYS 92 H LYS 92 -5.464 4.141 3.419 716 HA LYS 92 HA LYS 92 -5.847 2.896 6.096 717 HB2 LYS 92 1HB LYS 92 -6.036 1.383 3.507 718 HB3 LYS 92 2HB LYS 92 -6.674 0.960 5.056 719 HG2 LYS 92 1HG LYS 92 -7.748 3.151 3.215 720 HG3 LYS 92 2HG LYS 92 -8.440 1.561 3.525 721 HD2 LYS 92 1HD LYS 92 -8.640 2.260 5.959 722 HD3 LYS 92 2HD LYS 92 -8.217 3.896 5.425 723 HE2 LYS 92 1HE LYS 92 -10.214 4.031 4.027 724 HE3 LYS 92 2HE LYS 92 -10.523 2.314 4.197 725 HZ1 LYS 92 3HZ LYS 92 -10.748 4.226 6.474 726 HZ2 LYS 92 1HZ LYS 92 -11.123 2.610 6.461 727 HZ3 LYS 92 2HZ LYS 92 -11.985 3.659 5.561 728 H TYR 93 H TYR 93 -4.051 2.177 7.132 729 HA TYR 93 HA TYR 93 -1.550 1.727 5.625 730 HB2 TYR 93 1HB TYR 93 -2.234 1.744 8.588 731 HB3 TYR 93 2HB TYR 93 -0.630 1.476 7.955 732 HD1 TYR 93 2HD TYR 93 -3.380 4.050 8.032 733 HD2 TYR 93 1HD TYR 93 0.832 3.312 7.504 734 HE1 TYR 93 2HE TYR 93 -2.970 6.451 8.015 735 HE2 TYR 93 1HE TYR 93 1.257 5.736 7.565 736 HH TYR 93 HH TYR 93 -1.363 8.181 7.822 737 H PHE 94 H PHE 94 -0.455 -0.330 5.748 738 HA PHE 94 HA PHE 94 -1.939 -2.606 6.947 739 HB2 PHE 94 1HB PHE 94 -0.750 -2.599 4.152 740 HB3 PHE 94 2HB PHE 94 -1.523 -3.972 4.950 741 HD1 PHE 94 1HD PHE 94 -4.046 -3.749 5.583 742 HD2 PHE 94 2HD PHE 94 -1.991 -0.982 2.987 743 HE1 PHE 94 1HE PHE 94 -6.232 -2.924 4.719 744 HE2 PHE 94 2HE PHE 94 -4.121 -0.136 2.203 745 HZ PHE 94 HZ PHE 94 -6.283 -1.087 3.048 746 H GLU 95 H GLU 95 -0.675 -4.308 7.593 747 HA GLU 95 HA GLU 95 2.271 -3.879 7.742 748 HB2 GLU 95 1HB GLU 95 0.784 -3.735 9.749 749 HB3 GLU 95 2HB GLU 95 0.301 -5.394 9.539 750 HG2 GLU 95 1HG GLU 95 2.417 -6.213 10.224 751 HG3 GLU 95 2HG GLU 95 3.245 -4.725 9.746 752 H ILE 96 H ILE 96 2.260 -4.994 5.434 753 HA ILE 96 HA ILE 96 1.257 -7.766 5.501 754 HB ILE 96 HB ILE 96 2.660 -6.443 3.179 755 HG12 ILE 96 1HG1 ILE 96 0.019 -6.158 2.524 756 HG13 ILE 96 2HG1 ILE 96 -0.093 -5.803 4.223 757 HG21 ILE 96 1HG2 ILE 96 1.145 -7.920 1.837 758 HG22 ILE 96 2HG2 ILE 96 2.206 -8.826 2.890 759 HG23 ILE 96 3HG2 ILE 96 0.494 -8.592 3.330 760 HD11 ILE 96 3HD1 ILE 96 0.263 -3.852 2.597 761 HD12 ILE 96 1HD1 ILE 96 1.420 -3.909 3.943 762 HD13 ILE 96 2HD1 ILE 96 1.895 -4.464 2.318 763 HA PRO 97 HA PRO 97 5.521 -9.381 5.974 764 HB2 PRO 97 1HB PRO 97 5.284 -11.819 4.721 765 HB3 PRO 97 2HB PRO 97 4.704 -11.496 6.386 766 HG2 PRO 97 1HG PRO 97 3.137 -11.407 3.787 767 HG3 PRO 97 2HG PRO 97 2.697 -12.270 5.290 768 HD2 PRO 97 1HD PRO 97 1.681 -9.894 4.717 769 HD3 PRO 97 2HD PRO 97 2.165 -10.207 6.391 770 H MET 98 H MET 98 7.245 -10.102 4.447 771 HA MET 98 HA MET 98 6.868 -9.154 1.647 772 HB2 MET 98 1HB MET 98 9.395 -9.818 3.210 773 HB3 MET 98 2HB MET 98 9.362 -9.444 1.488 774 HG2 MET 98 1HG MET 98 8.367 -7.221 1.988 775 HG3 MET 98 2HG MET 98 8.473 -7.582 3.707 776 HE1 MET 98 3HE MET 98 11.332 -5.063 3.725 777 HE2 MET 98 1HE MET 98 9.766 -4.906 2.902 778 HE3 MET 98 2HE MET 98 9.856 -5.681 4.499 779 H ASP 99 H ASP 99 8.171 -12.050 3.399 780 HA ASP 99 HA ASP 99 8.669 -13.503 1.063 781 HB2 ASP 99 1HB ASP 99 9.583 -14.118 3.253 782 HB3 ASP 99 2HB ASP 99 7.970 -14.537 3.834 783 H ALA 100 H ALA 100 5.707 -13.322 3.002 784 HA ALA 100 HA ALA 100 4.558 -15.697 1.753 785 HB1 ALA 100 1HB ALA 100 2.735 -15.419 3.257 786 HB2 ALA 100 2HB ALA 100 4.187 -14.948 4.159 787 HB3 ALA 100 3HB ALA 100 3.088 -13.702 3.511 788 H LEU 101 H LEU 101 5.029 -13.182 0.050 789 HA LEU 101 HA LEU 101 2.302 -12.511 -0.917 790 HB2 LEU 101 1HB LEU 101 5.068 -11.651 -1.836 791 HB3 LEU 101 2HB LEU 101 3.552 -11.048 -2.508 792 HG LEU 101 HG LEU 101 4.509 -10.657 0.366 793 HD11 LEU 101 1HD1 LEU 101 5.623 -9.480 -1.582 794 HD12 LEU 101 2HD1 LEU 101 5.010 -8.455 -0.279 795 HD13 LEU 101 3HD1 LEU 101 4.114 -8.597 -1.832 796 HD21 LEU 101 3HD2 LEU 101 2.603 -9.109 0.566 797 HD22 LEU 101 1HD2 LEU 101 2.066 -10.763 0.357 798 HD23 LEU 101 2HD2 LEU 101 1.985 -9.628 -1.013 799 H GLN 102 H GLN 102 1.930 -12.685 -3.253 800 HA GLN 102 HA GLN 102 2.359 -15.393 -4.084 801 HB2 GLN 102 1HB GLN 102 0.314 -13.822 -4.285 802 HB3 GLN 102 2HB GLN 102 1.190 -13.035 -5.622 803 HG2 GLN 102 1HG GLN 102 1.293 -15.259 -6.753 804 HG3 GLN 102 2HG GLN 102 0.382 -15.941 -5.387 805 HE21 GLN 102 1HE2 GLN 102 -1.280 -16.593 -6.938 806 HE22 GLN 102 2HE2 GLN 102 -2.287 -15.422 -7.786 807 H ASP 103 H ASP 103 4.049 -12.451 -4.650 808 HA ASP 103 HA ASP 103 5.710 -13.490 -6.867 809 HB2 ASP 103 1HB ASP 103 3.578 -11.978 -7.522 810 HB3 ASP 103 2HB ASP 103 4.631 -10.676 -6.929 811 H ASN 104 H ASN 104 7.499 -11.655 -7.185 812 HA ASN 104 HA ASN 104 8.524 -10.731 -4.567 813 HB2 ASN 104 1HB ASN 104 9.639 -10.559 -7.416 814 HB3 ASN 104 2HB ASN 104 10.325 -9.728 -6.051 815 HD21 ASN 104 1HD2 ASN 104 12.161 -10.728 -6.063 816 HD22 ASN 104 2HD2 ASN 104 12.483 -12.351 -5.470 817 H SER 105 H SER 105 6.223 -9.662 -6.631 818 HA SER 105 HA SER 105 6.874 -6.788 -6.147 819 HB2 SER 105 1HB SER 105 4.525 -7.495 -7.708 820 HB3 SER 105 2HB SER 105 5.655 -6.234 -7.989 821 HG SER 105 HG SER 105 7.057 -8.095 -8.853 822 H ILE 106 H ILE 106 5.256 -5.396 -5.378 823 HA ILE 106 HA ILE 106 3.183 -6.708 -3.722 824 HB ILE 106 HB ILE 106 4.785 -5.301 -2.573 825 HG12 ILE 106 1HG1 ILE 106 2.354 -5.470 -1.899 826 HG13 ILE 106 2HG1 ILE 106 3.386 -4.289 -1.106 827 HG21 ILE 106 1HG2 ILE 106 3.855 -2.975 -4.285 828 HG22 ILE 106 2HG2 ILE 106 4.847 -2.851 -2.828 829 HG23 ILE 106 3HG2 ILE 106 5.463 -3.716 -4.225 830 HD11 ILE 106 3HD1 ILE 106 1.090 -3.463 -1.594 831 HD12 ILE 106 1HD1 ILE 106 2.375 -2.452 -2.271 832 HD13 ILE 106 2HD1 ILE 106 1.462 -3.535 -3.329 833 H GLN 107 H GLN 107 1.037 -6.249 -3.984 834 HA GLN 107 HA GLN 107 0.134 -4.005 -5.605 835 HB2 GLN 107 1HB GLN 107 0.467 -5.792 -7.335 836 HB3 GLN 107 2HB GLN 107 -0.594 -6.858 -6.406 837 HG2 GLN 107 1HG GLN 107 -2.424 -5.067 -6.729 838 HG3 GLN 107 2HG GLN 107 -1.291 -4.243 -7.804 839 HE21 GLN 107 1HE2 GLN 107 -2.353 -4.542 -9.752 840 HE22 GLN 107 2HE2 GLN 107 -2.402 -6.137 -10.488 841 H ILE 108 H ILE 108 -1.944 -3.381 -4.907 842 HA ILE 108 HA ILE 108 -3.373 -5.148 -2.963 843 HB ILE 108 HB ILE 108 -3.154 -2.103 -3.020 844 HG12 ILE 108 1HG1 ILE 108 -2.312 -4.214 -0.961 845 HG13 ILE 108 2HG1 ILE 108 -1.234 -3.233 -1.950 846 HG21 ILE 108 1HG2 ILE 108 -4.697 -2.196 -1.047 847 HG22 ILE 108 2HG2 ILE 108 -5.470 -2.737 -2.509 848 HG23 ILE 108 3HG2 ILE 108 -4.886 -3.952 -1.338 849 HD11 ILE 108 3HD1 ILE 108 -2.125 -1.173 -0.804 850 HD12 ILE 108 1HD1 ILE 108 -2.995 -2.240 0.320 851 HD13 ILE 108 2HD1 ILE 108 -1.237 -2.305 0.246 852 H LYS 109 H LYS 109 -5.810 -5.109 -3.276 853 HA LYS 109 HA LYS 109 -6.761 -3.638 -5.583 854 HB2 LYS 109 1HB LYS 109 -7.826 -5.650 -6.606 855 HB3 LYS 109 2HB LYS 109 -6.106 -5.559 -6.765 856 HG2 LYS 109 1HG LYS 109 -6.504 -7.115 -4.402 857 HG3 LYS 109 2HG LYS 109 -7.763 -7.619 -5.508 858 HD2 LYS 109 1HD LYS 109 -5.778 -9.016 -5.755 859 HD3 LYS 109 2HD LYS 109 -6.098 -8.136 -7.230 860 HE2 LYS 109 1HE LYS 109 -3.740 -8.141 -6.862 861 HE3 LYS 109 2HE LYS 109 -4.275 -6.484 -6.664 862 HZ1 LYS 109 3HZ LYS 109 -4.321 -7.066 -4.187 863 HZ2 LYS 109 1HZ LYS 109 -2.797 -7.078 -4.866 864 HZ3 LYS 109 2HZ LYS 109 -3.566 -8.475 -4.612 865 H ALA 110 H ALA 110 -9.210 -3.457 -5.389 866 HA ALA 110 HA ALA 110 -10.456 -4.685 -3.033 867 HB1 ALA 110 1HB ALA 110 -11.016 -2.591 -1.954 868 HB2 ALA 110 2HB ALA 110 -9.251 -2.695 -2.095 869 HB3 ALA 110 3HB ALA 110 -10.169 -1.658 -3.207 870 H LEU 111 H LEU 111 -12.719 -4.307 -2.914 871 HA LEU 111 HA LEU 111 -14.180 -3.958 -5.419 872 HB2 LEU 111 1HB LEU 111 -14.908 -5.655 -3.835 873 HB3 LEU 111 2HB LEU 111 -14.906 -4.490 -2.515 874 HG LEU 111 HG LEU 111 -16.841 -3.270 -3.663 875 HD11 LEU 111 1HD1 LEU 111 -16.677 -4.053 -5.939 876 HD12 LEU 111 2HD1 LEU 111 -18.192 -4.626 -5.260 877 HD13 LEU 111 3HD1 LEU 111 -16.821 -5.753 -5.430 878 HD21 LEU 111 3HD2 LEU 111 -18.466 -4.934 -2.926 879 HD22 LEU 111 1HD2 LEU 111 -17.138 -4.716 -1.775 880 HD23 LEU 111 2HD2 LEU 111 -17.177 -6.149 -2.828 881 H SER 112 H SER 112 -15.053 -2.101 -6.093 882 HA SER 112 HA SER 112 -15.293 0.214 -4.205 883 HB2 SER 112 1HB SER 112 -14.852 1.647 -6.171 884 HB3 SER 112 2HB SER 112 -13.493 0.587 -5.733 885 HG SER 112 HG SER 112 -14.115 0.759 -8.038 886 H SER 113 H SER 113 -16.558 -0.641 -7.467 887 HA SER 113 HA SER 113 -19.259 0.314 -6.697 888 HB2 SER 113 1HB SER 113 -18.035 1.636 -8.405 889 HB3 SER 113 2HB SER 113 -17.822 0.185 -9.388 890 HG SER 113 HG SER 113 -20.346 1.332 -8.693 891 H GLY 114 H GLY 114 -20.799 -0.897 -8.573 892 HA2 GLY 114 1HA GLY 114 -21.506 -3.236 -7.353 893 HA3 GLY 114 2HA GLY 114 -21.991 -2.770 -8.983 894 H THR 115 H THR 115 -19.912 -4.752 -7.084 895 HA THR 115 HA THR 115 -18.864 -6.673 -7.399 896 HB THR 115 HB THR 115 -19.416 -8.199 -9.086 897 HG1 THR 115 1HG THR 115 -20.155 -5.959 -10.611 898 HG21 THR 115 3HG2 THR 115 -21.798 -8.263 -9.079 899 HG22 THR 115 1HG2 THR 115 -21.930 -6.526 -8.773 900 HG23 THR 115 2HG2 THR 115 -21.254 -7.586 -7.512 901 H THR 116 H THR 116 -17.721 -3.971 -8.692 902 HA THR 116 HA THR 116 -15.921 -5.015 -10.718 903 HB THR 116 HB THR 116 -17.127 -2.622 -10.506 904 HG1 THR 116 1HG THR 116 -15.394 -3.274 -12.053 905 HG21 THR 116 3HG2 THR 116 -15.930 -0.918 -9.448 906 HG22 THR 116 1HG2 THR 116 -14.591 -1.986 -9.021 907 HG23 THR 116 2HG2 THR 116 -16.160 -2.210 -8.235 908 H PHE 117 H PHE 117 -13.503 -4.418 -10.256 909 HA PHE 117 HA PHE 117 -12.795 -4.232 -7.444 910 HB2 PHE 117 1HB PHE 117 -12.854 -6.709 -8.793 911 HB3 PHE 117 2HB PHE 117 -11.143 -6.255 -8.815 912 HD1 PHE 117 1HD PHE 117 -14.079 -7.015 -6.791 913 HD2 PHE 117 2HD PHE 117 -9.916 -6.135 -6.703 914 HE1 PHE 117 1HE PHE 117 -13.985 -7.813 -4.390 915 HE2 PHE 117 2HE PHE 117 -9.776 -6.911 -4.303 916 HZ PHE 117 HZ PHE 117 -11.828 -7.733 -3.163 917 H VAL 118 H VAL 118 -11.307 -2.633 -7.374 918 HA VAL 118 HA VAL 118 -9.971 -1.774 -9.865 919 HB VAL 118 HB VAL 118 -9.532 -0.590 -7.108 920 HG11 VAL 118 1HG1 VAL 118 -9.351 0.573 -9.925 921 HG12 VAL 118 2HG1 VAL 118 -8.969 1.432 -8.421 922 HG13 VAL 118 3HG1 VAL 118 -7.966 0.070 -8.942 923 HG21 VAL 118 3HG2 VAL 118 -11.911 -0.445 -7.357 924 HG22 VAL 118 1HG2 VAL 118 -11.239 1.147 -7.709 925 HG23 VAL 118 2HG2 VAL 118 -11.767 0.093 -9.042 926 H TYR 119 H TYR 119 -7.777 -2.206 -10.190 927 HA TYR 119 HA TYR 119 -6.305 -3.682 -8.042 928 HB2 TYR 119 1HB TYR 119 -5.894 -3.805 -11.061 929 HB3 TYR 119 2HB TYR 119 -4.943 -4.644 -9.860 930 HD1 TYR 119 2HD TYR 119 -8.411 -4.354 -11.256 931 HD2 TYR 119 1HD TYR 119 -5.607 -6.821 -9.104 932 HE1 TYR 119 2HE TYR 119 -10.051 -6.126 -11.233 933 HE2 TYR 119 1HE TYR 119 -7.278 -8.685 -9.108 934 HH TYR 119 HH TYR 119 -10.538 -8.238 -10.549 935 H SER 120 H SER 120 -4.477 -2.756 -7.268 936 HA SER 120 HA SER 120 -3.790 -0.099 -8.200 937 HB2 SER 120 1HB SER 120 -2.437 -0.000 -6.351 938 HB3 SER 120 2HB SER 120 -3.587 -1.130 -5.782 939 HG SER 120 HG SER 120 -1.098 -1.931 -6.924 940 H GLN 121 H GLN 121 -1.426 0.342 -8.757 941 HA GLN 121 HA GLN 121 -0.587 -1.271 -10.995 942 HB2 GLN 121 1HB GLN 121 1.471 0.201 -10.836 943 HB3 GLN 121 2HB GLN 121 -0.069 1.016 -11.097 944 HG2 GLN 121 1HG GLN 121 -0.071 1.594 -8.600 945 HG3 GLN 121 2HG GLN 121 1.579 0.947 -8.549 946 HE21 GLN 121 1HE2 GLN 121 2.408 3.105 -7.935 947 HE22 GLN 121 2HE2 GLN 121 2.412 4.353 -9.159 948 H LYS 122 H LYS 122 1.536 -2.355 -11.068 949 HA LYS 122 HA LYS 122 2.059 -3.927 -8.585 950 HB2 LYS 122 1HB LYS 122 1.563 -5.194 -10.658 951 HB3 LYS 122 2HB LYS 122 2.895 -4.373 -11.481 952 HG2 LYS 122 1HG LYS 122 4.495 -5.379 -9.817 953 HG3 LYS 122 2HG LYS 122 3.137 -6.184 -9.040 954 HD2 LYS 122 1HD LYS 122 4.026 -7.857 -10.453 955 HD3 LYS 122 2HD LYS 122 2.685 -7.212 -11.408 956 HE2 LYS 122 1HE LYS 122 4.669 -5.519 -12.189 957 HE3 LYS 122 2HE LYS 122 5.672 -6.898 -11.721 958 HZ1 LYS 122 3HZ LYS 122 5.025 -6.906 -14.076 959 HZ2 LYS 122 1HZ LYS 122 3.425 -7.013 -13.652 960 HZ3 LYS 122 2HZ LYS 122 4.499 -8.245 -13.330 961 H ILE 123 H ILE 123 4.019 -3.678 -7.546 962 HA ILE 123 HA ILE 123 6.255 -2.171 -8.845 963 HB ILE 123 HB ILE 123 5.404 -1.957 -5.928 964 HG12 ILE 123 1HG1 ILE 123 3.703 -0.739 -7.164 965 HG13 ILE 123 2HG1 ILE 123 4.705 0.323 -6.199 966 HG21 ILE 123 1HG2 ILE 123 7.485 -0.425 -7.536 967 HG22 ILE 123 2HG2 ILE 123 7.117 -0.158 -5.829 968 HG23 ILE 123 3HG2 ILE 123 7.812 -1.716 -6.362 969 HD11 ILE 123 3HD1 ILE 123 4.955 -0.077 -9.205 970 HD12 ILE 123 1HD1 ILE 123 4.120 1.263 -8.404 971 HD13 ILE 123 2HD1 ILE 123 5.876 1.070 -8.223 972 H ASP 124 H ASP 124 7.490 -3.745 -9.349 973 HA ASP 124 HA ASP 124 7.875 -6.174 -7.808 974 HB2 ASP 124 1HB ASP 124 9.050 -4.913 -10.184 975 HB3 ASP 124 2HB ASP 124 10.246 -5.686 -9.156 976 H PHE 125 H PHE 125 8.996 -6.459 -5.966 977 HA PHE 125 HA PHE 125 11.050 -4.372 -5.325 978 HB2 PHE 125 1HB PHE 125 10.522 -4.182 -3.082 979 HB3 PHE 125 2HB PHE 125 9.061 -3.840 -3.936 980 HD1 PHE 125 2HD PHE 125 7.303 -5.737 -4.122 981 HD2 PHE 125 1HD PHE 125 10.560 -5.770 -1.340 982 HE1 PHE 125 2HE PHE 125 6.246 -7.639 -2.867 983 HE2 PHE 125 1HE PHE 125 9.516 -7.556 -0.058 984 HZ PHE 125 HZ PHE 125 7.405 -8.560 -0.829 985 H GLU 126 H GLU 126 12.464 -5.340 -3.079 986 HA GLU 126 HA GLU 126 13.098 -8.117 -3.839 987 HB2 GLU 126 1HB GLU 126 14.548 -5.521 -3.833 988 HB3 GLU 126 2HB GLU 126 15.494 -7.025 -3.516 989 HG2 GLU 126 1HG GLU 126 14.823 -7.742 -5.775 990 HG3 GLU 126 2HG GLU 126 13.797 -6.290 -5.919 991 H ARG 127 H ARG 127 14.225 -9.101 -1.885 992 HA ARG 127 HA ARG 127 12.671 -8.116 0.479 993 HB2 ARG 127 1HB ARG 127 13.059 -11.020 -0.235 994 HB3 ARG 127 2HB ARG 127 12.144 -10.318 1.078 995 HG2 ARG 127 1HG ARG 127 10.478 -10.938 -0.390 996 HG3 ARG 127 2HG ARG 127 10.666 -9.218 -0.712 997 HD2 ARG 127 1HD ARG 127 10.355 -10.519 -2.759 998 HD3 ARG 127 2HD ARG 127 11.899 -9.696 -2.757 999 HE ARG 127 HE ARG 127 13.051 -11.714 -2.432 1000 HH11 ARG 127 1HH1 ARG 127 9.506 -12.360 -2.525 1001 HH12 ARG 127 2HH1 ARG 127 9.728 -14.026 -2.844 1002 HH21 ARG 127 1HH2 ARG 127 13.278 -13.976 -3.028 1003 HH22 ARG 127 2HH2 ARG 127 11.847 -14.826 -3.482 1004 H GLU 128 H GLU 128 14.604 -7.063 1.152 1005 HA GLU 128 HA GLU 128 16.514 -6.702 2.209 1006 HB2 GLU 128 1HB GLU 128 16.550 -9.579 3.144 1007 HB3 GLU 128 2HB GLU 128 17.403 -8.186 3.801 1008 HG2 GLU 128 1HG GLU 128 15.551 -7.395 4.929 1009 HG3 GLU 128 2HG GLU 128 14.379 -8.152 3.841 Start of MODEL 10 1 H1 GLY 1 H GLY 1 -25.645 15.834 -4.616 2 HA2 GLY 1 1HA GLY 1 -25.227 14.980 -2.371 3 HA3 GLY 1 2HA GLY 1 -24.520 13.911 -3.603 4 H ALA 2 H ALA 2 -23.592 13.970 -0.976 5 HA ALA 2 HA ALA 2 -20.909 13.891 -1.679 6 HB1 ALA 2 1HB ALA 2 -19.913 15.280 0.131 7 HB2 ALA 2 2HB ALA 2 -20.809 16.303 -1.003 8 HB3 ALA 2 3HB ALA 2 -21.525 15.897 0.569 9 H GLU 3 H GLU 3 -22.618 11.974 -1.246 10 HA GLU 3 HA GLU 3 -22.664 11.039 1.544 11 HB2 GLU 3 1HB GLU 3 -23.328 9.754 -1.127 12 HB3 GLU 3 2HB GLU 3 -23.438 8.910 0.429 13 HG2 GLU 3 1HG GLU 3 -24.969 10.820 1.216 14 HG3 GLU 3 2HG GLU 3 -25.122 11.253 -0.487 15 H ALA 4 H ALA 4 -21.750 8.698 1.761 16 HA ALA 4 HA ALA 4 -18.922 8.489 1.238 17 HB1 ALA 4 1HB ALA 4 -19.880 7.421 3.167 18 HB2 ALA 4 2HB ALA 4 -21.107 6.604 2.180 19 HB3 ALA 4 3HB ALA 4 -19.404 6.122 2.034 20 H LEU 5 H LEU 5 -19.041 8.989 -1.129 21 HA LEU 5 HA LEU 5 -20.052 7.170 -3.042 22 HB2 LEU 5 1HB LEU 5 -17.477 8.737 -3.155 23 HB3 LEU 5 2HB LEU 5 -18.225 8.013 -4.533 24 HG LEU 5 HG LEU 5 -19.404 10.284 -2.880 25 HD11 LEU 5 1HD1 LEU 5 -17.970 10.267 -5.573 26 HD12 LEU 5 2HD1 LEU 5 -17.377 10.992 -4.065 27 HD13 LEU 5 3HD1 LEU 5 -18.799 11.667 -4.855 28 HD21 LEU 5 3HD2 LEU 5 -20.148 8.952 -5.498 29 HD22 LEU 5 1HD2 LEU 5 -20.898 10.466 -4.893 30 HD23 LEU 5 2HD2 LEU 5 -21.127 8.940 -4.004 31 HA PRO 6 HA PRO 6 -17.233 3.785 -2.344 32 HB2 PRO 6 1HB PRO 6 -17.409 2.419 -4.711 33 HB3 PRO 6 2HB PRO 6 -18.792 2.541 -3.577 34 HG2 PRO 6 1HG PRO 6 -18.277 4.149 -6.080 35 HG3 PRO 6 2HG PRO 6 -19.809 3.410 -5.531 36 HD2 PRO 6 1HD PRO 6 -19.086 6.099 -5.073 37 HD3 PRO 6 2HD PRO 6 -20.249 5.176 -4.065 38 H LEU 7 H LEU 7 -15.278 2.884 -3.261 39 HA LEU 7 HA LEU 7 -13.197 4.622 -3.801 40 HB2 LEU 7 1HB LEU 7 -13.018 2.360 -2.918 41 HB3 LEU 7 2HB LEU 7 -13.486 1.672 -4.484 42 HG LEU 7 HG LEU 7 -11.363 2.766 -5.407 43 HD11 LEU 7 1HD1 LEU 7 -10.872 3.137 -2.413 44 HD12 LEU 7 2HD1 LEU 7 -10.890 4.392 -3.662 45 HD13 LEU 7 3HD1 LEU 7 -9.593 3.207 -3.648 46 HD21 LEU 7 3HD2 LEU 7 -10.996 0.678 -3.222 47 HD22 LEU 7 1HD2 LEU 7 -9.946 0.969 -4.637 48 HD23 LEU 7 2HD2 LEU 7 -11.581 0.345 -4.875 49 H TYR 8 H TYR 8 -12.693 5.848 -5.571 50 HA TYR 8 HA TYR 8 -13.300 4.756 -8.291 51 HB2 TYR 8 1HB TYR 8 -12.941 7.242 -8.964 52 HB3 TYR 8 2HB TYR 8 -14.430 6.688 -8.281 53 HD1 TYR 8 1HD TYR 8 -11.338 8.626 -7.510 54 HD2 TYR 8 2HD TYR 8 -15.303 7.521 -6.228 55 HE1 TYR 8 1HE TYR 8 -11.257 10.358 -5.754 56 HE2 TYR 8 2HE TYR 8 -15.281 9.234 -4.497 57 HH TYR 8 HH TYR 8 -12.517 11.521 -4.121 58 H TYR 9 H TYR 9 -10.628 4.831 -6.296 59 HA TYR 9 HA TYR 9 -8.734 5.174 -8.572 60 HB2 TYR 9 1HB TYR 9 -8.860 7.192 -7.132 61 HB3 TYR 9 2HB TYR 9 -8.458 6.202 -5.729 62 HD1 TYR 9 1HD TYR 9 -7.084 6.982 -9.174 63 HD2 TYR 9 2HD TYR 9 -6.268 6.317 -5.004 64 HE1 TYR 9 1HE TYR 9 -4.773 7.744 -9.518 65 HE2 TYR 9 2HE TYR 9 -3.961 7.158 -5.303 66 HH TYR 9 HH TYR 9 -2.899 8.570 -8.391 67 H LEU 10 H LEU 10 -6.681 3.884 -8.213 68 HA LEU 10 HA LEU 10 -6.353 2.911 -5.621 69 HB2 LEU 10 1HB LEU 10 -7.530 0.903 -6.890 70 HB3 LEU 10 2HB LEU 10 -5.910 0.661 -7.534 71 HG LEU 10 HG LEU 10 -5.909 -0.737 -5.677 72 HD11 LEU 10 1HD1 LEU 10 -5.049 1.651 -4.120 73 HD12 LEU 10 2HD1 LEU 10 -4.033 0.804 -5.299 74 HD13 LEU 10 3HD1 LEU 10 -4.665 -0.075 -3.904 75 HD21 LEU 10 3HD2 LEU 10 -7.604 1.265 -4.227 76 HD22 LEU 10 1HD2 LEU 10 -6.858 -0.123 -3.421 77 HD23 LEU 10 2HD2 LEU 10 -8.041 -0.378 -4.734 78 H GLN 11 H GLN 11 -4.348 3.257 -4.976 79 HA GLN 11 HA GLN 11 -2.169 2.658 -6.768 80 HB2 GLN 11 1HB GLN 11 -3.051 5.102 -7.271 81 HB3 GLN 11 2HB GLN 11 -2.289 5.495 -5.743 82 HG2 GLN 11 1HG GLN 11 -0.719 6.021 -7.422 83 HG3 GLN 11 2HG GLN 11 -0.136 4.492 -6.779 84 HE21 GLN 11 1HE2 GLN 11 -2.731 3.455 -8.725 85 HE22 GLN 11 2HE2 GLN 11 -1.757 3.276 -10.178 86 H ILE 12 H ILE 12 -0.202 2.382 -5.629 87 HA ILE 12 HA ILE 12 -0.389 1.800 -2.837 88 HB ILE 12 HB ILE 12 2.100 2.049 -4.534 89 HG12 ILE 12 1HG1 ILE 12 0.389 0.295 -5.349 90 HG13 ILE 12 2HG1 ILE 12 1.994 -0.240 -4.986 91 HG21 ILE 12 1HG2 ILE 12 3.126 0.507 -2.784 92 HG22 ILE 12 2HG2 ILE 12 2.648 2.018 -2.013 93 HG23 ILE 12 3HG2 ILE 12 1.615 0.653 -1.874 94 HD11 ILE 12 3HD1 ILE 12 0.074 -1.726 -4.267 95 HD12 ILE 12 1HD1 ILE 12 1.326 -1.404 -3.056 96 HD13 ILE 12 2HD1 ILE 12 -0.234 -0.556 -2.969 97 H THR 13 H THR 13 0.786 4.802 -4.438 98 HA THR 13 HA THR 13 1.248 6.789 -3.689 99 HB THR 13 HB THR 13 0.513 6.780 -0.902 100 HG1 THR 13 1HG THR 13 -0.848 5.336 -1.015 101 HG21 THR 13 3HG2 THR 13 -0.819 8.034 -3.300 102 HG22 THR 13 1HG2 THR 13 0.594 8.691 -2.417 103 HG23 THR 13 2HG2 THR 13 -0.958 8.514 -1.579 104 H GLY 14 H GLY 14 2.008 4.786 -0.816 105 HA2 GLY 14 1HA GLY 14 4.870 5.441 -1.141 106 HA3 GLY 14 2HA GLY 14 4.133 5.988 0.369 107 H ILE 15 H ILE 15 6.198 4.132 0.390 108 HA ILE 15 HA ILE 15 4.959 1.709 1.517 109 HB ILE 15 HB ILE 15 5.113 1.317 -0.901 110 HG12 ILE 15 1HG1 ILE 15 7.051 -0.552 0.436 111 HG13 ILE 15 2HG1 ILE 15 5.431 -0.410 1.018 112 HG21 ILE 15 1HG2 ILE 15 7.203 0.964 -2.081 113 HG22 ILE 15 2HG2 ILE 15 7.237 2.601 -1.375 114 HG23 ILE 15 3HG2 ILE 15 8.147 1.288 -0.615 115 HD11 ILE 15 3HD1 ILE 15 6.240 -2.010 -1.148 116 HD12 ILE 15 1HD1 ILE 15 4.580 -1.725 -0.484 117 HD13 ILE 15 2HD1 ILE 15 5.214 -0.730 -1.817 118 H THR 16 H THR 16 6.695 0.746 2.891 119 HA THR 16 HA THR 16 9.401 1.508 2.737 120 HB THR 16 HB THR 16 8.529 3.611 3.732 121 HG1 THR 16 1HG THR 16 10.458 3.484 4.193 122 HG21 THR 16 3HG2 THR 16 7.786 3.787 5.982 123 HG22 THR 16 1HG2 THR 16 8.032 2.058 6.296 124 HG23 THR 16 2HG2 THR 16 6.737 2.594 5.199 125 H SER 17 H SER 17 10.193 0.768 5.379 126 HA SER 17 HA SER 17 8.685 -1.483 6.307 127 HB2 SER 17 1HB SER 17 10.541 -3.125 6.026 128 HB3 SER 17 2HB SER 17 9.700 -2.705 4.556 129 HG SER 17 HG SER 17 12.248 -2.574 5.069 130 H ASP 18 H ASP 18 9.892 -2.439 8.198 131 HA ASP 18 HA ASP 18 10.767 -0.525 10.072 132 HB2 ASP 18 1HB ASP 18 9.835 -2.805 10.510 133 HB3 ASP 18 2HB ASP 18 11.356 -3.515 9.989 134 H GLY 19 H GLY 19 12.708 -2.771 8.008 135 HA2 GLY 19 1HA GLY 19 15.243 -1.738 8.876 136 HA3 GLY 19 2HA GLY 19 14.923 -2.800 7.512 137 H ASN 20 H ASN 20 12.961 -0.056 7.056 138 HA ASN 20 HA ASN 20 15.026 1.213 5.297 139 HB2 ASN 20 1HB ASN 20 12.087 0.808 4.911 140 HB3 ASN 20 2HB ASN 20 12.888 2.199 4.178 141 HD21 ASN 20 1HD2 ASN 20 13.122 1.583 1.939 142 HD22 ASN 20 2HD2 ASN 20 13.937 0.075 1.524 143 H ASP 21 H ASP 21 13.851 1.646 8.299 144 HA ASP 21 HA ASP 21 13.809 3.389 9.738 145 HB2 ASP 21 1HB ASP 21 16.057 3.822 8.660 146 HB3 ASP 21 2HB ASP 21 15.273 4.981 7.604 147 H PHE 22 H PHE 22 11.526 2.980 8.132 148 HA PHE 22 HA PHE 22 9.551 3.896 7.529 149 HB2 PHE 22 1HB PHE 22 10.430 5.988 9.553 150 HB3 PHE 22 2HB PHE 22 8.854 5.972 8.820 151 HD1 PHE 22 2HD PHE 22 11.118 3.696 10.828 152 HD2 PHE 22 1HD PHE 22 7.077 4.895 9.847 153 HE1 PHE 22 2HE PHE 22 10.232 2.199 12.583 154 HE2 PHE 22 1HE PHE 22 6.215 3.445 11.653 155 HZ PHE 22 HZ PHE 22 7.787 2.078 13.004 156 H ALA 23 H ALA 23 12.071 4.792 5.963 157 HA ALA 23 HA ALA 23 11.424 7.343 4.779 158 HB1 ALA 23 1HB ALA 23 12.994 6.576 3.007 159 HB2 ALA 23 2HB ALA 23 13.671 6.381 4.636 160 HB3 ALA 23 3HB ALA 23 13.054 4.968 3.762 161 H TRP 24 H TRP 24 9.242 7.361 4.348 162 HA TRP 24 HA TRP 24 7.644 5.298 3.264 163 HB2 TRP 24 1HB TRP 24 7.396 8.254 3.898 164 HB3 TRP 24 2HB TRP 24 6.142 7.498 2.961 165 HD1 TRP 24 HD TRP 24 6.963 8.043 6.479 166 HE1 TRP 24 1HE TRP 24 5.603 6.542 7.976 167 HE3 TRP 24 3HE TRP 24 5.429 4.661 2.968 168 HZ2 TRP 24 2HZ TRP 24 3.834 4.186 7.656 169 HZ3 TRP 24 3HZ TRP 24 4.032 2.754 3.598 170 HH2 TRP 24 HH TRP 24 3.164 2.532 5.931 171 H ASP 25 H ASP 25 9.632 7.335 1.605 172 HA ASP 25 HA ASP 25 9.836 8.015 -0.623 173 HB2 ASP 25 1HB ASP 25 9.659 5.035 -0.372 174 HB3 ASP 25 2HB ASP 25 9.888 5.792 -1.960 175 H ASN 26 H ASN 26 8.069 9.305 -1.090 176 HA ASN 26 HA ASN 26 5.517 8.420 -1.859 177 HB2 ASN 26 1HB ASN 26 7.056 10.949 -2.577 178 HB3 ASN 26 2HB ASN 26 5.461 10.648 -3.253 179 HD21 ASN 26 1HD2 ASN 26 3.694 10.066 -1.691 180 HD22 ASN 26 2HD2 ASN 26 3.668 10.847 -0.147 181 H LEU 27 H LEU 27 5.098 6.980 -3.253 182 HA LEU 27 HA LEU 27 6.829 6.322 -5.481 183 HB2 LEU 27 1HB LEU 27 4.037 5.298 -4.808 184 HB3 LEU 27 2HB LEU 27 5.111 4.602 -6.011 185 HG LEU 27 HG LEU 27 5.631 4.708 -3.020 186 HD11 LEU 27 1HD1 LEU 27 5.272 2.275 -3.130 187 HD12 LEU 27 2HD1 LEU 27 4.898 2.399 -4.862 188 HD13 LEU 27 3HD1 LEU 27 3.853 3.189 -3.650 189 HD21 LEU 27 3HD2 LEU 27 7.514 3.211 -3.463 190 HD22 LEU 27 1HD2 LEU 27 7.769 4.770 -4.197 191 HD23 LEU 27 2HD2 LEU 27 7.274 3.368 -5.213 192 H THR 28 H THR 28 6.656 6.887 -7.593 193 HA THR 28 HA THR 28 5.024 9.008 -8.377 194 HB THR 28 HB THR 28 5.930 7.454 -10.627 195 HG1 THR 28 1HG THR 28 8.057 7.108 -10.149 196 HG21 THR 28 3HG2 THR 28 7.682 9.325 -10.654 197 HG22 THR 28 1HG2 THR 28 7.057 9.848 -9.093 198 HG23 THR 28 2HG2 THR 28 6.004 9.893 -10.521 199 H SER 29 H SER 29 3.208 9.072 -9.760 200 HA SER 29 HA SER 29 1.122 7.266 -9.310 201 HB2 SER 29 1HB SER 29 1.267 9.147 -11.689 202 HB3 SER 29 2HB SER 29 -0.137 8.702 -10.712 203 HG SER 29 HG SER 29 0.534 10.764 -10.274 204 H SER 30 H SER 30 3.688 6.463 -11.098 205 HA SER 30 HA SER 30 2.291 4.548 -12.776 206 HB2 SER 30 1HB SER 30 2.659 6.831 -13.992 207 HB3 SER 30 2HB SER 30 4.366 6.397 -13.948 208 HG SER 30 HG SER 30 3.694 5.728 -15.829 209 H GLN 31 H GLN 31 4.321 4.873 -10.347 210 HA GLN 31 HA GLN 31 6.876 3.900 -11.113 211 HB2 GLN 31 1HB GLN 31 6.057 4.902 -8.853 212 HB3 GLN 31 2HB GLN 31 5.391 3.295 -8.513 213 HG2 GLN 31 1HG GLN 31 7.306 2.927 -7.528 214 HG3 GLN 31 2HG GLN 31 7.894 2.611 -9.154 215 HE21 GLN 31 1HE2 GLN 31 8.016 4.776 -6.385 216 HE22 GLN 31 2HE2 GLN 31 9.439 5.622 -6.896 217 H THR 32 H THR 32 7.610 1.710 -11.439 218 HA THR 32 HA THR 32 5.496 -0.414 -11.245 219 HB THR 32 HB THR 32 6.448 -1.595 -12.984 220 HG1 THR 32 1HG THR 32 8.555 0.321 -13.263 221 HG21 THR 32 3HG2 THR 32 6.423 1.283 -13.979 222 HG22 THR 32 1HG2 THR 32 4.997 0.251 -13.725 223 HG23 THR 32 2HG2 THR 32 6.194 -0.197 -14.935 224 H LYS 33 H LYS 33 8.282 0.748 -9.728 225 HA LYS 33 HA LYS 33 8.862 -1.861 -8.531 226 HB2 LYS 33 1HB LYS 33 10.395 -0.809 -10.676 227 HB3 LYS 33 2HB LYS 33 11.281 -0.243 -9.262 228 HG2 LYS 33 1HG LYS 33 12.143 -2.328 -8.958 229 HG3 LYS 33 2HG LYS 33 10.555 -2.929 -8.708 230 HD2 LYS 33 1HD LYS 33 11.632 -4.168 -10.553 231 HD3 LYS 33 2HD LYS 33 10.322 -3.175 -11.229 232 HE2 LYS 33 1HE LYS 33 12.137 -1.367 -11.615 233 HE3 LYS 33 2HE LYS 33 13.327 -2.603 -11.222 234 HZ1 LYS 33 3HZ LYS 33 12.920 -2.329 -13.567 235 HZ2 LYS 33 1HZ LYS 33 11.353 -2.780 -13.441 236 HZ3 LYS 33 2HZ LYS 33 12.590 -3.853 -13.103 237 H ALA 34 H ALA 34 10.229 -1.591 -6.607 238 HA ALA 34 HA ALA 34 9.353 0.546 -5.027 239 HB1 ALA 34 1HB ALA 34 9.854 -1.652 -4.144 240 HB2 ALA 34 2HB ALA 34 11.563 -1.522 -4.622 241 HB3 ALA 34 3HB ALA 34 10.907 -0.498 -3.332 242 HA PRO 35 HA PRO 35 12.805 3.511 -5.372 243 HB2 PRO 35 1HB PRO 35 13.100 4.177 -2.712 244 HB3 PRO 35 2HB PRO 35 11.780 4.838 -3.742 245 HG2 PRO 35 1HG PRO 35 11.666 2.448 -1.854 246 HG3 PRO 35 2HG PRO 35 10.466 3.754 -2.024 247 HD2 PRO 35 1HD PRO 35 9.985 1.495 -3.194 248 HD3 PRO 35 2HD PRO 35 9.682 2.994 -4.086 249 H ASN 36 H ASN 36 12.745 0.674 -3.100 250 HA ASN 36 HA ASN 36 15.650 0.534 -3.096 251 HB2 ASN 36 1HB ASN 36 14.222 2.023 -1.084 252 HB3 ASN 36 2HB ASN 36 14.653 0.492 -0.369 253 HD21 ASN 36 1HD2 ASN 36 15.809 3.555 -1.324 254 HD22 ASN 36 2HD2 ASN 36 17.488 3.283 -1.091 255 H VAL 37 H VAL 37 16.312 -1.385 -2.005 256 HA VAL 37 HA VAL 37 14.416 -3.539 -1.738 257 HB VAL 37 HB VAL 37 16.377 -4.308 -2.337 258 HG11 VAL 37 1HG1 VAL 37 17.828 -2.653 -2.159 259 HG12 VAL 37 2HG1 VAL 37 17.808 -2.687 -0.339 260 HG13 VAL 37 3HG1 VAL 37 18.479 -4.059 -1.310 261 HG21 VAL 37 3HG2 VAL 37 17.149 -5.790 -0.630 262 HG22 VAL 37 1HG2 VAL 37 16.553 -4.636 0.652 263 HG23 VAL 37 2HG2 VAL 37 15.450 -5.548 -0.352 264 H LEU 38 H LEU 38 12.918 -3.398 -0.361 265 HA LEU 38 HA LEU 38 12.884 -1.954 2.117 266 HB2 LEU 38 1HB LEU 38 11.046 -4.135 1.087 267 HB3 LEU 38 2HB LEU 38 10.701 -2.988 2.382 268 HG LEU 38 HG LEU 38 11.080 -2.328 -0.571 269 HD11 LEU 38 1HD1 LEU 38 8.963 -3.434 -0.017 270 HD12 LEU 38 2HD1 LEU 38 8.738 -1.776 -0.563 271 HD13 LEU 38 3HD1 LEU 38 8.619 -2.157 1.184 272 HD21 LEU 38 3HD2 LEU 38 10.245 -0.019 0.135 273 HD22 LEU 38 1HD2 LEU 38 11.901 -0.424 0.561 274 HD23 LEU 38 2HD2 LEU 38 10.638 -0.500 1.817 275 H LYS 39 H LYS 39 14.387 -2.582 3.651 276 HA LYS 39 HA LYS 39 15.011 -5.456 4.065 277 HB2 LYS 39 1HB LYS 39 15.993 -3.123 5.726 278 HB3 LYS 39 2HB LYS 39 16.647 -4.747 5.655 279 HG2 LYS 39 1HG LYS 39 18.122 -3.955 4.207 280 HG3 LYS 39 2HG LYS 39 16.827 -3.915 2.999 281 HD2 LYS 39 1HD LYS 39 16.333 -1.559 3.949 282 HD3 LYS 39 2HD LYS 39 17.888 -1.644 4.732 283 HE2 LYS 39 1HE LYS 39 17.345 -1.951 1.746 284 HE3 LYS 39 2HE LYS 39 17.890 -0.475 2.523 285 HZ1 LYS 39 3HZ LYS 39 19.918 -1.618 3.135 286 HZ2 LYS 39 1HZ LYS 39 19.659 -1.616 1.512 287 HZ3 LYS 39 2HZ LYS 39 19.433 -3.007 2.384 288 H GLY 40 H GLY 40 14.902 -6.361 6.351 289 HA2 GLY 40 1HA GLY 40 14.279 -6.311 8.586 290 HA3 GLY 40 2HA GLY 40 13.398 -4.820 8.329 291 H ASN 41 H ASN 41 12.255 -7.004 6.113 292 HA ASN 41 HA ASN 41 10.835 -8.760 5.921 293 HB2 ASN 41 1HB ASN 41 11.965 -9.587 8.049 294 HB3 ASN 41 2HB ASN 41 10.510 -9.074 8.877 295 HD21 ASN 41 1HD2 ASN 41 8.499 -9.876 6.922 296 HD22 ASN 41 2HD2 ASN 41 8.552 -11.637 6.836 297 H LYS 42 H LYS 42 10.038 -6.128 7.956 298 HA LYS 42 HA LYS 42 7.105 -6.672 7.830 299 HB2 LYS 42 1HB LYS 42 8.707 -4.572 9.306 300 HB3 LYS 42 2HB LYS 42 6.948 -4.669 9.368 301 HG2 LYS 42 1HG LYS 42 8.732 -7.001 10.194 302 HG3 LYS 42 2HG LYS 42 8.205 -5.739 11.327 303 HD2 LYS 42 1HD LYS 42 5.888 -6.277 10.995 304 HD3 LYS 42 2HD LYS 42 6.247 -7.396 9.674 305 HE2 LYS 42 1HE LYS 42 7.394 -8.930 11.155 306 HE3 LYS 42 2HE LYS 42 7.303 -7.762 12.484 307 HZ1 LYS 42 3HZ LYS 42 5.006 -8.033 12.625 308 HZ2 LYS 42 1HZ LYS 42 5.615 -9.552 12.581 309 HZ3 LYS 42 2HZ LYS 42 4.876 -8.915 11.245 310 H LEU 43 H LEU 43 6.149 -6.070 6.018 311 HA LEU 43 HA LEU 43 7.181 -3.790 4.426 312 HB2 LEU 43 1HB LEU 43 5.799 -6.144 3.730 313 HB3 LEU 43 2HB LEU 43 4.521 -4.870 3.658 314 HG LEU 43 HG LEU 43 5.389 -5.190 1.567 315 HD11 LEU 43 1HD1 LEU 43 6.183 -3.042 0.904 316 HD12 LEU 43 2HD1 LEU 43 6.611 -2.613 2.568 317 HD13 LEU 43 3HD1 LEU 43 4.889 -2.848 2.125 318 HD21 LEU 43 3HD2 LEU 43 8.190 -4.462 2.425 319 HD22 LEU 43 1HD2 LEU 43 7.632 -5.056 0.823 320 HD23 LEU 43 2HD2 LEU 43 7.597 -6.132 2.216 321 H TYR 44 H TYR 44 6.414 -1.789 4.707 322 HA TYR 44 HA TYR 44 3.719 -1.409 5.918 323 HB2 TYR 44 1HB TYR 44 6.049 0.523 6.131 324 HB3 TYR 44 2HB TYR 44 4.494 0.652 6.873 325 HD1 TYR 44 1HD TYR 44 4.022 -2.051 8.044 326 HD2 TYR 44 2HD TYR 44 7.631 0.269 7.817 327 HE1 TYR 44 1HE TYR 44 4.772 -3.019 10.202 328 HE2 TYR 44 2HE TYR 44 8.376 -0.662 10.013 329 HH TYR 44 HH TYR 44 6.252 -2.686 12.040 330 H VAL 45 H VAL 45 2.394 -0.030 4.730 331 HA VAL 45 HA VAL 45 3.310 1.232 2.140 332 HB VAL 45 HB VAL 45 2.655 -1.411 2.081 333 HG11 VAL 45 1HG1 VAL 45 0.774 -1.825 1.347 334 HG12 VAL 45 2HG1 VAL 45 0.740 -1.112 3.025 335 HG13 VAL 45 3HG1 VAL 45 0.196 -0.121 1.605 336 HG21 VAL 45 3HG2 VAL 45 1.762 0.762 0.142 337 HG22 VAL 45 1HG2 VAL 45 3.422 0.197 0.180 338 HG23 VAL 45 2HG2 VAL 45 2.142 -0.939 -0.301 339 H LYS 46 H LYS 46 1.820 2.757 1.463 340 HA LYS 46 HA LYS 46 -0.211 3.518 3.482 341 HB2 LYS 46 1HB LYS 46 2.159 4.739 3.472 342 HB3 LYS 46 2HB LYS 46 1.525 5.597 2.109 343 HG2 LYS 46 1HG LYS 46 -0.310 6.448 3.503 344 HG3 LYS 46 2HG LYS 46 0.108 5.308 4.797 345 HD2 LYS 46 1HD LYS 46 0.994 7.390 5.496 346 HD3 LYS 46 2HD LYS 46 2.378 6.442 4.949 347 HE2 LYS 46 1HE LYS 46 2.893 8.098 3.602 348 HE3 LYS 46 2HE LYS 46 1.489 7.732 2.624 349 HZ1 LYS 46 3HZ LYS 46 1.312 10.046 3.310 350 HZ2 LYS 46 1HZ LYS 46 1.436 9.648 4.893 351 HZ3 LYS 46 2HZ LYS 46 0.133 9.166 4.057 352 H ALA 47 H ALA 47 -1.812 2.675 2.119 353 HA ALA 47 HA ALA 47 -1.782 3.292 -0.766 354 HB1 ALA 47 1HB ALA 47 -3.523 1.497 0.910 355 HB2 ALA 47 2HB ALA 47 -3.469 1.521 -0.872 356 HB3 ALA 47 3HB ALA 47 -2.058 1.007 0.029 357 H ARG 48 H ARG 48 -3.014 4.868 -1.728 358 HA ARG 48 HA ARG 48 -4.637 6.600 -0.003 359 HB2 ARG 48 1HB ARG 48 -3.033 7.568 -1.457 360 HB3 ARG 48 2HB ARG 48 -3.616 6.705 -2.880 361 HG2 ARG 48 1HG ARG 48 -5.110 8.326 -3.371 362 HG3 ARG 48 2HG ARG 48 -5.817 8.265 -1.759 363 HD2 ARG 48 1HD ARG 48 -5.012 10.451 -1.836 364 HD3 ARG 48 2HD ARG 48 -3.779 9.505 -0.963 365 HE ARG 48 HE ARG 48 -2.271 9.950 -2.636 366 HH11 ARG 48 1HH1 ARG 48 -5.466 11.064 -3.720 367 HH12 ARG 48 2HH1 ARG 48 -4.858 11.982 -5.024 368 HH21 ARG 48 1HH2 ARG 48 -1.488 10.921 -4.626 369 HH22 ARG 48 2HH2 ARG 48 -2.643 11.579 -5.738 370 H PHE 49 H PHE 49 -6.608 5.760 0.358 371 HA PHE 49 HA PHE 49 -8.092 4.468 -1.932 372 HB2 PHE 49 1HB PHE 49 -8.772 4.322 0.970 373 HB3 PHE 49 2HB PHE 49 -9.771 3.733 -0.329 374 HD1 PHE 49 1HD PHE 49 -8.961 1.661 -1.818 375 HD2 PHE 49 2HD PHE 49 -6.671 3.204 1.537 376 HE1 PHE 49 1HE PHE 49 -7.942 -0.501 -1.496 377 HE2 PHE 49 2HE PHE 49 -5.425 1.062 1.610 378 HZ PHE 49 HZ PHE 49 -6.124 -0.825 0.156 379 H MET 50 H MET 50 -8.857 6.005 -3.232 380 HA MET 50 HA MET 50 -10.027 8.432 -2.063 381 HB2 MET 50 1HB MET 50 -9.893 7.809 -5.010 382 HB3 MET 50 2HB MET 50 -10.101 9.356 -4.217 383 HG2 MET 50 1HG MET 50 -7.571 7.861 -3.743 384 HG3 MET 50 2HG MET 50 -7.843 8.605 -5.321 385 HE1 MET 50 3HE MET 50 -7.448 10.835 -1.330 386 HE2 MET 50 1HE MET 50 -9.065 10.362 -1.908 387 HE3 MET 50 2HE MET 50 -7.848 9.113 -1.579 388 H GLY 51 H GLY 51 -11.840 7.717 -1.148 389 HA2 GLY 51 1HA GLY 51 -14.313 7.607 -1.611 390 HA3 GLY 51 2HA GLY 51 -13.968 6.410 -2.839 391 H TYR 52 H TYR 52 -15.736 5.863 -0.816 392 HA TYR 52 HA TYR 52 -14.483 4.796 1.562 393 HB2 TYR 52 1HB TYR 52 -16.932 5.905 0.899 394 HB3 TYR 52 2HB TYR 52 -17.350 4.227 1.047 395 HD1 TYR 52 2HD TYR 52 -16.101 3.105 3.339 396 HD2 TYR 52 1HD TYR 52 -17.330 7.172 2.698 397 HE1 TYR 52 2HE TYR 52 -16.553 3.365 5.778 398 HE2 TYR 52 1HE TYR 52 -17.917 7.394 5.088 399 HH TYR 52 HH TYR 52 -16.828 5.612 7.496 400 H THR 53 H THR 53 -13.533 2.876 1.528 401 HA THR 53 HA THR 53 -14.836 0.422 0.853 402 HB THR 53 HB THR 53 -12.730 1.539 -0.999 403 HG1 THR 53 1HG THR 53 -15.102 1.587 -1.295 404 HG21 THR 53 3HG2 THR 53 -12.657 -0.745 -2.099 405 HG22 THR 53 1HG2 THR 53 -13.287 -1.392 -0.561 406 HG23 THR 53 2HG2 THR 53 -11.729 -0.555 -0.583 407 H LYS 54 H LYS 54 -14.204 -0.676 2.587 408 HA LYS 54 HA LYS 54 -11.342 -0.508 3.441 409 HB2 LYS 54 1HB LYS 54 -13.916 -0.943 4.998 410 HB3 LYS 54 2HB LYS 54 -12.310 -1.243 5.686 411 HG2 LYS 54 1HG LYS 54 -11.975 0.941 6.112 412 HG3 LYS 54 2HG LYS 54 -12.353 1.397 4.466 413 HD2 LYS 54 1HD LYS 54 -13.816 2.570 5.934 414 HD3 LYS 54 2HD LYS 54 -14.784 1.444 5.001 415 HE2 LYS 54 1HE LYS 54 -13.773 0.360 7.583 416 HE3 LYS 54 2HE LYS 54 -14.769 1.803 7.780 417 HZ1 LYS 54 3HZ LYS 54 -15.690 -0.661 6.401 418 HZ2 LYS 54 1HZ LYS 54 -16.546 0.718 6.607 419 HZ3 LYS 54 2HZ LYS 54 -16.081 -0.149 7.908 420 H LEU 55 H LEU 55 -13.552 -2.598 1.909 421 HA LEU 55 HA LEU 55 -12.752 -5.055 3.179 422 HB2 LEU 55 1HB LEU 55 -14.400 -4.486 0.698 423 HB3 LEU 55 2HB LEU 55 -14.139 -6.081 1.389 424 HG LEU 55 HG LEU 55 -15.333 -5.400 3.453 425 HD11 LEU 55 1HD1 LEU 55 -16.925 -3.424 3.170 426 HD12 LEU 55 2HD1 LEU 55 -15.918 -2.885 1.824 427 HD13 LEU 55 3HD1 LEU 55 -15.245 -3.003 3.481 428 HD21 LEU 55 3HD2 LEU 55 -16.800 -5.185 0.776 429 HD22 LEU 55 1HD2 LEU 55 -17.580 -5.542 2.325 430 HD23 LEU 55 2HD2 LEU 55 -16.407 -6.680 1.659 431 H THR 56 H THR 56 -10.375 -3.849 2.294 432 HA THR 56 HA THR 56 -9.574 -4.252 -0.338 433 HB THR 56 HB THR 56 -7.845 -4.306 2.192 434 HG1 THR 56 1HG THR 56 -8.543 -2.443 2.647 435 HG21 THR 56 3HG2 THR 56 -6.269 -3.001 0.850 436 HG22 THR 56 1HG2 THR 56 -7.368 -3.074 -0.552 437 HG23 THR 56 2HG2 THR 56 -6.593 -4.546 0.088 438 H VAL 57 H VAL 57 -8.154 -5.820 -1.365 439 HA VAL 57 HA VAL 57 -7.880 -8.410 0.044 440 HB VAL 57 HB VAL 57 -8.570 -8.110 -2.887 441 HG11 VAL 57 1HG1 VAL 57 -8.735 -10.496 -0.965 442 HG12 VAL 57 2HG1 VAL 57 -9.206 -10.489 -2.669 443 HG13 VAL 57 3HG1 VAL 57 -7.516 -10.260 -2.226 444 HG21 VAL 57 3HG2 VAL 57 -10.891 -8.856 -2.238 445 HG22 VAL 57 1HG2 VAL 57 -10.475 -8.525 -0.545 446 HG23 VAL 57 2HG2 VAL 57 -10.513 -7.212 -1.737 447 H ILE 58 H ILE 58 -6.050 -9.557 -0.325 448 HA ILE 58 HA ILE 58 -3.932 -8.718 -2.154 449 HB ILE 58 HB ILE 58 -3.530 -9.170 0.846 450 HG12 ILE 58 1HG1 ILE 58 -3.210 -6.554 -0.696 451 HG13 ILE 58 2HG1 ILE 58 -4.443 -6.915 0.513 452 HG21 ILE 58 1HG2 ILE 58 -1.711 -10.033 -0.601 453 HG22 ILE 58 2HG2 ILE 58 -1.500 -8.411 -1.300 454 HG23 ILE 58 3HG2 ILE 58 -1.152 -8.718 0.409 455 HD11 ILE 58 3HD1 ILE 58 -2.541 -7.298 2.199 456 HD12 ILE 58 1HD1 ILE 58 -1.473 -6.554 0.994 457 HD13 ILE 58 2HD1 ILE 58 -2.825 -5.626 1.654 458 H THR 59 H THR 59 -3.675 -10.759 -3.281 459 HA THR 59 HA THR 59 -5.089 -12.986 -2.384 460 HB THR 59 HB THR 59 -2.967 -12.860 -4.545 461 HG1 THR 59 1HG THR 59 -4.278 -11.851 -5.839 462 HG21 THR 59 3HG2 THR 59 -5.613 -14.369 -4.359 463 HG22 THR 59 1HG2 THR 59 -3.957 -15.037 -4.384 464 HG23 THR 59 2HG2 THR 59 -4.609 -14.261 -5.827 465 H GLY 60 H GLY 60 -1.674 -12.109 -2.183 466 HA2 GLY 60 1HA GLY 60 0.205 -13.166 -1.356 467 HA3 GLY 60 2HA GLY 60 -0.910 -14.145 -0.386 468 H LYS 61 H LYS 61 1.126 -15.426 -0.893 469 HA LYS 61 HA LYS 61 1.034 -17.010 -3.331 470 HB2 LYS 61 1HB LYS 61 2.524 -18.471 -2.136 471 HB3 LYS 61 2HB LYS 61 3.030 -16.770 -2.022 472 HG2 LYS 61 1HG LYS 61 2.166 -16.714 0.300 473 HG3 LYS 61 2HG LYS 61 1.636 -18.369 0.162 474 HD2 LYS 61 1HD LYS 61 3.705 -18.107 1.423 475 HD3 LYS 61 2HD LYS 61 3.848 -19.208 0.081 476 HE2 LYS 61 1HE LYS 61 4.830 -16.343 -0.194 477 HE3 LYS 61 2HE LYS 61 5.763 -17.530 0.710 478 HZ1 LYS 61 3HZ LYS 61 5.089 -17.731 -2.155 479 HZ2 LYS 61 1HZ LYS 61 5.803 -18.920 -1.293 480 HZ3 LYS 61 2HZ LYS 61 6.549 -17.474 -1.506 481 H ASP 62 H ASP 62 -0.764 -16.963 -0.332 482 HA ASP 62 HA ASP 62 -1.550 -19.719 -0.500 483 HB2 ASP 62 1HB ASP 62 -2.056 -17.401 1.324 484 HB3 ASP 62 2HB ASP 62 -3.269 -18.671 1.331 485 H GLY 63 H GLY 63 -2.691 -17.103 -2.290 486 HA2 GLY 63 1HA GLY 63 -4.601 -16.937 -3.634 487 HA3 GLY 63 2HA GLY 63 -5.037 -18.572 -3.176 488 H LYS 64 H LYS 64 -4.494 -16.575 -0.408 489 HA LYS 64 HA LYS 64 -7.418 -16.354 0.092 490 HB2 LYS 64 1HB LYS 64 -5.043 -16.708 1.984 491 HB3 LYS 64 2HB LYS 64 -6.725 -16.541 2.495 492 HG2 LYS 64 1HG LYS 64 -5.598 -18.833 0.821 493 HG3 LYS 64 2HG LYS 64 -5.924 -18.835 2.532 494 HD2 LYS 64 1HD LYS 64 -8.377 -18.253 1.865 495 HD3 LYS 64 2HD LYS 64 -7.884 -18.654 0.225 496 HE2 LYS 64 1HE LYS 64 -8.931 -20.577 1.072 497 HE3 LYS 64 2HE LYS 64 -7.201 -20.954 1.043 498 HZ1 LYS 64 3HZ LYS 64 -8.607 -19.981 3.454 499 HZ2 LYS 64 1HZ LYS 64 -7.131 -20.755 3.386 500 HZ3 LYS 64 2HZ LYS 64 -8.559 -21.554 3.085 501 H ASN 65 H ASN 65 -8.024 -14.537 1.452 502 HA ASN 65 HA ASN 65 -6.706 -12.052 0.678 503 HB2 ASN 65 1HB ASN 65 -9.239 -12.493 1.273 504 HB3 ASN 65 2HB ASN 65 -8.734 -12.413 2.971 505 HD21 ASN 65 1HD2 ASN 65 -7.235 -10.209 3.301 506 HD22 ASN 65 2HD2 ASN 65 -8.092 -8.835 2.574 507 H LEU 66 H LEU 66 -4.569 -12.035 1.443 508 HA LEU 66 HA LEU 66 -3.669 -13.135 3.791 509 HB2 LEU 66 1HB LEU 66 -2.623 -10.570 2.529 510 HB3 LEU 66 2HB LEU 66 -1.792 -11.517 3.745 511 HG LEU 66 HG LEU 66 -2.482 -12.393 0.928 512 HD11 LEU 66 1HD1 LEU 66 0.155 -11.917 2.458 513 HD12 LEU 66 2HD1 LEU 66 -0.536 -10.826 1.241 514 HD13 LEU 66 3HD1 LEU 66 0.058 -12.426 0.779 515 HD21 LEU 66 3HD2 LEU 66 -0.987 -14.440 1.684 516 HD22 LEU 66 1HD2 LEU 66 -2.679 -14.410 2.190 517 HD23 LEU 66 2HD2 LEU 66 -1.379 -13.925 3.314 518 H LEU 67 H LEU 67 -5.073 -9.884 3.466 519 HA LEU 67 HA LEU 67 -4.525 -8.963 6.036 520 HB2 LEU 67 1HB LEU 67 -6.912 -8.302 4.296 521 HB3 LEU 67 2HB LEU 67 -6.368 -7.386 5.660 522 HG LEU 67 HG LEU 67 -4.587 -7.823 3.242 523 HD11 LEU 67 1HD1 LEU 67 -6.596 -6.753 2.422 524 HD12 LEU 67 2HD1 LEU 67 -5.298 -5.551 2.510 525 HD13 LEU 67 3HD1 LEU 67 -6.573 -5.579 3.753 526 HD21 LEU 67 3HD2 LEU 67 -3.491 -7.054 5.333 527 HD22 LEU 67 1HD2 LEU 67 -4.640 -5.703 5.428 528 HD23 LEU 67 2HD2 LEU 67 -3.467 -5.800 4.091 529 H TYR 68 H TYR 68 -6.667 -11.557 5.151 530 HA TYR 68 HA TYR 68 -7.833 -11.600 7.848 531 HB2 TYR 68 1HB TYR 68 -9.328 -11.027 5.739 532 HB3 TYR 68 2HB TYR 68 -9.191 -12.732 5.377 533 HD1 TYR 68 2HD TYR 68 -9.982 -10.302 8.117 534 HD2 TYR 68 1HD TYR 68 -10.776 -14.232 6.524 535 HE1 TYR 68 2HE TYR 68 -11.748 -10.614 9.798 536 HE2 TYR 68 1HE TYR 68 -12.576 -14.545 8.201 537 HH TYR 68 HH TYR 68 -13.430 -11.966 10.566 538 H ASN 69 H ASN 69 -5.359 -12.827 6.346 539 HA ASN 69 HA ASN 69 -5.923 -15.716 6.638 540 HB2 ASN 69 1HB ASN 69 -4.617 -14.956 4.674 541 HB3 ASN 69 2HB ASN 69 -3.357 -14.337 5.766 542 HD21 ASN 69 1HD2 ASN 69 -5.295 -17.464 5.525 543 HD22 ASN 69 2HD2 ASN 69 -3.841 -18.440 5.482 544 H GLY 70 H GLY 70 -3.401 -13.395 7.782 545 HA2 GLY 70 1HA GLY 70 -3.935 -13.615 10.470 546 HA3 GLY 70 2HA GLY 70 -2.855 -14.975 10.159 547 H THR 71 H THR 71 -1.494 -13.096 7.977 548 HA THR 71 HA THR 71 0.260 -11.849 10.020 549 HB THR 71 HB THR 71 0.909 -12.488 7.143 550 HG1 THR 71 1HG THR 71 0.819 -14.182 9.390 551 HG21 THR 71 3HG2 THR 71 2.571 -11.111 8.234 552 HG22 THR 71 1HG2 THR 71 3.195 -12.776 8.162 553 HG23 THR 71 2HG2 THR 71 2.555 -12.138 9.686 554 H ALA 72 H ALA 72 -1.029 -11.058 6.680 555 HA ALA 72 HA ALA 72 -0.213 -8.258 7.085 556 HB1 ALA 72 1HB ALA 72 -1.278 -7.865 4.941 557 HB2 ALA 72 2HB ALA 72 -0.360 -9.369 4.756 558 HB3 ALA 72 3HB ALA 72 -2.115 -9.427 4.994 559 H LYS 73 H LYS 73 -1.559 -6.678 7.694 560 HA LYS 73 HA LYS 73 -4.420 -6.949 7.888 561 HB2 LYS 73 1HB LYS 73 -3.945 -8.211 9.866 562 HB3 LYS 73 2HB LYS 73 -2.601 -7.179 10.307 563 HG2 LYS 73 1HG LYS 73 -4.372 -6.816 11.834 564 HG3 LYS 73 2HG LYS 73 -4.108 -5.388 10.853 565 HD2 LYS 73 1HD LYS 73 -6.524 -5.734 11.144 566 HD3 LYS 73 2HD LYS 73 -6.131 -6.028 9.468 567 HE2 LYS 73 1HE LYS 73 -7.706 -7.694 10.202 568 HE3 LYS 73 2HE LYS 73 -6.167 -8.481 9.852 569 HZ1 LYS 73 3HZ LYS 73 -5.752 -8.663 12.181 570 HZ2 LYS 73 1HZ LYS 73 -7.247 -9.250 11.887 571 HZ3 LYS 73 2HZ LYS 73 -7.098 -7.795 12.593 572 H MET 74 H MET 74 -5.307 -4.751 8.225 573 HA MET 74 HA MET 74 -3.420 -2.576 7.894 574 HB2 MET 74 1HB MET 74 -5.356 -1.250 7.642 575 HB3 MET 74 2HB MET 74 -5.610 -2.727 6.688 576 HG2 MET 74 1HG MET 74 -6.850 -3.632 8.795 577 HG3 MET 74 2HG MET 74 -6.735 -1.957 9.354 578 HE1 MET 74 3HE MET 74 -7.442 -0.013 7.743 579 HE2 MET 74 1HE MET 74 -7.076 -0.803 6.190 580 HE3 MET 74 2HE MET 74 -8.707 -0.137 6.470 581 H PHE 75 H PHE 75 -2.711 -1.286 9.542 582 HA PHE 75 HA PHE 75 -3.866 -1.739 12.260 583 HB2 PHE 75 1HB PHE 75 -1.694 -1.923 13.194 584 HB3 PHE 75 2HB PHE 75 -1.830 -3.094 11.905 585 HD1 PHE 75 2HD PHE 75 -0.777 -2.462 9.579 586 HD2 PHE 75 1HD PHE 75 0.138 -0.407 13.270 587 HE1 PHE 75 2HE PHE 75 1.379 -1.654 8.627 588 HE2 PHE 75 1HE PHE 75 2.276 0.377 12.282 589 HZ PHE 75 HZ PHE 75 2.897 -0.281 9.984 590 H LYS 76 H LYS 76 -3.699 0.532 9.985 591 HA LYS 76 HA LYS 76 -3.785 2.658 11.883 592 HB2 LYS 76 1HB LYS 76 -1.298 2.418 11.566 593 HB3 LYS 76 2HB LYS 76 -1.501 2.859 9.879 594 HG2 LYS 76 1HG LYS 76 -2.374 5.075 10.547 595 HG3 LYS 76 2HG LYS 76 -2.349 4.574 12.240 596 HD2 LYS 76 1HD LYS 76 0.218 4.145 11.847 597 HD3 LYS 76 2HD LYS 76 -0.010 5.085 10.366 598 HE2 LYS 76 1HE LYS 76 0.684 6.678 11.962 599 HE3 LYS 76 2HE LYS 76 -1.066 6.908 11.866 600 HZ1 LYS 76 3HZ LYS 76 -0.416 6.860 14.147 601 HZ2 LYS 76 1HZ LYS 76 0.473 5.510 13.973 602 HZ3 LYS 76 2HZ LYS 76 -1.156 5.402 13.876 603 H SER 77 H SER 77 -4.694 4.577 10.877 604 HA SER 77 HA SER 77 -5.650 4.403 8.132 605 HB2 SER 77 1HB SER 77 -8.053 4.410 9.014 606 HB3 SER 77 2HB SER 77 -7.192 2.892 8.893 607 HG SER 77 HG SER 77 -8.343 3.303 10.917 608 H ASP 78 H ASP 78 -5.019 6.497 7.694 609 HA ASP 78 HA ASP 78 -5.793 8.669 9.644 610 HB2 ASP 78 1HB ASP 78 -3.261 8.208 8.821 611 HB3 ASP 78 2HB ASP 78 -3.783 9.238 7.489 612 H ALA 79 H ALA 79 -5.825 10.846 7.976 613 HA ALA 79 HA ALA 79 -7.957 10.178 5.982 614 HB1 ALA 79 1HB ALA 79 -9.089 12.250 6.625 615 HB2 ALA 79 2HB ALA 79 -8.920 11.173 8.026 616 HB3 ALA 79 3HB ALA 79 -7.845 12.569 7.858 617 H ILE 80 H ILE 80 -8.109 11.648 4.170 618 HA ILE 80 HA ILE 80 -5.559 13.046 3.541 619 HB ILE 80 HB ILE 80 -7.320 11.491 1.608 620 HG12 ILE 80 1HG1 ILE 80 -4.642 10.605 2.774 621 HG13 ILE 80 2HG1 ILE 80 -6.197 9.951 3.281 622 HG21 ILE 80 1HG2 ILE 80 -4.471 12.536 1.256 623 HG22 ILE 80 2HG2 ILE 80 -5.552 11.898 0.005 624 HG23 ILE 80 3HG2 ILE 80 -5.901 13.442 0.757 625 HD11 ILE 80 3HD1 ILE 80 -5.092 9.794 0.493 626 HD12 ILE 80 1HD1 ILE 80 -5.152 8.468 1.642 627 HD13 ILE 80 2HD1 ILE 80 -6.655 9.151 0.985 628 H LEU 81 H LEU 81 -5.971 15.148 3.360 629 HA LEU 81 HA LEU 81 -8.770 15.987 2.931 630 HB2 LEU 81 1HB LEU 81 -6.475 17.599 4.021 631 HB3 LEU 81 2HB LEU 81 -8.162 18.059 3.962 632 HG LEU 81 HG LEU 81 -6.872 15.903 5.687 633 HD11 LEU 81 1HD1 LEU 81 -8.617 18.263 6.523 634 HD12 LEU 81 2HD1 LEU 81 -6.850 18.312 6.436 635 HD13 LEU 81 3HD1 LEU 81 -7.652 17.197 7.549 636 HD21 LEU 81 3HD2 LEU 81 -9.017 14.928 4.953 637 HD22 LEU 81 1HD2 LEU 81 -9.871 16.405 5.415 638 HD23 LEU 81 2HD2 LEU 81 -9.079 15.385 6.647 639 H GLY 82 H GLY 82 -9.344 16.911 1.106 640 HA2 GLY 82 1HA GLY 82 -7.409 17.491 -1.049 641 HA3 GLY 82 2HA GLY 82 -9.166 17.437 -1.182 642 H GLN 83 H GLN 83 -6.740 19.245 0.697 643 HA GLN 83 HA GLN 83 -6.307 21.377 1.054 644 HB2 GLN 83 1HB GLN 83 -6.866 21.450 -1.571 645 HB3 GLN 83 2HB GLN 83 -8.234 22.401 -1.024 646 HG2 GLN 83 1HG GLN 83 -6.589 23.976 -1.494 647 HG3 GLN 83 2HG GLN 83 -6.536 23.828 0.268 648 HE21 GLN 83 1HE2 GLN 83 -4.911 22.839 -2.796 649 HE22 GLN 83 2HE2 GLN 83 -3.344 22.488 -2.059 650 H ASN 84 H ASN 84 -9.760 21.285 0.283 651 HA ASN 84 HA ASN 84 -10.467 23.332 2.192 652 HB2 ASN 84 1HB ASN 84 -12.355 21.451 0.692 653 HB3 ASN 84 2HB ASN 84 -12.729 23.014 1.388 654 HD21 ASN 84 1HD2 ASN 84 -11.050 21.396 -1.384 655 HD22 ASN 84 2HD2 ASN 84 -10.922 22.903 -2.254 656 H LYS 85 H LYS 85 -9.289 20.943 3.447 657 HA LYS 85 HA LYS 85 -9.614 19.208 4.856 658 HB2 LYS 85 1HB LYS 85 -11.910 20.836 5.948 659 HB3 LYS 85 2HB LYS 85 -11.077 19.498 6.736 660 HG2 LYS 85 1HG LYS 85 -8.905 20.818 6.464 661 HG3 LYS 85 2HG LYS 85 -9.900 22.213 5.978 662 HD2 LYS 85 1HD LYS 85 -11.049 22.182 8.146 663 HD3 LYS 85 2HD LYS 85 -10.284 20.630 8.562 664 HE2 LYS 85 1HE LYS 85 -8.032 21.949 8.239 665 HE3 LYS 85 2HE LYS 85 -9.053 23.381 8.458 666 HZ1 LYS 85 3HZ LYS 85 -9.829 22.293 10.545 667 HZ2 LYS 85 1HZ LYS 85 -8.235 22.687 10.575 668 HZ3 LYS 85 2HZ LYS 85 -8.702 21.121 10.330 669 H VAL 86 H VAL 86 -11.357 19.356 2.266 670 HA VAL 86 HA VAL 86 -13.559 17.631 2.730 671 HB VAL 86 HB VAL 86 -13.777 18.900 0.904 672 HG11 VAL 86 1HG1 VAL 86 -11.197 17.775 -0.062 673 HG12 VAL 86 2HG1 VAL 86 -12.243 18.886 -0.995 674 HG13 VAL 86 3HG1 VAL 86 -11.493 19.416 0.523 675 HG21 VAL 86 3HG2 VAL 86 -14.664 16.592 0.645 676 HG22 VAL 86 1HG2 VAL 86 -14.192 17.316 -0.903 677 HG23 VAL 86 2HG2 VAL 86 -13.136 16.109 -0.133 678 H VAL 87 H VAL 87 -13.500 15.418 3.225 679 HA VAL 87 HA VAL 87 -10.934 14.005 3.287 680 HB VAL 87 HB VAL 87 -13.745 13.062 3.899 681 HG11 VAL 87 1HG1 VAL 87 -11.008 11.841 4.511 682 HG12 VAL 87 2HG1 VAL 87 -12.582 11.267 5.102 683 HG13 VAL 87 3HG1 VAL 87 -12.217 11.188 3.376 684 HG21 VAL 87 3HG2 VAL 87 -13.030 13.287 6.273 685 HG22 VAL 87 1HG2 VAL 87 -11.501 14.017 5.741 686 HG23 VAL 87 2HG2 VAL 87 -13.046 14.847 5.452 687 H ILE 88 H ILE 88 -10.315 14.080 1.110 688 HA ILE 88 HA ILE 88 -12.033 13.092 -1.026 689 HB ILE 88 HB ILE 88 -9.935 12.976 -2.358 690 HG12 ILE 88 1HG1 ILE 88 -8.527 14.360 -0.038 691 HG13 ILE 88 2HG1 ILE 88 -8.329 12.641 -0.384 692 HG21 ILE 88 1HG2 ILE 88 -9.765 15.433 -2.520 693 HG22 ILE 88 2HG2 ILE 88 -11.418 14.924 -2.248 694 HG23 ILE 88 3HG2 ILE 88 -10.498 15.597 -0.897 695 HD11 ILE 88 3HD1 ILE 88 -7.609 14.948 -2.245 696 HD12 ILE 88 1HD1 ILE 88 -6.496 13.863 -1.418 697 HD13 ILE 88 2HD1 ILE 88 -7.544 13.232 -2.702 698 H GLY 89 H GLY 89 -9.945 11.594 1.387 699 HA2 GLY 89 1HA GLY 89 -11.012 9.027 1.004 700 HA3 GLY 89 2HA GLY 89 -9.478 9.143 0.118 701 H TRP 90 H TRP 90 -8.745 7.448 1.745 702 HA TRP 90 HA TRP 90 -7.850 8.754 4.248 703 HB2 TRP 90 1HB TRP 90 -9.264 6.133 3.927 704 HB3 TRP 90 2HB TRP 90 -8.478 6.653 5.414 705 HD1 TRP 90 HD TRP 90 -9.644 8.724 6.687 706 HE1 TRP 90 1HE TRP 90 -12.060 9.680 6.618 707 HE3 TRP 90 3HE TRP 90 -11.302 6.535 2.382 708 HZ2 TRP 90 2HZ TRP 90 -14.422 9.320 5.088 709 HZ3 TRP 90 3HZ TRP 90 -13.646 6.932 1.609 710 HH2 TRP 90 HH TRP 90 -15.203 8.278 2.974 711 H ASP 91 H ASP 91 -6.016 7.847 5.112 712 HA ASP 91 HA ASP 91 -4.253 6.345 3.282 713 HB2 ASP 91 1HB ASP 91 -3.967 7.928 5.839 714 HB3 ASP 91 2HB ASP 91 -2.824 6.646 5.537 715 H LYS 92 H LYS 92 -5.387 4.268 3.373 716 HA LYS 92 HA LYS 92 -5.518 3.008 6.111 717 HB2 LYS 92 1HB LYS 92 -6.497 1.946 3.451 718 HB3 LYS 92 2HB LYS 92 -6.287 0.946 4.869 719 HG2 LYS 92 1HG LYS 92 -8.583 1.476 4.689 720 HG3 LYS 92 2HG LYS 92 -7.965 2.313 6.109 721 HD2 LYS 92 1HD LYS 92 -8.089 4.425 5.054 722 HD3 LYS 92 2HD LYS 92 -8.133 3.716 3.439 723 HE2 LYS 92 1HE LYS 92 -10.299 4.248 3.529 724 HE3 LYS 92 2HE LYS 92 -10.435 2.658 4.244 725 HZ1 LYS 92 3HZ LYS 92 -10.331 5.230 5.748 726 HZ2 LYS 92 1HZ LYS 92 -10.587 3.766 6.425 727 HZ3 LYS 92 2HZ LYS 92 -11.685 4.425 5.390 728 H TYR 93 H TYR 93 -3.681 2.219 6.838 729 HA TYR 93 HA TYR 93 -1.390 1.687 5.091 730 HB2 TYR 93 1HB TYR 93 -1.812 1.652 8.104 731 HB3 TYR 93 2HB TYR 93 -0.272 1.424 7.352 732 HD1 TYR 93 2HD TYR 93 -3.037 3.996 7.570 733 HD2 TYR 93 1HD TYR 93 1.203 3.277 7.203 734 HE1 TYR 93 2HE TYR 93 -2.626 6.379 7.804 735 HE2 TYR 93 1HE TYR 93 1.623 5.697 7.405 736 HH TYR 93 HH TYR 93 -0.720 8.047 6.964 737 H PHE 94 H PHE 94 -0.180 -0.427 5.327 738 HA PHE 94 HA PHE 94 -1.718 -2.694 6.532 739 HB2 PHE 94 1HB PHE 94 -0.264 -2.695 3.836 740 HB3 PHE 94 2HB PHE 94 -1.087 -4.068 4.584 741 HD1 PHE 94 1HD PHE 94 -3.612 -3.657 5.323 742 HD2 PHE 94 2HD PHE 94 -1.512 -1.356 2.353 743 HE1 PHE 94 1HE PHE 94 -5.798 -2.919 4.374 744 HE2 PHE 94 2HE PHE 94 -3.711 -0.585 1.436 745 HZ PHE 94 HZ PHE 94 -5.851 -1.341 2.476 746 H GLU 95 H GLU 95 -0.479 -4.414 7.400 747 HA GLU 95 HA GLU 95 2.459 -4.042 7.526 748 HB2 GLU 95 1HB GLU 95 0.950 -4.100 9.561 749 HB3 GLU 95 2HB GLU 95 0.632 -5.773 9.263 750 HG2 GLU 95 1HG GLU 95 2.989 -6.326 9.587 751 HG3 GLU 95 2HG GLU 95 3.460 -4.640 9.521 752 H ILE 96 H ILE 96 2.590 -5.087 5.231 753 HA ILE 96 HA ILE 96 1.493 -7.796 5.054 754 HB ILE 96 HB ILE 96 3.322 -6.619 2.962 755 HG12 ILE 96 1HG1 ILE 96 0.882 -6.108 1.908 756 HG13 ILE 96 2HG1 ILE 96 0.459 -5.850 3.575 757 HG21 ILE 96 1HG2 ILE 96 2.701 -8.991 2.738 758 HG22 ILE 96 2HG2 ILE 96 0.983 -8.557 2.807 759 HG23 ILE 96 3HG2 ILE 96 2.005 -8.006 1.459 760 HD11 ILE 96 3HD1 ILE 96 2.202 -4.064 3.719 761 HD12 ILE 96 1HD1 ILE 96 2.716 -4.452 2.052 762 HD13 ILE 96 2HD1 ILE 96 1.104 -3.795 2.350 763 HA PRO 97 HA PRO 97 5.537 -9.716 6.243 764 HB2 PRO 97 1HB PRO 97 5.060 -12.230 5.212 765 HB3 PRO 97 2HB PRO 97 4.465 -11.673 6.811 766 HG2 PRO 97 1HG PRO 97 3.035 -11.694 4.122 767 HG3 PRO 97 2HG PRO 97 2.425 -12.340 5.675 768 HD2 PRO 97 1HD PRO 97 1.754 -9.913 4.740 769 HD3 PRO 97 2HD PRO 97 2.030 -10.100 6.475 770 H MET 98 H MET 98 7.322 -9.754 5.022 771 HA MET 98 HA MET 98 7.244 -9.562 2.131 772 HB2 MET 98 1HB MET 98 9.441 -9.937 4.187 773 HB3 MET 98 2HB MET 98 9.789 -9.984 2.466 774 HG2 MET 98 1HG MET 98 9.015 -7.733 2.132 775 HG3 MET 98 2HG MET 98 8.320 -7.645 3.753 776 HE1 MET 98 3HE MET 98 10.119 -5.171 2.957 777 HE2 MET 98 1HE MET 98 9.301 -5.479 4.505 778 HE3 MET 98 2HE MET 98 11.015 -5.048 4.476 779 H ASP 99 H ASP 99 7.700 -12.361 4.442 780 HA ASP 99 HA ASP 99 8.729 -13.982 2.264 781 HB2 ASP 99 1HB ASP 99 9.540 -14.038 4.654 782 HB3 ASP 99 2HB ASP 99 8.079 -14.915 5.059 783 H ALA 100 H ALA 100 5.548 -13.288 3.194 784 HA ALA 100 HA ALA 100 4.539 -15.972 2.336 785 HB1 ALA 100 1HB ALA 100 3.831 -15.105 4.589 786 HB2 ALA 100 2HB ALA 100 2.913 -13.837 3.725 787 HB3 ALA 100 3HB ALA 100 2.522 -15.530 3.470 788 H LEU 101 H LEU 101 5.522 -13.698 0.486 789 HA LEU 101 HA LEU 101 3.018 -13.099 -0.919 790 HB2 LEU 101 1HB LEU 101 5.838 -11.973 -0.921 791 HB3 LEU 101 2HB LEU 101 4.685 -11.552 -2.168 792 HG LEU 101 HG LEU 101 4.093 -11.190 0.806 793 HD11 LEU 101 1HD1 LEU 101 5.979 -9.810 0.161 794 HD12 LEU 101 2HD1 LEU 101 4.560 -8.796 0.444 795 HD13 LEU 101 3HD1 LEU 101 5.084 -9.154 -1.234 796 HD21 LEU 101 3HD2 LEU 101 2.056 -11.305 -0.523 797 HD22 LEU 101 1HD2 LEU 101 2.695 -10.091 -1.662 798 HD23 LEU 101 2HD2 LEU 101 2.329 -9.648 0.007 799 H GLN 102 H GLN 102 2.766 -13.397 -3.137 800 HA GLN 102 HA GLN 102 3.640 -15.909 -4.153 801 HB2 GLN 102 1HB GLN 102 1.379 -14.579 -4.300 802 HB3 GLN 102 2HB GLN 102 2.151 -13.670 -5.593 803 HG2 GLN 102 1HG GLN 102 2.530 -15.904 -6.763 804 HG3 GLN 102 2HG GLN 102 1.556 -16.642 -5.484 805 HE21 GLN 102 1HE2 GLN 102 -0.746 -15.518 -5.143 806 HE22 GLN 102 2HE2 GLN 102 -1.519 -15.046 -6.637 807 H ASP 103 H ASP 103 4.523 -12.574 -4.634 808 HA ASP 103 HA ASP 103 6.469 -13.170 -6.839 809 HB2 ASP 103 1HB ASP 103 4.587 -10.746 -6.573 810 HB3 ASP 103 2HB ASP 103 5.948 -10.830 -7.667 811 H ASN 104 H ASN 104 8.386 -11.631 -6.641 812 HA ASN 104 HA ASN 104 8.713 -10.120 -4.183 813 HB2 ASN 104 1HB ASN 104 10.297 -10.363 -6.767 814 HB3 ASN 104 2HB ASN 104 10.659 -9.156 -5.584 815 HD21 ASN 104 1HD2 ASN 104 12.367 -9.649 -4.657 816 HD22 ASN 104 2HD2 ASN 104 12.937 -11.198 -4.080 817 H SER 105 H SER 105 6.194 -9.444 -5.436 818 HA SER 105 HA SER 105 6.735 -6.633 -5.671 819 HB2 SER 105 1HB SER 105 5.370 -6.223 -7.702 820 HB3 SER 105 2HB SER 105 6.810 -7.164 -8.067 821 HG SER 105 HG SER 105 5.680 -8.961 -8.288 822 H ILE 106 H ILE 106 5.126 -5.397 -4.821 823 HA ILE 106 HA ILE 106 2.872 -6.877 -3.555 824 HB ILE 106 HB ILE 106 4.410 -5.367 -2.267 825 HG12 ILE 106 1HG1 ILE 106 1.977 -6.109 -1.664 826 HG13 ILE 106 2HG1 ILE 106 2.928 -4.989 -0.673 827 HG21 ILE 106 1HG2 ILE 106 4.765 -3.534 -3.729 828 HG22 ILE 106 2HG2 ILE 106 3.038 -3.114 -3.783 829 HG23 ILE 106 3HG2 ILE 106 3.971 -2.946 -2.287 830 HD11 ILE 106 3HD1 ILE 106 0.555 -4.337 -0.902 831 HD12 ILE 106 1HD1 ILE 106 1.675 -3.082 -1.417 832 HD13 ILE 106 2HD1 ILE 106 0.801 -4.041 -2.622 833 H GLN 107 H GLN 107 0.762 -5.882 -3.828 834 HA GLN 107 HA GLN 107 0.064 -3.827 -5.609 835 HB2 GLN 107 1HB GLN 107 0.531 -5.436 -7.454 836 HB3 GLN 107 2HB GLN 107 -0.360 -6.711 -6.608 837 HG2 GLN 107 1HG GLN 107 -2.466 -5.439 -6.915 838 HG3 GLN 107 2HG GLN 107 -1.574 -4.141 -7.699 839 HE21 GLN 107 1HE2 GLN 107 -2.555 -4.232 -9.679 840 HE22 GLN 107 2HE2 GLN 107 -2.593 -5.620 -10.717 841 H ILE 108 H ILE 108 -2.094 -3.284 -5.045 842 HA ILE 108 HA ILE 108 -3.528 -5.123 -3.162 843 HB ILE 108 HB ILE 108 -3.532 -2.077 -3.213 844 HG12 ILE 108 1HG1 ILE 108 -2.005 -4.079 -1.478 845 HG13 ILE 108 2HG1 ILE 108 -1.352 -2.772 -2.477 846 HG21 ILE 108 1HG2 ILE 108 -4.731 -2.318 -1.051 847 HG22 ILE 108 2HG2 ILE 108 -5.639 -3.040 -2.354 848 HG23 ILE 108 3HG2 ILE 108 -4.709 -4.081 -1.243 849 HD11 ILE 108 3HD1 ILE 108 -2.572 -1.138 -0.902 850 HD12 ILE 108 1HD1 ILE 108 -2.772 -2.545 0.153 851 HD13 ILE 108 2HD1 ILE 108 -1.147 -2.005 -0.273 852 H LYS 109 H LYS 109 -5.963 -5.054 -3.415 853 HA LYS 109 HA LYS 109 -7.008 -3.615 -5.687 854 HB2 LYS 109 1HB LYS 109 -8.051 -5.647 -6.721 855 HB3 LYS 109 2HB LYS 109 -6.340 -5.494 -6.948 856 HG2 LYS 109 1HG LYS 109 -6.648 -7.116 -4.598 857 HG3 LYS 109 2HG LYS 109 -7.836 -7.665 -5.744 858 HD2 LYS 109 1HD LYS 109 -5.817 -8.960 -6.046 859 HD3 LYS 109 2HD LYS 109 -6.096 -7.978 -7.472 860 HE2 LYS 109 1HE LYS 109 -3.762 -7.893 -6.990 861 HE3 LYS 109 2HE LYS 109 -4.386 -6.299 -6.623 862 HZ1 LYS 109 3HZ LYS 109 -3.019 -7.009 -4.784 863 HZ2 LYS 109 1HZ LYS 109 -3.600 -8.513 -4.836 864 HZ3 LYS 109 2HZ LYS 109 -4.562 -7.312 -4.227 865 H ALA 110 H ALA 110 -9.436 -3.631 -5.615 866 HA ALA 110 HA ALA 110 -10.737 -4.815 -3.290 867 HB1 ALA 110 1HB ALA 110 -10.490 -1.782 -3.485 868 HB2 ALA 110 2HB ALA 110 -11.435 -2.705 -2.291 869 HB3 ALA 110 3HB ALA 110 -9.667 -2.797 -2.273 870 H LEU 111 H LEU 111 -13.078 -4.487 -3.415 871 HA LEU 111 HA LEU 111 -14.210 -3.940 -6.057 872 HB2 LEU 111 1HB LEU 111 -15.011 -5.802 -4.664 873 HB3 LEU 111 2HB LEU 111 -15.413 -4.721 -3.361 874 HG LEU 111 HG LEU 111 -17.210 -5.720 -4.881 875 HD11 LEU 111 1HD1 LEU 111 -18.714 -3.806 -4.551 876 HD12 LEU 111 2HD1 LEU 111 -17.314 -2.830 -4.058 877 HD13 LEU 111 3HD1 LEU 111 -17.767 -4.257 -3.126 878 HD21 LEU 111 3HD2 LEU 111 -16.936 -3.360 -6.657 879 HD22 LEU 111 1HD2 LEU 111 -17.941 -4.782 -6.803 880 HD23 LEU 111 2HD2 LEU 111 -16.192 -4.934 -7.046 881 H SER 112 H SER 112 -15.315 -2.187 -6.551 882 HA SER 112 HA SER 112 -15.301 0.201 -4.775 883 HB2 SER 112 1HB SER 112 -14.399 0.557 -6.998 884 HB3 SER 112 2HB SER 112 -15.808 -0.210 -7.756 885 HG SER 112 HG SER 112 -15.460 2.337 -6.857 886 H SER 113 H SER 113 -17.622 -1.197 -7.154 887 HA SER 113 HA SER 113 -19.871 -1.218 -5.286 888 HB2 SER 113 1HB SER 113 -19.603 1.189 -6.044 889 HB3 SER 113 2HB SER 113 -19.732 0.636 -7.724 890 HG SER 113 HG SER 113 -21.718 1.305 -7.065 891 H GLY 114 H GLY 114 -21.663 -2.361 -6.332 892 HA2 GLY 114 1HA GLY 114 -22.533 -4.067 -7.611 893 HA3 GLY 114 2HA GLY 114 -21.777 -3.267 -8.986 894 H THR 115 H THR 115 -20.022 -4.171 -9.913 895 HA THR 115 HA THR 115 -18.732 -6.534 -8.617 896 HB THR 115 HB THR 115 -20.580 -6.864 -10.366 897 HG1 THR 115 1HG THR 115 -18.106 -8.169 -10.825 898 HG21 THR 115 3HG2 THR 115 -19.830 -6.713 -12.627 899 HG22 THR 115 1HG2 THR 115 -18.160 -6.348 -12.089 900 HG23 THR 115 2HG2 THR 115 -19.456 -5.163 -11.844 901 H THR 116 H THR 116 -18.337 -3.433 -9.768 902 HA THR 116 HA THR 116 -16.105 -3.411 -11.425 903 HB THR 116 HB THR 116 -16.663 -1.097 -9.625 904 HG1 THR 116 1HG THR 116 -18.698 -1.685 -9.725 905 HG21 THR 116 3HG2 THR 116 -16.518 -1.369 -12.635 906 HG22 THR 116 1HG2 THR 116 -15.322 -0.639 -11.526 907 HG23 THR 116 2HG2 THR 116 -16.882 0.142 -11.779 908 H PHE 117 H PHE 117 -14.168 -4.137 -10.830 909 HA PHE 117 HA PHE 117 -13.207 -3.790 -8.024 910 HB2 PHE 117 1HB PHE 117 -13.500 -6.138 -9.510 911 HB3 PHE 117 2HB PHE 117 -11.812 -5.752 -9.719 912 HD1 PHE 117 1HD PHE 117 -10.259 -5.765 -7.768 913 HD2 PHE 117 2HD PHE 117 -14.446 -6.704 -7.341 914 HE1 PHE 117 1HE PHE 117 -9.830 -6.760 -5.510 915 HE2 PHE 117 2HE PHE 117 -13.996 -7.701 -5.108 916 HZ PHE 117 HZ PHE 117 -11.693 -7.742 -4.207 917 H VAL 118 H VAL 118 -11.145 -2.922 -7.702 918 HA VAL 118 HA VAL 118 -9.843 -1.737 -10.108 919 HB VAL 118 HB VAL 118 -10.024 -0.365 -7.403 920 HG11 VAL 118 1HG1 VAL 118 -9.515 0.689 -10.231 921 HG12 VAL 118 2HG1 VAL 118 -9.451 1.626 -8.723 922 HG13 VAL 118 3HG1 VAL 118 -8.254 0.369 -9.035 923 HG21 VAL 118 3HG2 VAL 118 -12.355 -0.534 -8.117 924 HG22 VAL 118 1HG2 VAL 118 -11.795 1.111 -8.389 925 HG23 VAL 118 2HG2 VAL 118 -11.937 -0.014 -9.765 926 H TYR 119 H TYR 119 -7.692 -1.984 -10.191 927 HA TYR 119 HA TYR 119 -6.307 -3.439 -7.972 928 HB2 TYR 119 1HB TYR 119 -5.864 -3.579 -10.983 929 HB3 TYR 119 2HB TYR 119 -4.979 -4.437 -9.789 930 HD1 TYR 119 2HD TYR 119 -8.504 -4.046 -11.051 931 HD2 TYR 119 1HD TYR 119 -5.530 -6.674 -9.353 932 HE1 TYR 119 2HE TYR 119 -10.086 -5.875 -11.149 933 HE2 TYR 119 1HE TYR 119 -7.155 -8.551 -9.460 934 HH TYR 119 HH TYR 119 -10.459 -8.129 -10.766 935 H SER 120 H SER 120 -4.406 -2.563 -7.282 936 HA SER 120 HA SER 120 -3.602 0.083 -8.101 937 HB2 SER 120 1HB SER 120 -2.218 -0.009 -6.291 938 HB3 SER 120 2HB SER 120 -3.372 -1.165 -5.789 939 HG SER 120 HG SER 120 -1.016 -2.020 -7.100 940 H GLN 121 H GLN 121 -1.013 0.292 -8.515 941 HA GLN 121 HA GLN 121 -0.375 -1.115 -10.976 942 HB2 GLN 121 1HB GLN 121 1.773 -0.039 -10.722 943 HB3 GLN 121 2HB GLN 121 0.523 1.151 -10.438 944 HG2 GLN 121 1HG GLN 121 1.590 -0.233 -7.999 945 HG3 GLN 121 2HG GLN 121 2.744 0.685 -8.943 946 HE21 GLN 121 1HE2 GLN 121 2.809 2.857 -8.690 947 HE22 GLN 121 2HE2 GLN 121 1.645 3.833 -7.859 948 H LYS 122 H LYS 122 1.784 -2.347 -11.013 949 HA LYS 122 HA LYS 122 2.159 -4.241 -8.722 950 HB2 LYS 122 1HB LYS 122 2.116 -5.295 -10.905 951 HB3 LYS 122 2HB LYS 122 3.234 -4.107 -11.579 952 HG2 LYS 122 1HG LYS 122 5.057 -4.909 -10.150 953 HG3 LYS 122 2HG LYS 122 3.959 -6.067 -9.378 954 HD2 LYS 122 1HD LYS 122 4.409 -6.122 -12.382 955 HD3 LYS 122 2HD LYS 122 5.609 -6.829 -11.282 956 HE2 LYS 122 1HE LYS 122 3.884 -8.273 -10.271 957 HE3 LYS 122 2HE LYS 122 2.676 -7.598 -11.372 958 HZ1 LYS 122 3HZ LYS 122 5.072 -9.018 -12.344 959 HZ2 LYS 122 1HZ LYS 122 3.730 -8.636 -13.200 960 HZ3 LYS 122 2HZ LYS 122 3.641 -9.764 -12.002 961 H ILE 123 H ILE 123 3.935 -3.858 -7.329 962 HA ILE 123 HA ILE 123 6.156 -2.128 -8.234 963 HB ILE 123 HB ILE 123 4.798 -2.040 -5.510 964 HG12 ILE 123 1HG1 ILE 123 3.589 -0.704 -7.203 965 HG13 ILE 123 2HG1 ILE 123 4.231 0.254 -5.852 966 HG21 ILE 123 1HG2 ILE 123 6.389 -0.226 -4.922 967 HG22 ILE 123 2HG2 ILE 123 7.232 -1.746 -5.217 968 HG23 ILE 123 3HG2 ILE 123 7.233 -0.453 -6.446 969 HD11 ILE 123 3HD1 ILE 123 5.440 0.098 -8.657 970 HD12 ILE 123 1HD1 ILE 123 4.470 1.418 -7.977 971 HD13 ILE 123 2HD1 ILE 123 6.047 1.090 -7.317 972 H ASP 124 H ASP 124 7.467 -3.616 -8.756 973 HA ASP 124 HA ASP 124 8.063 -5.946 -7.136 974 HB2 ASP 124 1HB ASP 124 8.455 -5.762 -9.549 975 HB3 ASP 124 2HB ASP 124 9.628 -4.583 -9.321 976 H PHE 125 H PHE 125 9.952 -6.275 -5.889 977 HA PHE 125 HA PHE 125 11.435 -3.951 -4.980 978 HB2 PHE 125 1HB PHE 125 10.727 -3.995 -2.615 979 HB3 PHE 125 2HB PHE 125 9.389 -3.681 -3.659 980 HD1 PHE 125 2HD PHE 125 11.007 -6.291 -1.631 981 HD2 PHE 125 1HD PHE 125 7.410 -5.108 -3.638 982 HE1 PHE 125 2HE PHE 125 9.855 -8.105 -0.524 983 HE2 PHE 125 1HE PHE 125 6.184 -6.950 -2.476 984 HZ PHE 125 HZ PHE 125 7.408 -8.496 -0.951 985 H GLU 126 H GLU 126 13.164 -4.541 -3.551 986 HA GLU 126 HA GLU 126 13.939 -7.418 -3.824 987 HB2 GLU 126 1HB GLU 126 15.470 -4.965 -4.121 988 HB3 GLU 126 2HB GLU 126 16.236 -6.260 -3.153 989 HG2 GLU 126 1HG GLU 126 15.018 -6.816 -5.853 990 HG3 GLU 126 2HG GLU 126 16.657 -6.218 -5.682 991 H ARG 127 H ARG 127 14.958 -8.492 -2.265 992 HA ARG 127 HA ARG 127 13.996 -7.767 0.466 993 HB2 ARG 127 1HB ARG 127 14.164 -10.561 -0.663 994 HB3 ARG 127 2HB ARG 127 13.497 -10.033 0.874 995 HG2 ARG 127 1HG ARG 127 12.008 -8.693 -1.149 996 HG3 ARG 127 2HG ARG 127 12.357 -10.273 -1.832 997 HD2 ARG 127 1HD ARG 127 10.941 -9.611 0.734 998 HD3 ARG 127 2HD ARG 127 10.264 -10.367 -0.714 999 HE ARG 127 HE ARG 127 11.777 -11.621 1.468 1000 HH11 ARG 127 1HH1 ARG 127 10.341 -12.128 -1.767 1001 HH12 ARG 127 2HH1 ARG 127 10.824 -13.784 -1.829 1002 HH21 ARG 127 1HH2 ARG 127 12.307 -13.882 1.361 1003 HH22 ARG 127 2HH2 ARG 127 11.528 -14.825 0.132 1004 H GLU 128 H GLU 128 15.780 -6.980 1.209 1005 HA GLU 128 HA GLU 128 18.378 -8.207 1.189 1006 HB2 GLU 128 1HB GLU 128 18.043 -5.833 1.644 1007 HB3 GLU 128 2HB GLU 128 17.002 -6.213 3.004 1008 HG2 GLU 128 1HG GLU 128 18.770 -6.061 4.287 1009 HG3 GLU 128 2HG GLU 128 19.394 -7.540 3.621 Start of MODEL 11 1 H1 GLY 1 H GLY 1 -22.491 18.338 -7.038 2 HA2 GLY 1 1HA GLY 1 -21.927 17.541 -4.735 3 HA3 GLY 1 2HA GLY 1 -22.220 16.261 -5.905 4 H ALA 2 H ALA 2 -20.893 15.588 -3.815 5 HA ALA 2 HA ALA 2 -18.733 14.118 -4.764 6 HB1 ALA 2 1HB ALA 2 -16.890 14.959 -3.309 7 HB2 ALA 2 2HB ALA 2 -17.295 16.131 -4.574 8 HB3 ALA 2 3HB ALA 2 -17.844 16.395 -2.901 9 H GLU 3 H GLU 3 -20.499 12.896 -3.953 10 HA GLU 3 HA GLU 3 -21.257 13.047 -1.146 11 HB2 GLU 3 1HB GLU 3 -22.140 10.785 -2.960 12 HB3 GLU 3 2HB GLU 3 -22.973 11.591 -1.633 13 HG2 GLU 3 1HG GLU 3 -22.656 12.443 -4.499 14 HG3 GLU 3 2HG GLU 3 -24.134 12.275 -3.574 15 H ALA 4 H ALA 4 -21.510 10.195 -0.562 16 HA ALA 4 HA ALA 4 -18.642 9.462 -0.204 17 HB1 ALA 4 1HB ALA 4 -20.123 9.166 1.740 18 HB2 ALA 4 2HB ALA 4 -21.258 8.208 0.770 19 HB3 ALA 4 3HB ALA 4 -19.668 7.577 1.116 20 H LEU 5 H LEU 5 -18.637 9.486 -2.947 21 HA LEU 5 HA LEU 5 -19.731 7.405 -4.201 22 HB2 LEU 5 1HB LEU 5 -16.915 8.342 -4.728 23 HB3 LEU 5 2HB LEU 5 -18.203 8.044 -5.854 24 HG LEU 5 HG LEU 5 -17.975 10.265 -5.878 25 HD11 LEU 5 1HD1 LEU 5 -20.299 9.493 -5.519 26 HD12 LEU 5 2HD1 LEU 5 -19.911 11.243 -5.491 27 HD13 LEU 5 3HD1 LEU 5 -20.157 10.356 -3.965 28 HD21 LEU 5 3HD2 LEU 5 -17.147 10.277 -3.138 29 HD22 LEU 5 1HD2 LEU 5 -17.889 11.759 -3.851 30 HD23 LEU 5 2HD2 LEU 5 -16.493 11.013 -4.598 31 HA PRO 6 HA PRO 6 -17.078 3.988 -2.940 32 HB2 PRO 6 1HB PRO 6 -17.219 2.339 -5.092 33 HB3 PRO 6 2HB PRO 6 -18.631 2.627 -4.011 34 HG2 PRO 6 1HG PRO 6 -18.071 3.805 -6.732 35 HG3 PRO 6 2HG PRO 6 -19.608 3.284 -5.979 36 HD2 PRO 6 1HD PRO 6 -18.556 5.968 -6.059 37 HD3 PRO 6 2HD PRO 6 -19.948 5.394 -5.084 38 H LEU 7 H LEU 7 -15.196 3.191 -3.403 39 HA LEU 7 HA LEU 7 -13.044 4.659 -3.829 40 HB2 LEU 7 1HB LEU 7 -13.092 2.575 -2.741 41 HB3 LEU 7 2HB LEU 7 -13.424 1.699 -4.234 42 HG LEU 7 HG LEU 7 -11.101 2.346 -5.033 43 HD11 LEU 7 1HD1 LEU 7 -10.990 3.453 -2.195 44 HD12 LEU 7 2HD1 LEU 7 -10.742 4.343 -3.707 45 HD13 LEU 7 3HD1 LEU 7 -9.556 3.138 -3.223 46 HD21 LEU 7 3HD2 LEU 7 -11.746 0.180 -3.915 47 HD22 LEU 7 1HD2 LEU 7 -11.240 0.884 -2.368 48 HD23 LEU 7 2HD2 LEU 7 -10.070 0.637 -3.669 49 H TYR 8 H TYR 8 -12.907 5.993 -5.619 50 HA TYR 8 HA TYR 8 -13.119 4.867 -8.325 51 HB2 TYR 8 1HB TYR 8 -13.101 7.282 -8.997 52 HB3 TYR 8 2HB TYR 8 -14.439 6.722 -8.031 53 HD1 TYR 8 1HD TYR 8 -11.288 8.721 -7.883 54 HD2 TYR 8 2HD TYR 8 -15.014 7.732 -5.970 55 HE1 TYR 8 1HE TYR 8 -11.052 10.690 -6.393 56 HE2 TYR 8 2HE TYR 8 -14.838 9.683 -4.506 57 HH TYR 8 HH TYR 8 -13.474 11.616 -3.926 58 H TYR 9 H TYR 9 -10.526 4.958 -6.293 59 HA TYR 9 HA TYR 9 -8.560 4.925 -8.462 60 HB2 TYR 9 1HB TYR 9 -8.777 7.374 -7.875 61 HB3 TYR 9 2HB TYR 9 -8.638 6.914 -6.197 62 HD1 TYR 9 1HD TYR 9 -6.677 7.177 -9.354 63 HD2 TYR 9 2HD TYR 9 -6.547 6.571 -5.088 64 HE1 TYR 9 1HE TYR 9 -4.279 7.724 -9.361 65 HE2 TYR 9 2HE TYR 9 -4.184 7.211 -5.054 66 HH TYR 9 HH TYR 9 -2.399 7.953 -6.279 67 H LEU 10 H LEU 10 -6.650 3.679 -7.792 68 HA LEU 10 HA LEU 10 -6.364 3.356 -4.932 69 HB2 LEU 10 1HB LEU 10 -7.838 1.551 -5.990 70 HB3 LEU 10 2HB LEU 10 -6.446 1.176 -6.999 71 HG LEU 10 HG LEU 10 -6.478 -0.465 -5.638 72 HD11 LEU 10 1HD1 LEU 10 -4.269 0.719 -5.382 73 HD12 LEU 10 2HD1 LEU 10 -4.660 -0.463 -4.093 74 HD13 LEU 10 3HD1 LEU 10 -4.806 1.289 -3.804 75 HD21 LEU 10 3HD2 LEU 10 -8.032 0.813 -3.847 76 HD22 LEU 10 1HD2 LEU 10 -6.595 0.440 -2.900 77 HD23 LEU 10 2HD2 LEU 10 -7.451 -0.875 -3.755 78 H GLN 11 H GLN 11 -4.280 3.242 -4.361 79 HA GLN 11 HA GLN 11 -2.164 2.754 -6.331 80 HB2 GLN 11 1HB GLN 11 -2.932 5.202 -6.654 81 HB3 GLN 11 2HB GLN 11 -2.332 5.515 -5.061 82 HG2 GLN 11 1HG GLN 11 -0.445 6.077 -6.187 83 HG3 GLN 11 2HG GLN 11 -0.108 4.364 -6.106 84 HE21 GLN 11 1HE2 GLN 11 -2.388 3.891 -8.280 85 HE22 GLN 11 2HE2 GLN 11 -1.449 4.229 -9.717 86 H ILE 12 H ILE 12 -0.372 1.926 -5.213 87 HA ILE 12 HA ILE 12 -0.393 1.578 -2.440 88 HB ILE 12 HB ILE 12 2.058 1.690 -4.204 89 HG12 ILE 12 1HG1 ILE 12 0.321 -0.100 -4.894 90 HG13 ILE 12 2HG1 ILE 12 1.916 -0.703 -4.536 91 HG21 ILE 12 1HG2 ILE 12 2.944 1.759 -2.034 92 HG22 ILE 12 2HG2 ILE 12 1.509 1.004 -1.376 93 HG23 ILE 12 3HG2 ILE 12 2.719 0.001 -2.123 94 HD11 ILE 12 3HD1 ILE 12 -0.124 -0.768 -2.339 95 HD12 ILE 12 1HD1 ILE 12 -0.165 -1.940 -3.679 96 HD13 ILE 12 2HD1 ILE 12 1.273 -1.817 -2.645 97 H THR 13 H THR 13 0.876 4.394 -4.268 98 HA THR 13 HA THR 13 1.319 6.454 -3.647 99 HB THR 13 HB THR 13 -0.163 5.837 -1.076 100 HG1 THR 13 1HG THR 13 -1.379 5.235 -2.780 101 HG21 THR 13 3HG2 THR 13 -0.806 8.204 -1.178 102 HG22 THR 13 1HG2 THR 13 0.228 8.444 -2.606 103 HG23 THR 13 2HG2 THR 13 0.945 8.041 -1.034 104 H GLY 14 H GLY 14 1.995 4.705 -0.462 105 HA2 GLY 14 1HA GLY 14 4.831 5.332 -0.970 106 HA3 GLY 14 2HA GLY 14 4.177 5.970 0.529 107 H ILE 15 H ILE 15 6.263 4.161 0.521 108 HA ILE 15 HA ILE 15 5.198 1.690 1.664 109 HB ILE 15 HB ILE 15 5.241 1.235 -0.749 110 HG12 ILE 15 1HG1 ILE 15 7.641 -0.180 0.463 111 HG13 ILE 15 2HG1 ILE 15 5.990 -0.493 0.994 112 HG21 ILE 15 1HG2 ILE 15 8.245 1.807 -0.736 113 HG22 ILE 15 2HG2 ILE 15 7.239 1.385 -2.133 114 HG23 ILE 15 3HG2 ILE 15 7.039 2.945 -1.327 115 HD11 ILE 15 3HD1 ILE 15 6.849 -0.766 -1.919 116 HD12 ILE 15 1HD1 ILE 15 6.860 -2.095 -0.787 117 HD13 ILE 15 2HD1 ILE 15 5.326 -1.306 -1.140 118 H THR 16 H THR 16 6.761 0.749 3.062 119 HA THR 16 HA THR 16 9.507 1.399 2.814 120 HB THR 16 HB THR 16 8.667 3.475 3.925 121 HG1 THR 16 1HG THR 16 10.602 3.285 4.332 122 HG21 THR 16 3HG2 THR 16 6.885 2.441 5.351 123 HG22 THR 16 1HG2 THR 16 7.990 3.510 6.215 124 HG23 THR 16 2HG2 THR 16 8.171 1.746 6.373 125 H SER 17 H SER 17 10.348 0.526 5.340 126 HA SER 17 HA SER 17 8.870 -1.846 6.092 127 HB2 SER 17 1HB SER 17 10.195 -2.623 4.124 128 HB3 SER 17 2HB SER 17 11.680 -2.126 4.956 129 HG SER 17 HG SER 17 11.507 -4.157 5.460 130 H ASP 18 H ASP 18 9.983 -2.836 7.952 131 HA ASP 18 HA ASP 18 10.784 -0.997 9.980 132 HB2 ASP 18 1HB ASP 18 9.715 -3.184 10.380 133 HB3 ASP 18 2HB ASP 18 11.122 -3.993 9.744 134 H GLY 19 H GLY 19 12.746 -3.087 7.811 135 HA2 GLY 19 1HA GLY 19 15.266 -2.168 8.876 136 HA3 GLY 19 2HA GLY 19 14.995 -3.089 7.406 137 H ASN 20 H ASN 20 13.099 -0.231 7.175 138 HA ASN 20 HA ASN 20 15.175 0.856 5.337 139 HB2 ASN 20 1HB ASN 20 12.223 0.585 5.111 140 HB3 ASN 20 2HB ASN 20 12.969 1.973 4.326 141 HD21 ASN 20 1HD2 ASN 20 13.167 1.420 2.102 142 HD22 ASN 20 2HD2 ASN 20 13.983 -0.062 1.624 143 H ASP 21 H ASP 21 14.656 1.594 8.341 144 HA ASP 21 HA ASP 21 14.646 3.458 9.630 145 HB2 ASP 21 1HB ASP 21 16.416 4.140 7.837 146 HB3 ASP 21 2HB ASP 21 15.184 5.267 7.272 147 H PHE 22 H PHE 22 12.304 2.493 7.967 148 HA PHE 22 HA PHE 22 10.175 2.919 7.516 149 HB2 PHE 22 1HB PHE 22 10.492 4.879 9.809 150 HB3 PHE 22 2HB PHE 22 8.962 4.490 9.054 151 HD1 PHE 22 2HD PHE 22 11.849 2.327 10.374 152 HD2 PHE 22 1HD PHE 22 7.620 3.230 10.449 153 HE1 PHE 22 2HE PHE 22 11.468 0.430 11.874 154 HE2 PHE 22 1HE PHE 22 7.261 1.318 11.964 155 HZ PHE 22 HZ PHE 22 9.178 -0.126 12.637 156 H ALA 23 H ALA 23 12.344 4.531 6.120 157 HA ALA 23 HA ALA 23 11.389 7.042 5.252 158 HB1 ALA 23 1HB ALA 23 13.162 5.003 3.853 159 HB2 ALA 23 2HB ALA 23 12.942 6.691 3.361 160 HB3 ALA 23 3HB ALA 23 13.691 6.321 4.926 161 H TRP 24 H TRP 24 9.333 7.175 4.619 162 HA TRP 24 HA TRP 24 7.738 5.175 3.452 163 HB2 TRP 24 1HB TRP 24 7.455 8.106 4.143 164 HB3 TRP 24 2HB TRP 24 6.206 7.345 3.186 165 HD1 TRP 24 HD TRP 24 7.065 7.842 6.698 166 HE1 TRP 24 1HE TRP 24 5.683 6.335 8.204 167 HE3 TRP 24 3HE TRP 24 5.378 4.632 3.146 168 HZ2 TRP 24 2HZ TRP 24 3.922 3.980 7.864 169 HZ3 TRP 24 3HZ TRP 24 3.965 2.711 3.736 170 HH2 TRP 24 HH TRP 24 3.233 2.367 6.096 171 H ASP 25 H ASP 25 9.731 7.186 1.762 172 HA ASP 25 HA ASP 25 9.838 7.942 -0.497 173 HB2 ASP 25 1HB ASP 25 9.651 4.949 -0.316 174 HB3 ASP 25 2HB ASP 25 9.803 5.779 -1.872 175 H ASN 26 H ASN 26 7.956 9.304 -0.913 176 HA ASN 26 HA ASN 26 5.453 8.319 -1.783 177 HB2 ASN 26 1HB ASN 26 6.951 10.913 -2.235 178 HB3 ASN 26 2HB ASN 26 5.507 10.557 -3.192 179 HD21 ASN 26 1HD2 ASN 26 3.441 10.213 -2.143 180 HD22 ASN 26 2HD2 ASN 26 3.158 10.804 -0.543 181 H LEU 27 H LEU 27 5.059 6.964 -3.345 182 HA LEU 27 HA LEU 27 6.969 6.471 -5.465 183 HB2 LEU 27 1HB LEU 27 4.172 5.357 -4.979 184 HB3 LEU 27 2HB LEU 27 5.337 4.698 -6.121 185 HG LEU 27 HG LEU 27 5.586 4.762 -3.081 186 HD11 LEU 27 1HD1 LEU 27 5.136 2.450 -5.015 187 HD12 LEU 27 2HD1 LEU 27 3.908 3.194 -3.960 188 HD13 LEU 27 3HD1 LEU 27 5.279 2.338 -3.247 189 HD21 LEU 27 3HD2 LEU 27 7.587 3.409 -3.349 190 HD22 LEU 27 1HD2 LEU 27 7.821 4.936 -4.138 191 HD23 LEU 27 2HD2 LEU 27 7.464 3.458 -5.107 192 H THR 28 H THR 28 6.764 6.853 -7.660 193 HA THR 28 HA THR 28 5.238 9.062 -8.491 194 HB THR 28 HB THR 28 6.095 7.631 -10.760 195 HG1 THR 28 1HG THR 28 8.078 6.901 -10.363 196 HG21 THR 28 3HG2 THR 28 6.429 10.047 -10.303 197 HG22 THR 28 1HG2 THR 28 7.996 9.305 -10.674 198 HG23 THR 28 2HG2 THR 28 7.553 9.658 -8.991 199 H SER 29 H SER 29 3.606 9.209 -10.096 200 HA SER 29 HA SER 29 1.372 7.651 -9.692 201 HB2 SER 29 1HB SER 29 1.941 9.316 -12.160 202 HB3 SER 29 2HB SER 29 0.379 9.013 -11.385 203 HG SER 29 HG SER 29 1.452 11.097 -10.968 204 H SER 30 H SER 30 4.035 6.753 -11.688 205 HA SER 30 HA SER 30 2.498 4.436 -12.629 206 HB2 SER 30 1HB SER 30 3.419 4.588 -14.863 207 HB3 SER 30 2HB SER 30 2.434 6.016 -14.504 208 HG SER 30 HG SER 30 5.168 5.724 -14.913 209 H GLN 31 H GLN 31 4.309 4.814 -10.421 210 HA GLN 31 HA GLN 31 6.951 3.793 -10.990 211 HB2 GLN 31 1HB GLN 31 6.057 4.850 -8.778 212 HB3 GLN 31 2HB GLN 31 5.295 3.271 -8.510 213 HG2 GLN 31 1HG GLN 31 7.143 2.855 -7.361 214 HG3 GLN 31 2HG GLN 31 7.747 2.421 -8.928 215 HE21 GLN 31 1HE2 GLN 31 7.754 4.835 -6.417 216 HE22 GLN 31 2HE2 GLN 31 9.292 5.563 -6.775 217 H THR 32 H THR 32 7.584 1.614 -11.261 218 HA THR 32 HA THR 32 5.506 -0.503 -10.997 219 HB THR 32 HB THR 32 6.452 -1.455 -13.113 220 HG1 THR 32 1HG THR 32 7.309 0.293 -14.496 221 HG21 THR 32 3HG2 THR 32 5.096 1.221 -13.395 222 HG22 THR 32 1HG2 THR 32 4.308 -0.318 -13.001 223 HG23 THR 32 2HG2 THR 32 5.097 -0.117 -14.572 224 H LYS 33 H LYS 33 8.331 0.581 -9.782 225 HA LYS 33 HA LYS 33 8.921 -2.015 -8.641 226 HB2 LYS 33 1HB LYS 33 10.346 -1.532 -10.901 227 HB3 LYS 33 2HB LYS 33 11.359 -0.637 -9.770 228 HG2 LYS 33 1HG LYS 33 10.501 -3.383 -8.963 229 HG3 LYS 33 2HG LYS 33 11.573 -3.314 -10.341 230 HD2 LYS 33 1HD LYS 33 12.312 -1.871 -7.774 231 HD3 LYS 33 2HD LYS 33 12.566 -3.617 -7.971 232 HE2 LYS 33 1HE LYS 33 13.795 -3.093 -10.133 233 HE3 LYS 33 2HE LYS 33 13.740 -1.382 -9.689 234 HZ1 LYS 33 3HZ LYS 33 15.776 -2.692 -9.084 235 HZ2 LYS 33 1HZ LYS 33 14.947 -3.467 -7.953 236 HZ3 LYS 33 2HZ LYS 33 15.162 -1.837 -7.827 237 H ALA 34 H ALA 34 10.350 -1.816 -6.775 238 HA ALA 34 HA ALA 34 9.500 0.343 -5.211 239 HB1 ALA 34 1HB ALA 34 11.040 -0.673 -3.475 240 HB2 ALA 34 2HB ALA 34 10.019 -1.860 -4.296 241 HB3 ALA 34 3HB ALA 34 11.736 -1.693 -4.745 242 HA PRO 35 HA PRO 35 12.519 3.483 -5.781 243 HB2 PRO 35 1HB PRO 35 12.648 4.628 -3.269 244 HB3 PRO 35 2HB PRO 35 11.245 4.795 -4.363 245 HG2 PRO 35 1HG PRO 35 11.610 2.785 -2.105 246 HG3 PRO 35 2HG PRO 35 10.182 3.813 -2.439 247 HD2 PRO 35 1HD PRO 35 10.152 1.335 -3.250 248 HD3 PRO 35 2HD PRO 35 9.578 2.617 -4.339 249 H ASN 36 H ASN 36 13.187 1.088 -3.110 250 HA ASN 36 HA ASN 36 15.983 1.164 -3.684 251 HB2 ASN 36 1HB ASN 36 15.582 1.514 -0.776 252 HB3 ASN 36 2HB ASN 36 16.825 2.159 -1.841 253 HD21 ASN 36 1HD2 ASN 36 13.646 2.752 -0.419 254 HD22 ASN 36 2HD2 ASN 36 13.599 4.452 -0.709 255 H VAL 37 H VAL 37 16.948 -0.523 -1.918 256 HA VAL 37 HA VAL 37 15.372 -2.922 -2.028 257 HB VAL 37 HB VAL 37 17.842 -2.399 -0.319 258 HG11 VAL 37 1HG1 VAL 37 16.785 -4.959 -1.644 259 HG12 VAL 37 2HG1 VAL 37 18.188 -4.809 -0.577 260 HG13 VAL 37 3HG1 VAL 37 16.572 -4.535 0.072 261 HG21 VAL 37 3HG2 VAL 37 17.700 -3.189 -3.273 262 HG22 VAL 37 1HG2 VAL 37 18.470 -1.742 -2.594 263 HG23 VAL 37 2HG2 VAL 37 19.148 -3.327 -2.262 264 H LEU 38 H LEU 38 13.638 -3.217 -0.799 265 HA LEU 38 HA LEU 38 13.194 -1.969 1.802 266 HB2 LEU 38 1HB LEU 38 11.574 -4.145 0.493 267 HB3 LEU 38 2HB LEU 38 11.109 -3.129 1.862 268 HG LEU 38 HG LEU 38 11.492 -2.274 -1.045 269 HD11 LEU 38 1HD1 LEU 38 9.003 -2.296 0.704 270 HD12 LEU 38 2HD1 LEU 38 9.423 -3.554 -0.469 271 HD13 LEU 38 3HD1 LEU 38 9.124 -1.905 -1.038 272 HD21 LEU 38 3HD2 LEU 38 12.183 -0.378 0.237 273 HD22 LEU 38 1HD2 LEU 38 10.826 -0.554 1.379 274 HD23 LEU 38 2HD2 LEU 38 10.542 -0.058 -0.309 275 H LYS 39 H LYS 39 14.672 -2.655 3.236 276 HA LYS 39 HA LYS 39 15.537 -5.416 3.459 277 HB2 LYS 39 1HB LYS 39 15.901 -3.072 5.382 278 HB3 LYS 39 2HB LYS 39 16.826 -4.575 5.401 279 HG2 LYS 39 1HG LYS 39 17.595 -3.947 3.004 280 HG3 LYS 39 2HG LYS 39 16.849 -2.367 3.317 281 HD2 LYS 39 1HD LYS 39 18.315 -2.340 5.474 282 HD3 LYS 39 2HD LYS 39 19.237 -3.639 4.673 283 HE2 LYS 39 1HE LYS 39 19.460 -2.165 2.655 284 HE3 LYS 39 2HE LYS 39 18.566 -0.899 3.524 285 HZ1 LYS 39 3HZ LYS 39 20.427 -1.026 5.197 286 HZ2 LYS 39 1HZ LYS 39 20.778 -0.350 3.744 287 HZ3 LYS 39 2HZ LYS 39 21.290 -1.861 4.024 288 H GLY 40 H GLY 40 15.359 -6.463 5.865 289 HA2 GLY 40 1HA GLY 40 13.954 -7.052 7.643 290 HA3 GLY 40 2HA GLY 40 12.934 -5.677 7.291 291 H ASN 41 H ASN 41 11.280 -7.390 7.803 292 HA ASN 41 HA ASN 41 10.292 -8.546 5.223 293 HB2 ASN 41 1HB ASN 41 11.066 -10.313 6.840 294 HB3 ASN 41 2HB ASN 41 9.823 -9.776 7.961 295 HD21 ASN 41 1HD2 ASN 41 7.890 -11.088 7.788 296 HD22 ASN 41 2HD2 ASN 41 7.535 -11.983 6.331 297 H LYS 42 H LYS 42 9.613 -6.632 8.084 298 HA LYS 42 HA LYS 42 6.718 -6.772 7.684 299 HB2 LYS 42 1HB LYS 42 8.410 -5.071 9.545 300 HB3 LYS 42 2HB LYS 42 6.650 -5.091 9.524 301 HG2 LYS 42 1HG LYS 42 8.448 -7.460 10.223 302 HG3 LYS 42 2HG LYS 42 7.466 -6.489 11.334 303 HD2 LYS 42 1HD LYS 42 5.436 -7.188 9.958 304 HD3 LYS 42 2HD LYS 42 6.481 -8.376 9.155 305 HE2 LYS 42 1HE LYS 42 6.895 -9.554 11.199 306 HE3 LYS 42 2HE LYS 42 6.190 -8.249 12.165 307 HZ1 LYS 42 3HZ LYS 42 4.066 -8.701 11.034 308 HZ2 LYS 42 1HZ LYS 42 4.557 -9.942 11.962 309 HZ3 LYS 42 2HZ LYS 42 4.769 -10.055 10.333 310 H LEU 43 H LEU 43 6.287 -6.142 5.816 311 HA LEU 43 HA LEU 43 7.275 -3.776 4.501 312 HB2 LEU 43 1HB LEU 43 6.125 -6.168 3.689 313 HB3 LEU 43 2HB LEU 43 4.741 -5.096 3.585 314 HG LEU 43 HG LEU 43 7.403 -4.801 2.163 315 HD11 LEU 43 1HD1 LEU 43 5.691 -6.461 1.275 316 HD12 LEU 43 2HD1 LEU 43 6.127 -5.172 0.153 317 HD13 LEU 43 3HD1 LEU 43 4.592 -5.085 1.070 318 HD21 LEU 43 3HD2 LEU 43 5.122 -2.861 2.382 319 HD22 LEU 43 1HD2 LEU 43 6.196 -2.938 0.970 320 HD23 LEU 43 2HD2 LEU 43 6.879 -2.601 2.558 321 H TYR 44 H TYR 44 6.478 -1.737 4.896 322 HA TYR 44 HA TYR 44 3.767 -1.485 6.123 323 HB2 TYR 44 1HB TYR 44 6.147 0.381 6.289 324 HB3 TYR 44 2HB TYR 44 4.577 0.625 7.047 325 HD1 TYR 44 1HD TYR 44 3.917 -2.004 8.215 326 HD2 TYR 44 2HD TYR 44 7.713 0.044 8.002 327 HE1 TYR 44 1HE TYR 44 4.712 -3.290 10.131 328 HE2 TYR 44 2HE TYR 44 8.469 -1.167 10.009 329 HH TYR 44 HH TYR 44 6.283 -3.174 11.923 330 H VAL 45 H VAL 45 2.315 -0.660 4.843 331 HA VAL 45 HA VAL 45 3.141 0.996 2.474 332 HB VAL 45 HB VAL 45 0.799 -0.946 2.644 333 HG11 VAL 45 1HG1 VAL 45 2.123 0.666 0.515 334 HG12 VAL 45 2HG1 VAL 45 0.872 -0.577 0.180 335 HG13 VAL 45 3HG1 VAL 45 0.463 0.889 1.093 336 HG21 VAL 45 3HG2 VAL 45 3.550 -1.224 1.330 337 HG22 VAL 45 1HG2 VAL 45 2.925 -2.224 2.654 338 HG23 VAL 45 2HG2 VAL 45 2.171 -2.315 1.064 339 H LYS 46 H LYS 46 1.814 2.793 2.022 340 HA LYS 46 HA LYS 46 -0.240 3.634 4.016 341 HB2 LYS 46 1HB LYS 46 1.887 4.822 4.435 342 HB3 LYS 46 2HB LYS 46 2.014 5.275 2.740 343 HG2 LYS 46 1HG LYS 46 -0.562 6.079 3.973 344 HG3 LYS 46 2HG LYS 46 0.848 6.731 4.810 345 HD2 LYS 46 1HD LYS 46 0.301 7.186 1.871 346 HD3 LYS 46 2HD LYS 46 -0.084 8.288 3.192 347 HE2 LYS 46 1HE LYS 46 2.321 8.300 3.864 348 HE3 LYS 46 2HE LYS 46 2.692 7.344 2.419 349 HZ1 LYS 46 3HZ LYS 46 1.663 9.260 1.129 350 HZ2 LYS 46 1HZ LYS 46 3.043 9.646 1.958 351 HZ3 LYS 46 2HZ LYS 46 1.560 10.090 2.511 352 H ALA 47 H ALA 47 -1.937 2.957 2.584 353 HA ALA 47 HA ALA 47 -1.507 3.554 -0.287 354 HB1 ALA 47 1HB ALA 47 -3.382 1.497 0.888 355 HB2 ALA 47 2HB ALA 47 -2.724 1.611 -0.769 356 HB3 ALA 47 3HB ALA 47 -1.673 1.168 0.557 357 H ARG 48 H ARG 48 -2.826 4.922 -1.373 358 HA ARG 48 HA ARG 48 -4.742 6.381 0.326 359 HB2 ARG 48 1HB ARG 48 -3.181 7.706 -0.955 360 HB3 ARG 48 2HB ARG 48 -3.717 6.974 -2.485 361 HG2 ARG 48 1HG ARG 48 -5.887 8.050 -2.362 362 HG3 ARG 48 2HG ARG 48 -5.697 8.345 -0.651 363 HD2 ARG 48 1HD ARG 48 -5.472 10.398 -1.836 364 HD3 ARG 48 2HD ARG 48 -3.928 10.001 -1.069 365 HE ARG 48 HE ARG 48 -3.191 9.082 -3.247 366 HH11 ARG 48 1HH1 ARG 48 -5.465 11.826 -3.237 367 HH12 ARG 48 2HH1 ARG 48 -4.501 12.758 -4.317 368 HH21 ARG 48 1HH2 ARG 48 -2.285 10.055 -5.022 369 HH22 ARG 48 2HH2 ARG 48 -2.922 11.514 -5.708 370 H PHE 49 H PHE 49 -6.918 6.208 0.157 371 HA PHE 49 HA PHE 49 -8.153 4.687 -2.103 372 HB2 PHE 49 1HB PHE 49 -8.901 4.698 0.843 373 HB3 PHE 49 2HB PHE 49 -9.875 3.991 -0.415 374 HD1 PHE 49 1HD PHE 49 -6.718 3.696 1.474 375 HD2 PHE 49 2HD PHE 49 -9.219 1.698 -1.427 376 HE1 PHE 49 1HE PHE 49 -5.449 1.599 1.784 377 HE2 PHE 49 2HE PHE 49 -8.200 -0.427 -0.869 378 HZ PHE 49 HZ PHE 49 -6.272 -0.526 0.720 379 H MET 50 H MET 50 -9.117 6.140 -3.430 380 HA MET 50 HA MET 50 -10.074 8.623 -2.164 381 HB2 MET 50 1HB MET 50 -10.083 8.054 -5.128 382 HB3 MET 50 2HB MET 50 -10.221 9.599 -4.311 383 HG2 MET 50 1HG MET 50 -7.711 8.063 -3.863 384 HG3 MET 50 2HG MET 50 -7.973 8.694 -5.497 385 HE1 MET 50 3HE MET 50 -7.690 11.273 -1.658 386 HE2 MET 50 1HE MET 50 -9.253 10.694 -2.270 387 HE3 MET 50 2HE MET 50 -8.020 9.528 -1.732 388 H GLY 51 H GLY 51 -12.071 8.307 -1.424 389 HA2 GLY 51 1HA GLY 51 -14.492 7.996 -1.802 390 HA3 GLY 51 2HA GLY 51 -14.125 6.839 -3.062 391 H TYR 52 H TYR 52 -15.916 6.219 -1.123 392 HA TYR 52 HA TYR 52 -14.799 4.991 1.217 393 HB2 TYR 52 1HB TYR 52 -17.462 5.464 0.077 394 HB3 TYR 52 2HB TYR 52 -17.346 3.846 0.718 395 HD1 TYR 52 1HD TYR 52 -16.789 3.433 3.127 396 HD2 TYR 52 2HD TYR 52 -17.338 7.405 1.546 397 HE1 TYR 52 1HE TYR 52 -17.101 4.301 5.421 398 HE2 TYR 52 2HE TYR 52 -17.582 8.300 3.836 399 HH TYR 52 HH TYR 52 -17.685 6.143 6.704 400 H THR 53 H THR 53 -14.151 2.980 1.612 401 HA THR 53 HA THR 53 -15.233 0.624 0.717 402 HB THR 53 HB THR 53 -12.698 1.416 -0.728 403 HG1 THR 53 1HG THR 53 -14.801 1.599 -1.649 404 HG21 THR 53 3HG2 THR 53 -12.476 -0.923 -1.480 405 HG22 THR 53 1HG2 THR 53 -13.644 -1.424 -0.244 406 HG23 THR 53 2HG2 THR 53 -12.058 -0.705 0.218 407 H LYS 54 H LYS 54 -15.151 -0.282 2.639 408 HA LYS 54 HA LYS 54 -12.526 -0.507 4.059 409 HB2 LYS 54 1HB LYS 54 -15.381 -0.818 5.080 410 HB3 LYS 54 2HB LYS 54 -13.933 -1.261 5.996 411 HG2 LYS 54 1HG LYS 54 -13.952 0.820 6.820 412 HG3 LYS 54 2HG LYS 54 -13.285 1.312 5.282 413 HD2 LYS 54 1HD LYS 54 -15.086 2.790 5.631 414 HD3 LYS 54 2HD LYS 54 -15.697 1.623 4.468 415 HE2 LYS 54 1HE LYS 54 -17.461 1.904 6.023 416 HE3 LYS 54 2HE LYS 54 -16.727 0.349 6.427 417 HZ1 LYS 54 3HZ LYS 54 -17.200 1.656 8.371 418 HZ2 LYS 54 1HZ LYS 54 -16.188 2.880 7.869 419 HZ3 LYS 54 2HZ LYS 54 -15.611 1.378 8.264 420 H LEU 55 H LEU 55 -13.074 -1.919 1.603 421 HA LEU 55 HA LEU 55 -13.241 -4.745 2.516 422 HB2 LEU 55 1HB LEU 55 -14.680 -3.533 0.115 423 HB3 LEU 55 2HB LEU 55 -14.471 -5.240 0.440 424 HG LEU 55 HG LEU 55 -15.557 -4.579 2.806 425 HD11 LEU 55 1HD1 LEU 55 -15.899 -2.174 2.282 426 HD12 LEU 55 2HD1 LEU 55 -17.433 -3.002 2.480 427 HD13 LEU 55 3HD1 LEU 55 -16.845 -2.613 0.848 428 HD21 LEU 55 3HD2 LEU 55 -17.129 -5.094 0.265 429 HD22 LEU 55 1HD2 LEU 55 -17.720 -5.325 1.928 430 HD23 LEU 55 2HD2 LEU 55 -16.377 -6.312 1.334 431 H THR 56 H THR 56 -10.818 -3.916 2.453 432 HA THR 56 HA THR 56 -9.530 -4.024 -0.147 433 HB THR 56 HB THR 56 -8.155 -4.468 2.542 434 HG1 THR 56 1HG THR 56 -9.151 -1.991 1.557 435 HG21 THR 56 3HG2 THR 56 -7.420 -2.879 0.050 436 HG22 THR 56 1HG2 THR 56 -6.797 -4.478 0.516 437 HG23 THR 56 2HG2 THR 56 -6.420 -3.071 1.512 438 H VAL 57 H VAL 57 -8.114 -5.822 -0.817 439 HA VAL 57 HA VAL 57 -8.227 -8.378 0.641 440 HB VAL 57 HB VAL 57 -8.847 -7.981 -2.331 441 HG11 VAL 57 1HG1 VAL 57 -9.314 -10.455 -2.323 442 HG12 VAL 57 2HG1 VAL 57 -7.621 -10.045 -2.143 443 HG13 VAL 57 3HG1 VAL 57 -8.560 -10.573 -0.729 444 HG21 VAL 57 3HG2 VAL 57 -10.648 -8.800 -0.021 445 HG22 VAL 57 1HG2 VAL 57 -10.853 -7.446 -1.152 446 HG23 VAL 57 2HG2 VAL 57 -11.048 -9.106 -1.715 447 H ILE 58 H ILE 58 -6.329 -9.677 0.056 448 HA ILE 58 HA ILE 58 -4.376 -8.645 -1.828 449 HB ILE 58 HB ILE 58 -3.473 -9.336 0.996 450 HG12 ILE 58 1HG1 ILE 58 -3.678 -6.520 -0.144 451 HG13 ILE 58 2HG1 ILE 58 -4.683 -7.191 1.148 452 HG21 ILE 58 1HG2 ILE 58 -1.893 -9.730 -0.944 453 HG22 ILE 58 2HG2 ILE 58 -1.974 -7.992 -1.287 454 HG23 ILE 58 3HG2 ILE 58 -1.283 -8.566 0.230 455 HD11 ILE 58 3HD1 ILE 58 -2.602 -7.541 2.528 456 HD12 ILE 58 1HD1 ILE 58 -1.720 -6.611 1.296 457 HD13 ILE 58 2HD1 ILE 58 -3.031 -5.844 2.195 458 H THR 59 H THR 59 -4.177 -10.586 -3.105 459 HA THR 59 HA THR 59 -5.234 -12.972 -2.146 460 HB THR 59 HB THR 59 -3.564 -12.904 -4.620 461 HG1 THR 59 1HG THR 59 -4.691 -11.519 -5.655 462 HG21 THR 59 3HG2 THR 59 -5.158 -14.741 -4.177 463 HG22 THR 59 1HG2 THR 59 -5.579 -13.859 -5.642 464 HG23 THR 59 2HG2 THR 59 -6.503 -13.597 -4.140 465 H GLY 60 H GLY 60 -1.914 -11.793 -2.170 466 HA2 GLY 60 1HA GLY 60 0.012 -12.735 -1.266 467 HA3 GLY 60 2HA GLY 60 -1.010 -14.005 -0.561 468 H LYS 61 H LYS 61 0.593 -15.505 -1.050 469 HA LYS 61 HA LYS 61 0.831 -16.373 -3.892 470 HB2 LYS 61 1HB LYS 61 2.687 -17.731 -3.156 471 HB3 LYS 61 2HB LYS 61 2.868 -16.080 -2.594 472 HG2 LYS 61 1HG LYS 61 1.905 -16.909 -0.334 473 HG3 LYS 61 2HG LYS 61 2.265 -18.531 -0.933 474 HD2 LYS 61 1HD LYS 61 4.279 -16.228 -0.776 475 HD3 LYS 61 2HD LYS 61 4.077 -17.435 0.488 476 HE2 LYS 61 1HE LYS 61 4.893 -18.048 -2.384 477 HE3 LYS 61 2HE LYS 61 6.011 -17.780 -1.051 478 HZ1 LYS 61 3HZ LYS 61 5.743 -20.039 -1.192 479 HZ2 LYS 61 1HZ LYS 61 4.101 -20.025 -1.303 480 HZ3 LYS 61 2HZ LYS 61 4.870 -19.630 0.124 481 H ASP 62 H ASP 62 -0.585 -17.309 -0.800 482 HA ASP 62 HA ASP 62 -1.229 -20.018 -1.506 483 HB2 ASP 62 1HB ASP 62 -1.113 -18.931 0.790 484 HB3 ASP 62 2HB ASP 62 -2.658 -18.168 0.438 485 H GLY 63 H GLY 63 -2.600 -16.911 -2.372 486 HA2 GLY 63 1HA GLY 63 -4.086 -16.509 -4.072 487 HA3 GLY 63 2HA GLY 63 -4.579 -18.189 -4.101 488 H LYS 64 H LYS 64 -4.527 -16.294 -1.072 489 HA LYS 64 HA LYS 64 -7.446 -16.091 -1.016 490 HB2 LYS 64 1HB LYS 64 -5.828 -17.501 1.160 491 HB3 LYS 64 2HB LYS 64 -7.573 -17.217 1.131 492 HG2 LYS 64 1HG LYS 64 -7.640 -18.680 -0.982 493 HG3 LYS 64 2HG LYS 64 -5.946 -19.075 -0.647 494 HD2 LYS 64 1HD LYS 64 -6.732 -19.739 1.718 495 HD3 LYS 64 2HD LYS 64 -8.371 -19.746 1.063 496 HE2 LYS 64 1HE LYS 64 -5.998 -21.294 -0.085 497 HE3 LYS 64 2HE LYS 64 -7.123 -21.952 1.100 498 HZ1 LYS 64 3HZ LYS 64 -7.656 -22.630 -1.111 499 HZ2 LYS 64 1HZ LYS 64 -7.843 -21.109 -1.641 500 HZ3 LYS 64 2HZ LYS 64 -8.900 -21.737 -0.499 501 H ASN 65 H ASN 65 -8.105 -14.756 0.745 502 HA ASN 65 HA ASN 65 -6.784 -12.315 0.733 503 HB2 ASN 65 1HB ASN 65 -9.294 -12.991 1.145 504 HB3 ASN 65 2HB ASN 65 -8.835 -13.086 2.845 505 HD21 ASN 65 1HD2 ASN 65 -7.520 -10.990 3.571 506 HD22 ASN 65 2HD2 ASN 65 -8.483 -9.571 3.176 507 H LEU 66 H LEU 66 -4.687 -12.354 1.549 508 HA LEU 66 HA LEU 66 -3.700 -13.472 3.858 509 HB2 LEU 66 1HB LEU 66 -2.972 -10.748 2.679 510 HB3 LEU 66 2HB LEU 66 -2.023 -11.592 3.883 511 HG LEU 66 HG LEU 66 -2.565 -12.548 1.043 512 HD11 LEU 66 1HD1 LEU 66 -0.974 -10.733 1.062 513 HD12 LEU 66 2HD1 LEU 66 -0.027 -12.212 0.899 514 HD13 LEU 66 3HD1 LEU 66 -0.100 -11.382 2.450 515 HD21 LEU 66 3HD2 LEU 66 -0.732 -14.279 1.703 516 HD22 LEU 66 1HD2 LEU 66 -2.376 -14.528 2.276 517 HD23 LEU 66 2HD2 LEU 66 -1.159 -13.894 3.384 518 H LEU 67 H LEU 67 -5.387 -10.332 3.663 519 HA LEU 67 HA LEU 67 -4.872 -9.537 6.355 520 HB2 LEU 67 1HB LEU 67 -7.136 -8.806 4.472 521 HB3 LEU 67 2HB LEU 67 -6.774 -7.945 5.924 522 HG LEU 67 HG LEU 67 -4.772 -8.137 3.650 523 HD11 LEU 67 1HD1 LEU 67 -6.822 -7.171 2.721 524 HD12 LEU 67 2HD1 LEU 67 -5.623 -5.887 2.948 525 HD13 LEU 67 3HD1 LEU 67 -6.968 -6.057 4.094 526 HD21 LEU 67 3HD2 LEU 67 -3.860 -6.114 4.662 527 HD22 LEU 67 1HD2 LEU 67 -3.971 -7.371 5.902 528 HD23 LEU 67 2HD2 LEU 67 -5.180 -6.068 5.856 529 H TYR 68 H TYR 68 -7.030 -12.041 5.174 530 HA TYR 68 HA TYR 68 -8.532 -12.056 7.725 531 HB2 TYR 68 1HB TYR 68 -9.698 -11.807 5.435 532 HB3 TYR 68 2HB TYR 68 -9.173 -13.449 5.113 533 HD1 TYR 68 2HD TYR 68 -11.397 -11.311 7.183 534 HD2 TYR 68 1HD TYR 68 -10.345 -15.352 6.135 535 HE1 TYR 68 2HE TYR 68 -13.494 -12.080 8.176 536 HE2 TYR 68 1HE TYR 68 -12.432 -16.146 7.104 537 HH TYR 68 HH TYR 68 -14.392 -15.551 8.207 538 H ASN 69 H ASN 69 -5.703 -13.095 6.529 539 HA ASN 69 HA ASN 69 -5.953 -15.960 7.242 540 HB2 ASN 69 1HB ASN 69 -4.955 -15.325 5.058 541 HB3 ASN 69 2HB ASN 69 -3.650 -14.493 5.896 542 HD21 ASN 69 1HD2 ASN 69 -5.289 -17.754 5.921 543 HD22 ASN 69 2HD2 ASN 69 -3.755 -18.594 6.047 544 H GLY 70 H GLY 70 -3.381 -13.467 7.666 545 HA2 GLY 70 1HA GLY 70 -3.817 -12.932 10.334 546 HA3 GLY 70 2HA GLY 70 -2.829 -14.379 10.385 547 H THR 71 H THR 71 -1.276 -13.424 7.888 548 HA THR 71 HA THR 71 0.685 -12.081 9.621 549 HB THR 71 HB THR 71 0.889 -13.317 6.860 550 HG1 THR 71 1HG THR 71 0.407 -14.731 8.629 551 HG21 THR 71 3HG2 THR 71 3.084 -12.393 8.750 552 HG22 THR 71 1HG2 THR 71 2.767 -11.773 7.153 553 HG23 THR 71 2HG2 THR 71 3.345 -13.429 7.309 554 H ALA 72 H ALA 72 -1.591 -10.928 7.371 555 HA ALA 72 HA ALA 72 -0.165 -8.305 7.263 556 HB1 ALA 72 1HB ALA 72 -2.159 -9.446 5.217 557 HB2 ALA 72 2HB ALA 72 -1.457 -7.816 5.191 558 HB3 ALA 72 3HB ALA 72 -0.414 -9.227 4.938 559 H LYS 73 H LYS 73 -1.466 -6.564 7.913 560 HA LYS 73 HA LYS 73 -4.270 -6.923 8.610 561 HB2 LYS 73 1HB LYS 73 -3.347 -8.157 10.418 562 HB3 LYS 73 2HB LYS 73 -2.088 -6.960 10.747 563 HG2 LYS 73 1HG LYS 73 -3.674 -5.425 11.633 564 HG3 LYS 73 2HG LYS 73 -5.060 -6.414 11.134 565 HD2 LYS 73 1HD LYS 73 -2.928 -7.236 13.156 566 HD3 LYS 73 2HD LYS 73 -4.522 -6.566 13.580 567 HE2 LYS 73 1HE LYS 73 -5.626 -8.495 12.495 568 HE3 LYS 73 2HE LYS 73 -4.046 -9.159 12.049 569 HZ1 LYS 73 3HZ LYS 73 -3.553 -9.315 14.444 570 HZ2 LYS 73 1HZ LYS 73 -4.821 -10.226 13.977 571 HZ3 LYS 73 2HZ LYS 73 -5.130 -8.838 14.767 572 H MET 74 H MET 74 -5.255 -4.817 9.079 573 HA MET 74 HA MET 74 -3.446 -2.522 8.765 574 HB2 MET 74 1HB MET 74 -5.284 -1.287 8.301 575 HB3 MET 74 2HB MET 74 -5.649 -2.818 7.521 576 HG2 MET 74 1HG MET 74 -7.053 -3.405 9.553 577 HG3 MET 74 2HG MET 74 -6.755 -1.760 10.134 578 HE1 MET 74 3HE MET 74 -6.811 -1.182 6.573 579 HE2 MET 74 1HE MET 74 -8.264 -0.160 6.554 580 HE3 MET 74 2HE MET 74 -6.976 0.135 7.750 581 H PHE 75 H PHE 75 -3.156 -1.051 10.372 582 HA PHE 75 HA PHE 75 -4.262 -1.522 13.068 583 HB2 PHE 75 1HB PHE 75 -2.085 -1.489 14.056 584 HB3 PHE 75 2HB PHE 75 -2.179 -2.799 12.901 585 HD1 PHE 75 2HD PHE 75 -1.019 -2.543 10.610 586 HD2 PHE 75 1HD PHE 75 -0.423 0.216 13.884 587 HE1 PHE 75 2HE PHE 75 1.083 -1.732 9.557 588 HE2 PHE 75 1HE PHE 75 1.683 0.984 12.838 589 HZ PHE 75 HZ PHE 75 2.450 -0.015 10.692 590 H LYS 76 H LYS 76 -3.750 0.722 10.583 591 HA LYS 76 HA LYS 76 -3.999 3.047 12.354 592 HB2 LYS 76 1HB LYS 76 -1.586 2.585 12.282 593 HB3 LYS 76 2HB LYS 76 -1.616 2.496 10.530 594 HG2 LYS 76 1HG LYS 76 -2.314 4.930 10.492 595 HG3 LYS 76 2HG LYS 76 -2.136 4.965 12.246 596 HD2 LYS 76 1HD LYS 76 0.241 4.365 12.056 597 HD3 LYS 76 2HD LYS 76 0.072 4.156 10.295 598 HE2 LYS 76 1HE LYS 76 -0.732 6.600 10.227 599 HE3 LYS 76 2HE LYS 76 -0.187 6.734 11.902 600 HZ1 LYS 76 3HZ LYS 76 2.032 6.125 11.132 601 HZ2 LYS 76 1HZ LYS 76 1.478 7.467 10.342 602 HZ3 LYS 76 2HZ LYS 76 1.502 6.025 9.576 603 H SER 77 H SER 77 -5.210 4.647 11.233 604 HA SER 77 HA SER 77 -5.195 4.767 8.306 605 HB2 SER 77 1HB SER 77 -7.721 4.684 8.274 606 HB3 SER 77 2HB SER 77 -6.869 3.148 8.448 607 HG SER 77 HG SER 77 -8.044 4.605 10.596 608 H ASP 78 H ASP 78 -4.944 7.050 7.958 609 HA ASP 78 HA ASP 78 -6.027 8.904 10.022 610 HB2 ASP 78 1HB ASP 78 -3.440 8.652 8.915 611 HB3 ASP 78 2HB ASP 78 -4.199 9.850 7.913 612 H ALA 79 H ALA 79 -6.034 11.118 8.409 613 HA ALA 79 HA ALA 79 -8.172 10.561 6.405 614 HB1 ALA 79 1HB ALA 79 -7.630 13.046 8.074 615 HB2 ALA 79 2HB ALA 79 -9.010 12.788 6.976 616 HB3 ALA 79 3HB ALA 79 -8.841 11.803 8.453 617 H ILE 80 H ILE 80 -8.218 11.968 4.611 618 HA ILE 80 HA ILE 80 -5.762 13.429 3.807 619 HB ILE 80 HB ILE 80 -7.419 11.654 1.953 620 HG12 ILE 80 1HG1 ILE 80 -4.689 11.103 3.157 621 HG13 ILE 80 2HG1 ILE 80 -6.180 10.198 3.460 622 HG21 ILE 80 1HG2 ILE 80 -5.751 12.209 0.268 623 HG22 ILE 80 2HG2 ILE 80 -6.390 13.689 0.943 624 HG23 ILE 80 3HG2 ILE 80 -4.787 13.109 1.462 625 HD11 ILE 80 3HD1 ILE 80 -4.592 10.253 0.902 626 HD12 ILE 80 1HD1 ILE 80 -5.108 8.866 1.862 627 HD13 ILE 80 2HD1 ILE 80 -6.305 9.770 0.932 628 H LEU 81 H LEU 81 -6.606 15.464 3.982 629 HA LEU 81 HA LEU 81 -9.413 15.931 3.115 630 HB2 LEU 81 1HB LEU 81 -7.417 17.907 4.246 631 HB3 LEU 81 2HB LEU 81 -9.076 18.247 3.765 632 HG LEU 81 HG LEU 81 -8.210 16.427 6.053 633 HD11 LEU 81 1HD1 LEU 81 -9.701 19.093 5.980 634 HD12 LEU 81 2HD1 LEU 81 -8.025 18.832 6.511 635 HD13 LEU 81 3HD1 LEU 81 -9.350 18.124 7.437 636 HD21 LEU 81 3HD2 LEU 81 -10.667 16.317 6.590 637 HD22 LEU 81 1HD2 LEU 81 -10.242 15.450 5.122 638 HD23 LEU 81 2HD2 LEU 81 -11.022 17.047 5.012 639 H GLY 82 H GLY 82 -9.905 17.154 1.328 640 HA2 GLY 82 1HA GLY 82 -8.090 16.819 -0.883 641 HA3 GLY 82 2HA GLY 82 -9.686 17.585 -0.958 642 H GLN 83 H GLN 83 -9.840 19.791 -0.344 643 HA GLN 83 HA GLN 83 -7.488 21.472 0.045 644 HB2 GLN 83 1HB GLN 83 -9.384 22.023 -2.273 645 HB3 GLN 83 2HB GLN 83 -8.018 23.005 -1.782 646 HG2 GLN 83 1HG GLN 83 -7.860 20.242 -3.044 647 HG3 GLN 83 2HG GLN 83 -7.612 21.776 -3.856 648 HE21 GLN 83 1HE2 GLN 83 -5.658 19.789 -3.975 649 HE22 GLN 83 2HE2 GLN 83 -4.260 20.340 -3.068 650 H ASN 84 H ASN 84 -11.007 21.340 -0.685 651 HA ASN 84 HA ASN 84 -11.566 23.500 1.262 652 HB2 ASN 84 1HB ASN 84 -13.454 22.042 -0.647 653 HB3 ASN 84 2HB ASN 84 -13.851 23.422 0.358 654 HD21 ASN 84 1HD2 ASN 84 -12.176 22.383 -2.605 655 HD22 ASN 84 2HD2 ASN 84 -11.785 23.999 -3.118 656 H LYS 85 H LYS 85 -10.615 21.320 2.710 657 HA LYS 85 HA LYS 85 -11.059 19.810 4.281 658 HB2 LYS 85 1HB LYS 85 -13.543 21.554 4.561 659 HB3 LYS 85 2HB LYS 85 -13.135 20.272 5.691 660 HG2 LYS 85 1HG LYS 85 -11.097 21.265 6.318 661 HG3 LYS 85 2HG LYS 85 -11.211 22.536 5.083 662 HD2 LYS 85 1HD LYS 85 -13.526 22.370 6.968 663 HD3 LYS 85 2HD LYS 85 -12.014 22.780 7.731 664 HE2 LYS 85 1HE LYS 85 -12.889 24.207 5.199 665 HE3 LYS 85 2HE LYS 85 -13.526 24.704 6.773 666 HZ1 LYS 85 3HZ LYS 85 -11.452 25.365 7.525 667 HZ2 LYS 85 1HZ LYS 85 -11.405 25.850 5.965 668 HZ3 LYS 85 2HZ LYS 85 -10.623 24.512 6.377 669 H VAL 86 H VAL 86 -12.249 19.242 1.510 670 HA VAL 86 HA VAL 86 -14.471 17.455 1.975 671 HB VAL 86 HB VAL 86 -12.522 17.591 -0.382 672 HG11 VAL 86 1HG1 VAL 86 -15.354 16.458 -0.116 673 HG12 VAL 86 2HG1 VAL 86 -14.489 16.633 -1.651 674 HG13 VAL 86 3HG1 VAL 86 -13.881 15.520 -0.410 675 HG21 VAL 86 3HG2 VAL 86 -15.136 19.076 0.012 676 HG22 VAL 86 1HG2 VAL 86 -13.508 19.785 -0.032 677 HG23 VAL 86 2HG2 VAL 86 -14.157 19.023 -1.472 678 H VAL 87 H VAL 87 -14.395 15.312 2.678 679 HA VAL 87 HA VAL 87 -11.852 14.106 3.442 680 HB VAL 87 HB VAL 87 -14.671 12.935 3.478 681 HG11 VAL 87 1HG1 VAL 87 -12.631 11.341 3.818 682 HG12 VAL 87 2HG1 VAL 87 -12.348 12.225 5.334 683 HG13 VAL 87 3HG1 VAL 87 -13.869 11.383 5.087 684 HG21 VAL 87 3HG2 VAL 87 -13.248 14.541 5.641 685 HG22 VAL 87 1HG2 VAL 87 -14.773 14.953 4.820 686 HG23 VAL 87 2HG2 VAL 87 -14.703 13.557 5.891 687 H ILE 88 H ILE 88 -10.957 14.217 1.172 688 HA ILE 88 HA ILE 88 -12.356 12.872 -0.955 689 HB ILE 88 HB ILE 88 -10.253 13.003 -2.219 690 HG12 ILE 88 1HG1 ILE 88 -8.999 14.516 0.094 691 HG13 ILE 88 2HG1 ILE 88 -8.660 12.814 -0.225 692 HG21 ILE 88 1HG2 ILE 88 -11.953 14.781 -2.147 693 HG22 ILE 88 2HG2 ILE 88 -11.090 15.569 -0.797 694 HG23 ILE 88 3HG2 ILE 88 -10.339 15.441 -2.401 695 HD11 ILE 88 3HD1 ILE 88 -7.865 13.377 -2.514 696 HD12 ILE 88 1HD1 ILE 88 -8.149 15.088 -2.193 697 HD13 ILE 88 2HD1 ILE 88 -6.935 14.214 -1.258 698 H GLY 89 H GLY 89 -10.177 11.682 1.558 699 HA2 GLY 89 1HA GLY 89 -10.877 8.968 1.008 700 HA3 GLY 89 2HA GLY 89 -9.282 9.368 0.326 701 H TRP 90 H TRP 90 -8.835 7.600 1.942 702 HA TRP 90 HA TRP 90 -7.769 8.858 4.397 703 HB2 TRP 90 1HB TRP 90 -9.239 6.222 4.329 704 HB3 TRP 90 2HB TRP 90 -8.449 6.911 5.740 705 HD1 TRP 90 HD TRP 90 -9.816 9.001 6.860 706 HE1 TRP 90 1HE TRP 90 -12.321 9.654 6.735 707 HE3 TRP 90 3HE TRP 90 -11.120 6.344 2.717 708 HZ2 TRP 90 2HZ TRP 90 -14.537 9.261 4.864 709 HZ3 TRP 90 3HZ TRP 90 -13.343 6.654 1.661 710 HH2 TRP 90 HH TRP 90 -15.034 8.131 2.711 711 H ASP 91 H ASP 91 -5.696 7.908 4.926 712 HA ASP 91 HA ASP 91 -4.565 6.439 2.611 713 HB2 ASP 91 1HB ASP 91 -3.784 8.737 4.061 714 HB3 ASP 91 2HB ASP 91 -2.621 7.520 4.474 715 H LYS 92 H LYS 92 -5.675 4.670 3.474 716 HA LYS 92 HA LYS 92 -5.315 3.586 6.135 717 HB2 LYS 92 1HB LYS 92 -6.597 2.625 3.623 718 HB3 LYS 92 2HB LYS 92 -5.960 1.350 4.647 719 HG2 LYS 92 1HG LYS 92 -8.261 1.711 5.134 720 HG3 LYS 92 2HG LYS 92 -7.281 2.143 6.537 721 HD2 LYS 92 1HD LYS 92 -7.558 4.543 5.992 722 HD3 LYS 92 2HD LYS 92 -8.455 4.111 4.546 723 HE2 LYS 92 1HE LYS 92 -9.571 4.813 6.965 724 HE3 LYS 92 2HE LYS 92 -10.403 3.986 5.653 725 HZ1 LYS 92 3HZ LYS 92 -10.087 1.908 6.702 726 HZ2 LYS 92 1HZ LYS 92 -10.690 2.916 7.829 727 HZ3 LYS 92 2HZ LYS 92 -9.113 2.542 7.888 728 H TYR 93 H TYR 93 -3.556 2.701 7.043 729 HA TYR 93 HA TYR 93 -1.296 2.090 5.323 730 HB2 TYR 93 1HB TYR 93 -1.726 2.054 8.340 731 HB3 TYR 93 2HB TYR 93 -0.215 1.649 7.575 732 HD1 TYR 93 2HD TYR 93 -2.655 4.457 8.091 733 HD2 TYR 93 1HD TYR 93 1.318 3.338 6.854 734 HE1 TYR 93 2HE TYR 93 -2.020 6.835 8.033 735 HE2 TYR 93 1HE TYR 93 1.958 5.733 6.744 736 HH TYR 93 HH TYR 93 -0.382 8.369 7.275 737 H PHE 94 H PHE 94 -0.204 -0.152 5.749 738 HA PHE 94 HA PHE 94 -1.904 -2.217 6.936 739 HB2 PHE 94 1HB PHE 94 -1.027 -2.298 4.018 740 HB3 PHE 94 2HB PHE 94 -1.458 -3.744 4.934 741 HD1 PHE 94 1HD PHE 94 -3.778 -4.064 5.792 742 HD2 PHE 94 2HD PHE 94 -2.773 -0.766 3.210 743 HE1 PHE 94 1HE PHE 94 -6.198 -3.708 5.302 744 HE2 PHE 94 2HE PHE 94 -5.172 -0.372 2.794 745 HZ PHE 94 HZ PHE 94 -6.896 -1.834 3.832 746 H GLU 95 H GLU 95 -0.631 -3.904 7.784 747 HA GLU 95 HA GLU 95 2.300 -3.895 7.315 748 HB2 GLU 95 1HB GLU 95 1.297 -4.206 9.667 749 HB3 GLU 95 2HB GLU 95 0.600 -5.706 9.106 750 HG2 GLU 95 1HG GLU 95 2.746 -6.717 8.745 751 HG3 GLU 95 2HG GLU 95 3.572 -5.155 8.818 752 H ILE 96 H ILE 96 3.048 -5.422 5.826 753 HA ILE 96 HA ILE 96 1.416 -7.775 5.231 754 HB ILE 96 HB ILE 96 2.840 -6.211 3.040 755 HG12 ILE 96 1HG1 ILE 96 0.266 -6.019 2.212 756 HG13 ILE 96 2HG1 ILE 96 -0.038 -5.970 3.932 757 HG21 ILE 96 1HG2 ILE 96 1.624 -7.576 1.439 758 HG22 ILE 96 2HG2 ILE 96 2.594 -8.586 2.479 759 HG23 ILE 96 3HG2 ILE 96 0.834 -8.468 2.750 760 HD11 ILE 96 3HD1 ILE 96 1.869 -4.203 2.342 761 HD12 ILE 96 1HD1 ILE 96 0.219 -3.746 2.810 762 HD13 ILE 96 2HD1 ILE 96 1.462 -3.959 4.053 763 HA PRO 97 HA PRO 97 5.722 -9.457 5.589 764 HB2 PRO 97 1HB PRO 97 5.438 -11.707 3.948 765 HB3 PRO 97 2HB PRO 97 4.929 -11.662 5.631 766 HG2 PRO 97 1HG PRO 97 3.280 -11.207 3.167 767 HG3 PRO 97 2HG PRO 97 2.881 -12.192 4.630 768 HD2 PRO 97 1HD PRO 97 1.883 -9.723 4.225 769 HD3 PRO 97 2HD PRO 97 2.327 -10.239 5.854 770 H MET 98 H MET 98 7.430 -10.158 3.926 771 HA MET 98 HA MET 98 6.940 -9.119 1.159 772 HB2 MET 98 1HB MET 98 9.321 -8.909 3.024 773 HB3 MET 98 2HB MET 98 9.583 -8.919 1.281 774 HG2 MET 98 1HG MET 98 7.822 -7.129 1.074 775 HG3 MET 98 2HG MET 98 7.898 -6.969 2.835 776 HE1 MET 98 3HE MET 98 11.076 -5.163 3.530 777 HE2 MET 98 1HE MET 98 9.366 -5.425 3.985 778 HE3 MET 98 2HE MET 98 10.495 -6.805 3.885 779 H ASP 99 H ASP 99 6.815 -11.816 2.693 780 HA ASP 99 HA ASP 99 8.057 -13.425 0.506 781 HB2 ASP 99 1HB ASP 99 9.309 -13.086 2.752 782 HB3 ASP 99 2HB ASP 99 8.114 -14.178 3.427 783 H ALA 100 H ALA 100 5.157 -12.531 1.223 784 HA ALA 100 HA ALA 100 4.084 -15.336 1.277 785 HB1 ALA 100 1HB ALA 100 2.309 -14.941 2.635 786 HB2 ALA 100 2HB ALA 100 3.664 -14.194 3.500 787 HB3 ALA 100 3HB ALA 100 2.481 -13.194 2.581 788 H LEU 101 H LEU 101 4.649 -12.860 -0.689 789 HA LEU 101 HA LEU 101 2.066 -12.723 -2.034 790 HB2 LEU 101 1HB LEU 101 4.770 -11.445 -2.608 791 HB3 LEU 101 2HB LEU 101 3.214 -10.976 -3.261 792 HG LEU 101 HG LEU 101 4.040 -9.478 -1.616 793 HD11 LEU 101 1HD1 LEU 101 1.712 -10.967 -0.358 794 HD12 LEU 101 2HD1 LEU 101 1.549 -9.940 -1.790 795 HD13 LEU 101 3HD1 LEU 101 2.046 -9.223 -0.233 796 HD21 LEU 101 3HD2 LEU 101 5.416 -10.995 -0.397 797 HD22 LEU 101 1HD2 LEU 101 4.006 -11.144 0.729 798 HD23 LEU 101 2HD2 LEU 101 4.705 -9.554 0.356 799 H GLN 102 H GLN 102 2.000 -13.284 -4.302 800 HA GLN 102 HA GLN 102 3.131 -15.733 -4.937 801 HB2 GLN 102 1HB GLN 102 0.976 -14.828 -5.685 802 HB3 GLN 102 2HB GLN 102 1.790 -13.603 -6.664 803 HG2 GLN 102 1HG GLN 102 2.707 -15.267 -8.078 804 HG3 GLN 102 2HG GLN 102 2.214 -16.547 -6.935 805 HE21 GLN 102 1HE2 GLN 102 0.131 -13.785 -8.122 806 HE22 GLN 102 2HE2 GLN 102 -1.065 -14.831 -8.811 807 H ASP 103 H ASP 103 4.783 -12.783 -4.999 808 HA ASP 103 HA ASP 103 7.006 -13.817 -6.504 809 HB2 ASP 103 1HB ASP 103 5.326 -12.864 -8.230 810 HB3 ASP 103 2HB ASP 103 5.760 -11.276 -7.582 811 H ASN 104 H ASN 104 8.613 -11.603 -6.593 812 HA ASN 104 HA ASN 104 8.727 -10.607 -3.828 813 HB2 ASN 104 1HB ASN 104 10.603 -10.248 -6.181 814 HB3 ASN 104 2HB ASN 104 10.836 -9.528 -4.577 815 HD21 ASN 104 1HD2 ASN 104 11.924 -10.640 -3.147 816 HD22 ASN 104 2HD2 ASN 104 12.183 -12.392 -3.139 817 H SER 105 H SER 105 6.385 -9.759 -4.998 818 HA SER 105 HA SER 105 6.849 -6.870 -5.038 819 HB2 SER 105 1HB SER 105 5.431 -6.434 -6.963 820 HB3 SER 105 2HB SER 105 6.723 -7.515 -7.446 821 HG SER 105 HG SER 105 5.459 -9.092 -7.760 822 H ILE 106 H ILE 106 4.965 -5.726 -4.359 823 HA ILE 106 HA ILE 106 2.965 -7.436 -2.919 824 HB ILE 106 HB ILE 106 4.409 -6.252 -1.445 825 HG12 ILE 106 1HG1 ILE 106 1.907 -6.686 -1.065 826 HG13 ILE 106 2HG1 ILE 106 2.841 -5.743 0.074 827 HG21 ILE 106 1HG2 ILE 106 4.371 -3.793 -1.172 828 HG22 ILE 106 2HG2 ILE 106 5.127 -4.313 -2.685 829 HG23 ILE 106 3HG2 ILE 106 3.480 -3.652 -2.707 830 HD11 ILE 106 3HD1 ILE 106 1.011 -4.500 -2.012 831 HD12 ILE 106 1HD1 ILE 106 0.601 -4.791 -0.313 832 HD13 ILE 106 2HD1 ILE 106 1.889 -3.654 -0.736 833 H GLN 107 H GLN 107 0.713 -6.882 -3.355 834 HA GLN 107 HA GLN 107 0.147 -4.340 -4.650 835 HB2 GLN 107 1HB GLN 107 0.548 -5.885 -6.605 836 HB3 GLN 107 2HB GLN 107 -0.562 -7.055 -5.889 837 HG2 GLN 107 1HG GLN 107 -2.384 -5.228 -6.158 838 HG3 GLN 107 2HG GLN 107 -1.199 -4.362 -7.136 839 HE21 GLN 107 1HE2 GLN 107 -2.326 -4.530 -9.077 840 HE22 GLN 107 2HE2 GLN 107 -2.628 -5.995 -9.937 841 H ILE 108 H ILE 108 -1.969 -3.646 -4.233 842 HA ILE 108 HA ILE 108 -3.501 -5.244 -2.226 843 HB ILE 108 HB ILE 108 -3.334 -2.222 -2.608 844 HG12 ILE 108 1HG1 ILE 108 -2.388 -3.919 -0.242 845 HG13 ILE 108 2HG1 ILE 108 -1.325 -3.221 -1.456 846 HG21 ILE 108 1HG2 ILE 108 -5.597 -2.858 -1.909 847 HG22 ILE 108 2HG2 ILE 108 -4.912 -3.870 -0.604 848 HG23 ILE 108 3HG2 ILE 108 -4.785 -2.095 -0.577 849 HD11 ILE 108 3HD1 ILE 108 -2.114 -0.933 -0.830 850 HD12 ILE 108 1HD1 ILE 108 -2.985 -1.655 0.547 851 HD13 ILE 108 2HD1 ILE 108 -1.229 -1.805 0.449 852 H LYS 109 H LYS 109 -5.872 -5.217 -2.643 853 HA LYS 109 HA LYS 109 -6.744 -3.834 -4.981 854 HB2 LYS 109 1HB LYS 109 -7.791 -5.943 -6.023 855 HB3 LYS 109 2HB LYS 109 -6.074 -5.709 -6.172 856 HG2 LYS 109 1HG LYS 109 -6.101 -7.251 -3.859 857 HG3 LYS 109 2HG LYS 109 -7.579 -7.786 -4.626 858 HD2 LYS 109 1HD LYS 109 -5.693 -9.197 -5.210 859 HD3 LYS 109 2HD LYS 109 -6.333 -8.419 -6.623 860 HE2 LYS 109 1HE LYS 109 -4.137 -8.116 -7.061 861 HE3 LYS 109 2HE LYS 109 -4.347 -6.624 -6.168 862 HZ1 LYS 109 3HZ LYS 109 -2.392 -7.909 -5.554 863 HZ2 LYS 109 1HZ LYS 109 -3.238 -9.164 -5.092 864 HZ3 LYS 109 2HZ LYS 109 -3.330 -7.733 -4.235 865 H ALA 110 H ALA 110 -9.325 -3.812 -5.206 866 HA ALA 110 HA ALA 110 -10.562 -4.868 -2.767 867 HB1 ALA 110 1HB ALA 110 -10.510 -1.873 -3.356 868 HB2 ALA 110 2HB ALA 110 -11.382 -2.690 -2.044 869 HB3 ALA 110 3HB ALA 110 -9.612 -2.655 -2.031 870 H LEU 111 H LEU 111 -12.825 -4.693 -2.811 871 HA LEU 111 HA LEU 111 -14.258 -4.449 -5.377 872 HB2 LEU 111 1HB LEU 111 -15.078 -5.977 -3.543 873 HB3 LEU 111 2HB LEU 111 -15.171 -4.590 -2.465 874 HG LEU 111 HG LEU 111 -16.799 -3.568 -4.288 875 HD11 LEU 111 1HD1 LEU 111 -18.120 -5.307 -5.445 876 HD12 LEU 111 2HD1 LEU 111 -16.942 -6.540 -4.949 877 HD13 LEU 111 3HD1 LEU 111 -16.459 -5.237 -6.040 878 HD21 LEU 111 3HD2 LEU 111 -17.457 -4.224 -2.005 879 HD22 LEU 111 1HD2 LEU 111 -17.752 -5.888 -2.586 880 HD23 LEU 111 2HD2 LEU 111 -18.700 -4.534 -3.221 881 H SER 112 H SER 112 -14.690 -2.517 -6.194 882 HA SER 112 HA SER 112 -14.771 -0.129 -4.382 883 HB2 SER 112 1HB SER 112 -13.260 0.273 -6.183 884 HB3 SER 112 2HB SER 112 -14.384 -0.405 -7.387 885 HG SER 112 HG SER 112 -14.195 2.075 -6.798 886 H SER 113 H SER 113 -16.410 -0.928 -7.389 887 HA SER 113 HA SER 113 -19.005 -0.071 -6.233 888 HB2 SER 113 1HB SER 113 -18.040 1.177 -8.201 889 HB3 SER 113 2HB SER 113 -18.151 -0.323 -9.145 890 HG SER 113 HG SER 113 -20.053 1.524 -8.513 891 H GLY 114 H GLY 114 -20.838 -1.374 -7.328 892 HA2 GLY 114 1HA GLY 114 -21.052 -3.963 -6.599 893 HA3 GLY 114 2HA GLY 114 -21.897 -3.310 -8.005 894 H THR 115 H THR 115 -19.134 -5.022 -6.945 895 HA THR 115 HA THR 115 -18.068 -6.854 -7.550 896 HB THR 115 HB THR 115 -20.334 -7.563 -8.386 897 HG1 THR 115 1HG THR 115 -18.508 -8.934 -7.889 898 HG21 THR 115 3HG2 THR 115 -18.679 -7.339 -10.892 899 HG22 THR 115 1HG2 THR 115 -20.196 -6.489 -10.600 900 HG23 THR 115 2HG2 THR 115 -20.211 -8.249 -10.780 901 H THR 116 H THR 116 -17.781 -3.973 -8.935 902 HA THR 116 HA THR 116 -15.600 -4.389 -10.786 903 HB THR 116 HB THR 116 -16.515 -2.123 -9.004 904 HG1 THR 116 1HG THR 116 -16.722 -2.683 -11.758 905 HG21 THR 116 3HG2 THR 116 -14.979 -0.585 -10.170 906 HG22 THR 116 1HG2 THR 116 -14.198 -1.982 -10.949 907 HG23 THR 116 2HG2 THR 116 -14.116 -1.763 -9.185 908 H PHE 117 H PHE 117 -13.615 -4.750 -10.273 909 HA PHE 117 HA PHE 117 -12.693 -4.427 -7.473 910 HB2 PHE 117 1HB PHE 117 -12.986 -6.831 -8.940 911 HB3 PHE 117 2HB PHE 117 -11.253 -6.488 -8.843 912 HD1 PHE 117 1HD PHE 117 -14.367 -7.000 -6.911 913 HD2 PHE 117 2HD PHE 117 -10.079 -6.689 -6.719 914 HE1 PHE 117 1HE PHE 117 -14.405 -7.976 -4.619 915 HE2 PHE 117 2HE PHE 117 -10.125 -7.581 -4.386 916 HZ PHE 117 HZ PHE 117 -12.303 -8.236 -3.353 917 H VAL 118 H VAL 118 -11.150 -3.015 -7.383 918 HA VAL 118 HA VAL 118 -9.711 -2.065 -9.797 919 HB VAL 118 HB VAL 118 -10.390 -0.436 -8.074 920 HG11 VAL 118 1HG1 VAL 118 -9.316 -2.048 -5.981 921 HG12 VAL 118 2HG1 VAL 118 -9.556 -0.271 -5.865 922 HG13 VAL 118 3HG1 VAL 118 -10.906 -1.321 -6.308 923 HG21 VAL 118 3HG2 VAL 118 -7.445 -0.427 -8.099 924 HG22 VAL 118 1HG2 VAL 118 -8.493 0.087 -9.415 925 HG23 VAL 118 2HG2 VAL 118 -8.603 0.957 -7.938 926 H TYR 119 H TYR 119 -7.532 -2.605 -10.143 927 HA TYR 119 HA TYR 119 -6.143 -4.024 -7.901 928 HB2 TYR 119 1HB TYR 119 -5.785 -4.509 -10.886 929 HB3 TYR 119 2HB TYR 119 -4.957 -5.388 -9.602 930 HD1 TYR 119 1HD TYR 119 -8.156 -4.846 -11.380 931 HD2 TYR 119 2HD TYR 119 -6.144 -7.150 -8.388 932 HE1 TYR 119 1HE TYR 119 -10.026 -6.379 -11.384 933 HE2 TYR 119 2HE TYR 119 -8.025 -8.816 -8.411 934 HH TYR 119 HH TYR 119 -10.978 -8.319 -10.375 935 H SER 120 H SER 120 -4.461 -2.975 -7.142 936 HA SER 120 HA SER 120 -3.842 -0.448 -8.245 937 HB2 SER 120 1HB SER 120 -2.766 -0.048 -6.388 938 HB3 SER 120 2HB SER 120 -3.772 -1.344 -5.848 939 HG SER 120 HG SER 120 -1.762 -1.391 -5.016 940 H GLN 121 H GLN 121 -0.952 -0.231 -8.129 941 HA GLN 121 HA GLN 121 -0.297 -1.632 -10.696 942 HB2 GLN 121 1HB GLN 121 1.461 -0.004 -11.009 943 HB3 GLN 121 2HB GLN 121 -0.164 0.669 -10.994 944 HG2 GLN 121 1HG GLN 121 0.319 1.305 -8.522 945 HG3 GLN 121 2HG GLN 121 1.981 0.758 -8.860 946 HE21 GLN 121 1HE2 GLN 121 2.034 3.034 -7.798 947 HE22 GLN 121 2HE2 GLN 121 2.219 4.319 -8.992 948 H LYS 122 H LYS 122 1.159 -3.140 -10.648 949 HA LYS 122 HA LYS 122 2.148 -4.316 -8.230 950 HB2 LYS 122 1HB LYS 122 1.923 -5.558 -10.380 951 HB3 LYS 122 2HB LYS 122 3.266 -4.618 -11.054 952 HG2 LYS 122 1HG LYS 122 4.328 -5.754 -8.695 953 HG3 LYS 122 2HG LYS 122 3.270 -6.985 -9.321 954 HD2 LYS 122 1HD LYS 122 5.371 -7.462 -10.244 955 HD3 LYS 122 2HD LYS 122 4.489 -6.704 -11.582 956 HE2 LYS 122 1HE LYS 122 5.674 -4.545 -11.102 957 HE3 LYS 122 2HE LYS 122 6.477 -5.309 -9.720 958 HZ1 LYS 122 3HZ LYS 122 7.954 -5.323 -11.611 959 HZ2 LYS 122 1HZ LYS 122 6.852 -6.148 -12.529 960 HZ3 LYS 122 2HZ LYS 122 7.552 -6.818 -11.184 961 H ILE 123 H ILE 123 3.895 -3.871 -6.925 962 HA ILE 123 HA ILE 123 6.195 -2.468 -8.146 963 HB ILE 123 HB ILE 123 5.154 -2.071 -5.332 964 HG12 ILE 123 1HG1 ILE 123 3.606 -0.926 -6.837 965 HG13 ILE 123 2HG1 ILE 123 4.496 0.206 -5.840 966 HG21 ILE 123 1HG2 ILE 123 7.590 -1.745 -5.483 967 HG22 ILE 123 2HG2 ILE 123 7.349 -0.583 -6.806 968 HG23 ILE 123 3HG2 ILE 123 6.779 -0.194 -5.184 969 HD11 ILE 123 3HD1 ILE 123 5.153 -0.329 -8.756 970 HD12 ILE 123 1HD1 ILE 123 4.211 1.050 -8.128 971 HD13 ILE 123 2HD1 ILE 123 5.901 0.864 -7.705 972 H ASP 124 H ASP 124 7.574 -3.909 -8.432 973 HA ASP 124 HA ASP 124 8.144 -6.246 -6.770 974 HB2 ASP 124 1HB ASP 124 8.912 -5.129 -9.373 975 HB3 ASP 124 2HB ASP 124 10.316 -5.538 -8.429 976 H PHE 125 H PHE 125 9.996 -6.405 -5.371 977 HA PHE 125 HA PHE 125 11.534 -3.969 -4.841 978 HB2 PHE 125 1HB PHE 125 11.152 -4.153 -2.416 979 HB3 PHE 125 2HB PHE 125 9.655 -3.784 -3.268 980 HD1 PHE 125 2HD PHE 125 11.594 -6.570 -1.690 981 HD2 PHE 125 1HD PHE 125 7.689 -5.142 -2.906 982 HE1 PHE 125 2HE PHE 125 10.576 -8.555 -0.738 983 HE2 PHE 125 1HE PHE 125 6.662 -7.124 -1.871 984 HZ PHE 125 HZ PHE 125 8.095 -8.927 -0.922 985 H GLU 126 H GLU 126 13.384 -4.606 -3.193 986 HA GLU 126 HA GLU 126 14.323 -7.329 -3.918 987 HB2 GLU 126 1HB GLU 126 15.893 -4.745 -3.831 988 HB3 GLU 126 2HB GLU 126 16.584 -6.378 -4.010 989 HG2 GLU 126 1HG GLU 126 15.078 -6.699 -6.034 990 HG3 GLU 126 2HG GLU 126 14.609 -5.005 -5.908 991 H ARG 127 H ARG 127 15.424 -8.470 -2.414 992 HA ARG 127 HA ARG 127 14.561 -7.857 0.362 993 HB2 ARG 127 1HB ARG 127 15.153 -10.400 -1.179 994 HB3 ARG 127 2HB ARG 127 14.978 -10.391 0.566 995 HG2 ARG 127 1HG ARG 127 12.799 -9.293 -1.228 996 HG3 ARG 127 2HG ARG 127 12.991 -11.038 -1.023 997 HD2 ARG 127 1HD ARG 127 12.635 -9.121 1.312 998 HD3 ARG 127 2HD ARG 127 11.335 -10.005 0.491 999 HE ARG 127 HE ARG 127 13.005 -12.027 1.106 1000 HH11 ARG 127 1HH1 ARG 127 11.934 -9.450 3.334 1001 HH12 ARG 127 2HH1 ARG 127 10.991 -10.556 4.294 1002 HH21 ARG 127 1HH2 ARG 127 12.153 -13.443 2.634 1003 HH22 ARG 127 2HH2 ARG 127 11.440 -12.875 4.112 1004 H GLU 128 H GLU 128 16.262 -6.518 0.705 1005 HA GLU 128 HA GLU 128 18.226 -5.824 1.579 1006 HB2 GLU 128 1HB GLU 128 18.389 -8.688 2.528 1007 HB3 GLU 128 2HB GLU 128 19.427 -7.337 3.093 1008 HG2 GLU 128 1HG GLU 128 17.484 -6.139 3.852 1009 HG3 GLU 128 2HG GLU 128 16.400 -7.412 3.321 Start of MODEL 12 1 H1 GLY 1 H GLY 1 -21.940 16.242 -6.652 2 HA2 GLY 1 1HA GLY 1 -20.629 18.275 -6.108 3 HA3 GLY 1 2HA GLY 1 -21.199 18.083 -4.448 4 H ALA 2 H ALA 2 -20.321 16.402 -3.146 5 HA ALA 2 HA ALA 2 -18.380 14.477 -4.112 6 HB1 ALA 2 1HB ALA 2 -16.885 16.486 -3.948 7 HB2 ALA 2 2HB ALA 2 -17.411 16.735 -2.270 8 HB3 ALA 2 3HB ALA 2 -16.516 15.265 -2.710 9 H GLU 3 H GLU 3 -20.104 13.256 -3.231 10 HA GLU 3 HA GLU 3 -20.718 13.413 -0.352 11 HB2 GLU 3 1HB GLU 3 -21.815 11.581 -2.530 12 HB3 GLU 3 2HB GLU 3 -22.389 11.706 -0.855 13 HG2 GLU 3 1HG GLU 3 -22.842 14.162 -1.272 14 HG3 GLU 3 2HG GLU 3 -22.458 13.890 -2.979 15 H ALA 4 H ALA 4 -20.953 10.583 0.079 16 HA ALA 4 HA ALA 4 -18.119 9.795 0.217 17 HB1 ALA 4 1HB ALA 4 -19.085 7.811 1.451 18 HB2 ALA 4 2HB ALA 4 -19.463 9.380 2.213 19 HB3 ALA 4 3HB ALA 4 -20.706 8.508 1.237 20 H LEU 5 H LEU 5 -18.189 9.895 -2.519 21 HA LEU 5 HA LEU 5 -19.463 7.927 -3.798 22 HB2 LEU 5 1HB LEU 5 -16.611 8.700 -4.456 23 HB3 LEU 5 2HB LEU 5 -17.987 8.520 -5.522 24 HG LEU 5 HG LEU 5 -17.591 10.711 -5.461 25 HD11 LEU 5 1HD1 LEU 5 -19.743 10.828 -3.463 26 HD12 LEU 5 2HD1 LEU 5 -19.946 10.077 -5.054 27 HD13 LEU 5 3HD1 LEU 5 -19.475 11.795 -4.929 28 HD21 LEU 5 3HD2 LEU 5 -15.978 11.251 -4.179 29 HD22 LEU 5 1HD2 LEU 5 -16.706 10.623 -2.720 30 HD23 LEU 5 2HD2 LEU 5 -17.290 12.165 -3.449 31 HA PRO 6 HA PRO 6 -17.110 4.236 -2.723 32 HB2 PRO 6 1HB PRO 6 -17.459 2.705 -4.934 33 HB3 PRO 6 2HB PRO 6 -18.823 3.075 -3.833 34 HG2 PRO 6 1HG PRO 6 -18.118 4.368 -6.464 35 HG3 PRO 6 2HG PRO 6 -19.719 3.880 -5.835 36 HD2 PRO 6 1HD PRO 6 -18.579 6.505 -5.683 37 HD3 PRO 6 2HD PRO 6 -19.931 5.955 -4.680 38 H LEU 7 H LEU 7 -15.258 3.188 -3.436 39 HA LEU 7 HA LEU 7 -13.056 4.782 -3.865 40 HB2 LEU 7 1HB LEU 7 -13.058 2.579 -2.845 41 HB3 LEU 7 2HB LEU 7 -13.466 1.847 -4.396 42 HG LEU 7 HG LEU 7 -11.234 2.656 -5.299 43 HD11 LEU 7 1HD1 LEU 7 -10.617 4.365 -3.726 44 HD12 LEU 7 2HD1 LEU 7 -9.484 3.035 -3.516 45 HD13 LEU 7 3HD1 LEU 7 -10.804 3.273 -2.350 46 HD21 LEU 7 3HD2 LEU 7 -11.527 0.626 -3.079 47 HD22 LEU 7 1HD2 LEU 7 -10.063 0.795 -4.065 48 HD23 LEU 7 2HD2 LEU 7 -11.629 0.382 -4.801 49 H TYR 8 H TYR 8 -12.329 5.906 -5.573 50 HA TYR 8 HA TYR 8 -12.845 4.923 -8.334 51 HB2 TYR 8 1HB TYR 8 -12.951 7.340 -8.934 52 HB3 TYR 8 2HB TYR 8 -14.229 6.726 -7.927 53 HD1 TYR 8 2HD TYR 8 -11.063 8.733 -7.804 54 HD2 TYR 8 1HD TYR 8 -14.799 7.764 -5.907 55 HE1 TYR 8 2HE TYR 8 -10.752 10.628 -6.233 56 HE2 TYR 8 1HE TYR 8 -14.533 9.640 -4.329 57 HH TYR 8 HH TYR 8 -11.682 11.844 -4.524 58 H TYR 9 H TYR 9 -10.231 5.121 -6.323 59 HA TYR 9 HA TYR 9 -8.364 5.219 -8.573 60 HB2 TYR 9 1HB TYR 9 -8.460 7.595 -7.732 61 HB3 TYR 9 2HB TYR 9 -8.175 6.937 -6.123 62 HD1 TYR 9 1HD TYR 9 -6.534 7.328 -9.462 63 HD2 TYR 9 2HD TYR 9 -5.998 6.666 -5.235 64 HE1 TYR 9 1HE TYR 9 -4.121 7.769 -9.711 65 HE2 TYR 9 2HE TYR 9 -3.601 7.171 -5.449 66 HH TYR 9 HH TYR 9 -2.064 7.676 -8.638 67 H LEU 10 H LEU 10 -6.455 3.919 -8.047 68 HA LEU 10 HA LEU 10 -6.220 3.126 -5.262 69 HB2 LEU 10 1HB LEU 10 -7.798 1.558 -6.500 70 HB3 LEU 10 2HB LEU 10 -6.390 1.070 -7.445 71 HG LEU 10 HG LEU 10 -6.518 -0.555 -5.971 72 HD11 LEU 10 1HD1 LEU 10 -4.715 -0.491 -4.395 73 HD12 LEU 10 2HD1 LEU 10 -4.789 1.269 -4.281 74 HD13 LEU 10 3HD1 LEU 10 -4.349 0.544 -5.813 75 HD21 LEU 10 3HD2 LEU 10 -8.115 -0.210 -4.261 76 HD22 LEU 10 1HD2 LEU 10 -7.598 1.485 -4.034 77 HD23 LEU 10 2HD2 LEU 10 -6.703 0.165 -3.288 78 H GLN 11 H GLN 11 -4.194 3.324 -4.836 79 HA GLN 11 HA GLN 11 -2.122 2.288 -6.537 80 HB2 GLN 11 1HB GLN 11 -2.426 5.253 -6.359 81 HB3 GLN 11 2HB GLN 11 -0.873 4.651 -5.875 82 HG2 GLN 11 1HG GLN 11 -0.296 4.950 -7.934 83 HG3 GLN 11 2HG GLN 11 -0.994 3.358 -8.226 84 HE21 GLN 11 1HE2 GLN 11 -3.557 3.595 -8.787 85 HE22 GLN 11 2HE2 GLN 11 -3.909 4.805 -9.983 86 H ILE 12 H ILE 12 -0.304 1.741 -5.379 87 HA ILE 12 HA ILE 12 -0.412 1.405 -2.561 88 HB ILE 12 HB ILE 12 1.990 1.422 -4.434 89 HG12 ILE 12 1HG1 ILE 12 0.500 -0.237 -5.267 90 HG13 ILE 12 2HG1 ILE 12 1.741 -1.083 -4.380 91 HG21 ILE 12 1HG2 ILE 12 3.201 0.060 -2.851 92 HG22 ILE 12 2HG2 ILE 12 2.715 1.538 -2.031 93 HG23 ILE 12 3HG2 ILE 12 1.842 0.041 -1.719 94 HD11 ILE 12 3HD1 ILE 12 0.085 -1.189 -2.402 95 HD12 ILE 12 1HD1 ILE 12 -1.144 -0.578 -3.530 96 HD13 ILE 12 2HD1 ILE 12 -0.340 -2.122 -3.837 97 H THR 13 H THR 13 0.977 4.066 -4.454 98 HA THR 13 HA THR 13 1.638 6.083 -4.014 99 HB THR 13 HB THR 13 -0.215 5.908 -1.631 100 HG1 THR 13 1HG THR 13 -0.699 6.376 -4.398 101 HG21 THR 13 3HG2 THR 13 0.943 8.095 -1.864 102 HG22 THR 13 1HG2 THR 13 -0.758 8.238 -2.353 103 HG23 THR 13 2HG2 THR 13 0.509 8.125 -3.595 104 H GLY 14 H GLY 14 2.182 4.326 -0.874 105 HA2 GLY 14 1HA GLY 14 4.877 5.508 -0.865 106 HA3 GLY 14 2HA GLY 14 3.852 5.904 0.521 107 H ILE 15 H ILE 15 6.337 4.280 0.511 108 HA ILE 15 HA ILE 15 5.288 1.773 1.608 109 HB ILE 15 HB ILE 15 5.666 1.574 -0.926 110 HG12 ILE 15 1HG1 ILE 15 7.189 -0.463 0.733 111 HG13 ILE 15 2HG1 ILE 15 5.424 -0.305 0.745 112 HG21 ILE 15 1HG2 ILE 15 8.606 1.240 -0.210 113 HG22 ILE 15 2HG2 ILE 15 7.864 1.257 -1.823 114 HG23 ILE 15 3HG2 ILE 15 7.966 2.743 -0.857 115 HD11 ILE 15 3HD1 ILE 15 5.437 -0.576 -1.764 116 HD12 ILE 15 1HD1 ILE 15 7.168 -0.983 -1.646 117 HD13 ILE 15 2HD1 ILE 15 5.952 -1.991 -0.842 118 H THR 16 H THR 16 6.796 0.716 2.968 119 HA THR 16 HA THR 16 9.533 1.320 2.798 120 HB THR 16 HB THR 16 9.026 3.302 4.089 121 HG1 THR 16 1HG THR 16 10.164 1.546 5.975 122 HG21 THR 16 3HG2 THR 16 7.934 1.575 6.340 123 HG22 THR 16 1HG2 THR 16 6.931 2.535 5.230 124 HG23 THR 16 2HG2 THR 16 8.080 3.346 6.289 125 H SER 17 H SER 17 10.657 0.032 4.756 126 HA SER 17 HA SER 17 8.964 -2.146 5.695 127 HB2 SER 17 1HB SER 17 10.218 -3.031 3.657 128 HB3 SER 17 2HB SER 17 11.717 -2.624 4.513 129 HG SER 17 HG SER 17 9.706 -4.271 5.665 130 H ASP 18 H ASP 18 10.245 -3.293 7.475 131 HA ASP 18 HA ASP 18 10.522 -1.306 9.502 132 HB2 ASP 18 1HB ASP 18 10.492 -3.151 11.040 133 HB3 ASP 18 2HB ASP 18 9.422 -3.535 9.738 134 H GLY 19 H GLY 19 12.974 -2.779 7.550 135 HA2 GLY 19 1HA GLY 19 15.074 -2.058 9.469 136 HA3 GLY 19 2HA GLY 19 15.266 -2.878 7.927 137 H ASN 20 H ASN 20 13.255 -0.577 6.967 138 HA ASN 20 HA ASN 20 15.487 0.724 5.656 139 HB2 ASN 20 1HB ASN 20 12.885 -0.119 4.863 140 HB3 ASN 20 2HB ASN 20 12.844 1.656 4.746 141 HD21 ASN 20 1HD2 ASN 20 12.838 1.645 2.342 142 HD22 ASN 20 2HD2 ASN 20 14.296 1.211 1.515 143 H ASP 21 H ASP 21 14.389 1.605 8.503 144 HA ASP 21 HA ASP 21 14.504 3.456 9.697 145 HB2 ASP 21 1HB ASP 21 16.336 4.234 8.097 146 HB3 ASP 21 2HB ASP 21 15.106 5.160 7.270 147 H PHE 22 H PHE 22 12.178 2.485 8.149 148 HA PHE 22 HA PHE 22 10.041 3.001 7.563 149 HB2 PHE 22 1HB PHE 22 10.410 4.893 9.876 150 HB3 PHE 22 2HB PHE 22 8.861 4.538 9.126 151 HD1 PHE 22 2HD PHE 22 11.810 2.697 10.714 152 HD2 PHE 22 1HD PHE 22 7.558 2.802 10.009 153 HE1 PHE 22 2HE PHE 22 11.559 0.598 11.953 154 HE2 PHE 22 1HE PHE 22 7.297 0.717 11.298 155 HZ PHE 22 HZ PHE 22 9.302 -0.417 12.270 156 H ALA 23 H ALA 23 12.213 4.260 6.106 157 HA ALA 23 HA ALA 23 11.542 6.879 5.250 158 HB1 ALA 23 1HB ALA 23 13.203 4.704 3.965 159 HB2 ALA 23 2HB ALA 23 13.158 6.413 3.451 160 HB3 ALA 23 3HB ALA 23 13.774 5.988 5.056 161 H TRP 24 H TRP 24 9.402 6.964 4.757 162 HA TRP 24 HA TRP 24 7.812 5.093 3.506 163 HB2 TRP 24 1HB TRP 24 7.573 7.990 4.320 164 HB3 TRP 24 2HB TRP 24 6.319 7.319 3.316 165 HD1 TRP 24 HD TRP 24 7.163 7.537 6.874 166 HE1 TRP 24 1HE TRP 24 5.733 5.982 8.237 167 HE3 TRP 24 3HE TRP 24 5.460 4.614 3.082 168 HZ2 TRP 24 2HZ TRP 24 3.741 3.883 7.683 169 HZ3 TRP 24 3HZ TRP 24 3.900 2.752 3.518 170 HH2 TRP 24 HH TRP 24 2.998 2.392 5.816 171 H ASP 25 H ASP 25 9.871 6.934 1.722 172 HA ASP 25 HA ASP 25 9.979 7.637 -0.498 173 HB2 ASP 25 1HB ASP 25 9.328 4.694 -0.433 174 HB3 ASP 25 2HB ASP 25 9.830 5.564 -1.892 175 H ASN 26 H ASN 26 8.474 9.173 -1.101 176 HA ASN 26 HA ASN 26 5.729 8.561 -1.796 177 HB2 ASN 26 1HB ASN 26 7.529 10.940 -2.073 178 HB3 ASN 26 2HB ASN 26 6.365 10.739 -3.370 179 HD21 ASN 26 1HD2 ASN 26 6.126 10.276 0.237 180 HD22 ASN 26 2HD2 ASN 26 4.670 11.255 0.344 181 H LEU 27 H LEU 27 5.393 6.994 -3.203 182 HA LEU 27 HA LEU 27 7.208 6.246 -5.272 183 HB2 LEU 27 1HB LEU 27 4.251 5.563 -5.077 184 HB3 LEU 27 2HB LEU 27 5.465 4.685 -6.007 185 HG LEU 27 HG LEU 27 5.260 4.922 -2.990 186 HD11 LEU 27 1HD1 LEU 27 3.630 3.402 -4.045 187 HD12 LEU 27 2HD1 LEU 27 4.787 2.528 -3.027 188 HD13 LEU 27 3HD1 LEU 27 4.959 2.497 -4.794 189 HD21 LEU 27 3HD2 LEU 27 7.677 4.802 -3.664 190 HD22 LEU 27 1HD2 LEU 27 7.321 3.215 -4.412 191 HD23 LEU 27 2HD2 LEU 27 7.093 3.478 -2.688 192 H THR 28 H THR 28 7.218 6.617 -7.474 193 HA THR 28 HA THR 28 6.181 9.092 -8.340 194 HB THR 28 HB THR 28 6.786 7.776 -10.657 195 HG1 THR 28 1HG THR 28 8.269 6.379 -10.450 196 HG21 THR 28 3HG2 THR 28 7.753 9.916 -9.885 197 HG22 THR 28 1HG2 THR 28 9.033 8.833 -10.448 198 HG23 THR 28 2HG2 THR 28 8.759 9.053 -8.703 199 H SER 29 H SER 29 4.793 9.548 -10.114 200 HA SER 29 HA SER 29 2.256 8.780 -9.399 201 HB2 SER 29 1HB SER 29 2.889 10.056 -12.062 202 HB3 SER 29 2HB SER 29 1.541 10.381 -10.968 203 HG SER 29 HG SER 29 3.154 11.245 -9.468 204 H SER 30 H SER 30 4.224 7.294 -11.887 205 HA SER 30 HA SER 30 2.191 5.202 -12.073 206 HB2 SER 30 1HB SER 30 2.422 4.939 -14.506 207 HB3 SER 30 2HB SER 30 1.630 6.443 -14.038 208 HG SER 30 HG SER 30 4.115 5.996 -15.235 209 H GLN 31 H GLN 31 4.289 5.228 -10.402 210 HA GLN 31 HA GLN 31 6.696 4.080 -11.377 211 HB2 GLN 31 1HB GLN 31 6.138 4.964 -9.018 212 HB3 GLN 31 2HB GLN 31 5.324 3.441 -8.726 213 HG2 GLN 31 1HG GLN 31 7.505 2.335 -9.268 214 HG3 GLN 31 2HG GLN 31 8.272 3.916 -9.345 215 HE21 GLN 31 1HE2 GLN 31 9.218 4.536 -7.365 216 HE22 GLN 31 2HE2 GLN 31 8.632 4.003 -5.800 217 H THR 32 H THR 32 7.315 1.897 -11.600 218 HA THR 32 HA THR 32 5.284 -0.248 -11.359 219 HB THR 32 HB THR 32 6.447 -1.178 -13.473 220 HG1 THR 32 1HG THR 32 7.182 0.513 -14.854 221 HG21 THR 32 3HG2 THR 32 4.735 1.299 -13.767 222 HG22 THR 32 1HG2 THR 32 4.142 -0.321 -13.313 223 HG23 THR 32 2HG2 THR 32 4.865 -0.071 -14.898 224 H LYS 33 H LYS 33 8.214 0.913 -10.312 225 HA LYS 33 HA LYS 33 9.046 -1.703 -9.292 226 HB2 LYS 33 1HB LYS 33 10.244 -0.567 -11.625 227 HB3 LYS 33 2HB LYS 33 11.372 -0.205 -10.309 228 HG2 LYS 33 1HG LYS 33 11.526 -2.537 -9.700 229 HG3 LYS 33 2HG LYS 33 10.121 -2.905 -10.723 230 HD2 LYS 33 1HD LYS 33 11.433 -2.343 -12.764 231 HD3 LYS 33 2HD LYS 33 12.809 -1.927 -11.743 232 HE2 LYS 33 1HE LYS 33 13.291 -4.084 -12.496 233 HE3 LYS 33 2HE LYS 33 12.744 -4.307 -10.835 234 HZ1 LYS 33 3HZ LYS 33 11.066 -4.785 -13.218 235 HZ2 LYS 33 1HZ LYS 33 10.648 -5.123 -11.661 236 HZ3 LYS 33 2HZ LYS 33 11.861 -5.932 -12.331 237 H ALA 34 H ALA 34 10.155 -1.598 -7.417 238 HA ALA 34 HA ALA 34 9.451 0.464 -5.750 239 HB1 ALA 34 1HB ALA 34 9.952 -1.830 -5.024 240 HB2 ALA 34 2HB ALA 34 11.682 -1.597 -5.401 241 HB3 ALA 34 3HB ALA 34 10.926 -0.697 -4.079 242 HA PRO 35 HA PRO 35 12.637 3.588 -5.842 243 HB2 PRO 35 1HB PRO 35 13.067 3.974 -3.108 244 HB3 PRO 35 2HB PRO 35 11.762 4.750 -4.072 245 HG2 PRO 35 1HG PRO 35 11.596 2.262 -2.350 246 HG3 PRO 35 2HG PRO 35 10.397 3.571 -2.509 247 HD2 PRO 35 1HD PRO 35 10.056 1.264 -3.741 248 HD3 PRO 35 2HD PRO 35 9.665 2.785 -4.585 249 H ASN 36 H ASN 36 13.251 1.024 -3.196 250 HA ASN 36 HA ASN 36 15.834 0.485 -4.324 251 HB2 ASN 36 1HB ASN 36 15.508 1.190 -1.369 252 HB3 ASN 36 2HB ASN 36 16.988 0.739 -2.188 253 HD21 ASN 36 1HD2 ASN 36 17.416 2.381 -4.198 254 HD22 ASN 36 2HD2 ASN 36 17.379 4.044 -3.619 255 H VAL 37 H VAL 37 16.549 -1.386 -2.635 256 HA VAL 37 HA VAL 37 14.282 -3.111 -1.969 257 HB VAL 37 HB VAL 37 16.101 -4.257 -2.686 258 HG11 VAL 37 1HG1 VAL 37 17.883 -2.675 -1.011 259 HG12 VAL 37 2HG1 VAL 37 18.322 -4.221 -1.856 260 HG13 VAL 37 3HG1 VAL 37 17.704 -2.868 -2.793 261 HG21 VAL 37 3HG2 VAL 37 15.100 -4.975 -0.315 262 HG22 VAL 37 1HG2 VAL 37 16.285 -5.873 -1.252 263 HG23 VAL 37 2HG2 VAL 37 16.805 -4.783 0.096 264 H LEU 38 H LEU 38 13.359 -3.056 -0.444 265 HA LEU 38 HA LEU 38 13.358 -1.420 1.862 266 HB2 LEU 38 1HB LEU 38 11.606 -3.804 1.305 267 HB3 LEU 38 2HB LEU 38 11.294 -2.321 2.186 268 HG LEU 38 HG LEU 38 10.167 -2.255 0.249 269 HD11 LEU 38 1HD1 LEU 38 11.149 -0.146 0.972 270 HD12 LEU 38 2HD1 LEU 38 10.738 -0.169 -0.766 271 HD13 LEU 38 3HD1 LEU 38 12.428 -0.381 -0.261 272 HD21 LEU 38 3HD2 LEU 38 11.238 -3.927 -0.935 273 HD22 LEU 38 1HD2 LEU 38 12.245 -2.659 -1.706 274 HD23 LEU 38 2HD2 LEU 38 10.483 -2.578 -1.820 275 H LYS 39 H LYS 39 15.203 -2.053 3.220 276 HA LYS 39 HA LYS 39 15.741 -4.867 3.768 277 HB2 LYS 39 1HB LYS 39 16.587 -2.443 5.403 278 HB3 LYS 39 2HB LYS 39 17.331 -4.054 5.415 279 HG2 LYS 39 1HG LYS 39 18.032 -3.763 3.038 280 HG3 LYS 39 2HG LYS 39 17.257 -2.177 3.003 281 HD2 LYS 39 1HD LYS 39 18.865 -1.772 5.125 282 HD3 LYS 39 2HD LYS 39 19.842 -2.976 4.252 283 HE2 LYS 39 1HE LYS 39 19.575 -1.567 2.164 284 HE3 LYS 39 2HE LYS 39 18.668 -0.390 3.120 285 HZ1 LYS 39 3HZ LYS 39 20.702 -0.191 4.527 286 HZ2 LYS 39 1HZ LYS 39 20.867 0.372 2.991 287 HZ3 LYS 39 2HZ LYS 39 21.520 -1.077 3.388 288 H GLY 40 H GLY 40 15.076 -6.071 5.584 289 HA2 GLY 40 1HA GLY 40 14.003 -6.121 7.847 290 HA3 GLY 40 2HA GLY 40 12.916 -4.847 7.280 291 H ASN 41 H ASN 41 11.317 -6.589 8.019 292 HA ASN 41 HA ASN 41 10.694 -8.385 5.677 293 HB2 ASN 41 1HB ASN 41 11.794 -9.521 7.715 294 HB3 ASN 41 2HB ASN 41 10.264 -9.243 8.543 295 HD21 ASN 41 1HD2 ASN 41 8.293 -9.930 6.876 296 HD22 ASN 41 2HD2 ASN 41 8.455 -11.580 6.327 297 H LYS 42 H LYS 42 9.438 -6.311 8.251 298 HA LYS 42 HA LYS 42 6.645 -6.919 7.485 299 HB2 LYS 42 1HB LYS 42 7.943 -4.999 9.446 300 HB3 LYS 42 2HB LYS 42 6.305 -4.736 8.936 301 HG2 LYS 42 1HG LYS 42 7.403 -7.136 10.430 302 HG3 LYS 42 2HG LYS 42 6.294 -5.895 11.019 303 HD2 LYS 42 1HD LYS 42 4.693 -6.745 9.108 304 HD3 LYS 42 2HD LYS 42 5.749 -8.164 9.076 305 HE2 LYS 42 1HE LYS 42 3.946 -7.179 11.304 306 HE3 LYS 42 2HE LYS 42 3.946 -8.749 10.487 307 HZ1 LYS 42 3HZ LYS 42 5.872 -7.724 12.460 308 HZ2 LYS 42 1HZ LYS 42 6.170 -9.105 11.586 309 HZ3 LYS 42 2HZ LYS 42 4.884 -9.018 12.598 310 H LEU 43 H LEU 43 5.619 -5.912 5.926 311 HA LEU 43 HA LEU 43 7.115 -3.938 4.311 312 HB2 LEU 43 1HB LEU 43 6.198 -6.416 3.605 313 HB3 LEU 43 2HB LEU 43 4.760 -5.470 3.237 314 HG LEU 43 HG LEU 43 7.574 -5.066 2.163 315 HD11 LEU 43 1HD1 LEU 43 4.995 -5.897 0.760 316 HD12 LEU 43 2HD1 LEU 43 6.336 -6.978 1.212 317 HD13 LEU 43 3HD1 LEU 43 6.593 -5.713 0.011 318 HD21 LEU 43 3HD2 LEU 43 5.066 -3.449 1.521 319 HD22 LEU 43 1HD2 LEU 43 6.630 -3.369 0.686 320 HD23 LEU 43 2HD2 LEU 43 6.538 -2.849 2.352 321 H TYR 44 H TYR 44 6.382 -1.895 4.795 322 HA TYR 44 HA TYR 44 3.619 -1.600 5.836 323 HB2 TYR 44 1HB TYR 44 5.966 0.299 6.020 324 HB3 TYR 44 2HB TYR 44 4.377 0.517 6.718 325 HD1 TYR 44 1HD TYR 44 3.536 -1.589 8.229 326 HD2 TYR 44 2HD TYR 44 7.645 -0.486 7.482 327 HE1 TYR 44 1HE TYR 44 4.228 -2.748 10.302 328 HE2 TYR 44 2HE TYR 44 8.322 -1.575 9.557 329 HH TYR 44 HH TYR 44 7.630 -2.829 11.430 330 H VAL 45 H VAL 45 2.182 -0.727 4.543 331 HA VAL 45 HA VAL 45 3.040 0.943 2.204 332 HB VAL 45 HB VAL 45 0.801 -1.102 2.414 333 HG11 VAL 45 1HG1 VAL 45 0.392 -0.492 0.004 334 HG12 VAL 45 2HG1 VAL 45 -0.086 0.718 1.199 335 HG13 VAL 45 3HG1 VAL 45 1.407 0.948 0.274 336 HG21 VAL 45 3HG2 VAL 45 3.075 -2.052 1.969 337 HG22 VAL 45 1HG2 VAL 45 1.944 -2.270 0.642 338 HG23 VAL 45 2HG2 VAL 45 3.193 -1.008 0.537 339 H LYS 46 H LYS 46 1.772 2.762 1.835 340 HA LYS 46 HA LYS 46 -0.308 3.549 3.824 341 HB2 LYS 46 1HB LYS 46 1.883 4.656 4.276 342 HB3 LYS 46 2HB LYS 46 1.915 5.265 2.618 343 HG2 LYS 46 1HG LYS 46 -0.366 6.401 3.271 344 HG3 LYS 46 2HG LYS 46 0.081 5.994 4.913 345 HD2 LYS 46 1HD LYS 46 1.712 7.698 2.973 346 HD3 LYS 46 2HD LYS 46 0.700 8.315 4.284 347 HE2 LYS 46 1HE LYS 46 2.136 7.198 5.957 348 HE3 LYS 46 2HE LYS 46 3.159 6.535 4.667 349 HZ1 LYS 46 3HZ LYS 46 3.781 8.773 4.066 350 HZ2 LYS 46 1HZ LYS 46 4.090 8.576 5.659 351 HZ3 LYS 46 2HZ LYS 46 2.755 9.417 5.186 352 H ALA 47 H ALA 47 -1.722 2.597 2.169 353 HA ALA 47 HA ALA 47 -1.384 3.628 -0.580 354 HB1 ALA 47 1HB ALA 47 -3.275 1.473 0.352 355 HB2 ALA 47 2HB ALA 47 -2.805 1.928 -1.318 356 HB3 ALA 47 3HB ALA 47 -1.623 1.203 -0.259 357 H ARG 48 H ARG 48 -2.734 4.917 -1.667 358 HA ARG 48 HA ARG 48 -4.425 6.546 0.118 359 HB2 ARG 48 1HB ARG 48 -2.704 7.622 -1.172 360 HB3 ARG 48 2HB ARG 48 -3.314 6.944 -2.684 361 HG2 ARG 48 1HG ARG 48 -4.684 8.662 -2.979 362 HG3 ARG 48 2HG ARG 48 -5.533 8.350 -1.501 363 HD2 ARG 48 1HD ARG 48 -4.704 10.591 -1.323 364 HD3 ARG 48 2HD ARG 48 -3.725 9.597 -0.239 365 HE ARG 48 HE ARG 48 -1.864 10.033 -1.488 366 HH11 ARG 48 1HH1 ARG 48 -4.706 11.225 -3.354 367 HH12 ARG 48 2HH1 ARG 48 -3.721 12.263 -4.329 368 HH21 ARG 48 1HH2 ARG 48 -0.636 11.330 -2.882 369 HH22 ARG 48 2HH2 ARG 48 -1.401 12.284 -4.106 370 H PHE 49 H PHE 49 -6.435 5.614 0.291 371 HA PHE 49 HA PHE 49 -7.790 4.462 -2.126 372 HB2 PHE 49 1HB PHE 49 -8.589 4.414 0.812 373 HB3 PHE 49 2HB PHE 49 -9.556 3.775 -0.514 374 HD1 PHE 49 1HD PHE 49 -6.362 3.473 1.286 375 HD2 PHE 49 2HD PHE 49 -8.965 1.528 -1.560 376 HE1 PHE 49 1HE PHE 49 -5.136 1.404 1.578 377 HE2 PHE 49 2HE PHE 49 -7.955 -0.641 -0.982 378 HZ PHE 49 HZ PHE 49 -6.080 -0.771 0.620 379 H MET 50 H MET 50 -8.440 6.164 -3.353 380 HA MET 50 HA MET 50 -9.720 8.474 -2.069 381 HB2 MET 50 1HB MET 50 -9.649 8.014 -5.050 382 HB3 MET 50 2HB MET 50 -9.806 9.518 -4.186 383 HG2 MET 50 1HG MET 50 -7.291 7.934 -3.834 384 HG3 MET 50 2HG MET 50 -7.554 8.741 -5.370 385 HE1 MET 50 3HE MET 50 -7.747 9.363 -1.477 386 HE2 MET 50 1HE MET 50 -7.467 11.116 -1.382 387 HE3 MET 50 2HE MET 50 -8.960 10.506 -2.125 388 H GLY 51 H GLY 51 -11.525 7.741 -1.183 389 HA2 GLY 51 1HA GLY 51 -13.929 7.753 -1.662 390 HA3 GLY 51 2HA GLY 51 -13.683 6.581 -2.926 391 H TYR 52 H TYR 52 -15.571 6.099 -1.036 392 HA TYR 52 HA TYR 52 -14.657 4.671 1.271 393 HB2 TYR 52 1HB TYR 52 -17.226 5.450 0.092 394 HB3 TYR 52 2HB TYR 52 -17.277 3.800 0.652 395 HD1 TYR 52 1HD TYR 52 -17.078 3.198 3.048 396 HD2 TYR 52 2HD TYR 52 -16.865 7.288 1.698 397 HE1 TYR 52 1HE TYR 52 -17.367 4.019 5.373 398 HE2 TYR 52 2HE TYR 52 -17.135 8.096 4.005 399 HH TYR 52 HH TYR 52 -17.299 7.495 6.211 400 H THR 53 H THR 53 -13.928 2.648 1.452 401 HA THR 53 HA THR 53 -15.209 0.502 0.157 402 HB THR 53 HB THR 53 -13.594 0.688 -1.636 403 HG1 THR 53 1HG THR 53 -12.239 -1.069 0.084 404 HG21 THR 53 3HG2 THR 53 -11.583 1.213 0.560 405 HG22 THR 53 1HG2 THR 53 -11.951 2.205 -0.840 406 HG23 THR 53 2HG2 THR 53 -11.071 0.658 -1.020 407 H LYS 54 H LYS 54 -14.959 -1.290 1.407 408 HA LYS 54 HA LYS 54 -13.181 -1.169 3.765 409 HB2 LYS 54 1HB LYS 54 -16.195 -1.556 3.793 410 HB3 LYS 54 2HB LYS 54 -15.170 -2.149 5.116 411 HG2 LYS 54 1HG LYS 54 -14.325 0.081 5.558 412 HG3 LYS 54 2HG LYS 54 -15.227 0.746 4.187 413 HD2 LYS 54 1HD LYS 54 -17.360 0.176 5.234 414 HD3 LYS 54 2HD LYS 54 -16.507 -0.522 6.639 415 HE2 LYS 54 1HE LYS 54 -15.483 1.620 7.149 416 HE3 LYS 54 2HE LYS 54 -16.078 2.325 5.642 417 HZ1 LYS 54 3HZ LYS 54 -18.325 2.160 6.497 418 HZ2 LYS 54 1HZ LYS 54 -17.379 2.985 7.565 419 HZ3 LYS 54 2HZ LYS 54 -17.794 1.437 7.878 420 H LEU 55 H LEU 55 -13.267 -2.592 1.079 421 HA LEU 55 HA LEU 55 -13.115 -5.415 2.027 422 HB2 LEU 55 1HB LEU 55 -14.313 -4.383 -0.557 423 HB3 LEU 55 2HB LEU 55 -13.937 -6.064 -0.248 424 HG LEU 55 HG LEU 55 -16.234 -5.852 -0.134 425 HD11 LEU 55 1HD1 LEU 55 -15.228 -6.035 2.725 426 HD12 LEU 55 2HD1 LEU 55 -15.271 -7.350 1.540 427 HD13 LEU 55 3HD1 LEU 55 -16.786 -6.626 2.130 428 HD21 LEU 55 3HD2 LEU 55 -17.550 -4.384 1.164 429 HD22 LEU 55 1HD2 LEU 55 -16.377 -3.386 0.297 430 HD23 LEU 55 2HD2 LEU 55 -16.157 -3.736 2.030 431 H THR 56 H THR 56 -10.828 -4.328 2.237 432 HA THR 56 HA THR 56 -9.359 -4.245 -0.325 433 HB THR 56 HB THR 56 -8.233 -4.304 2.513 434 HG1 THR 56 1HG THR 56 -9.078 -2.441 2.674 435 HG21 THR 56 3HG2 THR 56 -6.613 -4.769 0.680 436 HG22 THR 56 1HG2 THR 56 -6.299 -3.212 1.441 437 HG23 THR 56 2HG2 THR 56 -7.133 -3.272 -0.132 438 H VAL 57 H VAL 57 -8.354 -6.028 -1.198 439 HA VAL 57 HA VAL 57 -7.947 -8.401 0.478 440 HB VAL 57 HB VAL 57 -8.750 -8.268 -2.466 441 HG11 VAL 57 1HG1 VAL 57 -8.768 -10.781 -2.347 442 HG12 VAL 57 2HG1 VAL 57 -7.152 -10.076 -2.280 443 HG13 VAL 57 3HG1 VAL 57 -7.920 -10.675 -0.797 444 HG21 VAL 57 3HG2 VAL 57 -10.162 -9.542 -0.080 445 HG22 VAL 57 1HG2 VAL 57 -10.658 -8.037 -0.865 446 HG23 VAL 57 2HG2 VAL 57 -10.727 -9.558 -1.759 447 H ILE 58 H ILE 58 -5.943 -9.359 0.255 448 HA ILE 58 HA ILE 58 -3.936 -8.256 -1.606 449 HB ILE 58 HB ILE 58 -3.538 -8.932 1.345 450 HG12 ILE 58 1HG1 ILE 58 -2.795 -6.234 0.210 451 HG13 ILE 58 2HG1 ILE 58 -4.471 -6.512 0.616 452 HG21 ILE 58 1HG2 ILE 58 -1.164 -8.270 0.965 453 HG22 ILE 58 2HG2 ILE 58 -1.617 -9.644 -0.049 454 HG23 ILE 58 3HG2 ILE 58 -1.511 -8.028 -0.759 455 HD11 ILE 58 3HD1 ILE 58 -3.862 -7.117 2.947 456 HD12 ILE 58 1HD1 ILE 58 -2.152 -6.818 2.563 457 HD13 ILE 58 2HD1 ILE 58 -3.330 -5.491 2.503 458 H THR 59 H THR 59 -3.797 -10.082 -2.967 459 HA THR 59 HA THR 59 -4.997 -12.487 -2.244 460 HB THR 59 HB THR 59 -2.984 -11.911 -4.462 461 HG1 THR 59 1HG THR 59 -4.832 -11.637 -5.700 462 HG21 THR 59 3HG2 THR 59 -4.166 -13.755 -5.686 463 HG22 THR 59 1HG2 THR 59 -5.067 -14.126 -4.199 464 HG23 THR 59 2HG2 THR 59 -3.294 -14.298 -4.276 465 H GLY 60 H GLY 60 -1.530 -11.619 -2.169 466 HA2 GLY 60 1HA GLY 60 0.217 -12.673 -1.112 467 HA3 GLY 60 2HA GLY 60 -0.976 -13.591 -0.179 468 H LYS 61 H LYS 61 1.037 -15.126 -0.516 469 HA LYS 61 HA LYS 61 1.529 -16.329 -2.986 470 HB2 LYS 61 1HB LYS 61 3.162 -15.961 -1.241 471 HB3 LYS 61 2HB LYS 61 2.117 -16.622 0.004 472 HG2 LYS 61 1HG LYS 61 2.314 -18.720 -0.757 473 HG3 LYS 61 2HG LYS 61 3.229 -18.301 -2.231 474 HD2 LYS 61 1HD LYS 61 4.191 -18.057 0.672 475 HD3 LYS 61 2HD LYS 61 4.749 -19.224 -0.521 476 HE2 LYS 61 1HE LYS 61 5.670 -17.299 -1.889 477 HE3 LYS 61 2HE LYS 61 5.230 -16.205 -0.573 478 HZ1 LYS 61 3HZ LYS 61 7.522 -16.895 -0.384 479 HZ2 LYS 61 1HZ LYS 61 7.103 -18.489 -0.269 480 HZ3 LYS 61 2HZ LYS 61 6.691 -17.401 0.890 481 H ASP 62 H ASP 62 -0.214 -17.213 -0.035 482 HA ASP 62 HA ASP 62 -1.258 -19.691 -0.626 483 HB2 ASP 62 1HB ASP 62 -2.364 -17.337 0.943 484 HB3 ASP 62 2HB ASP 62 -3.275 -18.827 0.802 485 H GLY 63 H GLY 63 -2.413 -16.554 -1.933 486 HA2 GLY 63 1HA GLY 63 -3.941 -16.209 -3.645 487 HA3 GLY 63 2HA GLY 63 -4.309 -17.922 -3.707 488 H LYS 64 H LYS 64 -4.394 -16.085 -0.668 489 HA LYS 64 HA LYS 64 -7.325 -15.905 -0.686 490 HB2 LYS 64 1HB LYS 64 -5.715 -17.223 1.531 491 HB3 LYS 64 2HB LYS 64 -7.388 -16.682 1.653 492 HG2 LYS 64 1HG LYS 64 -7.599 -18.322 -0.538 493 HG3 LYS 64 2HG LYS 64 -6.239 -19.088 0.299 494 HD2 LYS 64 1HD LYS 64 -8.144 -20.143 1.245 495 HD3 LYS 64 2HD LYS 64 -7.708 -18.910 2.436 496 HE2 LYS 64 1HE LYS 64 -9.388 -17.401 0.978 497 HE3 LYS 64 2HE LYS 64 -9.995 -18.982 0.438 498 HZ1 LYS 64 3HZ LYS 64 -10.221 -19.475 2.887 499 HZ2 LYS 64 1HZ LYS 64 -11.270 -18.373 2.282 500 HZ3 LYS 64 2HZ LYS 64 -9.964 -17.880 3.171 501 H ASN 65 H ASN 65 -7.979 -14.293 0.932 502 HA ASN 65 HA ASN 65 -6.315 -12.005 0.721 503 HB2 ASN 65 1HB ASN 65 -8.813 -11.954 0.940 504 HB3 ASN 65 2HB ASN 65 -8.641 -12.428 2.634 505 HD21 ASN 65 1HD2 ASN 65 -9.972 -10.104 2.245 506 HD22 ASN 65 2HD2 ASN 65 -8.967 -8.781 2.781 507 H LEU 66 H LEU 66 -4.344 -11.964 1.707 508 HA LEU 66 HA LEU 66 -3.557 -13.242 4.070 509 HB2 LEU 66 1HB LEU 66 -2.578 -10.562 3.009 510 HB3 LEU 66 2HB LEU 66 -1.772 -11.526 4.244 511 HG LEU 66 HG LEU 66 -2.166 -12.318 1.328 512 HD11 LEU 66 1HD1 LEU 66 0.289 -12.057 1.265 513 HD12 LEU 66 2HD1 LEU 66 0.315 -11.620 2.984 514 HD13 LEU 66 3HD1 LEU 66 -0.462 -10.551 1.800 515 HD21 LEU 66 3HD2 LEU 66 -2.246 -14.362 2.643 516 HD22 LEU 66 1HD2 LEU 66 -0.894 -13.822 3.672 517 HD23 LEU 66 2HD2 LEU 66 -0.622 -14.244 1.968 518 H LEU 67 H LEU 67 -5.233 -10.182 3.684 519 HA LEU 67 HA LEU 67 -4.825 -9.153 6.324 520 HB2 LEU 67 1HB LEU 67 -5.536 -8.080 4.061 521 HB3 LEU 67 2HB LEU 67 -7.157 -8.630 4.472 522 HG LEU 67 HG LEU 67 -6.604 -7.255 6.719 523 HD11 LEU 67 1HD1 LEU 67 -5.345 -5.230 6.228 524 HD12 LEU 67 2HD1 LEU 67 -4.949 -5.839 4.611 525 HD13 LEU 67 3HD1 LEU 67 -4.331 -6.684 6.060 526 HD21 LEU 67 3HD2 LEU 67 -7.802 -5.354 5.693 527 HD22 LEU 67 1HD2 LEU 67 -8.495 -6.894 5.150 528 HD23 LEU 67 2HD2 LEU 67 -7.431 -5.986 4.069 529 H TYR 68 H TYR 68 -6.893 -11.610 5.048 530 HA TYR 68 HA TYR 68 -8.452 -11.746 7.576 531 HB2 TYR 68 1HB TYR 68 -9.588 -11.444 5.265 532 HB3 TYR 68 2HB TYR 68 -9.110 -13.104 4.951 533 HD1 TYR 68 1HD TYR 68 -10.901 -10.967 7.513 534 HD2 TYR 68 2HD TYR 68 -10.607 -14.836 5.612 535 HE1 TYR 68 1HE TYR 68 -12.858 -11.735 8.793 536 HE2 TYR 68 2HE TYR 68 -12.581 -15.595 6.858 537 HH TYR 68 HH TYR 68 -13.858 -15.155 8.750 538 H ASN 69 H ASN 69 -5.619 -13.061 6.170 539 HA ASN 69 HA ASN 69 -5.962 -15.765 7.050 540 HB2 ASN 69 1HB ASN 69 -4.501 -15.050 5.099 541 HB3 ASN 69 2HB ASN 69 -3.448 -14.227 6.255 542 HD21 ASN 69 1HD2 ASN 69 -5.109 -17.423 5.897 543 HD22 ASN 69 2HD2 ASN 69 -3.741 -18.319 6.487 544 H GLY 70 H GLY 70 -3.948 -12.912 8.068 545 HA2 GLY 70 1HA GLY 70 -4.525 -12.855 10.704 546 HA3 GLY 70 2HA GLY 70 -3.403 -14.206 10.657 547 H THR 71 H THR 71 -1.621 -13.044 8.539 548 HA THR 71 HA THR 71 -0.002 -11.632 10.514 549 HB THR 71 HB THR 71 0.741 -11.895 7.596 550 HG1 THR 71 1HG THR 71 0.682 -13.934 9.543 551 HG21 THR 71 3HG2 THR 71 2.361 -12.025 10.171 552 HG22 THR 71 1HG2 THR 71 2.309 -10.676 9.016 553 HG23 THR 71 2HG2 THR 71 3.007 -12.229 8.529 554 H ALA 72 H ALA 72 -1.580 -10.826 7.442 555 HA ALA 72 HA ALA 72 -0.718 -8.013 7.520 556 HB1 ALA 72 1HB ALA 72 -0.937 -9.198 5.361 557 HB2 ALA 72 2HB ALA 72 -2.615 -9.596 5.739 558 HB3 ALA 72 3HB ALA 72 -2.167 -7.923 5.446 559 H LYS 73 H LYS 73 -1.928 -6.359 8.283 560 HA LYS 73 HA LYS 73 -4.771 -6.615 8.698 561 HB2 LYS 73 1HB LYS 73 -4.424 -5.496 11.016 562 HB3 LYS 73 2HB LYS 73 -4.450 -7.252 10.858 563 HG2 LYS 73 1HG LYS 73 -1.749 -5.949 10.796 564 HG3 LYS 73 2HG LYS 73 -2.627 -5.871 12.318 565 HD2 LYS 73 1HD LYS 73 -2.919 -8.316 12.365 566 HD3 LYS 73 2HD LYS 73 -2.172 -8.460 10.796 567 HE2 LYS 73 1HE LYS 73 -0.503 -9.094 12.295 568 HE3 LYS 73 2HE LYS 73 -0.041 -7.467 11.795 569 HZ1 LYS 73 3HZ LYS 73 0.086 -7.940 14.254 570 HZ2 LYS 73 1HZ LYS 73 -1.559 -8.019 14.274 571 HZ3 LYS 73 2HZ LYS 73 -0.803 -6.626 13.872 572 H MET 74 H MET 74 -5.749 -4.564 8.794 573 HA MET 74 HA MET 74 -4.115 -2.201 8.132 574 HB2 MET 74 1HB MET 74 -6.615 -2.581 7.333 575 HB3 MET 74 2HB MET 74 -7.021 -2.317 9.014 576 HG2 MET 74 1HG MET 74 -5.882 -0.096 8.916 577 HG3 MET 74 2HG MET 74 -5.456 -0.405 7.228 578 HE1 MET 74 3HE MET 74 -8.825 -1.232 9.146 579 HE2 MET 74 1HE MET 74 -8.155 0.277 9.830 580 HE3 MET 74 2HE MET 74 -9.691 0.315 8.925 581 H PHE 75 H PHE 75 -3.205 -1.099 9.884 582 HA PHE 75 HA PHE 75 -4.465 -1.521 12.577 583 HB2 PHE 75 1HB PHE 75 -2.344 -1.650 13.615 584 HB3 PHE 75 2HB PHE 75 -2.382 -2.842 12.330 585 HD1 PHE 75 2HD PHE 75 -1.111 -2.423 10.196 586 HD2 PHE 75 1HD PHE 75 -0.815 0.250 13.563 587 HE1 PHE 75 2HE PHE 75 1.025 -1.500 9.295 588 HE2 PHE 75 1HE PHE 75 1.253 1.196 12.637 589 HZ PHE 75 HZ PHE 75 2.250 0.227 10.541 590 H LYS 76 H LYS 76 -3.863 0.772 10.209 591 HA LYS 76 HA LYS 76 -4.539 2.886 12.038 592 HB2 LYS 76 1HB LYS 76 -2.226 3.137 12.376 593 HB3 LYS 76 2HB LYS 76 -1.796 2.756 10.737 594 HG2 LYS 76 1HG LYS 76 -2.736 4.898 9.953 595 HG3 LYS 76 2HG LYS 76 -3.258 5.281 11.575 596 HD2 LYS 76 1HD LYS 76 -0.887 5.356 12.334 597 HD3 LYS 76 2HD LYS 76 -0.352 4.803 10.755 598 HE2 LYS 76 1HE LYS 76 -0.072 7.190 10.738 599 HE3 LYS 76 2HE LYS 76 -1.549 6.908 9.814 600 HZ1 LYS 76 3HZ LYS 76 -2.686 7.338 12.085 601 HZ2 LYS 76 1HZ LYS 76 -2.119 8.616 11.242 602 HZ3 LYS 76 2HZ LYS 76 -1.260 8.023 12.516 603 H SER 77 H SER 77 -5.598 4.575 10.831 604 HA SER 77 HA SER 77 -5.725 4.296 7.903 605 HB2 SER 77 1HB SER 77 -8.233 4.132 8.027 606 HB3 SER 77 2HB SER 77 -7.371 2.672 8.560 607 HG SER 77 HG SER 77 -8.332 4.696 10.296 608 H ASP 78 H ASP 78 -4.833 6.353 7.838 609 HA ASP 78 HA ASP 78 -6.028 8.486 9.527 610 HB2 ASP 78 1HB ASP 78 -3.424 8.071 8.784 611 HB3 ASP 78 2HB ASP 78 -3.944 9.209 7.530 612 H ALA 79 H ALA 79 -6.390 10.622 8.364 613 HA ALA 79 HA ALA 79 -8.434 10.043 6.279 614 HB1 ALA 79 1HB ALA 79 -9.097 11.358 8.238 615 HB2 ALA 79 2HB ALA 79 -7.803 12.539 7.920 616 HB3 ALA 79 3HB ALA 79 -9.163 12.370 6.780 617 H ILE 80 H ILE 80 -8.451 11.129 4.273 618 HA ILE 80 HA ILE 80 -6.073 12.777 3.587 619 HB ILE 80 HB ILE 80 -7.681 11.025 1.695 620 HG12 ILE 80 1HG1 ILE 80 -4.753 10.631 2.387 621 HG13 ILE 80 2HG1 ILE 80 -5.992 9.890 3.363 622 HG21 ILE 80 1HG2 ILE 80 -6.824 13.127 0.681 623 HG22 ILE 80 2HG2 ILE 80 -5.191 12.753 1.274 624 HG23 ILE 80 3HG2 ILE 80 -5.955 11.748 0.040 625 HD11 ILE 80 3HD1 ILE 80 -5.908 9.551 0.350 626 HD12 ILE 80 1HD1 ILE 80 -5.147 8.410 1.484 627 HD13 ILE 80 2HD1 ILE 80 -6.891 8.666 1.461 628 H LEU 81 H LEU 81 -6.832 14.643 3.877 629 HA LEU 81 HA LEU 81 -9.586 15.439 3.184 630 HB2 LEU 81 1HB LEU 81 -7.287 17.270 3.924 631 HB3 LEU 81 2HB LEU 81 -8.987 17.701 3.766 632 HG LEU 81 HG LEU 81 -7.672 16.002 5.911 633 HD11 LEU 81 1HD1 LEU 81 -7.707 18.485 6.120 634 HD12 LEU 81 2HD1 LEU 81 -8.617 17.663 7.398 635 HD13 LEU 81 3HD1 LEU 81 -9.489 18.444 6.065 636 HD21 LEU 81 3HD2 LEU 81 -10.656 16.227 5.346 637 HD22 LEU 81 1HD2 LEU 81 -9.973 15.708 6.908 638 HD23 LEU 81 2HD2 LEU 81 -9.686 14.747 5.455 639 H GLY 82 H GLY 82 -10.160 16.717 1.293 640 HA2 GLY 82 1HA GLY 82 -8.227 16.404 -0.927 641 HA3 GLY 82 2HA GLY 82 -9.920 16.878 -1.035 642 H GLN 83 H GLN 83 -10.204 18.983 -1.608 643 HA GLN 83 HA GLN 83 -8.336 21.070 -0.571 644 HB2 GLN 83 1HB GLN 83 -8.508 22.198 -2.725 645 HB3 GLN 83 2HB GLN 83 -7.598 20.698 -2.791 646 HG2 GLN 83 1HG GLN 83 -9.435 19.515 -3.868 647 HG3 GLN 83 2HG GLN 83 -10.496 20.922 -3.713 648 HE21 GLN 83 1HE2 GLN 83 -9.233 19.394 -6.191 649 HE22 GLN 83 2HE2 GLN 83 -8.434 20.665 -7.063 650 H ASN 84 H ASN 84 -10.438 20.577 0.839 651 HA ASN 84 HA ASN 84 -11.773 22.879 1.224 652 HB2 ASN 84 1HB ASN 84 -14.187 22.409 0.614 653 HB3 ASN 84 2HB ASN 84 -13.150 22.930 -0.660 654 HD21 ASN 84 1HD2 ASN 84 -12.382 21.254 -2.184 655 HD22 ASN 84 2HD2 ASN 84 -13.448 19.936 -2.605 656 H LYS 85 H LYS 85 -10.537 20.866 2.654 657 HA LYS 85 HA LYS 85 -10.547 19.523 4.383 658 HB2 LYS 85 1HB LYS 85 -13.126 20.869 5.236 659 HB3 LYS 85 2HB LYS 85 -11.982 19.993 6.254 660 HG2 LYS 85 1HG LYS 85 -10.214 21.710 5.515 661 HG3 LYS 85 2HG LYS 85 -11.577 22.679 4.916 662 HD2 LYS 85 1HD LYS 85 -12.576 22.591 7.241 663 HD3 LYS 85 2HD LYS 85 -11.132 21.699 7.773 664 HE2 LYS 85 1HE LYS 85 -9.785 23.664 6.769 665 HE3 LYS 85 2HE LYS 85 -11.303 24.559 6.723 666 HZ1 LYS 85 3HZ LYS 85 -9.983 23.426 9.121 667 HZ2 LYS 85 1HZ LYS 85 -11.405 24.293 9.154 668 HZ3 LYS 85 2HZ LYS 85 -10.025 25.004 8.695 669 H VAL 86 H VAL 86 -12.675 18.906 2.056 670 HA VAL 86 HA VAL 86 -14.393 16.975 3.027 671 HB VAL 86 HB VAL 86 -14.874 17.952 1.074 672 HG11 VAL 86 1HG1 VAL 86 -12.813 18.585 0.305 673 HG12 VAL 86 2HG1 VAL 86 -12.304 16.914 0.056 674 HG13 VAL 86 3HG1 VAL 86 -13.599 17.631 -0.976 675 HG21 VAL 86 3HG2 VAL 86 -15.611 15.565 1.277 676 HG22 VAL 86 1HG2 VAL 86 -15.428 16.093 -0.397 677 HG23 VAL 86 2HG2 VAL 86 -14.187 15.070 0.346 678 H VAL 87 H VAL 87 -14.115 14.812 3.651 679 HA VAL 87 HA VAL 87 -11.449 13.637 3.628 680 HB VAL 87 HB VAL 87 -14.072 12.330 4.412 681 HG11 VAL 87 1HG1 VAL 87 -12.544 11.018 5.856 682 HG12 VAL 87 2HG1 VAL 87 -12.101 10.839 4.144 683 HG13 VAL 87 3HG1 VAL 87 -11.145 11.890 5.204 684 HG21 VAL 87 3HG2 VAL 87 -13.479 13.003 6.745 685 HG22 VAL 87 1HG2 VAL 87 -12.194 14.044 6.096 686 HG23 VAL 87 2HG2 VAL 87 -13.905 14.389 5.751 687 H ILE 88 H ILE 88 -10.989 13.675 1.369 688 HA ILE 88 HA ILE 88 -12.742 12.417 -0.569 689 HB ILE 88 HB ILE 88 -10.828 12.531 -2.124 690 HG12 ILE 88 1HG1 ILE 88 -9.329 14.074 0.013 691 HG13 ILE 88 2HG1 ILE 88 -8.995 12.397 -0.362 692 HG21 ILE 88 1HG2 ILE 88 -12.552 14.320 -1.798 693 HG22 ILE 88 2HG2 ILE 88 -11.444 15.102 -0.649 694 HG23 ILE 88 3HG2 ILE 88 -11.001 14.955 -2.369 695 HD11 ILE 88 3HD1 ILE 88 -8.506 13.015 -2.733 696 HD12 ILE 88 1HD1 ILE 88 -8.758 14.718 -2.328 697 HD13 ILE 88 2HD1 ILE 88 -7.430 13.822 -1.574 698 H GLY 89 H GLY 89 -10.260 11.226 1.617 699 HA2 GLY 89 1HA GLY 89 -10.864 8.482 0.899 700 HA3 GLY 89 2HA GLY 89 -9.271 9.037 0.330 701 H TRP 90 H TRP 90 -8.746 7.110 1.892 702 HA TRP 90 HA TRP 90 -7.881 8.351 4.372 703 HB2 TRP 90 1HB TRP 90 -9.258 5.629 4.273 704 HB3 TRP 90 2HB TRP 90 -8.501 6.349 5.688 705 HD1 TRP 90 HD TRP 90 -9.902 8.144 7.022 706 HE1 TRP 90 1HE TRP 90 -12.260 9.130 6.811 707 HE3 TRP 90 3HE TRP 90 -11.186 6.209 2.487 708 HZ2 TRP 90 2HZ TRP 90 -14.422 9.132 4.875 709 HZ3 TRP 90 3HZ TRP 90 -13.321 6.884 1.392 710 HH2 TRP 90 HH TRP 90 -14.925 8.326 2.555 711 H ASP 91 H ASP 91 -5.852 7.650 4.859 712 HA ASP 91 HA ASP 91 -4.385 6.000 2.859 713 HB2 ASP 91 1HB ASP 91 -3.575 7.659 5.281 714 HB3 ASP 91 2HB ASP 91 -2.517 6.425 4.605 715 H LYS 92 H LYS 92 -5.261 3.940 3.241 716 HA LYS 92 HA LYS 92 -5.394 2.951 6.054 717 HB2 LYS 92 1HB LYS 92 -5.492 1.179 3.620 718 HB3 LYS 92 2HB LYS 92 -5.925 0.789 5.254 719 HG2 LYS 92 1HG LYS 92 -7.480 2.487 3.285 720 HG3 LYS 92 2HG LYS 92 -7.930 0.987 4.096 721 HD2 LYS 92 1HD LYS 92 -7.688 2.498 6.283 722 HD3 LYS 92 2HD LYS 92 -7.823 3.821 5.129 723 HE2 LYS 92 1HE LYS 92 -9.963 3.211 6.261 724 HE3 LYS 92 2HE LYS 92 -10.003 3.236 4.498 725 HZ1 LYS 92 3HZ LYS 92 -9.803 0.708 6.046 726 HZ2 LYS 92 1HZ LYS 92 -10.048 0.913 4.423 727 HZ3 LYS 92 2HZ LYS 92 -11.191 1.374 5.476 728 H TYR 93 H TYR 93 -3.696 2.310 7.171 729 HA TYR 93 HA TYR 93 -1.108 1.849 5.833 730 HB2 TYR 93 1HB TYR 93 -1.952 2.307 8.700 731 HB3 TYR 93 2HB TYR 93 -0.323 1.870 8.273 732 HD1 TYR 93 2HD TYR 93 -2.918 4.459 7.504 733 HD2 TYR 93 1HD TYR 93 1.270 3.618 7.983 734 HE1 TYR 93 2HE TYR 93 -2.457 6.801 7.133 735 HE2 TYR 93 1HE TYR 93 1.777 6.022 7.755 736 HH TYR 93 HH TYR 93 -0.676 8.500 6.888 737 H PHE 94 H PHE 94 -0.366 -0.135 5.646 738 HA PHE 94 HA PHE 94 -1.823 -2.413 6.920 739 HB2 PHE 94 1HB PHE 94 -0.522 -2.026 4.195 740 HB3 PHE 94 2HB PHE 94 -1.084 -3.575 4.760 741 HD1 PHE 94 1HD PHE 94 -3.656 -3.394 5.850 742 HD2 PHE 94 2HD PHE 94 -1.970 -0.868 2.789 743 HE1 PHE 94 1HE PHE 94 -5.939 -2.902 4.997 744 HE2 PHE 94 2HE PHE 94 -4.206 -0.448 1.908 745 HZ PHE 94 HZ PHE 94 -6.232 -1.422 3.031 746 H GLU 95 H GLU 95 -0.662 -4.291 7.401 747 HA GLU 95 HA GLU 95 2.259 -3.966 7.938 748 HB2 GLU 95 1HB GLU 95 0.555 -3.786 9.783 749 HB3 GLU 95 2HB GLU 95 0.060 -5.430 9.470 750 HG2 GLU 95 1HG GLU 95 2.334 -6.215 10.110 751 HG3 GLU 95 2HG GLU 95 2.847 -4.541 10.323 752 H ILE 96 H ILE 96 2.293 -5.038 5.554 753 HA ILE 96 HA ILE 96 1.161 -7.731 5.573 754 HB ILE 96 HB ILE 96 2.764 -6.648 3.266 755 HG12 ILE 96 1HG1 ILE 96 0.270 -6.146 2.436 756 HG13 ILE 96 2HG1 ILE 96 -0.050 -5.873 4.122 757 HG21 ILE 96 1HG2 ILE 96 0.422 -8.600 3.580 758 HG22 ILE 96 2HG2 ILE 96 1.125 -8.129 2.042 759 HG23 ILE 96 3HG2 ILE 96 2.107 -9.018 3.195 760 HD11 ILE 96 3HD1 ILE 96 0.503 -3.835 2.703 761 HD12 ILE 96 1HD1 ILE 96 1.500 -3.992 4.152 762 HD13 ILE 96 2HD1 ILE 96 2.159 -4.446 2.561 763 HA PRO 97 HA PRO 97 5.360 -9.689 6.332 764 HB2 PRO 97 1HB PRO 97 4.727 -12.098 5.082 765 HB3 PRO 97 2HB PRO 97 4.320 -11.708 6.783 766 HG2 PRO 97 1HG PRO 97 2.620 -11.392 4.305 767 HG3 PRO 97 2HG PRO 97 2.179 -12.241 5.834 768 HD2 PRO 97 1HD PRO 97 1.390 -9.770 5.345 769 HD3 PRO 97 2HD PRO 97 2.020 -10.107 6.963 770 H MET 98 H MET 98 6.832 -10.831 4.781 771 HA MET 98 HA MET 98 6.624 -9.721 2.014 772 HB2 MET 98 1HB MET 98 9.062 -10.420 3.664 773 HB3 MET 98 2HB MET 98 9.098 -10.403 1.891 774 HG2 MET 98 1HG MET 98 8.181 -8.070 1.927 775 HG3 MET 98 2HG MET 98 8.337 -8.077 3.682 776 HE1 MET 98 3HE MET 98 9.610 -5.674 2.872 777 HE2 MET 98 1HE MET 98 10.043 -6.430 4.416 778 HE3 MET 98 2HE MET 98 11.313 -5.805 3.343 779 H ASP 99 H ASP 99 7.584 -12.756 3.873 780 HA ASP 99 HA ASP 99 7.563 -14.107 1.313 781 HB2 ASP 99 1HB ASP 99 9.176 -14.541 3.187 782 HB3 ASP 99 2HB ASP 99 7.916 -15.527 3.936 783 H ALA 100 H ALA 100 5.024 -13.206 2.908 784 HA ALA 100 HA ALA 100 3.433 -15.661 2.199 785 HB1 ALA 100 1HB ALA 100 2.179 -13.175 3.299 786 HB2 ALA 100 2HB ALA 100 1.584 -14.822 3.321 787 HB3 ALA 100 3HB ALA 100 2.933 -14.374 4.392 788 H LEU 101 H LEU 101 4.876 -13.492 0.301 789 HA LEU 101 HA LEU 101 2.427 -12.474 -1.033 790 HB2 LEU 101 1HB LEU 101 5.331 -11.685 -1.279 791 HB3 LEU 101 2HB LEU 101 4.025 -10.961 -2.208 792 HG LEU 101 HG LEU 101 4.166 -10.918 0.847 793 HD11 LEU 101 1HD1 LEU 101 4.846 -8.602 0.582 794 HD12 LEU 101 2HD1 LEU 101 4.814 -8.761 -1.201 795 HD13 LEU 101 3HD1 LEU 101 5.979 -9.692 -0.235 796 HD21 LEU 101 3HD2 LEU 101 2.451 -9.189 0.650 797 HD22 LEU 101 1HD2 LEU 101 1.860 -10.737 0.078 798 HD23 LEU 101 2HD2 LEU 101 2.328 -9.483 -1.100 799 H GLN 102 H GLN 102 2.091 -12.545 -3.193 800 HA GLN 102 HA GLN 102 2.442 -15.091 -4.333 801 HB2 GLN 102 1HB GLN 102 0.510 -13.432 -4.383 802 HB3 GLN 102 2HB GLN 102 1.423 -12.479 -5.554 803 HG2 GLN 102 1HG GLN 102 1.363 -14.313 -7.145 804 HG3 GLN 102 2HG GLN 102 0.680 -15.397 -5.911 805 HE21 GLN 102 1HE2 GLN 102 -1.493 -15.729 -6.244 806 HE22 GLN 102 2HE2 GLN 102 -2.579 -14.547 -6.996 807 H ASP 103 H ASP 103 4.386 -12.263 -4.604 808 HA ASP 103 HA ASP 103 6.037 -13.296 -6.772 809 HB2 ASP 103 1HB ASP 103 4.011 -11.953 -7.767 810 HB3 ASP 103 2HB ASP 103 4.742 -10.563 -6.932 811 H ASN 104 H ASN 104 7.730 -11.315 -7.065 812 HA ASN 104 HA ASN 104 8.265 -10.018 -4.435 813 HB2 ASN 104 1HB ASN 104 10.134 -10.661 -6.738 814 HB3 ASN 104 2HB ASN 104 10.486 -9.475 -5.490 815 HD21 ASN 104 1HD2 ASN 104 12.299 -11.240 -5.353 816 HD22 ASN 104 2HD2 ASN 104 12.021 -12.518 -4.151 817 H SER 105 H SER 105 6.035 -9.286 -5.774 818 HA SER 105 HA SER 105 6.799 -6.552 -6.128 819 HB2 SER 105 1HB SER 105 5.165 -6.092 -7.916 820 HB3 SER 105 2HB SER 105 6.426 -7.201 -8.460 821 HG SER 105 HG SER 105 5.151 -8.853 -8.480 822 H ILE 106 H ILE 106 5.063 -5.151 -5.529 823 HA ILE 106 HA ILE 106 3.233 -6.431 -3.571 824 HB ILE 106 HB ILE 106 4.980 -5.161 -2.548 825 HG12 ILE 106 1HG1 ILE 106 2.589 -5.162 -1.707 826 HG13 ILE 106 2HG1 ILE 106 3.751 -4.066 -0.976 827 HG21 ILE 106 1HG2 ILE 106 5.242 -2.738 -2.794 828 HG22 ILE 106 2HG2 ILE 106 5.651 -3.594 -4.259 829 HG23 ILE 106 3HG2 ILE 106 4.096 -2.737 -4.143 830 HD11 ILE 106 3HD1 ILE 106 1.437 -3.131 -1.376 831 HD12 ILE 106 1HD1 ILE 106 2.772 -2.171 -2.045 832 HD13 ILE 106 2HD1 ILE 106 1.770 -3.179 -3.104 833 H GLN 107 H GLN 107 1.144 -6.110 -3.776 834 HA GLN 107 HA GLN 107 0.029 -3.931 -5.370 835 HB2 GLN 107 1HB GLN 107 0.296 -5.648 -7.032 836 HB3 GLN 107 2HB GLN 107 -0.406 -6.885 -5.976 837 HG2 GLN 107 1HG GLN 107 -2.607 -5.825 -6.147 838 HG3 GLN 107 2HG GLN 107 -1.920 -4.482 -7.088 839 HE21 GLN 107 1HE2 GLN 107 -2.435 -4.703 -9.254 840 HE22 GLN 107 2HE2 GLN 107 -2.321 -6.251 -10.101 841 H ILE 108 H ILE 108 -2.272 -3.742 -4.900 842 HA ILE 108 HA ILE 108 -3.436 -5.291 -2.683 843 HB ILE 108 HB ILE 108 -3.326 -2.239 -2.906 844 HG12 ILE 108 1HG1 ILE 108 -2.477 -4.093 -0.627 845 HG13 ILE 108 2HG1 ILE 108 -1.368 -3.348 -1.771 846 HG21 ILE 108 1HG2 ILE 108 -5.018 -3.983 -1.074 847 HG22 ILE 108 2HG2 ILE 108 -4.837 -2.220 -0.902 848 HG23 ILE 108 3HG2 ILE 108 -5.617 -2.857 -2.322 849 HD11 ILE 108 3HD1 ILE 108 -1.295 -2.080 0.238 850 HD12 ILE 108 1HD1 ILE 108 -2.104 -1.090 -1.001 851 HD13 ILE 108 2HD1 ILE 108 -3.045 -1.886 0.283 852 H LYS 109 H LYS 109 -5.877 -5.326 -3.048 853 HA LYS 109 HA LYS 109 -6.776 -3.784 -5.323 854 HB2 LYS 109 1HB LYS 109 -7.810 -5.712 -6.524 855 HB3 LYS 109 2HB LYS 109 -6.072 -5.709 -6.497 856 HG2 LYS 109 1HG LYS 109 -6.479 -7.320 -4.316 857 HG3 LYS 109 2HG LYS 109 -7.965 -7.610 -5.199 858 HD2 LYS 109 1HD LYS 109 -6.424 -9.282 -5.879 859 HD3 LYS 109 2HD LYS 109 -6.512 -8.170 -7.238 860 HE2 LYS 109 1HE LYS 109 -4.342 -7.118 -6.515 861 HE3 LYS 109 2HE LYS 109 -4.347 -8.170 -5.078 862 HZ1 LYS 109 3HZ LYS 109 -3.989 -8.964 -7.888 863 HZ2 LYS 109 1HZ LYS 109 -4.301 -10.083 -6.755 864 HZ3 LYS 109 2HZ LYS 109 -2.939 -9.179 -6.654 865 H ALA 110 H ALA 110 -9.143 -3.290 -5.173 866 HA ALA 110 HA ALA 110 -10.374 -4.333 -2.664 867 HB1 ALA 110 1HB ALA 110 -10.785 -2.080 -1.819 868 HB2 ALA 110 2HB ALA 110 -9.045 -2.413 -1.935 869 HB3 ALA 110 3HB ALA 110 -9.845 -1.390 -3.159 870 H LEU 111 H LEU 111 -12.608 -4.069 -2.518 871 HA LEU 111 HA LEU 111 -13.932 -4.063 -5.077 872 HB2 LEU 111 1HB LEU 111 -14.699 -5.434 -3.083 873 HB3 LEU 111 2HB LEU 111 -15.255 -3.912 -2.369 874 HG LEU 111 HG LEU 111 -16.633 -3.553 -4.529 875 HD11 LEU 111 1HD1 LEU 111 -15.572 -5.365 -5.901 876 HD12 LEU 111 2HD1 LEU 111 -17.319 -5.552 -5.720 877 HD13 LEU 111 3HD1 LEU 111 -16.221 -6.569 -4.771 878 HD21 LEU 111 3HD2 LEU 111 -17.349 -5.839 -2.664 879 HD22 LEU 111 1HD2 LEU 111 -18.464 -4.874 -3.670 880 HD23 LEU 111 2HD2 LEU 111 -17.581 -4.101 -2.344 881 H SER 112 H SER 112 -14.321 -2.340 -6.154 882 HA SER 112 HA SER 112 -14.614 0.337 -5.009 883 HB2 SER 112 1HB SER 112 -13.217 0.201 -6.938 884 HB3 SER 112 2HB SER 112 -14.358 -0.821 -7.788 885 HG SER 112 HG SER 112 -14.502 1.963 -7.259 886 H SER 113 H SER 113 -16.590 -1.316 -7.549 887 HA SER 113 HA SER 113 -19.044 -0.687 -6.049 888 HB2 SER 113 1HB SER 113 -18.383 1.342 -7.330 889 HB3 SER 113 2HB SER 113 -18.315 0.372 -8.808 890 HG SER 113 HG SER 113 -20.249 1.361 -8.760 891 H GLY 114 H GLY 114 -20.561 -2.226 -6.432 892 HA2 GLY 114 1HA GLY 114 -21.634 -4.030 -7.289 893 HA3 GLY 114 2HA GLY 114 -20.852 -3.725 -8.837 894 H THR 115 H THR 115 -18.919 -4.707 -9.287 895 HA THR 115 HA THR 115 -17.836 -6.805 -7.471 896 HB THR 115 HB THR 115 -17.639 -8.261 -9.485 897 HG1 THR 115 1HG THR 115 -17.915 -7.207 -11.266 898 HG21 THR 115 3HG2 THR 115 -19.482 -8.521 -7.838 899 HG22 THR 115 1HG2 THR 115 -19.955 -9.032 -9.461 900 HG23 THR 115 2HG2 THR 115 -20.515 -7.472 -8.853 901 H THR 116 H THR 116 -17.175 -3.992 -9.154 902 HA THR 116 HA THR 116 -14.703 -4.707 -10.489 903 HB THR 116 HB THR 116 -15.660 -2.062 -9.379 904 HG1 THR 116 1HG THR 116 -15.906 -3.372 -11.862 905 HG21 THR 116 3HG2 THR 116 -13.983 -0.988 -10.857 906 HG22 THR 116 1HG2 THR 116 -13.312 -2.591 -11.239 907 HG23 THR 116 2HG2 THR 116 -13.225 -1.936 -9.589 908 H PHE 117 H PHE 117 -12.904 -5.106 -9.629 909 HA PHE 117 HA PHE 117 -12.317 -4.436 -6.793 910 HB2 PHE 117 1HB PHE 117 -12.575 -6.961 -8.051 911 HB3 PHE 117 2HB PHE 117 -10.832 -6.709 -7.781 912 HD1 PHE 117 2HD PHE 117 -10.050 -6.153 -5.420 913 HD2 PHE 117 1HD PHE 117 -14.061 -7.459 -6.270 914 HE1 PHE 117 2HE PHE 117 -10.394 -6.679 -3.002 915 HE2 PHE 117 1HE PHE 117 -14.386 -8.020 -3.867 916 HZ PHE 117 HZ PHE 117 -12.564 -7.624 -2.241 917 H VAL 118 H VAL 118 -11.158 -2.573 -7.195 918 HA VAL 118 HA VAL 118 -9.687 -2.149 -9.670 919 HB VAL 118 HB VAL 118 -10.495 -0.269 -8.291 920 HG11 VAL 118 1HG1 VAL 118 -9.649 0.534 -6.335 921 HG12 VAL 118 2HG1 VAL 118 -10.559 -0.942 -6.256 922 HG13 VAL 118 3HG1 VAL 118 -8.791 -1.019 -6.107 923 HG21 VAL 118 3HG2 VAL 118 -8.842 0.209 -9.910 924 HG22 VAL 118 1HG2 VAL 118 -8.683 1.286 -8.541 925 HG23 VAL 118 2HG2 VAL 118 -7.568 -0.115 -8.748 926 H TYR 119 H TYR 119 -7.740 -2.762 -10.184 927 HA TYR 119 HA TYR 119 -6.058 -4.114 -8.167 928 HB2 TYR 119 1HB TYR 119 -5.693 -3.830 -11.182 929 HB3 TYR 119 2HB TYR 119 -4.858 -4.966 -10.124 930 HD1 TYR 119 1HD TYR 119 -6.209 -6.772 -8.986 931 HD2 TYR 119 2HD TYR 119 -7.954 -4.258 -12.011 932 HE1 TYR 119 1HE TYR 119 -8.169 -8.308 -9.149 933 HE2 TYR 119 2HE TYR 119 -9.844 -5.818 -12.249 934 HH TYR 119 HH TYR 119 -11.036 -7.497 -10.951 935 H SER 120 H SER 120 -4.475 -3.000 -7.204 936 HA SER 120 HA SER 120 -3.786 -0.304 -7.982 937 HB2 SER 120 1HB SER 120 -2.696 -0.341 -6.054 938 HB3 SER 120 2HB SER 120 -3.555 -1.720 -5.711 939 HG SER 120 HG SER 120 -0.965 -2.010 -6.841 940 H GLN 121 H GLN 121 -1.328 0.122 -8.442 941 HA GLN 121 HA GLN 121 -0.619 -1.274 -10.862 942 HB2 GLN 121 1HB GLN 121 1.303 0.032 -10.928 943 HB3 GLN 121 2HB GLN 121 0.050 1.114 -10.347 944 HG2 GLN 121 1HG GLN 121 1.983 -0.267 -8.453 945 HG3 GLN 121 2HG GLN 121 2.468 1.110 -9.418 946 HE21 GLN 121 1HE2 GLN 121 2.602 2.841 -8.183 947 HE22 GLN 121 2HE2 GLN 121 1.472 3.405 -6.992 948 H LYS 122 H LYS 122 1.454 -2.419 -11.163 949 HA LYS 122 HA LYS 122 2.163 -4.270 -8.935 950 HB2 LYS 122 1HB LYS 122 1.814 -5.167 -11.294 951 HB3 LYS 122 2HB LYS 122 3.100 -4.122 -11.874 952 HG2 LYS 122 1HG LYS 122 4.790 -5.294 -10.680 953 HG3 LYS 122 2HG LYS 122 3.603 -6.107 -9.646 954 HD2 LYS 122 1HD LYS 122 2.779 -7.445 -11.418 955 HD3 LYS 122 2HD LYS 122 3.715 -6.590 -12.649 956 HE2 LYS 122 1HE LYS 122 4.951 -8.159 -10.349 957 HE3 LYS 122 2HE LYS 122 4.617 -8.879 -11.921 958 HZ1 LYS 122 3HZ LYS 122 6.932 -7.832 -11.340 959 HZ2 LYS 122 1HZ LYS 122 6.235 -6.457 -11.876 960 HZ3 LYS 122 2HZ LYS 122 6.326 -7.751 -12.868 961 H ILE 123 H ILE 123 3.919 -3.775 -7.709 962 HA ILE 123 HA ILE 123 6.092 -2.112 -8.899 963 HB ILE 123 HB ILE 123 5.191 -2.111 -5.996 964 HG12 ILE 123 1HG1 ILE 123 3.585 -0.771 -7.106 965 HG13 ILE 123 2HG1 ILE 123 4.636 0.240 -6.146 966 HG21 ILE 123 1HG2 ILE 123 7.384 -0.475 -7.312 967 HG22 ILE 123 2HG2 ILE 123 6.845 -0.293 -5.644 968 HG23 ILE 123 3HG2 ILE 123 7.613 -1.803 -6.153 969 HD11 ILE 123 3HD1 ILE 123 4.596 0.006 -9.166 970 HD12 ILE 123 1HD1 ILE 123 4.319 1.432 -8.150 971 HD13 ILE 123 2HD1 ILE 123 5.940 0.769 -8.316 972 H ASP 124 H ASP 124 7.362 -3.666 -9.517 973 HA ASP 124 HA ASP 124 8.082 -6.076 -8.029 974 HB2 ASP 124 1HB ASP 124 9.034 -4.525 -10.368 975 HB3 ASP 124 2HB ASP 124 10.276 -5.435 -9.507 976 H PHE 125 H PHE 125 9.663 -6.292 -6.428 977 HA PHE 125 HA PHE 125 11.177 -3.889 -5.654 978 HB2 PHE 125 1HB PHE 125 10.537 -4.109 -3.354 979 HB3 PHE 125 2HB PHE 125 9.100 -3.847 -4.295 980 HD1 PHE 125 1HD PHE 125 11.054 -6.387 -2.373 981 HD2 PHE 125 2HD PHE 125 7.270 -5.411 -4.166 982 HE1 PHE 125 1HE PHE 125 10.019 -8.257 -1.152 983 HE2 PHE 125 2HE PHE 125 6.216 -7.285 -2.894 984 HZ PHE 125 HZ PHE 125 7.604 -8.743 -1.445 985 H GLU 126 H GLU 126 12.834 -4.587 -3.679 986 HA GLU 126 HA GLU 126 13.825 -7.306 -4.363 987 HB2 GLU 126 1HB GLU 126 15.044 -4.611 -4.295 988 HB3 GLU 126 2HB GLU 126 16.031 -6.065 -3.822 989 HG2 GLU 126 1HG GLU 126 15.777 -6.956 -5.958 990 HG3 GLU 126 2HG GLU 126 14.391 -5.877 -6.305 991 H ARG 127 H ARG 127 14.542 -8.521 -2.913 992 HA ARG 127 HA ARG 127 13.854 -7.927 -0.093 993 HB2 ARG 127 1HB ARG 127 14.295 -10.726 -1.096 994 HB3 ARG 127 2HB ARG 127 13.385 -10.161 0.295 995 HG2 ARG 127 1HG ARG 127 11.888 -9.254 -1.904 996 HG3 ARG 127 2HG ARG 127 12.578 -10.760 -2.484 997 HD2 ARG 127 1HD ARG 127 10.916 -10.314 -0.025 998 HD3 ARG 127 2HD ARG 127 10.358 -11.100 -1.506 999 HE ARG 127 HE ARG 127 12.602 -12.326 0.007 1000 HH11 ARG 127 1HH1 ARG 127 9.063 -12.580 -0.815 1001 HH12 ARG 127 2HH1 ARG 127 9.007 -14.194 -0.190 1002 HH21 ARG 127 1HH2 ARG 127 12.263 -14.483 0.923 1003 HH22 ARG 127 2HH2 ARG 127 10.682 -15.198 0.711 1004 H GLU 128 H GLU 128 15.633 -7.439 0.707 1005 HA GLU 128 HA GLU 128 18.034 -7.069 -0.447 1006 HB2 GLU 128 1HB GLU 128 19.051 -6.557 1.583 1007 HB3 GLU 128 2HB GLU 128 17.369 -6.115 1.759 1008 HG2 GLU 128 1HG GLU 128 18.327 -8.789 2.833 1009 HG3 GLU 128 2HG GLU 128 18.717 -7.296 3.660 Start of MODEL 13 1 H1 GLY 1 H GLY 1 -23.757 14.842 -5.631 2 HA2 GLY 1 1HA GLY 1 -22.376 17.457 -5.799 3 HA3 GLY 1 2HA GLY 1 -23.031 16.747 -4.324 4 H ALA 2 H ALA 2 -21.384 16.045 -3.060 5 HA ALA 2 HA ALA 2 -19.437 14.118 -4.098 6 HB1 ALA 2 1HB ALA 2 -17.597 15.239 -2.870 7 HB2 ALA 2 2HB ALA 2 -18.181 16.233 -4.217 8 HB3 ALA 2 3HB ALA 2 -18.650 16.614 -2.510 9 H GLU 3 H GLU 3 -21.395 13.154 -3.096 10 HA GLU 3 HA GLU 3 -21.705 12.946 -0.258 11 HB2 GLU 3 1HB GLU 3 -22.993 11.981 -2.632 12 HB3 GLU 3 2HB GLU 3 -22.386 10.543 -1.856 13 HG2 GLU 3 1HG GLU 3 -24.559 10.832 -1.004 14 HG3 GLU 3 2HG GLU 3 -23.497 11.354 0.298 15 H ALA 4 H ALA 4 -21.469 10.279 0.390 16 HA ALA 4 HA ALA 4 -18.602 9.638 0.218 17 HB1 ALA 4 1HB ALA 4 -19.752 9.059 2.258 18 HB2 ALA 4 2HB ALA 4 -21.079 8.251 1.373 19 HB3 ALA 4 3HB ALA 4 -19.469 7.531 1.412 20 H LEU 5 H LEU 5 -18.739 9.728 -2.523 21 HA LEU 5 HA LEU 5 -19.875 7.628 -3.733 22 HB2 LEU 5 1HB LEU 5 -17.124 8.577 -4.446 23 HB3 LEU 5 2HB LEU 5 -18.508 8.293 -5.481 24 HG LEU 5 HG LEU 5 -18.246 10.496 -5.496 25 HD11 LEU 5 1HD1 LEU 5 -20.184 11.493 -4.953 26 HD12 LEU 5 2HD1 LEU 5 -20.353 10.591 -3.447 27 HD13 LEU 5 3HD1 LEU 5 -20.552 9.741 -4.996 28 HD21 LEU 5 3HD2 LEU 5 -17.305 10.550 -2.756 29 HD22 LEU 5 1HD2 LEU 5 -17.984 12.034 -3.523 30 HD23 LEU 5 2HD2 LEU 5 -16.638 11.186 -4.246 31 HA PRO 6 HA PRO 6 -17.219 4.157 -2.640 32 HB2 PRO 6 1HB PRO 6 -17.478 2.579 -4.847 33 HB3 PRO 6 2HB PRO 6 -18.820 2.857 -3.700 34 HG2 PRO 6 1HG PRO 6 -18.378 4.100 -6.403 35 HG3 PRO 6 2HG PRO 6 -19.898 3.584 -5.630 36 HD2 PRO 6 1HD PRO 6 -18.825 6.238 -5.667 37 HD3 PRO 6 2HD PRO 6 -20.146 5.658 -4.617 38 H LEU 7 H LEU 7 -15.321 3.060 -3.443 39 HA LEU 7 HA LEU 7 -13.189 4.654 -3.910 40 HB2 LEU 7 1HB LEU 7 -13.308 2.274 -3.104 41 HB3 LEU 7 2HB LEU 7 -13.445 1.784 -4.797 42 HG LEU 7 HG LEU 7 -11.223 2.792 -5.260 43 HD11 LEU 7 1HD1 LEU 7 -11.266 3.193 -2.247 44 HD12 LEU 7 2HD1 LEU 7 -10.992 4.411 -3.492 45 HD13 LEU 7 3HD1 LEU 7 -9.773 3.174 -3.214 46 HD21 LEU 7 3HD2 LEU 7 -11.502 0.415 -4.913 47 HD22 LEU 7 1HD2 LEU 7 -11.474 0.616 -3.150 48 HD23 LEU 7 2HD2 LEU 7 -10.020 0.945 -4.119 49 H TYR 8 H TYR 8 -12.564 5.925 -5.589 50 HA TYR 8 HA TYR 8 -12.920 4.923 -8.381 51 HB2 TYR 8 1HB TYR 8 -12.986 7.356 -8.989 52 HB3 TYR 8 2HB TYR 8 -14.350 6.711 -8.140 53 HD1 TYR 8 2HD TYR 8 -11.215 8.707 -7.554 54 HD2 TYR 8 1HD TYR 8 -15.208 7.737 -6.236 55 HE1 TYR 8 2HE TYR 8 -11.135 10.584 -5.916 56 HE2 TYR 8 1HE TYR 8 -15.155 9.614 -4.647 57 HH TYR 8 HH TYR 8 -12.623 12.094 -4.674 58 H TYR 9 H TYR 9 -10.502 4.612 -6.419 59 HA TYR 9 HA TYR 9 -8.458 5.252 -8.424 60 HB2 TYR 9 1HB TYR 9 -8.820 7.363 -7.091 61 HB3 TYR 9 2HB TYR 9 -8.376 6.464 -5.647 62 HD1 TYR 9 2HD TYR 9 -7.082 7.356 -9.063 63 HD2 TYR 9 1HD TYR 9 -6.135 6.493 -4.955 64 HE1 TYR 9 2HE TYR 9 -4.733 8.045 -9.467 65 HE2 TYR 9 1HE TYR 9 -3.822 7.203 -5.314 66 HH TYR 9 HH TYR 9 -2.496 8.699 -6.950 67 H LEU 10 H LEU 10 -6.575 3.853 -8.045 68 HA LEU 10 HA LEU 10 -6.302 2.676 -5.396 69 HB2 LEU 10 1HB LEU 10 -7.481 1.034 -7.142 70 HB3 LEU 10 2HB LEU 10 -5.820 0.742 -7.584 71 HG LEU 10 HG LEU 10 -6.104 -0.877 -5.990 72 HD11 LEU 10 1HD1 LEU 10 -5.632 1.152 -3.859 73 HD12 LEU 10 2HD1 LEU 10 -4.338 0.556 -4.893 74 HD13 LEU 10 3HD1 LEU 10 -5.268 -0.575 -3.877 75 HD21 LEU 10 3HD2 LEU 10 -7.864 0.792 -4.279 76 HD22 LEU 10 1HD2 LEU 10 -7.539 -0.955 -4.170 77 HD23 LEU 10 2HD2 LEU 10 -8.455 -0.310 -5.548 78 H GLN 11 H GLN 11 -4.328 3.215 -4.648 79 HA GLN 11 HA GLN 11 -2.072 2.793 -6.440 80 HB2 GLN 11 1HB GLN 11 -3.153 5.190 -6.744 81 HB3 GLN 11 2HB GLN 11 -2.358 5.532 -5.226 82 HG2 GLN 11 1HG GLN 11 -0.718 6.149 -6.631 83 HG3 GLN 11 2HG GLN 11 -0.235 4.492 -6.402 84 HE21 GLN 11 1HE2 GLN 11 -2.667 3.745 -8.446 85 HE22 GLN 11 2HE2 GLN 11 -1.820 4.120 -9.947 86 H ILE 12 H ILE 12 -0.471 1.979 -5.319 87 HA ILE 12 HA ILE 12 -0.356 1.598 -2.547 88 HB ILE 12 HB ILE 12 1.971 1.806 -4.466 89 HG12 ILE 12 1HG1 ILE 12 0.538 0.147 -5.373 90 HG13 ILE 12 2HG1 ILE 12 1.820 -0.714 -4.538 91 HG21 ILE 12 1HG2 ILE 12 2.059 -0.044 -2.054 92 HG22 ILE 12 2HG2 ILE 12 3.386 0.667 -2.951 93 HG23 ILE 12 3HG2 ILE 12 2.503 1.605 -1.741 94 HD11 ILE 12 3HD1 ILE 12 -0.227 -1.848 -4.060 95 HD12 ILE 12 1HD1 ILE 12 0.172 -0.993 -2.566 96 HD13 ILE 12 2HD1 ILE 12 -1.069 -0.350 -3.660 97 H THR 13 H THR 13 1.026 4.399 -4.298 98 HA THR 13 HA THR 13 1.525 6.439 -3.630 99 HB THR 13 HB THR 13 -0.309 5.739 -1.326 100 HG1 THR 13 1HG THR 13 -1.344 5.468 -3.166 101 HG21 THR 13 3HG2 THR 13 -0.829 8.079 -1.137 102 HG22 THR 13 1HG2 THR 13 0.344 8.514 -2.407 103 HG23 THR 13 2HG2 THR 13 0.895 7.867 -0.842 104 H GLY 14 H GLY 14 2.006 4.546 -0.545 105 HA2 GLY 14 1HA GLY 14 4.820 5.372 -0.742 106 HA3 GLY 14 2HA GLY 14 4.005 5.783 0.759 107 H ILE 15 H ILE 15 6.151 4.051 0.613 108 HA ILE 15 HA ILE 15 4.981 1.480 1.595 109 HB ILE 15 HB ILE 15 5.052 1.226 -0.821 110 HG12 ILE 15 1HG1 ILE 15 7.022 -0.734 0.359 111 HG13 ILE 15 2HG1 ILE 15 5.407 -0.603 1.007 112 HG21 ILE 15 1HG2 ILE 15 8.094 1.102 -0.710 113 HG22 ILE 15 2HG2 ILE 15 7.035 1.030 -2.140 114 HG23 ILE 15 3HG2 ILE 15 7.249 2.548 -1.198 115 HD11 ILE 15 3HD1 ILE 15 4.464 -0.963 -1.317 116 HD12 ILE 15 1HD1 ILE 15 6.138 -1.387 -1.823 117 HD13 ILE 15 2HD1 ILE 15 5.256 -2.324 -0.577 118 H THR 16 H THR 16 6.698 0.511 2.934 119 HA THR 16 HA THR 16 9.476 1.110 2.637 120 HB THR 16 HB THR 16 8.761 3.197 3.549 121 HG1 THR 16 1HG THR 16 10.718 2.810 4.082 122 HG21 THR 16 3HG2 THR 16 7.976 3.496 5.831 123 HG22 THR 16 1HG2 THR 16 8.057 1.749 6.165 124 HG23 THR 16 2HG2 THR 16 6.843 2.403 5.054 125 H SER 17 H SER 17 10.361 0.291 5.245 126 HA SER 17 HA SER 17 8.652 -1.812 6.222 127 HB2 SER 17 1HB SER 17 10.320 -3.633 5.992 128 HB3 SER 17 2HB SER 17 9.711 -3.082 4.429 129 HG SER 17 HG SER 17 12.168 -3.337 5.135 130 H ASP 18 H ASP 18 9.668 -2.922 8.074 131 HA ASP 18 HA ASP 18 10.584 -1.210 10.096 132 HB2 ASP 18 1HB ASP 18 9.491 -3.419 10.377 133 HB3 ASP 18 2HB ASP 18 10.957 -4.218 9.812 134 H GLY 19 H GLY 19 12.549 -3.446 8.040 135 HA2 GLY 19 1HA GLY 19 15.049 -2.444 9.096 136 HA3 GLY 19 2HA GLY 19 14.817 -3.586 7.783 137 H ASN 20 H ASN 20 13.067 -0.550 7.350 138 HA ASN 20 HA ASN 20 15.132 0.272 5.343 139 HB2 ASN 20 1HB ASN 20 12.612 -0.421 4.704 140 HB3 ASN 20 2HB ASN 20 12.288 1.240 5.228 141 HD21 ASN 20 1HD2 ASN 20 15.056 -0.209 3.347 142 HD22 ASN 20 2HD2 ASN 20 14.793 0.822 1.977 143 H ASP 21 H ASP 21 14.598 1.092 8.348 144 HA ASP 21 HA ASP 21 14.781 2.948 9.598 145 HB2 ASP 21 1HB ASP 21 15.320 4.726 7.235 146 HB3 ASP 21 2HB ASP 21 15.869 4.878 8.891 147 H PHE 22 H PHE 22 12.310 2.080 8.131 148 HA PHE 22 HA PHE 22 10.165 2.584 7.809 149 HB2 PHE 22 1HB PHE 22 10.746 4.605 10.000 150 HB3 PHE 22 2HB PHE 22 9.147 4.289 9.367 151 HD1 PHE 22 2HD PHE 22 12.001 2.100 10.662 152 HD2 PHE 22 1HD PHE 22 7.789 3.067 10.736 153 HE1 PHE 22 2HE PHE 22 11.615 0.288 12.272 154 HE2 PHE 22 1HE PHE 22 7.432 1.252 12.408 155 HZ PHE 22 HZ PHE 22 9.345 -0.154 13.141 156 H ALA 23 H ALA 23 12.237 3.964 6.180 157 HA ALA 23 HA ALA 23 11.443 6.571 5.452 158 HB1 ALA 23 1HB ALA 23 13.683 5.753 5.142 159 HB2 ALA 23 2HB ALA 23 13.111 4.468 4.033 160 HB3 ALA 23 3HB ALA 23 13.012 6.165 3.558 161 H TRP 24 H TRP 24 9.238 6.540 5.092 162 HA TRP 24 HA TRP 24 7.612 4.778 3.655 163 HB2 TRP 24 1HB TRP 24 7.467 7.704 4.477 164 HB3 TRP 24 2HB TRP 24 6.183 7.000 3.513 165 HD1 TRP 24 HD TRP 24 7.107 7.356 7.031 166 HE1 TRP 24 1HE TRP 24 5.604 5.865 8.496 167 HE3 TRP 24 3HE TRP 24 5.239 4.374 3.369 168 HZ2 TRP 24 2HZ TRP 24 3.898 3.536 8.095 169 HZ3 TRP 24 3HZ TRP 24 3.675 2.577 3.890 170 HH2 TRP 24 HH TRP 24 2.960 2.154 6.245 171 H ASP 25 H ASP 25 9.798 6.890 2.147 172 HA ASP 25 HA ASP 25 9.996 7.817 0.146 173 HB2 ASP 25 1HB ASP 25 10.314 5.324 -0.185 174 HB3 ASP 25 2HB ASP 25 8.686 5.265 -0.763 175 H ASN 26 H ASN 26 8.563 8.037 -2.204 176 HA ASN 26 HA ASN 26 5.800 8.456 -1.589 177 HB2 ASN 26 1HB ASN 26 7.264 10.767 -3.044 178 HB3 ASN 26 2HB ASN 26 5.653 10.792 -2.351 179 HD21 ASN 26 1HD2 ASN 26 5.507 11.020 0.034 180 HD22 ASN 26 2HD2 ASN 26 6.980 11.332 0.942 181 H LEU 27 H LEU 27 5.128 7.020 -3.060 182 HA LEU 27 HA LEU 27 6.757 6.422 -5.356 183 HB2 LEU 27 1HB LEU 27 3.965 5.459 -4.665 184 HB3 LEU 27 2HB LEU 27 5.090 4.705 -5.810 185 HG LEU 27 HG LEU 27 5.577 4.971 -2.815 186 HD11 LEU 27 1HD1 LEU 27 5.108 2.609 -2.625 187 HD12 LEU 27 2HD1 LEU 27 4.759 2.496 -4.364 188 HD13 LEU 27 3HD1 LEU 27 3.705 3.442 -3.295 189 HD21 LEU 27 3HD2 LEU 27 7.075 3.332 -4.890 190 HD22 LEU 27 1HD2 LEU 27 7.399 3.422 -3.150 191 HD23 LEU 27 2HD2 LEU 27 7.662 4.843 -4.115 192 H THR 28 H THR 28 6.448 6.929 -7.522 193 HA THR 28 HA THR 28 4.985 9.254 -8.049 194 HB THR 28 HB THR 28 5.759 7.846 -10.473 195 HG1 THR 28 1HG THR 28 8.045 7.678 -9.877 196 HG21 THR 28 3HG2 THR 28 7.361 9.751 -10.575 197 HG22 THR 28 1HG2 THR 28 7.002 10.112 -8.872 198 HG23 THR 28 2HG2 THR 28 5.738 10.295 -10.104 199 H SER 29 H SER 29 3.271 9.532 -9.670 200 HA SER 29 HA SER 29 1.061 7.804 -9.123 201 HB2 SER 29 1HB SER 29 1.270 10.024 -11.178 202 HB3 SER 29 2HB SER 29 -0.196 9.418 -10.384 203 HG SER 29 HG SER 29 1.212 10.061 -8.377 204 H SER 30 H SER 30 3.510 7.062 -11.195 205 HA SER 30 HA SER 30 1.794 5.079 -12.458 206 HB2 SER 30 1HB SER 30 2.787 5.497 -14.710 207 HB3 SER 30 2HB SER 30 1.696 6.755 -14.133 208 HG SER 30 HG SER 30 3.263 8.045 -14.611 209 H GLN 31 H GLN 31 3.943 5.236 -10.337 210 HA GLN 31 HA GLN 31 6.395 4.117 -11.262 211 HB2 GLN 31 1HB GLN 31 5.808 5.040 -8.895 212 HB3 GLN 31 2HB GLN 31 5.118 3.442 -8.586 213 HG2 GLN 31 1HG GLN 31 7.092 2.711 -7.974 214 HG3 GLN 31 2HG GLN 31 7.678 2.895 -9.616 215 HE21 GLN 31 1HE2 GLN 31 7.408 4.598 -6.455 216 HE22 GLN 31 2HE2 GLN 31 8.807 5.608 -6.729 217 H THR 32 H THR 32 7.114 1.975 -11.426 218 HA THR 32 HA THR 32 5.110 -0.217 -11.321 219 HB THR 32 HB THR 32 6.114 -1.082 -13.332 220 HG1 THR 32 1HG THR 32 8.128 -0.381 -13.588 221 HG21 THR 32 3HG2 THR 32 5.245 0.369 -14.948 222 HG22 THR 32 1HG2 THR 32 5.534 1.820 -13.968 223 HG23 THR 32 2HG2 THR 32 4.278 0.653 -13.504 224 H LYS 33 H LYS 33 8.129 0.919 -10.083 225 HA LYS 33 HA LYS 33 8.617 -1.714 -8.955 226 HB2 LYS 33 1HB LYS 33 9.985 -1.455 -11.167 227 HB3 LYS 33 2HB LYS 33 10.969 -0.280 -10.282 228 HG2 LYS 33 1HG LYS 33 10.375 -2.946 -9.040 229 HG3 LYS 33 2HG LYS 33 11.481 -2.953 -10.400 230 HD2 LYS 33 1HD LYS 33 12.109 -0.987 -8.230 231 HD3 LYS 33 2HD LYS 33 12.309 -2.701 -7.835 232 HE2 LYS 33 1HE LYS 33 13.859 -3.026 -9.629 233 HE3 LYS 33 2HE LYS 33 13.528 -1.438 -10.330 234 HZ1 LYS 33 3HZ LYS 33 14.554 -0.409 -8.413 235 HZ2 LYS 33 1HZ LYS 33 15.616 -1.503 -9.033 236 HZ3 LYS 33 2HZ LYS 33 14.812 -1.824 -7.661 237 H ALA 34 H ALA 34 9.798 -1.520 -6.968 238 HA ALA 34 HA ALA 34 8.998 0.695 -5.483 239 HB1 ALA 34 1HB ALA 34 11.105 -1.449 -4.889 240 HB2 ALA 34 2HB ALA 34 10.353 -0.408 -3.671 241 HB3 ALA 34 3HB ALA 34 9.360 -1.551 -4.556 242 HA PRO 35 HA PRO 35 12.505 3.514 -5.649 243 HB2 PRO 35 1HB PRO 35 12.764 4.263 -3.002 244 HB3 PRO 35 2HB PRO 35 11.481 4.890 -4.098 245 HG2 PRO 35 1HG PRO 35 11.280 2.558 -2.151 246 HG3 PRO 35 2HG PRO 35 10.142 3.907 -2.328 247 HD2 PRO 35 1HD PRO 35 9.549 1.696 -3.496 248 HD3 PRO 35 2HD PRO 35 9.414 3.165 -4.491 249 H ASN 36 H ASN 36 12.409 0.644 -3.443 250 HA ASN 36 HA ASN 36 15.310 0.539 -3.418 251 HB2 ASN 36 1HB ASN 36 13.875 2.032 -1.416 252 HB3 ASN 36 2HB ASN 36 14.295 0.513 -0.651 253 HD21 ASN 36 1HD2 ASN 36 15.817 2.833 -2.966 254 HD22 ASN 36 2HD2 ASN 36 17.254 3.077 -1.991 255 H VAL 37 H VAL 37 16.141 -1.160 -2.206 256 HA VAL 37 HA VAL 37 14.599 -3.573 -1.917 257 HB VAL 37 HB VAL 37 16.629 -3.935 -2.918 258 HG11 VAL 37 1HG1 VAL 37 17.649 -2.129 -2.861 259 HG12 VAL 37 2HG1 VAL 37 17.942 -2.131 -1.083 260 HG13 VAL 37 3HG1 VAL 37 18.731 -3.342 -2.214 261 HG21 VAL 37 3HG2 VAL 37 17.165 -4.587 -0.049 262 HG22 VAL 37 1HG2 VAL 37 16.229 -5.609 -1.201 263 HG23 VAL 37 2HG2 VAL 37 17.935 -5.335 -1.464 264 H LEU 38 H LEU 38 13.186 -3.184 -0.477 265 HA LEU 38 HA LEU 38 13.460 -2.029 2.141 266 HB2 LEU 38 1HB LEU 38 11.392 -3.996 1.063 267 HB3 LEU 38 2HB LEU 38 11.204 -2.946 2.453 268 HG LEU 38 HG LEU 38 11.434 -2.078 -0.446 269 HD11 LEU 38 1HD1 LEU 38 9.294 -3.128 0.300 270 HD12 LEU 38 2HD1 LEU 38 9.126 -1.452 -0.243 271 HD13 LEU 38 3HD1 LEU 38 9.103 -1.826 1.499 272 HD21 LEU 38 3HD2 LEU 38 12.480 -0.349 0.853 273 HD22 LEU 38 1HD2 LEU 38 11.183 -0.369 2.063 274 HD23 LEU 38 2HD2 LEU 38 10.876 0.216 0.404 275 H LYS 39 H LYS 39 14.799 -2.960 3.683 276 HA LYS 39 HA LYS 39 15.147 -5.876 3.756 277 HB2 LYS 39 1HB LYS 39 16.127 -3.937 5.846 278 HB3 LYS 39 2HB LYS 39 16.805 -5.490 5.426 279 HG2 LYS 39 1HG LYS 39 17.711 -4.615 3.324 280 HG3 LYS 39 2HG LYS 39 16.901 -3.072 3.540 281 HD2 LYS 39 1HD LYS 39 18.183 -2.911 5.825 282 HD3 LYS 39 2HD LYS 39 19.134 -4.253 5.172 283 HE2 LYS 39 1HE LYS 39 19.533 -2.752 3.125 284 HE3 LYS 39 2HE LYS 39 18.779 -1.437 4.047 285 HZ1 LYS 39 3HZ LYS 39 21.256 -2.924 4.691 286 HZ2 LYS 39 1HZ LYS 39 20.560 -1.782 5.690 287 HZ3 LYS 39 2HZ LYS 39 21.161 -1.370 4.208 288 H GLY 40 H GLY 40 14.907 -7.044 5.955 289 HA2 GLY 40 1HA GLY 40 13.686 -7.429 7.957 290 HA3 GLY 40 2HA GLY 40 12.708 -6.001 7.670 291 H ASN 41 H ASN 41 11.016 -7.826 8.201 292 HA ASN 41 HA ASN 41 10.037 -8.899 5.553 293 HB2 ASN 41 1HB ASN 41 10.517 -10.728 7.086 294 HB3 ASN 41 2HB ASN 41 9.528 -9.953 8.338 295 HD21 ASN 41 1HD2 ASN 41 7.677 -11.126 8.606 296 HD22 ASN 41 2HD2 ASN 41 6.827 -11.945 7.306 297 H LYS 42 H LYS 42 9.232 -6.905 8.397 298 HA LYS 42 HA LYS 42 6.424 -6.837 7.675 299 HB2 LYS 42 1HB LYS 42 8.030 -5.193 9.668 300 HB3 LYS 42 2HB LYS 42 6.294 -4.995 9.403 301 HG2 LYS 42 1HG LYS 42 7.480 -7.706 10.082 302 HG3 LYS 42 2HG LYS 42 7.003 -6.565 11.330 303 HD2 LYS 42 1HD LYS 42 4.744 -6.792 10.888 304 HD3 LYS 42 2HD LYS 42 4.967 -7.283 9.204 305 HE2 LYS 42 1HE LYS 42 5.825 -9.455 9.872 306 HE3 LYS 42 2HE LYS 42 5.797 -8.989 11.572 307 HZ1 LYS 42 3HZ LYS 42 3.360 -9.275 9.900 308 HZ2 LYS 42 1HZ LYS 42 3.412 -8.926 11.517 309 HZ3 LYS 42 2HZ LYS 42 3.934 -10.360 10.994 310 H LEU 43 H LEU 43 5.854 -6.000 5.922 311 HA LEU 43 HA LEU 43 7.224 -3.793 4.535 312 HB2 LEU 43 1HB LEU 43 6.031 -6.219 3.700 313 HB3 LEU 43 2HB LEU 43 4.791 -5.020 3.338 314 HG LEU 43 HG LEU 43 7.667 -4.883 2.382 315 HD11 LEU 43 1HD1 LEU 43 5.162 -5.569 0.785 316 HD12 LEU 43 2HD1 LEU 43 6.292 -6.786 1.423 317 HD13 LEU 43 3HD1 LEU 43 6.840 -5.598 0.228 318 HD21 LEU 43 3HD2 LEU 43 5.203 -3.256 1.604 319 HD22 LEU 43 1HD2 LEU 43 6.815 -3.170 0.850 320 HD23 LEU 43 2HD2 LEU 43 6.605 -2.654 2.512 321 H TYR 44 H TYR 44 6.427 -1.779 4.912 322 HA TYR 44 HA TYR 44 3.691 -1.485 6.046 323 HB2 TYR 44 1HB TYR 44 6.064 0.393 6.242 324 HB3 TYR 44 2HB TYR 44 4.487 0.614 6.979 325 HD1 TYR 44 2HD TYR 44 3.857 -1.963 8.230 326 HD2 TYR 44 1HD TYR 44 7.630 0.107 7.936 327 HE1 TYR 44 2HE TYR 44 4.626 -3.102 10.286 328 HE2 TYR 44 1HE TYR 44 8.365 -0.960 10.064 329 HH TYR 44 HH TYR 44 6.191 -2.905 12.080 330 H VAL 45 H VAL 45 2.270 -0.501 4.672 331 HA VAL 45 HA VAL 45 3.227 1.099 2.257 332 HB VAL 45 HB VAL 45 2.672 -1.521 2.191 333 HG11 VAL 45 1HG1 VAL 45 0.211 -0.431 1.435 334 HG12 VAL 45 2HG1 VAL 45 0.919 -2.086 1.313 335 HG13 VAL 45 3HG1 VAL 45 0.703 -1.337 2.938 336 HG21 VAL 45 3HG2 VAL 45 1.723 0.449 0.062 337 HG22 VAL 45 1HG2 VAL 45 3.437 0.195 0.310 338 HG23 VAL 45 2HG2 VAL 45 2.424 -1.177 -0.211 339 H LYS 46 H LYS 46 1.766 2.664 1.760 340 HA LYS 46 HA LYS 46 -0.488 3.200 3.668 341 HB2 LYS 46 1HB LYS 46 1.486 4.476 4.464 342 HB3 LYS 46 2HB LYS 46 1.748 5.087 2.830 343 HG2 LYS 46 1HG LYS 46 -1.020 5.600 3.457 344 HG3 LYS 46 2HG LYS 46 -0.164 5.914 4.919 345 HD2 LYS 46 1HD LYS 46 1.027 7.095 2.394 346 HD3 LYS 46 2HD LYS 46 -0.544 7.666 2.928 347 HE2 LYS 46 1HE LYS 46 0.627 7.774 5.302 348 HE3 LYS 46 2HE LYS 46 2.100 7.846 4.341 349 HZ1 LYS 46 3HZ LYS 46 1.140 9.843 3.266 350 HZ2 LYS 46 1HZ LYS 46 1.030 10.050 4.887 351 HZ3 LYS 46 2HZ LYS 46 -0.296 9.626 4.018 352 H ALA 47 H ALA 47 -1.944 2.587 1.987 353 HA ALA 47 HA ALA 47 -1.452 3.749 -0.700 354 HB1 ALA 47 1HB ALA 47 -1.564 1.277 -0.421 355 HB2 ALA 47 2HB ALA 47 -3.283 1.454 0.025 356 HB3 ALA 47 3HB ALA 47 -2.694 1.934 -1.589 357 H ARG 48 H ARG 48 -2.988 4.886 -1.856 358 HA ARG 48 HA ARG 48 -4.624 6.527 -0.031 359 HB2 ARG 48 1HB ARG 48 -2.963 7.549 -1.492 360 HB3 ARG 48 2HB ARG 48 -3.736 6.879 -2.913 361 HG2 ARG 48 1HG ARG 48 -5.025 8.689 -3.080 362 HG3 ARG 48 2HG ARG 48 -5.816 8.312 -1.569 363 HD2 ARG 48 1HD ARG 48 -4.970 10.518 -1.330 364 HD3 ARG 48 2HD ARG 48 -3.956 9.496 -0.330 365 HE ARG 48 HE ARG 48 -2.139 9.942 -1.580 366 HH11 ARG 48 1HH1 ARG 48 -4.916 11.337 -3.420 367 HH12 ARG 48 2HH1 ARG 48 -3.956 12.708 -3.923 368 HH21 ARG 48 1HH2 ARG 48 -1.004 11.629 -2.426 369 HH22 ARG 48 2HH2 ARG 48 -1.657 12.715 -3.628 370 H PHE 49 H PHE 49 -6.674 5.692 0.275 371 HA PHE 49 HA PHE 49 -8.150 4.604 -2.081 372 HB2 PHE 49 1HB PHE 49 -8.782 4.203 0.799 373 HB3 PHE 49 2HB PHE 49 -9.729 3.599 -0.563 374 HD1 PHE 49 1HD PHE 49 -6.518 3.382 1.219 375 HD2 PHE 49 2HD PHE 49 -8.848 1.519 -1.921 376 HE1 PHE 49 1HE PHE 49 -5.136 1.376 1.356 377 HE2 PHE 49 2HE PHE 49 -7.501 -0.477 -1.730 378 HZ PHE 49 HZ PHE 49 -5.621 -0.599 -0.084 379 H MET 50 H MET 50 -8.722 6.232 -3.198 380 HA MET 50 HA MET 50 -10.019 8.545 -1.979 381 HB2 MET 50 1HB MET 50 -9.846 8.044 -4.959 382 HB3 MET 50 2HB MET 50 -10.051 9.563 -4.119 383 HG2 MET 50 1HG MET 50 -7.533 8.012 -3.680 384 HG3 MET 50 2HG MET 50 -7.785 8.801 -5.241 385 HE1 MET 50 3HE MET 50 -9.123 10.565 -1.955 386 HE2 MET 50 1HE MET 50 -7.927 9.348 -1.429 387 HE3 MET 50 2HE MET 50 -7.577 11.089 -1.233 388 H GLY 51 H GLY 51 -11.844 7.805 -1.149 389 HA2 GLY 51 1HA GLY 51 -14.282 7.742 -1.712 390 HA3 GLY 51 2HA GLY 51 -13.922 6.536 -2.929 391 H TYR 52 H TYR 52 -15.819 6.007 -1.037 392 HA TYR 52 HA TYR 52 -14.828 4.668 1.295 393 HB2 TYR 52 1HB TYR 52 -17.422 5.258 0.070 394 HB3 TYR 52 2HB TYR 52 -17.382 3.622 0.676 395 HD1 TYR 52 2HD TYR 52 -17.041 3.122 3.081 396 HD2 TYR 52 1HD TYR 52 -17.276 7.156 1.600 397 HE1 TYR 52 2HE TYR 52 -17.450 3.926 5.371 398 HE2 TYR 52 1HE TYR 52 -17.740 7.991 3.875 399 HH TYR 52 HH TYR 52 -17.333 6.034 6.667 400 H THR 53 H THR 53 -14.099 2.634 1.592 401 HA THR 53 HA THR 53 -15.215 0.432 0.189 402 HB THR 53 HB THR 53 -13.508 0.936 -1.483 403 HG1 THR 53 1HG THR 53 -13.463 -1.092 -1.530 404 HG21 THR 53 3HG2 THR 53 -11.891 2.249 -0.297 405 HG22 THR 53 1HG2 THR 53 -11.065 0.814 -0.911 406 HG23 THR 53 2HG2 THR 53 -11.498 0.933 0.808 407 H LYS 54 H LYS 54 -14.982 -1.400 1.402 408 HA LYS 54 HA LYS 54 -13.157 -1.496 3.654 409 HB2 LYS 54 1HB LYS 54 -16.141 -1.316 3.980 410 HB3 LYS 54 2HB LYS 54 -15.343 -2.478 4.999 411 HG2 LYS 54 1HG LYS 54 -13.889 0.076 5.077 412 HG3 LYS 54 2HG LYS 54 -15.569 0.287 5.451 413 HD2 LYS 54 1HD LYS 54 -15.503 -1.184 7.306 414 HD3 LYS 54 2HD LYS 54 -13.959 -1.908 6.797 415 HE2 LYS 54 1HE LYS 54 -12.785 0.194 7.225 416 HE3 LYS 54 2HE LYS 54 -14.304 0.978 7.700 417 HZ1 LYS 54 3HZ LYS 54 -13.069 -1.296 9.127 418 HZ2 LYS 54 1HZ LYS 54 -14.436 -0.498 9.579 419 HZ3 LYS 54 2HZ LYS 54 -12.988 0.282 9.597 420 H LEU 55 H LEU 55 -13.124 -2.745 1.130 421 HA LEU 55 HA LEU 55 -13.349 -5.606 1.831 422 HB2 LEU 55 1HB LEU 55 -14.269 -4.359 -0.780 423 HB3 LEU 55 2HB LEU 55 -13.970 -6.065 -0.511 424 HG LEU 55 HG LEU 55 -15.803 -5.841 1.385 425 HD11 LEU 55 1HD1 LEU 55 -17.623 -4.262 0.651 426 HD12 LEU 55 2HD1 LEU 55 -16.497 -3.524 -0.501 427 HD13 LEU 55 3HD1 LEU 55 -16.206 -3.412 1.251 428 HD21 LEU 55 3HD2 LEU 55 -16.318 -5.926 -1.608 429 HD22 LEU 55 1HD2 LEU 55 -17.520 -6.364 -0.403 430 HD23 LEU 55 2HD2 LEU 55 -16.018 -7.297 -0.533 431 H THR 56 H THR 56 -11.053 -4.377 2.285 432 HA THR 56 HA THR 56 -9.283 -4.280 0.004 433 HB THR 56 HB THR 56 -7.804 -4.810 2.390 434 HG1 THR 56 1HG THR 56 -9.426 -4.394 3.770 435 HG21 THR 56 3HG2 THR 56 -7.153 -3.237 0.664 436 HG22 THR 56 1HG2 THR 56 -7.244 -2.417 2.234 437 HG23 THR 56 2HG2 THR 56 -8.540 -2.183 1.051 438 H VAL 57 H VAL 57 -8.111 -5.984 -0.925 439 HA VAL 57 HA VAL 57 -7.944 -8.559 0.545 440 HB VAL 57 HB VAL 57 -8.692 -8.179 -2.406 441 HG11 VAL 57 1HG1 VAL 57 -8.383 -10.753 -0.787 442 HG12 VAL 57 2HG1 VAL 57 -9.097 -10.639 -2.401 443 HG13 VAL 57 3HG1 VAL 57 -7.410 -10.220 -2.162 444 HG21 VAL 57 3HG2 VAL 57 -10.460 -8.998 -0.079 445 HG22 VAL 57 1HG2 VAL 57 -10.655 -7.616 -1.163 446 HG23 VAL 57 2HG2 VAL 57 -10.883 -9.242 -1.789 447 H ILE 58 H ILE 58 -6.051 -9.769 -0.157 448 HA ILE 58 HA ILE 58 -4.029 -8.494 -1.829 449 HB ILE 58 HB ILE 58 -3.347 -9.344 1.009 450 HG12 ILE 58 1HG1 ILE 58 -3.744 -6.454 0.148 451 HG13 ILE 58 2HG1 ILE 58 -4.780 -7.359 1.261 452 HG21 ILE 58 1HG2 ILE 58 -1.792 -7.660 -1.005 453 HG22 ILE 58 2HG2 ILE 58 -1.192 -8.279 0.546 454 HG23 ILE 58 3HG2 ILE 58 -1.559 -9.408 -0.742 455 HD11 ILE 58 3HD1 ILE 58 -1.959 -6.443 1.748 456 HD12 ILE 58 1HD1 ILE 58 -3.425 -6.054 2.655 457 HD13 ILE 58 2HD1 ILE 58 -2.736 -7.691 2.764 458 H THR 59 H THR 59 -3.509 -10.314 -3.141 459 HA THR 59 HA THR 59 -4.706 -12.775 -2.598 460 HB THR 59 HB THR 59 -2.480 -12.463 -4.613 461 HG1 THR 59 1HG THR 59 -3.949 -11.470 -6.025 462 HG21 THR 59 3HG2 THR 59 -3.721 -13.934 -5.965 463 HG22 THR 59 1HG2 THR 59 -5.249 -13.629 -5.095 464 HG23 THR 59 2HG2 THR 59 -3.970 -14.563 -4.347 465 H GLY 60 H GLY 60 -1.367 -11.619 -2.224 466 HA2 GLY 60 1HA GLY 60 0.455 -12.477 -1.157 467 HA3 GLY 60 2HA GLY 60 -0.647 -13.583 -0.306 468 H LYS 61 H LYS 61 1.380 -14.966 -0.513 469 HA LYS 61 HA LYS 61 2.155 -16.109 -2.968 470 HB2 LYS 61 1HB LYS 61 3.625 -15.661 -1.161 471 HB3 LYS 61 2HB LYS 61 2.558 -16.368 0.047 472 HG2 LYS 61 1HG LYS 61 2.956 -18.444 -0.557 473 HG3 LYS 61 2HG LYS 61 3.734 -18.075 -2.120 474 HD2 LYS 61 1HD LYS 61 4.909 -17.594 0.661 475 HD3 LYS 61 2HD LYS 61 5.449 -18.788 -0.531 476 HE2 LYS 61 1HE LYS 61 6.039 -16.878 -2.076 477 HE3 LYS 61 2HE LYS 61 5.622 -15.745 -0.783 478 HZ1 LYS 61 3HZ LYS 61 7.808 -17.715 -0.727 479 HZ2 LYS 61 1HZ LYS 61 7.327 -16.775 0.583 480 HZ3 LYS 61 2HZ LYS 61 7.885 -16.072 -0.775 481 H ASP 62 H ASP 62 0.492 -17.348 -0.105 482 HA ASP 62 HA ASP 62 -0.338 -19.765 -1.021 483 HB2 ASP 62 1HB ASP 62 -0.812 -18.103 1.220 484 HB3 ASP 62 2HB ASP 62 -2.412 -18.415 0.598 485 H GLY 63 H GLY 63 -1.762 -16.673 -1.885 486 HA2 GLY 63 1HA GLY 63 -3.174 -16.320 -3.727 487 HA3 GLY 63 2HA GLY 63 -3.720 -17.987 -3.685 488 H LYS 64 H LYS 64 -3.661 -16.410 -0.572 489 HA LYS 64 HA LYS 64 -6.607 -16.150 -0.653 490 HB2 LYS 64 1HB LYS 64 -6.883 -17.124 1.426 491 HB3 LYS 64 2HB LYS 64 -6.137 -18.284 0.346 492 HG2 LYS 64 1HG LYS 64 -4.361 -18.542 1.732 493 HG3 LYS 64 2HG LYS 64 -4.110 -16.794 1.804 494 HD2 LYS 64 1HD LYS 64 -4.535 -17.358 4.027 495 HD3 LYS 64 2HD LYS 64 -6.068 -16.703 3.456 496 HE2 LYS 64 1HE LYS 64 -5.286 -19.511 4.226 497 HE3 LYS 64 2HE LYS 64 -6.703 -18.583 4.712 498 HZ1 LYS 64 3HZ LYS 64 -7.442 -18.942 2.273 499 HZ2 LYS 64 1HZ LYS 64 -7.495 -20.197 3.299 500 HZ3 LYS 64 2HZ LYS 64 -6.258 -20.120 2.255 501 H ASN 65 H ASN 65 -7.457 -14.798 0.928 502 HA ASN 65 HA ASN 65 -6.352 -12.232 0.762 503 HB2 ASN 65 1HB ASN 65 -8.787 -13.079 1.173 504 HB3 ASN 65 2HB ASN 65 -8.364 -13.138 2.883 505 HD21 ASN 65 1HD2 ASN 65 -7.381 -10.933 3.713 506 HD22 ASN 65 2HD2 ASN 65 -8.390 -9.589 3.227 507 H LEU 66 H LEU 66 -4.256 -12.056 1.600 508 HA LEU 66 HA LEU 66 -3.266 -13.169 3.946 509 HB2 LEU 66 1HB LEU 66 -2.588 -10.439 2.735 510 HB3 LEU 66 2HB LEU 66 -1.615 -11.248 3.934 511 HG LEU 66 HG LEU 66 -2.125 -12.134 1.080 512 HD11 LEU 66 1HD1 LEU 66 0.389 -11.916 1.019 513 HD12 LEU 66 2HD1 LEU 66 0.390 -11.419 2.701 514 HD13 LEU 66 3HD1 LEU 66 -0.394 -10.392 1.472 515 HD21 LEU 66 3HD2 LEU 66 -0.952 -13.706 3.404 516 HD22 LEU 66 1HD2 LEU 66 -0.433 -14.037 1.762 517 HD23 LEU 66 2HD2 LEU 66 -2.137 -14.227 2.192 518 H LEU 67 H LEU 67 -5.355 -10.342 3.752 519 HA LEU 67 HA LEU 67 -4.826 -9.481 6.483 520 HB2 LEU 67 1HB LEU 67 -6.433 -8.609 4.167 521 HB3 LEU 67 2HB LEU 67 -7.420 -8.590 5.611 522 HG LEU 67 HG LEU 67 -5.950 -6.980 6.684 523 HD11 LEU 67 1HD1 LEU 67 -4.228 -7.378 4.270 524 HD12 LEU 67 2HD1 LEU 67 -3.778 -7.623 5.958 525 HD13 LEU 67 3HD1 LEU 67 -4.052 -5.981 5.371 526 HD21 LEU 67 3HD2 LEU 67 -6.529 -6.213 3.783 527 HD22 LEU 67 1HD2 LEU 67 -6.299 -5.083 5.140 528 HD23 LEU 67 2HD2 LEU 67 -7.699 -6.168 5.117 529 H TYR 68 H TYR 68 -6.581 -12.182 5.263 530 HA TYR 68 HA TYR 68 -7.880 -12.497 7.886 531 HB2 TYR 68 1HB TYR 68 -9.401 -11.938 5.875 532 HB3 TYR 68 2HB TYR 68 -8.962 -13.518 5.235 533 HD1 TYR 68 1HD TYR 68 -9.903 -12.105 8.625 534 HD2 TYR 68 2HD TYR 68 -10.599 -15.158 5.668 535 HE1 TYR 68 1HE TYR 68 -11.667 -13.029 10.042 536 HE2 TYR 68 2HE TYR 68 -12.366 -16.112 7.079 537 HH TYR 68 HH TYR 68 -13.451 -15.992 9.202 538 H ASN 69 H ASN 69 -5.323 -13.293 6.422 539 HA ASN 69 HA ASN 69 -5.234 -16.190 7.081 540 HB2 ASN 69 1HB ASN 69 -3.863 -15.522 5.169 541 HB3 ASN 69 2HB ASN 69 -3.243 -14.138 6.025 542 HD21 ASN 69 1HD2 ASN 69 -3.093 -17.816 6.098 543 HD22 ASN 69 2HD2 ASN 69 -1.468 -17.722 6.640 544 H GLY 70 H GLY 70 -3.075 -13.473 7.948 545 HA2 GLY 70 1HA GLY 70 -4.008 -12.552 10.283 546 HA3 GLY 70 2HA GLY 70 -3.302 -14.081 10.817 547 H THR 71 H THR 71 -1.311 -13.328 8.321 548 HA THR 71 HA THR 71 0.683 -12.169 10.143 549 HB THR 71 HB THR 71 0.780 -13.315 7.336 550 HG1 THR 71 1HG THR 71 1.373 -15.101 8.311 551 HG21 THR 71 3HG2 THR 71 3.207 -13.371 7.513 552 HG22 THR 71 1HG2 THR 71 3.142 -12.464 9.036 553 HG23 THR 71 2HG2 THR 71 2.623 -11.707 7.526 554 H ALA 72 H ALA 72 -1.572 -11.007 7.704 555 HA ALA 72 HA ALA 72 -0.333 -8.357 8.012 556 HB1 ALA 72 1HB ALA 72 -2.036 -9.327 5.667 557 HB2 ALA 72 2HB ALA 72 -1.204 -7.761 5.819 558 HB3 ALA 72 3HB ALA 72 -0.267 -9.258 5.624 559 H LYS 73 H LYS 73 -1.671 -6.683 8.440 560 HA LYS 73 HA LYS 73 -4.555 -6.872 8.434 561 HB2 LYS 73 1HB LYS 73 -4.288 -8.067 10.464 562 HB3 LYS 73 2HB LYS 73 -2.946 -7.051 10.996 563 HG2 LYS 73 1HG LYS 73 -4.374 -5.197 11.363 564 HG3 LYS 73 2HG LYS 73 -5.795 -6.055 10.721 565 HD2 LYS 73 1HD LYS 73 -4.174 -6.945 13.151 566 HD3 LYS 73 2HD LYS 73 -5.573 -5.917 13.284 567 HE2 LYS 73 1HE LYS 73 -5.795 -8.627 11.908 568 HE3 LYS 73 2HE LYS 73 -5.740 -8.514 13.670 569 HZ1 LYS 73 3HZ LYS 73 -8.001 -8.560 12.912 570 HZ2 LYS 73 1HZ LYS 73 -7.838 -7.176 12.050 571 HZ3 LYS 73 2HZ LYS 73 -7.684 -7.186 13.679 572 H MET 74 H MET 74 -5.431 -4.624 8.664 573 HA MET 74 HA MET 74 -3.406 -2.538 8.326 574 HB2 MET 74 1HB MET 74 -5.159 -1.126 7.763 575 HB3 MET 74 2HB MET 74 -5.512 -2.666 6.965 576 HG2 MET 74 1HG MET 74 -7.080 -3.160 8.889 577 HG3 MET 74 2HG MET 74 -6.740 -1.566 9.510 578 HE1 MET 74 3HE MET 74 -6.786 0.354 6.933 579 HE2 MET 74 1HE MET 74 -6.628 -1.081 5.878 580 HE3 MET 74 2HE MET 74 -8.048 -0.039 5.725 581 H PHE 75 H PHE 75 -3.007 -0.885 9.792 582 HA PHE 75 HA PHE 75 -4.191 -1.164 12.507 583 HB2 PHE 75 1HB PHE 75 -2.052 -1.220 13.510 584 HB3 PHE 75 2HB PHE 75 -2.157 -2.498 12.330 585 HD1 PHE 75 2HD PHE 75 -0.959 -2.220 10.062 586 HD2 PHE 75 1HD PHE 75 -0.278 0.374 13.444 587 HE1 PHE 75 2HE PHE 75 1.239 -1.537 9.110 588 HE2 PHE 75 1HE PHE 75 1.921 1.008 12.510 589 HZ PHE 75 HZ PHE 75 2.685 0.040 10.337 590 H LYS 76 H LYS 76 -3.820 1.057 10.047 591 HA LYS 76 HA LYS 76 -4.093 3.300 11.864 592 HB2 LYS 76 1HB LYS 76 -1.661 2.976 11.900 593 HB3 LYS 76 2HB LYS 76 -1.574 3.013 10.165 594 HG2 LYS 76 1HG LYS 76 -2.067 5.381 10.101 595 HG3 LYS 76 2HG LYS 76 -2.461 5.390 11.834 596 HD2 LYS 76 1HD LYS 76 -0.245 5.174 12.508 597 HD3 LYS 76 2HD LYS 76 0.235 4.312 11.068 598 HE2 LYS 76 1HE LYS 76 1.335 6.422 11.164 599 HE3 LYS 76 2HE LYS 76 0.299 6.345 9.754 600 HZ1 LYS 76 3HZ LYS 76 0.309 8.439 11.082 601 HZ2 LYS 76 1HZ LYS 76 -0.547 7.676 12.250 602 HZ3 LYS 76 2HZ LYS 76 -1.165 7.870 10.696 603 H SER 77 H SER 77 -5.095 5.099 10.657 604 HA SER 77 HA SER 77 -5.346 4.862 7.756 605 HB2 SER 77 1HB SER 77 -7.902 4.737 7.963 606 HB3 SER 77 2HB SER 77 -6.965 3.280 8.194 607 HG SER 77 HG SER 77 -8.207 4.835 10.203 608 H ASP 78 H ASP 78 -4.550 6.884 7.485 609 HA ASP 78 HA ASP 78 -5.335 9.115 9.277 610 HB2 ASP 78 1HB ASP 78 -3.262 8.711 7.118 611 HB3 ASP 78 2HB ASP 78 -3.825 10.338 7.462 612 H ALA 79 H ALA 79 -6.589 10.834 8.565 613 HA ALA 79 HA ALA 79 -8.386 10.351 6.312 614 HB1 ALA 79 1HB ALA 79 -8.122 12.700 8.247 615 HB2 ALA 79 2HB ALA 79 -9.518 12.340 7.217 616 HB3 ALA 79 3HB ALA 79 -9.099 11.248 8.538 617 H ILE 80 H ILE 80 -8.233 11.296 4.244 618 HA ILE 80 HA ILE 80 -5.917 13.141 3.799 619 HB ILE 80 HB ILE 80 -7.511 11.543 1.776 620 HG12 ILE 80 1HG1 ILE 80 -4.596 10.982 2.323 621 HG13 ILE 80 2HG1 ILE 80 -5.786 10.344 3.447 622 HG21 ILE 80 1HG2 ILE 80 -4.942 13.172 1.439 623 HG22 ILE 80 2HG2 ILE 80 -5.739 12.221 0.170 624 HG23 ILE 80 3HG2 ILE 80 -6.546 13.638 0.843 625 HD11 ILE 80 3HD1 ILE 80 -6.001 9.994 0.431 626 HD12 ILE 80 1HD1 ILE 80 -5.311 8.762 1.521 627 HD13 ILE 80 2HD1 ILE 80 -6.990 9.254 1.620 628 H LEU 81 H LEU 81 -6.480 15.141 3.687 629 HA LEU 81 HA LEU 81 -9.251 15.946 2.931 630 HB2 LEU 81 1HB LEU 81 -6.969 17.801 3.656 631 HB3 LEU 81 2HB LEU 81 -8.703 18.154 3.452 632 HG LEU 81 HG LEU 81 -7.403 16.615 5.720 633 HD11 LEU 81 1HD1 LEU 81 -7.281 19.112 5.783 634 HD12 LEU 81 2HD1 LEU 81 -8.312 18.470 7.060 635 HD13 LEU 81 3HD1 LEU 81 -9.048 19.202 5.612 636 HD21 LEU 81 3HD2 LEU 81 -9.545 15.528 5.185 637 HD22 LEU 81 1HD2 LEU 81 -10.364 17.080 5.129 638 HD23 LEU 81 2HD2 LEU 81 -9.700 16.457 6.668 639 H GLY 82 H GLY 82 -9.810 16.954 1.035 640 HA2 GLY 82 1HA GLY 82 -7.725 17.083 -1.099 641 HA3 GLY 82 2HA GLY 82 -9.460 16.899 -1.314 642 H GLN 83 H GLN 83 -7.388 19.221 0.461 643 HA GLN 83 HA GLN 83 -7.014 21.384 0.418 644 HB2 GLN 83 1HB GLN 83 -8.345 21.614 -2.293 645 HB3 GLN 83 2HB GLN 83 -7.256 22.748 -1.525 646 HG2 GLN 83 1HG GLN 83 -6.639 20.129 -2.834 647 HG3 GLN 83 2HG GLN 83 -5.853 21.692 -3.032 648 HE21 GLN 83 1HE2 GLN 83 -5.339 18.627 -1.827 649 HE22 GLN 83 2HE2 GLN 83 -4.387 19.012 -0.388 650 H ASN 84 H ASN 84 -10.260 20.993 -0.916 651 HA ASN 84 HA ASN 84 -11.423 23.210 0.570 652 HB2 ASN 84 1HB ASN 84 -12.533 20.934 -1.146 653 HB3 ASN 84 2HB ASN 84 -13.627 21.978 -0.270 654 HD21 ASN 84 1HD2 ASN 84 -11.626 21.740 -3.104 655 HD22 ASN 84 2HD2 ASN 84 -11.868 23.374 -3.630 656 H LYS 85 H LYS 85 -10.075 21.149 2.302 657 HA LYS 85 HA LYS 85 -10.363 19.697 3.994 658 HB2 LYS 85 1HB LYS 85 -12.874 21.320 4.561 659 HB3 LYS 85 2HB LYS 85 -12.048 20.234 5.672 660 HG2 LYS 85 1HG LYS 85 -9.996 21.642 5.503 661 HG3 LYS 85 2HG LYS 85 -10.894 22.811 4.501 662 HD2 LYS 85 1HD LYS 85 -12.175 23.557 6.321 663 HD3 LYS 85 2HD LYS 85 -12.192 21.974 7.089 664 HE2 LYS 85 1HE LYS 85 -10.788 22.769 8.574 665 HE3 LYS 85 2HE LYS 85 -9.545 22.538 7.347 666 HZ1 LYS 85 3HZ LYS 85 -11.028 25.074 7.762 667 HZ2 LYS 85 1HZ LYS 85 -9.706 24.844 6.784 668 HZ3 LYS 85 2HZ LYS 85 -9.581 24.737 8.416 669 H VAL 86 H VAL 86 -12.026 19.199 1.395 670 HA VAL 86 HA VAL 86 -14.197 17.548 2.144 671 HB VAL 86 HB VAL 86 -14.323 18.526 0.098 672 HG11 VAL 86 1HG1 VAL 86 -11.720 17.225 -0.435 673 HG12 VAL 86 2HG1 VAL 86 -12.737 17.928 -1.732 674 HG13 VAL 86 3HG1 VAL 86 -12.126 18.929 -0.395 675 HG21 VAL 86 3HG2 VAL 86 -14.857 16.666 -1.382 676 HG22 VAL 86 1HG2 VAL 86 -13.849 15.562 -0.429 677 HG23 VAL 86 2HG2 VAL 86 -15.336 16.242 0.267 678 H VAL 87 H VAL 87 -14.280 15.328 2.674 679 HA VAL 87 HA VAL 87 -11.779 14.004 3.293 680 HB VAL 87 HB VAL 87 -14.622 12.879 3.361 681 HG11 VAL 87 1HG1 VAL 87 -13.842 11.267 4.897 682 HG12 VAL 87 2HG1 VAL 87 -12.568 11.270 3.667 683 HG13 VAL 87 3HG1 VAL 87 -12.345 12.102 5.222 684 HG21 VAL 87 3HG2 VAL 87 -14.753 14.859 4.711 685 HG22 VAL 87 1HG2 VAL 87 -14.667 13.461 5.775 686 HG23 VAL 87 2HG2 VAL 87 -13.222 14.462 5.518 687 H ILE 88 H ILE 88 -10.936 14.031 1.024 688 HA ILE 88 HA ILE 88 -12.452 12.710 -1.055 689 HB ILE 88 HB ILE 88 -10.300 12.699 -2.344 690 HG12 ILE 88 1HG1 ILE 88 -9.168 14.373 -0.061 691 HG13 ILE 88 2HG1 ILE 88 -8.750 12.687 -0.306 692 HG21 ILE 88 1HG2 ILE 88 -10.449 15.113 -2.718 693 HG22 ILE 88 2HG2 ILE 88 -12.056 14.466 -2.382 694 HG23 ILE 88 3HG2 ILE 88 -11.180 15.312 -1.101 695 HD11 ILE 88 3HD1 ILE 88 -8.251 14.945 -2.311 696 HD12 ILE 88 1HD1 ILE 88 -7.037 14.119 -1.325 697 HD13 ILE 88 2HD1 ILE 88 -7.897 13.232 -2.591 698 H GLY 89 H GLY 89 -10.350 11.492 1.453 699 HA2 GLY 89 1HA GLY 89 -11.143 8.812 1.044 700 HA3 GLY 89 2HA GLY 89 -9.584 9.066 0.224 701 H TRP 90 H TRP 90 -8.892 7.378 1.844 702 HA TRP 90 HA TRP 90 -7.825 8.744 4.200 703 HB2 TRP 90 1HB TRP 90 -9.260 6.069 4.251 704 HB3 TRP 90 2HB TRP 90 -8.430 6.825 5.628 705 HD1 TRP 90 HD TRP 90 -9.775 8.718 6.883 706 HE1 TRP 90 1HE TRP 90 -12.201 9.646 6.715 707 HE3 TRP 90 3HE TRP 90 -11.252 6.468 2.536 708 HZ2 TRP 90 2HZ TRP 90 -14.556 9.141 5.099 709 HZ3 TRP 90 3HZ TRP 90 -13.564 6.743 1.678 710 HH2 TRP 90 HH TRP 90 -15.217 8.061 2.941 711 H ASP 91 H ASP 91 -5.821 8.111 4.614 712 HA ASP 91 HA ASP 91 -4.261 6.552 2.643 713 HB2 ASP 91 1HB ASP 91 -3.704 8.523 4.874 714 HB3 ASP 91 2HB ASP 91 -2.477 7.317 4.491 715 H LYS 92 H LYS 92 -5.126 4.493 3.074 716 HA LYS 92 HA LYS 92 -5.285 3.482 5.865 717 HB2 LYS 92 1HB LYS 92 -5.448 1.831 3.362 718 HB3 LYS 92 2HB LYS 92 -6.035 1.378 4.923 719 HG2 LYS 92 1HG LYS 92 -7.299 3.596 3.233 720 HG3 LYS 92 2HG LYS 92 -7.685 1.885 3.098 721 HD2 LYS 92 1HD LYS 92 -8.259 2.083 5.653 722 HD3 LYS 92 2HD LYS 92 -8.418 3.809 5.268 723 HE2 LYS 92 1HE LYS 92 -10.009 3.278 3.443 724 HE3 LYS 92 2HE LYS 92 -9.740 1.552 3.672 725 HZ1 LYS 92 3HZ LYS 92 -11.795 2.238 4.591 726 HZ2 LYS 92 1HZ LYS 92 -11.100 3.333 5.582 727 HZ3 LYS 92 2HZ LYS 92 -10.824 1.698 5.802 728 H TYR 93 H TYR 93 -3.701 2.219 6.890 729 HA TYR 93 HA TYR 93 -1.196 1.729 5.410 730 HB2 TYR 93 1HB TYR 93 -1.901 1.956 8.339 731 HB3 TYR 93 2HB TYR 93 -0.303 1.557 7.774 732 HD1 TYR 93 2HD TYR 93 -2.905 4.303 7.430 733 HD2 TYR 93 1HD TYR 93 1.282 3.259 7.429 734 HE1 TYR 93 2HE TYR 93 -2.326 6.657 7.386 735 HE2 TYR 93 1HE TYR 93 1.868 5.650 7.366 736 HH TYR 93 HH TYR 93 -0.600 8.137 8.031 737 H PHE 94 H PHE 94 -0.264 -0.417 5.335 738 HA PHE 94 HA PHE 94 -1.863 -2.611 6.608 739 HB2 PHE 94 1HB PHE 94 -0.249 -2.696 4.018 740 HB3 PHE 94 2HB PHE 94 -1.239 -3.983 4.691 741 HD1 PHE 94 1HD PHE 94 -1.338 -0.709 2.996 742 HD2 PHE 94 2HD PHE 94 -3.732 -3.805 4.807 743 HE1 PHE 94 1HE PHE 94 -3.363 0.359 2.117 744 HE2 PHE 94 2HE PHE 94 -5.783 -2.757 3.904 745 HZ PHE 94 HZ PHE 94 -5.615 -0.660 2.565 746 H GLU 95 H GLU 95 -0.721 -4.139 7.857 747 HA GLU 95 HA GLU 95 2.239 -3.924 7.886 748 HB2 GLU 95 1HB GLU 95 0.761 -3.895 9.916 749 HB3 GLU 95 2HB GLU 95 0.261 -5.525 9.582 750 HG2 GLU 95 1HG GLU 95 2.462 -6.388 9.992 751 HG3 GLU 95 2HG GLU 95 3.189 -4.773 9.890 752 H ILE 96 H ILE 96 2.315 -4.918 5.566 753 HA ILE 96 HA ILE 96 1.260 -7.689 5.443 754 HB ILE 96 HB ILE 96 2.546 -7.323 3.040 755 HG12 ILE 96 1HG1 ILE 96 1.017 -4.719 3.427 756 HG13 ILE 96 2HG1 ILE 96 2.744 -4.792 3.658 757 HG21 ILE 96 1HG2 ILE 96 0.275 -7.150 2.105 758 HG22 ILE 96 2HG2 ILE 96 0.332 -8.323 3.403 759 HG23 ILE 96 3HG2 ILE 96 -0.363 -6.717 3.716 760 HD11 ILE 96 3HD1 ILE 96 2.408 -4.067 1.423 761 HD12 ILE 96 1HD1 ILE 96 2.991 -5.739 1.337 762 HD13 ILE 96 2HD1 ILE 96 1.269 -5.394 1.094 763 HA PRO 97 HA PRO 97 5.507 -9.291 5.927 764 HB2 PRO 97 1HB PRO 97 5.261 -11.749 4.799 765 HB3 PRO 97 2HB PRO 97 4.585 -11.353 6.403 766 HG2 PRO 97 1HG PRO 97 3.154 -11.328 3.712 767 HG3 PRO 97 2HG PRO 97 2.630 -12.154 5.220 768 HD2 PRO 97 1HD PRO 97 1.689 -9.732 4.509 769 HD3 PRO 97 2HD PRO 97 2.022 -10.079 6.220 770 H MET 98 H MET 98 7.246 -9.770 4.397 771 HA MET 98 HA MET 98 6.801 -9.212 1.506 772 HB2 MET 98 1HB MET 98 9.307 -9.822 3.123 773 HB3 MET 98 2HB MET 98 9.274 -9.522 1.377 774 HG2 MET 98 1HG MET 98 8.461 -7.253 1.722 775 HG3 MET 98 2HG MET 98 8.323 -7.536 3.461 776 HE1 MET 98 3HE MET 98 11.248 -5.298 3.996 777 HE2 MET 98 1HE MET 98 9.717 -5.052 3.137 778 HE3 MET 98 2HE MET 98 9.740 -5.987 4.655 779 H ASP 99 H ASP 99 7.773 -11.718 3.831 780 HA ASP 99 HA ASP 99 8.690 -13.604 1.973 781 HB2 ASP 99 1HB ASP 99 9.048 -13.256 4.559 782 HB3 ASP 99 2HB ASP 99 7.697 -14.380 4.720 783 H ALA 100 H ALA 100 5.479 -12.875 2.673 784 HA ALA 100 HA ALA 100 4.500 -15.513 1.678 785 HB1 ALA 100 1HB ALA 100 3.862 -15.002 4.053 786 HB2 ALA 100 2HB ALA 100 2.938 -13.609 3.435 787 HB3 ALA 100 3HB ALA 100 2.497 -15.244 2.936 788 H LEU 101 H LEU 101 5.461 -13.242 0.060 789 HA LEU 101 HA LEU 101 2.925 -12.417 -1.277 790 HB2 LEU 101 1HB LEU 101 5.739 -11.302 -1.545 791 HB3 LEU 101 2HB LEU 101 4.327 -10.754 -2.446 792 HG LEU 101 HG LEU 101 4.667 -10.574 0.575 793 HD11 LEU 101 1HD1 LEU 101 6.103 -9.120 -0.729 794 HD12 LEU 101 2HD1 LEU 101 4.855 -8.157 0.074 795 HD13 LEU 101 3HD1 LEU 101 4.716 -8.524 -1.681 796 HD21 LEU 101 3HD2 LEU 101 2.625 -9.151 0.495 797 HD22 LEU 101 1HD2 LEU 101 2.299 -10.837 0.116 798 HD23 LEU 101 2HD2 LEU 101 2.376 -9.638 -1.205 799 H GLN 102 H GLN 102 2.892 -12.438 -3.535 800 HA GLN 102 HA GLN 102 3.220 -15.105 -4.326 801 HB2 GLN 102 1HB GLN 102 1.384 -13.370 -4.739 802 HB3 GLN 102 2HB GLN 102 2.420 -12.673 -5.977 803 HG2 GLN 102 1HG GLN 102 2.364 -14.824 -7.183 804 HG3 GLN 102 2HG GLN 102 1.347 -15.516 -5.896 805 HE21 GLN 102 1HE2 GLN 102 -0.879 -15.420 -6.323 806 HE22 GLN 102 2HE2 GLN 102 -1.588 -14.264 -7.467 807 H ASP 103 H ASP 103 5.312 -12.446 -4.828 808 HA ASP 103 HA ASP 103 7.281 -13.793 -6.371 809 HB2 ASP 103 1HB ASP 103 5.409 -12.981 -8.056 810 HB3 ASP 103 2HB ASP 103 6.079 -11.375 -7.761 811 H ASN 104 H ASN 104 8.841 -11.587 -7.021 812 HA ASN 104 HA ASN 104 9.328 -10.050 -4.613 813 HB2 ASN 104 1HB ASN 104 10.340 -9.762 -7.486 814 HB3 ASN 104 2HB ASN 104 10.745 -8.660 -6.253 815 HD21 ASN 104 1HD2 ASN 104 12.549 -8.908 -5.337 816 HD22 ASN 104 2HD2 ASN 104 13.535 -10.381 -5.292 817 H SER 105 H SER 105 6.553 -9.780 -6.271 818 HA SER 105 HA SER 105 6.651 -6.801 -6.121 819 HB2 SER 105 1HB SER 105 5.468 -6.391 -7.988 820 HB3 SER 105 2HB SER 105 6.440 -7.773 -8.508 821 HG SER 105 HG SER 105 4.473 -9.066 -7.825 822 H ILE 106 H ILE 106 4.767 -5.716 -5.586 823 HA ILE 106 HA ILE 106 2.748 -7.272 -4.125 824 HB ILE 106 HB ILE 106 4.298 -6.422 -2.460 825 HG12 ILE 106 1HG1 ILE 106 2.848 -4.931 -1.116 826 HG13 ILE 106 2HG1 ILE 106 1.795 -4.704 -2.503 827 HG21 ILE 106 1HG2 ILE 106 4.790 -4.062 -2.110 828 HG22 ILE 106 2HG2 ILE 106 5.367 -4.571 -3.689 829 HG23 ILE 106 3HG2 ILE 106 3.876 -3.620 -3.568 830 HD11 ILE 106 3HD1 ILE 106 1.319 -7.206 -2.443 831 HD12 ILE 106 1HD1 ILE 106 2.323 -7.283 -0.980 832 HD13 ILE 106 2HD1 ILE 106 0.819 -6.340 -0.990 833 H GLN 107 H GLN 107 0.697 -6.238 -4.080 834 HA GLN 107 HA GLN 107 0.185 -3.702 -5.188 835 HB2 GLN 107 1HB GLN 107 -1.349 -4.348 -6.953 836 HB3 GLN 107 2HB GLN 107 0.241 -5.006 -7.329 837 HG2 GLN 107 1HG GLN 107 -0.485 -7.227 -6.427 838 HG3 GLN 107 2HG GLN 107 -2.084 -6.527 -6.113 839 HE21 GLN 107 1HE2 GLN 107 -2.335 -4.954 -8.626 840 HE22 GLN 107 2HE2 GLN 107 -2.605 -6.197 -9.807 841 H ILE 108 H ILE 108 -2.243 -3.323 -4.817 842 HA ILE 108 HA ILE 108 -3.456 -5.200 -2.837 843 HB ILE 108 HB ILE 108 -3.864 -2.182 -2.966 844 HG12 ILE 108 1HG1 ILE 108 -2.284 -3.871 -0.989 845 HG13 ILE 108 2HG1 ILE 108 -1.641 -2.697 -2.134 846 HG21 ILE 108 1HG2 ILE 108 -4.972 -4.337 -1.103 847 HG22 ILE 108 2HG2 ILE 108 -5.048 -2.609 -0.726 848 HG23 ILE 108 3HG2 ILE 108 -5.894 -3.193 -2.122 849 HD11 ILE 108 3HD1 ILE 108 -3.007 -0.909 -0.943 850 HD12 ILE 108 1HD1 ILE 108 -3.196 -2.113 0.373 851 HD13 ILE 108 2HD1 ILE 108 -1.590 -1.565 -0.106 852 H LYS 109 H LYS 109 -5.905 -5.229 -3.037 853 HA LYS 109 HA LYS 109 -7.002 -4.045 -5.460 854 HB2 LYS 109 1HB LYS 109 -8.148 -6.206 -6.074 855 HB3 LYS 109 2HB LYS 109 -6.445 -6.150 -6.365 856 HG2 LYS 109 1HG LYS 109 -6.953 -7.277 -3.722 857 HG3 LYS 109 2HG LYS 109 -8.035 -8.021 -4.896 858 HD2 LYS 109 1HD LYS 109 -5.956 -9.290 -4.645 859 HD3 LYS 109 2HD LYS 109 -6.057 -8.644 -6.291 860 HE2 LYS 109 1HE LYS 109 -4.465 -6.829 -5.718 861 HE3 LYS 109 2HE LYS 109 -4.504 -7.364 -4.026 862 HZ1 LYS 109 3HZ LYS 109 -3.315 -8.748 -6.343 863 HZ2 LYS 109 1HZ LYS 109 -3.705 -9.575 -5.005 864 HZ3 LYS 109 2HZ LYS 109 -2.626 -8.389 -4.867 865 H ALA 110 H ALA 110 -8.969 -3.192 -4.956 866 HA ALA 110 HA ALA 110 -10.370 -4.214 -2.563 867 HB1 ALA 110 1HB ALA 110 -10.812 -1.937 -1.747 868 HB2 ALA 110 2HB ALA 110 -9.079 -2.304 -1.730 869 HB3 ALA 110 3HB ALA 110 -9.761 -1.267 -3.010 870 H LEU 111 H LEU 111 -12.511 -4.253 -2.737 871 HA LEU 111 HA LEU 111 -13.797 -3.872 -5.320 872 HB2 LEU 111 1HB LEU 111 -14.372 -5.499 -3.318 873 HB3 LEU 111 2HB LEU 111 -15.236 -4.098 -2.688 874 HG LEU 111 HG LEU 111 -16.777 -5.475 -3.711 875 HD11 LEU 111 1HD1 LEU 111 -17.944 -4.281 -5.250 876 HD12 LEU 111 2HD1 LEU 111 -16.542 -3.406 -5.828 877 HD13 LEU 111 3HD1 LEU 111 -17.159 -3.119 -4.162 878 HD21 LEU 111 3HD2 LEU 111 -15.520 -6.895 -5.101 879 HD22 LEU 111 1HD2 LEU 111 -15.117 -5.572 -6.222 880 HD23 LEU 111 2HD2 LEU 111 -16.788 -6.169 -6.082 881 H SER 112 H SER 112 -14.943 -2.249 -5.971 882 HA SER 112 HA SER 112 -14.820 0.327 -4.494 883 HB2 SER 112 1HB SER 112 -15.840 -0.175 -7.310 884 HB3 SER 112 2HB SER 112 -15.428 1.386 -6.592 885 HG SER 112 HG SER 112 -13.585 -0.758 -6.749 886 H SER 113 H SER 113 -17.416 -1.264 -6.408 887 HA SER 113 HA SER 113 -19.131 -1.128 -4.053 888 HB2 SER 113 1HB SER 113 -19.270 1.040 -5.910 889 HB3 SER 113 2HB SER 113 -20.714 0.049 -6.157 890 HG SER 113 HG SER 113 -21.346 1.211 -4.546 891 H GLY 114 H GLY 114 -19.560 -1.571 -7.649 892 HA2 GLY 114 1HA GLY 114 -21.035 -4.097 -7.002 893 HA3 GLY 114 2HA GLY 114 -21.668 -2.846 -8.069 894 H THR 115 H THR 115 -19.706 -5.594 -7.816 895 HA THR 115 HA THR 115 -18.141 -6.607 -9.123 896 HB THR 115 HB THR 115 -18.965 -6.803 -11.563 897 HG1 THR 115 1HG THR 115 -20.232 -4.815 -11.378 898 HG21 THR 115 3HG2 THR 115 -20.857 -7.479 -9.268 899 HG22 THR 115 1HG2 THR 115 -19.448 -8.429 -9.745 900 HG23 THR 115 2HG2 THR 115 -20.825 -8.249 -10.865 901 H THR 116 H THR 116 -17.090 -4.313 -8.321 902 HA THR 116 HA THR 116 -15.364 -3.601 -10.611 903 HB THR 116 HB THR 116 -15.367 -1.354 -8.995 904 HG1 THR 116 1HG THR 116 -17.588 -0.759 -8.823 905 HG21 THR 116 3HG2 THR 116 -15.205 -1.447 -11.327 906 HG22 THR 116 1HG2 THR 116 -16.487 -0.292 -10.874 907 HG23 THR 116 2HG2 THR 116 -16.923 -1.917 -11.511 908 H PHE 117 H PHE 117 -13.283 -4.277 -10.143 909 HA PHE 117 HA PHE 117 -12.356 -3.821 -7.432 910 HB2 PHE 117 1HB PHE 117 -12.352 -6.306 -9.126 911 HB3 PHE 117 2HB PHE 117 -10.829 -5.884 -8.481 912 HD1 PHE 117 1HD PHE 117 -10.807 -5.404 -5.759 913 HD2 PHE 117 2HD PHE 117 -13.656 -7.832 -7.907 914 HE1 PHE 117 1HE PHE 117 -11.352 -6.538 -3.681 915 HE2 PHE 117 2HE PHE 117 -14.210 -8.989 -5.796 916 HZ PHE 117 HZ PHE 117 -13.069 -8.344 -3.664 917 H VAL 118 H VAL 118 -11.072 -2.063 -7.746 918 HA VAL 118 HA VAL 118 -9.593 -1.724 -10.286 919 HB VAL 118 HB VAL 118 -9.436 -0.035 -7.811 920 HG11 VAL 118 1HG1 VAL 118 -7.722 0.270 -9.578 921 HG12 VAL 118 2HG1 VAL 118 -9.010 0.636 -10.737 922 HG13 VAL 118 3HG1 VAL 118 -8.708 1.723 -9.356 923 HG21 VAL 118 3HG2 VAL 118 -11.859 -0.122 -8.437 924 HG22 VAL 118 1HG2 VAL 118 -11.180 1.472 -8.666 925 HG23 VAL 118 2HG2 VAL 118 -11.437 0.391 -10.072 926 H TYR 119 H TYR 119 -7.991 -3.144 -10.294 927 HA TYR 119 HA TYR 119 -6.505 -4.008 -7.867 928 HB2 TYR 119 1HB TYR 119 -5.907 -4.623 -10.782 929 HB3 TYR 119 2HB TYR 119 -5.088 -5.322 -9.395 930 HD1 TYR 119 2HD TYR 119 -8.398 -4.987 -11.044 931 HD2 TYR 119 1HD TYR 119 -5.955 -7.360 -8.423 932 HE1 TYR 119 2HE TYR 119 -10.150 -6.713 -11.020 933 HE2 TYR 119 1HE TYR 119 -7.751 -9.092 -8.325 934 HH TYR 119 HH TYR 119 -10.844 -8.662 -10.128 935 H SER 120 H SER 120 -4.638 -2.994 -7.115 936 HA SER 120 HA SER 120 -3.993 -0.406 -8.211 937 HB2 SER 120 1HB SER 120 -2.819 -0.101 -6.306 938 HB3 SER 120 2HB SER 120 -3.803 -1.393 -5.752 939 HG SER 120 HG SER 120 -1.173 -1.848 -6.747 940 H GLN 121 H GLN 121 -1.541 0.111 -8.624 941 HA GLN 121 HA GLN 121 -0.708 -1.474 -10.867 942 HB2 GLN 121 1HB GLN 121 1.175 -0.115 -10.960 943 HB3 GLN 121 2HB GLN 121 -0.155 0.974 -10.580 944 HG2 GLN 121 1HG GLN 121 1.692 -0.117 -8.407 945 HG3 GLN 121 2HG GLN 121 2.221 1.124 -9.498 946 HE21 GLN 121 1HE2 GLN 121 1.956 3.126 -8.914 947 HE22 GLN 121 2HE2 GLN 121 0.921 3.702 -7.630 948 H LYS 122 H LYS 122 1.316 -2.591 -11.010 949 HA LYS 122 HA LYS 122 1.975 -4.331 -8.726 950 HB2 LYS 122 1HB LYS 122 1.731 -4.966 -11.236 951 HB3 LYS 122 2HB LYS 122 3.256 -4.124 -11.501 952 HG2 LYS 122 1HG LYS 122 4.266 -5.712 -9.755 953 HG3 LYS 122 2HG LYS 122 2.732 -6.609 -9.823 954 HD2 LYS 122 1HD LYS 122 3.112 -6.724 -12.378 955 HD3 LYS 122 2HD LYS 122 4.738 -6.109 -12.045 956 HE2 LYS 122 1HE LYS 122 5.055 -8.091 -10.472 957 HE3 LYS 122 2HE LYS 122 3.512 -8.718 -11.077 958 HZ1 LYS 122 3HZ LYS 122 6.016 -8.318 -12.583 959 HZ2 LYS 122 1HZ LYS 122 4.600 -8.586 -13.344 960 HZ3 LYS 122 2HZ LYS 122 5.222 -9.720 -12.322 961 H ILE 123 H ILE 123 3.779 -3.970 -7.442 962 HA ILE 123 HA ILE 123 5.973 -2.241 -8.445 963 HB ILE 123 HB ILE 123 4.812 -2.154 -5.624 964 HG12 ILE 123 1HG1 ILE 123 3.290 -0.946 -7.143 965 HG13 ILE 123 2HG1 ILE 123 4.012 0.063 -5.916 966 HG21 ILE 123 1HG2 ILE 123 7.230 -1.730 -5.658 967 HG22 ILE 123 2HG2 ILE 123 7.002 -0.457 -6.891 968 HG23 ILE 123 3HG2 ILE 123 6.359 -0.238 -5.261 969 HD11 ILE 123 3HD1 ILE 123 5.552 1.075 -7.533 970 HD12 ILE 123 1HD1 ILE 123 4.973 0.006 -8.818 971 HD13 ILE 123 2HD1 ILE 123 3.901 1.222 -8.088 972 H ASP 124 H ASP 124 7.149 -3.795 -9.019 973 HA ASP 124 HA ASP 124 8.023 -6.105 -7.532 974 HB2 ASP 124 1HB ASP 124 8.876 -4.432 -9.885 975 HB3 ASP 124 2HB ASP 124 10.068 -5.448 -9.117 976 H PHE 125 H PHE 125 9.832 -6.196 -6.030 977 HA PHE 125 HA PHE 125 11.261 -3.745 -5.351 978 HB2 PHE 125 1HB PHE 125 10.650 -3.691 -3.030 979 HB3 PHE 125 2HB PHE 125 9.206 -3.703 -3.949 980 HD1 PHE 125 2HD PHE 125 7.659 -5.652 -3.897 981 HD2 PHE 125 1HD PHE 125 11.312 -5.598 -1.607 982 HE1 PHE 125 2HE PHE 125 6.838 -7.542 -2.521 983 HE2 PHE 125 1HE PHE 125 10.544 -7.523 -0.287 984 HZ PHE 125 HZ PHE 125 8.291 -8.518 -0.734 985 H GLU 126 H GLU 126 13.023 -4.320 -3.653 986 HA GLU 126 HA GLU 126 14.096 -7.008 -4.445 987 HB2 GLU 126 1HB GLU 126 15.172 -4.309 -4.151 988 HB3 GLU 126 2HB GLU 126 16.242 -5.756 -3.930 989 HG2 GLU 126 1HG GLU 126 14.481 -5.605 -6.344 990 HG3 GLU 126 2HG GLU 126 15.738 -4.382 -6.265 991 H ARG 127 H ARG 127 14.982 -8.364 -2.849 992 HA ARG 127 HA ARG 127 13.675 -7.828 -0.214 993 HB2 ARG 127 1HB ARG 127 14.327 -10.539 -1.398 994 HB3 ARG 127 2HB ARG 127 13.378 -10.125 0.035 995 HG2 ARG 127 1HG ARG 127 11.944 -8.854 -1.926 996 HG3 ARG 127 2HG ARG 127 12.661 -10.161 -2.868 997 HD2 ARG 127 1HD ARG 127 11.064 -10.359 -0.325 998 HD3 ARG 127 2HD ARG 127 10.475 -10.845 -1.920 999 HE ARG 127 HE ARG 127 12.354 -12.268 -0.117 1000 HH11 ARG 127 1HH1 ARG 127 11.185 -12.301 -3.514 1001 HH12 ARG 127 2HH1 ARG 127 11.462 -13.990 -3.673 1002 HH21 ARG 127 1HH2 ARG 127 12.376 -14.520 -0.299 1003 HH22 ARG 127 2HH2 ARG 127 12.182 -15.263 -1.874 1004 H GLU 128 H GLU 128 15.283 -6.827 0.610 1005 HA GLU 128 HA GLU 128 17.194 -6.087 1.429 1006 HB2 GLU 128 1HB GLU 128 18.281 -7.204 3.174 1007 HB3 GLU 128 2HB GLU 128 16.536 -7.381 3.269 1008 HG2 GLU 128 1HG GLU 128 16.865 -9.485 3.696 1009 HG3 GLU 128 2HG GLU 128 17.166 -9.718 2.003 Start of MODEL 14 1 H1 GLY 1 H GLY 1 -19.562 14.231 -9.400 2 HA2 GLY 1 1HA GLY 1 -21.456 14.108 -7.792 3 HA3 GLY 1 2HA GLY 1 -20.225 12.857 -7.535 4 H ALA 2 H ALA 2 -21.804 13.418 -5.397 5 HA ALA 2 HA ALA 2 -19.913 14.598 -3.522 6 HB1 ALA 2 1HB ALA 2 -22.864 15.238 -3.251 7 HB2 ALA 2 2HB ALA 2 -21.464 16.098 -2.589 8 HB3 ALA 2 3HB ALA 2 -21.853 16.254 -4.293 9 H GLU 3 H GLU 3 -21.586 14.101 -1.258 10 HA GLU 3 HA GLU 3 -22.232 12.490 0.133 11 HB2 GLU 3 1HB GLU 3 -23.668 11.858 -2.175 12 HB3 GLU 3 2HB GLU 3 -22.817 10.355 -1.855 13 HG2 GLU 3 1HG GLU 3 -24.851 10.143 -0.696 14 HG3 GLU 3 2HG GLU 3 -23.717 10.598 0.585 15 H ALA 4 H ALA 4 -21.844 9.936 0.588 16 HA ALA 4 HA ALA 4 -18.958 9.494 0.559 17 HB1 ALA 4 1HB ALA 4 -19.634 7.377 1.751 18 HB2 ALA 4 2HB ALA 4 -20.165 8.878 2.540 19 HB3 ALA 4 3HB ALA 4 -21.324 7.887 1.606 20 H LEU 5 H LEU 5 -18.978 9.614 -1.871 21 HA LEU 5 HA LEU 5 -19.938 7.617 -3.566 22 HB2 LEU 5 1HB LEU 5 -17.211 8.908 -3.718 23 HB3 LEU 5 2HB LEU 5 -17.994 8.109 -5.050 24 HG LEU 5 HG LEU 5 -18.974 10.648 -3.693 25 HD11 LEU 5 1HD1 LEU 5 -16.878 11.041 -4.889 26 HD12 LEU 5 2HD1 LEU 5 -18.231 11.788 -5.744 27 HD13 LEU 5 3HD1 LEU 5 -17.541 10.261 -6.350 28 HD21 LEU 5 3HD2 LEU 5 -19.842 9.143 -6.210 29 HD22 LEU 5 1HD2 LEU 5 -20.438 10.761 -5.766 30 HD23 LEU 5 2HD2 LEU 5 -20.819 9.382 -4.734 31 HA PRO 6 HA PRO 6 -17.510 4.038 -2.359 32 HB2 PRO 6 1HB PRO 6 -17.700 2.476 -4.584 33 HB3 PRO 6 2HB PRO 6 -19.128 2.846 -3.555 34 HG2 PRO 6 1HG PRO 6 -18.300 4.167 -6.149 35 HG3 PRO 6 2HG PRO 6 -19.913 3.573 -5.637 36 HD2 PRO 6 1HD PRO 6 -19.033 6.242 -5.383 37 HD3 PRO 6 2HD PRO 6 -20.305 5.511 -4.362 38 H LEU 7 H LEU 7 -15.587 2.943 -3.043 39 HA LEU 7 HA LEU 7 -13.396 4.563 -3.609 40 HB2 LEU 7 1HB LEU 7 -13.264 2.477 -2.476 41 HB3 LEU 7 2HB LEU 7 -13.840 1.588 -3.889 42 HG LEU 7 HG LEU 7 -11.729 2.193 -5.105 43 HD11 LEU 7 1HD1 LEU 7 -9.826 2.959 -3.545 44 HD12 LEU 7 2HD1 LEU 7 -11.112 3.486 -2.424 45 HD13 LEU 7 3HD1 LEU 7 -10.979 4.179 -4.052 46 HD21 LEU 7 3HD2 LEU 7 -12.022 0.053 -3.847 47 HD22 LEU 7 1HD2 LEU 7 -11.213 0.814 -2.449 48 HD23 LEU 7 2HD2 LEU 7 -10.354 0.601 -3.962 49 H TYR 8 H TYR 8 -12.768 5.574 -5.425 50 HA TYR 8 HA TYR 8 -13.368 4.337 -8.065 51 HB2 TYR 8 1HB TYR 8 -13.251 6.721 -8.897 52 HB3 TYR 8 2HB TYR 8 -14.625 6.227 -7.951 53 HD1 TYR 8 1HD TYR 8 -11.414 8.157 -7.765 54 HD2 TYR 8 2HD TYR 8 -15.269 7.408 -6.008 55 HE1 TYR 8 1HE TYR 8 -11.183 10.197 -6.375 56 HE2 TYR 8 2HE TYR 8 -15.073 9.404 -4.623 57 HH TYR 8 HH TYR 8 -12.183 11.549 -4.752 58 H TYR 9 H TYR 9 -10.678 4.811 -6.060 59 HA TYR 9 HA TYR 9 -8.829 4.744 -8.384 60 HB2 TYR 9 1HB TYR 9 -9.117 7.107 -7.763 61 HB3 TYR 9 2HB TYR 9 -8.769 6.666 -6.091 62 HD1 TYR 9 1HD TYR 9 -7.280 7.075 -9.450 63 HD2 TYR 9 2HD TYR 9 -6.482 6.327 -5.276 64 HE1 TYR 9 1HE TYR 9 -4.924 7.668 -9.812 65 HE2 TYR 9 2HE TYR 9 -4.131 6.977 -5.610 66 HH TYR 9 HH TYR 9 -2.604 7.337 -8.637 67 H LEU 10 H LEU 10 -6.943 3.634 -7.985 68 HA LEU 10 HA LEU 10 -6.208 2.941 -5.195 69 HB2 LEU 10 1HB LEU 10 -6.601 1.176 -7.563 70 HB3 LEU 10 2HB LEU 10 -5.060 0.987 -6.840 71 HG LEU 10 HG LEU 10 -6.785 -0.599 -6.093 72 HD11 LEU 10 1HD1 LEU 10 -6.110 0.583 -3.460 73 HD12 LEU 10 2HD1 LEU 10 -4.758 0.431 -4.565 74 HD13 LEU 10 3HD1 LEU 10 -5.729 -1.001 -4.141 75 HD21 LEU 10 3HD2 LEU 10 -7.762 1.629 -4.353 76 HD22 LEU 10 1HD2 LEU 10 -8.325 -0.064 -4.451 77 HD23 LEU 10 2HD2 LEU 10 -8.568 1.077 -5.821 78 H GLN 11 H GLN 11 -4.095 3.005 -4.836 79 HA GLN 11 HA GLN 11 -2.075 2.701 -6.737 80 HB2 GLN 11 1HB GLN 11 -2.953 5.335 -6.876 81 HB3 GLN 11 2HB GLN 11 -1.684 5.466 -5.716 82 HG2 GLN 11 1HG GLN 11 -0.345 5.718 -7.517 83 HG3 GLN 11 2HG GLN 11 -0.430 3.972 -7.676 84 HE21 GLN 11 1HE2 GLN 11 -2.458 3.204 -9.211 85 HE22 GLN 11 2HE2 GLN 11 -2.603 4.203 -10.615 86 H ILE 12 H ILE 12 -0.419 1.885 -5.537 87 HA ILE 12 HA ILE 12 -0.247 1.748 -2.831 88 HB ILE 12 HB ILE 12 2.102 1.750 -4.748 89 HG12 ILE 12 1HG1 ILE 12 0.288 0.096 -5.353 90 HG13 ILE 12 2HG1 ILE 12 1.820 -0.609 -4.937 91 HG21 ILE 12 1HG2 ILE 12 2.975 1.890 -2.464 92 HG22 ILE 12 2HG2 ILE 12 1.792 0.729 -1.925 93 HG23 ILE 12 3HG2 ILE 12 3.126 0.198 -2.973 94 HD11 ILE 12 3HD1 ILE 12 -0.553 -0.503 -3.040 95 HD12 ILE 12 1HD1 ILE 12 -0.073 -1.884 -4.041 96 HD13 ILE 12 2HD1 ILE 12 0.996 -1.330 -2.754 97 H THR 13 H THR 13 1.123 4.562 -4.639 98 HA THR 13 HA THR 13 1.696 6.586 -3.988 99 HB THR 13 HB THR 13 0.416 6.061 -1.333 100 HG1 THR 13 1HG THR 13 -1.463 6.486 -2.189 101 HG21 THR 13 3HG2 THR 13 0.595 8.571 -3.014 102 HG22 THR 13 1HG2 THR 13 1.395 8.265 -1.447 103 HG23 THR 13 2HG2 THR 13 -0.374 8.393 -1.530 104 H GLY 14 H GLY 14 2.400 4.581 -1.027 105 HA2 GLY 14 1HA GLY 14 5.199 5.498 -1.170 106 HA3 GLY 14 2HA GLY 14 4.293 5.904 0.295 107 H ILE 15 H ILE 15 6.576 4.126 0.176 108 HA ILE 15 HA ILE 15 5.362 1.719 1.280 109 HB ILE 15 HB ILE 15 5.622 1.374 -1.185 110 HG12 ILE 15 1HG1 ILE 15 7.295 -0.503 0.500 111 HG13 ILE 15 2HG1 ILE 15 5.525 -0.450 0.472 112 HG21 ILE 15 1HG2 ILE 15 8.628 1.260 -0.694 113 HG22 ILE 15 2HG2 ILE 15 7.769 1.098 -2.242 114 HG23 ILE 15 3HG2 ILE 15 7.822 2.663 -1.404 115 HD11 ILE 15 3HD1 ILE 15 7.348 -1.134 -1.862 116 HD12 ILE 15 1HD1 ILE 15 6.203 -2.188 -1.035 117 HD13 ILE 15 2HD1 ILE 15 5.591 -0.853 -2.014 118 H THR 16 H THR 16 6.789 0.718 2.746 119 HA THR 16 HA THR 16 9.517 1.368 2.778 120 HB THR 16 HB THR 16 8.711 3.476 3.810 121 HG1 THR 16 1HG THR 16 10.712 2.653 4.240 122 HG21 THR 16 3HG2 THR 16 7.800 3.612 6.005 123 HG22 THR 16 1HG2 THR 16 7.908 1.852 6.238 124 HG23 THR 16 2HG2 THR 16 6.746 2.541 5.078 125 H SER 17 H SER 17 10.240 0.489 5.353 126 HA SER 17 HA SER 17 8.671 -1.862 6.010 127 HB2 SER 17 1HB SER 17 11.455 -2.158 4.797 128 HB3 SER 17 2HB SER 17 10.517 -3.450 5.578 129 HG SER 17 HG SER 17 9.028 -2.120 3.739 130 H ASP 18 H ASP 18 9.670 -3.025 7.814 131 HA ASP 18 HA ASP 18 10.135 -1.148 9.884 132 HB2 ASP 18 1HB ASP 18 9.105 -3.555 9.856 133 HB3 ASP 18 2HB ASP 18 10.748 -4.103 10.147 134 H GLY 19 H GLY 19 12.427 -3.112 8.028 135 HA2 GLY 19 1HA GLY 19 14.713 -2.150 9.571 136 HA3 GLY 19 2HA GLY 19 14.722 -3.199 8.165 137 H ASN 20 H ASN 20 12.920 -0.097 7.835 138 HA ASN 20 HA ASN 20 15.292 0.966 6.385 139 HB2 ASN 20 1HB ASN 20 13.165 -0.040 4.993 140 HB3 ASN 20 2HB ASN 20 12.689 1.671 5.138 141 HD21 ASN 20 1HD2 ASN 20 13.498 0.348 2.652 142 HD22 ASN 20 2HD2 ASN 20 15.023 1.027 2.148 143 H ASP 21 H ASP 21 14.085 1.727 9.106 144 HA ASP 21 HA ASP 21 13.853 3.679 10.269 145 HB2 ASP 21 1HB ASP 21 15.850 4.242 8.558 146 HB3 ASP 21 2HB ASP 21 14.711 5.448 7.999 147 H PHE 22 H PHE 22 11.816 2.687 8.280 148 HA PHE 22 HA PHE 22 9.787 3.089 7.462 149 HB2 PHE 22 1HB PHE 22 9.701 5.191 9.642 150 HB3 PHE 22 2HB PHE 22 8.328 4.638 8.705 151 HD1 PHE 22 2HD PHE 22 10.984 2.333 10.314 152 HD2 PHE 22 1HD PHE 22 6.934 3.862 10.436 153 HE1 PHE 22 2HE PHE 22 10.417 0.712 12.008 154 HE2 PHE 22 1HE PHE 22 6.431 2.303 12.257 155 HZ PHE 22 HZ PHE 22 8.155 0.655 13.003 156 H ALA 23 H ALA 23 12.018 4.333 6.150 157 HA ALA 23 HA ALA 23 11.478 6.935 5.177 158 HB1 ALA 23 1HB ALA 23 13.690 5.953 5.035 159 HB2 ALA 23 2HB ALA 23 13.085 4.649 3.982 160 HB3 ALA 23 3HB ALA 23 13.100 6.328 3.403 161 H TRP 24 H TRP 24 9.330 7.175 4.469 162 HA TRP 24 HA TRP 24 7.860 5.232 3.150 163 HB2 TRP 24 1HB TRP 24 7.550 8.168 3.742 164 HB3 TRP 24 2HB TRP 24 6.421 7.450 2.610 165 HD1 TRP 24 HD TRP 24 6.758 7.944 6.191 166 HE1 TRP 24 1HE TRP 24 5.175 6.470 7.509 167 HE3 TRP 24 3HE TRP 24 5.636 4.653 2.512 168 HZ2 TRP 24 2HZ TRP 24 3.581 4.010 6.984 169 HZ3 TRP 24 3HZ TRP 24 4.196 2.675 2.951 170 HH2 TRP 24 HH TRP 24 3.194 2.350 5.202 171 H ASP 25 H ASP 25 10.168 7.001 1.596 172 HA ASP 25 HA ASP 25 10.643 7.494 -0.643 173 HB2 ASP 25 1HB ASP 25 10.107 4.588 -0.201 174 HB3 ASP 25 2HB ASP 25 10.369 5.172 -1.850 175 H ASN 26 H ASN 26 9.203 8.986 -1.428 176 HA ASN 26 HA ASN 26 6.380 8.366 -1.739 177 HB2 ASN 26 1HB ASN 26 8.013 10.800 -2.552 178 HB3 ASN 26 2HB ASN 26 6.302 10.631 -2.889 179 HD21 ASN 26 1HD2 ASN 26 8.053 9.634 0.152 180 HD22 ASN 26 2HD2 ASN 26 7.208 10.784 1.168 181 H LEU 27 H LEU 27 5.788 6.979 -3.241 182 HA LEU 27 HA LEU 27 7.367 6.310 -5.458 183 HB2 LEU 27 1HB LEU 27 4.406 5.738 -5.057 184 HB3 LEU 27 2HB LEU 27 5.447 4.947 -6.224 185 HG LEU 27 HG LEU 27 5.735 4.769 -3.195 186 HD11 LEU 27 1HD1 LEU 27 5.034 2.437 -3.509 187 HD12 LEU 27 2HD1 LEU 27 4.838 2.706 -5.253 188 HD13 LEU 27 3HD1 LEU 27 3.795 3.558 -4.095 189 HD21 LEU 27 3HD2 LEU 27 7.952 4.552 -4.263 190 HD22 LEU 27 1HD2 LEU 27 7.290 3.263 -5.337 191 HD23 LEU 27 2HD2 LEU 27 7.397 3.033 -3.597 192 H THR 28 H THR 28 7.323 6.771 -7.544 193 HA THR 28 HA THR 28 6.274 9.227 -8.464 194 HB THR 28 HB THR 28 7.076 7.346 -10.559 195 HG1 THR 28 1HG THR 28 8.823 7.635 -8.329 196 HG21 THR 28 3HG2 THR 28 8.580 9.656 -9.225 197 HG22 THR 28 1HG2 THR 28 7.348 9.897 -10.470 198 HG23 THR 28 2HG2 THR 28 8.858 9.045 -10.866 199 H SER 29 H SER 29 4.699 9.471 -10.242 200 HA SER 29 HA SER 29 2.317 8.553 -9.256 201 HB2 SER 29 1HB SER 29 2.871 9.818 -11.964 202 HB3 SER 29 2HB SER 29 1.318 9.792 -11.122 203 HG SER 29 HG SER 29 2.295 11.686 -10.619 204 H SER 30 H SER 30 4.193 6.874 -11.687 205 HA SER 30 HA SER 30 2.132 4.786 -11.721 206 HB2 SER 30 1HB SER 30 3.511 5.824 -14.227 207 HB3 SER 30 2HB SER 30 2.390 4.459 -14.124 208 HG SER 30 HG SER 30 1.547 6.630 -14.800 209 H GLN 31 H GLN 31 4.387 5.026 -10.093 210 HA GLN 31 HA GLN 31 6.769 3.775 -10.989 211 HB2 GLN 31 1HB GLN 31 6.256 4.815 -8.647 212 HB3 GLN 31 2HB GLN 31 5.456 3.300 -8.288 213 HG2 GLN 31 1HG GLN 31 7.374 2.639 -7.466 214 HG3 GLN 31 2HG GLN 31 7.826 2.357 -9.121 215 HE21 GLN 31 1HE2 GLN 31 8.427 4.299 -6.280 216 HE22 GLN 31 2HE2 GLN 31 9.856 5.067 -6.907 217 H THR 32 H THR 32 7.326 1.579 -11.311 218 HA THR 32 HA THR 32 5.265 -0.480 -10.687 219 HB THR 32 HB THR 32 5.992 -1.608 -12.777 220 HG1 THR 32 1HG THR 32 6.867 0.330 -14.208 221 HG21 THR 32 3HG2 THR 32 3.926 -0.236 -12.685 222 HG22 THR 32 1HG2 THR 32 4.680 -0.258 -14.293 223 HG23 THR 32 2HG2 THR 32 4.856 1.165 -13.248 224 H LYS 33 H LYS 33 8.334 0.615 -9.896 225 HA LYS 33 HA LYS 33 8.942 -2.023 -8.786 226 HB2 LYS 33 1HB LYS 33 10.291 -1.368 -11.041 227 HB3 LYS 33 2HB LYS 33 11.320 -0.517 -9.892 228 HG2 LYS 33 1HG LYS 33 10.467 -3.347 -9.323 229 HG3 LYS 33 2HG LYS 33 11.646 -3.106 -10.603 230 HD2 LYS 33 1HD LYS 33 12.135 -2.058 -7.812 231 HD3 LYS 33 2HD LYS 33 12.544 -3.703 -8.306 232 HE2 LYS 33 1HE LYS 33 13.969 -2.728 -10.156 233 HE3 LYS 33 2HE LYS 33 13.634 -1.122 -9.495 234 HZ1 LYS 33 3HZ LYS 33 14.619 -2.054 -7.351 235 HZ2 LYS 33 1HZ LYS 33 15.677 -1.810 -8.585 236 HZ3 LYS 33 2HZ LYS 33 15.173 -3.313 -8.210 237 H ALA 34 H ALA 34 10.271 -1.910 -6.940 238 HA ALA 34 HA ALA 34 9.598 0.179 -5.195 239 HB1 ALA 34 1HB ALA 34 11.724 -2.011 -5.066 240 HB2 ALA 34 2HB ALA 34 11.294 -1.007 -3.681 241 HB3 ALA 34 3HB ALA 34 10.064 -2.047 -4.407 242 HA PRO 35 HA PRO 35 12.797 3.188 -5.743 243 HB2 PRO 35 1HB PRO 35 13.417 3.881 -3.160 244 HB3 PRO 35 2HB PRO 35 11.902 4.372 -3.974 245 HG2 PRO 35 1HG PRO 35 12.328 1.960 -2.155 246 HG3 PRO 35 2HG PRO 35 11.035 3.175 -2.036 247 HD2 PRO 35 1HD PRO 35 10.499 0.934 -3.244 248 HD3 PRO 35 2HD PRO 35 9.992 2.448 -4.029 249 H ASN 36 H ASN 36 13.503 0.556 -3.295 250 HA ASN 36 HA ASN 36 16.088 0.001 -4.391 251 HB2 ASN 36 1HB ASN 36 15.755 1.519 -1.762 252 HB3 ASN 36 2HB ASN 36 17.058 0.363 -1.956 253 HD21 ASN 36 1HD2 ASN 36 16.307 3.645 -2.379 254 HD22 ASN 36 2HD2 ASN 36 17.592 4.011 -3.505 255 H VAL 37 H VAL 37 17.004 -1.815 -2.947 256 HA VAL 37 HA VAL 37 15.046 -3.721 -2.131 257 HB VAL 37 HB VAL 37 16.927 -4.657 -2.804 258 HG11 VAL 37 1HG1 VAL 37 19.117 -4.456 -1.946 259 HG12 VAL 37 2HG1 VAL 37 18.453 -3.185 -2.946 260 HG13 VAL 37 3HG1 VAL 37 18.561 -2.901 -1.166 261 HG21 VAL 37 3HG2 VAL 37 16.082 -5.304 -0.251 262 HG22 VAL 37 1HG2 VAL 37 17.099 -6.277 -1.324 263 HG23 VAL 37 2HG2 VAL 37 17.828 -5.189 -0.113 264 H LEU 38 H LEU 38 13.723 -3.565 -0.651 265 HA LEU 38 HA LEU 38 13.984 -1.932 1.742 266 HB2 LEU 38 1HB LEU 38 11.922 -4.078 1.090 267 HB3 LEU 38 2HB LEU 38 11.787 -2.799 2.293 268 HG LEU 38 HG LEU 38 11.824 -2.440 -0.743 269 HD11 LEU 38 1HD1 LEU 38 9.574 -1.997 1.249 270 HD12 LEU 38 2HD1 LEU 38 9.737 -3.392 0.158 271 HD13 LEU 38 3HD1 LEU 38 9.509 -1.765 -0.516 272 HD21 LEU 38 3HD2 LEU 38 12.873 -0.484 0.270 273 HD22 LEU 38 1HD2 LEU 38 11.535 -0.328 1.447 274 HD23 LEU 38 2HD2 LEU 38 11.264 -0.064 -0.290 275 H LYS 39 H LYS 39 14.326 -2.700 3.822 276 HA LYS 39 HA LYS 39 15.348 -5.498 4.074 277 HB2 LYS 39 1HB LYS 39 15.902 -3.259 6.020 278 HB3 LYS 39 2HB LYS 39 16.700 -4.801 5.873 279 HG2 LYS 39 1HG LYS 39 18.272 -3.696 4.793 280 HG3 LYS 39 2HG LYS 39 17.211 -3.762 3.385 281 HD2 LYS 39 1HD LYS 39 16.249 -1.501 4.392 282 HD3 LYS 39 2HD LYS 39 17.787 -1.460 5.257 283 HE2 LYS 39 1HE LYS 39 17.336 -1.536 2.242 284 HE3 LYS 39 2HE LYS 39 17.930 -0.189 3.197 285 HZ1 LYS 39 3HZ LYS 39 19.373 -2.645 2.465 286 HZ2 LYS 39 1HZ LYS 39 19.865 -1.732 3.739 287 HZ3 LYS 39 2HZ LYS 39 19.768 -1.072 2.228 288 H GLY 40 H GLY 40 14.963 -6.545 6.132 289 HA2 GLY 40 1HA GLY 40 13.683 -7.057 8.043 290 HA3 GLY 40 2HA GLY 40 12.611 -5.691 7.729 291 H ASN 41 H ASN 41 11.032 -7.531 8.232 292 HA ASN 41 HA ASN 41 10.303 -9.051 5.742 293 HB2 ASN 41 1HB ASN 41 10.829 -10.484 7.712 294 HB3 ASN 41 2HB ASN 41 9.512 -9.691 8.597 295 HD21 ASN 41 1HD2 ASN 41 7.427 -10.693 8.409 296 HD22 ASN 41 2HD2 ASN 41 7.084 -11.810 7.085 297 H LYS 42 H LYS 42 9.118 -6.806 8.258 298 HA LYS 42 HA LYS 42 6.402 -6.899 7.147 299 HB2 LYS 42 1HB LYS 42 7.701 -5.197 9.320 300 HB3 LYS 42 2HB LYS 42 6.103 -4.842 8.701 301 HG2 LYS 42 1HG LYS 42 6.897 -7.472 10.017 302 HG3 LYS 42 2HG LYS 42 5.956 -6.163 10.734 303 HD2 LYS 42 1HD LYS 42 4.267 -6.518 8.783 304 HD3 LYS 42 2HD LYS 42 5.155 -8.006 8.444 305 HE2 LYS 42 1HE LYS 42 3.362 -8.717 9.754 306 HE3 LYS 42 2HE LYS 42 4.751 -8.701 10.844 307 HZ1 LYS 42 3HZ LYS 42 2.547 -6.748 10.735 308 HZ2 LYS 42 1HZ LYS 42 3.919 -6.486 11.615 309 HZ3 LYS 42 2HZ LYS 42 2.924 -7.770 11.931 310 H LEU 43 H LEU 43 5.628 -5.807 5.535 311 HA LEU 43 HA LEU 43 7.226 -3.739 4.225 312 HB2 LEU 43 1HB LEU 43 6.194 -6.157 3.280 313 HB3 LEU 43 2HB LEU 43 4.920 -5.042 2.826 314 HG LEU 43 HG LEU 43 7.874 -4.844 2.097 315 HD11 LEU 43 1HD1 LEU 43 6.428 -6.574 0.897 316 HD12 LEU 43 2HD1 LEU 43 7.128 -5.331 -0.161 317 HD13 LEU 43 3HD1 LEU 43 5.421 -5.241 0.341 318 HD21 LEU 43 3HD2 LEU 43 5.596 -3.000 1.262 319 HD22 LEU 43 1HD2 LEU 43 7.285 -2.985 0.676 320 HD23 LEU 43 2HD2 LEU 43 6.942 -2.570 2.339 321 H TYR 44 H TYR 44 6.465 -1.776 4.781 322 HA TYR 44 HA TYR 44 3.663 -1.478 5.693 323 HB2 TYR 44 1HB TYR 44 6.057 0.364 5.951 324 HB3 TYR 44 2HB TYR 44 4.461 0.693 6.584 325 HD1 TYR 44 1HD TYR 44 3.579 -1.800 7.839 326 HD2 TYR 44 2HD TYR 44 7.507 -0.042 7.735 327 HE1 TYR 44 1HE TYR 44 4.142 -3.022 9.906 328 HE2 TYR 44 2HE TYR 44 8.041 -1.150 9.881 329 HH TYR 44 HH TYR 44 7.322 -2.543 11.587 330 H VAL 45 H VAL 45 2.245 -0.542 4.421 331 HA VAL 45 HA VAL 45 3.164 0.850 1.941 332 HB VAL 45 HB VAL 45 0.660 -0.836 2.057 333 HG11 VAL 45 1HG1 VAL 45 2.572 -0.050 -0.107 334 HG12 VAL 45 2HG1 VAL 45 1.084 -1.009 -0.322 335 HG13 VAL 45 3HG1 VAL 45 0.967 0.672 0.205 336 HG21 VAL 45 3HG2 VAL 45 1.989 -2.703 1.002 337 HG22 VAL 45 1HG2 VAL 45 3.482 -1.847 1.423 338 HG23 VAL 45 2HG2 VAL 45 2.419 -2.469 2.698 339 H LYS 46 H LYS 46 1.761 2.568 1.235 340 HA LYS 46 HA LYS 46 -0.185 3.557 3.235 341 HB2 LYS 46 1HB LYS 46 2.129 4.636 3.516 342 HB3 LYS 46 2HB LYS 46 2.013 5.228 1.854 343 HG2 LYS 46 1HG LYS 46 -0.202 6.297 2.737 344 HG3 LYS 46 2HG LYS 46 0.450 6.012 4.312 345 HD2 LYS 46 1HD LYS 46 1.748 7.715 2.145 346 HD3 LYS 46 2HD LYS 46 0.703 8.313 3.432 347 HE2 LYS 46 1HE LYS 46 2.452 7.077 5.014 348 HE3 LYS 46 2HE LYS 46 3.528 7.263 3.629 349 HZ1 LYS 46 3HZ LYS 46 2.057 9.480 4.959 350 HZ2 LYS 46 1HZ LYS 46 3.100 9.663 3.727 351 HZ3 LYS 46 2HZ LYS 46 3.653 9.146 5.175 352 H ALA 47 H ALA 47 -1.299 2.357 1.405 353 HA ALA 47 HA ALA 47 -1.506 3.391 -1.247 354 HB1 ALA 47 1HB ALA 47 -3.150 1.530 0.495 355 HB2 ALA 47 2HB ALA 47 -3.583 1.852 -1.175 356 HB3 ALA 47 3HB ALA 47 -2.009 1.101 -0.794 357 H ARG 48 H ARG 48 -2.598 5.181 -2.003 358 HA ARG 48 HA ARG 48 -4.375 6.673 -0.173 359 HB2 ARG 48 1HB ARG 48 -2.925 7.956 -1.607 360 HB3 ARG 48 2HB ARG 48 -3.445 7.098 -3.053 361 HG2 ARG 48 1HG ARG 48 -4.918 8.777 -3.394 362 HG3 ARG 48 2HG ARG 48 -5.903 8.138 -2.096 363 HD2 ARG 48 1HD ARG 48 -5.540 10.334 -1.389 364 HD3 ARG 48 2HD ARG 48 -4.216 9.498 -0.551 365 HE ARG 48 HE ARG 48 -3.236 10.264 -3.045 366 HH11 ARG 48 1HH1 ARG 48 -3.989 11.832 0.057 367 HH12 ARG 48 2HH1 ARG 48 -3.660 13.434 -0.528 368 HH21 ARG 48 1HH2 ARG 48 -2.503 12.411 -3.674 369 HH22 ARG 48 2HH2 ARG 48 -2.696 13.727 -2.580 370 H PHE 49 H PHE 49 -6.474 5.865 0.048 371 HA PHE 49 HA PHE 49 -7.737 4.675 -2.399 372 HB2 PHE 49 1HB PHE 49 -8.671 4.623 0.496 373 HB3 PHE 49 2HB PHE 49 -9.521 4.039 -0.921 374 HD1 PHE 49 2HD PHE 49 -6.366 3.537 1.025 375 HD2 PHE 49 1HD PHE 49 -9.151 1.759 -1.792 376 HE1 PHE 49 2HE PHE 49 -5.170 1.391 1.166 377 HE2 PHE 49 1HE PHE 49 -8.017 -0.371 -1.570 378 HZ PHE 49 HZ PHE 49 -5.961 -0.567 -0.151 379 H MET 50 H MET 50 -9.066 5.912 -3.461 380 HA MET 50 HA MET 50 -10.114 8.409 -2.171 381 HB2 MET 50 1HB MET 50 -10.168 7.938 -5.135 382 HB3 MET 50 2HB MET 50 -10.308 9.443 -4.250 383 HG2 MET 50 1HG MET 50 -7.741 7.985 -3.924 384 HG3 MET 50 2HG MET 50 -8.088 8.573 -5.546 385 HE1 MET 50 3HE MET 50 -9.319 10.551 -2.329 386 HE2 MET 50 1HE MET 50 -7.961 9.540 -1.779 387 HE3 MET 50 2HE MET 50 -7.795 11.314 -1.826 388 H GLY 51 H GLY 51 -12.043 7.966 -1.366 389 HA2 GLY 51 1HA GLY 51 -14.457 7.713 -1.695 390 HA3 GLY 51 2HA GLY 51 -14.148 6.552 -2.974 391 H TYR 52 H TYR 52 -15.938 5.849 -1.015 392 HA TYR 52 HA TYR 52 -14.739 4.616 1.280 393 HB2 TYR 52 1HB TYR 52 -17.396 5.272 0.354 394 HB3 TYR 52 2HB TYR 52 -17.400 3.608 0.861 395 HD1 TYR 52 1HD TYR 52 -16.442 3.015 3.216 396 HD2 TYR 52 2HD TYR 52 -17.439 7.010 1.942 397 HE1 TYR 52 1HE TYR 52 -16.645 3.685 5.579 398 HE2 TYR 52 2HE TYR 52 -17.710 7.703 4.296 399 HH TYR 52 HH TYR 52 -17.103 5.521 7.071 400 H THR 53 H THR 53 -13.555 2.836 1.166 401 HA THR 53 HA THR 53 -14.894 0.387 0.882 402 HB THR 53 HB THR 53 -12.771 1.025 -1.108 403 HG1 THR 53 1HG THR 53 -14.285 -0.410 -2.379 404 HG21 THR 53 3HG2 THR 53 -13.236 -1.798 -0.165 405 HG22 THR 53 1HG2 THR 53 -11.690 -0.886 -0.311 406 HG23 THR 53 2HG2 THR 53 -12.541 -1.339 -1.740 407 H LYS 54 H LYS 54 -14.550 0.187 3.001 408 HA LYS 54 HA LYS 54 -11.745 0.149 3.957 409 HB2 LYS 54 1HB LYS 54 -12.624 -0.124 6.106 410 HB3 LYS 54 2HB LYS 54 -13.519 1.142 5.230 411 HG2 LYS 54 1HG LYS 54 -15.352 0.194 6.020 412 HG3 LYS 54 2HG LYS 54 -15.166 -1.021 4.764 413 HD2 LYS 54 1HD LYS 54 -13.946 -2.467 6.387 414 HD3 LYS 54 2HD LYS 54 -14.016 -1.158 7.587 415 HE2 LYS 54 1HE LYS 54 -16.536 -1.250 7.441 416 HE3 LYS 54 2HE LYS 54 -16.359 -2.735 6.483 417 HZ1 LYS 54 3HZ LYS 54 -15.502 -2.302 9.280 418 HZ2 LYS 54 1HZ LYS 54 -15.026 -3.620 8.400 419 HZ3 LYS 54 2HZ LYS 54 -16.603 -3.385 8.716 420 H LEU 55 H LEU 55 -13.514 -1.972 2.136 421 HA LEU 55 HA LEU 55 -12.602 -4.410 3.505 422 HB2 LEU 55 1HB LEU 55 -14.486 -3.972 1.142 423 HB3 LEU 55 2HB LEU 55 -14.139 -5.524 1.901 424 HG LEU 55 HG LEU 55 -15.491 -3.154 3.281 425 HD11 LEU 55 1HD1 LEU 55 -16.718 -5.761 2.308 426 HD12 LEU 55 2HD1 LEU 55 -16.896 -4.179 1.515 427 HD13 LEU 55 3HD1 LEU 55 -17.549 -4.437 3.138 428 HD21 LEU 55 3HD2 LEU 55 -14.318 -4.520 4.933 429 HD22 LEU 55 1HD2 LEU 55 -14.961 -6.004 4.201 430 HD23 LEU 55 2HD2 LEU 55 -16.047 -4.878 5.029 431 H THR 56 H THR 56 -10.294 -3.934 2.957 432 HA THR 56 HA THR 56 -9.593 -4.002 0.108 433 HB THR 56 HB THR 56 -7.530 -4.053 2.316 434 HG1 THR 56 1HG THR 56 -9.235 -1.842 1.689 435 HG21 THR 56 3HG2 THR 56 -6.876 -3.879 -0.049 436 HG22 THR 56 1HG2 THR 56 -6.452 -2.430 0.864 437 HG23 THR 56 2HG2 THR 56 -7.853 -2.408 -0.233 438 H VAL 57 H VAL 57 -7.870 -5.595 -0.664 439 HA VAL 57 HA VAL 57 -7.662 -8.096 0.856 440 HB VAL 57 HB VAL 57 -8.522 -7.836 -2.061 441 HG11 VAL 57 1HG1 VAL 57 -8.798 -10.338 -1.953 442 HG12 VAL 57 2HG1 VAL 57 -7.127 -9.800 -1.896 443 HG13 VAL 57 3HG1 VAL 57 -7.946 -10.329 -0.407 444 HG21 VAL 57 3HG2 VAL 57 -10.461 -7.406 -0.713 445 HG22 VAL 57 1HG2 VAL 57 -10.585 -9.084 -1.255 446 HG23 VAL 57 2HG2 VAL 57 -10.067 -8.737 0.397 447 H ILE 58 H ILE 58 -5.775 -9.253 0.244 448 HA ILE 58 HA ILE 58 -3.977 -8.251 -1.819 449 HB ILE 58 HB ILE 58 -3.025 -9.069 0.956 450 HG12 ILE 58 1HG1 ILE 58 -1.964 -6.481 0.429 451 HG13 ILE 58 2HG1 ILE 58 -3.679 -6.338 0.046 452 HG21 ILE 58 1HG2 ILE 58 -1.421 -8.135 -1.432 453 HG22 ILE 58 2HG2 ILE 58 -0.771 -8.499 0.174 454 HG23 ILE 58 3HG2 ILE 58 -1.496 -9.790 -0.785 455 HD11 ILE 58 3HD1 ILE 58 -3.129 -5.881 2.449 456 HD12 ILE 58 1HD1 ILE 58 -4.309 -7.192 2.181 457 HD13 ILE 58 2HD1 ILE 58 -2.636 -7.572 2.623 458 H THR 59 H THR 59 -3.899 -10.173 -3.142 459 HA THR 59 HA THR 59 -5.225 -12.469 -2.288 460 HB THR 59 HB THR 59 -3.529 -12.954 -4.581 461 HG1 THR 59 1HG THR 59 -3.836 -11.288 -5.816 462 HG21 THR 59 3HG2 THR 59 -6.486 -12.295 -4.455 463 HG22 THR 59 1HG2 THR 59 -5.780 -13.906 -4.219 464 HG23 THR 59 2HG2 THR 59 -5.636 -13.102 -5.792 465 H GLY 60 H GLY 60 -1.807 -11.589 -2.390 466 HA2 GLY 60 1HA GLY 60 0.088 -12.643 -1.638 467 HA3 GLY 60 2HA GLY 60 -0.942 -13.615 -0.597 468 H LYS 61 H LYS 61 0.865 -15.198 -1.126 469 HA LYS 61 HA LYS 61 0.921 -16.458 -3.718 470 HB2 LYS 61 1HB LYS 61 2.506 -17.879 -2.772 471 HB3 LYS 61 2HB LYS 61 2.751 -16.351 -1.924 472 HG2 LYS 61 1HG LYS 61 1.162 -17.421 -0.108 473 HG3 LYS 61 2HG LYS 61 1.559 -18.925 -0.910 474 HD2 LYS 61 1HD LYS 61 3.236 -17.064 0.719 475 HD3 LYS 61 2HD LYS 61 3.048 -18.783 0.923 476 HE2 LYS 61 1HE LYS 61 4.565 -17.662 -1.467 477 HE3 LYS 61 2HE LYS 61 5.309 -17.697 0.123 478 HZ1 LYS 61 3HZ LYS 61 5.864 -19.597 -1.175 479 HZ2 LYS 61 1HZ LYS 61 4.337 -20.115 -1.277 480 HZ3 LYS 61 2HZ LYS 61 5.132 -20.050 0.196 481 H ASP 62 H ASP 62 -1.125 -16.719 -0.879 482 HA ASP 62 HA ASP 62 -1.930 -19.414 -1.454 483 HB2 ASP 62 1HB ASP 62 -3.317 -19.324 0.420 484 HB3 ASP 62 2HB ASP 62 -1.825 -18.503 0.824 485 H GLY 63 H GLY 63 -2.785 -16.393 -2.750 486 HA2 GLY 63 1HA GLY 63 -4.248 -15.893 -4.467 487 HA3 GLY 63 2HA GLY 63 -4.638 -17.615 -4.598 488 H LYS 64 H LYS 64 -5.025 -16.005 -1.451 489 HA LYS 64 HA LYS 64 -7.987 -15.903 -1.918 490 HB2 LYS 64 1HB LYS 64 -6.586 -16.987 0.532 491 HB3 LYS 64 2HB LYS 64 -8.314 -16.631 0.369 492 HG2 LYS 64 1HG LYS 64 -8.200 -18.188 -1.761 493 HG3 LYS 64 2HG LYS 64 -6.656 -18.719 -1.078 494 HD2 LYS 64 1HD LYS 64 -8.236 -20.255 -0.295 495 HD3 LYS 64 2HD LYS 64 -7.919 -19.177 1.078 496 HE2 LYS 64 1HE LYS 64 -9.991 -17.933 0.603 497 HE3 LYS 64 2HE LYS 64 -10.267 -18.885 -0.861 498 HZ1 LYS 64 3HZ LYS 64 -10.182 -20.046 1.840 499 HZ2 LYS 64 1HZ LYS 64 -10.660 -20.797 0.461 500 HZ3 LYS 64 2HZ LYS 64 -11.568 -19.561 1.101 501 H ASN 65 H ASN 65 -6.009 -15.000 0.951 502 HA ASN 65 HA ASN 65 -6.519 -12.164 0.613 503 HB2 ASN 65 1HB ASN 65 -8.889 -13.323 0.991 504 HB3 ASN 65 2HB ASN 65 -8.375 -13.435 2.668 505 HD21 ASN 65 1HD2 ASN 65 -7.298 -11.090 3.387 506 HD22 ASN 65 2HD2 ASN 65 -8.419 -9.784 2.971 507 H LEU 66 H LEU 66 -4.413 -11.898 1.467 508 HA LEU 66 HA LEU 66 -3.518 -13.141 3.837 509 HB2 LEU 66 1HB LEU 66 -2.586 -10.467 2.753 510 HB3 LEU 66 2HB LEU 66 -1.740 -11.485 3.913 511 HG LEU 66 HG LEU 66 -2.301 -12.122 0.990 512 HD11 LEU 66 1HD1 LEU 66 0.283 -11.741 2.582 513 HD12 LEU 66 2HD1 LEU 66 -0.435 -10.551 1.472 514 HD13 LEU 66 3HD1 LEU 66 0.181 -12.092 0.847 515 HD21 LEU 66 3HD2 LEU 66 -2.511 -14.256 2.034 516 HD22 LEU 66 1HD2 LEU 66 -1.215 -13.911 3.194 517 HD23 LEU 66 2HD2 LEU 66 -0.833 -14.197 1.496 518 H LEU 67 H LEU 67 -5.370 -10.120 3.500 519 HA LEU 67 HA LEU 67 -5.171 -9.392 6.271 520 HB2 LEU 67 1HB LEU 67 -6.964 -8.630 3.942 521 HB3 LEU 67 2HB LEU 67 -7.391 -8.063 5.546 522 HG LEU 67 HG LEU 67 -4.686 -7.555 4.315 523 HD11 LEU 67 1HD1 LEU 67 -5.578 -5.311 3.683 524 HD12 LEU 67 2HD1 LEU 67 -7.194 -5.795 4.235 525 HD13 LEU 67 3HD1 LEU 67 -6.459 -6.595 2.841 526 HD21 LEU 67 3HD2 LEU 67 -4.349 -5.993 5.982 527 HD22 LEU 67 1HD2 LEU 67 -5.186 -7.285 6.851 528 HD23 LEU 67 2HD2 LEU 67 -6.081 -5.827 6.355 529 H TYR 68 H TYR 68 -6.721 -12.109 4.953 530 HA TYR 68 HA TYR 68 -8.364 -12.352 7.367 531 HB2 TYR 68 1HB TYR 68 -9.565 -12.005 4.930 532 HB3 TYR 68 2HB TYR 68 -9.334 -13.739 4.899 533 HD1 TYR 68 2HD TYR 68 -10.595 -10.917 7.002 534 HD2 TYR 68 1HD TYR 68 -10.887 -15.140 6.182 535 HE1 TYR 68 2HE TYR 68 -12.509 -11.057 8.532 536 HE2 TYR 68 1HE TYR 68 -12.864 -15.291 7.680 537 HH TYR 68 HH TYR 68 -13.841 -12.496 9.691 538 H ASN 69 H ASN 69 -5.636 -12.865 6.875 539 HA ASN 69 HA ASN 69 -5.571 -15.802 7.283 540 HB2 ASN 69 1HB ASN 69 -3.639 -14.072 5.750 541 HB3 ASN 69 2HB ASN 69 -2.955 -15.217 6.863 542 HD21 ASN 69 1HD2 ASN 69 -5.432 -15.203 4.175 543 HD22 ASN 69 2HD2 ASN 69 -4.678 -16.618 3.457 544 H GLY 70 H GLY 70 -3.399 -12.962 7.845 545 HA2 GLY 70 1HA GLY 70 -3.972 -12.236 10.350 546 HA3 GLY 70 2HA GLY 70 -3.124 -13.753 10.681 547 H THR 71 H THR 71 -1.310 -12.860 8.115 548 HA THR 71 HA THR 71 0.597 -11.487 9.849 549 HB THR 71 HB THR 71 0.871 -11.884 6.860 550 HG1 THR 71 1HG THR 71 0.831 -13.793 8.887 551 HG21 THR 71 3HG2 THR 71 2.623 -10.542 7.964 552 HG22 THR 71 1HG2 THR 71 3.263 -12.100 7.424 553 HG23 THR 71 2HG2 THR 71 2.897 -11.843 9.143 554 H ALA 72 H ALA 72 -1.278 -10.641 6.862 555 HA ALA 72 HA ALA 72 -0.453 -7.830 7.067 556 HB1 ALA 72 1HB ALA 72 -2.483 -9.240 5.255 557 HB2 ALA 72 2HB ALA 72 -1.961 -7.553 5.117 558 HB3 ALA 72 3HB ALA 72 -0.799 -8.864 4.812 559 H LYS 73 H LYS 73 -1.551 -6.421 8.237 560 HA LYS 73 HA LYS 73 -4.399 -6.717 8.892 561 HB2 LYS 73 1HB LYS 73 -3.369 -7.902 10.705 562 HB3 LYS 73 2HB LYS 73 -2.045 -6.742 10.809 563 HG2 LYS 73 1HG LYS 73 -3.433 -6.489 12.722 564 HG3 LYS 73 2HG LYS 73 -3.422 -5.067 11.725 565 HD2 LYS 73 1HD LYS 73 -5.678 -5.195 12.250 566 HD3 LYS 73 2HD LYS 73 -5.720 -6.117 10.742 567 HE2 LYS 73 1HE LYS 73 -5.647 -8.225 11.996 568 HE3 LYS 73 2HE LYS 73 -5.382 -7.343 13.503 569 HZ1 LYS 73 3HZ LYS 73 -7.590 -6.385 13.274 570 HZ2 LYS 73 1HZ LYS 73 -7.631 -8.024 13.306 571 HZ3 LYS 73 2HZ LYS 73 -7.872 -7.281 11.896 572 H MET 74 H MET 74 -5.180 -4.440 9.779 573 HA MET 74 HA MET 74 -3.417 -2.275 8.914 574 HB2 MET 74 1HB MET 74 -5.368 -0.996 8.847 575 HB3 MET 74 2HB MET 74 -5.808 -2.542 8.111 576 HG2 MET 74 1HG MET 74 -6.607 -3.194 10.532 577 HG3 MET 74 2HG MET 74 -6.435 -1.453 10.834 578 HE1 MET 74 3HE MET 74 -7.396 -0.787 7.641 579 HE2 MET 74 1HE MET 74 -8.949 -0.057 8.146 580 HE3 MET 74 2HE MET 74 -7.453 0.213 9.107 581 H PHE 75 H PHE 75 -2.685 -0.817 10.371 582 HA PHE 75 HA PHE 75 -3.367 -1.027 13.246 583 HB2 PHE 75 1HB PHE 75 -1.057 -0.967 13.863 584 HB3 PHE 75 2HB PHE 75 -1.303 -2.325 12.779 585 HD1 PHE 75 2HD PHE 75 -0.401 -2.246 10.436 586 HD2 PHE 75 1HD PHE 75 0.354 0.931 13.255 587 HE1 PHE 75 2HE PHE 75 1.460 -1.409 9.016 588 HE2 PHE 75 1HE PHE 75 2.205 1.756 11.818 589 HZ PHE 75 HZ PHE 75 2.801 0.524 9.733 590 H LYS 76 H LYS 76 -3.367 1.053 10.510 591 HA LYS 76 HA LYS 76 -3.375 3.361 12.229 592 HB2 LYS 76 1HB LYS 76 -0.924 3.147 11.814 593 HB3 LYS 76 2HB LYS 76 -1.210 3.116 10.066 594 HG2 LYS 76 1HG LYS 76 -2.155 5.406 10.180 595 HG3 LYS 76 2HG LYS 76 -1.963 5.408 11.930 596 HD2 LYS 76 1HD LYS 76 0.496 5.284 11.663 597 HD3 LYS 76 2HD LYS 76 0.301 5.166 9.911 598 HE2 LYS 76 1HE LYS 76 0.802 7.466 10.362 599 HE3 LYS 76 2HE LYS 76 -0.912 7.422 9.985 600 HZ1 LYS 76 3HZ LYS 76 -1.416 7.582 12.290 601 HZ2 LYS 76 1HZ LYS 76 -0.338 8.763 11.951 602 HZ3 LYS 76 2HZ LYS 76 0.175 7.415 12.738 603 H SER 77 H SER 77 -4.499 5.047 11.144 604 HA SER 77 HA SER 77 -5.322 4.727 8.340 605 HB2 SER 77 1HB SER 77 -7.730 4.833 9.103 606 HB3 SER 77 2HB SER 77 -6.899 3.338 9.470 607 HG SER 77 HG SER 77 -8.026 3.922 11.256 608 H ASP 78 H ASP 78 -5.258 6.833 7.502 609 HA ASP 78 HA ASP 78 -5.624 9.172 9.354 610 HB2 ASP 78 1HB ASP 78 -3.581 8.615 7.258 611 HB3 ASP 78 2HB ASP 78 -4.428 10.124 7.043 612 H ALA 79 H ALA 79 -6.823 10.976 8.329 613 HA ALA 79 HA ALA 79 -8.643 10.065 6.154 614 HB1 ALA 79 1HB ALA 79 -9.294 11.984 8.421 615 HB2 ALA 79 2HB ALA 79 -10.401 11.362 7.168 616 HB3 ALA 79 3HB ALA 79 -9.752 10.266 8.392 617 H ILE 80 H ILE 80 -8.470 11.218 4.327 618 HA ILE 80 HA ILE 80 -6.412 13.337 4.331 619 HB ILE 80 HB ILE 80 -7.693 11.755 2.064 620 HG12 ILE 80 1HG1 ILE 80 -4.992 11.308 3.425 621 HG13 ILE 80 2HG1 ILE 80 -6.400 10.275 3.624 622 HG21 ILE 80 1HG2 ILE 80 -5.123 13.384 2.006 623 HG22 ILE 80 2HG2 ILE 80 -6.023 12.656 0.636 624 HG23 ILE 80 3HG2 ILE 80 -6.699 14.025 1.494 625 HD11 ILE 80 3HD1 ILE 80 -5.012 9.204 2.018 626 HD12 ILE 80 1HD1 ILE 80 -6.388 9.868 1.120 627 HD13 ILE 80 2HD1 ILE 80 -4.807 10.700 1.112 628 H LEU 81 H LEU 81 -7.287 15.357 4.534 629 HA LEU 81 HA LEU 81 -9.936 15.892 3.371 630 HB2 LEU 81 1HB LEU 81 -8.166 17.669 5.058 631 HB3 LEU 81 2HB LEU 81 -9.720 18.140 4.396 632 HG LEU 81 HG LEU 81 -9.267 15.837 6.340 633 HD11 LEU 81 1HD1 LEU 81 -10.211 17.252 8.036 634 HD12 LEU 81 2HD1 LEU 81 -10.496 18.579 6.862 635 HD13 LEU 81 3HD1 LEU 81 -8.850 18.086 7.305 636 HD21 LEU 81 3HD2 LEU 81 -11.779 15.966 6.593 637 HD22 LEU 81 1HD2 LEU 81 -11.197 15.326 5.065 638 HD23 LEU 81 2HD2 LEU 81 -11.811 16.977 5.139 639 H GLY 82 H GLY 82 -10.263 17.432 1.821 640 HA2 GLY 82 1HA GLY 82 -7.975 18.362 0.153 641 HA3 GLY 82 2HA GLY 82 -9.642 18.108 -0.397 642 H GLN 83 H GLN 83 -8.025 19.770 2.328 643 HA GLN 83 HA GLN 83 -7.968 21.776 3.145 644 HB2 GLN 83 1HB GLN 83 -8.857 23.049 0.595 645 HB3 GLN 83 2HB GLN 83 -7.700 23.592 1.805 646 HG2 GLN 83 1HG GLN 83 -7.299 21.437 -0.294 647 HG3 GLN 83 2HG GLN 83 -6.569 23.032 -0.234 648 HE21 GLN 83 1HE2 GLN 83 -4.534 21.823 -0.554 649 HE22 GLN 83 2HE2 GLN 83 -3.755 21.066 0.819 650 H ASN 84 H ASN 84 -10.909 22.031 1.129 651 HA ASN 84 HA ASN 84 -12.373 23.554 3.145 652 HB2 ASN 84 1HB ASN 84 -13.544 22.200 0.671 653 HB3 ASN 84 2HB ASN 84 -14.258 23.468 1.634 654 HD21 ASN 84 1HD2 ASN 84 -11.942 22.751 -0.937 655 HD22 ASN 84 2HD2 ASN 84 -11.623 24.436 -1.307 656 H LYS 85 H LYS 85 -11.528 21.246 4.383 657 HA LYS 85 HA LYS 85 -11.992 19.197 5.280 658 HB2 LYS 85 1HB LYS 85 -14.749 20.475 5.573 659 HB3 LYS 85 2HB LYS 85 -14.178 19.062 6.457 660 HG2 LYS 85 1HG LYS 85 -12.345 20.399 7.452 661 HG3 LYS 85 2HG LYS 85 -12.971 21.853 6.659 662 HD2 LYS 85 1HD LYS 85 -14.696 20.134 8.484 663 HD3 LYS 85 2HD LYS 85 -13.652 21.419 9.117 664 HE2 LYS 85 1HE LYS 85 -14.803 23.108 7.847 665 HE3 LYS 85 2HE LYS 85 -15.753 21.917 6.960 666 HZ1 LYS 85 3HZ LYS 85 -17.097 21.559 8.770 667 HZ2 LYS 85 1HZ LYS 85 -16.695 23.158 8.988 668 HZ3 LYS 85 2HZ LYS 85 -15.958 22.015 9.887 669 H VAL 86 H VAL 86 -12.353 19.252 2.323 670 HA VAL 86 HA VAL 86 -14.539 17.449 1.742 671 HB VAL 86 HB VAL 86 -12.005 17.968 0.118 672 HG11 VAL 86 1HG1 VAL 86 -13.526 17.279 -1.777 673 HG12 VAL 86 2HG1 VAL 86 -13.221 15.983 -0.612 674 HG13 VAL 86 3HG1 VAL 86 -14.743 16.844 -0.570 675 HG21 VAL 86 3HG2 VAL 86 -14.598 19.527 0.225 676 HG22 VAL 86 1HG2 VAL 86 -12.938 20.103 0.470 677 HG23 VAL 86 2HG2 VAL 86 -13.453 19.613 -1.140 678 H VAL 87 H VAL 87 -14.465 15.428 2.843 679 HA VAL 87 HA VAL 87 -11.981 13.924 3.126 680 HB VAL 87 HB VAL 87 -13.509 13.492 4.730 681 HG11 VAL 87 1HG1 VAL 87 -15.815 12.646 4.414 682 HG12 VAL 87 2HG1 VAL 87 -15.608 14.303 3.868 683 HG13 VAL 87 3HG1 VAL 87 -15.690 12.979 2.679 684 HG21 VAL 87 3HG2 VAL 87 -13.612 11.207 4.749 685 HG22 VAL 87 1HG2 VAL 87 -13.968 11.074 3.002 686 HG23 VAL 87 2HG2 VAL 87 -12.347 11.493 3.564 687 H ILE 88 H ILE 88 -11.067 14.088 1.071 688 HA ILE 88 HA ILE 88 -12.436 13.096 -1.300 689 HB ILE 88 HB ILE 88 -10.125 13.087 -2.299 690 HG12 ILE 88 1HG1 ILE 88 -9.207 14.422 0.283 691 HG13 ILE 88 2HG1 ILE 88 -8.800 12.768 -0.187 692 HG21 ILE 88 1HG2 ILE 88 -10.107 15.476 -2.556 693 HG22 ILE 88 2HG2 ILE 88 -11.786 14.994 -2.340 694 HG23 ILE 88 3HG2 ILE 88 -10.889 15.716 -0.976 695 HD11 ILE 88 3HD1 ILE 88 -8.040 15.296 -1.713 696 HD12 ILE 88 1HD1 ILE 88 -6.961 14.254 -0.796 697 HD13 ILE 88 2HD1 ILE 88 -7.721 13.634 -2.267 698 H GLY 89 H GLY 89 -10.547 11.626 1.282 699 HA2 GLY 89 1HA GLY 89 -11.261 8.971 0.697 700 HA3 GLY 89 2HA GLY 89 -9.714 9.329 -0.107 701 H TRP 90 H TRP 90 -8.799 7.642 1.444 702 HA TRP 90 HA TRP 90 -8.152 8.832 4.037 703 HB2 TRP 90 1HB TRP 90 -9.522 6.162 3.622 704 HB3 TRP 90 2HB TRP 90 -8.779 6.700 5.118 705 HD1 TRP 90 HD TRP 90 -10.063 8.488 6.564 706 HE1 TRP 90 1HE TRP 90 -12.445 9.490 6.479 707 HE3 TRP 90 3HE TRP 90 -11.529 6.644 2.038 708 HZ2 TRP 90 2HZ TRP 90 -14.829 9.099 4.869 709 HZ3 TRP 90 3HZ TRP 90 -13.863 7.084 1.223 710 HH2 TRP 90 HH TRP 90 -15.475 8.295 2.609 711 H ASP 91 H ASP 91 -6.288 8.049 4.810 712 HA ASP 91 HA ASP 91 -4.528 6.544 2.973 713 HB2 ASP 91 1HB ASP 91 -4.252 8.622 5.062 714 HB3 ASP 91 2HB ASP 91 -3.161 7.258 5.337 715 H LYS 92 H LYS 92 -5.444 4.500 3.157 716 HA LYS 92 HA LYS 92 -5.695 3.263 5.888 717 HB2 LYS 92 1HB LYS 92 -6.628 2.374 3.160 718 HB3 LYS 92 2HB LYS 92 -6.226 1.163 4.371 719 HG2 LYS 92 1HG LYS 92 -8.596 1.567 4.427 720 HG3 LYS 92 2HG LYS 92 -7.861 2.092 5.951 721 HD2 LYS 92 1HD LYS 92 -7.876 4.426 5.126 722 HD3 LYS 92 2HD LYS 92 -8.638 3.892 3.622 723 HE2 LYS 92 1HE LYS 92 -10.444 4.697 4.855 724 HE3 LYS 92 2HE LYS 92 -10.542 2.959 5.149 725 HZ1 LYS 92 3HZ LYS 92 -9.617 3.319 7.313 726 HZ2 LYS 92 1HZ LYS 92 -10.761 4.500 7.101 727 HZ3 LYS 92 2HZ LYS 92 -9.166 4.863 6.955 728 H TYR 93 H TYR 93 -3.698 2.614 6.760 729 HA TYR 93 HA TYR 93 -1.506 1.995 4.890 730 HB2 TYR 93 1HB TYR 93 -1.651 2.131 7.928 731 HB3 TYR 93 2HB TYR 93 -0.220 1.953 6.971 732 HD1 TYR 93 1HD TYR 93 -3.040 4.344 7.657 733 HD2 TYR 93 2HD TYR 93 1.045 3.874 6.348 734 HE1 TYR 93 1HE TYR 93 -2.678 6.750 7.930 735 HE2 TYR 93 2HE TYR 93 1.409 6.289 6.641 736 HH TYR 93 HH TYR 93 0.224 8.467 6.969 737 H PHE 94 H PHE 94 -0.256 -0.195 5.586 738 HA PHE 94 HA PHE 94 -1.826 -2.102 7.159 739 HB2 PHE 94 1HB PHE 94 -0.996 -2.826 4.317 740 HB3 PHE 94 2HB PHE 94 -1.705 -3.918 5.497 741 HD1 PHE 94 1HD PHE 94 -2.354 -1.144 3.218 742 HD2 PHE 94 2HD PHE 94 -4.106 -3.776 6.101 743 HE1 PHE 94 1HE PHE 94 -4.639 -0.408 2.488 744 HE2 PHE 94 2HE PHE 94 -6.392 -3.076 5.372 745 HZ PHE 94 HZ PHE 94 -6.642 -1.372 3.598 746 H GLU 95 H GLU 95 -0.554 -4.091 7.642 747 HA GLU 95 HA GLU 95 2.402 -3.716 7.535 748 HB2 GLU 95 1HB GLU 95 2.515 -4.793 9.644 749 HB3 GLU 95 2HB GLU 95 1.289 -3.555 9.763 750 HG2 GLU 95 1HG GLU 95 -0.358 -5.576 9.269 751 HG3 GLU 95 2HG GLU 95 1.030 -6.516 9.820 752 H ILE 96 H ILE 96 2.096 -4.768 5.233 753 HA ILE 96 HA ILE 96 1.139 -7.548 5.282 754 HB ILE 96 HB ILE 96 2.233 -5.751 3.091 755 HG12 ILE 96 1HG1 ILE 96 -0.666 -6.627 3.259 756 HG13 ILE 96 2HG1 ILE 96 -0.160 -5.361 4.347 757 HG21 ILE 96 1HG2 ILE 96 0.743 -8.390 2.683 758 HG22 ILE 96 2HG2 ILE 96 1.275 -7.267 1.419 759 HG23 ILE 96 3HG2 ILE 96 2.467 -8.121 2.379 760 HD11 ILE 96 3HD1 ILE 96 -1.020 -4.339 2.349 761 HD12 ILE 96 1HD1 ILE 96 0.734 -4.055 2.480 762 HD13 ILE 96 2HD1 ILE 96 0.102 -5.274 1.344 763 HA PRO 97 HA PRO 97 5.364 -9.241 5.607 764 HB2 PRO 97 1HB PRO 97 5.065 -11.543 4.016 765 HB3 PRO 97 2HB PRO 97 4.622 -11.420 5.720 766 HG2 PRO 97 1HG PRO 97 2.877 -11.071 3.290 767 HG3 PRO 97 2HG PRO 97 2.521 -11.993 4.796 768 HD2 PRO 97 1HD PRO 97 1.533 -9.553 4.361 769 HD3 PRO 97 2HD PRO 97 2.080 -9.984 5.982 770 H MET 98 H MET 98 7.107 -9.866 4.248 771 HA MET 98 HA MET 98 7.051 -9.051 1.352 772 HB2 MET 98 1HB MET 98 9.296 -9.278 3.437 773 HB3 MET 98 2HB MET 98 9.639 -9.226 1.713 774 HG2 MET 98 1HG MET 98 8.408 -7.098 1.534 775 HG3 MET 98 2HG MET 98 8.231 -7.077 3.297 776 HE1 MET 98 3HE MET 98 9.385 -5.168 4.137 777 HE2 MET 98 1HE MET 98 10.124 -6.566 4.927 778 HE3 MET 98 2HE MET 98 11.152 -5.222 4.386 779 H ASP 99 H ASP 99 6.820 -11.799 3.237 780 HA ASP 99 HA ASP 99 8.132 -13.451 1.141 781 HB2 ASP 99 1HB ASP 99 8.544 -13.254 3.964 782 HB3 ASP 99 2HB ASP 99 7.802 -14.813 3.685 783 H ALA 100 H ALA 100 5.102 -12.473 1.379 784 HA ALA 100 HA ALA 100 4.053 -15.293 1.466 785 HB1 ALA 100 1HB ALA 100 2.403 -13.135 2.705 786 HB2 ALA 100 2HB ALA 100 2.248 -14.881 2.820 787 HB3 ALA 100 3HB ALA 100 3.584 -14.086 3.668 788 H LEU 101 H LEU 101 4.676 -12.802 -0.389 789 HA LEU 101 HA LEU 101 2.220 -12.450 -1.876 790 HB2 LEU 101 1HB LEU 101 5.148 -11.702 -2.361 791 HB3 LEU 101 2HB LEU 101 3.747 -11.080 -3.248 792 HG LEU 101 HG LEU 101 4.551 -9.515 -1.713 793 HD11 LEU 101 1HD1 LEU 101 2.048 -9.630 -1.833 794 HD12 LEU 101 2HD1 LEU 101 2.636 -8.945 -0.297 795 HD13 LEU 101 3HD1 LEU 101 2.068 -10.628 -0.367 796 HD21 LEU 101 3HD2 LEU 101 4.383 -10.939 0.770 797 HD22 LEU 101 1HD2 LEU 101 5.179 -9.437 0.242 798 HD23 LEU 101 2HD2 LEU 101 5.807 -10.983 -0.362 799 H GLN 102 H GLN 102 2.065 -13.155 -4.093 800 HA GLN 102 HA GLN 102 2.965 -15.786 -4.643 801 HB2 GLN 102 1HB GLN 102 0.858 -14.533 -5.334 802 HB3 GLN 102 2HB GLN 102 1.852 -13.590 -6.462 803 HG2 GLN 102 1HG GLN 102 2.513 -15.693 -7.541 804 HG3 GLN 102 2HG GLN 102 1.457 -16.584 -6.423 805 HE21 GLN 102 1HE2 GLN 102 -0.731 -16.758 -7.031 806 HE22 GLN 102 2HE2 GLN 102 -1.424 -15.986 -8.421 807 H ASP 103 H ASP 103 4.660 -12.820 -4.876 808 HA ASP 103 HA ASP 103 6.633 -13.802 -6.793 809 HB2 ASP 103 1HB ASP 103 4.443 -12.529 -7.882 810 HB3 ASP 103 2HB ASP 103 5.401 -11.125 -7.429 811 H ASN 104 H ASN 104 8.325 -11.804 -7.037 812 HA ASN 104 HA ASN 104 8.838 -10.756 -4.357 813 HB2 ASN 104 1HB ASN 104 10.352 -10.316 -6.972 814 HB3 ASN 104 2HB ASN 104 10.805 -9.638 -5.436 815 HD21 ASN 104 1HD2 ASN 104 11.875 -10.882 -3.879 816 HD22 ASN 104 2HD2 ASN 104 12.115 -12.617 -4.085 817 H SER 105 H SER 105 6.302 -9.849 -5.518 818 HA SER 105 HA SER 105 6.839 -6.975 -5.396 819 HB2 SER 105 1HB SER 105 5.288 -6.473 -7.282 820 HB3 SER 105 2HB SER 105 6.725 -7.340 -7.795 821 HG SER 105 HG SER 105 5.721 -8.964 -8.378 822 H ILE 106 H ILE 106 5.347 -5.833 -4.369 823 HA ILE 106 HA ILE 106 3.253 -7.338 -2.901 824 HB ILE 106 HB ILE 106 4.823 -5.757 -1.812 825 HG12 ILE 106 1HG1 ILE 106 2.844 -6.372 -0.636 826 HG13 ILE 106 2HG1 ILE 106 3.372 -4.741 -0.276 827 HG21 ILE 106 1HG2 ILE 106 5.058 -3.992 -3.428 828 HG22 ILE 106 2HG2 ILE 106 3.361 -3.522 -3.242 829 HG23 ILE 106 3HG2 ILE 106 4.478 -3.341 -1.891 830 HD11 ILE 106 3HD1 ILE 106 1.145 -4.354 -0.358 831 HD12 ILE 106 1HD1 ILE 106 1.499 -4.046 -2.050 832 HD13 ILE 106 2HD1 ILE 106 0.825 -5.621 -1.532 833 H GLN 107 H GLN 107 0.926 -6.409 -3.173 834 HA GLN 107 HA GLN 107 0.371 -4.278 -4.946 835 HB2 GLN 107 1HB GLN 107 0.759 -6.364 -6.563 836 HB3 GLN 107 2HB GLN 107 -0.737 -6.971 -5.870 837 HG2 GLN 107 1HG GLN 107 -1.834 -4.787 -6.610 838 HG3 GLN 107 2HG GLN 107 -0.317 -4.392 -7.430 839 HE21 GLN 107 1HE2 GLN 107 -2.555 -4.530 -8.878 840 HE22 GLN 107 2HE2 GLN 107 -2.567 -5.857 -9.949 841 H ILE 108 H ILE 108 -1.826 -3.576 -4.504 842 HA ILE 108 HA ILE 108 -3.330 -5.213 -2.513 843 HB ILE 108 HB ILE 108 -2.956 -2.199 -2.796 844 HG12 ILE 108 1HG1 ILE 108 -2.289 -4.158 -0.535 845 HG13 ILE 108 2HG1 ILE 108 -1.120 -3.452 -1.647 846 HG21 ILE 108 1HG2 ILE 108 -4.807 -3.752 -0.945 847 HG22 ILE 108 2HG2 ILE 108 -4.448 -2.022 -0.800 848 HG23 ILE 108 3HG2 ILE 108 -5.302 -2.596 -2.214 849 HD11 ILE 108 3HD1 ILE 108 -2.684 -1.945 0.469 850 HD12 ILE 108 1HD1 ILE 108 -0.958 -2.284 0.416 851 HD13 ILE 108 2HD1 ILE 108 -1.675 -1.186 -0.782 852 H LYS 109 H LYS 109 -5.753 -5.012 -2.773 853 HA LYS 109 HA LYS 109 -6.720 -3.788 -5.201 854 HB2 LYS 109 1HB LYS 109 -7.801 -5.902 -6.039 855 HB3 LYS 109 2HB LYS 109 -6.062 -5.860 -6.209 856 HG2 LYS 109 1HG LYS 109 -6.717 -7.111 -3.659 857 HG3 LYS 109 2HG LYS 109 -7.691 -7.831 -4.926 858 HD2 LYS 109 1HD LYS 109 -5.633 -9.039 -4.530 859 HD3 LYS 109 2HD LYS 109 -5.747 -8.471 -6.202 860 HE2 LYS 109 1HE LYS 109 -4.121 -6.670 -5.760 861 HE3 LYS 109 2HE LYS 109 -4.093 -7.119 -4.022 862 HZ1 LYS 109 3HZ LYS 109 -2.240 -8.181 -4.963 863 HZ2 LYS 109 1HZ LYS 109 -3.033 -8.567 -6.343 864 HZ3 LYS 109 2HZ LYS 109 -3.325 -9.382 -4.969 865 H ALA 110 H ALA 110 -9.262 -3.697 -5.186 866 HA ALA 110 HA ALA 110 -10.419 -4.952 -2.799 867 HB1 ALA 110 1HB ALA 110 -9.407 -2.730 -2.001 868 HB2 ALA 110 2HB ALA 110 -10.600 -1.927 -3.043 869 HB3 ALA 110 3HB ALA 110 -11.120 -2.989 -1.696 870 H LEU 111 H LEU 111 -12.809 -4.355 -2.647 871 HA LEU 111 HA LEU 111 -14.234 -4.473 -5.223 872 HB2 LEU 111 1HB LEU 111 -15.103 -5.647 -3.240 873 HB3 LEU 111 2HB LEU 111 -15.046 -4.155 -2.301 874 HG LEU 111 HG LEU 111 -16.849 -3.179 -3.719 875 HD11 LEU 111 1HD1 LEU 111 -18.172 -4.786 -5.170 876 HD12 LEU 111 2HD1 LEU 111 -16.807 -5.922 -5.061 877 HD13 LEU 111 3HD1 LEU 111 -16.606 -4.331 -5.828 878 HD21 LEU 111 3HD2 LEU 111 -18.637 -4.600 -2.823 879 HD22 LEU 111 1HD2 LEU 111 -17.364 -4.335 -1.622 880 HD23 LEU 111 2HD2 LEU 111 -17.473 -5.888 -2.486 881 H SER 112 H SER 112 -14.970 -2.742 -6.316 882 HA SER 112 HA SER 112 -14.750 -0.047 -5.011 883 HB2 SER 112 1HB SER 112 -13.263 0.156 -6.694 884 HB3 SER 112 2HB SER 112 -14.055 -0.994 -7.733 885 HG SER 112 HG SER 112 -14.756 1.707 -7.265 886 H SER 113 H SER 113 -16.753 -1.514 -7.666 887 HA SER 113 HA SER 113 -19.104 -1.057 -6.000 888 HB2 SER 113 1HB SER 113 -20.232 0.350 -7.493 889 HB3 SER 113 2HB SER 113 -18.603 1.017 -7.475 890 HG SER 113 HG SER 113 -20.052 -0.162 -9.470 891 H GLY 114 H GLY 114 -21.028 -2.102 -6.874 892 HA2 GLY 114 1HA GLY 114 -22.104 -4.006 -7.540 893 HA3 GLY 114 2HA GLY 114 -21.175 -3.833 -9.018 894 H THR 115 H THR 115 -19.398 -5.140 -9.351 895 HA THR 115 HA THR 115 -18.494 -7.017 -7.312 896 HB THR 115 HB THR 115 -20.303 -8.131 -8.346 897 HG1 THR 115 1HG THR 115 -18.430 -9.310 -7.604 898 HG21 THR 115 3HG2 THR 115 -18.553 -7.950 -10.780 899 HG22 THR 115 1HG2 THR 115 -20.042 -7.032 -10.497 900 HG23 THR 115 2HG2 THR 115 -20.144 -8.795 -10.670 901 H THR 116 H THR 116 -17.546 -4.551 -9.026 902 HA THR 116 HA THR 116 -15.420 -5.607 -10.692 903 HB THR 116 HB THR 116 -16.681 -3.274 -10.877 904 HG1 THR 116 1HG THR 116 -15.047 -3.687 -12.304 905 HG21 THR 116 3HG2 THR 116 -14.312 -2.365 -9.247 906 HG22 THR 116 1HG2 THR 116 -15.905 -2.603 -8.518 907 HG23 THR 116 2HG2 THR 116 -15.702 -1.410 -9.821 908 H PHE 117 H PHE 117 -13.228 -5.346 -10.142 909 HA PHE 117 HA PHE 117 -12.601 -4.873 -7.297 910 HB2 PHE 117 1HB PHE 117 -12.784 -7.402 -8.425 911 HB3 PHE 117 2HB PHE 117 -11.042 -7.069 -8.466 912 HD1 PHE 117 1HD PHE 117 -14.081 -7.189 -6.322 913 HD2 PHE 117 2HD PHE 117 -9.784 -7.003 -6.374 914 HE1 PHE 117 1HE PHE 117 -14.043 -7.722 -3.893 915 HE2 PHE 117 2HE PHE 117 -9.745 -7.457 -3.914 916 HZ PHE 117 HZ PHE 117 -11.882 -7.828 -2.685 917 H VAL 118 H VAL 118 -11.141 -3.350 -7.179 918 HA VAL 118 HA VAL 118 -9.707 -2.478 -9.604 919 HB VAL 118 HB VAL 118 -10.787 -0.786 -8.342 920 HG11 VAL 118 1HG1 VAL 118 -10.391 -0.057 -6.153 921 HG12 VAL 118 2HG1 VAL 118 -11.211 -1.581 -6.282 922 HG13 VAL 118 3HG1 VAL 118 -9.478 -1.570 -5.830 923 HG21 VAL 118 3HG2 VAL 118 -8.965 0.810 -7.969 924 HG22 VAL 118 1HG2 VAL 118 -7.819 -0.568 -8.006 925 HG23 VAL 118 2HG2 VAL 118 -8.754 -0.134 -9.425 926 H TYR 119 H TYR 119 -7.711 -3.115 -9.968 927 HA TYR 119 HA TYR 119 -6.113 -4.355 -7.790 928 HB2 TYR 119 1HB TYR 119 -5.888 -4.473 -10.822 929 HB3 TYR 119 2HB TYR 119 -4.880 -5.343 -9.689 930 HD1 TYR 119 1HD TYR 119 -5.844 -7.084 -8.194 931 HD2 TYR 119 2HD TYR 119 -8.227 -5.271 -11.279 932 HE1 TYR 119 1HE TYR 119 -7.397 -8.981 -8.071 933 HE2 TYR 119 2HE TYR 119 -9.778 -7.155 -11.206 934 HH TYR 119 HH TYR 119 -9.160 -10.025 -9.042 935 H SER 120 H SER 120 -4.468 -3.097 -6.955 936 HA SER 120 HA SER 120 -4.086 -0.433 -8.059 937 HB2 SER 120 1HB SER 120 -3.040 0.041 -6.077 938 HB3 SER 120 2HB SER 120 -4.015 -1.248 -5.582 939 HG SER 120 HG SER 120 -1.299 -1.683 -6.304 940 H GLN 121 H GLN 121 -1.507 0.262 -8.265 941 HA GLN 121 HA GLN 121 -0.430 -1.317 -10.413 942 HB2 GLN 121 1HB GLN 121 1.478 0.228 -10.311 943 HB3 GLN 121 2HB GLN 121 -0.081 1.053 -10.377 944 HG2 GLN 121 1HG GLN 121 0.114 1.431 -7.874 945 HG3 GLN 121 2HG GLN 121 1.728 0.724 -7.950 946 HE21 GLN 121 1HE2 GLN 121 2.720 2.810 -7.247 947 HE22 GLN 121 2HE2 GLN 121 2.575 4.216 -8.279 948 H LYS 122 H LYS 122 1.491 -2.518 -10.404 949 HA LYS 122 HA LYS 122 1.947 -4.090 -7.936 950 HB2 LYS 122 1HB LYS 122 1.370 -4.990 -10.347 951 HB3 LYS 122 2HB LYS 122 3.075 -4.652 -10.691 952 HG2 LYS 122 1HG LYS 122 3.713 -6.172 -8.836 953 HG3 LYS 122 2HG LYS 122 2.000 -6.419 -8.466 954 HD2 LYS 122 1HD LYS 122 2.673 -8.318 -9.704 955 HD3 LYS 122 2HD LYS 122 1.690 -7.347 -10.806 956 HE2 LYS 122 1HE LYS 122 3.790 -6.413 -11.816 957 HE3 LYS 122 2HE LYS 122 4.734 -7.346 -10.655 958 HZ1 LYS 122 3HZ LYS 122 3.072 -8.505 -12.800 959 HZ2 LYS 122 1HZ LYS 122 3.898 -9.361 -11.643 960 HZ3 LYS 122 2HZ LYS 122 4.712 -8.422 -12.721 961 H ILE 123 H ILE 123 4.161 -4.260 -7.079 962 HA ILE 123 HA ILE 123 6.205 -2.474 -8.201 963 HB ILE 123 HB ILE 123 5.215 -2.346 -5.309 964 HG12 ILE 123 1HG1 ILE 123 3.581 -1.160 -6.783 965 HG13 ILE 123 2HG1 ILE 123 4.329 -0.174 -5.553 966 HG21 ILE 123 1HG2 ILE 123 7.286 -0.616 -6.700 967 HG22 ILE 123 2HG2 ILE 123 6.747 -0.445 -5.022 968 HG23 ILE 123 3HG2 ILE 123 7.625 -1.899 -5.521 969 HD11 ILE 123 3HD1 ILE 123 5.300 -0.181 -8.426 970 HD12 ILE 123 1HD1 ILE 123 3.991 0.867 -7.841 971 HD13 ILE 123 2HD1 ILE 123 5.620 1.041 -7.178 972 H ASP 124 H ASP 124 7.594 -3.916 -8.670 973 HA ASP 124 HA ASP 124 8.233 -6.284 -7.080 974 HB2 ASP 124 1HB ASP 124 8.949 -5.206 -9.679 975 HB3 ASP 124 2HB ASP 124 10.414 -5.578 -8.781 976 H PHE 125 H PHE 125 10.033 -6.618 -5.705 977 HA PHE 125 HA PHE 125 11.772 -4.316 -5.188 978 HB2 PHE 125 1HB PHE 125 11.387 -4.314 -2.807 979 HB3 PHE 125 2HB PHE 125 9.873 -4.019 -3.627 980 HD1 PHE 125 2HD PHE 125 8.054 -5.745 -3.696 981 HD2 PHE 125 1HD PHE 125 11.649 -6.227 -1.355 982 HE1 PHE 125 2HE PHE 125 6.956 -7.518 -2.352 983 HE2 PHE 125 1HE PHE 125 10.556 -7.957 -0.011 984 HZ PHE 125 HZ PHE 125 8.177 -8.582 -0.471 985 H GLU 126 H GLU 126 13.598 -4.978 -3.689 986 HA GLU 126 HA GLU 126 14.391 -7.826 -4.108 987 HB2 GLU 126 1HB GLU 126 15.726 -5.185 -4.269 988 HB3 GLU 126 2HB GLU 126 16.667 -6.602 -3.677 989 HG2 GLU 126 1HG GLU 126 16.717 -7.530 -5.757 990 HG3 GLU 126 2HG GLU 126 15.135 -6.860 -6.227 991 H ARG 127 H ARG 127 15.213 -8.928 -2.411 992 HA ARG 127 HA ARG 127 14.122 -7.903 0.166 993 HB2 ARG 127 1HB ARG 127 14.574 -10.779 -0.675 994 HB3 ARG 127 2HB ARG 127 13.800 -10.180 0.789 995 HG2 ARG 127 1HG ARG 127 12.208 -9.023 -1.089 996 HG3 ARG 127 2HG ARG 127 12.772 -10.407 -2.031 997 HD2 ARG 127 1HD ARG 127 11.473 -10.427 0.706 998 HD3 ARG 127 2HD ARG 127 10.702 -10.980 -0.813 999 HE ARG 127 HE ARG 127 13.156 -12.284 0.314 1000 HH11 ARG 127 1HH1 ARG 127 9.705 -12.806 -0.682 1001 HH12 ARG 127 2HH1 ARG 127 9.793 -14.438 -0.132 1002 HH21 ARG 127 1HH2 ARG 127 13.120 -14.361 0.944 1003 HH22 ARG 127 2HH2 ARG 127 11.614 -15.235 0.966 1004 H GLU 128 H GLU 128 15.824 -6.939 1.001 1005 HA GLU 128 HA GLU 128 18.479 -7.588 0.947 1006 HB2 GLU 128 1HB GLU 128 17.247 -5.545 2.007 1007 HB3 GLU 128 2HB GLU 128 17.145 -6.540 3.462 1008 HG2 GLU 128 1HG GLU 128 19.133 -5.335 3.750 1009 HG3 GLU 128 2HG GLU 128 19.619 -6.924 3.226 Start of MODEL 15 1 H1 GLY 1 H GLY 1 -24.752 7.755 -3.516 2 HA2 GLY 1 1HA GLY 1 -26.825 9.844 -3.841 3 HA3 GLY 1 2HA GLY 1 -26.027 9.467 -2.294 4 H ALA 2 H ALA 2 -25.080 11.581 -2.057 5 HA ALA 2 HA ALA 2 -22.997 12.290 -4.073 6 HB1 ALA 2 1HB ALA 2 -24.709 14.117 -2.345 7 HB2 ALA 2 2HB ALA 2 -23.518 14.615 -3.558 8 HB3 ALA 2 3HB ALA 2 -24.994 13.779 -4.068 9 H GLU 3 H GLU 3 -23.211 11.063 -0.922 10 HA GLU 3 HA GLU 3 -20.454 11.977 -0.563 11 HB2 GLU 3 1HB GLU 3 -21.857 11.723 2.034 12 HB3 GLU 3 2HB GLU 3 -20.552 12.765 1.498 13 HG2 GLU 3 1HG GLU 3 -22.073 14.352 1.948 14 HG3 GLU 3 2HG GLU 3 -22.515 14.100 0.260 15 H ALA 4 H ALA 4 -19.537 10.597 1.322 16 HA ALA 4 HA ALA 4 -18.519 8.647 1.544 17 HB1 ALA 4 1HB ALA 4 -20.285 8.185 3.144 18 HB2 ALA 4 2HB ALA 4 -21.301 7.493 1.856 19 HB3 ALA 4 3HB ALA 4 -19.768 6.702 2.309 20 H LEU 5 H LEU 5 -18.618 9.484 -0.985 21 HA LEU 5 HA LEU 5 -19.744 7.792 -2.930 22 HB2 LEU 5 1HB LEU 5 -17.251 9.490 -2.914 23 HB3 LEU 5 2HB LEU 5 -17.684 8.631 -4.349 24 HG LEU 5 HG LEU 5 -19.457 10.637 -2.953 25 HD11 LEU 5 1HD1 LEU 5 -18.777 12.232 -4.738 26 HD12 LEU 5 2HD1 LEU 5 -17.558 11.070 -5.293 27 HD13 LEU 5 3HD1 LEU 5 -17.448 11.783 -3.666 28 HD21 LEU 5 3HD2 LEU 5 -20.680 9.088 -4.457 29 HD22 LEU 5 1HD2 LEU 5 -19.517 9.472 -5.770 30 HD23 LEU 5 2HD2 LEU 5 -20.637 10.715 -5.154 31 HA PRO 6 HA PRO 6 -17.397 4.088 -2.459 32 HB2 PRO 6 1HB PRO 6 -17.453 3.023 -5.009 33 HB3 PRO 6 2HB PRO 6 -18.925 3.184 -3.995 34 HG2 PRO 6 1HG PRO 6 -17.931 5.047 -6.161 35 HG3 PRO 6 2HG PRO 6 -19.566 4.361 -5.883 36 HD2 PRO 6 1HD PRO 6 -18.759 6.918 -5.009 37 HD3 PRO 6 2HD PRO 6 -20.034 5.945 -4.192 38 H LEU 7 H LEU 7 -15.482 3.092 -3.092 39 HA LEU 7 HA LEU 7 -13.201 4.675 -3.434 40 HB2 LEU 7 1HB LEU 7 -13.074 2.504 -2.472 41 HB3 LEU 7 2HB LEU 7 -13.725 1.752 -3.901 42 HG LEU 7 HG LEU 7 -11.576 2.604 -5.140 43 HD11 LEU 7 1HD1 LEU 7 -10.775 2.958 -2.226 44 HD12 LEU 7 2HD1 LEU 7 -10.770 4.177 -3.493 45 HD13 LEU 7 3HD1 LEU 7 -9.624 2.837 -3.582 46 HD21 LEU 7 3HD2 LEU 7 -11.908 0.295 -4.789 47 HD22 LEU 7 1HD2 LEU 7 -11.628 0.412 -3.057 48 HD23 LEU 7 2HD2 LEU 7 -10.283 0.658 -4.188 49 H TYR 8 H TYR 8 -12.577 5.837 -5.159 50 HA TYR 8 HA TYR 8 -13.147 4.850 -7.915 51 HB2 TYR 8 1HB TYR 8 -13.186 7.202 -8.603 52 HB3 TYR 8 2HB TYR 8 -14.474 6.697 -7.538 53 HD1 TYR 8 1HD TYR 8 -11.209 8.557 -7.472 54 HD2 TYR 8 2HD TYR 8 -15.090 7.937 -5.709 55 HE1 TYR 8 1HE TYR 8 -10.920 10.612 -6.097 56 HE2 TYR 8 2HE TYR 8 -14.847 10.001 -4.382 57 HH TYR 8 HH TYR 8 -12.032 12.178 -4.729 58 H TYR 9 H TYR 9 -10.519 5.327 -5.786 59 HA TYR 9 HA TYR 9 -8.655 5.027 -8.055 60 HB2 TYR 9 1HB TYR 9 -8.783 7.475 -7.719 61 HB3 TYR 9 2HB TYR 9 -8.509 7.174 -6.013 62 HD1 TYR 9 2HD TYR 9 -6.881 7.009 -9.338 63 HD2 TYR 9 1HD TYR 9 -6.305 6.878 -5.076 64 HE1 TYR 9 2HE TYR 9 -4.431 7.237 -9.677 65 HE2 TYR 9 1HE TYR 9 -3.884 7.235 -5.379 66 HH TYR 9 HH TYR 9 -2.309 7.159 -8.532 67 H LEU 10 H LEU 10 -6.873 3.663 -7.473 68 HA LEU 10 HA LEU 10 -6.464 3.124 -4.623 69 HB2 LEU 10 1HB LEU 10 -7.955 1.499 -5.934 70 HB3 LEU 10 2HB LEU 10 -6.587 1.303 -7.023 71 HG LEU 10 HG LEU 10 -6.405 -0.540 -5.889 72 HD11 LEU 10 1HD1 LEU 10 -4.298 0.673 -5.520 73 HD12 LEU 10 2HD1 LEU 10 -4.613 -0.522 -4.218 74 HD13 LEU 10 3HD1 LEU 10 -4.830 1.189 -3.934 75 HD21 LEU 10 3HD2 LEU 10 -8.235 -0.115 -4.232 76 HD22 LEU 10 1HD2 LEU 10 -7.149 0.974 -3.347 77 HD23 LEU 10 2HD2 LEU 10 -6.833 -0.776 -3.389 78 H GLN 11 H GLN 11 -4.350 3.343 -4.325 79 HA GLN 11 HA GLN 11 -2.469 2.343 -6.166 80 HB2 GLN 11 1HB GLN 11 -3.028 5.060 -6.678 81 HB3 GLN 11 2HB GLN 11 -1.539 5.123 -5.774 82 HG2 GLN 11 1HG GLN 11 -0.379 4.605 -7.604 83 HG3 GLN 11 2HG GLN 11 -1.210 3.071 -7.778 84 HE21 GLN 11 1HE2 GLN 11 -3.563 3.313 -8.836 85 HE22 GLN 11 2HE2 GLN 11 -3.554 4.332 -10.251 86 H ILE 12 H ILE 12 -0.412 2.105 -5.218 87 HA ILE 12 HA ILE 12 -0.452 1.949 -2.380 88 HB ILE 12 HB ILE 12 1.882 1.831 -4.288 89 HG12 ILE 12 1HG1 ILE 12 0.343 0.237 -5.174 90 HG13 ILE 12 2HG1 ILE 12 1.411 -0.708 -4.183 91 HG21 ILE 12 1HG2 ILE 12 2.515 1.848 -1.819 92 HG22 ILE 12 2HG2 ILE 12 1.692 0.276 -1.698 93 HG23 ILE 12 3HG2 ILE 12 3.072 0.478 -2.769 94 HD11 ILE 12 3HD1 ILE 12 -1.462 0.043 -3.638 95 HD12 ILE 12 1HD1 ILE 12 -0.734 -1.554 -3.764 96 HD13 ILE 12 2HD1 ILE 12 -0.394 -0.565 -2.341 97 H THR 13 H THR 13 0.692 4.478 -4.480 98 HA THR 13 HA THR 13 1.693 6.403 -4.350 99 HB THR 13 HB THR 13 0.755 8.067 -3.001 100 HG1 THR 13 1HG THR 13 0.670 7.310 -0.960 101 HG21 THR 13 3HG2 THR 13 -0.682 6.845 -4.715 102 HG22 THR 13 1HG2 THR 13 -1.540 7.796 -3.479 103 HG23 THR 13 2HG2 THR 13 -1.435 6.026 -3.331 104 H GLY 14 H GLY 14 2.115 5.092 -1.048 105 HA2 GLY 14 1HA GLY 14 5.004 5.775 -1.268 106 HA3 GLY 14 2HA GLY 14 4.128 6.279 0.184 107 H ILE 15 H ILE 15 6.338 4.359 0.031 108 HA ILE 15 HA ILE 15 5.050 2.098 1.343 109 HB ILE 15 HB ILE 15 5.277 1.623 -1.168 110 HG12 ILE 15 1HG1 ILE 15 6.631 -0.359 0.674 111 HG13 ILE 15 2HG1 ILE 15 4.888 -0.091 0.559 112 HG21 ILE 15 1HG2 ILE 15 7.628 2.616 -1.347 113 HG22 ILE 15 2HG2 ILE 15 8.219 1.161 -0.552 114 HG23 ILE 15 3HG2 ILE 15 7.403 1.031 -2.122 115 HD11 ILE 15 3HD1 ILE 15 5.130 -0.585 -1.970 116 HD12 ILE 15 1HD1 ILE 15 6.737 -1.242 -1.576 117 HD13 ILE 15 2HD1 ILE 15 5.275 -1.942 -0.866 118 H THR 16 H THR 16 6.619 1.033 2.722 119 HA THR 16 HA THR 16 9.388 1.686 2.522 120 HB THR 16 HB THR 16 8.715 3.702 3.738 121 HG1 THR 16 1HG THR 16 9.874 2.157 5.755 122 HG21 THR 16 3HG2 THR 16 6.676 2.770 4.914 123 HG22 THR 16 1HG2 THR 16 7.752 3.750 5.913 124 HG23 THR 16 2HG2 THR 16 7.773 1.978 6.059 125 H SER 17 H SER 17 10.324 0.547 4.795 126 HA SER 17 HA SER 17 8.425 -1.370 5.853 127 HB2 SER 17 1HB SER 17 9.947 -3.281 5.635 128 HB3 SER 17 2HB SER 17 9.441 -2.677 4.054 129 HG SER 17 HG SER 17 11.868 -2.955 5.101 130 H ASP 18 H ASP 18 9.446 -2.530 7.643 131 HA ASP 18 HA ASP 18 10.220 -0.893 9.730 132 HB2 ASP 18 1HB ASP 18 9.189 -3.244 9.519 133 HB3 ASP 18 2HB ASP 18 10.828 -3.873 9.409 134 H GLY 19 H GLY 19 12.311 -3.004 7.707 135 HA2 GLY 19 1HA GLY 19 14.735 -2.012 8.995 136 HA3 GLY 19 2HA GLY 19 14.607 -3.160 7.673 137 H ASN 20 H ASN 20 12.864 -0.115 7.176 138 HA ASN 20 HA ASN 20 15.091 0.835 5.432 139 HB2 ASN 20 1HB ASN 20 12.708 -0.095 4.403 140 HB3 ASN 20 2HB ASN 20 12.380 1.650 4.562 141 HD21 ASN 20 1HD2 ASN 20 13.898 -0.699 2.548 142 HD22 ASN 20 2HD2 ASN 20 14.788 0.413 1.594 143 H ASP 21 H ASP 21 14.215 1.633 8.303 144 HA ASP 21 HA ASP 21 14.240 3.556 9.477 145 HB2 ASP 21 1HB ASP 21 15.093 5.093 7.019 146 HB3 ASP 21 2HB ASP 21 15.465 5.427 8.690 147 H PHE 22 H PHE 22 11.814 2.837 7.866 148 HA PHE 22 HA PHE 22 9.813 3.601 7.173 149 HB2 PHE 22 1HB PHE 22 10.304 5.668 9.307 150 HB3 PHE 22 2HB PHE 22 8.801 5.520 8.424 151 HD1 PHE 22 2HD PHE 22 11.131 3.326 10.434 152 HD2 PHE 22 1HD PHE 22 7.074 4.232 9.297 153 HE1 PHE 22 2HE PHE 22 10.303 1.780 12.171 154 HE2 PHE 22 1HE PHE 22 6.256 2.772 11.119 155 HZ PHE 22 HZ PHE 22 7.859 1.511 12.539 156 H ALA 23 H ALA 23 12.029 4.355 5.499 157 HA ALA 23 HA ALA 23 11.671 7.007 4.489 158 HB1 ALA 23 1HB ALA 23 12.925 4.533 3.273 159 HB2 ALA 23 2HB ALA 23 12.980 6.160 2.568 160 HB3 ALA 23 3HB ALA 23 13.747 5.858 4.138 161 H TRP 24 H TRP 24 9.418 7.332 4.143 162 HA TRP 24 HA TRP 24 7.705 5.460 2.933 163 HB2 TRP 24 1HB TRP 24 7.566 8.416 3.586 164 HB3 TRP 24 2HB TRP 24 6.281 7.693 2.631 165 HD1 TRP 24 HD TRP 24 7.075 8.265 6.122 166 HE1 TRP 24 1HE TRP 24 5.657 6.827 7.657 167 HE3 TRP 24 3HE TRP 24 5.383 4.956 2.651 168 HZ2 TRP 24 2HZ TRP 24 4.108 4.329 7.419 169 HZ3 TRP 24 3HZ TRP 24 4.006 3.005 3.313 170 HH2 TRP 24 HH TRP 24 3.364 2.686 5.697 171 H ASP 25 H ASP 25 9.908 7.264 1.406 172 HA ASP 25 HA ASP 25 10.288 7.974 -0.840 173 HB2 ASP 25 1HB ASP 25 10.079 5.043 -0.342 174 HB3 ASP 25 2HB ASP 25 10.217 5.627 -2.018 175 H ASN 26 H ASN 26 8.583 9.340 -1.433 176 HA ASN 26 HA ASN 26 5.994 8.605 -2.157 177 HB2 ASN 26 1HB ASN 26 7.707 10.891 -3.228 178 HB3 ASN 26 2HB ASN 26 5.975 10.735 -3.471 179 HD21 ASN 26 1HD2 ASN 26 4.529 11.136 -1.701 180 HD22 ASN 26 2HD2 ASN 26 5.121 12.091 -0.341 181 H LEU 27 H LEU 27 5.585 6.974 -3.560 182 HA LEU 27 HA LEU 27 7.296 6.204 -5.656 183 HB2 LEU 27 1HB LEU 27 4.325 5.630 -5.368 184 HB3 LEU 27 2HB LEU 27 5.448 4.732 -6.385 185 HG LEU 27 HG LEU 27 5.512 4.856 -3.333 186 HD11 LEU 27 1HD1 LEU 27 4.745 2.611 -5.243 187 HD12 LEU 27 2HD1 LEU 27 3.626 3.569 -4.239 188 HD13 LEU 27 3HD1 LEU 27 4.809 2.506 -3.467 189 HD21 LEU 27 3HD2 LEU 27 7.233 3.181 -5.214 190 HD22 LEU 27 1HD2 LEU 27 7.200 3.099 -3.457 191 HD23 LEU 27 2HD2 LEU 27 7.797 4.557 -4.212 192 H THR 28 H THR 28 7.327 6.536 -7.832 193 HA THR 28 HA THR 28 6.311 8.908 -8.955 194 HB THR 28 HB THR 28 7.084 7.178 -11.007 195 HG1 THR 28 1HG THR 28 8.551 5.904 -10.444 196 HG21 THR 28 3HG2 THR 28 9.236 8.403 -10.927 197 HG22 THR 28 1HG2 THR 28 9.000 8.759 -9.213 198 HG23 THR 28 2HG2 THR 28 7.984 9.538 -10.437 199 H SER 29 H SER 29 5.016 9.021 -10.964 200 HA SER 29 HA SER 29 2.401 8.345 -10.525 201 HB2 SER 29 1HB SER 29 3.522 8.833 -13.289 202 HB3 SER 29 2HB SER 29 1.884 9.151 -12.711 203 HG SER 29 HG SER 29 2.542 11.031 -12.032 204 H SER 30 H SER 30 4.554 6.679 -12.888 205 HA SER 30 HA SER 30 2.930 4.215 -12.519 206 HB2 SER 30 1HB SER 30 4.393 5.129 -15.013 207 HB3 SER 30 2HB SER 30 3.621 3.550 -14.784 208 HG SER 30 HG SER 30 2.325 5.087 -15.935 209 H GLN 31 H GLN 31 4.655 4.661 -10.596 210 HA GLN 31 HA GLN 31 7.272 3.460 -10.986 211 HB2 GLN 31 1HB GLN 31 6.360 4.613 -8.845 212 HB3 GLN 31 2HB GLN 31 5.406 3.136 -8.641 213 HG2 GLN 31 1HG GLN 31 7.124 2.674 -7.300 214 HG3 GLN 31 2HG GLN 31 7.627 1.925 -8.785 215 HE21 GLN 31 1HE2 GLN 31 8.585 4.107 -6.312 216 HE22 GLN 31 2HE2 GLN 31 9.997 4.701 -7.148 217 H THR 32 H THR 32 7.718 1.215 -11.226 218 HA THR 32 HA THR 32 5.509 -0.693 -10.647 219 HB THR 32 HB THR 32 6.355 -2.049 -12.519 220 HG1 THR 32 1HG THR 32 7.673 -1.215 -13.972 221 HG21 THR 32 3HG2 THR 32 4.351 -0.660 -12.788 222 HG22 THR 32 1HG2 THR 32 5.287 -0.722 -14.297 223 HG23 THR 32 2HG2 THR 32 5.345 0.726 -13.304 224 H LYS 33 H LYS 33 8.481 0.374 -9.671 225 HA LYS 33 HA LYS 33 9.029 -2.213 -8.382 226 HB2 LYS 33 1HB LYS 33 11.089 -0.701 -10.013 227 HB3 LYS 33 2HB LYS 33 11.546 -1.768 -8.693 228 HG2 LYS 33 1HG LYS 33 11.480 -3.530 -10.035 229 HG3 LYS 33 2HG LYS 33 9.745 -3.322 -10.186 230 HD2 LYS 33 1HD LYS 33 10.706 -3.413 -12.409 231 HD3 LYS 33 2HD LYS 33 10.172 -1.742 -12.119 232 HE2 LYS 33 1HE LYS 33 12.559 -1.204 -11.398 233 HE3 LYS 33 2HE LYS 33 13.016 -2.846 -11.874 234 HZ1 LYS 33 3HZ LYS 33 11.921 -0.755 -13.650 235 HZ2 LYS 33 1HZ LYS 33 12.346 -2.290 -14.131 236 HZ3 LYS 33 2HZ LYS 33 13.497 -1.272 -13.584 237 H ALA 34 H ALA 34 10.223 -2.014 -6.478 238 HA ALA 34 HA ALA 34 9.458 0.237 -4.986 239 HB1 ALA 34 1HB ALA 34 9.798 -1.862 -3.871 240 HB2 ALA 34 2HB ALA 34 11.488 -2.002 -4.459 241 HB3 ALA 34 3HB ALA 34 11.066 -0.827 -3.218 242 HA PRO 35 HA PRO 35 12.573 3.232 -5.413 243 HB2 PRO 35 1HB PRO 35 12.774 4.256 -2.858 244 HB3 PRO 35 2HB PRO 35 11.408 4.571 -3.969 245 HG2 PRO 35 1HG PRO 35 11.573 2.504 -1.742 246 HG3 PRO 35 2HG PRO 35 10.194 3.574 -2.162 247 HD2 PRO 35 1HD PRO 35 10.168 1.089 -2.933 248 HD3 PRO 35 2HD PRO 35 9.576 2.391 -3.995 249 H ASN 36 H ASN 36 13.052 0.834 -2.768 250 HA ASN 36 HA ASN 36 15.869 0.510 -3.277 251 HB2 ASN 36 1HB ASN 36 14.769 1.842 -0.759 252 HB3 ASN 36 2HB ASN 36 16.214 0.855 -0.686 253 HD21 ASN 36 1HD2 ASN 36 15.606 4.017 -0.538 254 HD22 ASN 36 2HD2 ASN 36 16.983 4.525 -1.499 255 H VAL 37 H VAL 37 16.617 -1.278 -1.788 256 HA VAL 37 HA VAL 37 14.872 -3.473 -1.698 257 HB VAL 37 HB VAL 37 17.469 -3.099 -0.144 258 HG11 VAL 37 1HG1 VAL 37 16.179 -5.619 -1.308 259 HG12 VAL 37 2HG1 VAL 37 17.671 -5.511 -0.363 260 HG13 VAL 37 3HG1 VAL 37 16.111 -5.125 0.397 261 HG21 VAL 37 3HG2 VAL 37 17.094 -3.997 -3.039 262 HG22 VAL 37 1HG2 VAL 37 17.956 -2.559 -2.483 263 HG23 VAL 37 2HG2 VAL 37 18.586 -4.154 -2.095 264 H LEU 38 H LEU 38 13.114 -3.480 -0.482 265 HA LEU 38 HA LEU 38 12.881 -2.168 2.102 266 HB2 LEU 38 1HB LEU 38 10.988 -4.102 0.747 267 HB3 LEU 38 2HB LEU 38 10.637 -3.094 2.146 268 HG LEU 38 HG LEU 38 11.171 -2.130 -0.691 269 HD11 LEU 38 1HD1 LEU 38 8.721 -1.921 1.094 270 HD12 LEU 38 2HD1 LEU 38 8.934 -3.081 -0.245 271 HD13 LEU 38 3HD1 LEU 38 8.877 -1.338 -0.578 272 HD21 LEU 38 3HD2 LEU 38 10.789 -0.510 1.870 273 HD22 LEU 38 1HD2 LEU 38 10.597 0.160 0.231 274 HD23 LEU 38 2HD2 LEU 38 12.159 -0.450 0.731 275 H LYS 39 H LYS 39 13.876 -2.962 3.821 276 HA LYS 39 HA LYS 39 14.251 -5.893 4.116 277 HB2 LYS 39 1HB LYS 39 15.470 -3.527 5.556 278 HB3 LYS 39 2HB LYS 39 15.854 -5.190 5.968 279 HG2 LYS 39 1HG LYS 39 17.128 -5.549 4.121 280 HG3 LYS 39 2HG LYS 39 16.273 -4.414 3.082 281 HD2 LYS 39 1HD LYS 39 17.989 -3.545 5.443 282 HD3 LYS 39 2HD LYS 39 18.638 -3.763 3.804 283 HE2 LYS 39 1HE LYS 39 17.184 -2.122 2.876 284 HE3 LYS 39 2HE LYS 39 16.258 -1.989 4.379 285 HZ1 LYS 39 3HZ LYS 39 18.340 -1.169 5.444 286 HZ2 LYS 39 1HZ LYS 39 17.752 -0.149 4.311 287 HZ3 LYS 39 2HZ LYS 39 19.033 -1.109 3.953 288 H GLY 40 H GLY 40 14.018 -6.918 6.294 289 HA2 GLY 40 1HA GLY 40 13.408 -6.886 8.515 290 HA3 GLY 40 2HA GLY 40 12.538 -5.380 8.322 291 H ASN 41 H ASN 41 11.387 -7.192 5.902 292 HA ASN 41 HA ASN 41 9.819 -8.718 5.369 293 HB2 ASN 41 1HB ASN 41 10.900 -10.107 7.216 294 HB3 ASN 41 2HB ASN 41 9.497 -9.657 8.193 295 HD21 ASN 41 1HD2 ASN 41 7.267 -9.973 6.599 296 HD22 ASN 41 2HD2 ASN 41 7.269 -11.661 5.994 297 H LYS 42 H LYS 42 9.274 -6.507 7.933 298 HA LYS 42 HA LYS 42 6.301 -6.646 7.595 299 HB2 LYS 42 1HB LYS 42 7.851 -4.843 9.475 300 HB3 LYS 42 2HB LYS 42 6.107 -5.029 9.384 301 HG2 LYS 42 1HG LYS 42 8.151 -7.082 10.318 302 HG3 LYS 42 2HG LYS 42 6.934 -6.238 11.286 303 HD2 LYS 42 1HD LYS 42 5.146 -7.410 9.915 304 HD3 LYS 42 2HD LYS 42 6.438 -8.366 9.149 305 HE2 LYS 42 1HE LYS 42 7.175 -9.080 11.465 306 HE3 LYS 42 2HE LYS 42 5.758 -8.246 12.118 307 HZ1 LYS 42 3HZ LYS 42 5.765 -10.605 10.328 308 HZ2 LYS 42 1HZ LYS 42 4.403 -9.743 10.690 309 HZ3 LYS 42 2HZ LYS 42 5.193 -10.495 11.876 310 H LEU 43 H LEU 43 5.845 -5.933 5.709 311 HA LEU 43 HA LEU 43 7.247 -3.701 4.417 312 HB2 LEU 43 1HB LEU 43 6.388 -6.115 3.523 313 HB3 LEU 43 2HB LEU 43 4.919 -5.213 3.214 314 HG LEU 43 HG LEU 43 7.705 -4.490 2.194 315 HD11 LEU 43 1HD1 LEU 43 5.337 -5.665 0.715 316 HD12 LEU 43 2HD1 LEU 43 6.688 -6.622 1.272 317 HD13 LEU 43 3HD1 LEU 43 6.974 -5.362 0.067 318 HD21 LEU 43 3HD2 LEU 43 6.313 -2.477 2.317 319 HD22 LEU 43 1HD2 LEU 43 4.977 -3.316 1.483 320 HD23 LEU 43 2HD2 LEU 43 6.522 -2.988 0.654 321 H TYR 44 H TYR 44 6.361 -1.611 4.546 322 HA TYR 44 HA TYR 44 3.626 -1.396 5.670 323 HB2 TYR 44 1HB TYR 44 5.980 0.491 5.889 324 HB3 TYR 44 2HB TYR 44 4.397 0.751 6.576 325 HD1 TYR 44 2HD TYR 44 3.657 -1.828 7.811 326 HD2 TYR 44 1HD TYR 44 7.445 0.212 7.678 327 HE1 TYR 44 2HE TYR 44 4.311 -2.970 9.893 328 HE2 TYR 44 1HE TYR 44 8.096 -0.872 9.802 329 HH TYR 44 HH TYR 44 7.576 -2.575 11.403 330 H VAL 45 H VAL 45 2.222 -0.960 4.142 331 HA VAL 45 HA VAL 45 2.971 0.817 1.850 332 HB VAL 45 HB VAL 45 0.687 -1.125 2.364 333 HG11 VAL 45 1HG1 VAL 45 -0.469 0.531 1.253 334 HG12 VAL 45 2HG1 VAL 45 0.907 0.982 0.219 335 HG13 VAL 45 3HG1 VAL 45 0.033 -0.537 -0.066 336 HG21 VAL 45 3HG2 VAL 45 2.868 -2.066 1.564 337 HG22 VAL 45 1HG2 VAL 45 1.497 -2.311 0.470 338 HG23 VAL 45 2HG2 VAL 45 2.723 -1.067 0.106 339 H LYS 46 H LYS 46 1.735 2.700 1.448 340 HA LYS 46 HA LYS 46 -0.247 3.561 3.503 341 HB2 LYS 46 1HB LYS 46 1.880 4.628 3.904 342 HB3 LYS 46 2HB LYS 46 2.048 5.065 2.203 343 HG2 LYS 46 1HG LYS 46 -0.436 6.118 3.362 344 HG3 LYS 46 2HG LYS 46 0.936 6.573 4.341 345 HD2 LYS 46 1HD LYS 46 0.866 7.034 1.333 346 HD3 LYS 46 2HD LYS 46 0.327 8.186 2.549 347 HE2 LYS 46 1HE LYS 46 2.632 7.867 3.658 348 HE3 LYS 46 2HE LYS 46 3.125 7.023 2.182 349 HZ1 LYS 46 3HZ LYS 46 2.101 9.785 2.347 350 HZ2 LYS 46 1HZ LYS 46 2.559 9.022 0.958 351 HZ3 LYS 46 2HZ LYS 46 3.690 9.367 2.108 352 H ALA 47 H ALA 47 -1.471 2.270 1.756 353 HA ALA 47 HA ALA 47 -1.550 3.330 -0.924 354 HB1 ALA 47 1HB ALA 47 -1.884 0.987 -0.577 355 HB2 ALA 47 2HB ALA 47 -3.301 1.285 0.454 356 HB3 ALA 47 3HB ALA 47 -3.318 1.670 -1.292 357 H ARG 48 H ARG 48 -2.817 4.867 -1.820 358 HA ARG 48 HA ARG 48 -4.634 6.383 -0.049 359 HB2 ARG 48 1HB ARG 48 -3.136 7.674 -1.344 360 HB3 ARG 48 2HB ARG 48 -3.606 6.864 -2.854 361 HG2 ARG 48 1HG ARG 48 -5.475 8.121 -3.147 362 HG3 ARG 48 2HG ARG 48 -5.894 8.119 -1.426 363 HD2 ARG 48 1HD ARG 48 -5.384 10.393 -2.077 364 HD3 ARG 48 2HD ARG 48 -4.174 9.745 -0.947 365 HE ARG 48 HE ARG 48 -2.569 10.014 -2.530 366 HH11 ARG 48 1HH1 ARG 48 -5.668 10.583 -4.169 367 HH12 ARG 48 2HH1 ARG 48 -4.937 11.290 -5.565 368 HH21 ARG 48 1HH2 ARG 48 -1.605 10.696 -4.528 369 HH22 ARG 48 2HH2 ARG 48 -2.624 11.174 -5.845 370 H PHE 49 H PHE 49 -6.647 5.694 0.106 371 HA PHE 49 HA PHE 49 -8.063 4.350 -2.170 372 HB2 PHE 49 1HB PHE 49 -8.529 4.330 0.839 373 HB3 PHE 49 2HB PHE 49 -9.689 3.736 -0.302 374 HD1 PHE 49 2HD PHE 49 -9.118 1.478 -1.599 375 HD2 PHE 49 1HD PHE 49 -6.473 3.141 1.383 376 HE1 PHE 49 2HE PHE 49 -7.996 -0.680 -1.326 377 HE2 PHE 49 1HE PHE 49 -5.212 1.130 1.452 378 HZ PHE 49 HZ PHE 49 -6.004 -0.895 0.161 379 H MET 50 H MET 50 -8.897 6.102 -3.312 380 HA MET 50 HA MET 50 -10.029 8.399 -1.785 381 HB2 MET 50 1HB MET 50 -10.099 8.008 -4.788 382 HB3 MET 50 2HB MET 50 -10.373 9.484 -3.875 383 HG2 MET 50 1HG MET 50 -7.697 8.220 -3.586 384 HG3 MET 50 2HG MET 50 -8.075 8.868 -5.178 385 HE1 MET 50 3HE MET 50 -9.406 10.583 -1.821 386 HE2 MET 50 1HE MET 50 -7.989 9.585 -1.395 387 HE3 MET 50 2HE MET 50 -7.894 11.363 -1.291 388 H GLY 51 H GLY 51 -12.044 8.127 -1.123 389 HA2 GLY 51 1HA GLY 51 -14.338 7.662 -1.299 390 HA3 GLY 51 2HA GLY 51 -14.052 6.613 -2.675 391 H TYR 52 H TYR 52 -15.758 5.907 -0.455 392 HA TYR 52 HA TYR 52 -14.409 4.381 1.538 393 HB2 TYR 52 1HB TYR 52 -17.218 4.892 0.704 394 HB3 TYR 52 2HB TYR 52 -16.970 3.332 1.430 395 HD1 TYR 52 2HD TYR 52 -15.874 3.128 3.752 396 HD2 TYR 52 1HD TYR 52 -17.323 6.832 2.091 397 HE1 TYR 52 2HE TYR 52 -16.002 4.092 6.027 398 HE2 TYR 52 1HE TYR 52 -17.436 7.823 4.347 399 HH TYR 52 HH TYR 52 -16.243 6.209 7.281 400 H THR 53 H THR 53 -13.598 2.392 1.540 401 HA THR 53 HA THR 53 -15.154 0.263 0.357 402 HB THR 53 HB THR 53 -13.574 0.455 -1.441 403 HG1 THR 53 1HG THR 53 -12.217 -1.467 0.017 404 HG21 THR 53 3HG2 THR 53 -11.815 1.836 -0.597 405 HG22 THR 53 1HG2 THR 53 -11.058 0.266 -0.954 406 HG23 THR 53 2HG2 THR 53 -11.433 0.726 0.713 407 H LYS 54 H LYS 54 -14.839 -1.646 1.503 408 HA LYS 54 HA LYS 54 -12.911 -1.759 3.652 409 HB2 LYS 54 1HB LYS 54 -15.900 -1.737 4.131 410 HB3 LYS 54 2HB LYS 54 -14.917 -2.815 5.105 411 HG2 LYS 54 1HG LYS 54 -13.648 -0.205 5.087 412 HG3 LYS 54 2HG LYS 54 -15.345 -0.025 5.500 413 HD2 LYS 54 1HD LYS 54 -13.442 -2.007 6.804 414 HD3 LYS 54 2HD LYS 54 -13.767 -0.381 7.443 415 HE2 LYS 54 1HE LYS 54 -16.097 -0.865 7.789 416 HE3 LYS 54 2HE LYS 54 -15.976 -2.393 6.916 417 HZ1 LYS 54 3HZ LYS 54 -14.973 -1.785 9.600 418 HZ2 LYS 54 1HZ LYS 54 -14.321 -3.045 8.731 419 HZ3 LYS 54 2HZ LYS 54 -15.908 -3.034 9.105 420 H LEU 55 H LEU 55 -12.999 -2.884 1.061 421 HA LEU 55 HA LEU 55 -13.148 -5.766 1.667 422 HB2 LEU 55 1HB LEU 55 -14.074 -4.449 -0.917 423 HB3 LEU 55 2HB LEU 55 -13.785 -6.160 -0.663 424 HG LEU 55 HG LEU 55 -15.617 -5.993 1.210 425 HD11 LEU 55 1HD1 LEU 55 -17.411 -4.312 0.522 426 HD12 LEU 55 2HD1 LEU 55 -16.173 -3.483 -0.442 427 HD13 LEU 55 3HD1 LEU 55 -16.017 -3.607 1.323 428 HD21 LEU 55 3HD2 LEU 55 -15.852 -7.309 -0.791 429 HD22 LEU 55 1HD2 LEU 55 -16.147 -5.866 -1.782 430 HD23 LEU 55 2HD2 LEU 55 -17.348 -6.380 -0.588 431 H THR 56 H THR 56 -10.868 -5.242 2.203 432 HA THR 56 HA THR 56 -9.182 -4.481 -0.122 433 HB THR 56 HB THR 56 -8.225 -4.980 2.714 434 HG1 THR 56 1HG THR 56 -9.228 -3.320 3.395 435 HG21 THR 56 3HG2 THR 56 -6.561 -4.666 0.879 436 HG22 THR 56 1HG2 THR 56 -6.489 -3.356 2.058 437 HG23 THR 56 2HG2 THR 56 -7.300 -3.092 0.499 438 H VAL 57 H VAL 57 -8.050 -6.098 -1.227 439 HA VAL 57 HA VAL 57 -7.581 -8.664 0.149 440 HB VAL 57 HB VAL 57 -8.281 -8.156 -2.754 441 HG11 VAL 57 1HG1 VAL 57 -8.242 -10.590 -3.036 442 HG12 VAL 57 2HG1 VAL 57 -6.645 -9.999 -2.602 443 HG13 VAL 57 3HG1 VAL 57 -7.658 -10.801 -1.375 444 HG21 VAL 57 3HG2 VAL 57 -10.278 -9.542 -2.262 445 HG22 VAL 57 1HG2 VAL 57 -9.815 -9.608 -0.553 446 HG23 VAL 57 2HG2 VAL 57 -10.268 -8.063 -1.307 447 H ILE 58 H ILE 58 -5.565 -8.949 0.618 448 HA ILE 58 HA ILE 58 -3.409 -8.232 -1.321 449 HB ILE 58 HB ILE 58 -3.213 -8.761 1.673 450 HG12 ILE 58 1HG1 ILE 58 -2.491 -6.068 0.574 451 HG13 ILE 58 2HG1 ILE 58 -4.197 -6.382 0.737 452 HG21 ILE 58 1HG2 ILE 58 -1.187 -9.388 0.401 453 HG22 ILE 58 2HG2 ILE 58 -1.157 -7.799 -0.387 454 HG23 ILE 58 3HG2 ILE 58 -0.888 -7.935 1.356 455 HD11 ILE 58 3HD1 ILE 58 -2.139 -6.561 2.968 456 HD12 ILE 58 1HD1 ILE 58 -3.385 -5.317 2.747 457 HD13 ILE 58 2HD1 ILE 58 -3.861 -6.970 3.163 458 H THR 59 H THR 59 -4.117 -10.133 -2.550 459 HA THR 59 HA THR 59 -5.114 -12.398 -1.664 460 HB THR 59 HB THR 59 -3.457 -12.867 -4.029 461 HG1 THR 59 1HG THR 59 -4.062 -11.243 -5.250 462 HG21 THR 59 3HG2 THR 59 -5.584 -13.177 -5.136 463 HG22 THR 59 1HG2 THR 59 -6.458 -12.370 -3.807 464 HG23 THR 59 2HG2 THR 59 -5.675 -13.933 -3.539 465 H GLY 60 H GLY 60 -1.622 -11.903 -2.077 466 HA2 GLY 60 1HA GLY 60 0.193 -13.054 -1.205 467 HA3 GLY 60 2HA GLY 60 -0.904 -14.156 -0.365 468 H LYS 61 H LYS 61 1.057 -15.423 -1.309 469 HA LYS 61 HA LYS 61 0.847 -16.364 -4.047 470 HB2 LYS 61 1HB LYS 61 2.468 -18.010 -3.387 471 HB3 LYS 61 2HB LYS 61 2.936 -16.413 -2.796 472 HG2 LYS 61 1HG LYS 61 2.305 -17.031 -0.494 473 HG3 LYS 61 2HG LYS 61 1.762 -18.610 -1.079 474 HD2 LYS 61 1HD LYS 61 3.926 -18.909 -0.170 475 HD3 LYS 61 2HD LYS 61 4.046 -19.085 -1.919 476 HE2 LYS 61 1HE LYS 61 4.796 -16.525 -1.800 477 HE3 LYS 61 2HE LYS 61 5.111 -16.921 -0.100 478 HZ1 LYS 61 3HZ LYS 61 7.088 -17.479 -0.986 479 HZ2 LYS 61 1HZ LYS 61 6.523 -17.805 -2.474 480 HZ3 LYS 61 2HZ LYS 61 6.383 -18.918 -1.270 481 H ASP 62 H ASP 62 -0.480 -17.346 -0.936 482 HA ASP 62 HA ASP 62 -1.632 -19.801 -1.829 483 HB2 ASP 62 1HB ASP 62 -2.332 -17.959 0.478 484 HB3 ASP 62 2HB ASP 62 -2.933 -19.608 0.277 485 H GLY 63 H GLY 63 -2.542 -16.565 -2.658 486 HA2 GLY 63 1HA GLY 63 -4.408 -15.737 -3.685 487 HA3 GLY 63 2HA GLY 63 -4.928 -17.398 -3.958 488 H LYS 64 H LYS 64 -4.406 -16.513 -0.628 489 HA LYS 64 HA LYS 64 -7.330 -16.903 -0.222 490 HB2 LYS 64 1HB LYS 64 -6.980 -18.067 1.748 491 HB3 LYS 64 2HB LYS 64 -5.984 -18.761 0.479 492 HG2 LYS 64 1HG LYS 64 -4.242 -18.601 1.827 493 HG3 LYS 64 2HG LYS 64 -4.318 -16.849 1.665 494 HD2 LYS 64 1HD LYS 64 -4.218 -17.267 3.946 495 HD3 LYS 64 2HD LYS 64 -5.915 -16.865 3.696 496 HE2 LYS 64 1HE LYS 64 -5.398 -19.746 3.399 497 HE3 LYS 64 2HE LYS 64 -4.727 -19.161 4.920 498 HZ1 LYS 64 3HZ LYS 64 -6.985 -19.949 5.138 499 HZ2 LYS 64 1HZ LYS 64 -7.571 -18.808 4.136 500 HZ3 LYS 64 2HZ LYS 64 -6.886 -18.378 5.573 501 H ASN 65 H ASN 65 -5.394 -14.383 -0.257 502 HA ASN 65 HA ASN 65 -5.465 -12.281 0.531 503 HB2 ASN 65 1HB ASN 65 -7.964 -12.428 0.396 504 HB3 ASN 65 2HB ASN 65 -7.976 -12.888 2.114 505 HD21 ASN 65 1HD2 ASN 65 -9.379 -10.646 1.727 506 HD22 ASN 65 2HD2 ASN 65 -8.479 -9.214 2.105 507 H LEU 66 H LEU 66 -3.663 -12.188 1.648 508 HA LEU 66 HA LEU 66 -2.972 -13.505 4.054 509 HB2 LEU 66 1HB LEU 66 -1.961 -10.861 2.924 510 HB3 LEU 66 2HB LEU 66 -1.159 -11.827 4.166 511 HG LEU 66 HG LEU 66 -1.667 -12.710 1.287 512 HD11 LEU 66 1HD1 LEU 66 0.792 -12.527 1.106 513 HD12 LEU 66 2HD1 LEU 66 0.841 -11.881 2.756 514 HD13 LEU 66 3HD1 LEU 66 0.042 -10.964 1.474 515 HD21 LEU 66 3HD2 LEU 66 -1.711 -14.664 2.716 516 HD22 LEU 66 1HD2 LEU 66 -0.275 -14.118 3.603 517 HD23 LEU 66 2HD2 LEU 66 -0.148 -14.624 1.903 518 H LEU 67 H LEU 67 -4.862 -10.592 3.517 519 HA LEU 67 HA LEU 67 -4.621 -9.494 6.146 520 HB2 LEU 67 1HB LEU 67 -5.364 -8.437 3.932 521 HB3 LEU 67 2HB LEU 67 -6.901 -9.265 4.181 522 HG LEU 67 HG LEU 67 -6.877 -8.068 6.491 523 HD11 LEU 67 1HD1 LEU 67 -4.540 -7.222 6.287 524 HD12 LEU 67 2HD1 LEU 67 -5.729 -5.959 6.622 525 HD13 LEU 67 3HD1 LEU 67 -5.063 -6.156 4.987 526 HD21 LEU 67 3HD2 LEU 67 -8.350 -7.617 4.418 527 HD22 LEU 67 1HD2 LEU 67 -7.290 -6.218 4.163 528 HD23 LEU 67 2HD2 LEU 67 -8.219 -6.346 5.653 529 H TYR 68 H TYR 68 -6.664 -11.977 4.651 530 HA TYR 68 HA TYR 68 -8.274 -12.369 7.100 531 HB2 TYR 68 1HB TYR 68 -9.398 -12.468 4.909 532 HB3 TYR 68 2HB TYR 68 -8.337 -13.774 4.392 533 HD1 TYR 68 1HD TYR 68 -10.974 -12.803 6.862 534 HD2 TYR 68 2HD TYR 68 -8.754 -16.059 5.119 535 HE1 TYR 68 1HE TYR 68 -12.358 -14.448 8.127 536 HE2 TYR 68 2HE TYR 68 -10.116 -17.679 6.392 537 HH TYR 68 HH TYR 68 -11.443 -17.511 8.729 538 H ASN 69 H ASN 69 -5.396 -13.636 5.480 539 HA ASN 69 HA ASN 69 -5.226 -16.076 6.986 540 HB2 ASN 69 1HB ASN 69 -3.754 -15.413 4.982 541 HB3 ASN 69 2HB ASN 69 -2.776 -14.499 6.141 542 HD21 ASN 69 1HD2 ASN 69 -1.059 -15.748 7.134 543 HD22 ASN 69 2HD2 ASN 69 -1.325 -17.459 7.461 544 H GLY 70 H GLY 70 -3.857 -12.835 7.575 545 HA2 GLY 70 1HA GLY 70 -4.214 -11.995 9.919 546 HA3 GLY 70 2HA GLY 70 -3.441 -13.500 10.457 547 H THR 71 H THR 71 -1.589 -13.370 8.045 548 HA THR 71 HA THR 71 0.625 -12.227 9.274 549 HB THR 71 HB THR 71 0.267 -12.712 6.288 550 HG1 THR 71 1HG THR 71 0.775 -14.700 8.213 551 HG21 THR 71 3HG2 THR 71 2.496 -11.963 7.000 552 HG22 THR 71 1HG2 THR 71 2.552 -13.658 6.452 553 HG23 THR 71 2HG2 THR 71 2.585 -13.253 8.193 554 H ALA 72 H ALA 72 -1.812 -10.747 7.307 555 HA ALA 72 HA ALA 72 -0.248 -8.213 7.264 556 HB1 ALA 72 1HB ALA 72 -0.543 -9.161 4.918 557 HB2 ALA 72 2HB ALA 72 -2.297 -9.197 5.172 558 HB3 ALA 72 3HB ALA 72 -1.447 -7.649 5.137 559 H LYS 73 H LYS 73 -1.487 -6.354 7.711 560 HA LYS 73 HA LYS 73 -4.294 -6.504 8.498 561 HB2 LYS 73 1HB LYS 73 -3.298 -7.791 10.278 562 HB3 LYS 73 2HB LYS 73 -2.008 -6.641 10.517 563 HG2 LYS 73 1HG LYS 73 -3.267 -5.206 11.705 564 HG3 LYS 73 2HG LYS 73 -4.779 -5.606 10.857 565 HD2 LYS 73 1HD LYS 73 -4.805 -7.870 11.931 566 HD3 LYS 73 2HD LYS 73 -3.535 -7.314 13.034 567 HE2 LYS 73 1HE LYS 73 -4.982 -5.815 14.112 568 HE3 LYS 73 2HE LYS 73 -5.995 -5.615 12.684 569 HZ1 LYS 73 3HZ LYS 73 -7.144 -6.865 14.363 570 HZ2 LYS 73 1HZ LYS 73 -5.987 -8.035 14.391 571 HZ3 LYS 73 2HZ LYS 73 -6.942 -7.805 13.069 572 H MET 74 H MET 74 -5.063 -4.288 9.427 573 HA MET 74 HA MET 74 -3.322 -2.079 8.656 574 HB2 MET 74 1HB MET 74 -5.376 -0.871 8.648 575 HB3 MET 74 2HB MET 74 -5.699 -2.381 7.801 576 HG2 MET 74 1HG MET 74 -6.485 -3.268 10.132 577 HG3 MET 74 2HG MET 74 -6.387 -1.571 10.601 578 HE1 MET 74 3HE MET 74 -7.360 -0.471 7.670 579 HE2 MET 74 1HE MET 74 -9.002 0.019 8.161 580 HE3 MET 74 2HE MET 74 -7.613 0.280 9.259 581 H PHE 75 H PHE 75 -2.808 -0.552 10.223 582 HA PHE 75 HA PHE 75 -3.407 -1.071 13.091 583 HB2 PHE 75 1HB PHE 75 -1.045 -0.927 13.646 584 HB3 PHE 75 2HB PHE 75 -1.339 -2.261 12.554 585 HD1 PHE 75 2HD PHE 75 -0.556 -2.167 10.177 586 HD2 PHE 75 1HD PHE 75 0.304 1.003 12.982 587 HE1 PHE 75 2HE PHE 75 1.252 -1.307 8.687 588 HE2 PHE 75 1HE PHE 75 2.167 1.768 11.500 589 HZ PHE 75 HZ PHE 75 2.688 0.525 9.435 590 H LYS 76 H LYS 76 -3.561 1.233 10.652 591 HA LYS 76 HA LYS 76 -3.495 3.442 12.560 592 HB2 LYS 76 1HB LYS 76 -1.098 3.268 12.002 593 HB3 LYS 76 2HB LYS 76 -1.463 3.285 10.271 594 HG2 LYS 76 1HG LYS 76 -2.343 5.585 10.455 595 HG3 LYS 76 2HG LYS 76 -2.134 5.521 12.203 596 HD2 LYS 76 1HD LYS 76 0.322 5.351 11.934 597 HD3 LYS 76 2HD LYS 76 0.137 5.335 10.176 598 HE2 LYS 76 1HE LYS 76 0.753 7.570 10.856 599 HE3 LYS 76 2HE LYS 76 -0.917 7.602 10.275 600 HZ1 LYS 76 3HZ LYS 76 -1.623 7.572 12.636 601 HZ2 LYS 76 1HZ LYS 76 -0.660 8.871 12.293 602 HZ3 LYS 76 2HZ LYS 76 -0.060 7.574 13.106 603 H SER 77 H SER 77 -5.157 4.833 11.910 604 HA SER 77 HA SER 77 -5.739 5.059 9.020 605 HB2 SER 77 1HB SER 77 -8.098 4.721 9.375 606 HB3 SER 77 2HB SER 77 -7.144 3.293 9.653 607 HG SER 77 HG SER 77 -8.291 4.900 11.696 608 H ASP 78 H ASP 78 -5.410 7.215 8.706 609 HA ASP 78 HA ASP 78 -6.529 9.315 10.528 610 HB2 ASP 78 1HB ASP 78 -3.886 9.029 9.665 611 HB3 ASP 78 2HB ASP 78 -4.573 10.039 8.426 612 H ALA 79 H ALA 79 -6.528 11.285 8.581 613 HA ALA 79 HA ALA 79 -8.573 10.267 6.600 614 HB1 ALA 79 1HB ALA 79 -9.564 11.559 8.461 615 HB2 ALA 79 2HB ALA 79 -8.538 12.946 8.039 616 HB3 ALA 79 3HB ALA 79 -9.771 12.379 6.897 617 H ILE 80 H ILE 80 -8.780 11.483 4.530 618 HA ILE 80 HA ILE 80 -6.681 13.469 4.004 619 HB ILE 80 HB ILE 80 -7.458 11.116 2.151 620 HG12 ILE 80 1HG1 ILE 80 -4.777 11.846 3.369 621 HG13 ILE 80 2HG1 ILE 80 -5.815 10.525 3.816 622 HG21 ILE 80 1HG2 ILE 80 -5.718 13.510 1.419 623 HG22 ILE 80 2HG2 ILE 80 -5.940 12.075 0.406 624 HG23 ILE 80 3HG2 ILE 80 -7.308 13.092 0.722 625 HD11 ILE 80 3HD1 ILE 80 -5.677 9.810 1.293 626 HD12 ILE 80 1HD1 ILE 80 -4.227 10.843 1.260 627 HD13 ILE 80 2HD1 ILE 80 -4.300 9.467 2.364 628 H LEU 81 H LEU 81 -7.358 15.105 3.343 629 HA LEU 81 HA LEU 81 -10.002 15.307 2.340 630 HB2 LEU 81 1HB LEU 81 -8.095 17.427 3.335 631 HB3 LEU 81 2HB LEU 81 -9.820 17.503 3.241 632 HG LEU 81 HG LEU 81 -9.353 17.168 5.400 633 HD11 LEU 81 1HD1 LEU 81 -9.967 14.299 4.890 634 HD12 LEU 81 2HD1 LEU 81 -11.143 15.607 4.780 635 HD13 LEU 81 3HD1 LEU 81 -10.344 15.247 6.315 636 HD21 LEU 81 3HD2 LEU 81 -7.243 15.213 5.143 637 HD22 LEU 81 1HD2 LEU 81 -7.942 15.881 6.623 638 HD23 LEU 81 2HD2 LEU 81 -7.199 16.977 5.446 639 H GLY 82 H GLY 82 -10.517 16.990 0.920 640 HA2 GLY 82 1HA GLY 82 -8.643 17.274 -1.417 641 HA3 GLY 82 2HA GLY 82 -10.409 17.355 -1.474 642 H GLN 83 H GLN 83 -7.597 18.978 0.051 643 HA GLN 83 HA GLN 83 -7.026 21.066 0.479 644 HB2 GLN 83 1HB GLN 83 -9.089 21.923 -1.569 645 HB3 GLN 83 2HB GLN 83 -7.809 22.920 -0.895 646 HG2 GLN 83 1HG GLN 83 -6.083 21.538 -1.894 647 HG3 GLN 83 2HG GLN 83 -7.274 20.362 -2.460 648 HE21 GLN 83 1HE2 GLN 83 -5.806 23.502 -3.144 649 HE22 GLN 83 2HE2 GLN 83 -6.717 23.818 -4.599 650 H ASN 84 H ASN 84 -10.576 21.394 0.132 651 HA ASN 84 HA ASN 84 -10.689 23.124 2.482 652 HB2 ASN 84 1HB ASN 84 -13.109 23.251 2.005 653 HB3 ASN 84 2HB ASN 84 -12.054 23.831 0.719 654 HD21 ASN 84 1HD2 ASN 84 -11.765 22.408 -1.215 655 HD22 ASN 84 2HD2 ASN 84 -13.002 21.273 -1.634 656 H LYS 85 H LYS 85 -9.714 20.922 3.481 657 HA LYS 85 HA LYS 85 -9.862 19.249 4.996 658 HB2 LYS 85 1HB LYS 85 -12.312 20.590 6.106 659 HB3 LYS 85 2HB LYS 85 -11.059 19.735 6.986 660 HG2 LYS 85 1HG LYS 85 -9.492 21.606 6.643 661 HG3 LYS 85 2HG LYS 85 -10.719 22.471 5.686 662 HD2 LYS 85 1HD LYS 85 -12.281 22.383 7.626 663 HD3 LYS 85 2HD LYS 85 -11.004 21.625 8.603 664 HE2 LYS 85 1HE LYS 85 -9.585 23.586 8.362 665 HE3 LYS 85 2HE LYS 85 -10.708 24.324 7.211 666 HZ1 LYS 85 3HZ LYS 85 -11.353 23.727 10.030 667 HZ2 LYS 85 1HZ LYS 85 -12.321 24.544 8.939 668 HZ3 LYS 85 2HZ LYS 85 -10.897 25.188 9.455 669 H VAL 86 H VAL 86 -11.540 18.861 2.653 670 HA VAL 86 HA VAL 86 -14.040 17.677 3.534 671 HB VAL 86 HB VAL 86 -14.454 19.158 1.932 672 HG11 VAL 86 1HG1 VAL 86 -13.400 19.141 -0.261 673 HG12 VAL 86 2HG1 VAL 86 -12.282 19.436 1.076 674 HG13 VAL 86 3HG1 VAL 86 -12.325 17.844 0.274 675 HG21 VAL 86 3HG2 VAL 86 -15.510 17.885 0.150 676 HG22 VAL 86 1HG2 VAL 86 -14.466 16.489 0.442 677 HG23 VAL 86 2HG2 VAL 86 -15.662 16.960 1.660 678 H VAL 87 H VAL 87 -13.997 15.470 4.084 679 HA VAL 87 HA VAL 87 -11.851 13.800 3.413 680 HB VAL 87 HB VAL 87 -13.164 13.383 5.310 681 HG11 VAL 87 1HG1 VAL 87 -15.563 12.924 3.505 682 HG12 VAL 87 2HG1 VAL 87 -15.489 12.510 5.226 683 HG13 VAL 87 3HG1 VAL 87 -15.345 14.200 4.733 684 HG21 VAL 87 3HG2 VAL 87 -13.552 11.020 5.157 685 HG22 VAL 87 1HG2 VAL 87 -13.630 11.084 3.385 686 HG23 VAL 87 2HG2 VAL 87 -12.102 11.435 4.230 687 H ILE 88 H ILE 88 -11.237 12.936 1.642 688 HA ILE 88 HA ILE 88 -13.146 12.174 -0.527 689 HB ILE 88 HB ILE 88 -11.175 12.572 -2.074 690 HG12 ILE 88 1HG1 ILE 88 -10.040 14.288 0.139 691 HG13 ILE 88 2HG1 ILE 88 -9.447 12.676 -0.219 692 HG21 ILE 88 1HG2 ILE 88 -11.681 14.971 -2.295 693 HG22 ILE 88 2HG2 ILE 88 -13.145 14.081 -1.878 694 HG23 ILE 88 3HG2 ILE 88 -12.296 15.012 -0.625 695 HD11 ILE 88 3HD1 ILE 88 -8.926 13.367 -2.541 696 HD12 ILE 88 1HD1 ILE 88 -9.406 15.033 -2.147 697 HD13 ILE 88 2HD1 ILE 88 -8.023 14.278 -1.328 698 H GLY 89 H GLY 89 -10.510 11.326 1.616 699 HA2 GLY 89 1HA GLY 89 -10.898 8.546 1.081 700 HA3 GLY 89 2HA GLY 89 -9.336 9.138 0.479 701 H TRP 90 H TRP 90 -8.660 7.589 2.209 702 HA TRP 90 HA TRP 90 -8.039 9.226 4.616 703 HB2 TRP 90 1HB TRP 90 -8.835 6.289 4.583 704 HB3 TRP 90 2HB TRP 90 -8.268 7.141 6.004 705 HD1 TRP 90 HD TRP 90 -10.034 8.775 7.199 706 HE1 TRP 90 1HE TRP 90 -12.467 9.428 6.797 707 HE3 TRP 90 3HE TRP 90 -10.836 6.229 2.832 708 HZ2 TRP 90 2HZ TRP 90 -14.550 8.821 4.872 709 HZ3 TRP 90 3HZ TRP 90 -13.024 6.370 1.709 710 HH2 TRP 90 HH TRP 90 -14.867 7.694 2.682 711 H ASP 91 H ASP 91 -6.017 7.777 5.726 712 HA ASP 91 HA ASP 91 -4.481 6.677 3.415 713 HB2 ASP 91 1HB ASP 91 -3.684 8.742 5.248 714 HB3 ASP 91 2HB ASP 91 -2.702 7.295 5.525 715 H LYS 92 H LYS 92 -5.625 4.738 3.716 716 HA LYS 92 HA LYS 92 -5.519 3.434 6.382 717 HB2 LYS 92 1HB LYS 92 -6.578 2.551 3.637 718 HB3 LYS 92 2HB LYS 92 -6.090 1.336 4.797 719 HG2 LYS 92 1HG LYS 92 -8.418 1.534 4.910 720 HG3 LYS 92 2HG LYS 92 -7.742 2.093 6.425 721 HD2 LYS 92 1HD LYS 92 -8.070 4.442 5.715 722 HD3 LYS 92 2HD LYS 92 -8.695 3.860 4.146 723 HE2 LYS 92 1HE LYS 92 -10.638 4.361 5.501 724 HE3 LYS 92 2HE LYS 92 -10.494 2.608 5.399 725 HZ1 LYS 92 3HZ LYS 92 -10.005 4.366 7.684 726 HZ2 LYS 92 1HZ LYS 92 -9.274 2.858 7.638 727 HZ3 LYS 92 2HZ LYS 92 -10.894 3.030 7.640 728 H TYR 93 H TYR 93 -3.555 3.039 7.005 729 HA TYR 93 HA TYR 93 -1.419 2.390 5.085 730 HB2 TYR 93 1HB TYR 93 -1.554 2.299 8.133 731 HB3 TYR 93 2HB TYR 93 -0.120 2.018 7.197 732 HD1 TYR 93 2HD TYR 93 -2.684 4.600 8.033 733 HD2 TYR 93 1HD TYR 93 1.227 3.869 6.359 734 HE1 TYR 93 2HE TYR 93 -2.120 6.992 8.282 735 HE2 TYR 93 1HE TYR 93 1.762 6.266 6.532 736 HH TYR 93 HH TYR 93 -0.669 8.692 7.248 737 H PHE 94 H PHE 94 -0.280 0.153 5.262 738 HA PHE 94 HA PHE 94 -1.877 -1.934 6.617 739 HB2 PHE 94 1HB PHE 94 -1.197 -1.948 3.643 740 HB3 PHE 94 2HB PHE 94 -1.403 -3.436 4.543 741 HD1 PHE 94 1HD PHE 94 -3.533 -4.049 5.628 742 HD2 PHE 94 2HD PHE 94 -3.209 -0.532 3.149 743 HE1 PHE 94 1HE PHE 94 -6.019 -3.840 5.578 744 HE2 PHE 94 2HE PHE 94 -5.676 -0.341 3.119 745 HZ PHE 94 HZ PHE 94 -7.083 -1.979 4.348 746 H GLU 95 H GLU 95 -0.674 -3.717 7.327 747 HA GLU 95 HA GLU 95 2.257 -3.598 7.058 748 HB2 GLU 95 1HB GLU 95 2.478 -4.490 9.147 749 HB3 GLU 95 2HB GLU 95 1.128 -3.358 9.372 750 HG2 GLU 95 1HG GLU 95 -0.288 -5.469 9.164 751 HG3 GLU 95 2HG GLU 95 1.200 -6.271 9.659 752 H ILE 96 H ILE 96 2.745 -5.038 5.409 753 HA ILE 96 HA ILE 96 1.288 -7.597 5.251 754 HB ILE 96 HB ILE 96 2.872 -6.151 3.101 755 HG12 ILE 96 1HG1 ILE 96 0.338 -5.634 2.380 756 HG13 ILE 96 2HG1 ILE 96 0.069 -5.569 4.087 757 HG21 ILE 96 1HG2 ILE 96 0.678 -8.227 2.896 758 HG22 ILE 96 2HG2 ILE 96 1.429 -7.389 1.524 759 HG23 ILE 96 3HG2 ILE 96 2.402 -8.449 2.514 760 HD11 ILE 96 3HD1 ILE 96 1.714 -3.726 4.217 761 HD12 ILE 96 1HD1 ILE 96 2.217 -4.011 2.547 762 HD13 ILE 96 2HD1 ILE 96 0.595 -3.385 2.900 763 HA PRO 97 HA PRO 97 5.393 -9.616 5.647 764 HB2 PRO 97 1HB PRO 97 5.042 -11.759 3.867 765 HB3 PRO 97 2HB PRO 97 4.522 -11.776 5.558 766 HG2 PRO 97 1HG PRO 97 2.953 -11.114 3.083 767 HG3 PRO 97 2HG PRO 97 2.451 -12.143 4.478 768 HD2 PRO 97 1HD PRO 97 1.590 -9.640 4.214 769 HD3 PRO 97 2HD PRO 97 2.025 -10.245 5.815 770 H MET 98 H MET 98 7.110 -10.332 4.098 771 HA MET 98 HA MET 98 6.969 -9.095 1.367 772 HB2 MET 98 1HB MET 98 9.330 -9.695 3.283 773 HB3 MET 98 2HB MET 98 9.553 -9.151 1.637 774 HG2 MET 98 1HG MET 98 8.554 -7.012 2.100 775 HG3 MET 98 2HG MET 98 8.186 -7.508 3.760 776 HE1 MET 98 3HE MET 98 9.649 -4.920 2.966 777 HE2 MET 98 1HE MET 98 9.336 -5.400 4.655 778 HE3 MET 98 2HE MET 98 10.961 -4.870 4.147 779 H ASP 99 H ASP 99 6.752 -12.053 2.873 780 HA ASP 99 HA ASP 99 7.960 -13.351 0.503 781 HB2 ASP 99 1HB ASP 99 9.261 -13.129 2.865 782 HB3 ASP 99 2HB ASP 99 8.361 -14.599 3.200 783 H ALA 100 H ALA 100 5.144 -12.684 1.203 784 HA ALA 100 HA ALA 100 4.193 -15.541 1.184 785 HB1 ALA 100 1HB ALA 100 2.340 -15.129 2.578 786 HB2 ALA 100 2HB ALA 100 3.758 -14.544 3.474 787 HB3 ALA 100 3HB ALA 100 2.666 -13.397 2.638 788 H LEU 101 H LEU 101 4.688 -12.836 -0.528 789 HA LEU 101 HA LEU 101 2.151 -12.597 -1.916 790 HB2 LEU 101 1HB LEU 101 4.940 -11.475 -2.469 791 HB3 LEU 101 2HB LEU 101 3.401 -10.947 -3.161 792 HG LEU 101 HG LEU 101 4.186 -9.460 -1.505 793 HD11 LEU 101 1HD1 LEU 101 1.719 -9.876 -1.507 794 HD12 LEU 101 2HD1 LEU 101 2.321 -9.311 0.074 795 HD13 LEU 101 3HD1 LEU 101 1.956 -11.031 -0.191 796 HD21 LEU 101 3HD2 LEU 101 4.359 -11.147 0.804 797 HD22 LEU 101 1HD2 LEU 101 5.060 -9.568 0.347 798 HD23 LEU 101 2HD2 LEU 101 5.667 -11.025 -0.452 799 H GLN 102 H GLN 102 2.095 -13.060 -4.258 800 HA GLN 102 HA GLN 102 2.859 -15.694 -4.828 801 HB2 GLN 102 1HB GLN 102 1.003 -14.309 -5.788 802 HB3 GLN 102 2HB GLN 102 2.193 -13.478 -6.810 803 HG2 GLN 102 1HG GLN 102 2.812 -15.644 -7.810 804 HG3 GLN 102 2HG GLN 102 1.686 -16.456 -6.690 805 HE21 GLN 102 1HE2 GLN 102 -0.668 -16.107 -7.039 806 HE22 GLN 102 2HE2 GLN 102 -1.233 -15.601 -8.615 807 H ASP 103 H ASP 103 4.833 -12.842 -4.993 808 HA ASP 103 HA ASP 103 7.025 -14.216 -6.163 809 HB2 ASP 103 1HB ASP 103 5.541 -13.595 -8.196 810 HB3 ASP 103 2HB ASP 103 5.934 -11.911 -7.823 811 H ASN 104 H ASN 104 8.635 -11.920 -6.703 812 HA ASN 104 HA ASN 104 9.078 -10.784 -4.112 813 HB2 ASN 104 1HB ASN 104 10.099 -10.377 -6.979 814 HB3 ASN 104 2HB ASN 104 10.644 -9.356 -5.684 815 HD21 ASN 104 1HD2 ASN 104 12.654 -9.934 -5.183 816 HD22 ASN 104 2HD2 ASN 104 13.244 -11.568 -5.127 817 H SER 105 H SER 105 6.357 -10.015 -5.556 818 HA SER 105 HA SER 105 6.781 -7.070 -5.263 819 HB2 SER 105 1HB SER 105 4.575 -7.881 -6.878 820 HB3 SER 105 2HB SER 105 5.590 -6.560 -7.149 821 HG SER 105 HG SER 105 7.119 -8.343 -8.039 822 H ILE 106 H ILE 106 5.138 -5.936 -4.270 823 HA ILE 106 HA ILE 106 3.121 -7.625 -2.969 824 HB ILE 106 HB ILE 106 4.785 -6.743 -1.495 825 HG12 ILE 106 1HG1 ILE 106 2.318 -7.146 -0.906 826 HG13 ILE 106 2HG1 ILE 106 3.368 -6.410 0.268 827 HG21 ILE 106 1HG2 ILE 106 3.786 -3.918 -1.915 828 HG22 ILE 106 2HG2 ILE 106 5.290 -4.427 -1.157 829 HG23 ILE 106 3HG2 ILE 106 5.069 -4.531 -2.918 830 HD11 ILE 106 3HD1 ILE 106 1.116 -5.385 0.183 831 HD12 ILE 106 1HD1 ILE 106 2.425 -4.230 -0.107 832 HD13 ILE 106 2HD1 ILE 106 1.429 -4.819 -1.459 833 H GLN 107 H GLN 107 0.991 -7.202 -3.571 834 HA GLN 107 HA GLN 107 0.306 -4.365 -4.139 835 HB2 GLN 107 1HB GLN 107 -0.819 -4.775 -6.204 836 HB3 GLN 107 2HB GLN 107 0.854 -5.276 -6.334 837 HG2 GLN 107 1HG GLN 107 0.139 -7.653 -5.993 838 HG3 GLN 107 2HG GLN 107 -1.547 -7.106 -6.026 839 HE21 GLN 107 1HE2 GLN 107 -1.764 -5.291 -8.181 840 HE22 GLN 107 2HE2 GLN 107 -1.356 -6.169 -9.579 841 H ILE 108 H ILE 108 -1.870 -3.826 -4.194 842 HA ILE 108 HA ILE 108 -3.587 -5.527 -2.466 843 HB ILE 108 HB ILE 108 -3.551 -2.486 -2.625 844 HG12 ILE 108 1HG1 ILE 108 -2.136 -4.321 -0.644 845 HG13 ILE 108 2HG1 ILE 108 -1.390 -3.145 -1.715 846 HG21 ILE 108 1HG2 ILE 108 -5.694 -3.466 -1.878 847 HG22 ILE 108 2HG2 ILE 108 -4.828 -4.469 -0.685 848 HG23 ILE 108 3HG2 ILE 108 -4.896 -2.708 -0.526 849 HD11 ILE 108 3HD1 ILE 108 -3.092 -2.513 0.711 850 HD12 ILE 108 1HD1 ILE 108 -1.369 -2.250 0.485 851 HD13 ILE 108 2HD1 ILE 108 -2.536 -1.310 -0.487 852 H LYS 109 H LYS 109 -5.893 -5.405 -3.055 853 HA LYS 109 HA LYS 109 -6.605 -3.855 -5.363 854 HB2 LYS 109 1HB LYS 109 -7.712 -5.787 -6.534 855 HB3 LYS 109 2HB LYS 109 -5.972 -5.844 -6.525 856 HG2 LYS 109 1HG LYS 109 -6.761 -7.336 -4.231 857 HG3 LYS 109 2HG LYS 109 -7.879 -7.782 -5.489 858 HD2 LYS 109 1HD LYS 109 -6.000 -9.309 -5.437 859 HD3 LYS 109 2HD LYS 109 -6.054 -8.472 -6.947 860 HE2 LYS 109 1HE LYS 109 -3.772 -8.592 -6.368 861 HE3 LYS 109 2HE LYS 109 -4.167 -6.903 -6.085 862 HZ1 LYS 109 3HZ LYS 109 -2.969 -7.756 -4.187 863 HZ2 LYS 109 1HZ LYS 109 -3.895 -9.117 -4.161 864 HZ3 LYS 109 2HZ LYS 109 -4.546 -7.684 -3.674 865 H ALA 110 H ALA 110 -9.091 -3.441 -5.375 866 HA ALA 110 HA ALA 110 -10.425 -4.565 -2.991 867 HB1 ALA 110 1HB ALA 110 -10.991 -2.314 -2.103 868 HB2 ALA 110 2HB ALA 110 -9.247 -2.629 -2.042 869 HB3 ALA 110 3HB ALA 110 -9.923 -1.578 -3.315 870 H LEU 111 H LEU 111 -12.727 -3.905 -2.890 871 HA LEU 111 HA LEU 111 -14.008 -3.801 -5.533 872 HB2 LEU 111 1HB LEU 111 -15.154 -5.007 -3.757 873 HB3 LEU 111 2HB LEU 111 -15.100 -3.583 -2.708 874 HG LEU 111 HG LEU 111 -16.652 -2.368 -4.169 875 HD11 LEU 111 1HD1 LEU 111 -17.899 -3.597 -5.959 876 HD12 LEU 111 2HD1 LEU 111 -16.705 -4.920 -5.836 877 HD13 LEU 111 3HD1 LEU 111 -16.218 -3.304 -6.377 878 HD21 LEU 111 3HD2 LEU 111 -17.555 -3.740 -2.347 879 HD22 LEU 111 1HD2 LEU 111 -17.694 -5.129 -3.451 880 HD23 LEU 111 2HD2 LEU 111 -18.654 -3.663 -3.730 881 H SER 112 H SER 112 -14.435 -2.055 -6.612 882 HA SER 112 HA SER 112 -14.569 0.601 -5.283 883 HB2 SER 112 1HB SER 112 -13.118 0.819 -7.046 884 HB3 SER 112 2HB SER 112 -13.961 -0.312 -8.059 885 HG SER 112 HG SER 112 -14.676 2.332 -7.434 886 H SER 113 H SER 113 -16.435 -0.815 -8.012 887 HA SER 113 HA SER 113 -18.955 -0.775 -6.509 888 HB2 SER 113 1HB SER 113 -18.034 1.259 -8.578 889 HB3 SER 113 2HB SER 113 -19.746 0.829 -8.465 890 HG SER 113 HG SER 113 -18.998 2.668 -7.282 891 H GLY 114 H GLY 114 -20.593 -1.962 -7.733 892 HA2 GLY 114 1HA GLY 114 -21.494 -3.229 -9.413 893 HA3 GLY 114 2HA GLY 114 -20.313 -2.530 -10.518 894 H THR 115 H THR 115 -19.372 -4.264 -7.714 895 HA THR 115 HA THR 115 -18.100 -6.104 -7.319 896 HB THR 115 HB THR 115 -18.515 -8.173 -8.368 897 HG1 THR 115 1HG THR 115 -19.596 -6.666 -10.466 898 HG21 THR 115 3HG2 THR 115 -20.331 -7.309 -6.911 899 HG22 THR 115 1HG2 THR 115 -20.851 -8.446 -8.182 900 HG23 THR 115 2HG2 THR 115 -21.169 -6.709 -8.365 901 H THR 116 H THR 116 -17.126 -3.950 -9.428 902 HA THR 116 HA THR 116 -15.079 -5.204 -10.948 903 HB THR 116 HB THR 116 -16.202 -2.782 -11.086 904 HG1 THR 116 1HG THR 116 -14.492 -3.400 -12.424 905 HG21 THR 116 3HG2 THR 116 -15.118 -1.019 -9.936 906 HG22 THR 116 1HG2 THR 116 -13.850 -2.081 -9.274 907 HG23 THR 116 2HG2 THR 116 -15.514 -2.214 -8.687 908 H PHE 117 H PHE 117 -12.773 -4.847 -10.308 909 HA PHE 117 HA PHE 117 -12.326 -4.375 -7.457 910 HB2 PHE 117 1HB PHE 117 -12.489 -6.942 -8.542 911 HB3 PHE 117 2HB PHE 117 -10.739 -6.645 -8.384 912 HD1 PHE 117 2HD PHE 117 -14.015 -6.741 -6.624 913 HD2 PHE 117 1HD PHE 117 -9.760 -6.572 -6.145 914 HE1 PHE 117 2HE PHE 117 -14.281 -7.286 -4.205 915 HE2 PHE 117 1HE PHE 117 -10.015 -7.050 -3.706 916 HZ PHE 117 HZ PHE 117 -12.276 -7.427 -2.744 917 H VAL 118 H VAL 118 -10.838 -2.812 -7.389 918 HA VAL 118 HA VAL 118 -9.280 -2.154 -9.809 919 HB VAL 118 HB VAL 118 -10.173 -0.344 -8.533 920 HG11 VAL 118 1HG1 VAL 118 -9.697 0.367 -6.393 921 HG12 VAL 118 2HG1 VAL 118 -10.657 -1.063 -6.508 922 HG13 VAL 118 3HG1 VAL 118 -8.928 -1.214 -6.047 923 HG21 VAL 118 3HG2 VAL 118 -7.225 -0.288 -8.271 924 HG22 VAL 118 1HG2 VAL 118 -8.135 0.029 -9.739 925 HG23 VAL 118 2HG2 VAL 118 -8.343 1.131 -8.374 926 H TYR 119 H TYR 119 -7.453 -3.085 -10.190 927 HA TYR 119 HA TYR 119 -5.867 -4.180 -7.928 928 HB2 TYR 119 1HB TYR 119 -5.257 -4.448 -10.889 929 HB3 TYR 119 2HB TYR 119 -4.556 -5.356 -9.567 930 HD1 TYR 119 1HD TYR 119 -7.667 -4.822 -11.540 931 HD2 TYR 119 2HD TYR 119 -5.736 -7.264 -8.625 932 HE1 TYR 119 1HE TYR 119 -9.518 -6.421 -11.710 933 HE2 TYR 119 2HE TYR 119 -7.638 -8.899 -8.719 934 HH TYR 119 HH TYR 119 -10.543 -8.134 -10.669 935 H SER 120 H SER 120 -4.440 -2.884 -7.058 936 HA SER 120 HA SER 120 -3.804 -0.258 -8.081 937 HB2 SER 120 1HB SER 120 -2.610 -0.135 -6.153 938 HB3 SER 120 2HB SER 120 -3.545 -1.456 -5.701 939 HG SER 120 HG SER 120 -1.794 -2.799 -6.682 940 H GLN 121 H GLN 121 -1.418 0.169 -8.663 941 HA GLN 121 HA GLN 121 -0.494 -1.628 -10.815 942 HB2 GLN 121 1HB GLN 121 1.423 -0.132 -11.073 943 HB3 GLN 121 2HB GLN 121 -0.113 0.701 -11.146 944 HG2 GLN 121 1HG GLN 121 0.311 1.246 -8.631 945 HG3 GLN 121 2HG GLN 121 1.969 0.659 -8.956 946 HE21 GLN 121 1HE2 GLN 121 1.907 3.012 -7.940 947 HE22 GLN 121 2HE2 GLN 121 2.147 4.289 -9.163 948 H LYS 122 H LYS 122 0.897 -3.176 -10.612 949 HA LYS 122 HA LYS 122 1.745 -4.284 -8.063 950 HB2 LYS 122 1HB LYS 122 1.339 -5.606 -10.192 951 HB3 LYS 122 2HB LYS 122 2.737 -4.800 -10.916 952 HG2 LYS 122 1HG LYS 122 4.145 -5.775 -9.054 953 HG3 LYS 122 2HG LYS 122 2.733 -6.735 -8.571 954 HD2 LYS 122 1HD LYS 122 3.867 -6.871 -11.374 955 HD3 LYS 122 2HD LYS 122 4.556 -7.776 -10.027 956 HE2 LYS 122 1HE LYS 122 2.091 -8.594 -9.631 957 HE3 LYS 122 2HE LYS 122 1.847 -8.091 -11.311 958 HZ1 LYS 122 3HZ LYS 122 3.593 -10.168 -10.220 959 HZ2 LYS 122 1HZ LYS 122 3.964 -9.526 -11.690 960 HZ3 LYS 122 2HZ LYS 122 2.510 -10.299 -11.444 961 H ILE 123 H ILE 123 3.579 -3.760 -6.831 962 HA ILE 123 HA ILE 123 5.803 -2.488 -8.237 963 HB ILE 123 HB ILE 123 4.988 -2.141 -5.334 964 HG12 ILE 123 1HG1 ILE 123 3.383 -0.840 -6.594 965 HG13 ILE 123 2HG1 ILE 123 4.460 0.204 -5.700 966 HG21 ILE 123 1HG2 ILE 123 7.188 -0.757 -6.878 967 HG22 ILE 123 2HG2 ILE 123 6.725 -0.364 -5.210 968 HG23 ILE 123 3HG2 ILE 123 7.397 -1.961 -5.591 969 HD11 ILE 123 3HD1 ILE 123 4.542 -0.361 -8.698 970 HD12 ILE 123 1HD1 ILE 123 4.112 1.159 -7.909 971 HD13 ILE 123 2HD1 ILE 123 5.768 0.606 -7.836 972 H ASP 124 H ASP 124 7.174 -3.854 -8.655 973 HA ASP 124 HA ASP 124 7.692 -6.252 -7.125 974 HB2 ASP 124 1HB ASP 124 8.476 -5.136 -9.670 975 HB3 ASP 124 2HB ASP 124 9.928 -5.492 -8.745 976 H PHE 125 H PHE 125 9.129 -6.581 -5.571 977 HA PHE 125 HA PHE 125 11.132 -4.370 -5.208 978 HB2 PHE 125 1HB PHE 125 10.771 -3.986 -2.910 979 HB3 PHE 125 2HB PHE 125 9.192 -3.927 -3.686 980 HD1 PHE 125 2HD PHE 125 7.631 -5.893 -3.520 981 HD2 PHE 125 1HD PHE 125 11.189 -5.504 -1.126 982 HE1 PHE 125 2HE PHE 125 6.890 -7.799 -2.107 983 HE2 PHE 125 1HE PHE 125 10.398 -7.267 0.372 984 HZ PHE 125 HZ PHE 125 8.256 -8.474 -0.158 985 H GLU 126 H GLU 126 12.699 -5.021 -3.121 986 HA GLU 126 HA GLU 126 13.805 -7.683 -3.889 987 HB2 GLU 126 1HB GLU 126 15.108 -4.978 -3.455 988 HB3 GLU 126 2HB GLU 126 16.018 -6.505 -3.503 989 HG2 GLU 126 1HG GLU 126 15.402 -6.920 -5.789 990 HG3 GLU 126 2HG GLU 126 14.186 -5.654 -5.777 991 H ARG 127 H ARG 127 14.444 -8.974 -2.155 992 HA ARG 127 HA ARG 127 13.344 -8.120 0.440 993 HB2 ARG 127 1HB ARG 127 13.646 -10.843 -0.848 994 HB3 ARG 127 2HB ARG 127 13.498 -10.648 0.886 995 HG2 ARG 127 1HG ARG 127 11.328 -10.931 0.439 996 HG3 ARG 127 2HG ARG 127 11.445 -9.180 0.396 997 HD2 ARG 127 1HD ARG 127 10.049 -9.971 -1.430 998 HD3 ARG 127 2HD ARG 127 11.510 -9.228 -2.069 999 HE ARG 127 HE ARG 127 12.210 -11.183 -2.881 1000 HH11 ARG 127 1HH1 ARG 127 9.677 -12.026 -0.499 1001 HH12 ARG 127 2HH1 ARG 127 9.744 -13.715 -0.826 1002 HH21 ARG 127 1HH2 ARG 127 11.648 -13.349 -3.788 1003 HH22 ARG 127 2HH2 ARG 127 10.584 -14.351 -2.934 1004 H GLU 128 H GLU 128 15.243 -6.956 0.980 1005 HA GLU 128 HA GLU 128 17.268 -6.500 1.740 1006 HB2 GLU 128 1HB GLU 128 17.790 -9.141 2.988 1007 HB3 GLU 128 2HB GLU 128 18.014 -7.471 3.561 1008 HG2 GLU 128 1HG GLU 128 15.464 -7.361 3.683 1009 HG3 GLU 128 2HG GLU 128 15.469 -9.101 3.486 Start of MODEL 16 1 H1 GLY 1 H GLY 1 -22.780 17.737 -4.420 2 HA2 GLY 1 1HA GLY 1 -21.700 17.773 -2.271 3 HA3 GLY 1 2HA GLY 1 -22.984 16.550 -2.238 4 H ALA 2 H ALA 2 -22.034 15.150 -0.752 5 HA ALA 2 HA ALA 2 -20.084 13.346 -1.987 6 HB1 ALA 2 1HB ALA 2 -20.077 14.164 0.959 7 HB2 ALA 2 2HB ALA 2 -19.122 12.853 0.257 8 HB3 ALA 2 3HB ALA 2 -18.800 14.535 -0.216 9 H GLU 3 H GLU 3 -20.472 11.122 -0.729 10 HA GLU 3 HA GLU 3 -22.991 10.826 0.640 11 HB2 GLU 3 1HB GLU 3 -23.484 10.954 -1.976 12 HB3 GLU 3 2HB GLU 3 -22.799 9.342 -1.990 13 HG2 GLU 3 1HG GLU 3 -24.900 8.615 -1.476 14 HG3 GLU 3 2HG GLU 3 -24.585 9.205 0.155 15 H ALA 4 H ALA 4 -19.976 10.165 0.732 16 HA ALA 4 HA ALA 4 -18.453 8.493 0.871 17 HB1 ALA 4 1HB ALA 4 -19.200 6.297 1.916 18 HB2 ALA 4 2HB ALA 4 -19.383 7.766 2.904 19 HB3 ALA 4 3HB ALA 4 -20.789 7.024 2.135 20 H LEU 5 H LEU 5 -18.805 8.947 -1.580 21 HA LEU 5 HA LEU 5 -20.052 6.988 -3.229 22 HB2 LEU 5 1HB LEU 5 -17.626 8.741 -3.841 23 HB3 LEU 5 2HB LEU 5 -18.675 7.918 -4.923 24 HG LEU 5 HG LEU 5 -19.976 9.617 -3.579 25 HD11 LEU 5 1HD1 LEU 5 -19.572 11.468 -5.253 26 HD12 LEU 5 2HD1 LEU 5 -18.383 10.380 -6.044 27 HD13 LEU 5 3HD1 LEU 5 -18.087 11.011 -4.420 28 HD21 LEU 5 3HD2 LEU 5 -21.229 8.150 -4.942 29 HD22 LEU 5 1HD2 LEU 5 -20.359 8.712 -6.388 30 HD23 LEU 5 2HD2 LEU 5 -21.454 9.806 -5.489 31 HA PRO 6 HA PRO 6 -17.247 3.750 -2.506 32 HB2 PRO 6 1HB PRO 6 -17.506 2.173 -4.684 33 HB3 PRO 6 2HB PRO 6 -18.905 2.582 -3.656 34 HG2 PRO 6 1HG PRO 6 -18.158 3.784 -6.321 35 HG3 PRO 6 2HG PRO 6 -19.772 3.344 -5.669 36 HD2 PRO 6 1HD PRO 6 -18.499 5.937 -5.558 37 HD3 PRO 6 2HD PRO 6 -19.946 5.503 -4.677 38 H LEU 7 H LEU 7 -15.297 2.540 -3.402 39 HA LEU 7 HA LEU 7 -13.176 4.312 -3.876 40 HB2 LEU 7 1HB LEU 7 -13.003 2.046 -2.941 41 HB3 LEU 7 2HB LEU 7 -13.216 1.379 -4.557 42 HG LEU 7 HG LEU 7 -10.923 1.553 -3.581 43 HD11 LEU 7 1HD1 LEU 7 -9.638 1.938 -5.536 44 HD12 LEU 7 2HD1 LEU 7 -11.013 2.689 -6.347 45 HD13 LEU 7 3HD1 LEU 7 -11.097 1.004 -5.896 46 HD21 LEU 7 3HD2 LEU 7 -10.567 4.328 -4.367 47 HD22 LEU 7 1HD2 LEU 7 -9.605 3.296 -3.323 48 HD23 LEU 7 2HD2 LEU 7 -11.163 3.911 -2.742 49 H TYR 8 H TYR 8 -12.106 5.044 -5.514 50 HA TYR 8 HA TYR 8 -12.718 4.165 -8.296 51 HB2 TYR 8 1HB TYR 8 -13.050 6.561 -8.988 52 HB3 TYR 8 2HB TYR 8 -14.330 5.779 -8.112 53 HD1 TYR 8 1HD TYR 8 -11.295 7.838 -7.247 54 HD2 TYR 8 2HD TYR 8 -15.456 7.063 -6.543 55 HE1 TYR 8 1HE TYR 8 -11.453 9.935 -5.890 56 HE2 TYR 8 2HE TYR 8 -15.629 9.067 -5.145 57 HH TYR 8 HH TYR 8 -14.530 11.001 -4.365 58 H TYR 9 H TYR 9 -10.271 4.724 -6.146 59 HA TYR 9 HA TYR 9 -8.291 4.776 -8.295 60 HB2 TYR 9 1HB TYR 9 -8.516 7.113 -8.049 61 HB3 TYR 9 2HB TYR 9 -8.523 6.941 -6.303 62 HD1 TYR 9 2HD TYR 9 -6.504 6.594 -4.993 63 HD2 TYR 9 1HD TYR 9 -6.314 6.908 -9.295 64 HE1 TYR 9 2HE TYR 9 -4.183 7.399 -4.825 65 HE2 TYR 9 1HE TYR 9 -3.894 7.468 -9.131 66 HH TYR 9 HH TYR 9 -2.134 8.179 -7.630 67 H LEU 10 H LEU 10 -6.885 3.144 -7.653 68 HA LEU 10 HA LEU 10 -6.326 2.777 -4.764 69 HB2 LEU 10 1HB LEU 10 -7.445 0.804 -6.095 70 HB3 LEU 10 2HB LEU 10 -5.936 0.707 -6.970 71 HG LEU 10 HG LEU 10 -5.685 -0.902 -5.333 72 HD11 LEU 10 1HD1 LEU 10 -3.726 0.567 -5.242 73 HD12 LEU 10 2HD1 LEU 10 -4.051 -0.334 -3.729 74 HD13 LEU 10 3HD1 LEU 10 -4.429 1.362 -3.844 75 HD21 LEU 10 3HD2 LEU 10 -7.724 -0.406 -4.074 76 HD22 LEU 10 1HD2 LEU 10 -6.917 0.977 -3.305 77 HD23 LEU 10 2HD2 LEU 10 -6.355 -0.677 -2.978 78 H GLN 11 H GLN 11 -4.198 3.390 -4.334 79 HA GLN 11 HA GLN 11 -2.179 2.729 -6.299 80 HB2 GLN 11 1HB GLN 11 -3.068 5.262 -6.531 81 HB3 GLN 11 2HB GLN 11 -1.948 5.521 -5.218 82 HG2 GLN 11 1HG GLN 11 -0.473 5.863 -6.890 83 HG3 GLN 11 2HG GLN 11 -0.336 4.116 -6.926 84 HE21 GLN 11 1HE2 GLN 11 -2.885 3.456 -8.290 85 HE22 GLN 11 2HE2 GLN 11 -2.467 3.875 -9.934 86 H ILE 12 H ILE 12 -0.242 2.222 -5.268 87 HA ILE 12 HA ILE 12 -0.304 1.803 -2.452 88 HB ILE 12 HB ILE 12 2.029 1.706 -4.424 89 HG12 ILE 12 1HG1 ILE 12 0.503 0.015 -5.166 90 HG13 ILE 12 2HG1 ILE 12 1.611 -0.822 -4.105 91 HG21 ILE 12 1HG2 ILE 12 3.108 0.200 -2.719 92 HG22 ILE 12 2HG2 ILE 12 2.803 1.764 -1.972 93 HG23 ILE 12 3HG2 ILE 12 1.746 0.393 -1.650 94 HD11 ILE 12 3HD1 ILE 12 -0.164 -0.663 -2.274 95 HD12 ILE 12 1HD1 ILE 12 -1.267 -0.082 -3.555 96 HD13 ILE 12 2HD1 ILE 12 -0.535 -1.686 -3.665 97 H THR 13 H THR 13 0.739 4.607 -4.276 98 HA THR 13 HA THR 13 1.487 6.617 -3.696 99 HB THR 13 HB THR 13 -0.225 5.914 -1.317 100 HG1 THR 13 1HG THR 13 -0.829 7.363 -3.672 101 HG21 THR 13 3HG2 THR 13 -0.693 8.333 -1.146 102 HG22 THR 13 1HG2 THR 13 0.570 8.677 -2.348 103 HG23 THR 13 2HG2 THR 13 0.996 7.978 -0.765 104 H GLY 14 H GLY 14 2.126 4.807 -0.575 105 HA2 GLY 14 1HA GLY 14 4.891 5.811 -0.729 106 HA3 GLY 14 2HA GLY 14 3.968 6.175 0.737 107 H ILE 15 H ILE 15 6.356 4.519 0.568 108 HA ILE 15 HA ILE 15 5.290 2.054 1.718 109 HB ILE 15 HB ILE 15 5.396 1.725 -0.784 110 HG12 ILE 15 1HG1 ILE 15 7.173 -0.189 0.750 111 HG13 ILE 15 2HG1 ILE 15 5.413 -0.114 0.886 112 HG21 ILE 15 1HG2 ILE 15 7.421 1.565 -1.994 113 HG22 ILE 15 2HG2 ILE 15 7.702 2.976 -0.945 114 HG23 ILE 15 3HG2 ILE 15 8.402 1.420 -0.525 115 HD11 ILE 15 3HD1 ILE 15 5.909 -1.819 -0.748 116 HD12 ILE 15 1HD1 ILE 15 5.258 -0.444 -1.616 117 HD13 ILE 15 2HD1 ILE 15 7.020 -0.760 -1.623 118 H THR 16 H THR 16 6.815 1.000 3.041 119 HA THR 16 HA THR 16 9.553 1.605 2.838 120 HB THR 16 HB THR 16 8.858 3.653 4.019 121 HG1 THR 16 1HG THR 16 10.865 2.771 4.306 122 HG21 THR 16 3HG2 THR 16 6.940 2.696 5.338 123 HG22 THR 16 1HG2 THR 16 8.066 3.690 6.266 124 HG23 THR 16 2HG2 THR 16 8.140 1.917 6.403 125 H SER 17 H SER 17 10.493 0.535 5.234 126 HA SER 17 HA SER 17 8.735 -1.614 6.047 127 HB2 SER 17 1HB SER 17 10.444 -3.372 5.809 128 HB3 SER 17 2HB SER 17 9.978 -2.706 4.240 129 HG SER 17 HG SER 17 12.352 -2.993 5.077 130 H ASP 18 H ASP 18 9.869 -2.897 7.812 131 HA ASP 18 HA ASP 18 10.660 -1.074 9.889 132 HB2 ASP 18 1HB ASP 18 10.619 -2.986 11.283 133 HB3 ASP 18 2HB ASP 18 9.253 -3.078 10.242 134 H GLY 19 H GLY 19 12.400 -3.216 7.645 135 HA2 GLY 19 1HA GLY 19 14.992 -2.178 8.643 136 HA3 GLY 19 2HA GLY 19 14.724 -3.366 7.388 137 H ASN 20 H ASN 20 13.270 -0.049 7.704 138 HA ASN 20 HA ASN 20 15.311 0.886 5.845 139 HB2 ASN 20 1HB ASN 20 13.002 0.108 4.580 140 HB3 ASN 20 2HB ASN 20 12.685 1.838 4.851 141 HD21 ASN 20 1HD2 ASN 20 13.666 0.059 2.412 142 HD22 ASN 20 2HD2 ASN 20 15.141 0.844 1.874 143 H ASP 21 H ASP 21 14.595 1.632 8.634 144 HA ASP 21 HA ASP 21 14.532 3.485 9.903 145 HB2 ASP 21 1HB ASP 21 15.105 5.188 7.450 146 HB3 ASP 21 2HB ASP 21 15.361 5.572 9.130 147 H PHE 22 H PHE 22 12.209 2.577 8.140 148 HA PHE 22 HA PHE 22 10.124 2.992 7.613 149 HB2 PHE 22 1HB PHE 22 10.242 4.869 9.989 150 HB3 PHE 22 2HB PHE 22 8.785 4.419 9.125 151 HD1 PHE 22 2HD PHE 22 11.599 2.127 10.388 152 HD2 PHE 22 1HD PHE 22 7.460 3.349 10.686 153 HE1 PHE 22 2HE PHE 22 11.147 0.233 11.841 154 HE2 PHE 22 1HE PHE 22 7.016 1.414 12.139 155 HZ PHE 22 HZ PHE 22 8.841 -0.184 12.699 156 H ALA 23 H ALA 23 12.122 4.366 6.136 157 HA ALA 23 HA ALA 23 11.433 7.055 5.531 158 HB1 ALA 23 1HB ALA 23 13.100 6.781 3.760 159 HB2 ALA 23 2HB ALA 23 13.679 6.177 5.326 160 HB3 ALA 23 3HB ALA 23 13.141 5.034 4.070 161 H TRP 24 H TRP 24 9.359 7.378 4.809 162 HA TRP 24 HA TRP 24 7.841 5.417 3.534 163 HB2 TRP 24 1HB TRP 24 7.531 8.306 4.416 164 HB3 TRP 24 2HB TRP 24 6.275 7.646 3.415 165 HD1 TRP 24 HD TRP 24 7.082 7.903 6.919 166 HE1 TRP 24 1HE TRP 24 5.647 6.334 8.304 167 HE3 TRP 24 3HE TRP 24 5.447 4.895 3.159 168 HZ2 TRP 24 2HZ TRP 24 3.924 4.003 7.811 169 HZ3 TRP 24 3HZ TRP 24 3.997 2.961 3.624 170 HH2 TRP 24 HH TRP 24 3.190 2.519 5.943 171 H ASP 25 H ASP 25 9.891 7.266 1.715 172 HA ASP 25 HA ASP 25 9.934 7.922 -0.518 173 HB2 ASP 25 1HB ASP 25 9.462 5.030 -0.087 174 HB3 ASP 25 2HB ASP 25 9.271 5.576 -1.748 175 H ASN 26 H ASN 26 8.386 9.540 -1.158 176 HA ASN 26 HA ASN 26 5.677 8.768 -1.791 177 HB2 ASN 26 1HB ASN 26 7.348 11.242 -2.367 178 HB3 ASN 26 2HB ASN 26 5.853 10.962 -3.250 179 HD21 ASN 26 1HD2 ASN 26 3.870 10.408 -1.929 180 HD22 ASN 26 2HD2 ASN 26 3.669 11.130 -0.359 181 H LEU 27 H LEU 27 5.345 7.240 -3.200 182 HA LEU 27 HA LEU 27 7.089 6.543 -5.368 183 HB2 LEU 27 1HB LEU 27 4.233 5.678 -4.830 184 HB3 LEU 27 2HB LEU 27 5.440 4.830 -5.803 185 HG LEU 27 HG LEU 27 5.709 5.374 -2.821 186 HD11 LEU 27 1HD1 LEU 27 4.933 3.351 -2.241 187 HD12 LEU 27 2HD1 LEU 27 5.103 2.666 -3.850 188 HD13 LEU 27 3HD1 LEU 27 3.811 3.829 -3.510 189 HD21 LEU 27 3HD2 LEU 27 7.560 3.812 -2.867 190 HD22 LEU 27 1HD2 LEU 27 7.891 5.096 -3.983 191 HD23 LEU 27 2HD2 LEU 27 7.342 3.511 -4.596 192 H THR 28 H THR 28 6.980 6.927 -7.512 193 HA THR 28 HA THR 28 5.560 9.225 -8.436 194 HB THR 28 HB THR 28 6.333 7.950 -10.694 195 HG1 THR 28 1HG THR 28 8.274 6.897 -10.265 196 HG21 THR 28 3HG2 THR 28 7.218 10.147 -9.825 197 HG22 THR 28 1HG2 THR 28 8.506 9.127 -10.491 198 HG23 THR 28 2HG2 THR 28 8.282 9.241 -8.730 199 H SER 29 H SER 29 3.744 9.299 -9.828 200 HA SER 29 HA SER 29 1.705 7.560 -9.058 201 HB2 SER 29 1HB SER 29 1.887 9.424 -11.477 202 HB3 SER 29 2HB SER 29 0.382 8.679 -10.902 203 HG SER 29 HG SER 29 0.599 9.715 -8.978 204 H SER 30 H SER 30 3.354 7.687 -12.210 205 HA SER 30 HA SER 30 2.262 5.246 -13.180 206 HB2 SER 30 1HB SER 30 4.278 5.924 -14.868 207 HB3 SER 30 2HB SER 30 2.676 6.665 -14.838 208 HG SER 30 HG SER 30 5.126 7.711 -13.901 209 H GLN 31 H GLN 31 4.189 5.263 -10.621 210 HA GLN 31 HA GLN 31 6.595 4.033 -11.436 211 HB2 GLN 31 1HB GLN 31 6.069 4.951 -9.099 212 HB3 GLN 31 2HB GLN 31 5.262 3.517 -8.718 213 HG2 GLN 31 1HG GLN 31 7.222 2.483 -8.272 214 HG3 GLN 31 2HG GLN 31 7.885 2.917 -9.845 215 HE21 GLN 31 1HE2 GLN 31 7.488 4.280 -6.498 216 HE22 GLN 31 2HE2 GLN 31 8.920 5.303 -6.727 217 H THR 32 H THR 32 7.272 1.908 -11.600 218 HA THR 32 HA THR 32 5.238 -0.262 -11.524 219 HB THR 32 HB THR 32 6.280 -1.164 -13.499 220 HG1 THR 32 1HG THR 32 7.799 -0.037 -14.618 221 HG21 THR 32 3HG2 THR 32 5.626 1.715 -14.140 222 HG22 THR 32 1HG2 THR 32 4.398 0.531 -13.647 223 HG23 THR 32 2HG2 THR 32 5.330 0.261 -15.109 224 H LYS 33 H LYS 33 8.044 0.880 -9.985 225 HA LYS 33 HA LYS 33 8.913 -1.819 -9.189 226 HB2 LYS 33 1HB LYS 33 9.996 -0.774 -11.468 227 HB3 LYS 33 2HB LYS 33 10.988 0.120 -10.316 228 HG2 LYS 33 1HG LYS 33 12.008 -1.848 -9.526 229 HG3 LYS 33 2HG LYS 33 10.543 -2.773 -9.841 230 HD2 LYS 33 1HD LYS 33 10.951 -2.693 -12.257 231 HD3 LYS 33 2HD LYS 33 12.501 -1.869 -11.996 232 HE2 LYS 33 1HE LYS 33 11.798 -4.501 -10.630 233 HE3 LYS 33 2HE LYS 33 12.390 -4.485 -12.284 234 HZ1 LYS 33 3HZ LYS 33 13.911 -3.152 -10.151 235 HZ2 LYS 33 1HZ LYS 33 14.418 -3.669 -11.639 236 HZ3 LYS 33 2HZ LYS 33 14.058 -4.749 -10.432 237 H ALA 34 H ALA 34 10.302 -1.699 -7.238 238 HA ALA 34 HA ALA 34 9.454 0.488 -5.608 239 HB1 ALA 34 1HB ALA 34 9.631 -1.719 -4.657 240 HB2 ALA 34 2HB ALA 34 11.328 -1.862 -5.155 241 HB3 ALA 34 3HB ALA 34 10.872 -0.753 -3.850 242 HA PRO 35 HA PRO 35 12.889 3.152 -5.788 243 HB2 PRO 35 1HB PRO 35 13.112 4.159 -3.268 244 HB3 PRO 35 2HB PRO 35 11.786 4.556 -4.385 245 HG2 PRO 35 1HG PRO 35 11.767 2.474 -2.180 246 HG3 PRO 35 2HG PRO 35 10.524 3.721 -2.552 247 HD2 PRO 35 1HD PRO 35 10.230 1.215 -3.412 248 HD3 PRO 35 2HD PRO 35 9.785 2.600 -4.447 249 H ASN 36 H ASN 36 13.237 0.719 -2.991 250 HA ASN 36 HA ASN 36 15.960 0.237 -3.823 251 HB2 ASN 36 1HB ASN 36 15.288 1.743 -1.288 252 HB3 ASN 36 2HB ASN 36 16.495 0.470 -1.197 253 HD21 ASN 36 1HD2 ASN 36 15.900 3.685 -2.305 254 HD22 ASN 36 2HD2 ASN 36 17.422 3.925 -3.155 255 H VAL 37 H VAL 37 16.751 -1.682 -2.556 256 HA VAL 37 HA VAL 37 14.758 -3.497 -1.749 257 HB VAL 37 HB VAL 37 16.491 -4.596 -2.426 258 HG11 VAL 37 1HG1 VAL 37 18.376 -2.950 -0.827 259 HG12 VAL 37 2HG1 VAL 37 18.755 -4.446 -1.771 260 HG13 VAL 37 3HG1 VAL 37 18.127 -3.041 -2.613 261 HG21 VAL 37 3HG2 VAL 37 17.417 -4.907 0.402 262 HG22 VAL 37 1HG2 VAL 37 15.730 -5.265 0.048 263 HG23 VAL 37 2HG2 VAL 37 16.991 -6.132 -0.806 264 H LEU 38 H LEU 38 13.516 -3.363 -0.273 265 HA LEU 38 HA LEU 38 13.689 -1.859 2.227 266 HB2 LEU 38 1HB LEU 38 11.710 -3.923 1.151 267 HB3 LEU 38 2HB LEU 38 11.439 -2.872 2.528 268 HG LEU 38 HG LEU 38 11.619 -2.101 -0.407 269 HD11 LEU 38 1HD1 LEU 38 9.366 -1.869 1.619 270 HD12 LEU 38 2HD1 LEU 38 9.513 -3.111 0.355 271 HD13 LEU 38 3HD1 LEU 38 9.301 -1.409 -0.104 272 HD21 LEU 38 3HD2 LEU 38 11.438 -0.274 2.031 273 HD22 LEU 38 1HD2 LEU 38 11.040 0.215 0.366 274 HD23 LEU 38 2HD2 LEU 38 12.677 -0.283 0.723 275 H LYS 39 H LYS 39 14.953 -2.747 3.927 276 HA LYS 39 HA LYS 39 15.450 -5.673 3.924 277 HB2 LYS 39 1HB LYS 39 16.350 -3.576 5.969 278 HB3 LYS 39 2HB LYS 39 16.679 -5.283 6.029 279 HG2 LYS 39 1HG LYS 39 18.583 -4.815 5.043 280 HG3 LYS 39 2HG LYS 39 17.671 -4.777 3.544 281 HD2 LYS 39 1HD LYS 39 18.313 -2.323 5.253 282 HD3 LYS 39 2HD LYS 39 19.281 -2.891 3.876 283 HE2 LYS 39 1HE LYS 39 17.149 -2.791 2.492 284 HE3 LYS 39 2HE LYS 39 16.415 -1.890 3.832 285 HZ1 LYS 39 3HZ LYS 39 17.326 -0.542 2.024 286 HZ2 LYS 39 1HZ LYS 39 18.848 -1.022 2.418 287 HZ3 LYS 39 2HZ LYS 39 17.964 -0.143 3.493 288 H GLY 40 H GLY 40 14.950 -6.876 6.094 289 HA2 GLY 40 1HA GLY 40 13.580 -7.166 7.990 290 HA3 GLY 40 2HA GLY 40 12.666 -5.734 7.561 291 H ASN 41 H ASN 41 10.772 -6.911 7.896 292 HA ASN 41 HA ASN 41 9.915 -8.513 5.534 293 HB2 ASN 41 1HB ASN 41 10.302 -10.274 7.131 294 HB3 ASN 41 2HB ASN 41 9.415 -9.399 8.389 295 HD21 ASN 41 1HD2 ASN 41 7.324 -10.259 8.723 296 HD22 ASN 41 2HD2 ASN 41 6.291 -10.734 7.410 297 H LYS 42 H LYS 42 9.116 -6.218 8.148 298 HA LYS 42 HA LYS 42 6.266 -6.417 7.469 299 HB2 LYS 42 1HB LYS 42 7.708 -4.491 9.317 300 HB3 LYS 42 2HB LYS 42 5.962 -4.581 9.051 301 HG2 LYS 42 1HG LYS 42 7.699 -6.676 10.386 302 HG3 LYS 42 2HG LYS 42 6.427 -5.662 11.093 303 HD2 LYS 42 1HD LYS 42 4.796 -6.804 9.490 304 HD3 LYS 42 2HD LYS 42 6.103 -7.948 9.126 305 HE2 LYS 42 1HE LYS 42 5.079 -9.119 10.788 306 HE3 LYS 42 2HE LYS 42 6.229 -8.187 11.752 307 HZ1 LYS 42 3HZ LYS 42 4.115 -8.094 12.740 308 HZ2 LYS 42 1HZ LYS 42 3.341 -7.715 11.385 309 HZ3 LYS 42 2HZ LYS 42 4.304 -6.568 12.081 310 H LEU 43 H LEU 43 5.654 -5.672 5.669 311 HA LEU 43 HA LEU 43 7.089 -3.539 4.273 312 HB2 LEU 43 1HB LEU 43 5.978 -5.914 3.397 313 HB3 LEU 43 2HB LEU 43 4.692 -4.794 2.992 314 HG LEU 43 HG LEU 43 7.589 -4.709 2.101 315 HD11 LEU 43 1HD1 LEU 43 5.940 -6.276 0.939 316 HD12 LEU 43 2HD1 LEU 43 6.695 -5.067 -0.117 317 HD13 LEU 43 3HD1 LEU 43 5.033 -4.828 0.469 318 HD21 LEU 43 3HD2 LEU 43 7.075 -2.833 0.722 319 HD22 LEU 43 1HD2 LEU 43 7.036 -2.425 2.426 320 HD23 LEU 43 2HD2 LEU 43 5.493 -2.625 1.539 321 H TYR 44 H TYR 44 6.502 -1.641 5.209 322 HA TYR 44 HA TYR 44 3.730 -1.228 6.111 323 HB2 TYR 44 1HB TYR 44 6.172 0.559 6.278 324 HB3 TYR 44 2HB TYR 44 4.597 0.892 6.999 325 HD1 TYR 44 2HD TYR 44 3.743 -1.604 8.276 326 HD2 TYR 44 1HD TYR 44 7.724 0.068 7.950 327 HE1 TYR 44 2HE TYR 44 4.466 -2.921 10.204 328 HE2 TYR 44 1HE TYR 44 8.398 -1.166 9.992 329 HH TYR 44 HH TYR 44 7.758 -2.964 11.444 330 H VAL 45 H VAL 45 2.381 -0.844 4.520 331 HA VAL 45 HA VAL 45 3.181 0.974 2.273 332 HB VAL 45 HB VAL 45 0.810 -0.912 2.491 333 HG11 VAL 45 1HG1 VAL 45 1.811 0.940 0.366 334 HG12 VAL 45 2HG1 VAL 45 0.678 -0.426 0.056 335 HG13 VAL 45 3HG1 VAL 45 0.224 0.882 1.140 336 HG21 VAL 45 3HG2 VAL 45 2.036 -2.185 0.760 337 HG22 VAL 45 1HG2 VAL 45 3.463 -1.172 1.036 338 HG23 VAL 45 2HG2 VAL 45 2.835 -2.218 2.336 339 H LYS 46 H LYS 46 2.087 2.838 1.908 340 HA LYS 46 HA LYS 46 -0.135 3.693 3.693 341 HB2 LYS 46 1HB LYS 46 1.958 4.924 4.254 342 HB3 LYS 46 2HB LYS 46 2.183 5.321 2.546 343 HG2 LYS 46 1HG LYS 46 -0.315 6.318 2.959 344 HG3 LYS 46 2HG LYS 46 0.295 6.476 4.581 345 HD2 LYS 46 1HD LYS 46 1.655 7.577 2.076 346 HD3 LYS 46 2HD LYS 46 0.542 8.491 3.095 347 HE2 LYS 46 1HE LYS 46 1.997 8.225 5.038 348 HE3 LYS 46 2HE LYS 46 3.166 7.283 4.080 349 HZ1 LYS 46 3HZ LYS 46 3.633 9.226 2.796 350 HZ2 LYS 46 1HZ LYS 46 3.659 9.709 4.375 351 HZ3 LYS 46 2HZ LYS 46 2.365 10.053 3.441 352 H ALA 47 H ALA 47 -1.316 2.532 2.004 353 HA ALA 47 HA ALA 47 -1.193 3.443 -0.794 354 HB1 ALA 47 1HB ALA 47 -1.387 1.021 -0.315 355 HB2 ALA 47 2HB ALA 47 -2.950 1.328 0.497 356 HB3 ALA 47 3HB ALA 47 -2.722 1.639 -1.241 357 H ARG 48 H ARG 48 -2.564 4.913 -1.679 358 HA ARG 48 HA ARG 48 -4.442 6.220 0.193 359 HB2 ARG 48 1HB ARG 48 -2.956 7.619 -1.118 360 HB3 ARG 48 2HB ARG 48 -3.557 6.914 -2.635 361 HG2 ARG 48 1HG ARG 48 -5.729 7.966 -2.390 362 HG3 ARG 48 2HG ARG 48 -5.420 8.289 -0.687 363 HD2 ARG 48 1HD ARG 48 -5.229 10.315 -2.009 364 HD3 ARG 48 2HD ARG 48 -3.722 9.926 -1.178 365 HE ARG 48 HE ARG 48 -2.824 9.039 -3.250 366 HH11 ARG 48 1HH1 ARG 48 -5.458 11.419 -3.657 367 HH12 ARG 48 2HH1 ARG 48 -4.497 12.441 -4.672 368 HH21 ARG 48 1HH2 ARG 48 -1.879 10.106 -4.997 369 HH22 ARG 48 2HH2 ARG 48 -2.727 11.343 -5.872 370 H PHE 49 H PHE 49 -6.661 6.109 -0.054 371 HA PHE 49 HA PHE 49 -7.761 4.488 -2.322 372 HB2 PHE 49 1HB PHE 49 -8.712 4.529 0.579 373 HB3 PHE 49 2HB PHE 49 -9.519 3.724 -0.750 374 HD1 PHE 49 2HD PHE 49 -6.417 3.740 1.327 375 HD2 PHE 49 1HD PHE 49 -8.776 1.444 -1.489 376 HE1 PHE 49 2HE PHE 49 -5.008 1.753 1.740 377 HE2 PHE 49 1HE PHE 49 -7.504 -0.575 -0.873 378 HZ PHE 49 HZ PHE 49 -5.613 -0.438 0.722 379 H MET 50 H MET 50 -8.802 5.978 -3.599 380 HA MET 50 HA MET 50 -9.938 8.386 -2.256 381 HB2 MET 50 1HB MET 50 -9.896 8.085 -5.241 382 HB3 MET 50 2HB MET 50 -10.082 9.518 -4.265 383 HG2 MET 50 1HG MET 50 -7.512 8.146 -3.897 384 HG3 MET 50 2HG MET 50 -7.815 8.719 -5.547 385 HE1 MET 50 3HE MET 50 -7.630 11.311 -1.720 386 HE2 MET 50 1HE MET 50 -9.090 10.431 -2.212 387 HE3 MET 50 2HE MET 50 -7.624 9.523 -1.794 388 H GLY 51 H GLY 51 -11.937 7.850 -1.592 389 HA2 GLY 51 1HA GLY 51 -14.327 7.417 -2.225 390 HA3 GLY 51 2HA GLY 51 -13.748 6.248 -3.376 391 H TYR 52 H TYR 52 -15.616 5.674 -1.384 392 HA TYR 52 HA TYR 52 -14.376 4.635 1.003 393 HB2 TYR 52 1HB TYR 52 -16.751 5.802 0.418 394 HB3 TYR 52 2HB TYR 52 -17.257 4.135 0.330 395 HD1 TYR 52 2HD TYR 52 -16.389 2.644 2.467 396 HD2 TYR 52 1HD TYR 52 -16.932 6.923 2.402 397 HE1 TYR 52 2HE TYR 52 -16.706 2.654 4.903 398 HE2 TYR 52 1HE TYR 52 -17.377 6.934 4.805 399 HH TYR 52 HH TYR 52 -17.860 5.514 6.675 400 H THR 53 H THR 53 -13.552 2.617 1.198 401 HA THR 53 HA THR 53 -15.275 0.437 0.471 402 HB THR 53 HB THR 53 -13.872 0.394 -1.527 403 HG1 THR 53 1HG THR 53 -13.954 -1.626 -1.277 404 HG21 THR 53 3HG2 THR 53 -11.859 1.611 -0.691 405 HG22 THR 53 1HG2 THR 53 -11.449 0.078 -1.469 406 HG23 THR 53 2HG2 THR 53 -11.437 0.201 0.302 407 H LYS 54 H LYS 54 -14.874 -1.351 1.820 408 HA LYS 54 HA LYS 54 -12.597 -1.203 3.592 409 HB2 LYS 54 1HB LYS 54 -13.683 -1.510 5.654 410 HB3 LYS 54 2HB LYS 54 -14.199 0.016 4.935 411 HG2 LYS 54 1HG LYS 54 -16.384 -0.580 4.853 412 HG3 LYS 54 2HG LYS 54 -16.049 -2.237 4.376 413 HD2 LYS 54 1HD LYS 54 -15.307 -2.753 6.707 414 HD3 LYS 54 2HD LYS 54 -15.714 -1.092 7.186 415 HE2 LYS 54 1HE LYS 54 -18.098 -1.570 6.491 416 HE3 LYS 54 2HE LYS 54 -17.612 -3.252 6.199 417 HZ1 LYS 54 3HZ LYS 54 -18.000 -1.836 8.693 418 HZ2 LYS 54 1HZ LYS 54 -16.753 -2.903 8.691 419 HZ3 LYS 54 2HZ LYS 54 -18.274 -3.424 8.349 420 H LEU 55 H LEU 55 -13.181 -2.697 1.333 421 HA LEU 55 HA LEU 55 -12.814 -5.321 2.567 422 HB2 LEU 55 1HB LEU 55 -15.231 -4.993 1.555 423 HB3 LEU 55 2HB LEU 55 -14.437 -5.207 0.013 424 HG LEU 55 HG LEU 55 -15.354 -7.293 0.731 425 HD11 LEU 55 1HD1 LEU 55 -12.375 -7.526 1.292 426 HD12 LEU 55 2HD1 LEU 55 -13.132 -7.498 -0.323 427 HD13 LEU 55 3HD1 LEU 55 -13.484 -8.821 0.799 428 HD21 LEU 55 3HD2 LEU 55 -14.833 -8.382 2.860 429 HD22 LEU 55 1HD2 LEU 55 -15.589 -6.812 3.115 430 HD23 LEU 55 2HD2 LEU 55 -13.840 -7.013 3.365 431 H THR 56 H THR 56 -10.759 -4.169 2.322 432 HA THR 56 HA THR 56 -9.464 -4.274 -0.289 433 HB THR 56 HB THR 56 -8.195 -4.175 2.484 434 HG1 THR 56 1HG THR 56 -9.541 -2.481 2.448 435 HG21 THR 56 3HG2 THR 56 -6.629 -4.589 0.639 436 HG22 THR 56 1HG2 THR 56 -6.395 -2.961 1.282 437 HG23 THR 56 2HG2 THR 56 -7.275 -3.182 -0.244 438 H VAL 57 H VAL 57 -8.048 -5.980 -0.906 439 HA VAL 57 HA VAL 57 -8.036 -8.514 0.623 440 HB VAL 57 HB VAL 57 -8.966 -8.079 -2.247 441 HG11 VAL 57 1HG1 VAL 57 -8.175 -10.691 -0.889 442 HG12 VAL 57 2HG1 VAL 57 -9.232 -10.599 -2.296 443 HG13 VAL 57 3HG1 VAL 57 -7.574 -10.010 -2.416 444 HG21 VAL 57 3HG2 VAL 57 -10.761 -7.743 -0.718 445 HG22 VAL 57 1HG2 VAL 57 -10.975 -9.373 -1.355 446 HG23 VAL 57 2HG2 VAL 57 -10.314 -9.142 0.264 447 H ILE 58 H ILE 58 -6.210 -9.780 0.107 448 HA ILE 58 HA ILE 58 -4.189 -8.730 -1.743 449 HB ILE 58 HB ILE 58 -3.513 -9.366 1.158 450 HG12 ILE 58 1HG1 ILE 58 -3.628 -6.577 -0.079 451 HG13 ILE 58 2HG1 ILE 58 -4.793 -7.214 1.082 452 HG21 ILE 58 1HG2 ILE 58 -1.789 -9.754 -0.681 453 HG22 ILE 58 2HG2 ILE 58 -1.887 -8.013 -1.029 454 HG23 ILE 58 3HG2 ILE 58 -1.281 -8.584 0.538 455 HD11 ILE 58 3HD1 ILE 58 -3.246 -5.830 2.267 456 HD12 ILE 58 1HD1 ILE 58 -2.995 -7.524 2.754 457 HD13 ILE 58 2HD1 ILE 58 -1.875 -6.746 1.626 458 H THR 59 H THR 59 -4.394 -10.559 -3.044 459 HA THR 59 HA THR 59 -5.429 -12.989 -2.237 460 HB THR 59 HB THR 59 -3.653 -12.326 -4.620 461 HG1 THR 59 1HG THR 59 -6.468 -12.157 -4.402 462 HG21 THR 59 3HG2 THR 59 -5.797 -14.468 -4.290 463 HG22 THR 59 1HG2 THR 59 -4.068 -14.683 -4.669 464 HG23 THR 59 2HG2 THR 59 -5.132 -13.927 -5.849 465 H GLY 60 H GLY 60 -2.075 -12.138 -2.816 466 HA2 GLY 60 1HA GLY 60 -0.077 -12.798 -1.990 467 HA3 GLY 60 2HA GLY 60 -0.891 -13.720 -0.745 468 H LYS 61 H LYS 61 1.196 -14.921 -1.366 469 HA LYS 61 HA LYS 61 1.323 -16.637 -3.645 470 HB2 LYS 61 1HB LYS 61 2.905 -16.007 -1.332 471 HB3 LYS 61 2HB LYS 61 2.566 -17.719 -1.188 472 HG2 LYS 61 1HG LYS 61 3.596 -18.220 -3.264 473 HG3 LYS 61 2HG LYS 61 3.677 -16.519 -3.722 474 HD2 LYS 61 1HD LYS 61 5.108 -16.318 -1.472 475 HD3 LYS 61 2HD LYS 61 5.409 -18.035 -1.786 476 HE2 LYS 61 1HE LYS 61 6.178 -17.422 -4.115 477 HE3 LYS 61 2HE LYS 61 5.818 -15.730 -3.761 478 HZ1 LYS 61 3HZ LYS 61 7.574 -16.032 -1.907 479 HZ2 LYS 61 1HZ LYS 61 8.043 -15.856 -3.469 480 HZ3 LYS 61 2HZ LYS 61 8.068 -17.323 -2.776 481 H ASP 62 H ASP 62 0.365 -17.108 -0.281 482 HA ASP 62 HA ASP 62 -0.897 -19.514 -0.322 483 HB2 ASP 62 1HB ASP 62 -1.567 -19.025 1.693 484 HB3 ASP 62 2HB ASP 62 -0.752 -17.484 1.505 485 H GLY 63 H GLY 63 -2.312 -16.564 -1.747 486 HA2 GLY 63 1HA GLY 63 -3.811 -16.449 -3.494 487 HA3 GLY 63 2HA GLY 63 -3.744 -18.208 -3.638 488 H LYS 64 H LYS 64 -4.579 -16.620 -0.597 489 HA LYS 64 HA LYS 64 -7.437 -17.446 -0.885 490 HB2 LYS 64 1HB LYS 64 -5.557 -18.514 1.260 491 HB3 LYS 64 2HB LYS 64 -7.299 -18.596 1.329 492 HG2 LYS 64 1HG LYS 64 -6.964 -19.689 -1.104 493 HG3 LYS 64 2HG LYS 64 -5.412 -20.140 -0.371 494 HD2 LYS 64 1HD LYS 64 -6.670 -21.205 1.514 495 HD3 LYS 64 2HD LYS 64 -8.193 -20.722 0.739 496 HE2 LYS 64 1HE LYS 64 -7.395 -21.990 -1.337 497 HE3 LYS 64 2HE LYS 64 -6.090 -22.646 -0.338 498 HZ1 LYS 64 3HZ LYS 64 -7.766 -23.691 1.057 499 HZ2 LYS 64 1HZ LYS 64 -8.054 -24.084 -0.520 500 HZ3 LYS 64 2HZ LYS 64 -8.975 -22.955 0.227 501 H ASN 65 H ASN 65 -5.643 -14.952 -0.331 502 HA ASN 65 HA ASN 65 -6.265 -12.841 0.329 503 HB2 ASN 65 1HB ASN 65 -8.723 -13.654 0.448 504 HB3 ASN 65 2HB ASN 65 -8.427 -13.839 2.188 505 HD21 ASN 65 1HD2 ASN 65 -6.990 -11.616 2.899 506 HD22 ASN 65 2HD2 ASN 65 -8.077 -10.256 2.608 507 H LEU 66 H LEU 66 -4.227 -12.912 1.251 508 HA LEU 66 HA LEU 66 -3.242 -13.853 3.601 509 HB2 LEU 66 1HB LEU 66 -2.883 -11.113 2.327 510 HB3 LEU 66 2HB LEU 66 -1.888 -11.681 3.631 511 HG LEU 66 HG LEU 66 -2.086 -12.778 0.815 512 HD11 LEU 66 1HD1 LEU 66 0.325 -11.703 2.353 513 HD12 LEU 66 2HD1 LEU 66 -0.683 -10.735 1.267 514 HD13 LEU 66 3HD1 LEU 66 0.231 -12.108 0.637 515 HD21 LEU 66 3HD2 LEU 66 -1.872 -14.750 2.181 516 HD22 LEU 66 1HD2 LEU 66 -0.606 -14.027 3.183 517 HD23 LEU 66 2HD2 LEU 66 -0.297 -14.429 1.480 518 H LEU 67 H LEU 67 -5.240 -10.841 3.381 519 HA LEU 67 HA LEU 67 -4.926 -10.140 6.069 520 HB2 LEU 67 1HB LEU 67 -7.375 -9.655 4.340 521 HB3 LEU 67 2HB LEU 67 -6.950 -8.809 5.778 522 HG LEU 67 HG LEU 67 -5.166 -8.673 3.332 523 HD11 LEU 67 1HD1 LEU 67 -7.494 -6.856 4.079 524 HD12 LEU 67 2HD1 LEU 67 -7.415 -7.950 2.689 525 HD13 LEU 67 3HD1 LEU 67 -6.326 -6.560 2.772 526 HD21 LEU 67 3HD2 LEU 67 -4.517 -6.491 4.355 527 HD22 LEU 67 1HD2 LEU 67 -4.142 -7.864 5.408 528 HD23 LEU 67 2HD2 LEU 67 -5.559 -6.837 5.744 529 H TYR 68 H TYR 68 -6.904 -12.774 4.698 530 HA TYR 68 HA TYR 68 -8.414 -13.101 7.205 531 HB2 TYR 68 1HB TYR 68 -9.488 -13.028 4.856 532 HB3 TYR 68 2HB TYR 68 -8.669 -14.534 4.538 533 HD1 TYR 68 2HD TYR 68 -11.268 -12.872 6.723 534 HD2 TYR 68 1HD TYR 68 -9.574 -16.576 5.344 535 HE1 TYR 68 2HE TYR 68 -13.240 -14.094 7.575 536 HE2 TYR 68 1HE TYR 68 -11.523 -17.823 6.246 537 HH TYR 68 HH TYR 68 -13.678 -17.633 7.180 538 H ASN 69 H ASN 69 -5.358 -13.632 6.447 539 HA ASN 69 HA ASN 69 -5.236 -16.417 7.475 540 HB2 ASN 69 1HB ASN 69 -3.860 -15.288 5.312 541 HB3 ASN 69 2HB ASN 69 -2.696 -15.133 6.615 542 HD21 ASN 69 1HD2 ASN 69 -4.981 -17.507 5.160 543 HD22 ASN 69 2HD2 ASN 69 -3.837 -18.820 5.208 544 H GLY 70 H GLY 70 -3.187 -13.449 7.762 545 HA2 GLY 70 1HA GLY 70 -4.126 -12.324 9.986 546 HA3 GLY 70 2HA GLY 70 -3.273 -13.688 10.712 547 H THR 71 H THR 71 -1.117 -13.221 8.352 548 HA THR 71 HA THR 71 0.562 -11.534 9.975 549 HB THR 71 HB THR 71 0.828 -12.477 7.113 550 HG1 THR 71 1HG THR 71 2.077 -13.416 9.431 551 HG21 THR 71 3HG2 THR 71 2.945 -11.288 8.934 552 HG22 THR 71 1HG2 THR 71 2.338 -10.586 7.431 553 HG23 THR 71 2HG2 THR 71 3.259 -12.098 7.377 554 H ALA 72 H ALA 72 -0.911 -10.895 6.685 555 HA ALA 72 HA ALA 72 -0.355 -8.037 6.938 556 HB1 ALA 72 1HB ALA 72 -2.163 -9.565 4.989 557 HB2 ALA 72 2HB ALA 72 -1.586 -7.893 4.807 558 HB3 ALA 72 3HB ALA 72 -0.442 -9.245 4.710 559 H LYS 73 H LYS 73 -1.546 -6.594 7.962 560 HA LYS 73 HA LYS 73 -4.459 -6.785 7.909 561 HB2 LYS 73 1HB LYS 73 -4.014 -8.207 9.779 562 HB3 LYS 73 2HB LYS 73 -2.828 -7.103 10.464 563 HG2 LYS 73 1HG LYS 73 -4.415 -5.568 11.138 564 HG3 LYS 73 2HG LYS 73 -5.651 -6.173 10.025 565 HD2 LYS 73 1HD LYS 73 -5.340 -8.430 11.497 566 HD3 LYS 73 2HD LYS 73 -4.867 -7.231 12.722 567 HE2 LYS 73 1HE LYS 73 -7.009 -6.132 12.539 568 HE3 LYS 73 2HE LYS 73 -7.412 -7.046 11.076 569 HZ1 LYS 73 3HZ LYS 73 -7.493 -9.064 12.468 570 HZ2 LYS 73 1HZ LYS 73 -8.588 -7.945 12.885 571 HZ3 LYS 73 2HZ LYS 73 -7.257 -8.154 13.813 572 H MET 74 H MET 74 -5.433 -4.668 8.414 573 HA MET 74 HA MET 74 -3.574 -2.426 8.233 574 HB2 MET 74 1HB MET 74 -5.442 -1.109 7.894 575 HB3 MET 74 2HB MET 74 -5.767 -2.596 7.001 576 HG2 MET 74 1HG MET 74 -7.140 -3.385 8.979 577 HG3 MET 74 2HG MET 74 -6.878 -1.819 9.706 578 HE1 MET 74 3HE MET 74 -8.605 0.010 6.284 579 HE2 MET 74 1HE MET 74 -7.196 0.262 7.349 580 HE3 MET 74 2HE MET 74 -7.151 -0.985 6.099 581 H PHE 75 H PHE 75 -3.201 -0.930 9.846 582 HA PHE 75 HA PHE 75 -4.246 -1.455 12.577 583 HB2 PHE 75 1HB PHE 75 -2.038 -1.612 13.485 584 HB3 PHE 75 2HB PHE 75 -2.229 -2.842 12.250 585 HD1 PHE 75 1HD PHE 75 -1.266 -2.271 9.836 586 HD2 PHE 75 2HD PHE 75 -0.151 -0.211 13.460 587 HE1 PHE 75 1HE PHE 75 0.787 -1.427 8.736 588 HE2 PHE 75 2HE PHE 75 1.908 0.606 12.336 589 HZ PHE 75 HZ PHE 75 2.382 -0.026 9.984 590 H LYS 76 H LYS 76 -4.000 0.826 10.244 591 HA LYS 76 HA LYS 76 -4.147 2.974 12.107 592 HB2 LYS 76 1HB LYS 76 -1.676 2.712 12.001 593 HB3 LYS 76 2HB LYS 76 -1.709 2.940 10.258 594 HG2 LYS 76 1HG LYS 76 -2.426 5.221 10.493 595 HG3 LYS 76 2HG LYS 76 -2.787 4.995 12.210 596 HD2 LYS 76 1HD LYS 76 -0.592 5.046 12.875 597 HD3 LYS 76 2HD LYS 76 0.035 4.423 11.341 598 HE2 LYS 76 1HE LYS 76 -0.338 6.542 10.233 599 HE3 LYS 76 2HE LYS 76 -1.214 7.192 11.637 600 HZ1 LYS 76 3HZ LYS 76 1.158 7.897 11.426 601 HZ2 LYS 76 1HZ LYS 76 1.629 6.374 11.719 602 HZ3 LYS 76 2HZ LYS 76 0.798 7.195 12.876 603 H SER 77 H SER 77 -5.206 4.747 11.091 604 HA SER 77 HA SER 77 -5.702 4.720 8.207 605 HB2 SER 77 1HB SER 77 -8.193 4.652 8.633 606 HB3 SER 77 2HB SER 77 -7.361 3.142 8.904 607 HG SER 77 HG SER 77 -8.043 4.950 10.972 608 H ASP 78 H ASP 78 -5.130 6.805 7.846 609 HA ASP 78 HA ASP 78 -5.794 8.897 9.886 610 HB2 ASP 78 1HB ASP 78 -3.451 8.471 8.719 611 HB3 ASP 78 2HB ASP 78 -4.122 9.480 7.482 612 H ALA 79 H ALA 79 -6.096 11.075 8.201 613 HA ALA 79 HA ALA 79 -8.199 10.316 6.246 614 HB1 ALA 79 1HB ALA 79 -9.284 10.843 8.494 615 HB2 ALA 79 2HB ALA 79 -8.807 12.538 8.232 616 HB3 ALA 79 3HB ALA 79 -9.911 11.716 7.103 617 H ILE 80 H ILE 80 -7.952 11.306 4.307 618 HA ILE 80 HA ILE 80 -5.928 13.446 4.091 619 HB ILE 80 HB ILE 80 -7.357 11.924 1.859 620 HG12 ILE 80 1HG1 ILE 80 -4.629 11.354 3.081 621 HG13 ILE 80 2HG1 ILE 80 -6.075 10.335 3.134 622 HG21 ILE 80 1HG2 ILE 80 -6.441 14.149 1.237 623 HG22 ILE 80 2HG2 ILE 80 -4.840 13.647 1.810 624 HG23 ILE 80 3HG2 ILE 80 -5.604 12.848 0.415 625 HD11 ILE 80 3HD1 ILE 80 -6.034 10.189 0.638 626 HD12 ILE 80 1HD1 ILE 80 -4.413 10.938 0.700 627 HD13 ILE 80 2HD1 ILE 80 -4.697 9.380 1.483 628 H LEU 81 H LEU 81 -6.812 15.470 4.330 629 HA LEU 81 HA LEU 81 -9.527 15.981 3.237 630 HB2 LEU 81 1HB LEU 81 -7.631 17.893 4.624 631 HB3 LEU 81 2HB LEU 81 -9.230 18.285 3.965 632 HG LEU 81 HG LEU 81 -8.685 16.411 6.280 633 HD11 LEU 81 1HD1 LEU 81 -10.074 19.117 6.170 634 HD12 LEU 81 2HD1 LEU 81 -8.418 18.828 6.735 635 HD13 LEU 81 3HD1 LEU 81 -9.776 18.117 7.609 636 HD21 LEU 81 3HD2 LEU 81 -11.311 17.151 4.919 637 HD22 LEU 81 1HD2 LEU 81 -11.202 16.419 6.531 638 HD23 LEU 81 2HD2 LEU 81 -10.631 15.541 5.119 639 H GLY 82 H GLY 82 -9.733 17.536 1.494 640 HA2 GLY 82 1HA GLY 82 -7.414 17.476 -0.382 641 HA3 GLY 82 2HA GLY 82 -9.113 17.344 -0.801 642 H GLN 83 H GLN 83 -7.263 19.670 1.208 643 HA GLN 83 HA GLN 83 -6.845 21.821 1.136 644 HB2 GLN 83 1HB GLN 83 -6.118 21.475 -1.187 645 HB3 GLN 83 2HB GLN 83 -7.761 21.776 -1.751 646 HG2 GLN 83 1HG GLN 83 -6.469 23.771 -2.066 647 HG3 GLN 83 2HG GLN 83 -7.695 24.040 -0.850 648 HE21 GLN 83 1HE2 GLN 83 -4.199 23.010 -1.060 649 HE22 GLN 83 2HE2 GLN 83 -3.697 24.004 0.272 650 H ASN 84 H ASN 84 -9.958 21.387 -0.615 651 HA ASN 84 HA ASN 84 -11.083 23.681 0.908 652 HB2 ASN 84 1HB ASN 84 -12.568 21.823 -0.958 653 HB3 ASN 84 2HB ASN 84 -13.092 23.363 -0.272 654 HD21 ASN 84 1HD2 ASN 84 -11.537 21.858 -2.995 655 HD22 ASN 84 2HD2 ASN 84 -11.046 23.310 -3.806 656 H LYS 85 H LYS 85 -10.353 21.928 2.796 657 HA LYS 85 HA LYS 85 -10.756 20.429 4.334 658 HB2 LYS 85 1HB LYS 85 -12.285 21.234 5.782 659 HB3 LYS 85 2HB LYS 85 -11.836 22.601 4.714 660 HG2 LYS 85 1HG LYS 85 -13.723 22.748 3.670 661 HG3 LYS 85 2HG LYS 85 -14.231 21.075 3.841 662 HD2 LYS 85 1HD LYS 85 -15.614 21.695 5.420 663 HD3 LYS 85 2HD LYS 85 -14.200 21.862 6.448 664 HE2 LYS 85 1HE LYS 85 -15.230 23.894 6.799 665 HE3 LYS 85 2HE LYS 85 -14.092 24.301 5.506 666 HZ1 LYS 85 3HZ LYS 85 -16.340 25.156 5.161 667 HZ2 LYS 85 1HZ LYS 85 -16.940 23.640 5.056 668 HZ3 LYS 85 2HZ LYS 85 -15.875 24.144 3.928 669 H VAL 86 H VAL 86 -11.810 19.435 1.622 670 HA VAL 86 HA VAL 86 -14.040 17.774 2.249 671 HB VAL 86 HB VAL 86 -14.269 18.740 0.257 672 HG11 VAL 86 1HG1 VAL 86 -12.155 19.542 -0.157 673 HG12 VAL 86 2HG1 VAL 86 -11.444 17.920 -0.268 674 HG13 VAL 86 3HG1 VAL 86 -12.530 18.518 -1.552 675 HG21 VAL 86 3HG2 VAL 86 -14.821 16.272 0.218 676 HG22 VAL 86 1HG2 VAL 86 -14.407 16.941 -1.370 677 HG23 VAL 86 2HG2 VAL 86 -13.219 15.968 -0.492 678 H VAL 87 H VAL 87 -13.946 15.637 3.029 679 HA VAL 87 HA VAL 87 -11.495 14.125 3.022 680 HB VAL 87 HB VAL 87 -12.983 13.650 4.696 681 HG11 VAL 87 1HG1 VAL 87 -15.216 13.156 2.700 682 HG12 VAL 87 2HG1 VAL 87 -15.288 12.848 4.444 683 HG13 VAL 87 3HG1 VAL 87 -15.085 14.492 3.878 684 HG21 VAL 87 3HG2 VAL 87 -13.440 11.274 2.887 685 HG22 VAL 87 1HG2 VAL 87 -11.834 11.669 3.527 686 HG23 VAL 87 2HG2 VAL 87 -13.144 11.344 4.646 687 H ILE 88 H ILE 88 -10.616 14.124 1.031 688 HA ILE 88 HA ILE 88 -12.116 13.201 -1.322 689 HB ILE 88 HB ILE 88 -9.883 13.256 -2.430 690 HG12 ILE 88 1HG1 ILE 88 -8.809 14.587 0.089 691 HG13 ILE 88 2HG1 ILE 88 -8.468 12.916 -0.346 692 HG21 ILE 88 1HG2 ILE 88 -10.736 15.794 -0.973 693 HG22 ILE 88 2HG2 ILE 88 -9.858 15.723 -2.518 694 HG23 ILE 88 3HG2 ILE 88 -11.512 15.135 -2.426 695 HD11 ILE 88 3HD1 ILE 88 -6.631 14.293 -1.121 696 HD12 ILE 88 1HD1 ILE 88 -7.509 13.702 -2.534 697 HD13 ILE 88 2HD1 ILE 88 -7.713 15.383 -1.975 698 H GLY 89 H GLY 89 -10.142 11.752 1.231 699 HA2 GLY 89 1HA GLY 89 -11.008 9.142 0.776 700 HA3 GLY 89 2HA GLY 89 -9.464 9.342 -0.087 701 H TRP 90 H TRP 90 -8.634 7.706 1.555 702 HA TRP 90 HA TRP 90 -7.673 9.112 3.958 703 HB2 TRP 90 1HB TRP 90 -8.990 6.403 3.974 704 HB3 TRP 90 2HB TRP 90 -8.261 7.215 5.362 705 HD1 TRP 90 HD TRP 90 -9.800 8.986 6.623 706 HE1 TRP 90 1HE TRP 90 -12.211 9.749 6.390 707 HE3 TRP 90 3HE TRP 90 -10.974 6.499 2.330 708 HZ2 TRP 90 2HZ TRP 90 -14.472 9.200 4.615 709 HZ3 TRP 90 3HZ TRP 90 -13.261 6.656 1.367 710 HH2 TRP 90 HH TRP 90 -14.998 8.036 2.481 711 H ASP 91 H ASP 91 -5.728 8.244 4.678 712 HA ASP 91 HA ASP 91 -4.444 6.175 3.009 713 HB2 ASP 91 1HB ASP 91 -3.392 8.347 4.830 714 HB3 ASP 91 2HB ASP 91 -2.492 6.855 4.712 715 H LYS 92 H LYS 92 -5.563 4.475 3.578 716 HA LYS 92 HA LYS 92 -5.584 3.491 6.398 717 HB2 LYS 92 1HB LYS 92 -6.841 2.537 3.815 718 HB3 LYS 92 2HB LYS 92 -6.427 1.360 5.049 719 HG2 LYS 92 1HG LYS 92 -8.702 1.948 5.297 720 HG3 LYS 92 2HG LYS 92 -7.821 2.505 6.711 721 HD2 LYS 92 1HD LYS 92 -8.076 4.780 6.132 722 HD3 LYS 92 2HD LYS 92 -8.433 4.378 4.435 723 HE2 LYS 92 1HE LYS 92 -10.604 3.717 4.836 724 HE3 LYS 92 2HE LYS 92 -10.302 3.280 6.524 725 HZ1 LYS 92 3HZ LYS 92 -10.451 5.561 7.144 726 HZ2 LYS 92 1HZ LYS 92 -11.707 5.274 6.109 727 HZ3 LYS 92 2HZ LYS 92 -10.407 6.084 5.592 728 H TYR 93 H TYR 93 -3.629 2.869 7.057 729 HA TYR 93 HA TYR 93 -1.543 1.973 5.242 730 HB2 TYR 93 1HB TYR 93 -1.742 2.085 8.269 731 HB3 TYR 93 2HB TYR 93 -0.280 1.760 7.385 732 HD1 TYR 93 1HD TYR 93 -2.804 4.427 8.133 733 HD2 TYR 93 2HD TYR 93 1.088 3.545 6.498 734 HE1 TYR 93 1HE TYR 93 -2.198 6.801 8.286 735 HE2 TYR 93 2HE TYR 93 1.703 5.922 6.659 736 HH TYR 93 HH TYR 93 0.969 8.112 7.320 737 H PHE 94 H PHE 94 -0.535 -0.142 5.398 738 HA PHE 94 HA PHE 94 -2.106 -2.327 6.688 739 HB2 PHE 94 1HB PHE 94 -1.198 -2.082 3.794 740 HB3 PHE 94 2HB PHE 94 -1.507 -3.640 4.543 741 HD1 PHE 94 2HD PHE 94 -3.160 -0.448 3.527 742 HD2 PHE 94 1HD PHE 94 -3.718 -4.437 5.067 743 HE1 PHE 94 2HE PHE 94 -5.598 -0.230 3.222 744 HE2 PHE 94 1HE PHE 94 -6.171 -4.234 4.697 745 HZ PHE 94 HZ PHE 94 -7.114 -2.118 3.791 746 H GLU 95 H GLU 95 -0.875 -4.109 7.453 747 HA GLU 95 HA GLU 95 2.066 -3.738 7.412 748 HB2 GLU 95 1HB GLU 95 0.632 -3.868 9.478 749 HB3 GLU 95 2HB GLU 95 0.298 -5.539 9.136 750 HG2 GLU 95 1HG GLU 95 2.597 -6.158 9.443 751 HG3 GLU 95 2HG GLU 95 3.145 -4.485 9.310 752 H ILE 96 H ILE 96 1.961 -4.657 5.003 753 HA ILE 96 HA ILE 96 1.128 -7.452 4.805 754 HB ILE 96 HB ILE 96 2.623 -5.726 2.791 755 HG12 ILE 96 1HG1 ILE 96 0.014 -5.868 1.879 756 HG13 ILE 96 2HG1 ILE 96 -0.274 -5.734 3.610 757 HG21 ILE 96 1HG2 ILE 96 0.853 -8.156 2.296 758 HG22 ILE 96 2HG2 ILE 96 1.663 -7.138 1.085 759 HG23 ILE 96 3HG2 ILE 96 2.627 -8.121 2.174 760 HD11 ILE 96 3HD1 ILE 96 -0.236 -3.579 2.359 761 HD12 ILE 96 1HD1 ILE 96 1.086 -3.621 3.565 762 HD13 ILE 96 2HD1 ILE 96 1.407 -3.947 1.840 763 HA PRO 97 HA PRO 97 5.354 -9.107 5.573 764 HB2 PRO 97 1HB PRO 97 5.227 -11.382 3.933 765 HB3 PRO 97 2HB PRO 97 4.639 -11.319 5.577 766 HG2 PRO 97 1HG PRO 97 3.112 -11.012 3.009 767 HG3 PRO 97 2HG PRO 97 2.647 -11.888 4.517 768 HD2 PRO 97 1HD PRO 97 1.663 -9.455 3.884 769 HD3 PRO 97 2HD PRO 97 1.969 -9.893 5.556 770 H MET 98 H MET 98 7.214 -9.838 4.115 771 HA MET 98 HA MET 98 7.035 -8.850 1.303 772 HB2 MET 98 1HB MET 98 9.267 -8.782 3.370 773 HB3 MET 98 2HB MET 98 9.661 -8.791 1.649 774 HG2 MET 98 1HG MET 98 8.031 -6.920 1.320 775 HG3 MET 98 2HG MET 98 8.013 -6.735 3.080 776 HE1 MET 98 3HE MET 98 10.486 -6.603 4.331 777 HE2 MET 98 1HE MET 98 11.211 -5.026 3.905 778 HE3 MET 98 2HE MET 98 9.456 -5.142 4.200 779 H ASP 99 H ASP 99 6.587 -11.487 2.820 780 HA ASP 99 HA ASP 99 8.200 -13.261 1.050 781 HB2 ASP 99 1HB ASP 99 8.586 -12.752 3.763 782 HB3 ASP 99 2HB ASP 99 7.575 -14.185 3.791 783 H ALA 100 H ALA 100 5.056 -12.307 1.212 784 HA ALA 100 HA ALA 100 4.093 -15.115 1.071 785 HB1 ALA 100 1HB ALA 100 2.316 -14.933 2.539 786 HB2 ALA 100 2HB ALA 100 3.666 -14.273 3.465 787 HB3 ALA 100 3HB ALA 100 2.441 -13.197 2.692 788 H LEU 101 H LEU 101 4.620 -12.506 -0.576 789 HA LEU 101 HA LEU 101 2.027 -12.120 -1.843 790 HB2 LEU 101 1HB LEU 101 4.868 -11.191 -2.464 791 HB3 LEU 101 2HB LEU 101 3.365 -10.557 -3.156 792 HG LEU 101 HG LEU 101 4.135 -9.118 -1.556 793 HD11 LEU 101 1HD1 LEU 101 2.087 -10.486 0.181 794 HD12 LEU 101 2HD1 LEU 101 1.623 -9.883 -1.414 795 HD13 LEU 101 3HD1 LEU 101 2.263 -8.753 -0.218 796 HD21 LEU 101 3HD2 LEU 101 4.428 -10.696 0.810 797 HD22 LEU 101 1HD2 LEU 101 5.002 -9.094 0.295 798 HD23 LEU 101 2HD2 LEU 101 5.706 -10.525 -0.467 799 H GLN 102 H GLN 102 1.854 -12.573 -4.171 800 HA GLN 102 HA GLN 102 2.515 -15.202 -4.814 801 HB2 GLN 102 1HB GLN 102 0.564 -13.901 -5.467 802 HB3 GLN 102 2HB GLN 102 1.591 -12.838 -6.475 803 HG2 GLN 102 1HG GLN 102 2.202 -14.754 -7.870 804 HG3 GLN 102 2HG GLN 102 1.241 -15.799 -6.785 805 HE21 GLN 102 1HE2 GLN 102 -0.979 -15.996 -7.234 806 HE22 GLN 102 2HE2 GLN 102 -1.789 -15.115 -8.520 807 H ASP 103 H ASP 103 4.583 -12.428 -4.916 808 HA ASP 103 HA ASP 103 6.666 -13.817 -6.302 809 HB2 ASP 103 1HB ASP 103 5.227 -12.900 -8.196 810 HB3 ASP 103 2HB ASP 103 5.520 -11.289 -7.498 811 H ASN 104 H ASN 104 8.447 -11.875 -6.621 812 HA ASN 104 HA ASN 104 8.775 -10.427 -4.082 813 HB2 ASN 104 1HB ASN 104 10.478 -10.625 -6.594 814 HB3 ASN 104 2HB ASN 104 10.861 -9.559 -5.237 815 HD21 ASN 104 1HD2 ASN 104 12.841 -10.651 -4.890 816 HD22 ASN 104 2HD2 ASN 104 12.882 -12.193 -4.063 817 H SER 105 H SER 105 6.411 -9.681 -5.208 818 HA SER 105 HA SER 105 6.911 -6.861 -5.514 819 HB2 SER 105 1HB SER 105 5.405 -6.565 -7.483 820 HB3 SER 105 2HB SER 105 6.865 -7.462 -7.873 821 HG SER 105 HG SER 105 5.839 -9.319 -8.029 822 H ILE 106 H ILE 106 5.294 -5.681 -4.588 823 HA ILE 106 HA ILE 106 3.210 -7.256 -3.143 824 HB ILE 106 HB ILE 106 4.644 -5.957 -1.770 825 HG12 ILE 106 1HG1 ILE 106 2.119 -6.322 -1.377 826 HG13 ILE 106 2HG1 ILE 106 3.055 -5.325 -0.300 827 HG21 ILE 106 1HG2 ILE 106 4.635 -3.492 -1.708 828 HG22 ILE 106 2HG2 ILE 106 5.394 -4.140 -3.168 829 HG23 ILE 106 3HG2 ILE 106 3.760 -3.463 -3.255 830 HD11 ILE 106 3HD1 ILE 106 2.185 -3.277 -1.255 831 HD12 ILE 106 1HD1 ILE 106 1.351 -4.170 -2.528 832 HD13 ILE 106 2HD1 ILE 106 0.840 -4.356 -0.836 833 H GLN 107 H GLN 107 0.997 -6.738 -3.593 834 HA GLN 107 HA GLN 107 0.440 -4.204 -4.792 835 HB2 GLN 107 1HB GLN 107 -1.059 -4.894 -6.522 836 HB3 GLN 107 2HB GLN 107 0.528 -5.560 -6.855 837 HG2 GLN 107 1HG GLN 107 -0.223 -7.787 -6.102 838 HG3 GLN 107 2HG GLN 107 -1.796 -7.121 -5.651 839 HE21 GLN 107 1HE2 GLN 107 -2.152 -5.351 -8.105 840 HE22 GLN 107 2HE2 GLN 107 -2.424 -6.463 -9.377 841 H ILE 108 H ILE 108 -2.127 -3.968 -4.728 842 HA ILE 108 HA ILE 108 -3.317 -5.464 -2.465 843 HB ILE 108 HB ILE 108 -3.251 -2.434 -2.856 844 HG12 ILE 108 1HG1 ILE 108 -2.213 -4.211 -0.594 845 HG13 ILE 108 2HG1 ILE 108 -1.238 -3.315 -1.758 846 HG21 ILE 108 1HG2 ILE 108 -4.679 -2.296 -0.810 847 HG22 ILE 108 2HG2 ILE 108 -5.510 -3.033 -2.137 848 HG23 ILE 108 3HG2 ILE 108 -4.841 -4.069 -0.840 849 HD11 ILE 108 3HD1 ILE 108 -1.149 -2.075 0.243 850 HD12 ILE 108 1HD1 ILE 108 -2.231 -1.174 -0.843 851 HD13 ILE 108 2HD1 ILE 108 -2.897 -2.143 0.492 852 H LYS 109 H LYS 109 -5.838 -5.286 -2.716 853 HA LYS 109 HA LYS 109 -6.745 -3.928 -5.065 854 HB2 LYS 109 1HB LYS 109 -8.025 -5.798 -6.029 855 HB3 LYS 109 2HB LYS 109 -6.301 -6.078 -6.116 856 HG2 LYS 109 1HG LYS 109 -7.211 -7.300 -3.671 857 HG3 LYS 109 2HG LYS 109 -8.341 -7.719 -4.938 858 HD2 LYS 109 1HD LYS 109 -6.712 -9.412 -4.788 859 HD3 LYS 109 2HD LYS 109 -6.545 -8.603 -6.337 860 HE2 LYS 109 1HE LYS 109 -4.555 -7.386 -5.502 861 HE3 LYS 109 2HE LYS 109 -4.785 -8.112 -3.891 862 HZ1 LYS 109 3HZ LYS 109 -4.625 -10.313 -5.207 863 HZ2 LYS 109 1HZ LYS 109 -3.197 -9.502 -4.972 864 HZ3 LYS 109 2HZ LYS 109 -3.986 -9.445 -6.403 865 H ALA 110 H ALA 110 -9.234 -3.682 -4.912 866 HA ALA 110 HA ALA 110 -10.407 -4.621 -2.376 867 HB1 ALA 110 1HB ALA 110 -11.107 -2.368 -1.666 868 HB2 ALA 110 2HB ALA 110 -9.338 -2.448 -1.753 869 HB3 ALA 110 3HB ALA 110 -10.248 -1.642 -3.045 870 H LEU 111 H LEU 111 -12.707 -4.368 -2.276 871 HA LEU 111 HA LEU 111 -14.107 -4.436 -4.878 872 HB2 LEU 111 1HB LEU 111 -14.597 -5.990 -2.861 873 HB3 LEU 111 2HB LEU 111 -15.276 -4.571 -2.064 874 HG LEU 111 HG LEU 111 -16.790 -4.307 -4.126 875 HD11 LEU 111 1HD1 LEU 111 -15.854 -7.171 -4.566 876 HD12 LEU 111 2HD1 LEU 111 -15.607 -5.828 -5.698 877 HD13 LEU 111 3HD1 LEU 111 -17.232 -6.470 -5.388 878 HD21 LEU 111 3HD2 LEU 111 -17.177 -6.796 -2.439 879 HD22 LEU 111 1HD2 LEU 111 -18.410 -5.989 -3.441 880 HD23 LEU 111 2HD2 LEU 111 -17.710 -5.145 -2.046 881 H SER 112 H SER 112 -14.997 -2.664 -5.816 882 HA SER 112 HA SER 112 -15.202 -0.096 -4.430 883 HB2 SER 112 1HB SER 112 -14.723 -0.143 -6.832 884 HB3 SER 112 2HB SER 112 -16.229 -1.042 -7.124 885 HG SER 112 HG SER 112 -16.406 1.280 -7.467 886 H SER 113 H SER 113 -17.745 -1.928 -6.113 887 HA SER 113 HA SER 113 -19.343 -2.740 -4.021 888 HB2 SER 113 1HB SER 113 -20.094 0.073 -4.907 889 HB3 SER 113 2HB SER 113 -21.322 -1.080 -4.344 890 HG SER 113 HG SER 113 -19.000 -0.323 -2.921 891 H GLY 114 H GLY 114 -19.814 -1.036 -7.203 892 HA2 GLY 114 1HA GLY 114 -21.926 -2.884 -7.921 893 HA3 GLY 114 2HA GLY 114 -21.292 -1.541 -8.874 894 H THR 115 H THR 115 -20.388 -4.675 -7.613 895 HA THR 115 HA THR 115 -19.258 -6.448 -8.218 896 HB THR 115 HB THR 115 -19.311 -6.914 -10.889 897 HG1 THR 115 1HG THR 115 -20.338 -4.746 -11.142 898 HG21 THR 115 3HG2 THR 115 -21.635 -7.049 -8.914 899 HG22 THR 115 1HG2 THR 115 -20.380 -8.286 -9.184 900 HG23 THR 115 2HG2 THR 115 -21.564 -7.924 -10.447 901 H THR 116 H THR 116 -17.962 -3.558 -9.024 902 HA THR 116 HA THR 116 -15.669 -4.077 -10.583 903 HB THR 116 HB THR 116 -15.440 -1.719 -8.964 904 HG1 THR 116 1HG THR 116 -17.983 -1.587 -10.018 905 HG21 THR 116 3HG2 THR 116 -16.606 -2.017 -11.762 906 HG22 THR 116 1HG2 THR 116 -14.880 -1.851 -11.358 907 HG23 THR 116 2HG2 THR 116 -15.997 -0.508 -11.023 908 H PHE 117 H PHE 117 -13.735 -4.918 -9.880 909 HA PHE 117 HA PHE 117 -12.920 -4.382 -7.089 910 HB2 PHE 117 1HB PHE 117 -13.459 -6.779 -8.294 911 HB3 PHE 117 2HB PHE 117 -11.715 -6.652 -8.586 912 HD1 PHE 117 1HD PHE 117 -10.306 -5.975 -6.383 913 HD2 PHE 117 2HD PHE 117 -14.248 -7.649 -6.384 914 HE1 PHE 117 1HE PHE 117 -10.028 -6.661 -3.975 915 HE2 PHE 117 2HE PHE 117 -13.955 -8.381 -4.002 916 HZ PHE 117 HZ PHE 117 -11.863 -7.841 -2.809 917 H VAL 118 H VAL 118 -11.077 -3.201 -6.913 918 HA VAL 118 HA VAL 118 -9.697 -2.438 -9.450 919 HB VAL 118 HB VAL 118 -9.945 -0.809 -6.913 920 HG11 VAL 118 1HG1 VAL 118 -8.022 -0.232 -8.370 921 HG12 VAL 118 2HG1 VAL 118 -9.130 -0.016 -9.739 922 HG13 VAL 118 3HG1 VAL 118 -9.215 1.065 -8.322 923 HG21 VAL 118 3HG2 VAL 118 -12.212 -1.000 -7.789 924 HG22 VAL 118 1HG2 VAL 118 -11.597 0.593 -8.228 925 HG23 VAL 118 2HG2 VAL 118 -11.639 -0.704 -9.442 926 H TYR 119 H TYR 119 -7.759 -3.232 -9.576 927 HA TYR 119 HA TYR 119 -6.266 -4.218 -7.230 928 HB2 TYR 119 1HB TYR 119 -5.518 -4.268 -10.183 929 HB3 TYR 119 2HB TYR 119 -4.694 -5.107 -8.879 930 HD1 TYR 119 2HD TYR 119 -7.877 -4.930 -10.787 931 HD2 TYR 119 1HD TYR 119 -5.414 -7.334 -8.220 932 HE1 TYR 119 2HE TYR 119 -9.489 -6.779 -11.039 933 HE2 TYR 119 1HE TYR 119 -6.998 -9.237 -8.513 934 HH TYR 119 HH TYR 119 -8.999 -9.628 -10.749 935 H SER 120 H SER 120 -4.127 -3.395 -6.760 936 HA SER 120 HA SER 120 -3.613 -0.622 -7.652 937 HB2 SER 120 1HB SER 120 -1.964 -0.547 -6.049 938 HB3 SER 120 2HB SER 120 -3.105 -1.579 -5.264 939 HG SER 120 HG SER 120 -0.786 -2.486 -6.637 940 H GLN 121 H GLN 121 -1.417 -0.284 -8.602 941 HA GLN 121 HA GLN 121 -0.732 -2.105 -10.742 942 HB2 GLN 121 1HB GLN 121 1.298 -0.611 -10.891 943 HB3 GLN 121 2HB GLN 121 -0.284 0.153 -11.115 944 HG2 GLN 121 1HG GLN 121 -0.049 0.869 -8.625 945 HG3 GLN 121 2HG GLN 121 1.641 0.380 -8.780 946 HE21 GLN 121 1HE2 GLN 121 1.777 2.771 -8.110 947 HE22 GLN 121 2HE2 GLN 121 1.770 3.948 -9.434 948 H LYS 122 H LYS 122 1.342 -3.166 -10.918 949 HA LYS 122 HA LYS 122 2.129 -4.640 -8.470 950 HB2 LYS 122 1HB LYS 122 1.625 -5.948 -10.427 951 HB3 LYS 122 2HB LYS 122 2.667 -4.990 -11.457 952 HG2 LYS 122 1HG LYS 122 4.027 -6.301 -9.137 953 HG3 LYS 122 2HG LYS 122 3.315 -7.400 -10.313 954 HD2 LYS 122 1HD LYS 122 4.520 -6.238 -12.147 955 HD3 LYS 122 2HD LYS 122 5.364 -5.238 -10.946 956 HE2 LYS 122 1HE LYS 122 6.416 -7.263 -9.995 957 HE3 LYS 122 2HE LYS 122 5.451 -8.289 -11.067 958 HZ1 LYS 122 3HZ LYS 122 6.615 -7.305 -12.955 959 HZ2 LYS 122 1HZ LYS 122 7.688 -8.002 -11.922 960 HZ3 LYS 122 2HZ LYS 122 7.551 -6.389 -11.981 961 H ILE 123 H ILE 123 4.021 -4.171 -7.418 962 HA ILE 123 HA ILE 123 6.170 -2.633 -8.757 963 HB ILE 123 HB ILE 123 5.069 -2.071 -5.957 964 HG12 ILE 123 1HG1 ILE 123 3.483 -1.120 -7.688 965 HG13 ILE 123 2HG1 ILE 123 4.153 0.007 -6.552 966 HG21 ILE 123 1HG2 ILE 123 6.719 -0.169 -6.030 967 HG22 ILE 123 2HG2 ILE 123 7.466 -1.755 -6.156 968 HG23 ILE 123 3HG2 ILE 123 7.222 -0.765 -7.606 969 HD11 ILE 123 3HD1 ILE 123 5.742 0.837 -8.353 970 HD12 ILE 123 1HD1 ILE 123 4.950 -0.330 -9.430 971 HD13 ILE 123 2HD1 ILE 123 4.052 1.040 -8.716 972 H ASP 124 H ASP 124 7.519 -3.958 -8.897 973 HA ASP 124 HA ASP 124 8.338 -6.252 -7.361 974 HB2 ASP 124 1HB ASP 124 8.912 -5.849 -9.700 975 HB3 ASP 124 2HB ASP 124 9.517 -4.322 -9.320 976 H PHE 125 H PHE 125 10.094 -6.372 -5.929 977 HA PHE 125 HA PHE 125 11.513 -3.999 -5.126 978 HB2 PHE 125 1HB PHE 125 10.980 -4.048 -2.753 979 HB3 PHE 125 2HB PHE 125 9.534 -3.781 -3.683 980 HD1 PHE 125 2HD PHE 125 11.335 -6.216 -1.566 981 HD2 PHE 125 1HD PHE 125 7.674 -5.333 -3.644 982 HE1 PHE 125 2HE PHE 125 10.255 -8.064 -0.391 983 HE2 PHE 125 1HE PHE 125 6.542 -7.164 -2.375 984 HZ PHE 125 HZ PHE 125 7.844 -8.596 -0.829 985 H GLU 126 H GLU 126 13.202 -4.745 -3.234 986 HA GLU 126 HA GLU 126 13.737 -7.621 -3.311 987 HB2 GLU 126 1HB GLU 126 15.596 -5.426 -4.014 988 HB3 GLU 126 2HB GLU 126 16.227 -6.881 -3.198 989 HG2 GLU 126 1HG GLU 126 14.690 -6.724 -5.831 990 HG3 GLU 126 2HG GLU 126 16.427 -6.827 -5.678 991 H ARG 127 H ARG 127 14.687 -8.414 -1.450 992 HA ARG 127 HA ARG 127 14.212 -6.698 0.854 993 HB2 ARG 127 1HB ARG 127 13.147 -8.730 1.987 994 HB3 ARG 127 2HB ARG 127 12.287 -7.535 1.041 995 HG2 ARG 127 1HG ARG 127 11.367 -9.668 0.574 996 HG3 ARG 127 2HG ARG 127 12.137 -8.950 -0.859 997 HD2 ARG 127 1HD ARG 127 12.407 -11.357 -0.726 998 HD3 ARG 127 2HD ARG 127 13.906 -10.418 -0.762 999 HE ARG 127 HE ARG 127 13.201 -10.906 1.956 1000 HH11 ARG 127 1HH1 ARG 127 14.398 -12.755 -0.829 1001 HH12 ARG 127 2HH1 ARG 127 15.291 -13.865 0.143 1002 HH21 ARG 127 1HH2 ARG 127 14.573 -12.272 3.222 1003 HH22 ARG 127 2HH2 ARG 127 15.594 -13.423 2.438 1004 H GLU 128 H GLU 128 16.070 -6.468 1.388 1005 HA GLU 128 HA GLU 128 18.164 -6.620 2.211 1006 HB2 GLU 128 1HB GLU 128 18.611 -8.137 4.103 1007 HB3 GLU 128 2HB GLU 128 17.204 -7.104 4.289 1008 HG2 GLU 128 1HG GLU 128 15.675 -8.908 3.969 1009 HG3 GLU 128 2HG GLU 128 16.955 -9.964 3.382 Start of MODEL 17 1 H1 GLY 1 H GLY 1 -23.722 17.099 -4.132 2 HA2 GLY 1 1HA GLY 1 -22.367 16.780 -6.203 3 HA3 GLY 1 2HA GLY 1 -21.516 18.265 -5.725 4 H ALA 2 H ALA 2 -20.468 15.577 -6.068 5 HA ALA 2 HA ALA 2 -19.132 14.046 -5.235 6 HB1 ALA 2 1HB ALA 2 -19.104 15.520 -2.568 7 HB2 ALA 2 2HB ALA 2 -18.154 14.096 -2.988 8 HB3 ALA 2 3HB ALA 2 -17.897 15.614 -3.858 9 H GLU 3 H GLU 3 -21.034 14.556 -2.251 10 HA GLU 3 HA GLU 3 -22.206 13.047 -1.042 11 HB2 GLU 3 1HB GLU 3 -23.543 12.538 -3.237 12 HB3 GLU 3 2HB GLU 3 -22.555 11.086 -3.315 13 HG2 GLU 3 1HG GLU 3 -23.405 10.408 -1.069 14 HG3 GLU 3 2HG GLU 3 -24.287 11.929 -0.950 15 H ALA 4 H ALA 4 -21.790 10.206 -1.054 16 HA ALA 4 HA ALA 4 -18.882 9.944 -0.596 17 HB1 ALA 4 1HB ALA 4 -20.191 9.282 1.319 18 HB2 ALA 4 2HB ALA 4 -21.327 8.353 0.305 19 HB3 ALA 4 3HB ALA 4 -19.671 7.789 0.511 20 H LEU 5 H LEU 5 -18.299 9.791 -3.113 21 HA LEU 5 HA LEU 5 -19.459 7.992 -4.751 22 HB2 LEU 5 1HB LEU 5 -16.577 8.900 -4.338 23 HB3 LEU 5 2HB LEU 5 -17.238 8.330 -5.845 24 HG LEU 5 HG LEU 5 -16.927 10.669 -5.726 25 HD11 LEU 5 1HD1 LEU 5 -19.091 11.380 -6.725 26 HD12 LEU 5 2HD1 LEU 5 -19.882 9.999 -5.945 27 HD13 LEU 5 3HD1 LEU 5 -18.657 9.730 -7.234 28 HD21 LEU 5 3HD2 LEU 5 -19.059 11.278 -3.853 29 HD22 LEU 5 1HD2 LEU 5 -17.962 12.352 -4.714 30 HD23 LEU 5 2HD2 LEU 5 -17.298 11.275 -3.459 31 HA PRO 6 HA PRO 6 -17.254 4.188 -3.481 32 HB2 PRO 6 1HB PRO 6 -17.051 2.879 -5.820 33 HB3 PRO 6 2HB PRO 6 -18.633 3.111 -5.010 34 HG2 PRO 6 1HG PRO 6 -17.463 4.684 -7.309 35 HG3 PRO 6 2HG PRO 6 -19.121 4.028 -7.127 36 HD2 PRO 6 1HD PRO 6 -18.370 6.636 -6.520 37 HD3 PRO 6 2HD PRO 6 -19.763 5.836 -5.751 38 H LEU 7 H LEU 7 -15.199 3.272 -3.962 39 HA LEU 7 HA LEU 7 -12.965 4.820 -4.082 40 HB2 LEU 7 1HB LEU 7 -13.090 2.529 -3.372 41 HB3 LEU 7 2HB LEU 7 -13.280 1.990 -5.047 42 HG LEU 7 HG LEU 7 -10.946 2.803 -5.513 43 HD11 LEU 7 1HD1 LEU 7 -10.981 3.197 -2.477 44 HD12 LEU 7 2HD1 LEU 7 -10.679 4.436 -3.704 45 HD13 LEU 7 3HD1 LEU 7 -9.501 3.142 -3.488 46 HD21 LEU 7 3HD2 LEU 7 -9.937 0.887 -4.320 47 HD22 LEU 7 1HD2 LEU 7 -11.512 0.433 -4.969 48 HD23 LEU 7 2HD2 LEU 7 -11.323 0.792 -3.243 49 H TYR 8 H TYR 8 -12.690 6.349 -5.599 50 HA TYR 8 HA TYR 8 -12.669 5.659 -8.473 51 HB2 TYR 8 1HB TYR 8 -12.697 8.079 -8.838 52 HB3 TYR 8 2HB TYR 8 -14.092 7.461 -7.984 53 HD1 TYR 8 1HD TYR 8 -10.885 9.333 -7.525 54 HD2 TYR 8 2HD TYR 8 -14.733 8.344 -5.861 55 HE1 TYR 8 1HE TYR 8 -10.577 11.070 -5.774 56 HE2 TYR 8 2HE TYR 8 -14.471 10.108 -4.152 57 HH TYR 8 HH TYR 8 -11.580 12.235 -4.071 58 H TYR 9 H TYR 9 -10.409 5.624 -5.991 59 HA TYR 9 HA TYR 9 -8.300 5.467 -8.012 60 HB2 TYR 9 1HB TYR 9 -8.314 7.859 -7.508 61 HB3 TYR 9 2HB TYR 9 -8.117 7.420 -5.821 62 HD1 TYR 9 2HD TYR 9 -6.441 7.206 -9.158 63 HD2 TYR 9 1HD TYR 9 -5.976 6.993 -4.878 64 HE1 TYR 9 2HE TYR 9 -3.975 7.444 -9.417 65 HE2 TYR 9 1HE TYR 9 -3.566 7.491 -5.098 66 HH TYR 9 HH TYR 9 -1.901 7.473 -8.210 67 H LEU 10 H LEU 10 -7.033 3.735 -7.435 68 HA LEU 10 HA LEU 10 -6.493 3.178 -4.592 69 HB2 LEU 10 1HB LEU 10 -8.165 1.510 -5.290 70 HB3 LEU 10 2HB LEU 10 -7.359 1.263 -6.789 71 HG LEU 10 HG LEU 10 -6.050 -0.218 -5.968 72 HD11 LEU 10 1HD1 LEU 10 -6.285 0.555 -3.082 73 HD12 LEU 10 2HD1 LEU 10 -4.866 0.923 -4.095 74 HD13 LEU 10 3HD1 LEU 10 -5.294 -0.760 -3.742 75 HD21 LEU 10 3HD2 LEU 10 -7.154 -1.755 -4.470 76 HD22 LEU 10 1HD2 LEU 10 -8.210 -1.082 -5.717 77 HD23 LEU 10 2HD2 LEU 10 -8.299 -0.503 -4.027 78 H GLN 11 H GLN 11 -4.345 3.590 -4.437 79 HA GLN 11 HA GLN 11 -2.529 2.407 -6.376 80 HB2 GLN 11 1HB GLN 11 -3.377 4.681 -7.250 81 HB3 GLN 11 2HB GLN 11 -2.443 5.392 -5.935 82 HG2 GLN 11 1HG GLN 11 -0.464 5.016 -7.009 83 HG3 GLN 11 2HG GLN 11 -0.936 3.428 -7.610 84 HE21 GLN 11 1HE2 GLN 11 -2.436 3.352 -9.572 85 HE22 GLN 11 2HE2 GLN 11 -2.229 4.647 -10.715 86 H ILE 12 H ILE 12 -0.436 2.211 -5.492 87 HA ILE 12 HA ILE 12 -0.525 1.904 -2.688 88 HB ILE 12 HB ILE 12 1.923 1.869 -4.462 89 HG12 ILE 12 1HG1 ILE 12 0.543 0.272 -5.465 90 HG13 ILE 12 2HG1 ILE 12 1.624 -0.602 -4.424 91 HG21 ILE 12 1HG2 ILE 12 1.306 0.517 -1.810 92 HG22 ILE 12 2HG2 ILE 12 2.813 0.249 -2.712 93 HG23 ILE 12 3HG2 ILE 12 2.478 1.814 -1.984 94 HD11 ILE 12 3HD1 ILE 12 -0.609 -1.569 -4.303 95 HD12 ILE 12 1HD1 ILE 12 -0.138 -0.921 -2.732 96 HD13 ILE 12 2HD1 ILE 12 -1.285 -0.026 -3.740 97 H THR 13 H THR 13 0.881 4.601 -4.575 98 HA THR 13 HA THR 13 1.459 6.646 -4.011 99 HB THR 13 HB THR 13 0.132 6.150 -1.339 100 HG1 THR 13 1HG THR 13 -0.834 6.711 -3.937 101 HG21 THR 13 3HG2 THR 13 1.295 8.353 -1.553 102 HG22 THR 13 1HG2 THR 13 -0.464 8.509 -1.470 103 HG23 THR 13 2HG2 THR 13 0.348 8.661 -3.037 104 H GLY 14 H GLY 14 2.308 4.652 -1.089 105 HA2 GLY 14 1HA GLY 14 5.034 4.956 -1.800 106 HA3 GLY 14 2HA GLY 14 4.744 5.981 -0.445 107 H ILE 15 H ILE 15 6.455 4.298 0.286 108 HA ILE 15 HA ILE 15 5.307 1.883 1.430 109 HB ILE 15 HB ILE 15 5.544 1.539 -1.059 110 HG12 ILE 15 1HG1 ILE 15 7.243 -0.322 0.619 111 HG13 ILE 15 2HG1 ILE 15 5.476 -0.262 0.587 112 HG21 ILE 15 1HG2 ILE 15 7.743 1.190 -2.093 113 HG22 ILE 15 2HG2 ILE 15 7.630 2.839 -1.458 114 HG23 ILE 15 3HG2 ILE 15 8.553 1.608 -0.575 115 HD11 ILE 15 3HD1 ILE 15 5.740 -0.518 -2.021 116 HD12 ILE 15 1HD1 ILE 15 7.330 -1.189 -1.622 117 HD13 ILE 15 2HD1 ILE 15 5.851 -1.907 -0.949 118 H THR 16 H THR 16 6.860 0.890 2.821 119 HA THR 16 HA THR 16 9.594 1.571 2.723 120 HB THR 16 HB THR 16 8.927 3.640 3.827 121 HG1 THR 16 1HG THR 16 10.111 1.989 5.801 122 HG21 THR 16 3HG2 THR 16 7.899 2.062 6.200 123 HG22 THR 16 1HG2 THR 16 6.843 2.773 4.976 124 HG23 THR 16 2HG2 THR 16 7.881 3.820 5.945 125 H SER 17 H SER 17 10.628 0.398 4.801 126 HA SER 17 HA SER 17 8.831 -1.669 5.897 127 HB2 SER 17 1HB SER 17 10.677 -3.322 5.560 128 HB3 SER 17 2HB SER 17 9.990 -2.727 4.038 129 HG SER 17 HG SER 17 12.468 -2.754 4.671 130 H ASP 18 H ASP 18 9.887 -2.750 7.693 131 HA ASP 18 HA ASP 18 10.705 -1.041 9.780 132 HB2 ASP 18 1HB ASP 18 9.474 -3.109 10.006 133 HB3 ASP 18 2HB ASP 18 10.843 -4.005 9.395 134 H GLY 19 H GLY 19 12.648 -2.619 7.288 135 HA2 GLY 19 1HA GLY 19 15.184 -1.891 8.658 136 HA3 GLY 19 2HA GLY 19 15.002 -2.896 7.238 137 H ASN 20 H ASN 20 13.006 -0.149 6.762 138 HA ASN 20 HA ASN 20 15.179 1.150 5.179 139 HB2 ASN 20 1HB ASN 20 12.364 0.543 4.530 140 HB3 ASN 20 2HB ASN 20 12.863 2.186 4.121 141 HD21 ASN 20 1HD2 ASN 20 13.080 1.961 1.790 142 HD22 ASN 20 2HD2 ASN 20 14.372 0.978 1.175 143 H ASP 21 H ASP 21 14.181 1.569 8.150 144 HA ASP 21 HA ASP 21 13.996 3.242 9.586 145 HB2 ASP 21 1HB ASP 21 16.182 3.817 8.417 146 HB3 ASP 21 2HB ASP 21 15.294 5.069 7.546 147 H PHE 22 H PHE 22 11.764 2.799 7.884 148 HA PHE 22 HA PHE 22 9.728 3.623 7.357 149 HB2 PHE 22 1HB PHE 22 10.370 5.572 9.571 150 HB3 PHE 22 2HB PHE 22 8.799 5.411 8.809 151 HD1 PHE 22 2HD PHE 22 11.377 3.234 10.567 152 HD2 PHE 22 1HD PHE 22 7.188 3.995 9.769 153 HE1 PHE 22 2HE PHE 22 10.751 1.566 12.227 154 HE2 PHE 22 1HE PHE 22 6.587 2.412 11.550 155 HZ PHE 22 HZ PHE 22 8.348 1.128 12.747 156 H ALA 23 H ALA 23 12.069 4.668 5.813 157 HA ALA 23 HA ALA 23 11.400 7.314 4.898 158 HB1 ALA 23 1HB ALA 23 12.982 5.085 3.564 159 HB2 ALA 23 2HB ALA 23 12.899 6.785 3.038 160 HB3 ALA 23 3HB ALA 23 13.640 6.378 4.597 161 H TRP 24 H TRP 24 9.127 7.180 4.707 162 HA TRP 24 HA TRP 24 7.659 5.273 3.347 163 HB2 TRP 24 1HB TRP 24 7.202 8.085 4.345 164 HB3 TRP 24 2HB TRP 24 6.019 7.437 3.268 165 HD1 TRP 24 HD TRP 24 6.824 7.426 6.846 166 HE1 TRP 24 1HE TRP 24 5.454 5.686 8.077 167 HE3 TRP 24 3HE TRP 24 5.299 4.689 2.825 168 HZ2 TRP 24 2HZ TRP 24 3.788 3.377 7.374 169 HZ3 TRP 24 3HZ TRP 24 3.931 2.664 3.127 170 HH2 TRP 24 HH TRP 24 3.123 2.025 5.404 171 H ASP 25 H ASP 25 9.548 7.519 1.815 172 HA ASP 25 HA ASP 25 9.786 8.317 -0.317 173 HB2 ASP 25 1HB ASP 25 9.200 5.392 -0.369 174 HB3 ASP 25 2HB ASP 25 9.095 6.182 -1.924 175 H ASN 26 H ASN 26 8.658 8.191 -2.747 176 HA ASN 26 HA ASN 26 5.754 8.230 -2.558 177 HB2 ASN 26 1HB ASN 26 7.331 10.651 -3.273 178 HB3 ASN 26 2HB ASN 26 6.176 10.183 -4.522 179 HD21 ASN 26 1HD2 ASN 26 6.455 10.554 -1.064 180 HD22 ASN 26 2HD2 ASN 26 4.780 10.726 -0.725 181 H LEU 27 H LEU 27 5.246 6.589 -3.751 182 HA LEU 27 HA LEU 27 6.915 5.559 -5.901 183 HB2 LEU 27 1HB LEU 27 4.075 4.937 -5.024 184 HB3 LEU 27 2HB LEU 27 4.886 4.086 -6.336 185 HG LEU 27 HG LEU 27 5.955 4.149 -3.475 186 HD11 LEU 27 1HD1 LEU 27 4.208 2.126 -4.903 187 HD12 LEU 27 2HD1 LEU 27 3.731 3.161 -3.532 188 HD13 LEU 27 3HD1 LEU 27 4.944 1.885 -3.304 189 HD21 LEU 27 3HD2 LEU 27 6.604 2.337 -5.834 190 HD22 LEU 27 1HD2 LEU 27 7.154 2.111 -4.157 191 HD23 LEU 27 2HD2 LEU 27 7.681 3.524 -5.039 192 H THR 28 H THR 28 6.849 6.186 -8.020 193 HA THR 28 HA THR 28 5.321 8.487 -8.713 194 HB THR 28 HB THR 28 6.436 7.618 -11.052 195 HG1 THR 28 1HG THR 28 8.288 6.561 -10.705 196 HG21 THR 28 3HG2 THR 28 6.883 9.774 -9.839 197 HG22 THR 28 1HG2 THR 28 8.375 9.033 -10.435 198 HG23 THR 28 2HG2 THR 28 7.947 8.892 -8.723 199 H SER 29 H SER 29 3.993 8.738 -10.605 200 HA SER 29 HA SER 29 1.640 7.569 -10.197 201 HB2 SER 29 1HB SER 29 2.494 8.868 -12.803 202 HB3 SER 29 2HB SER 29 0.890 8.896 -12.050 203 HG SER 29 HG SER 29 1.946 10.825 -11.608 204 H SER 30 H SER 30 4.027 6.166 -12.387 205 HA SER 30 HA SER 30 2.093 3.994 -12.885 206 HB2 SER 30 1HB SER 30 2.483 5.723 -14.885 207 HB3 SER 30 2HB SER 30 3.926 4.715 -15.137 208 HG SER 30 HG SER 30 1.178 3.995 -15.143 209 H GLN 31 H GLN 31 4.557 4.568 -11.075 210 HA GLN 31 HA GLN 31 6.880 3.250 -11.810 211 HB2 GLN 31 1HB GLN 31 6.379 4.550 -9.695 212 HB3 GLN 31 2HB GLN 31 5.517 3.159 -9.097 213 HG2 GLN 31 1HG GLN 31 7.374 2.229 -8.338 214 HG3 GLN 31 2HG GLN 31 8.122 2.251 -9.919 215 HE21 GLN 31 1HE2 GLN 31 7.814 4.019 -6.851 216 HE22 GLN 31 2HE2 GLN 31 9.179 5.058 -7.124 217 H THR 32 H THR 32 7.658 1.127 -11.727 218 HA THR 32 HA THR 32 5.670 -1.005 -11.110 219 HB THR 32 HB THR 32 6.465 -2.254 -12.962 220 HG1 THR 32 1HG THR 32 8.260 -0.091 -13.470 221 HG21 THR 32 3HG2 THR 32 5.666 -0.906 -14.829 222 HG22 THR 32 1HG2 THR 32 6.021 0.595 -13.977 223 HG23 THR 32 2HG2 THR 32 4.731 -0.482 -13.398 224 H LYS 33 H LYS 33 8.555 0.340 -9.979 225 HA LYS 33 HA LYS 33 9.252 -2.173 -8.599 226 HB2 LYS 33 1HB LYS 33 10.997 -0.712 -10.583 227 HB3 LYS 33 2HB LYS 33 11.756 -1.187 -9.086 228 HG2 LYS 33 1HG LYS 33 11.944 -3.291 -9.707 229 HG3 LYS 33 2HG LYS 33 10.220 -3.452 -9.991 230 HD2 LYS 33 1HD LYS 33 12.007 -2.212 -12.079 231 HD3 LYS 33 2HD LYS 33 11.838 -3.974 -11.932 232 HE2 LYS 33 1HE LYS 33 9.410 -3.825 -12.176 233 HE3 LYS 33 2HE LYS 33 9.494 -2.063 -12.146 234 HZ1 LYS 33 3HZ LYS 33 9.253 -2.772 -14.340 235 HZ2 LYS 33 1HZ LYS 33 10.579 -3.769 -14.286 236 HZ3 LYS 33 2HZ LYS 33 10.730 -2.124 -14.195 237 H ALA 34 H ALA 34 10.446 -1.835 -6.686 238 HA ALA 34 HA ALA 34 9.593 0.457 -5.244 239 HB1 ALA 34 1HB ALA 34 11.734 -1.682 -4.669 240 HB2 ALA 34 2HB ALA 34 11.148 -0.571 -3.441 241 HB3 ALA 34 3HB ALA 34 10.034 -1.735 -4.137 242 HA PRO 35 HA PRO 35 12.836 3.320 -5.908 243 HB2 PRO 35 1HB PRO 35 13.211 4.531 -3.479 244 HB3 PRO 35 2HB PRO 35 11.781 4.779 -4.516 245 HG2 PRO 35 1HG PRO 35 12.052 2.864 -2.172 246 HG3 PRO 35 2HG PRO 35 10.726 4.024 -2.497 247 HD2 PRO 35 1HD PRO 35 10.446 1.456 -3.190 248 HD3 PRO 35 2HD PRO 35 9.894 2.745 -4.292 249 H ASN 36 H ASN 36 13.384 1.003 -3.228 250 HA ASN 36 HA ASN 36 16.131 0.536 -3.999 251 HB2 ASN 36 1HB ASN 36 15.411 1.803 -1.308 252 HB3 ASN 36 2HB ASN 36 16.805 0.758 -1.488 253 HD21 ASN 36 1HD2 ASN 36 15.657 3.981 -1.964 254 HD22 ASN 36 2HD2 ASN 36 17.106 4.570 -2.769 255 H VAL 37 H VAL 37 16.890 -1.353 -2.574 256 HA VAL 37 HA VAL 37 14.843 -3.257 -2.050 257 HB VAL 37 HB VAL 37 16.694 -4.253 -2.668 258 HG11 VAL 37 1HG1 VAL 37 18.830 -4.210 -1.733 259 HG12 VAL 37 2HG1 VAL 37 18.276 -2.816 -2.646 260 HG13 VAL 37 3HG1 VAL 37 18.350 -2.690 -0.849 261 HG21 VAL 37 3HG2 VAL 37 15.625 -5.131 -0.414 262 HG22 VAL 37 1HG2 VAL 37 17.077 -5.880 -1.091 263 HG23 VAL 37 2HG2 VAL 37 17.193 -4.674 0.232 264 H LEU 38 H LEU 38 13.377 -2.914 -0.721 265 HA LEU 38 HA LEU 38 13.390 -1.654 1.803 266 HB2 LEU 38 1HB LEU 38 11.509 -3.794 0.735 267 HB3 LEU 38 2HB LEU 38 11.183 -2.644 2.025 268 HG LEU 38 HG LEU 38 11.520 -2.052 -0.944 269 HD11 LEU 38 1HD1 LEU 38 9.244 -1.140 -0.693 270 HD12 LEU 38 2HD1 LEU 38 9.195 -1.757 0.980 271 HD13 LEU 38 3HD1 LEU 38 9.352 -2.872 -0.411 272 HD21 LEU 38 3HD2 LEU 38 10.976 0.325 -0.350 273 HD22 LEU 38 1HD2 LEU 38 12.573 -0.219 0.103 274 HD23 LEU 38 2HD2 LEU 38 11.303 -0.090 1.359 275 H LYS 39 H LYS 39 14.984 -2.390 3.173 276 HA LYS 39 HA LYS 39 15.513 -5.244 3.543 277 HB2 LYS 39 1HB LYS 39 16.341 -3.046 5.466 278 HB3 LYS 39 2HB LYS 39 17.116 -4.607 5.190 279 HG2 LYS 39 1HG LYS 39 17.724 -3.794 2.865 280 HG3 LYS 39 2HG LYS 39 17.057 -2.218 3.314 281 HD2 LYS 39 1HD LYS 39 18.672 -2.523 5.437 282 HD3 LYS 39 2HD LYS 39 19.519 -3.622 4.322 283 HE2 LYS 39 1HE LYS 39 19.503 -1.725 2.635 284 HE3 LYS 39 2HE LYS 39 18.796 -0.688 3.901 285 HZ1 LYS 39 3HZ LYS 39 21.100 -0.309 3.947 286 HZ2 LYS 39 1HZ LYS 39 21.490 -1.903 3.835 287 HZ3 LYS 39 2HZ LYS 39 20.843 -1.282 5.226 288 H GLY 40 H GLY 40 15.481 -6.127 6.006 289 HA2 GLY 40 1HA GLY 40 14.287 -6.336 8.037 290 HA3 GLY 40 2HA GLY 40 13.049 -5.229 7.448 291 H ASN 41 H ASN 41 11.623 -7.044 8.228 292 HA ASN 41 HA ASN 41 11.073 -8.907 5.953 293 HB2 ASN 41 1HB ASN 41 12.021 -10.076 7.995 294 HB3 ASN 41 2HB ASN 41 10.532 -9.600 8.839 295 HD21 ASN 41 1HD2 ASN 41 8.603 -10.800 8.391 296 HD22 ASN 41 2HD2 ASN 41 8.475 -11.945 7.065 297 H LYS 42 H LYS 42 9.774 -6.504 8.167 298 HA LYS 42 HA LYS 42 7.019 -7.270 7.433 299 HB2 LYS 42 1HB LYS 42 8.185 -5.047 9.221 300 HB3 LYS 42 2HB LYS 42 6.462 -5.233 8.841 301 HG2 LYS 42 1HG LYS 42 8.156 -7.286 10.343 302 HG3 LYS 42 2HG LYS 42 6.956 -6.187 11.029 303 HD2 LYS 42 1HD LYS 42 5.220 -7.291 9.547 304 HD3 LYS 42 2HD LYS 42 6.427 -8.508 9.106 305 HE2 LYS 42 1HE LYS 42 6.388 -9.543 11.147 306 HE3 LYS 42 2HE LYS 42 6.146 -8.028 12.020 307 HZ1 LYS 42 3HZ LYS 42 4.013 -9.472 10.573 308 HZ2 LYS 42 1HZ LYS 42 3.852 -8.021 11.363 309 HZ3 LYS 42 2HZ LYS 42 4.198 -9.359 12.203 310 H LEU 43 H LEU 43 5.865 -5.998 5.991 311 HA LEU 43 HA LEU 43 7.369 -3.870 4.569 312 HB2 LEU 43 1HB LEU 43 6.567 -6.212 3.490 313 HB3 LEU 43 2HB LEU 43 5.035 -5.376 3.395 314 HG LEU 43 HG LEU 43 6.065 -5.113 1.339 315 HD11 LEU 43 1HD1 LEU 43 6.391 -2.796 0.992 316 HD12 LEU 43 2HD1 LEU 43 6.831 -2.519 2.675 317 HD13 LEU 43 3HD1 LEU 43 5.147 -2.967 2.246 318 HD21 LEU 43 3HD2 LEU 43 8.382 -5.708 1.952 319 HD22 LEU 43 1HD2 LEU 43 8.619 -4.063 2.600 320 HD23 LEU 43 2HD2 LEU 43 8.310 -4.334 0.888 321 H TYR 44 H TYR 44 6.448 -1.832 4.728 322 HA TYR 44 HA TYR 44 3.722 -1.607 5.903 323 HB2 TYR 44 1HB TYR 44 5.945 0.450 5.968 324 HB3 TYR 44 2HB TYR 44 4.376 0.549 6.747 325 HD1 TYR 44 1HD TYR 44 4.132 -2.063 8.186 326 HD2 TYR 44 2HD TYR 44 7.576 0.461 7.613 327 HE1 TYR 44 1HE TYR 44 5.161 -2.933 10.293 328 HE2 TYR 44 2HE TYR 44 8.585 -0.436 9.697 329 HH TYR 44 HH TYR 44 8.252 -1.795 11.628 330 H VAL 45 H VAL 45 2.234 -0.738 4.575 331 HA VAL 45 HA VAL 45 3.135 0.690 2.092 332 HB VAL 45 HB VAL 45 0.712 -1.147 2.320 333 HG11 VAL 45 1HG1 VAL 45 0.520 0.504 0.570 334 HG12 VAL 45 2HG1 VAL 45 2.204 0.162 0.074 335 HG13 VAL 45 3HG1 VAL 45 0.920 -1.060 -0.145 336 HG21 VAL 45 3HG2 VAL 45 3.452 -1.746 1.135 337 HG22 VAL 45 1HG2 VAL 45 2.773 -2.515 2.589 338 HG23 VAL 45 2HG2 VAL 45 1.992 -2.762 1.034 339 H LYS 46 H LYS 46 1.869 2.450 1.372 340 HA LYS 46 HA LYS 46 -0.032 3.543 3.353 341 HB2 LYS 46 1HB LYS 46 2.261 4.575 3.229 342 HB3 LYS 46 2HB LYS 46 1.966 5.009 1.564 343 HG2 LYS 46 1HG LYS 46 1.090 6.943 2.281 344 HG3 LYS 46 2HG LYS 46 -0.220 6.042 3.049 345 HD2 LYS 46 1HD LYS 46 0.374 6.696 4.996 346 HD3 LYS 46 2HD LYS 46 1.951 5.875 4.859 347 HE2 LYS 46 1HE LYS 46 2.924 7.872 3.869 348 HE3 LYS 46 2HE LYS 46 1.330 8.669 3.872 349 HZ1 LYS 46 3HZ LYS 46 2.140 9.494 5.796 350 HZ2 LYS 46 1HZ LYS 46 3.088 8.189 6.159 351 HZ3 LYS 46 2HZ LYS 46 1.443 8.175 6.395 352 H ALA 47 H ALA 47 -1.399 2.140 1.631 353 HA ALA 47 HA ALA 47 -1.529 3.170 -1.078 354 HB1 ALA 47 1HB ALA 47 -3.217 1.452 -1.435 355 HB2 ALA 47 2HB ALA 47 -1.802 0.815 -0.601 356 HB3 ALA 47 3HB ALA 47 -3.292 1.131 0.314 357 H ARG 48 H ARG 48 -2.424 5.121 -1.562 358 HA ARG 48 HA ARG 48 -4.412 6.386 0.118 359 HB2 ARG 48 1HB ARG 48 -2.768 7.640 -1.282 360 HB3 ARG 48 2HB ARG 48 -3.521 6.979 -2.738 361 HG2 ARG 48 1HG ARG 48 -4.640 8.933 -2.745 362 HG3 ARG 48 2HG ARG 48 -5.744 8.104 -1.662 363 HD2 ARG 48 1HD ARG 48 -5.257 10.204 -0.597 364 HD3 ARG 48 2HD ARG 48 -4.306 8.985 0.266 365 HE ARG 48 HE ARG 48 -2.409 10.066 -0.325 366 HH11 ARG 48 1HH1 ARG 48 -4.919 11.167 -2.670 367 HH12 ARG 48 2HH1 ARG 48 -3.889 12.363 -3.352 368 HH21 ARG 48 1HH2 ARG 48 -1.075 11.590 -1.340 369 HH22 ARG 48 2HH2 ARG 48 -1.610 12.485 -2.732 370 H PHE 49 H PHE 49 -6.510 5.628 0.168 371 HA PHE 49 HA PHE 49 -7.768 4.598 -2.345 372 HB2 PHE 49 1HB PHE 49 -8.701 4.480 0.539 373 HB3 PHE 49 2HB PHE 49 -9.619 3.903 -0.828 374 HD1 PHE 49 1HD PHE 49 -6.573 3.429 1.162 375 HD2 PHE 49 2HD PHE 49 -9.106 1.608 -1.816 376 HE1 PHE 49 1HE PHE 49 -5.310 1.341 1.393 377 HE2 PHE 49 2HE PHE 49 -8.076 -0.561 -1.360 378 HZ PHE 49 HZ PHE 49 -6.135 -0.727 0.216 379 H MET 50 H MET 50 -8.901 6.164 -3.401 380 HA MET 50 HA MET 50 -9.946 8.472 -1.830 381 HB2 MET 50 1HB MET 50 -9.682 8.489 -4.829 382 HB3 MET 50 2HB MET 50 -9.857 9.848 -3.746 383 HG2 MET 50 1HG MET 50 -7.405 8.186 -3.439 384 HG3 MET 50 2HG MET 50 -7.535 9.106 -4.922 385 HE1 MET 50 3HE MET 50 -7.588 11.044 -0.699 386 HE2 MET 50 1HE MET 50 -9.071 10.553 -1.556 387 HE3 MET 50 2HE MET 50 -7.889 9.325 -1.027 388 H GLY 51 H GLY 51 -12.041 8.401 -1.575 389 HA2 GLY 51 1HA GLY 51 -14.400 8.011 -2.219 390 HA3 GLY 51 2HA GLY 51 -13.844 6.826 -3.383 391 H TYR 52 H TYR 52 -15.882 6.227 -1.550 392 HA TYR 52 HA TYR 52 -14.884 4.942 0.844 393 HB2 TYR 52 1HB TYR 52 -17.479 5.529 -0.378 394 HB3 TYR 52 2HB TYR 52 -17.446 3.904 0.218 395 HD1 TYR 52 2HD TYR 52 -16.911 3.448 2.694 396 HD2 TYR 52 1HD TYR 52 -17.570 7.397 1.086 397 HE1 TYR 52 2HE TYR 52 -17.432 4.292 4.955 398 HE2 TYR 52 1HE TYR 52 -18.107 8.250 3.324 399 HH TYR 52 HH TYR 52 -17.966 6.095 6.239 400 H THR 53 H THR 53 -14.183 2.924 1.083 401 HA THR 53 HA THR 53 -15.162 0.589 0.112 402 HB THR 53 HB THR 53 -12.747 1.545 -1.434 403 HG1 THR 53 1HG THR 53 -14.990 1.634 -2.209 404 HG21 THR 53 3HG2 THR 53 -13.538 -1.320 -0.867 405 HG22 THR 53 1HG2 THR 53 -11.930 -0.553 -0.711 406 HG23 THR 53 2HG2 THR 53 -12.621 -0.835 -2.304 407 H LYS 54 H LYS 54 -14.989 -0.124 2.133 408 HA LYS 54 HA LYS 54 -12.375 -0.117 3.520 409 HB2 LYS 54 1HB LYS 54 -15.227 -0.891 4.180 410 HB3 LYS 54 2HB LYS 54 -13.898 -1.416 5.227 411 HG2 LYS 54 1HG LYS 54 -14.124 1.504 4.430 412 HG3 LYS 54 2HG LYS 54 -15.217 0.853 5.630 413 HD2 LYS 54 1HD LYS 54 -12.247 0.393 5.995 414 HD3 LYS 54 2HD LYS 54 -12.963 1.966 6.386 415 HE2 LYS 54 1HE LYS 54 -14.670 0.873 7.785 416 HE3 LYS 54 2HE LYS 54 -13.924 -0.701 7.486 417 HZ1 LYS 54 3HZ LYS 54 -11.980 0.042 8.621 418 HZ2 LYS 54 1HZ LYS 54 -13.303 0.281 9.579 419 HZ3 LYS 54 2HZ LYS 54 -12.579 1.569 8.830 420 H LEU 55 H LEU 55 -13.846 -2.006 1.154 421 HA LEU 55 HA LEU 55 -13.221 -4.626 2.246 422 HB2 LEU 55 1HB LEU 55 -14.552 -3.597 -0.291 423 HB3 LEU 55 2HB LEU 55 -14.194 -5.293 -0.062 424 HG LEU 55 HG LEU 55 -16.496 -4.835 0.407 425 HD11 LEU 55 1HD1 LEU 55 -16.709 -6.064 2.469 426 HD12 LEU 55 2HD1 LEU 55 -15.074 -5.598 2.991 427 HD13 LEU 55 3HD1 LEU 55 -15.298 -6.667 1.593 428 HD21 LEU 55 3HD2 LEU 55 -16.305 -2.512 1.293 429 HD22 LEU 55 1HD2 LEU 55 -15.706 -3.178 2.830 430 HD23 LEU 55 2HD2 LEU 55 -17.338 -3.569 2.254 431 H THR 56 H THR 56 -10.803 -3.684 2.281 432 HA THR 56 HA THR 56 -9.349 -3.844 -0.183 433 HB THR 56 HB THR 56 -8.173 -4.467 2.537 434 HG1 THR 56 1HG THR 56 -9.242 -1.945 1.777 435 HG21 THR 56 3HG2 THR 56 -6.324 -3.031 1.696 436 HG22 THR 56 1HG2 THR 56 -7.219 -2.797 0.181 437 HG23 THR 56 2HG2 THR 56 -6.646 -4.414 0.648 438 H VAL 57 H VAL 57 -8.106 -5.632 -1.056 439 HA VAL 57 HA VAL 57 -7.938 -8.086 0.531 440 HB VAL 57 HB VAL 57 -8.669 -7.967 -2.428 441 HG11 VAL 57 1HG1 VAL 57 -7.813 -10.331 -0.685 442 HG12 VAL 57 2HG1 VAL 57 -8.753 -10.527 -2.167 443 HG13 VAL 57 3HG1 VAL 57 -7.157 -9.816 -2.258 444 HG21 VAL 57 3HG2 VAL 57 -10.637 -7.682 -0.985 445 HG22 VAL 57 1HG2 VAL 57 -10.658 -9.279 -1.745 446 HG23 VAL 57 2HG2 VAL 57 -10.183 -9.126 -0.048 447 H ILE 58 H ILE 58 -6.029 -9.257 0.006 448 HA ILE 58 HA ILE 58 -3.976 -8.105 -1.721 449 HB ILE 58 HB ILE 58 -3.472 -8.809 1.222 450 HG12 ILE 58 1HG1 ILE 58 -3.478 -6.100 -0.161 451 HG13 ILE 58 2HG1 ILE 58 -4.588 -6.642 1.094 452 HG21 ILE 58 1HG2 ILE 58 -1.635 -9.423 -0.375 453 HG22 ILE 58 2HG2 ILE 58 -1.552 -7.731 -0.892 454 HG23 ILE 58 3HG2 ILE 58 -1.150 -8.193 0.780 455 HD11 ILE 58 3HD1 ILE 58 -3.080 -5.195 2.168 456 HD12 ILE 58 1HD1 ILE 58 -2.627 -6.835 2.675 457 HD13 ILE 58 2HD1 ILE 58 -1.671 -5.975 1.436 458 H THR 59 H THR 59 -3.849 -10.028 -3.092 459 HA THR 59 HA THR 59 -5.195 -12.303 -2.242 460 HB THR 59 HB THR 59 -3.523 -12.923 -4.489 461 HG1 THR 59 1HG THR 59 -3.786 -11.245 -5.830 462 HG21 THR 59 3HG2 THR 59 -5.949 -13.533 -4.188 463 HG22 THR 59 1HG2 THR 59 -5.580 -12.860 -5.781 464 HG23 THR 59 2HG2 THR 59 -6.378 -11.855 -4.544 465 H GLY 60 H GLY 60 -1.715 -11.644 -2.538 466 HA2 GLY 60 1HA GLY 60 -0.016 -12.564 -1.178 467 HA3 GLY 60 2HA GLY 60 -1.111 -13.830 -0.621 468 H LYS 61 H LYS 61 -0.035 -15.617 -1.080 469 HA LYS 61 HA LYS 61 1.323 -15.960 -3.618 470 HB2 LYS 61 1HB LYS 61 0.754 -17.997 -1.437 471 HB3 LYS 61 2HB LYS 61 1.823 -18.229 -2.830 472 HG2 LYS 61 1HG LYS 61 2.884 -15.964 -1.809 473 HG3 LYS 61 2HG LYS 61 2.226 -16.648 -0.325 474 HD2 LYS 61 1HD LYS 61 3.646 -18.501 -0.400 475 HD3 LYS 61 2HD LYS 61 3.994 -18.296 -2.113 476 HE2 LYS 61 1HE LYS 61 4.803 -15.959 -0.450 477 HE3 LYS 61 2HE LYS 61 5.606 -17.480 0.002 478 HZ1 LYS 61 3HZ LYS 61 5.620 -16.142 -2.614 479 HZ2 LYS 61 1HZ LYS 61 6.245 -17.666 -2.389 480 HZ3 LYS 61 2HZ LYS 61 6.878 -16.340 -1.640 481 H ASP 62 H ASP 62 -1.059 -18.180 -2.289 482 HA ASP 62 HA ASP 62 -1.966 -18.614 -5.068 483 HB2 ASP 62 1HB ASP 62 -1.163 -20.405 -3.028 484 HB3 ASP 62 2HB ASP 62 -2.903 -20.634 -3.167 485 H GLY 63 H GLY 63 -2.777 -16.338 -3.688 486 HA2 GLY 63 1HA GLY 63 -4.627 -15.048 -3.531 487 HA3 GLY 63 2HA GLY 63 -5.428 -16.266 -4.537 488 H LYS 64 H LYS 64 -4.198 -16.435 -1.162 489 HA LYS 64 HA LYS 64 -6.955 -17.248 -0.312 490 HB2 LYS 64 1HB LYS 64 -4.299 -18.036 0.926 491 HB3 LYS 64 2HB LYS 64 -5.906 -18.405 1.558 492 HG2 LYS 64 1HG LYS 64 -6.443 -19.463 -0.692 493 HG3 LYS 64 2HG LYS 64 -4.717 -19.411 -1.052 494 HD2 LYS 64 1HD LYS 64 -4.176 -20.925 0.679 495 HD3 LYS 64 2HD LYS 64 -5.674 -20.643 1.546 496 HE2 LYS 64 1HE LYS 64 -5.413 -22.130 -1.096 497 HE3 LYS 64 2HE LYS 64 -5.602 -22.867 0.496 498 HZ1 LYS 64 3HZ LYS 64 -7.760 -21.560 0.605 499 HZ2 LYS 64 1HZ LYS 64 -7.716 -22.844 -0.402 500 HZ3 LYS 64 2HZ LYS 64 -7.572 -21.337 -1.035 501 H ASN 65 H ASN 65 -5.378 -14.551 -0.444 502 HA ASN 65 HA ASN 65 -5.999 -12.523 0.306 503 HB2 ASN 65 1HB ASN 65 -8.255 -13.786 0.510 504 HB3 ASN 65 2HB ASN 65 -7.974 -13.680 2.246 505 HD21 ASN 65 1HD2 ASN 65 -7.192 -11.215 2.820 506 HD22 ASN 65 2HD2 ASN 65 -8.423 -10.085 2.267 507 H LEU 66 H LEU 66 -3.950 -12.123 1.308 508 HA LEU 66 HA LEU 66 -3.077 -13.299 3.684 509 HB2 LEU 66 1HB LEU 66 -2.296 -10.541 2.665 510 HB3 LEU 66 2HB LEU 66 -1.409 -11.532 3.828 511 HG LEU 66 HG LEU 66 -1.854 -12.104 0.869 512 HD11 LEU 66 1HD1 LEU 66 0.613 -11.629 2.624 513 HD12 LEU 66 2HD1 LEU 66 -0.066 -10.498 1.432 514 HD13 LEU 66 3HD1 LEU 66 0.661 -12.023 0.902 515 HD21 LEU 66 3HD2 LEU 66 -0.355 -14.149 1.348 516 HD22 LEU 66 1HD2 LEU 66 -2.025 -14.275 1.874 517 HD23 LEU 66 2HD2 LEU 66 -0.732 -13.928 3.048 518 H LEU 67 H LEU 67 -5.073 -10.375 3.338 519 HA LEU 67 HA LEU 67 -4.922 -9.531 6.048 520 HB2 LEU 67 1HB LEU 67 -7.001 -9.152 3.881 521 HB3 LEU 67 2HB LEU 67 -7.156 -8.420 5.462 522 HG LEU 67 HG LEU 67 -4.763 -7.920 3.655 523 HD11 LEU 67 1HD1 LEU 67 -6.803 -7.162 2.512 524 HD12 LEU 67 2HD1 LEU 67 -5.868 -5.767 3.082 525 HD13 LEU 67 3HD1 LEU 67 -7.323 -6.287 3.961 526 HD21 LEU 67 3HD2 LEU 67 -5.853 -6.333 6.028 527 HD22 LEU 67 1HD2 LEU 67 -4.403 -5.961 5.062 528 HD23 LEU 67 2HD2 LEU 67 -4.440 -7.399 6.088 529 H TYR 68 H TYR 68 -6.535 -12.328 4.672 530 HA TYR 68 HA TYR 68 -8.045 -12.744 7.174 531 HB2 TYR 68 1HB TYR 68 -9.326 -12.510 5.058 532 HB3 TYR 68 2HB TYR 68 -8.383 -13.826 4.361 533 HD1 TYR 68 1HD TYR 68 -10.440 -13.159 7.447 534 HD2 TYR 68 2HD TYR 68 -9.319 -15.952 4.351 535 HE1 TYR 68 1HE TYR 68 -11.879 -14.865 8.464 536 HE2 TYR 68 2HE TYR 68 -10.761 -17.685 5.409 537 HH TYR 68 HH TYR 68 -11.830 -17.274 8.586 538 H ASN 69 H ASN 69 -5.201 -13.749 5.467 539 HA ASN 69 HA ASN 69 -4.983 -16.457 6.472 540 HB2 ASN 69 1HB ASN 69 -3.033 -14.357 5.557 541 HB3 ASN 69 2HB ASN 69 -2.420 -15.539 6.682 542 HD21 ASN 69 1HD2 ASN 69 -2.978 -17.982 6.144 543 HD22 ASN 69 2HD2 ASN 69 -2.822 -18.329 4.436 544 H GLY 70 H GLY 70 -3.813 -13.323 7.666 545 HA2 GLY 70 1HA GLY 70 -4.475 -13.107 10.213 546 HA3 GLY 70 2HA GLY 70 -3.297 -14.415 10.358 547 H THR 71 H THR 71 -1.551 -13.364 8.105 548 HA THR 71 HA THR 71 0.077 -11.930 9.957 549 HB THR 71 HB THR 71 0.740 -12.163 7.023 550 HG1 THR 71 1HG THR 71 0.538 -14.238 8.930 551 HG21 THR 71 3HG2 THR 71 2.984 -12.626 7.876 552 HG22 THR 71 1HG2 THR 71 2.396 -12.459 9.541 553 HG23 THR 71 2HG2 THR 71 2.385 -11.053 8.434 554 H ALA 72 H ALA 72 -1.175 -10.933 6.718 555 HA ALA 72 HA ALA 72 -0.427 -8.122 7.164 556 HB1 ALA 72 1HB ALA 72 -1.751 -7.698 5.125 557 HB2 ALA 72 2HB ALA 72 -0.661 -9.076 4.839 558 HB3 ALA 72 3HB ALA 72 -2.388 -9.352 5.162 559 H LYS 73 H LYS 73 -1.408 -6.767 8.362 560 HA LYS 73 HA LYS 73 -4.294 -6.979 8.958 561 HB2 LYS 73 1HB LYS 73 -3.162 -8.331 10.641 562 HB3 LYS 73 2HB LYS 73 -1.969 -7.072 10.960 563 HG2 LYS 73 1HG LYS 73 -3.463 -5.694 12.003 564 HG3 LYS 73 2HG LYS 73 -4.907 -6.468 11.324 565 HD2 LYS 73 1HD LYS 73 -3.061 -7.784 13.366 566 HD3 LYS 73 2HD LYS 73 -4.583 -6.958 13.770 567 HE2 LYS 73 1HE LYS 73 -5.780 -8.565 12.222 568 HE3 LYS 73 2HE LYS 73 -4.250 -9.425 12.006 569 HZ1 LYS 73 3HZ LYS 73 -4.265 -9.778 14.460 570 HZ2 LYS 73 1HZ LYS 73 -5.474 -10.522 13.633 571 HZ3 LYS 73 2HZ LYS 73 -5.840 -9.180 14.460 572 H MET 74 H MET 74 -5.061 -4.845 9.769 573 HA MET 74 HA MET 74 -3.176 -2.660 9.069 574 HB2 MET 74 1HB MET 74 -4.912 -1.147 9.136 575 HB3 MET 74 2HB MET 74 -5.359 -2.484 8.065 576 HG2 MET 74 1HG MET 74 -6.948 -3.290 9.637 577 HG3 MET 74 2HG MET 74 -6.303 -2.274 10.941 578 HE1 MET 74 3HE MET 74 -6.389 -0.532 7.594 579 HE2 MET 74 1HE MET 74 -7.636 -1.759 7.231 580 HE3 MET 74 2HE MET 74 -8.089 -0.040 7.348 581 H PHE 75 H PHE 75 -2.616 -1.119 10.502 582 HA PHE 75 HA PHE 75 -3.345 -1.500 13.353 583 HB2 PHE 75 1HB PHE 75 -0.990 -1.288 13.948 584 HB3 PHE 75 2HB PHE 75 -1.275 -2.705 12.962 585 HD1 PHE 75 2HD PHE 75 -0.508 -2.759 10.561 586 HD2 PHE 75 1HD PHE 75 0.401 0.504 13.208 587 HE1 PHE 75 2HE PHE 75 1.380 -2.058 9.080 588 HE2 PHE 75 1HE PHE 75 2.287 1.189 11.735 589 HZ PHE 75 HZ PHE 75 2.802 -0.175 9.693 590 H LYS 76 H LYS 76 -3.690 0.706 10.822 591 HA LYS 76 HA LYS 76 -3.674 2.903 12.716 592 HB2 LYS 76 1HB LYS 76 -1.257 2.779 12.210 593 HB3 LYS 76 2HB LYS 76 -1.589 2.780 10.492 594 HG2 LYS 76 1HG LYS 76 -2.504 5.114 10.715 595 HG3 LYS 76 2HG LYS 76 -2.066 5.070 12.440 596 HD2 LYS 76 1HD LYS 76 0.289 4.753 11.904 597 HD3 LYS 76 2HD LYS 76 -0.069 4.495 10.207 598 HE2 LYS 76 1HE LYS 76 0.779 6.667 10.278 599 HE3 LYS 76 2HE LYS 76 -0.964 6.878 10.104 600 HZ1 LYS 76 3HZ LYS 76 -1.104 7.390 12.425 601 HZ2 LYS 76 1HZ LYS 76 0.062 8.345 11.762 602 HZ3 LYS 76 2HZ LYS 76 0.504 7.076 12.666 603 H SER 77 H SER 77 -5.165 4.516 11.806 604 HA SER 77 HA SER 77 -5.777 4.417 8.977 605 HB2 SER 77 1HB SER 77 -8.081 3.734 9.151 606 HB3 SER 77 2HB SER 77 -7.060 2.467 9.809 607 HG SER 77 HG SER 77 -7.644 3.105 11.918 608 H ASP 78 H ASP 78 -5.718 6.680 8.605 609 HA ASP 78 HA ASP 78 -6.838 8.460 10.756 610 HB2 ASP 78 1HB ASP 78 -4.188 8.343 9.863 611 HB3 ASP 78 2HB ASP 78 -4.848 9.617 8.885 612 H ALA 79 H ALA 79 -6.773 10.719 9.183 613 HA ALA 79 HA ALA 79 -8.714 10.107 7.030 614 HB1 ALA 79 1HB ALA 79 -9.785 12.329 7.659 615 HB2 ALA 79 2HB ALA 79 -9.910 11.068 8.884 616 HB3 ALA 79 3HB ALA 79 -8.713 12.371 9.074 617 H ILE 80 H ILE 80 -8.769 11.667 5.319 618 HA ILE 80 HA ILE 80 -6.358 13.354 4.889 619 HB ILE 80 HB ILE 80 -7.727 11.584 2.807 620 HG12 ILE 80 1HG1 ILE 80 -5.050 11.183 4.178 621 HG13 ILE 80 2HG1 ILE 80 -6.469 10.162 4.328 622 HG21 ILE 80 1HG2 ILE 80 -6.832 13.711 1.928 623 HG22 ILE 80 2HG2 ILE 80 -5.222 13.284 2.553 624 HG23 ILE 80 3HG2 ILE 80 -6.005 12.321 1.265 625 HD11 ILE 80 3HD1 ILE 80 -4.734 10.510 1.896 626 HD12 ILE 80 1HD1 ILE 80 -5.133 9.037 2.780 627 HD13 ILE 80 2HD1 ILE 80 -6.373 9.800 1.792 628 H LEU 81 H LEU 81 -7.087 15.410 4.638 629 HA LEU 81 HA LEU 81 -9.854 15.791 3.665 630 HB2 LEU 81 1HB LEU 81 -7.876 17.918 4.481 631 HB3 LEU 81 2HB LEU 81 -9.607 18.094 4.099 632 HG LEU 81 HG LEU 81 -8.340 16.864 6.559 633 HD11 LEU 81 1HD1 LEU 81 -10.426 19.051 6.227 634 HD12 LEU 81 2HD1 LEU 81 -8.687 19.291 6.529 635 HD13 LEU 81 3HD1 LEU 81 -9.685 18.498 7.748 636 HD21 LEU 81 3HD2 LEU 81 -11.105 16.301 5.462 637 HD22 LEU 81 1HD2 LEU 81 -10.890 16.505 7.217 638 HD23 LEU 81 2HD2 LEU 81 -9.928 15.310 6.387 639 H GLY 82 H GLY 82 -10.307 16.704 1.677 640 HA2 GLY 82 1HA GLY 82 -8.048 17.177 -0.225 641 HA3 GLY 82 2HA GLY 82 -9.775 17.079 -0.634 642 H GLN 83 H GLN 83 -8.431 19.287 -1.477 643 HA GLN 83 HA GLN 83 -7.900 21.254 0.442 644 HB2 GLN 83 1HB GLN 83 -8.244 21.903 -2.491 645 HB3 GLN 83 2HB GLN 83 -7.128 22.587 -1.305 646 HG2 GLN 83 1HG GLN 83 -6.247 20.052 -1.217 647 HG3 GLN 83 2HG GLN 83 -6.996 20.000 -2.823 648 HE21 GLN 83 1HE2 GLN 83 -4.024 20.018 -1.687 649 HE22 GLN 83 2HE2 GLN 83 -3.258 21.222 -2.693 650 H ASN 84 H ASN 84 -10.808 20.437 0.202 651 HA ASN 84 HA ASN 84 -11.863 23.091 0.827 652 HB2 ASN 84 1HB ASN 84 -14.052 22.660 -0.208 653 HB3 ASN 84 2HB ASN 84 -12.759 22.846 -1.387 654 HD21 ASN 84 1HD2 ASN 84 -11.972 20.959 -2.527 655 HD22 ASN 84 2HD2 ASN 84 -12.915 19.517 -2.655 656 H LYS 85 H LYS 85 -10.760 20.834 2.377 657 HA LYS 85 HA LYS 85 -11.080 19.730 4.211 658 HB2 LYS 85 1HB LYS 85 -13.447 21.584 4.591 659 HB3 LYS 85 2HB LYS 85 -12.821 20.495 5.829 660 HG2 LYS 85 1HG LYS 85 -10.672 21.538 5.852 661 HG3 LYS 85 2HG LYS 85 -11.060 22.590 4.489 662 HD2 LYS 85 1HD LYS 85 -12.652 22.645 7.078 663 HD3 LYS 85 2HD LYS 85 -11.183 23.595 6.884 664 HE2 LYS 85 1HE LYS 85 -13.486 23.763 4.895 665 HE3 LYS 85 2HE LYS 85 -13.438 24.741 6.358 666 HZ1 LYS 85 3HZ LYS 85 -12.541 25.900 4.456 667 HZ2 LYS 85 1HZ LYS 85 -11.290 24.812 4.313 668 HZ3 LYS 85 2HZ LYS 85 -11.421 25.758 5.635 669 H VAL 86 H VAL 86 -12.462 18.815 1.722 670 HA VAL 86 HA VAL 86 -14.755 17.273 2.473 671 HB VAL 86 HB VAL 86 -14.806 18.020 0.363 672 HG11 VAL 86 1HG1 VAL 86 -12.672 18.711 -0.030 673 HG12 VAL 86 2HG1 VAL 86 -11.989 17.109 0.224 674 HG13 VAL 86 3HG1 VAL 86 -12.908 17.473 -1.275 675 HG21 VAL 86 3HG2 VAL 86 -13.923 15.133 -0.038 676 HG22 VAL 86 1HG2 VAL 86 -15.542 15.637 0.492 677 HG23 VAL 86 2HG2 VAL 86 -14.944 16.094 -1.109 678 H VAL 87 H VAL 87 -14.850 14.908 2.779 679 HA VAL 87 HA VAL 87 -12.338 13.730 3.661 680 HB VAL 87 HB VAL 87 -15.084 12.399 3.433 681 HG11 VAL 87 1HG1 VAL 87 -14.304 10.855 5.072 682 HG12 VAL 87 2HG1 VAL 87 -12.960 10.969 3.923 683 HG13 VAL 87 3HG1 VAL 87 -12.889 11.834 5.463 684 HG21 VAL 87 3HG2 VAL 87 -15.462 14.360 4.823 685 HG22 VAL 87 1HG2 VAL 87 -15.405 12.910 5.828 686 HG23 VAL 87 2HG2 VAL 87 -14.011 14.015 5.784 687 H ILE 88 H ILE 88 -11.269 13.895 1.502 688 HA ILE 88 HA ILE 88 -12.450 12.648 -0.815 689 HB ILE 88 HB ILE 88 -10.157 12.721 -1.803 690 HG12 ILE 88 1HG1 ILE 88 -9.293 14.153 0.735 691 HG13 ILE 88 2HG1 ILE 88 -8.854 12.505 0.342 692 HG21 ILE 88 1HG2 ILE 88 -10.234 15.162 -2.032 693 HG22 ILE 88 2HG2 ILE 88 -11.873 14.509 -1.979 694 HG23 ILE 88 3HG2 ILE 88 -11.186 15.269 -0.532 695 HD11 ILE 88 3HD1 ILE 88 -7.845 13.329 -1.835 696 HD12 ILE 88 1HD1 ILE 88 -8.103 14.985 -1.257 697 HD13 ILE 88 2HD1 ILE 88 -7.028 13.898 -0.375 698 H GLY 89 H GLY 89 -10.583 11.296 1.841 699 HA2 GLY 89 1HA GLY 89 -11.187 8.603 1.294 700 HA3 GLY 89 2HA GLY 89 -9.622 8.993 0.535 701 H TRP 90 H TRP 90 -8.852 7.347 2.266 702 HA TRP 90 HA TRP 90 -8.149 8.775 4.761 703 HB2 TRP 90 1HB TRP 90 -9.341 6.009 4.534 704 HB3 TRP 90 2HB TRP 90 -8.658 6.692 6.014 705 HD1 TRP 90 HD TRP 90 -10.294 8.438 7.282 706 HE1 TRP 90 1HE TRP 90 -12.696 9.211 6.905 707 HE3 TRP 90 3HE TRP 90 -11.218 6.112 2.840 708 HZ2 TRP 90 2HZ TRP 90 -14.888 8.634 5.059 709 HZ3 TRP 90 3HZ TRP 90 -13.419 6.362 1.721 710 HH2 TRP 90 HH TRP 90 -15.237 7.629 2.820 711 H ASP 91 H ASP 91 -6.009 7.864 5.608 712 HA ASP 91 HA ASP 91 -4.558 6.699 3.324 713 HB2 ASP 91 1HB ASP 91 -3.949 8.738 5.200 714 HB3 ASP 91 2HB ASP 91 -2.879 7.391 5.568 715 H LYS 92 H LYS 92 -5.000 4.531 3.338 716 HA LYS 92 HA LYS 92 -5.398 3.243 5.955 717 HB2 LYS 92 1HB LYS 92 -6.271 2.712 3.210 718 HB3 LYS 92 2HB LYS 92 -5.802 1.252 4.067 719 HG2 LYS 92 1HG LYS 92 -8.248 1.905 4.138 720 HG3 LYS 92 2HG LYS 92 -7.493 1.462 5.656 721 HD2 LYS 92 1HD LYS 92 -7.384 3.801 6.370 722 HD3 LYS 92 2HD LYS 92 -7.916 4.325 4.752 723 HE2 LYS 92 1HE LYS 92 -10.066 3.319 5.059 724 HE3 LYS 92 2HE LYS 92 -9.547 2.406 6.484 725 HZ1 LYS 92 3HZ LYS 92 -9.439 4.675 7.609 726 HZ2 LYS 92 1HZ LYS 92 -10.897 4.092 7.216 727 HZ3 LYS 92 2HZ LYS 92 -10.224 5.257 6.283 728 H TYR 93 H TYR 93 -3.862 2.209 7.056 729 HA TYR 93 HA TYR 93 -1.326 1.571 5.675 730 HB2 TYR 93 1HB TYR 93 -2.129 1.863 8.584 731 HB3 TYR 93 2HB TYR 93 -0.516 1.487 8.046 732 HD1 TYR 93 2HD TYR 93 -3.070 4.182 8.260 733 HD2 TYR 93 1HD TYR 93 0.909 3.180 6.926 734 HE1 TYR 93 2HE TYR 93 -2.510 6.569 8.148 735 HE2 TYR 93 1HE TYR 93 1.500 5.551 6.917 736 HH TYR 93 HH TYR 93 -0.822 8.196 7.378 737 H PHE 94 H PHE 94 -0.410 -0.502 5.868 738 HA PHE 94 HA PHE 94 -1.875 -2.696 7.237 739 HB2 PHE 94 1HB PHE 94 -0.953 -2.709 4.330 740 HB3 PHE 94 2HB PHE 94 -1.639 -4.083 5.192 741 HD1 PHE 94 1HD PHE 94 -4.043 -3.920 6.074 742 HD2 PHE 94 2HD PHE 94 -2.391 -1.036 3.310 743 HE1 PHE 94 1HE PHE 94 -6.336 -3.227 5.419 744 HE2 PHE 94 2HE PHE 94 -4.673 -0.363 2.669 745 HZ PHE 94 HZ PHE 94 -6.656 -1.436 3.733 746 H GLU 95 H GLU 95 -0.521 -4.487 7.841 747 HA GLU 95 HA GLU 95 2.408 -4.081 7.524 748 HB2 GLU 95 1HB GLU 95 1.091 -4.165 9.785 749 HB3 GLU 95 2HB GLU 95 1.052 -5.866 9.603 750 HG2 GLU 95 1HG GLU 95 3.532 -5.916 9.276 751 HG3 GLU 95 2HG GLU 95 3.579 -4.166 9.445 752 H ILE 96 H ILE 96 2.592 -5.230 5.405 753 HA ILE 96 HA ILE 96 1.474 -7.946 5.412 754 HB ILE 96 HB ILE 96 2.896 -6.420 3.221 755 HG12 ILE 96 1HG1 ILE 96 0.102 -6.520 2.697 756 HG13 ILE 96 2HG1 ILE 96 0.173 -6.035 4.361 757 HG21 ILE 96 1HG2 ILE 96 1.739 -7.910 1.692 758 HG22 ILE 96 2HG2 ILE 96 2.703 -8.871 2.798 759 HG23 ILE 96 3HG2 ILE 96 0.948 -8.763 3.027 760 HD11 ILE 96 3HD1 ILE 96 0.138 -4.131 2.808 761 HD12 ILE 96 1HD1 ILE 96 1.615 -4.149 3.799 762 HD13 ILE 96 2HD1 ILE 96 1.662 -4.696 2.099 763 HA PRO 97 HA PRO 97 5.563 -9.991 6.133 764 HB2 PRO 97 1HB PRO 97 5.038 -12.268 4.628 765 HB3 PRO 97 2HB PRO 97 4.509 -12.032 6.309 766 HG2 PRO 97 1HG PRO 97 2.954 -11.598 3.769 767 HG3 PRO 97 2HG PRO 97 2.421 -12.446 5.265 768 HD2 PRO 97 1HD PRO 97 1.742 -9.930 4.746 769 HD3 PRO 97 2HD PRO 97 2.153 -10.361 6.408 770 H MET 98 H MET 98 7.305 -10.399 4.935 771 HA MET 98 HA MET 98 7.334 -9.653 2.047 772 HB2 MET 98 1HB MET 98 9.506 -9.943 4.170 773 HB3 MET 98 2HB MET 98 9.884 -9.830 2.455 774 HG2 MET 98 1HG MET 98 8.915 -7.678 2.243 775 HG3 MET 98 2HG MET 98 8.415 -7.668 3.955 776 HE1 MET 98 3HE MET 98 10.739 -5.290 2.718 777 HE2 MET 98 1HE MET 98 9.528 -5.463 4.007 778 HE3 MET 98 2HE MET 98 11.231 -5.230 4.435 779 H ASP 99 H ASP 99 6.829 -12.459 3.763 780 HA ASP 99 HA ASP 99 8.217 -14.084 1.683 781 HB2 ASP 99 1HB ASP 99 8.993 -13.911 4.276 782 HB3 ASP 99 2HB ASP 99 7.899 -15.280 4.386 783 H ALA 100 H ALA 100 5.335 -13.122 2.045 784 HA ALA 100 HA ALA 100 4.071 -15.775 1.550 785 HB1 ALA 100 1HB ALA 100 2.674 -13.740 3.264 786 HB2 ALA 100 2HB ALA 100 2.199 -15.402 2.920 787 HB3 ALA 100 3HB ALA 100 3.623 -15.099 3.929 788 H LEU 101 H LEU 101 4.792 -13.088 -0.029 789 HA LEU 101 HA LEU 101 2.159 -12.725 -1.376 790 HB2 LEU 101 1HB LEU 101 4.852 -11.398 -1.805 791 HB3 LEU 101 2HB LEU 101 3.392 -10.976 -2.676 792 HG LEU 101 HG LEU 101 3.491 -10.804 0.369 793 HD11 LEU 101 1HD1 LEU 101 4.009 -8.381 -1.282 794 HD12 LEU 101 2HD1 LEU 101 5.348 -9.459 -0.845 795 HD13 LEU 101 3HD1 LEU 101 4.354 -8.739 0.430 796 HD21 LEU 101 3HD2 LEU 101 1.861 -9.285 -1.723 797 HD22 LEU 101 1HD2 LEU 101 1.628 -9.257 0.031 798 HD23 LEU 101 2HD2 LEU 101 1.278 -10.721 -0.887 799 H GLN 102 H GLN 102 1.939 -13.295 -3.575 800 HA GLN 102 HA GLN 102 3.072 -15.596 -4.476 801 HB2 GLN 102 1HB GLN 102 1.148 -14.185 -5.544 802 HB3 GLN 102 2HB GLN 102 2.415 -13.430 -6.497 803 HG2 GLN 102 1HG GLN 102 3.042 -15.628 -7.402 804 HG3 GLN 102 2HG GLN 102 1.900 -16.436 -6.319 805 HE21 GLN 102 1HE2 GLN 102 -0.417 -16.220 -6.745 806 HE22 GLN 102 2HE2 GLN 102 -0.964 -15.777 -8.348 807 H ASP 103 H ASP 103 4.718 -12.488 -4.739 808 HA ASP 103 HA ASP 103 7.103 -13.934 -5.085 809 HB2 ASP 103 1HB ASP 103 6.139 -13.523 -7.530 810 HB3 ASP 103 2HB ASP 103 6.773 -11.896 -7.304 811 H ASN 104 H ASN 104 8.922 -11.934 -5.507 812 HA ASN 104 HA ASN 104 8.565 -10.195 -3.195 813 HB2 ASN 104 1HB ASN 104 10.788 -10.348 -5.259 814 HB3 ASN 104 2HB ASN 104 10.764 -9.234 -3.894 815 HD21 ASN 104 1HD2 ASN 104 12.941 -10.486 -3.677 816 HD22 ASN 104 2HD2 ASN 104 12.879 -11.934 -2.711 817 H SER 105 H SER 105 6.516 -9.340 -4.188 818 HA SER 105 HA SER 105 7.174 -6.620 -4.973 819 HB2 SER 105 1HB SER 105 4.896 -7.646 -6.435 820 HB3 SER 105 2HB SER 105 5.950 -6.444 -6.959 821 HG SER 105 HG SER 105 7.255 -8.201 -7.792 822 H ILE 106 H ILE 106 5.238 -5.213 -4.647 823 HA ILE 106 HA ILE 106 3.245 -6.390 -2.801 824 HB ILE 106 HB ILE 106 4.632 -4.690 -1.866 825 HG12 ILE 106 1HG1 ILE 106 2.166 -4.891 -1.323 826 HG13 ILE 106 2HG1 ILE 106 3.115 -3.568 -0.674 827 HG21 ILE 106 1HG2 ILE 106 4.421 -2.287 -2.595 828 HG22 ILE 106 2HG2 ILE 106 5.328 -3.336 -3.664 829 HG23 ILE 106 3HG2 ILE 106 3.671 -2.870 -4.078 830 HD11 ILE 106 3HD1 ILE 106 1.327 -3.286 -3.096 831 HD12 ILE 106 1HD1 ILE 106 0.801 -2.983 -1.437 832 HD13 ILE 106 2HD1 ILE 106 2.088 -1.996 -2.153 833 H GLN 107 H GLN 107 0.974 -5.852 -3.063 834 HA GLN 107 HA GLN 107 0.100 -4.132 -5.052 835 HB2 GLN 107 1HB GLN 107 0.748 -6.254 -6.470 836 HB3 GLN 107 2HB GLN 107 -0.709 -6.980 -5.811 837 HG2 GLN 107 1HG GLN 107 -2.071 -5.159 -6.747 838 HG3 GLN 107 2HG GLN 107 -0.620 -4.279 -7.230 839 HE21 GLN 107 1HE2 GLN 107 -2.402 -4.709 -9.222 840 HE22 GLN 107 2HE2 GLN 107 -1.899 -5.993 -10.273 841 H ILE 108 H ILE 108 -1.959 -3.476 -4.529 842 HA ILE 108 HA ILE 108 -3.580 -5.103 -2.645 843 HB ILE 108 HB ILE 108 -3.084 -2.096 -2.600 844 HG12 ILE 108 1HG1 ILE 108 -2.630 -4.062 -0.317 845 HG13 ILE 108 2HG1 ILE 108 -1.361 -3.707 -1.478 846 HG21 ILE 108 1HG2 ILE 108 -5.442 -2.464 -2.080 847 HG22 ILE 108 2HG2 ILE 108 -5.027 -3.807 -0.988 848 HG23 ILE 108 3HG2 ILE 108 -4.606 -2.139 -0.574 849 HD11 ILE 108 3HD1 ILE 108 -2.708 -1.629 0.310 850 HD12 ILE 108 1HD1 ILE 108 -1.094 -2.331 0.505 851 HD13 ILE 108 2HD1 ILE 108 -1.456 -1.327 -0.914 852 H LYS 109 H LYS 109 -5.905 -4.817 -2.992 853 HA LYS 109 HA LYS 109 -6.837 -3.515 -5.443 854 HB2 LYS 109 1HB LYS 109 -7.648 -5.730 -6.325 855 HB3 LYS 109 2HB LYS 109 -5.917 -5.460 -6.401 856 HG2 LYS 109 1HG LYS 109 -5.901 -6.855 -4.079 857 HG3 LYS 109 2HG LYS 109 -7.469 -7.383 -4.683 858 HD2 LYS 109 1HD LYS 109 -5.865 -8.996 -5.388 859 HD3 LYS 109 2HD LYS 109 -6.340 -8.079 -6.794 860 HE2 LYS 109 1HE LYS 109 -4.074 -8.256 -7.107 861 HE3 LYS 109 2HE LYS 109 -4.146 -6.649 -6.392 862 HZ1 LYS 109 3HZ LYS 109 -2.404 -8.157 -5.490 863 HZ2 LYS 109 1HZ LYS 109 -3.526 -9.184 -4.967 864 HZ3 LYS 109 2HZ LYS 109 -3.406 -7.670 -4.289 865 H ALA 110 H ALA 110 -9.142 -3.204 -5.237 866 HA ALA 110 HA ALA 110 -10.579 -4.605 -3.044 867 HB1 ALA 110 1HB ALA 110 -10.377 -1.569 -3.119 868 HB2 ALA 110 2HB ALA 110 -11.179 -2.583 -1.899 869 HB3 ALA 110 3HB ALA 110 -9.419 -2.597 -2.035 870 H LEU 111 H LEU 111 -12.895 -4.475 -3.205 871 HA LEU 111 HA LEU 111 -14.067 -3.927 -5.806 872 HB2 LEU 111 1HB LEU 111 -14.949 -5.682 -4.210 873 HB3 LEU 111 2HB LEU 111 -15.399 -4.393 -3.109 874 HG LEU 111 HG LEU 111 -16.779 -3.450 -5.176 875 HD11 LEU 111 1HD1 LEU 111 -17.580 -5.114 -6.722 876 HD12 LEU 111 2HD1 LEU 111 -16.632 -6.390 -5.939 877 HD13 LEU 111 3HD1 LEU 111 -15.815 -5.090 -6.813 878 HD21 LEU 111 3HD2 LEU 111 -18.726 -4.843 -4.573 879 HD22 LEU 111 1HD2 LEU 111 -17.868 -4.204 -3.160 880 HD23 LEU 111 2HD2 LEU 111 -17.659 -5.898 -3.622 881 H SER 112 H SER 112 -14.728 -1.847 -6.521 882 HA SER 112 HA SER 112 -14.477 0.353 -4.696 883 HB2 SER 112 1HB SER 112 -15.448 1.677 -6.623 884 HB3 SER 112 2HB SER 112 -13.953 0.827 -6.953 885 HG SER 112 HG SER 112 -15.559 0.665 -8.591 886 H SER 113 H SER 113 -17.287 -1.198 -6.239 887 HA SER 113 HA SER 113 -18.988 -0.162 -4.022 888 HB2 SER 113 1HB SER 113 -20.517 0.061 -6.377 889 HB3 SER 113 2HB SER 113 -19.851 1.370 -5.409 890 HG SER 113 HG SER 113 -19.259 1.487 -7.647 891 H GLY 114 H GLY 114 -19.219 -2.170 -6.969 892 HA2 GLY 114 1HA GLY 114 -21.208 -3.938 -5.636 893 HA3 GLY 114 2HA GLY 114 -21.557 -2.947 -7.079 894 H THR 115 H THR 115 -19.839 -3.238 -8.914 895 HA THR 115 HA THR 115 -19.388 -6.183 -9.243 896 HB THR 115 HB THR 115 -19.960 -5.753 -11.664 897 HG1 THR 115 1HG THR 115 -21.049 -3.323 -10.629 898 HG21 THR 115 3HG2 THR 115 -22.322 -5.970 -11.367 899 HG22 THR 115 1HG2 THR 115 -22.276 -5.178 -9.775 900 HG23 THR 115 2HG2 THR 115 -21.549 -6.786 -10.012 901 H THR 116 H THR 116 -17.855 -3.250 -9.019 902 HA THR 116 HA THR 116 -15.804 -3.919 -11.071 903 HB THR 116 HB THR 116 -16.493 -1.297 -9.798 904 HG1 THR 116 1HG THR 116 -17.451 -2.456 -12.198 905 HG21 THR 116 3HG2 THR 116 -14.350 -1.215 -10.734 906 HG22 THR 116 1HG2 THR 116 -15.508 -0.160 -11.557 907 HG23 THR 116 2HG2 THR 116 -15.014 -1.690 -12.340 908 H PHE 117 H PHE 117 -13.880 -4.422 -10.376 909 HA PHE 117 HA PHE 117 -13.047 -3.975 -7.556 910 HB2 PHE 117 1HB PHE 117 -13.295 -6.399 -8.897 911 HB3 PHE 117 2HB PHE 117 -11.610 -6.029 -9.132 912 HD1 PHE 117 1HD PHE 117 -10.060 -5.853 -7.136 913 HD2 PHE 117 2HD PHE 117 -14.223 -6.904 -6.780 914 HE1 PHE 117 1HE PHE 117 -9.651 -6.725 -4.843 915 HE2 PHE 117 2HE PHE 117 -13.807 -7.768 -4.476 916 HZ PHE 117 HZ PHE 117 -11.521 -7.664 -3.506 917 H VAL 118 H VAL 118 -11.451 -2.541 -7.333 918 HA VAL 118 HA VAL 118 -10.010 -1.597 -9.722 919 HB VAL 118 HB VAL 118 -9.861 -0.426 -6.930 920 HG11 VAL 118 1HG1 VAL 118 -9.277 1.635 -8.112 921 HG12 VAL 118 2HG1 VAL 118 -8.214 0.337 -8.680 922 HG13 VAL 118 3HG1 VAL 118 -9.584 0.860 -9.681 923 HG21 VAL 118 3HG2 VAL 118 -12.224 -0.435 -7.363 924 HG22 VAL 118 1HG2 VAL 118 -11.614 1.207 -7.568 925 HG23 VAL 118 2HG2 VAL 118 -11.981 0.209 -9.000 926 H TYR 119 H TYR 119 -7.851 -2.071 -9.972 927 HA TYR 119 HA TYR 119 -6.450 -3.491 -7.736 928 HB2 TYR 119 1HB TYR 119 -6.008 -3.761 -10.725 929 HB3 TYR 119 2HB TYR 119 -5.111 -4.590 -9.459 930 HD1 TYR 119 1HD TYR 119 -8.543 -4.189 -10.915 931 HD2 TYR 119 2HD TYR 119 -5.880 -6.746 -8.701 932 HE1 TYR 119 1HE TYR 119 -10.201 -5.947 -11.019 933 HE2 TYR 119 2HE TYR 119 -7.605 -8.549 -8.739 934 HH TYR 119 HH TYR 119 -10.652 -8.149 -10.592 935 H SER 120 H SER 120 -4.717 -2.415 -6.890 936 HA SER 120 HA SER 120 -3.773 0.041 -8.160 937 HB2 SER 120 1HB SER 120 -3.614 -0.228 -5.668 938 HB3 SER 120 2HB SER 120 -2.524 -1.599 -5.957 939 HG SER 120 HG SER 120 -0.979 -0.395 -6.582 940 H GLN 121 H GLN 121 -1.537 0.054 -8.781 941 HA GLN 121 HA GLN 121 -0.758 -1.908 -10.769 942 HB2 GLN 121 1HB GLN 121 1.192 -0.452 -11.067 943 HB3 GLN 121 2HB GLN 121 -0.306 0.467 -11.017 944 HG2 GLN 121 1HG GLN 121 0.220 1.073 -8.618 945 HG3 GLN 121 2HG GLN 121 1.775 0.252 -8.802 946 HE21 GLN 121 1HE2 GLN 121 2.121 2.842 -8.079 947 HE22 GLN 121 2HE2 GLN 121 2.474 3.826 -9.464 948 H LYS 122 H LYS 122 1.286 -3.155 -10.737 949 HA LYS 122 HA LYS 122 1.919 -4.281 -8.073 950 HB2 LYS 122 1HB LYS 122 1.549 -5.637 -10.209 951 HB3 LYS 122 2HB LYS 122 3.105 -5.017 -10.775 952 HG2 LYS 122 1HG LYS 122 4.287 -6.150 -8.996 953 HG3 LYS 122 2HG LYS 122 2.785 -6.488 -8.122 954 HD2 LYS 122 1HD LYS 122 2.016 -7.968 -9.909 955 HD3 LYS 122 2HD LYS 122 3.477 -7.645 -10.864 956 HE2 LYS 122 1HE LYS 122 4.855 -8.869 -9.456 957 HE3 LYS 122 2HE LYS 122 3.801 -8.665 -8.055 958 HZ1 LYS 122 3HZ LYS 122 3.084 -10.382 -10.360 959 HZ2 LYS 122 1HZ LYS 122 2.287 -10.264 -8.925 960 HZ3 LYS 122 2HZ LYS 122 3.763 -10.931 -8.968 961 H ILE 123 H ILE 123 4.049 -4.143 -7.148 962 HA ILE 123 HA ILE 123 6.134 -2.506 -8.417 963 HB ILE 123 HB ILE 123 5.101 -2.024 -5.576 964 HG12 ILE 123 1HG1 ILE 123 3.458 -1.025 -7.158 965 HG13 ILE 123 2HG1 ILE 123 4.195 0.081 -6.021 966 HG21 ILE 123 1HG2 ILE 123 7.531 -1.673 -5.868 967 HG22 ILE 123 2HG2 ILE 123 7.187 -0.422 -7.078 968 HG23 ILE 123 3HG2 ILE 123 6.686 -0.206 -5.390 969 HD11 ILE 123 3HD1 ILE 123 5.177 -0.225 -8.872 970 HD12 ILE 123 1HD1 ILE 123 3.924 0.945 -8.368 971 HD13 ILE 123 2HD1 ILE 123 5.556 1.080 -7.713 972 H ASP 124 H ASP 124 7.526 -3.892 -8.676 973 HA ASP 124 HA ASP 124 7.978 -6.132 -6.959 974 HB2 ASP 124 1HB ASP 124 8.640 -5.391 -9.456 975 HB3 ASP 124 2HB ASP 124 10.124 -5.015 -8.625 976 H PHE 125 H PHE 125 9.640 -6.549 -5.757 977 HA PHE 125 HA PHE 125 11.524 -4.324 -4.977 978 HB2 PHE 125 1HB PHE 125 11.211 -4.545 -2.541 979 HB3 PHE 125 2HB PHE 125 9.790 -4.122 -3.353 980 HD1 PHE 125 1HD PHE 125 11.516 -7.030 -1.778 981 HD2 PHE 125 2HD PHE 125 7.808 -5.437 -3.229 982 HE1 PHE 125 1HE PHE 125 10.337 -8.736 -0.511 983 HE2 PHE 125 2HE PHE 125 6.559 -7.087 -1.813 984 HZ PHE 125 HZ PHE 125 7.817 -8.797 -0.505 985 H GLU 126 H GLU 126 13.457 -5.000 -3.362 986 HA GLU 126 HA GLU 126 14.392 -7.732 -3.964 987 HB2 GLU 126 1HB GLU 126 15.467 -5.001 -3.986 988 HB3 GLU 126 2HB GLU 126 16.576 -6.317 -3.465 989 HG2 GLU 126 1HG GLU 126 16.612 -7.204 -5.570 990 HG3 GLU 126 2HG GLU 126 14.983 -6.633 -5.969 991 H ARG 127 H ARG 127 15.640 -8.736 -2.155 992 HA ARG 127 HA ARG 127 14.261 -8.123 0.389 993 HB2 ARG 127 1HB ARG 127 14.867 -10.637 -1.103 994 HB3 ARG 127 2HB ARG 127 14.897 -10.713 0.662 995 HG2 ARG 127 1HG ARG 127 12.584 -9.508 -0.858 996 HG3 ARG 127 2HG ARG 127 12.691 -11.248 -0.517 997 HD2 ARG 127 1HD ARG 127 13.192 -9.409 1.786 998 HD3 ARG 127 2HD ARG 127 11.557 -9.427 1.134 999 HE ARG 127 HE ARG 127 12.044 -12.078 1.363 1000 HH11 ARG 127 1HH1 ARG 127 12.584 -9.486 3.797 1001 HH12 ARG 127 2HH1 ARG 127 12.165 -10.555 5.099 1002 HH21 ARG 127 1HH2 ARG 127 11.326 -13.351 3.217 1003 HH22 ARG 127 2HH2 ARG 127 11.369 -12.581 4.778 1004 H GLU 128 H GLU 128 15.732 -6.733 1.079 1005 HA GLU 128 HA GLU 128 17.475 -5.839 2.132 1006 HB2 GLU 128 1HB GLU 128 18.318 -6.956 4.135 1007 HB3 GLU 128 2HB GLU 128 16.569 -6.966 4.030 1008 HG2 GLU 128 1HG GLU 128 16.445 -9.228 3.423 1009 HG3 GLU 128 2HG GLU 128 18.180 -9.318 3.105 Start of MODEL 18 1 H1 GLY 1 H GLY 1 -27.762 6.710 -5.474 2 HA2 GLY 1 1HA GLY 1 -27.529 8.148 -3.514 3 HA3 GLY 1 2HA GLY 1 -26.059 7.200 -3.788 4 H ALA 2 H ALA 2 -26.142 9.700 -2.360 5 HA ALA 2 HA ALA 2 -24.149 11.156 -3.919 6 HB1 ALA 2 1HB ALA 2 -25.044 13.330 -3.137 7 HB2 ALA 2 2HB ALA 2 -26.219 12.519 -4.193 8 HB3 ALA 2 3HB ALA 2 -26.446 12.513 -2.426 9 H GLU 3 H GLU 3 -22.798 12.356 -2.440 10 HA GLU 3 HA GLU 3 -21.139 12.066 -1.143 11 HB2 GLU 3 1HB GLU 3 -21.304 12.695 0.976 12 HB3 GLU 3 2HB GLU 3 -22.856 13.230 0.360 13 HG2 GLU 3 1HG GLU 3 -23.628 10.809 1.328 14 HG3 GLU 3 2HG GLU 3 -22.183 11.016 2.306 15 H ALA 4 H ALA 4 -20.112 10.762 0.732 16 HA ALA 4 HA ALA 4 -18.847 8.929 1.028 17 HB1 ALA 4 1HB ALA 4 -21.558 7.637 1.431 18 HB2 ALA 4 2HB ALA 4 -19.986 7.008 1.981 19 HB3 ALA 4 3HB ALA 4 -20.612 8.538 2.653 20 H LEU 5 H LEU 5 -19.045 9.437 -1.623 21 HA LEU 5 HA LEU 5 -20.125 7.398 -3.195 22 HB2 LEU 5 1HB LEU 5 -18.034 9.458 -3.647 23 HB3 LEU 5 2HB LEU 5 -18.218 8.291 -4.912 24 HG LEU 5 HG LEU 5 -20.498 9.831 -3.708 25 HD11 LEU 5 1HD1 LEU 5 -20.304 11.425 -5.604 26 HD12 LEU 5 2HD1 LEU 5 -18.721 10.724 -5.982 27 HD13 LEU 5 3HD1 LEU 5 -18.991 11.522 -4.413 28 HD21 LEU 5 3HD2 LEU 5 -21.529 9.427 -5.986 29 HD22 LEU 5 1HD2 LEU 5 -21.106 7.907 -5.174 30 HD23 LEU 5 2HD2 LEU 5 -20.028 8.576 -6.445 31 HA PRO 6 HA PRO 6 -17.356 4.061 -2.769 32 HB2 PRO 6 1HB PRO 6 -17.550 2.774 -5.191 33 HB3 PRO 6 2HB PRO 6 -18.925 2.862 -4.036 34 HG2 PRO 6 1HG PRO 6 -18.401 4.580 -6.479 35 HG3 PRO 6 2HG PRO 6 -19.927 3.808 -5.923 36 HD2 PRO 6 1HD PRO 6 -19.225 6.489 -5.397 37 HD3 PRO 6 2HD PRO 6 -20.323 5.502 -4.368 38 H LEU 7 H LEU 7 -15.518 3.236 -3.423 39 HA LEU 7 HA LEU 7 -13.333 4.648 -3.865 40 HB2 LEU 7 1HB LEU 7 -13.650 2.208 -3.190 41 HB3 LEU 7 2HB LEU 7 -13.604 1.805 -4.893 42 HG LEU 7 HG LEU 7 -11.323 2.827 -5.069 43 HD11 LEU 7 1HD1 LEU 7 -11.995 3.614 -2.243 44 HD12 LEU 7 2HD1 LEU 7 -10.954 4.398 -3.453 45 HD13 LEU 7 3HD1 LEU 7 -10.370 3.025 -2.533 46 HD21 LEU 7 3HD2 LEU 7 -10.255 1.011 -3.795 47 HD22 LEU 7 1HD2 LEU 7 -11.682 0.449 -4.691 48 HD23 LEU 7 2HD2 LEU 7 -11.798 0.676 -2.969 49 H TYR 8 H TYR 8 -13.176 6.178 -5.499 50 HA TYR 8 HA TYR 8 -13.357 5.265 -8.307 51 HB2 TYR 8 1HB TYR 8 -13.523 7.693 -8.803 52 HB3 TYR 8 2HB TYR 8 -14.822 6.943 -7.928 53 HD1 TYR 8 1HD TYR 8 -11.713 8.966 -7.265 54 HD2 TYR 8 2HD TYR 8 -15.749 8.014 -6.097 55 HE1 TYR 8 1HE TYR 8 -11.637 10.750 -5.544 56 HE2 TYR 8 2HE TYR 8 -15.708 9.749 -4.376 57 HH TYR 8 HH TYR 8 -14.349 11.480 -3.341 58 H TYR 9 H TYR 9 -10.829 5.087 -6.327 59 HA TYR 9 HA TYR 9 -8.877 5.274 -8.470 60 HB2 TYR 9 1HB TYR 9 -9.140 7.710 -7.755 61 HB3 TYR 9 2HB TYR 9 -8.826 7.155 -6.136 62 HD1 TYR 9 2HD TYR 9 -7.278 7.642 -9.486 63 HD2 TYR 9 1HD TYR 9 -6.603 6.808 -5.294 64 HE1 TYR 9 2HE TYR 9 -4.900 8.164 -9.777 65 HE2 TYR 9 1HE TYR 9 -4.245 7.403 -5.541 66 HH TYR 9 HH TYR 9 -2.518 7.610 -8.250 67 H LEU 10 H LEU 10 -6.973 3.901 -7.872 68 HA LEU 10 HA LEU 10 -6.583 3.447 -4.991 69 HB2 LEU 10 1HB LEU 10 -8.000 1.697 -6.218 70 HB3 LEU 10 2HB LEU 10 -6.625 1.518 -7.298 71 HG LEU 10 HG LEU 10 -6.570 -0.314 -6.183 72 HD11 LEU 10 1HD1 LEU 10 -4.363 0.870 -5.858 73 HD12 LEU 10 2HD1 LEU 10 -4.666 -0.338 -4.544 74 HD13 LEU 10 3HD1 LEU 10 -4.861 1.362 -4.262 75 HD21 LEU 10 3HD2 LEU 10 -7.031 -0.938 -3.988 76 HD22 LEU 10 1HD2 LEU 10 -8.243 0.293 -4.381 77 HD23 LEU 10 2HD2 LEU 10 -6.847 0.714 -3.373 78 H GLN 11 H GLN 11 -4.560 3.510 -4.422 79 HA GLN 11 HA GLN 11 -2.398 3.023 -6.343 80 HB2 GLN 11 1HB GLN 11 -3.258 5.590 -6.304 81 HB3 GLN 11 2HB GLN 11 -2.202 5.667 -4.902 82 HG2 GLN 11 1HG GLN 11 -0.740 6.255 -6.507 83 HG3 GLN 11 2HG GLN 11 -0.522 4.513 -6.692 84 HE21 GLN 11 1HE2 GLN 11 -2.788 3.771 -8.302 85 HE22 GLN 11 2HE2 GLN 11 -2.628 4.658 -9.807 86 H ILE 12 H ILE 12 -0.663 2.159 -5.258 87 HA ILE 12 HA ILE 12 -0.599 1.758 -2.462 88 HB ILE 12 HB ILE 12 1.846 2.002 -4.226 89 HG12 ILE 12 1HG1 ILE 12 0.418 0.465 -5.398 90 HG13 ILE 12 2HG1 ILE 12 1.727 -0.406 -4.621 91 HG21 ILE 12 1HG2 ILE 12 2.367 1.739 -1.710 92 HG22 ILE 12 2HG2 ILE 12 1.252 0.409 -1.686 93 HG23 ILE 12 3HG2 ILE 12 2.775 0.276 -2.588 94 HD11 ILE 12 3HD1 ILE 12 -1.165 -0.300 -3.680 95 HD12 ILE 12 1HD1 ILE 12 -0.313 -1.676 -4.412 96 HD13 ILE 12 2HD1 ILE 12 0.160 -1.130 -2.811 97 H THR 13 H THR 13 0.541 4.642 -4.250 98 HA THR 13 HA THR 13 1.253 6.627 -3.662 99 HB THR 13 HB THR 13 0.643 6.899 -0.870 100 HG1 THR 13 1HG THR 13 -0.851 5.591 -0.715 101 HG21 THR 13 3HG2 THR 13 0.677 8.680 -2.504 102 HG22 THR 13 1HG2 THR 13 -0.876 8.586 -1.666 103 HG23 THR 13 2HG2 THR 13 -0.739 7.969 -3.337 104 H GLY 14 H GLY 14 1.976 4.859 -0.616 105 HA2 GLY 14 1HA GLY 14 4.864 5.472 -0.992 106 HA3 GLY 14 2HA GLY 14 4.081 5.998 0.494 107 H ILE 15 H ILE 15 6.198 4.245 0.511 108 HA ILE 15 HA ILE 15 5.024 1.746 1.662 109 HB ILE 15 HB ILE 15 5.239 1.399 -0.745 110 HG12 ILE 15 1HG1 ILE 15 7.201 -0.458 0.537 111 HG13 ILE 15 2HG1 ILE 15 5.568 -0.392 1.139 112 HG21 ILE 15 1HG2 ILE 15 7.323 1.210 -1.930 113 HG22 ILE 15 2HG2 ILE 15 7.424 2.749 -1.030 114 HG23 ILE 15 3HG2 ILE 15 8.268 1.338 -0.435 115 HD11 ILE 15 3HD1 ILE 15 6.379 -1.964 -0.982 116 HD12 ILE 15 1HD1 ILE 15 4.687 -1.484 -0.600 117 HD13 ILE 15 2HD1 ILE 15 5.664 -0.600 -1.817 118 H THR 16 H THR 16 6.789 0.747 3.058 119 HA THR 16 HA THR 16 9.513 1.473 2.892 120 HB THR 16 HB THR 16 8.622 3.565 3.910 121 HG1 THR 16 1HG THR 16 10.653 3.101 4.243 122 HG21 THR 16 3HG2 THR 16 6.827 2.512 5.367 123 HG22 THR 16 1HG2 THR 16 7.868 3.691 6.175 124 HG23 THR 16 2HG2 THR 16 8.123 1.958 6.445 125 H SER 17 H SER 17 10.310 0.691 5.570 126 HA SER 17 HA SER 17 8.788 -1.613 6.399 127 HB2 SER 17 1HB SER 17 11.404 -1.993 4.937 128 HB3 SER 17 2HB SER 17 10.696 -3.194 6.049 129 HG SER 17 HG SER 17 9.013 -2.096 4.139 130 H ASP 18 H ASP 18 10.104 -2.737 8.263 131 HA ASP 18 HA ASP 18 10.995 -0.884 10.255 132 HB2 ASP 18 1HB ASP 18 10.207 -3.084 10.906 133 HB3 ASP 18 2HB ASP 18 11.421 -3.891 9.922 134 H GLY 19 H GLY 19 12.911 -3.148 8.170 135 HA2 GLY 19 1HA GLY 19 15.410 -1.729 8.747 136 HA3 GLY 19 2HA GLY 19 15.160 -3.085 7.654 137 H ASN 20 H ASN 20 13.674 0.152 7.929 138 HA ASN 20 HA ASN 20 15.030 1.025 5.434 139 HB2 ASN 20 1HB ASN 20 12.493 -0.013 5.244 140 HB3 ASN 20 2HB ASN 20 12.122 1.665 5.673 141 HD21 ASN 20 1HD2 ASN 20 14.579 0.035 3.555 142 HD22 ASN 20 2HD2 ASN 20 14.178 1.008 2.156 143 H ASP 21 H ASP 21 14.509 1.709 8.591 144 HA ASP 21 HA ASP 21 14.239 3.484 9.931 145 HB2 ASP 21 1HB ASP 21 16.214 4.202 8.381 146 HB3 ASP 21 2HB ASP 21 15.069 5.374 7.738 147 H PHE 22 H PHE 22 11.951 2.634 8.321 148 HA PHE 22 HA PHE 22 9.900 3.171 7.613 149 HB2 PHE 22 1HB PHE 22 10.087 5.409 9.646 150 HB3 PHE 22 2HB PHE 22 8.625 4.883 8.841 151 HD1 PHE 22 2HD PHE 22 11.357 3.429 11.018 152 HD2 PHE 22 1HD PHE 22 7.149 3.512 10.012 153 HE1 PHE 22 2HE PHE 22 10.853 2.057 12.994 154 HE2 PHE 22 1HE PHE 22 6.663 2.189 12.064 155 HZ PHE 22 HZ PHE 22 8.520 1.433 13.525 156 H ALA 23 H ALA 23 12.191 4.440 6.131 157 HA ALA 23 HA ALA 23 11.466 7.000 5.170 158 HB1 ALA 23 1HB ALA 23 13.692 6.073 4.863 159 HB2 ALA 23 2HB ALA 23 13.042 4.745 3.867 160 HB3 ALA 23 3HB ALA 23 12.971 6.413 3.275 161 H TRP 24 H TRP 24 9.248 7.037 4.807 162 HA TRP 24 HA TRP 24 7.666 5.193 3.459 163 HB2 TRP 24 1HB TRP 24 7.339 8.116 4.122 164 HB3 TRP 24 2HB TRP 24 6.099 7.230 3.242 165 HD1 TRP 24 HD TRP 24 7.202 7.855 6.721 166 HE1 TRP 24 1HE TRP 24 6.058 6.292 8.348 167 HE3 TRP 24 3HE TRP 24 5.315 4.579 3.332 168 HZ2 TRP 24 2HZ TRP 24 4.281 3.933 8.158 169 HZ3 TRP 24 3HZ TRP 24 3.945 2.656 4.058 170 HH2 TRP 24 HH TRP 24 3.383 2.362 6.469 171 H ASP 25 H ASP 25 9.754 7.341 1.922 172 HA ASP 25 HA ASP 25 10.008 8.170 -0.181 173 HB2 ASP 25 1HB ASP 25 9.285 5.286 -0.473 174 HB3 ASP 25 2HB ASP 25 9.275 6.233 -1.947 175 H ASN 26 H ASN 26 8.827 8.441 -2.517 176 HA ASN 26 HA ASN 26 5.891 8.353 -2.196 177 HB2 ASN 26 1HB ASN 26 7.615 10.619 -3.357 178 HB3 ASN 26 2HB ASN 26 6.138 10.208 -4.202 179 HD21 ASN 26 1HD2 ASN 26 6.218 9.837 -0.682 180 HD22 ASN 26 2HD2 ASN 26 5.029 11.049 -0.436 181 H LEU 27 H LEU 27 5.168 6.864 -3.448 182 HA LEU 27 HA LEU 27 6.816 5.689 -5.598 183 HB2 LEU 27 1HB LEU 27 3.930 5.112 -4.829 184 HB3 LEU 27 2HB LEU 27 4.942 4.139 -5.895 185 HG LEU 27 HG LEU 27 5.434 4.650 -2.940 186 HD11 LEU 27 1HD1 LEU 27 3.449 3.339 -3.283 187 HD12 LEU 27 2HD1 LEU 27 4.731 2.297 -2.654 188 HD13 LEU 27 3HD1 LEU 27 4.319 2.230 -4.380 189 HD21 LEU 27 3HD2 LEU 27 6.795 2.318 -4.122 190 HD22 LEU 27 1HD2 LEU 27 7.382 3.553 -2.979 191 HD23 LEU 27 2HD2 LEU 27 7.398 3.860 -4.686 192 H THR 28 H THR 28 6.669 6.255 -7.712 193 HA THR 28 HA THR 28 5.301 8.654 -8.399 194 HB THR 28 HB THR 28 5.902 7.635 -10.801 195 HG1 THR 28 1HG THR 28 7.082 6.043 -10.847 196 HG21 THR 28 3HG2 THR 28 6.910 9.672 -9.706 197 HG22 THR 28 1HG2 THR 28 8.146 8.716 -10.539 198 HG23 THR 28 2HG2 THR 28 7.992 8.607 -8.776 199 H SER 29 H SER 29 3.493 9.008 -9.689 200 HA SER 29 HA SER 29 1.193 7.552 -9.152 201 HB2 SER 29 1HB SER 29 1.622 9.231 -11.654 202 HB3 SER 29 2HB SER 29 0.095 8.914 -10.827 203 HG SER 29 HG SER 29 1.151 10.997 -10.475 204 H SER 30 H SER 30 3.561 6.786 -11.553 205 HA SER 30 HA SER 30 1.761 4.861 -12.924 206 HB2 SER 30 1HB SER 30 4.222 6.138 -14.110 207 HB3 SER 30 2HB SER 30 2.820 5.464 -14.954 208 HG SER 30 HG SER 30 1.650 7.266 -14.367 209 H GLN 31 H GLN 31 3.959 4.780 -10.560 210 HA GLN 31 HA GLN 31 6.276 3.604 -11.554 211 HB2 GLN 31 1HB GLN 31 5.794 4.615 -9.253 212 HB3 GLN 31 2HB GLN 31 5.044 3.146 -8.812 213 HG2 GLN 31 1HG GLN 31 7.220 2.010 -9.267 214 HG3 GLN 31 2HG GLN 31 7.948 3.556 -9.657 215 HE21 GLN 31 1HE2 GLN 31 9.052 4.565 -7.838 216 HE22 GLN 31 2HE2 GLN 31 8.635 4.238 -6.205 217 H THR 32 H THR 32 7.087 1.520 -11.717 218 HA THR 32 HA THR 32 5.204 -0.749 -11.443 219 HB THR 32 HB THR 32 6.422 -1.567 -13.482 220 HG1 THR 32 1HG THR 32 7.915 -0.399 -14.358 221 HG21 THR 32 3HG2 THR 32 4.214 -0.366 -13.603 222 HG22 THR 32 1HG2 THR 32 5.207 -0.154 -15.057 223 HG23 THR 32 2HG2 THR 32 5.088 1.147 -13.872 224 H LYS 33 H LYS 33 8.089 0.564 -10.210 225 HA LYS 33 HA LYS 33 8.735 -1.972 -8.944 226 HB2 LYS 33 1HB LYS 33 10.152 -1.591 -11.182 227 HB3 LYS 33 2HB LYS 33 11.084 -0.503 -10.146 228 HG2 LYS 33 1HG LYS 33 10.368 -3.258 -9.201 229 HG3 LYS 33 2HG LYS 33 11.603 -3.107 -10.433 230 HD2 LYS 33 1HD LYS 33 12.001 -1.602 -7.835 231 HD3 LYS 33 2HD LYS 33 12.278 -3.323 -7.931 232 HE2 LYS 33 1HE LYS 33 14.372 -2.367 -8.273 233 HE3 LYS 33 2HE LYS 33 13.844 -2.952 -9.853 234 HZ1 LYS 33 3HZ LYS 33 13.266 -0.658 -10.441 235 HZ2 LYS 33 1HZ LYS 33 14.819 -0.747 -10.006 236 HZ3 LYS 33 2HZ LYS 33 13.722 -0.132 -8.948 237 H ALA 34 H ALA 34 9.827 -1.651 -7.043 238 HA ALA 34 HA ALA 34 9.201 0.584 -5.517 239 HB1 ALA 34 1HB ALA 34 10.624 -0.566 -3.793 240 HB2 ALA 34 2HB ALA 34 9.551 -1.675 -4.649 241 HB3 ALA 34 3HB ALA 34 11.286 -1.598 -5.059 242 HA PRO 35 HA PRO 35 12.925 3.169 -5.808 243 HB2 PRO 35 1HB PRO 35 13.039 4.241 -3.310 244 HB3 PRO 35 2HB PRO 35 11.866 4.747 -4.559 245 HG2 PRO 35 1HG PRO 35 11.436 2.854 -2.233 246 HG3 PRO 35 2HG PRO 35 10.327 4.112 -2.896 247 HD2 PRO 35 1HD PRO 35 10.040 1.482 -3.455 248 HD3 PRO 35 2HD PRO 35 9.573 2.786 -4.576 249 H ASN 36 H ASN 36 12.591 0.644 -3.229 250 HA ASN 36 HA ASN 36 15.539 0.423 -3.170 251 HB2 ASN 36 1HB ASN 36 13.953 1.840 -1.195 252 HB3 ASN 36 2HB ASN 36 14.504 0.345 -0.468 253 HD21 ASN 36 1HD2 ASN 36 15.457 3.521 -1.366 254 HD22 ASN 36 2HD2 ASN 36 17.174 3.326 -1.156 255 H VAL 37 H VAL 37 16.314 -1.480 -2.068 256 HA VAL 37 HA VAL 37 14.487 -3.707 -1.706 257 HB VAL 37 HB VAL 37 16.576 -4.390 -2.379 258 HG11 VAL 37 1HG1 VAL 37 17.856 -2.680 -0.417 259 HG12 VAL 37 2HG1 VAL 37 18.614 -4.052 -1.333 260 HG13 VAL 37 3HG1 VAL 37 17.839 -2.703 -2.231 261 HG21 VAL 37 3HG2 VAL 37 16.435 -4.865 0.581 262 HG22 VAL 37 1HG2 VAL 37 15.753 -5.834 -0.734 263 HG23 VAL 37 2HG2 VAL 37 17.484 -5.752 -0.559 264 H LEU 38 H LEU 38 12.998 -3.240 -0.270 265 HA LEU 38 HA LEU 38 13.518 -1.746 2.176 266 HB2 LEU 38 1HB LEU 38 11.081 -3.443 1.639 267 HB3 LEU 38 2HB LEU 38 11.230 -1.988 2.614 268 HG LEU 38 HG LEU 38 11.446 -1.996 -0.424 269 HD11 LEU 38 1HD1 LEU 38 9.084 -1.347 1.330 270 HD12 LEU 38 2HD1 LEU 38 9.237 -2.686 0.164 271 HD13 LEU 38 3HD1 LEU 38 9.220 -1.029 -0.431 272 HD21 LEU 38 3HD2 LEU 38 11.103 0.276 1.584 273 HD22 LEU 38 1HD2 LEU 38 11.164 0.438 -0.181 274 HD23 LEU 38 2HD2 LEU 38 12.593 -0.101 0.702 275 H LYS 39 H LYS 39 14.233 -2.644 4.111 276 HA LYS 39 HA LYS 39 14.658 -5.586 4.066 277 HB2 LYS 39 1HB LYS 39 16.145 -3.662 5.863 278 HB3 LYS 39 2HB LYS 39 16.520 -5.313 5.438 279 HG2 LYS 39 1HG LYS 39 18.003 -4.328 4.094 280 HG3 LYS 39 2HG LYS 39 16.661 -4.275 2.947 281 HD2 LYS 39 1HD LYS 39 16.165 -1.964 3.605 282 HD3 LYS 39 2HD LYS 39 17.443 -2.000 4.818 283 HE2 LYS 39 1HE LYS 39 17.694 -2.001 1.794 284 HE3 LYS 39 2HE LYS 39 18.080 -0.715 2.932 285 HZ1 LYS 39 3HZ LYS 39 19.572 -3.221 2.472 286 HZ2 LYS 39 1HZ LYS 39 19.783 -2.299 3.846 287 HZ3 LYS 39 2HZ LYS 39 20.075 -1.671 2.366 288 H GLY 40 H GLY 40 14.741 -6.568 6.374 289 HA2 GLY 40 1HA GLY 40 14.063 -6.586 8.635 290 HA3 GLY 40 2HA GLY 40 13.154 -5.116 8.393 291 H ASN 41 H ASN 41 12.192 -7.184 5.979 292 HA ASN 41 HA ASN 41 10.626 -8.740 5.540 293 HB2 ASN 41 1HB ASN 41 11.759 -9.850 7.594 294 HB3 ASN 41 2HB ASN 41 10.267 -9.460 8.437 295 HD21 ASN 41 1HD2 ASN 41 8.238 -10.099 6.749 296 HD22 ASN 41 2HD2 ASN 41 8.344 -11.816 6.328 297 H LYS 42 H LYS 42 9.939 -6.263 7.738 298 HA LYS 42 HA LYS 42 6.969 -6.644 7.673 299 HB2 LYS 42 1HB LYS 42 8.789 -4.688 9.125 300 HB3 LYS 42 2HB LYS 42 7.038 -4.592 9.189 301 HG2 LYS 42 1HG LYS 42 8.627 -7.015 10.141 302 HG3 LYS 42 2HG LYS 42 8.044 -5.696 11.162 303 HD2 LYS 42 1HD LYS 42 5.690 -6.185 10.232 304 HD3 LYS 42 2HD LYS 42 6.379 -7.700 9.592 305 HE2 LYS 42 1HE LYS 42 7.149 -8.281 11.891 306 HE3 LYS 42 2HE LYS 42 6.417 -6.779 12.499 307 HZ1 LYS 42 3HZ LYS 42 4.285 -7.574 11.837 308 HZ2 LYS 42 1HZ LYS 42 4.995 -8.681 12.809 309 HZ3 LYS 42 2HZ LYS 42 4.962 -8.989 11.212 310 H LEU 43 H LEU 43 6.145 -6.008 5.827 311 HA LEU 43 HA LEU 43 7.271 -3.729 4.364 312 HB2 LEU 43 1HB LEU 43 6.081 -6.115 3.489 313 HB3 LEU 43 2HB LEU 43 4.811 -4.900 3.225 314 HG LEU 43 HG LEU 43 7.700 -4.736 2.272 315 HD11 LEU 43 1HD1 LEU 43 5.166 -5.211 0.665 316 HD12 LEU 43 2HD1 LEU 43 6.379 -6.452 1.082 317 HD13 LEU 43 3HD1 LEU 43 6.827 -5.099 0.040 318 HD21 LEU 43 3HD2 LEU 43 5.325 -2.876 1.725 319 HD22 LEU 43 1HD2 LEU 43 6.931 -2.840 0.934 320 HD23 LEU 43 2HD2 LEU 43 6.819 -2.476 2.627 321 H TYR 44 H TYR 44 6.559 -1.734 4.922 322 HA TYR 44 HA TYR 44 3.829 -1.429 6.054 323 HB2 TYR 44 1HB TYR 44 6.273 0.362 6.237 324 HB3 TYR 44 2HB TYR 44 4.714 0.669 6.985 325 HD1 TYR 44 2HD TYR 44 4.005 -2.001 8.121 326 HD2 TYR 44 1HD TYR 44 7.759 0.116 8.049 327 HE1 TYR 44 2HE TYR 44 4.686 -3.172 10.170 328 HE2 TYR 44 1HE TYR 44 8.429 -1.021 10.171 329 HH TYR 44 HH TYR 44 6.147 -3.165 11.942 330 H VAL 45 H VAL 45 2.365 -0.453 4.690 331 HA VAL 45 HA VAL 45 3.335 1.221 2.305 332 HB VAL 45 HB VAL 45 2.764 -1.408 2.129 333 HG11 VAL 45 1HG1 VAL 45 0.770 -1.159 2.963 334 HG12 VAL 45 2HG1 VAL 45 0.312 -0.182 1.509 335 HG13 VAL 45 3HG1 VAL 45 0.952 -1.875 1.297 336 HG21 VAL 45 3HG2 VAL 45 1.942 0.833 0.263 337 HG22 VAL 45 1HG2 VAL 45 3.603 0.288 0.359 338 HG23 VAL 45 2HG2 VAL 45 2.386 -0.847 -0.243 339 H LYS 46 H LYS 46 1.822 2.726 1.612 340 HA LYS 46 HA LYS 46 -0.150 3.513 3.675 341 HB2 LYS 46 1HB LYS 46 2.102 4.491 4.071 342 HB3 LYS 46 2HB LYS 46 2.051 5.254 2.471 343 HG2 LYS 46 1HG LYS 46 -0.100 6.384 3.315 344 HG3 LYS 46 2HG LYS 46 0.280 5.757 4.896 345 HD2 LYS 46 1HD LYS 46 1.892 7.726 3.220 346 HD3 LYS 46 2HD LYS 46 0.906 8.088 4.639 347 HE2 LYS 46 1HE LYS 46 2.422 6.847 6.083 348 HE3 LYS 46 2HE LYS 46 3.392 6.333 4.693 349 HZ1 LYS 46 3HZ LYS 46 4.228 8.350 6.006 350 HZ2 LYS 46 1HZ LYS 46 3.002 9.191 5.294 351 HZ3 LYS 46 2HZ LYS 46 4.157 8.550 4.384 352 H ALA 47 H ALA 47 -1.803 2.836 2.168 353 HA ALA 47 HA ALA 47 -1.591 3.762 -0.629 354 HB1 ALA 47 1HB ALA 47 -3.214 1.951 -1.088 355 HB2 ALA 47 2HB ALA 47 -1.744 1.381 -0.274 356 HB3 ALA 47 3HB ALA 47 -3.241 1.595 0.648 357 H ARG 48 H ARG 48 -3.016 4.963 -1.676 358 HA ARG 48 HA ARG 48 -4.828 6.559 -0.037 359 HB2 ARG 48 1HB ARG 48 -3.268 7.779 -1.284 360 HB3 ARG 48 2HB ARG 48 -3.561 6.880 -2.775 361 HG2 ARG 48 1HG ARG 48 -5.336 8.168 -3.405 362 HG3 ARG 48 2HG ARG 48 -5.997 8.313 -1.778 363 HD2 ARG 48 1HD ARG 48 -5.236 10.515 -2.498 364 HD3 ARG 48 2HD ARG 48 -4.273 9.881 -1.164 365 HE ARG 48 HE ARG 48 -2.438 10.083 -2.431 366 HH11 ARG 48 1HH1 ARG 48 -5.154 10.254 -4.702 367 HH12 ARG 48 2HH1 ARG 48 -4.133 10.513 -6.082 368 HH21 ARG 48 1HH2 ARG 48 -1.102 10.464 -4.324 369 HH22 ARG 48 2HH2 ARG 48 -1.860 10.504 -5.869 370 H PHE 49 H PHE 49 -6.822 5.945 0.142 371 HA PHE 49 HA PHE 49 -8.206 4.638 -2.166 372 HB2 PHE 49 1HB PHE 49 -8.937 4.488 0.778 373 HB3 PHE 49 2HB PHE 49 -9.774 3.704 -0.548 374 HD1 PHE 49 2HD PHE 49 -6.611 3.638 1.357 375 HD2 PHE 49 1HD PHE 49 -8.954 1.519 -1.635 376 HE1 PHE 49 2HE PHE 49 -5.182 1.648 1.576 377 HE2 PHE 49 1HE PHE 49 -7.648 -0.439 -1.274 378 HZ PHE 49 HZ PHE 49 -5.697 -0.425 0.297 379 H MET 50 H MET 50 -9.042 6.289 -3.364 380 HA MET 50 HA MET 50 -10.218 8.577 -1.949 381 HB2 MET 50 1HB MET 50 -10.310 8.207 -4.945 382 HB3 MET 50 2HB MET 50 -10.418 9.685 -4.009 383 HG2 MET 50 1HG MET 50 -7.894 8.142 -3.829 384 HG3 MET 50 2HG MET 50 -8.252 8.924 -5.375 385 HE1 MET 50 3HE MET 50 -7.945 9.387 -1.578 386 HE2 MET 50 1HE MET 50 -7.613 11.120 -1.379 387 HE3 MET 50 2HE MET 50 -9.237 10.577 -1.854 388 H GLY 51 H GLY 51 -12.245 8.353 -1.363 389 HA2 GLY 51 1HA GLY 51 -14.634 7.950 -1.682 390 HA3 GLY 51 2HA GLY 51 -14.263 6.780 -2.944 391 H TYR 52 H TYR 52 -16.056 6.144 -0.898 392 HA TYR 52 HA TYR 52 -14.865 5.196 1.523 393 HB2 TYR 52 1HB TYR 52 -17.240 6.227 0.740 394 HB3 TYR 52 2HB TYR 52 -17.668 4.562 0.562 395 HD1 TYR 52 2HD TYR 52 -17.166 3.043 2.807 396 HD2 TYR 52 1HD TYR 52 -17.592 7.350 2.677 397 HE1 TYR 52 2HE TYR 52 -17.838 3.104 5.226 398 HE2 TYR 52 1HE TYR 52 -18.312 7.355 5.037 399 HH TYR 52 HH TYR 52 -18.843 4.353 6.907 400 H THR 53 H THR 53 -14.003 3.108 1.874 401 HA THR 53 HA THR 53 -15.242 0.806 0.658 402 HB THR 53 HB THR 53 -13.755 1.857 -1.154 403 HG1 THR 53 1HG THR 53 -13.760 -0.053 -1.925 404 HG21 THR 53 3HG2 THR 53 -11.470 0.628 0.426 405 HG22 THR 53 1HG2 THR 53 -11.786 2.367 0.343 406 HG23 THR 53 2HG2 THR 53 -11.345 1.462 -1.094 407 H LYS 54 H LYS 54 -14.761 -1.090 1.702 408 HA LYS 54 HA LYS 54 -12.542 -1.101 3.666 409 HB2 LYS 54 1HB LYS 54 -15.461 -1.316 4.271 410 HB3 LYS 54 2HB LYS 54 -14.355 -2.321 5.239 411 HG2 LYS 54 1HG LYS 54 -13.737 0.594 4.861 412 HG3 LYS 54 2HG LYS 54 -15.065 0.154 5.901 413 HD2 LYS 54 1HD LYS 54 -12.332 -0.997 6.423 414 HD3 LYS 54 2HD LYS 54 -12.752 0.682 6.852 415 HE2 LYS 54 1HE LYS 54 -14.774 -0.121 8.048 416 HE3 LYS 54 2HE LYS 54 -14.256 -1.787 7.785 417 HZ1 LYS 54 3HZ LYS 54 -12.728 0.256 9.337 418 HZ2 LYS 54 1HZ LYS 54 -12.300 -1.324 9.153 419 HZ3 LYS 54 2HZ LYS 54 -13.673 -0.926 9.956 420 H LEU 55 H LEU 55 -14.081 -2.743 1.144 421 HA LEU 55 HA LEU 55 -13.636 -5.476 2.124 422 HB2 LEU 55 1HB LEU 55 -14.716 -4.206 -0.415 423 HB3 LEU 55 2HB LEU 55 -14.477 -5.941 -0.295 424 HG LEU 55 HG LEU 55 -16.236 -4.418 1.657 425 HD11 LEU 55 1HD1 LEU 55 -18.136 -5.253 0.320 426 HD12 LEU 55 2HD1 LEU 55 -17.012 -5.926 -0.888 427 HD13 LEU 55 3HD1 LEU 55 -17.116 -4.173 -0.628 428 HD21 LEU 55 3HD2 LEU 55 -17.130 -6.698 2.110 429 HD22 LEU 55 1HD2 LEU 55 -15.416 -6.611 2.478 430 HD23 LEU 55 2HD2 LEU 55 -15.931 -7.394 0.986 431 H THR 56 H THR 56 -11.187 -4.205 2.194 432 HA THR 56 HA THR 56 -9.726 -4.148 -0.234 433 HB THR 56 HB THR 56 -8.086 -4.786 2.134 434 HG1 THR 56 1HG THR 56 -9.561 -4.024 3.422 435 HG21 THR 56 3HG2 THR 56 -7.094 -2.635 1.695 436 HG22 THR 56 1HG2 THR 56 -8.390 -2.205 0.544 437 HG23 THR 56 2HG2 THR 56 -7.269 -3.539 0.181 438 H VAL 57 H VAL 57 -8.096 -5.655 -1.147 439 HA VAL 57 HA VAL 57 -7.826 -8.222 0.247 440 HB VAL 57 HB VAL 57 -8.553 -7.962 -2.711 441 HG11 VAL 57 1HG1 VAL 57 -7.994 -10.468 -1.060 442 HG12 VAL 57 2HG1 VAL 57 -8.672 -10.438 -2.691 443 HG13 VAL 57 3HG1 VAL 57 -7.037 -9.861 -2.441 444 HG21 VAL 57 3HG2 VAL 57 -10.596 -9.242 -2.142 445 HG22 VAL 57 1HG2 VAL 57 -10.170 -9.148 -0.429 446 HG23 VAL 57 2HG2 VAL 57 -10.561 -7.683 -1.329 447 H ILE 58 H ILE 58 -5.869 -9.230 -0.167 448 HA ILE 58 HA ILE 58 -3.887 -8.259 -2.093 449 HB ILE 58 HB ILE 58 -3.271 -8.847 0.852 450 HG12 ILE 58 1HG1 ILE 58 -2.864 -6.171 -0.546 451 HG13 ILE 58 2HG1 ILE 58 -4.209 -6.550 0.518 452 HG21 ILE 58 1HG2 ILE 58 -1.535 -9.647 -0.764 453 HG22 ILE 58 2HG2 ILE 58 -1.395 -7.989 -1.392 454 HG23 ILE 58 3HG2 ILE 58 -0.926 -8.369 0.272 455 HD11 ILE 58 3HD1 ILE 58 -2.500 -7.132 2.348 456 HD12 ILE 58 1HD1 ILE 58 -1.285 -6.384 1.294 457 HD13 ILE 58 2HD1 ILE 58 -2.637 -5.426 1.911 458 H THR 59 H THR 59 -3.853 -10.276 -3.328 459 HA THR 59 HA THR 59 -5.171 -12.496 -2.324 460 HB THR 59 HB THR 59 -3.342 -13.129 -4.503 461 HG1 THR 59 1HG THR 59 -3.588 -11.568 -5.799 462 HG21 THR 59 3HG2 THR 59 -5.378 -13.531 -5.750 463 HG22 THR 59 1HG2 THR 59 -6.342 -12.623 -4.555 464 HG23 THR 59 2HG2 THR 59 -5.584 -14.164 -4.112 465 H GLY 60 H GLY 60 -1.707 -11.742 -2.382 466 HA2 GLY 60 1HA GLY 60 0.055 -12.622 -1.227 467 HA3 GLY 60 2HA GLY 60 -1.044 -13.734 -0.400 468 H LYS 61 H LYS 61 1.099 -14.965 -0.832 469 HA LYS 61 HA LYS 61 1.498 -16.170 -3.373 470 HB2 LYS 61 1HB LYS 61 2.975 -17.595 -2.342 471 HB3 LYS 61 2HB LYS 61 2.979 -16.148 -1.349 472 HG2 LYS 61 1HG LYS 61 1.291 -17.489 0.154 473 HG3 LYS 61 2HG LYS 61 1.967 -18.886 -0.690 474 HD2 LYS 61 1HD LYS 61 3.055 -17.150 1.415 475 HD3 LYS 61 2HD LYS 61 3.384 -18.831 1.114 476 HE2 LYS 61 1HE LYS 61 4.674 -16.494 -0.411 477 HE3 LYS 61 2HE LYS 61 5.347 -17.224 1.025 478 HZ1 LYS 61 3HZ LYS 61 5.631 -19.251 -0.024 479 HZ2 LYS 61 1HZ LYS 61 6.257 -18.142 -1.030 480 HZ3 LYS 61 2HZ LYS 61 4.806 -18.834 -1.394 481 H ASP 62 H ASP 62 -0.414 -17.162 -0.626 482 HA ASP 62 HA ASP 62 -1.463 -19.540 -1.416 483 HB2 ASP 62 1HB ASP 62 -2.766 -17.312 0.207 484 HB3 ASP 62 2HB ASP 62 -3.293 -18.989 0.228 485 H GLY 63 H GLY 63 -2.380 -16.400 -2.695 486 HA2 GLY 63 1HA GLY 63 -3.895 -15.813 -4.307 487 HA3 GLY 63 2HA GLY 63 -4.121 -17.534 -4.640 488 H LYS 64 H LYS 64 -4.783 -15.869 -1.510 489 HA LYS 64 HA LYS 64 -7.667 -15.940 -2.107 490 HB2 LYS 64 1HB LYS 64 -6.496 -16.865 0.547 491 HB3 LYS 64 2HB LYS 64 -8.194 -16.661 0.128 492 HG2 LYS 64 1HG LYS 64 -7.837 -18.358 -1.704 493 HG3 LYS 64 2HG LYS 64 -6.227 -18.674 -1.057 494 HD2 LYS 64 1HD LYS 64 -7.043 -19.490 1.018 495 HD3 LYS 64 2HD LYS 64 -8.647 -18.811 0.759 496 HE2 LYS 64 1HE LYS 64 -8.744 -21.173 0.571 497 HE3 LYS 64 2HE LYS 64 -9.152 -20.443 -0.984 498 HZ1 LYS 64 3HZ LYS 64 -6.434 -21.446 -0.414 499 HZ2 LYS 64 1HZ LYS 64 -7.106 -21.156 -1.866 500 HZ3 LYS 64 2HZ LYS 64 -7.623 -22.439 -0.969 501 H ASN 65 H ASN 65 -5.927 -14.913 0.925 502 HA ASN 65 HA ASN 65 -6.216 -12.105 0.326 503 HB2 ASN 65 1HB ASN 65 -8.675 -12.947 0.646 504 HB3 ASN 65 2HB ASN 65 -8.238 -13.203 2.331 505 HD21 ASN 65 1HD2 ASN 65 -6.824 -10.862 3.056 506 HD22 ASN 65 2HD2 ASN 65 -7.961 -9.540 2.808 507 H LEU 66 H LEU 66 -4.160 -11.857 1.286 508 HA LEU 66 HA LEU 66 -3.310 -13.169 3.620 509 HB2 LEU 66 1HB LEU 66 -2.378 -10.477 2.560 510 HB3 LEU 66 2HB LEU 66 -1.561 -11.436 3.801 511 HG LEU 66 HG LEU 66 -2.016 -12.189 0.904 512 HD11 LEU 66 1HD1 LEU 66 -0.175 -10.603 1.300 513 HD12 LEU 66 2HD1 LEU 66 0.518 -12.191 0.921 514 HD13 LEU 66 3HD1 LEU 66 0.483 -11.635 2.596 515 HD21 LEU 66 3HD2 LEU 66 -1.041 -13.872 3.240 516 HD22 LEU 66 1HD2 LEU 66 -0.468 -14.221 1.615 517 HD23 LEU 66 2HD2 LEU 66 -2.196 -14.301 1.965 518 H LEU 67 H LEU 67 -5.073 -10.096 3.387 519 HA LEU 67 HA LEU 67 -4.765 -9.421 6.135 520 HB2 LEU 67 1HB LEU 67 -6.574 -8.570 3.954 521 HB3 LEU 67 2HB LEU 67 -7.236 -8.395 5.562 522 HG LEU 67 HG LEU 67 -5.300 -6.954 6.193 523 HD11 LEU 67 1HD1 LEU 67 -4.460 -7.100 3.323 524 HD12 LEU 67 2HD1 LEU 67 -3.616 -7.786 4.708 525 HD13 LEU 67 3HD1 LEU 67 -3.804 -6.040 4.597 526 HD21 LEU 67 3HD2 LEU 67 -7.096 -6.186 3.858 527 HD22 LEU 67 1HD2 LEU 67 -6.008 -5.024 4.610 528 HD23 LEU 67 2HD2 LEU 67 -7.280 -5.812 5.566 529 H TYR 68 H TYR 68 -6.605 -12.041 4.720 530 HA TYR 68 HA TYR 68 -8.099 -12.361 7.259 531 HB2 TYR 68 1HB TYR 68 -9.337 -12.074 5.046 532 HB3 TYR 68 2HB TYR 68 -8.630 -13.616 4.554 533 HD1 TYR 68 2HD TYR 68 -10.522 -12.040 7.406 534 HD2 TYR 68 1HD TYR 68 -9.736 -15.638 5.144 535 HE1 TYR 68 2HE TYR 68 -12.098 -13.262 8.811 536 HE2 TYR 68 1HE TYR 68 -11.386 -16.842 6.468 537 HH TYR 68 HH TYR 68 -12.700 -16.772 8.394 538 H ASN 69 H ASN 69 -5.406 -13.564 5.444 539 HA ASN 69 HA ASN 69 -5.505 -16.312 6.012 540 HB2 ASN 69 1HB ASN 69 -4.160 -15.136 4.267 541 HB3 ASN 69 2HB ASN 69 -3.136 -14.446 5.526 542 HD21 ASN 69 1HD2 ASN 69 -4.361 -17.729 4.405 543 HD22 ASN 69 2HD2 ASN 69 -2.817 -18.457 4.735 544 H GLY 70 H GLY 70 -3.533 -13.717 7.533 545 HA2 GLY 70 1HA GLY 70 -4.177 -14.203 10.177 546 HA3 GLY 70 2HA GLY 70 -2.847 -15.317 9.846 547 H THR 71 H THR 71 -1.458 -13.440 7.919 548 HA THR 71 HA THR 71 -0.021 -12.086 10.064 549 HB THR 71 HB THR 71 0.635 -11.824 7.120 550 HG1 THR 71 1HG THR 71 0.866 -14.078 8.791 551 HG21 THR 71 3HG2 THR 71 2.374 -12.043 9.609 552 HG22 THR 71 1HG2 THR 71 2.052 -10.558 8.676 553 HG23 THR 71 2HG2 THR 71 2.953 -11.888 7.936 554 H ALA 72 H ALA 72 -1.511 -10.903 6.957 555 HA ALA 72 HA ALA 72 -0.480 -8.303 7.690 556 HB1 ALA 72 1HB ALA 72 -0.316 -9.176 5.380 557 HB2 ALA 72 2HB ALA 72 -2.077 -9.290 5.266 558 HB3 ALA 72 3HB ALA 72 -1.294 -7.700 5.385 559 H LYS 73 H LYS 73 -1.608 -6.336 7.729 560 HA LYS 73 HA LYS 73 -4.502 -6.340 8.224 561 HB2 LYS 73 1HB LYS 73 -3.627 -7.388 10.248 562 HB3 LYS 73 2HB LYS 73 -2.410 -6.140 10.423 563 HG2 LYS 73 1HG LYS 73 -4.151 -5.851 12.065 564 HG3 LYS 73 2HG LYS 73 -4.207 -4.511 10.935 565 HD2 LYS 73 1HD LYS 73 -6.085 -5.692 9.709 566 HD3 LYS 73 2HD LYS 73 -5.929 -7.027 10.867 567 HE2 LYS 73 1HE LYS 73 -6.359 -5.160 12.651 568 HE3 LYS 73 2HE LYS 73 -6.994 -4.230 11.302 569 HZ1 LYS 73 3HZ LYS 73 -7.906 -6.941 12.067 570 HZ2 LYS 73 1HZ LYS 73 -8.596 -6.028 10.910 571 HZ3 LYS 73 2HZ LYS 73 -8.681 -5.569 12.498 572 H MET 74 H MET 74 -5.353 -4.266 8.279 573 HA MET 74 HA MET 74 -3.519 -1.971 7.953 574 HB2 MET 74 1HB MET 74 -5.605 -1.877 6.564 575 HB3 MET 74 2HB MET 74 -6.562 -2.092 8.002 576 HG2 MET 74 1HG MET 74 -4.553 0.143 7.949 577 HG3 MET 74 2HG MET 74 -5.995 0.326 6.960 578 HE1 MET 74 3HE MET 74 -8.415 1.045 8.014 579 HE2 MET 74 1HE MET 74 -8.147 -0.712 7.951 580 HE3 MET 74 2HE MET 74 -8.872 0.041 9.408 581 H PHE 75 H PHE 75 -2.753 -1.093 9.764 582 HA PHE 75 HA PHE 75 -4.179 -1.485 12.351 583 HB2 PHE 75 1HB PHE 75 -2.003 -1.668 13.373 584 HB3 PHE 75 2HB PHE 75 -2.181 -2.855 12.098 585 HD1 PHE 75 2HD PHE 75 -1.010 -2.442 9.826 586 HD2 PHE 75 1HD PHE 75 -0.211 -0.087 13.349 587 HE1 PHE 75 2HE PHE 75 1.087 -1.596 8.800 588 HE2 PHE 75 1HE PHE 75 1.933 0.724 12.267 589 HZ PHE 75 HZ PHE 75 2.550 -0.062 10.038 590 H LYS 76 H LYS 76 -3.996 0.870 10.172 591 HA LYS 76 HA LYS 76 -3.888 3.024 12.050 592 HB2 LYS 76 1HB LYS 76 -1.478 2.754 11.831 593 HB3 LYS 76 2HB LYS 76 -1.572 2.688 10.074 594 HG2 LYS 76 1HG LYS 76 -2.185 5.012 9.918 595 HG3 LYS 76 2HG LYS 76 -2.495 5.117 11.653 596 HD2 LYS 76 1HD LYS 76 -0.176 4.866 12.190 597 HD3 LYS 76 2HD LYS 76 0.248 4.384 10.550 598 HE2 LYS 76 1HE LYS 76 0.990 6.653 10.997 599 HE3 LYS 76 2HE LYS 76 -0.246 6.671 9.739 600 HZ1 LYS 76 3HZ LYS 76 -1.619 7.865 11.024 601 HZ2 LYS 76 1HZ LYS 76 -0.252 8.270 11.811 602 HZ3 LYS 76 2HZ LYS 76 -1.202 7.092 12.434 603 H SER 77 H SER 77 -5.291 4.541 11.192 604 HA SER 77 HA SER 77 -5.644 4.611 8.280 605 HB2 SER 77 1HB SER 77 -8.198 4.528 8.815 606 HB3 SER 77 2HB SER 77 -7.263 3.064 8.609 607 HG SER 77 HG SER 77 -7.536 4.134 11.195 608 H ASP 78 H ASP 78 -4.999 6.601 7.964 609 HA ASP 78 HA ASP 78 -5.863 8.892 9.671 610 HB2 ASP 78 1HB ASP 78 -3.457 8.207 8.087 611 HB3 ASP 78 2HB ASP 78 -4.139 9.742 7.582 612 H ALA 79 H ALA 79 -6.619 10.790 8.517 613 HA ALA 79 HA ALA 79 -8.484 10.146 6.333 614 HB1 ALA 79 1HB ALA 79 -9.312 12.429 6.804 615 HB2 ALA 79 2HB ALA 79 -9.182 11.468 8.303 616 HB3 ALA 79 3HB ALA 79 -7.955 12.691 7.928 617 H ILE 80 H ILE 80 -8.253 10.866 4.197 618 HA ILE 80 HA ILE 80 -5.761 12.342 3.496 619 HB ILE 80 HB ILE 80 -7.551 10.674 1.693 620 HG12 ILE 80 1HG1 ILE 80 -4.690 10.162 2.590 621 HG13 ILE 80 2HG1 ILE 80 -6.080 9.461 3.364 622 HG21 ILE 80 1HG2 ILE 80 -6.564 12.604 0.501 623 HG22 ILE 80 2HG2 ILE 80 -4.950 12.155 1.099 624 HG23 ILE 80 3HG2 ILE 80 -5.827 11.108 -0.030 625 HD11 ILE 80 3HD1 ILE 80 -6.731 8.398 1.161 626 HD12 ILE 80 1HD1 ILE 80 -5.208 9.017 0.492 627 HD13 ILE 80 2HD1 ILE 80 -5.160 7.857 1.798 628 H LEU 81 H LEU 81 -6.047 14.302 2.987 629 HA LEU 81 HA LEU 81 -8.810 15.326 2.621 630 HB2 LEU 81 1HB LEU 81 -6.406 16.913 3.504 631 HB3 LEU 81 2HB LEU 81 -8.076 17.460 3.408 632 HG LEU 81 HG LEU 81 -6.907 15.402 5.314 633 HD11 LEU 81 1HD1 LEU 81 -8.271 18.074 5.818 634 HD12 LEU 81 2HD1 LEU 81 -6.524 17.776 5.865 635 HD13 LEU 81 3HD1 LEU 81 -7.589 16.983 7.037 636 HD21 LEU 81 3HD2 LEU 81 -9.102 14.518 4.809 637 HD22 LEU 81 1HD2 LEU 81 -9.844 16.115 4.958 638 HD23 LEU 81 2HD2 LEU 81 -9.169 15.290 6.384 639 H GLY 82 H GLY 82 -9.264 16.880 1.054 640 HA2 GLY 82 1HA GLY 82 -7.773 16.673 -1.452 641 HA3 GLY 82 2HA GLY 82 -9.283 17.541 -1.187 642 H GLN 83 H GLN 83 -8.558 19.418 -2.294 643 HA GLN 83 HA GLN 83 -6.285 20.849 -1.112 644 HB2 GLN 83 1HB GLN 83 -8.031 21.296 -3.575 645 HB3 GLN 83 2HB GLN 83 -6.826 22.469 -3.095 646 HG2 GLN 83 1HG GLN 83 -5.921 19.606 -3.485 647 HG3 GLN 83 2HG GLN 83 -6.272 20.615 -4.889 648 HE21 GLN 83 1HE2 GLN 83 -3.796 19.947 -2.478 649 HE22 GLN 83 2HE2 GLN 83 -2.809 21.315 -2.924 650 H ASN 84 H ASN 84 -9.015 20.519 0.152 651 HA ASN 84 HA ASN 84 -9.291 23.210 1.220 652 HB2 ASN 84 1HB ASN 84 -11.667 23.480 0.600 653 HB3 ASN 84 2HB ASN 84 -10.583 23.591 -0.771 654 HD21 ASN 84 1HD2 ASN 84 -10.357 21.597 -2.107 655 HD22 ASN 84 2HD2 ASN 84 -11.783 20.642 -2.394 656 H LYS 85 H LYS 85 -8.474 20.827 2.393 657 HA LYS 85 HA LYS 85 -8.788 19.455 4.109 658 HB2 LYS 85 1HB LYS 85 -10.947 21.427 4.891 659 HB3 LYS 85 2HB LYS 85 -10.198 20.254 5.962 660 HG2 LYS 85 1HG LYS 85 -8.020 21.321 5.772 661 HG3 LYS 85 2HG LYS 85 -8.627 22.449 4.540 662 HD2 LYS 85 1HD LYS 85 -10.232 23.384 6.131 663 HD3 LYS 85 2HD LYS 85 -9.656 22.279 7.399 664 HE2 LYS 85 1HE LYS 85 -7.465 23.323 7.388 665 HE3 LYS 85 2HE LYS 85 -7.883 24.302 5.966 666 HZ1 LYS 85 3HZ LYS 85 -9.279 24.494 8.563 667 HZ2 LYS 85 1HZ LYS 85 -9.516 25.463 7.266 668 HZ3 LYS 85 2HZ LYS 85 -8.099 25.516 8.121 669 H VAL 86 H VAL 86 -10.838 19.243 1.704 670 HA VAL 86 HA VAL 86 -13.145 17.995 2.803 671 HB VAL 86 HB VAL 86 -13.562 19.088 0.885 672 HG11 VAL 86 1HG1 VAL 86 -11.244 17.583 -0.257 673 HG12 VAL 86 2HG1 VAL 86 -12.357 18.589 -1.241 674 HG13 VAL 86 3HG1 VAL 86 -11.402 19.335 0.053 675 HG21 VAL 86 3HG2 VAL 86 -13.446 16.153 0.056 676 HG22 VAL 86 1HG2 VAL 86 -14.779 16.955 0.918 677 HG23 VAL 86 2HG2 VAL 86 -14.378 17.436 -0.734 678 H VAL 87 H VAL 87 -13.635 15.712 3.172 679 HA VAL 87 HA VAL 87 -11.213 14.071 3.380 680 HB VAL 87 HB VAL 87 -14.019 13.316 4.236 681 HG11 VAL 87 1HG1 VAL 87 -12.788 11.813 5.747 682 HG12 VAL 87 2HG1 VAL 87 -12.283 11.510 4.076 683 HG13 VAL 87 3HG1 VAL 87 -11.229 12.435 5.152 684 HG21 VAL 87 3HG2 VAL 87 -11.887 14.724 5.905 685 HG22 VAL 87 1HG2 VAL 87 -13.449 15.420 5.408 686 HG23 VAL 87 2HG2 VAL 87 -13.426 14.031 6.486 687 H ILE 88 H ILE 88 -10.844 13.982 1.153 688 HA ILE 88 HA ILE 88 -12.680 12.742 -0.714 689 HB ILE 88 HB ILE 88 -10.634 12.670 -2.190 690 HG12 ILE 88 1HG1 ILE 88 -9.254 14.220 0.043 691 HG13 ILE 88 2HG1 ILE 88 -8.940 12.529 -0.290 692 HG21 ILE 88 1HG2 ILE 88 -11.248 15.350 -0.875 693 HG22 ILE 88 2HG2 ILE 88 -10.695 15.094 -2.548 694 HG23 ILE 88 3HG2 ILE 88 -12.296 14.542 -2.054 695 HD11 ILE 88 3HD1 ILE 88 -7.244 13.895 -1.379 696 HD12 ILE 88 1HD1 ILE 88 -8.252 13.125 -2.620 697 HD13 ILE 88 2HD1 ILE 88 -8.499 14.821 -2.219 698 H GLY 89 H GLY 89 -10.257 11.474 1.539 699 HA2 GLY 89 1HA GLY 89 -11.020 8.751 0.874 700 HA3 GLY 89 2HA GLY 89 -9.403 9.193 0.291 701 H TRP 90 H TRP 90 -8.993 7.293 1.864 702 HA TRP 90 HA TRP 90 -8.207 8.400 4.459 703 HB2 TRP 90 1HB TRP 90 -9.934 5.938 4.017 704 HB3 TRP 90 2HB TRP 90 -9.203 6.355 5.553 705 HD1 TRP 90 HD TRP 90 -10.169 8.389 6.900 706 HE1 TRP 90 1HE TRP 90 -12.372 9.756 6.692 707 HE3 TRP 90 3HE TRP 90 -11.636 6.720 2.371 708 HZ2 TRP 90 2HZ TRP 90 -14.494 10.061 4.722 709 HZ3 TRP 90 3HZ TRP 90 -13.762 7.541 1.300 710 HH2 TRP 90 HH TRP 90 -15.175 9.228 2.473 711 H ASP 91 H ASP 91 -6.297 7.612 5.021 712 HA ASP 91 HA ASP 91 -4.756 6.074 3.034 713 HB2 ASP 91 1HB ASP 91 -4.255 8.237 4.904 714 HB3 ASP 91 2HB ASP 91 -3.250 6.883 5.373 715 H LYS 92 H LYS 92 -5.615 4.048 3.276 716 HA LYS 92 HA LYS 92 -5.677 2.790 6.008 717 HB2 LYS 92 1HB LYS 92 -6.571 1.724 3.321 718 HB3 LYS 92 2HB LYS 92 -6.284 0.676 4.685 719 HG2 LYS 92 1HG LYS 92 -8.622 1.111 4.532 720 HG3 LYS 92 2HG LYS 92 -8.012 1.884 5.988 721 HD2 LYS 92 1HD LYS 92 -8.239 4.032 5.121 722 HD3 LYS 92 2HD LYS 92 -8.258 3.508 3.435 723 HE2 LYS 92 1HE LYS 92 -10.441 2.500 5.244 724 HE3 LYS 92 2HE LYS 92 -10.521 4.195 4.760 725 HZ1 LYS 92 3HZ LYS 92 -10.674 3.610 2.520 726 HZ2 LYS 92 1HZ LYS 92 -11.697 2.633 3.273 727 HZ3 LYS 92 2HZ LYS 92 -10.246 2.027 2.779 728 H TYR 93 H TYR 93 -3.717 2.405 6.727 729 HA TYR 93 HA TYR 93 -1.428 1.842 5.034 730 HB2 TYR 93 1HB TYR 93 -1.986 1.682 8.027 731 HB3 TYR 93 2HB TYR 93 -0.447 1.240 7.358 732 HD1 TYR 93 2HD TYR 93 -2.826 4.207 7.268 733 HD2 TYR 93 1HD TYR 93 1.259 2.823 7.299 734 HE1 TYR 93 2HE TYR 93 -2.038 6.531 7.385 735 HE2 TYR 93 1HE TYR 93 2.045 5.120 7.448 736 HH TYR 93 HH TYR 93 1.354 7.260 8.142 737 H PHE 94 H PHE 94 -0.132 -0.260 5.251 738 HA PHE 94 HA PHE 94 -1.684 -2.523 6.372 739 HB2 PHE 94 1HB PHE 94 -0.194 -2.785 3.722 740 HB3 PHE 94 2HB PHE 94 -1.033 -4.053 4.615 741 HD1 PHE 94 2HD PHE 94 -3.549 -3.777 5.121 742 HD2 PHE 94 1HD PHE 94 -1.407 -1.294 2.351 743 HE1 PHE 94 2HE PHE 94 -5.709 -2.786 4.368 744 HE2 PHE 94 1HE PHE 94 -3.578 -0.280 1.622 745 HZ PHE 94 HZ PHE 94 -5.708 -1.010 2.643 746 H GLU 95 H GLU 95 -0.518 -4.009 7.420 747 HA GLU 95 HA GLU 95 2.445 -3.934 7.430 748 HB2 GLU 95 1HB GLU 95 1.042 -3.988 9.624 749 HB3 GLU 95 2HB GLU 95 0.486 -5.571 9.154 750 HG2 GLU 95 1HG GLU 95 2.731 -6.469 9.238 751 HG3 GLU 95 2HG GLU 95 3.427 -4.851 9.380 752 H ILE 96 H ILE 96 3.042 -5.186 5.555 753 HA ILE 96 HA ILE 96 1.485 -7.661 5.190 754 HB ILE 96 HB ILE 96 3.115 -6.453 2.956 755 HG12 ILE 96 1HG1 ILE 96 0.152 -5.806 3.281 756 HG13 ILE 96 2HG1 ILE 96 1.424 -4.659 3.724 757 HG21 ILE 96 1HG2 ILE 96 2.312 -8.760 2.752 758 HG22 ILE 96 2HG2 ILE 96 0.646 -8.256 3.115 759 HG23 ILE 96 3HG2 ILE 96 1.425 -7.771 1.609 760 HD11 ILE 96 3HD1 ILE 96 0.581 -4.146 1.541 761 HD12 ILE 96 1HD1 ILE 96 2.305 -4.579 1.524 762 HD13 ILE 96 2HD1 ILE 96 1.073 -5.725 0.921 763 HA PRO 97 HA PRO 97 5.606 -9.491 5.971 764 HB2 PRO 97 1HB PRO 97 5.142 -11.932 4.743 765 HB3 PRO 97 2HB PRO 97 4.665 -11.542 6.427 766 HG2 PRO 97 1HG PRO 97 3.014 -11.420 3.890 767 HG3 PRO 97 2HG PRO 97 2.559 -12.157 5.468 768 HD2 PRO 97 1HD PRO 97 1.754 -9.731 4.707 769 HD3 PRO 97 2HD PRO 97 2.198 -9.996 6.413 770 H MET 98 H MET 98 7.304 -10.241 4.604 771 HA MET 98 HA MET 98 7.120 -9.432 1.733 772 HB2 MET 98 1HB MET 98 9.510 -9.971 3.544 773 HB3 MET 98 2HB MET 98 9.610 -9.670 1.807 774 HG2 MET 98 1HG MET 98 8.629 -7.454 2.064 775 HG3 MET 98 2HG MET 98 8.400 -7.725 3.792 776 HE1 MET 98 3HE MET 98 9.800 -5.113 2.928 777 HE2 MET 98 1HE MET 98 9.591 -5.612 4.609 778 HE3 MET 98 2HE MET 98 11.174 -5.075 4.034 779 H ASP 99 H ASP 99 8.006 -12.189 3.912 780 HA ASP 99 HA ASP 99 8.816 -13.853 1.734 781 HB2 ASP 99 1HB ASP 99 9.037 -13.867 4.568 782 HB3 ASP 99 2HB ASP 99 8.149 -15.331 4.176 783 H ALA 100 H ALA 100 5.749 -13.378 3.397 784 HA ALA 100 HA ALA 100 4.610 -15.880 2.493 785 HB1 ALA 100 1HB ALA 100 3.985 -14.558 4.612 786 HB2 ALA 100 2HB ALA 100 2.997 -13.556 3.504 787 HB3 ALA 100 3HB ALA 100 2.674 -15.273 3.667 788 H LEU 101 H LEU 101 5.540 -13.645 0.493 789 HA LEU 101 HA LEU 101 3.002 -13.077 -0.955 790 HB2 LEU 101 1HB LEU 101 5.829 -12.041 -1.353 791 HB3 LEU 101 2HB LEU 101 4.424 -11.512 -2.271 792 HG LEU 101 HG LEU 101 4.775 -11.141 0.739 793 HD11 LEU 101 1HD1 LEU 101 4.897 -9.049 -1.465 794 HD12 LEU 101 2HD1 LEU 101 6.309 -9.924 -0.840 795 HD13 LEU 101 3HD1 LEU 101 5.381 -8.910 0.256 796 HD21 LEU 101 3HD2 LEU 101 2.644 -10.005 -1.138 797 HD22 LEU 101 1HD2 LEU 101 2.816 -9.688 0.610 798 HD23 LEU 101 2HD2 LEU 101 2.382 -11.292 0.054 799 H GLN 102 H GLN 102 2.994 -13.286 -3.246 800 HA GLN 102 HA GLN 102 3.761 -15.928 -3.991 801 HB2 GLN 102 1HB GLN 102 1.681 -14.423 -4.584 802 HB3 GLN 102 2HB GLN 102 2.712 -13.729 -5.831 803 HG2 GLN 102 1HG GLN 102 2.995 -15.870 -6.883 804 HG3 GLN 102 2HG GLN 102 2.267 -16.718 -5.502 805 HE21 GLN 102 1HE2 GLN 102 -0.028 -17.050 -5.484 806 HE22 GLN 102 2HE2 GLN 102 -1.036 -16.387 -6.735 807 H ASP 103 H ASP 103 5.137 -12.785 -4.496 808 HA ASP 103 HA ASP 103 7.270 -13.721 -6.306 809 HB2 ASP 103 1HB ASP 103 5.374 -11.374 -6.831 810 HB3 ASP 103 2HB ASP 103 6.839 -11.713 -7.746 811 H ASN 104 H ASN 104 8.800 -11.692 -6.583 812 HA ASN 104 HA ASN 104 9.160 -10.216 -4.071 813 HB2 ASN 104 1HB ASN 104 10.683 -10.029 -6.706 814 HB3 ASN 104 2HB ASN 104 11.089 -9.257 -5.175 815 HD21 ASN 104 1HD2 ASN 104 12.731 -10.226 -4.129 816 HD22 ASN 104 2HD2 ASN 104 13.104 -11.936 -4.194 817 H SER 105 H SER 105 6.609 -9.558 -4.957 818 HA SER 105 HA SER 105 7.055 -6.752 -5.529 819 HB2 SER 105 1HB SER 105 5.517 -6.477 -7.377 820 HB3 SER 105 2HB SER 105 6.664 -7.742 -7.824 821 HG SER 105 HG SER 105 5.079 -8.949 -8.181 822 H ILE 106 H ILE 106 5.070 -5.496 -5.167 823 HA ILE 106 HA ILE 106 3.134 -6.744 -3.287 824 HB ILE 106 HB ILE 106 4.761 -5.253 -2.229 825 HG12 ILE 106 1HG1 ILE 106 2.297 -5.625 -1.525 826 HG13 ILE 106 2HG1 ILE 106 3.367 -4.516 -0.694 827 HG21 ILE 106 1HG2 ILE 106 5.277 -3.643 -3.903 828 HG22 ILE 106 2HG2 ILE 106 3.596 -3.075 -3.986 829 HG23 ILE 106 3HG2 ILE 106 4.577 -2.798 -2.537 830 HD11 ILE 106 3HD1 ILE 106 1.066 -3.617 -1.016 831 HD12 ILE 106 1HD1 ILE 106 2.337 -2.580 -1.689 832 HD13 ILE 106 2HD1 ILE 106 1.355 -3.577 -2.762 833 H GLN 107 H GLN 107 1.025 -5.601 -3.392 834 HA GLN 107 HA GLN 107 0.128 -3.901 -5.377 835 HB2 GLN 107 1HB GLN 107 0.493 -6.058 -6.821 836 HB3 GLN 107 2HB GLN 107 -0.804 -6.754 -5.847 837 HG2 GLN 107 1HG GLN 107 -2.342 -4.995 -6.670 838 HG3 GLN 107 2HG GLN 107 -0.991 -4.237 -7.530 839 HE21 GLN 107 1HE2 GLN 107 -2.729 -4.479 -9.217 840 HE22 GLN 107 2HE2 GLN 107 -2.490 -5.827 -10.281 841 H ILE 108 H ILE 108 -2.267 -3.615 -5.060 842 HA ILE 108 HA ILE 108 -3.499 -5.072 -2.809 843 HB ILE 108 HB ILE 108 -3.289 -2.044 -3.130 844 HG12 ILE 108 1HG1 ILE 108 -2.499 -3.749 -0.719 845 HG13 ILE 108 2HG1 ILE 108 -1.356 -3.260 -1.963 846 HG21 ILE 108 1HG2 ILE 108 -4.732 -1.894 -1.080 847 HG22 ILE 108 2HG2 ILE 108 -5.580 -2.512 -2.467 848 HG23 ILE 108 3HG2 ILE 108 -5.035 -3.638 -1.199 849 HD11 ILE 108 3HD1 ILE 108 -2.849 -1.365 -0.166 850 HD12 ILE 108 1HD1 ILE 108 -1.132 -1.773 -0.124 851 HD13 ILE 108 2HD1 ILE 108 -1.807 -0.879 -1.495 852 H LYS 109 H LYS 109 -5.930 -4.986 -3.069 853 HA LYS 109 HA LYS 109 -6.847 -3.513 -5.375 854 HB2 LYS 109 1HB LYS 109 -8.164 -5.459 -6.304 855 HB3 LYS 109 2HB LYS 109 -6.433 -5.575 -6.478 856 HG2 LYS 109 1HG LYS 109 -6.922 -6.915 -4.040 857 HG3 LYS 109 2HG LYS 109 -8.299 -7.333 -5.044 858 HD2 LYS 109 1HD LYS 109 -6.532 -8.974 -5.232 859 HD3 LYS 109 2HD LYS 109 -6.793 -8.201 -6.790 860 HE2 LYS 109 1HE LYS 109 -4.714 -6.822 -6.463 861 HE3 LYS 109 2HE LYS 109 -4.562 -7.516 -4.813 862 HZ1 LYS 109 3HZ LYS 109 -4.443 -9.736 -6.026 863 HZ2 LYS 109 1HZ LYS 109 -3.158 -8.757 -6.277 864 HZ3 LYS 109 2HZ LYS 109 -4.266 -8.856 -7.427 865 H ALA 110 H ALA 110 -9.315 -3.043 -5.272 866 HA ALA 110 HA ALA 110 -10.502 -3.858 -2.655 867 HB1 ALA 110 1HB ALA 110 -9.284 -1.950 -1.933 868 HB2 ALA 110 2HB ALA 110 -9.617 -1.083 -3.444 869 HB3 ALA 110 3HB ALA 110 -10.905 -1.323 -2.277 870 H LEU 111 H LEU 111 -12.747 -3.485 -2.549 871 HA LEU 111 HA LEU 111 -14.017 -3.730 -5.173 872 HB2 LEU 111 1HB LEU 111 -14.658 -4.932 -2.974 873 HB3 LEU 111 2HB LEU 111 -15.391 -3.419 -2.501 874 HG LEU 111 HG LEU 111 -17.112 -4.795 -3.290 875 HD11 LEU 111 1HD1 LEU 111 -18.265 -3.831 -4.963 876 HD12 LEU 111 2HD1 LEU 111 -16.815 -3.265 -5.779 877 HD13 LEU 111 3HD1 LEU 111 -17.331 -2.537 -4.204 878 HD21 LEU 111 3HD2 LEU 111 -17.192 -5.961 -5.460 879 HD22 LEU 111 1HD2 LEU 111 -15.890 -6.522 -4.427 880 HD23 LEU 111 2HD2 LEU 111 -15.525 -5.438 -5.790 881 H SER 112 H SER 112 -15.177 -2.198 -6.178 882 HA SER 112 HA SER 112 -15.355 0.565 -5.012 883 HB2 SER 112 1HB SER 112 -14.060 0.800 -6.938 884 HB3 SER 112 2HB SER 112 -14.974 -0.373 -7.857 885 HG SER 112 HG SER 112 -15.784 1.566 -8.551 886 H SER 113 H SER 113 -17.219 -1.610 -7.265 887 HA SER 113 HA SER 113 -19.615 -1.258 -5.779 888 HB2 SER 113 1HB SER 113 -19.504 0.960 -6.936 889 HB3 SER 113 2HB SER 113 -19.437 0.125 -8.501 890 HG SER 113 HG SER 113 -21.594 0.890 -7.512 891 H GLY 114 H GLY 114 -21.092 -2.819 -6.384 892 HA2 GLY 114 1HA GLY 114 -21.881 -4.760 -7.236 893 HA3 GLY 114 2HA GLY 114 -21.166 -4.299 -8.786 894 H THR 115 H THR 115 -19.245 -5.190 -9.402 895 HA THR 115 HA THR 115 -17.905 -7.212 -7.653 896 HB THR 115 HB THR 115 -17.572 -8.374 -10.000 897 HG1 THR 115 1HG THR 115 -19.278 -7.942 -11.442 898 HG21 THR 115 3HG2 THR 115 -20.229 -8.325 -8.513 899 HG22 THR 115 1HG2 THR 115 -18.858 -9.404 -8.217 900 HG23 THR 115 2HG2 THR 115 -19.779 -9.554 -9.725 901 H THR 116 H THR 116 -17.531 -4.286 -9.249 902 HA THR 116 HA THR 116 -14.986 -4.734 -10.540 903 HB THR 116 HB THR 116 -16.453 -2.282 -9.593 904 HG1 THR 116 1HG THR 116 -15.943 -3.450 -12.153 905 HG21 THR 116 3HG2 THR 116 -14.009 -1.739 -9.572 906 HG22 THR 116 1HG2 THR 116 -14.936 -0.861 -10.787 907 HG23 THR 116 2HG2 THR 116 -13.936 -2.253 -11.277 908 H PHE 117 H PHE 117 -13.223 -4.827 -9.707 909 HA PHE 117 HA PHE 117 -12.575 -4.193 -6.888 910 HB2 PHE 117 1HB PHE 117 -12.658 -6.767 -8.183 911 HB3 PHE 117 2HB PHE 117 -10.970 -6.382 -7.861 912 HD1 PHE 117 2HD PHE 117 -10.319 -5.644 -5.493 913 HD2 PHE 117 1HD PHE 117 -14.076 -7.509 -6.434 914 HE1 PHE 117 2HE PHE 117 -10.633 -6.204 -3.092 915 HE2 PHE 117 1HE PHE 117 -14.368 -8.130 -4.054 916 HZ PHE 117 HZ PHE 117 -12.655 -7.464 -2.369 917 H VAL 118 H VAL 118 -11.335 -2.374 -7.242 918 HA VAL 118 HA VAL 118 -9.774 -2.011 -9.686 919 HB VAL 118 HB VAL 118 -10.543 -0.078 -8.513 920 HG11 VAL 118 1HG1 VAL 118 -11.139 -0.569 -6.570 921 HG12 VAL 118 2HG1 VAL 118 -9.473 -0.964 -5.989 922 HG13 VAL 118 3HG1 VAL 118 -9.954 0.714 -6.382 923 HG21 VAL 118 3HG2 VAL 118 -7.612 -0.099 -8.307 924 HG22 VAL 118 1HG2 VAL 118 -8.572 0.200 -9.760 925 HG23 VAL 118 2HG2 VAL 118 -8.690 1.345 -8.425 926 H TYR 119 H TYR 119 -7.939 -2.747 -10.149 927 HA TYR 119 HA TYR 119 -6.299 -4.046 -8.057 928 HB2 TYR 119 1HB TYR 119 -6.190 -4.149 -11.105 929 HB3 TYR 119 2HB TYR 119 -5.299 -5.189 -10.024 930 HD1 TYR 119 1HD TYR 119 -6.796 -6.784 -8.475 931 HD2 TYR 119 2HD TYR 119 -8.430 -4.608 -11.795 932 HE1 TYR 119 1HE TYR 119 -8.631 -8.415 -8.613 933 HE2 TYR 119 2HE TYR 119 -10.195 -6.291 -12.043 934 HH TYR 119 HH TYR 119 -11.279 -7.958 -10.961 935 H SER 120 H SER 120 -4.589 -2.904 -7.334 936 HA SER 120 HA SER 120 -4.105 -0.202 -8.231 937 HB2 SER 120 1HB SER 120 -2.757 -0.143 -6.410 938 HB3 SER 120 2HB SER 120 -3.745 -1.418 -5.942 939 HG SER 120 HG SER 120 -1.225 -1.971 -7.100 940 H GLN 121 H GLN 121 -1.550 0.389 -8.662 941 HA GLN 121 HA GLN 121 -0.582 -1.056 -10.954 942 HB2 GLN 121 1HB GLN 121 1.217 0.416 -10.940 943 HB3 GLN 121 2HB GLN 121 -0.136 1.392 -10.451 944 HG2 GLN 121 1HG GLN 121 1.635 0.224 -8.290 945 HG3 GLN 121 2HG GLN 121 2.273 1.437 -9.356 946 HE21 GLN 121 1HE2 GLN 121 2.297 3.349 -8.607 947 HE22 GLN 121 2HE2 GLN 121 1.273 4.057 -7.387 948 H LYS 122 H LYS 122 1.579 -2.207 -10.918 949 HA LYS 122 HA LYS 122 1.733 -4.041 -8.538 950 HB2 LYS 122 1HB LYS 122 1.035 -4.982 -10.750 951 HB3 LYS 122 2HB LYS 122 2.500 -4.332 -11.473 952 HG2 LYS 122 1HG LYS 122 3.681 -5.885 -9.592 953 HG3 LYS 122 2HG LYS 122 2.126 -6.732 -9.692 954 HD2 LYS 122 1HD LYS 122 2.484 -6.710 -12.273 955 HD3 LYS 122 2HD LYS 122 4.115 -6.123 -11.919 956 HE2 LYS 122 1HE LYS 122 4.327 -8.416 -12.306 957 HE3 LYS 122 2HE LYS 122 4.546 -8.172 -10.575 958 HZ1 LYS 122 3HZ LYS 122 2.037 -9.095 -11.859 959 HZ2 LYS 122 1HZ LYS 122 2.328 -9.029 -10.221 960 HZ3 LYS 122 2HZ LYS 122 3.132 -10.085 -11.157 961 H ILE 123 H ILE 123 3.616 -3.769 -7.273 962 HA ILE 123 HA ILE 123 5.989 -2.458 -8.545 963 HB ILE 123 HB ILE 123 4.925 -2.108 -5.705 964 HG12 ILE 123 1HG1 ILE 123 3.392 -0.889 -7.143 965 HG13 ILE 123 2HG1 ILE 123 4.365 0.201 -6.181 966 HG21 ILE 123 1HG2 ILE 123 6.565 -0.278 -5.478 967 HG22 ILE 123 2HG2 ILE 123 7.356 -1.826 -5.820 968 HG23 ILE 123 3HG2 ILE 123 7.161 -0.612 -7.105 969 HD11 ILE 123 3HD1 ILE 123 5.799 0.558 -8.272 970 HD12 ILE 123 1HD1 ILE 123 4.580 -0.390 -9.149 971 HD13 ILE 123 2HD1 ILE 123 4.135 1.122 -8.337 972 H ASP 124 H ASP 124 7.145 -4.023 -9.059 973 HA ASP 124 HA ASP 124 8.013 -6.204 -7.419 974 HB2 ASP 124 1HB ASP 124 8.876 -4.775 -9.913 975 HB3 ASP 124 2HB ASP 124 10.029 -5.800 -9.095 976 H PHE 125 H PHE 125 9.864 -6.307 -6.022 977 HA PHE 125 HA PHE 125 11.280 -3.835 -5.342 978 HB2 PHE 125 1HB PHE 125 10.730 -3.936 -2.959 979 HB3 PHE 125 2HB PHE 125 9.314 -3.723 -3.898 980 HD1 PHE 125 1HD PHE 125 11.304 -6.337 -2.142 981 HD2 PHE 125 2HD PHE 125 7.404 -5.135 -3.463 982 HE1 PHE 125 1HE PHE 125 10.328 -8.100 -0.744 983 HE2 PHE 125 2HE PHE 125 6.403 -6.955 -2.078 984 HZ PHE 125 HZ PHE 125 7.872 -8.430 -0.716 985 H GLU 126 H GLU 126 13.119 -4.399 -3.608 986 HA GLU 126 HA GLU 126 13.984 -7.192 -4.180 987 HB2 GLU 126 1HB GLU 126 15.361 -4.604 -3.945 988 HB3 GLU 126 2HB GLU 126 16.180 -6.154 -3.536 989 HG2 GLU 126 1HG GLU 126 16.595 -6.398 -5.710 990 HG3 GLU 126 2HG GLU 126 14.882 -6.641 -5.996 991 H ARG 127 H ARG 127 14.672 -8.529 -2.768 992 HA ARG 127 HA ARG 127 13.667 -8.237 -0.003 993 HB2 ARG 127 1HB ARG 127 14.455 -10.591 -1.785 994 HB3 ARG 127 2HB ARG 127 14.202 -10.790 -0.081 995 HG2 ARG 127 1HG ARG 127 12.032 -9.644 -1.880 996 HG3 ARG 127 2HG ARG 127 12.298 -11.379 -1.759 997 HD2 ARG 127 1HD ARG 127 11.694 -9.602 0.621 998 HD3 ARG 127 2HD ARG 127 10.494 -10.536 -0.282 999 HE ARG 127 HE ARG 127 12.463 -11.503 1.648 1000 HH11 ARG 127 1HH1 ARG 127 10.173 -12.566 -0.929 1001 HH12 ARG 127 2HH1 ARG 127 10.546 -14.226 -0.675 1002 HH21 ARG 127 1HH2 ARG 127 12.583 -13.732 2.187 1003 HH22 ARG 127 2HH2 ARG 127 11.528 -14.842 1.432 1004 H GLU 128 H GLU 128 15.300 -7.226 1.020 1005 HA GLU 128 HA GLU 128 18.017 -8.288 0.986 1006 HB2 GLU 128 1HB GLU 128 17.758 -6.091 1.909 1007 HB3 GLU 128 2HB GLU 128 16.543 -6.675 3.049 1008 HG2 GLU 128 1HG GLU 128 18.456 -6.549 4.307 1009 HG3 GLU 128 2HG GLU 128 18.356 -8.259 3.968 Start of MODEL 19 1 H1 GLY 1 H GLY 1 -21.056 15.632 -6.786 2 HA2 GLY 1 1HA GLY 1 -20.689 18.147 -5.264 3 HA3 GLY 1 2HA GLY 1 -21.749 16.835 -4.715 4 H ALA 2 H ALA 2 -20.769 15.685 -3.094 5 HA ALA 2 HA ALA 2 -18.517 14.091 -3.804 6 HB1 ALA 2 1HB ALA 2 -17.094 14.629 -1.819 7 HB2 ALA 2 2HB ALA 2 -17.160 15.983 -2.959 8 HB3 ALA 2 3HB ALA 2 -18.128 16.032 -1.464 9 H GLU 3 H GLU 3 -20.793 13.107 -3.608 10 HA GLU 3 HA GLU 3 -21.978 12.780 -0.981 11 HB2 GLU 3 1HB GLU 3 -23.147 12.987 -3.223 12 HB3 GLU 3 2HB GLU 3 -22.495 11.367 -3.581 13 HG2 GLU 3 1HG GLU 3 -24.141 10.345 -2.385 14 HG3 GLU 3 2HG GLU 3 -23.906 11.402 -1.000 15 H ALA 4 H ALA 4 -19.459 11.822 -0.681 16 HA ALA 4 HA ALA 4 -18.096 10.081 -0.378 17 HB1 ALA 4 1HB ALA 4 -19.390 9.953 1.663 18 HB2 ALA 4 2HB ALA 4 -20.695 9.062 0.838 19 HB3 ALA 4 3HB ALA 4 -19.151 8.273 1.117 20 H LEU 5 H LEU 5 -18.268 9.908 -3.019 21 HA LEU 5 HA LEU 5 -19.437 7.905 -4.269 22 HB2 LEU 5 1HB LEU 5 -16.586 8.899 -4.655 23 HB3 LEU 5 2HB LEU 5 -17.728 8.461 -5.900 24 HG LEU 5 HG LEU 5 -17.514 10.743 -5.907 25 HD11 LEU 5 1HD1 LEU 5 -20.147 10.326 -4.505 26 HD12 LEU 5 2HD1 LEU 5 -19.801 9.808 -6.165 27 HD13 LEU 5 3HD1 LEU 5 -19.756 11.520 -5.760 28 HD21 LEU 5 3HD2 LEU 5 -17.339 12.328 -4.459 29 HD22 LEU 5 1HD2 LEU 5 -16.649 10.962 -3.561 30 HD23 LEU 5 2HD2 LEU 5 -18.316 11.515 -3.232 31 HA PRO 6 HA PRO 6 -17.076 4.234 -3.145 32 HB2 PRO 6 1HB PRO 6 -17.091 2.827 -5.486 33 HB3 PRO 6 2HB PRO 6 -18.560 3.049 -4.483 34 HG2 PRO 6 1HG PRO 6 -17.722 4.604 -6.945 35 HG3 PRO 6 2HG PRO 6 -19.328 3.916 -6.527 36 HD2 PRO 6 1HD PRO 6 -18.629 6.589 -6.069 37 HD3 PRO 6 2HD PRO 6 -19.812 5.700 -5.074 38 H LEU 7 H LEU 7 -15.122 3.098 -3.817 39 HA LEU 7 HA LEU 7 -12.934 4.775 -4.015 40 HB2 LEU 7 1HB LEU 7 -13.254 2.345 -3.168 41 HB3 LEU 7 2HB LEU 7 -12.745 1.871 -4.786 42 HG LEU 7 HG LEU 7 -11.222 3.523 -2.736 43 HD11 LEU 7 1HD1 LEU 7 -11.476 0.888 -2.756 44 HD12 LEU 7 2HD1 LEU 7 -9.843 1.591 -2.533 45 HD13 LEU 7 3HD1 LEU 7 -10.397 0.948 -4.099 46 HD21 LEU 7 3HD2 LEU 7 -9.274 3.342 -4.300 47 HD22 LEU 7 1HD2 LEU 7 -10.524 4.516 -4.704 48 HD23 LEU 7 2HD2 LEU 7 -10.435 2.975 -5.603 49 H TYR 8 H TYR 8 -12.501 6.091 -5.696 50 HA TYR 8 HA TYR 8 -12.686 5.039 -8.457 51 HB2 TYR 8 1HB TYR 8 -12.623 7.427 -9.137 52 HB3 TYR 8 2HB TYR 8 -14.034 6.878 -8.265 53 HD1 TYR 8 2HD TYR 8 -10.884 8.867 -7.898 54 HD2 TYR 8 1HD TYR 8 -14.776 7.954 -6.294 55 HE1 TYR 8 2HE TYR 8 -10.709 10.813 -6.371 56 HE2 TYR 8 1HE TYR 8 -14.648 9.922 -4.806 57 HH TYR 8 HH TYR 8 -11.776 12.074 -4.760 58 H TYR 9 H TYR 9 -10.174 5.601 -6.156 59 HA TYR 9 HA TYR 9 -8.176 5.271 -8.305 60 HB2 TYR 9 1HB TYR 9 -8.410 7.722 -8.144 61 HB3 TYR 9 2HB TYR 9 -8.243 7.581 -6.437 62 HD1 TYR 9 1HD TYR 9 -6.035 7.102 -5.331 63 HD2 TYR 9 2HD TYR 9 -6.389 7.773 -9.579 64 HE1 TYR 9 1HE TYR 9 -3.633 7.634 -5.432 65 HE2 TYR 9 2HE TYR 9 -3.960 8.226 -9.709 66 HH TYR 9 HH TYR 9 -1.934 7.908 -8.476 67 H LEU 10 H LEU 10 -6.586 3.995 -7.689 68 HA LEU 10 HA LEU 10 -6.038 3.548 -4.811 69 HB2 LEU 10 1HB LEU 10 -7.585 1.890 -6.055 70 HB3 LEU 10 2HB LEU 10 -6.150 1.479 -6.992 71 HG LEU 10 HG LEU 10 -6.260 -0.174 -5.543 72 HD11 LEU 10 1HD1 LEU 10 -4.491 -0.045 -3.846 73 HD12 LEU 10 2HD1 LEU 10 -4.660 1.712 -3.707 74 HD13 LEU 10 3HD1 LEU 10 -4.004 1.012 -5.186 75 HD21 LEU 10 3HD2 LEU 10 -7.025 1.874 -3.372 76 HD22 LEU 10 1HD2 LEU 10 -6.727 0.168 -3.006 77 HD23 LEU 10 2HD2 LEU 10 -8.073 0.613 -4.060 78 H GLN 11 H GLN 11 -3.889 3.704 -4.507 79 HA GLN 11 HA GLN 11 -1.964 2.908 -6.582 80 HB2 GLN 11 1HB GLN 11 -2.926 5.443 -6.902 81 HB3 GLN 11 2HB GLN 11 -1.642 5.797 -5.779 82 HG2 GLN 11 1HG GLN 11 -0.227 5.815 -7.505 83 HG3 GLN 11 2HG GLN 11 -0.481 4.093 -7.724 84 HE21 GLN 11 1HE2 GLN 11 -2.540 3.537 -9.242 85 HE22 GLN 11 2HE2 GLN 11 -2.756 4.670 -10.548 86 H ILE 12 H ILE 12 -0.103 2.203 -5.607 87 HA ILE 12 HA ILE 12 0.069 1.900 -2.893 88 HB ILE 12 HB ILE 12 2.453 2.049 -4.727 89 HG12 ILE 12 1HG1 ILE 12 0.933 0.447 -5.703 90 HG13 ILE 12 2HG1 ILE 12 2.231 -0.400 -4.886 91 HG21 ILE 12 1HG2 ILE 12 2.080 0.469 -2.140 92 HG22 ILE 12 2HG2 ILE 12 3.544 0.532 -3.112 93 HG23 ILE 12 3HG2 ILE 12 2.999 1.935 -2.191 94 HD11 ILE 12 3HD1 ILE 12 0.638 -0.845 -2.942 95 HD12 ILE 12 1HD1 ILE 12 -0.646 -0.115 -3.931 96 HD13 ILE 12 2HD1 ILE 12 0.198 -1.586 -4.455 97 H THR 13 H THR 13 1.558 4.714 -4.605 98 HA THR 13 HA THR 13 2.026 6.735 -3.902 99 HB THR 13 HB THR 13 0.178 6.136 -1.569 100 HG1 THR 13 1HG THR 13 -0.857 5.672 -3.443 101 HG21 THR 13 3HG2 THR 13 1.276 8.303 -1.279 102 HG22 THR 13 1HG2 THR 13 -0.384 8.561 -1.830 103 HG23 THR 13 2HG2 THR 13 0.961 8.714 -2.982 104 H GLY 14 H GLY 14 2.461 4.699 -0.876 105 HA2 GLY 14 1HA GLY 14 5.252 5.567 -0.837 106 HA3 GLY 14 2HA GLY 14 4.301 5.995 0.587 107 H ILE 15 H ILE 15 6.482 4.209 0.580 108 HA ILE 15 HA ILE 15 5.315 1.656 1.480 109 HB ILE 15 HB ILE 15 5.718 1.337 -0.946 110 HG12 ILE 15 1HG1 ILE 15 7.631 -0.267 0.798 111 HG13 ILE 15 2HG1 ILE 15 5.910 -0.577 0.533 112 HG21 ILE 15 1HG2 ILE 15 7.916 1.480 -1.974 113 HG22 ILE 15 2HG2 ILE 15 7.678 3.001 -1.098 114 HG23 ILE 15 3HG2 ILE 15 8.699 1.745 -0.411 115 HD11 ILE 15 3HD1 ILE 15 8.170 -0.751 -1.513 116 HD12 ILE 15 1HD1 ILE 15 7.189 -2.070 -0.881 117 HD13 ILE 15 2HD1 ILE 15 6.446 -0.856 -1.942 118 H THR 16 H THR 16 6.783 0.608 2.989 119 HA THR 16 HA THR 16 9.508 1.280 2.802 120 HB THR 16 HB THR 16 8.780 3.237 4.157 121 HG1 THR 16 1HG THR 16 10.833 2.541 4.254 122 HG21 THR 16 3HG2 THR 16 8.261 1.266 6.422 123 HG22 THR 16 1HG2 THR 16 6.991 2.130 5.519 124 HG23 THR 16 2HG2 THR 16 8.156 3.039 6.475 125 H SER 17 H SER 17 10.546 0.259 5.119 126 HA SER 17 HA SER 17 9.263 -2.243 5.647 127 HB2 SER 17 1HB SER 17 10.829 -2.742 3.682 128 HB3 SER 17 2HB SER 17 12.147 -2.108 4.706 129 HG SER 17 HG SER 17 12.295 -4.031 5.418 130 H ASP 18 H ASP 18 10.323 -3.205 7.540 131 HA ASP 18 HA ASP 18 10.752 -1.346 9.691 132 HB2 ASP 18 1HB ASP 18 9.916 -3.523 10.142 133 HB3 ASP 18 2HB ASP 18 11.345 -4.320 9.476 134 H GLY 19 H GLY 19 13.127 -3.464 7.960 135 HA2 GLY 19 1HA GLY 19 15.388 -2.388 9.347 136 HA3 GLY 19 2HA GLY 19 15.398 -3.412 7.914 137 H ASN 20 H ASN 20 13.642 -0.398 7.720 138 HA ASN 20 HA ASN 20 15.718 0.656 5.848 139 HB2 ASN 20 1HB ASN 20 12.947 -0.129 5.359 140 HB3 ASN 20 2HB ASN 20 13.099 1.601 5.067 141 HD21 ASN 20 1HD2 ASN 20 13.127 1.606 2.814 142 HD22 ASN 20 2HD2 ASN 20 14.366 0.804 1.871 143 H ASP 21 H ASP 21 14.613 1.343 8.767 144 HA ASP 21 HA ASP 21 14.506 3.132 10.062 145 HB2 ASP 21 1HB ASP 21 15.455 4.861 7.740 146 HB3 ASP 21 2HB ASP 21 15.263 5.293 9.421 147 H PHE 22 H PHE 22 12.353 2.098 8.310 148 HA PHE 22 HA PHE 22 10.238 2.444 7.698 149 HB2 PHE 22 1HB PHE 22 10.375 4.222 10.155 150 HB3 PHE 22 2HB PHE 22 8.883 3.834 9.324 151 HD1 PHE 22 2HD PHE 22 11.835 2.050 10.902 152 HD2 PHE 22 1HD PHE 22 7.618 1.991 9.943 153 HE1 PHE 22 2HE PHE 22 11.572 -0.068 12.148 154 HE2 PHE 22 1HE PHE 22 7.360 -0.084 11.262 155 HZ PHE 22 HZ PHE 22 9.331 -1.099 12.391 156 H ALA 23 H ALA 23 12.130 3.999 6.281 157 HA ALA 23 HA ALA 23 11.310 6.655 5.767 158 HB1 ALA 23 1HB ALA 23 12.843 6.471 3.843 159 HB2 ALA 23 2HB ALA 23 13.570 5.913 5.364 160 HB3 ALA 23 3HB ALA 23 13.007 4.724 4.164 161 H TRP 24 H TRP 24 9.064 6.684 5.336 162 HA TRP 24 HA TRP 24 7.626 4.891 3.754 163 HB2 TRP 24 1HB TRP 24 7.153 7.671 4.817 164 HB3 TRP 24 2HB TRP 24 5.990 6.976 3.700 165 HD1 TRP 24 HD TRP 24 6.897 6.890 7.273 166 HE1 TRP 24 1HE TRP 24 5.524 5.089 8.543 167 HE3 TRP 24 3HE TRP 24 5.136 4.373 3.260 168 HZ2 TRP 24 2HZ TRP 24 3.608 2.991 7.800 169 HZ3 TRP 24 3HZ TRP 24 3.597 2.468 3.505 170 HH2 TRP 24 HH TRP 24 2.741 1.812 5.765 171 H ASP 25 H ASP 25 9.660 7.209 2.447 172 HA ASP 25 HA ASP 25 9.911 8.168 0.367 173 HB2 ASP 25 1HB ASP 25 9.362 5.229 -0.103 174 HB3 ASP 25 2HB ASP 25 9.705 6.283 -1.454 175 H ASN 26 H ASN 26 8.938 7.961 -2.119 176 HA ASN 26 HA ASN 26 6.055 8.361 -2.020 177 HB2 ASN 26 1HB ASN 26 6.306 10.463 -3.284 178 HB3 ASN 26 2HB ASN 26 7.000 10.568 -1.644 179 HD21 ASN 26 1HD2 ASN 26 7.640 11.017 -5.003 180 HD22 ASN 26 2HD2 ASN 26 9.376 10.962 -4.937 181 H LEU 27 H LEU 27 5.338 7.021 -3.488 182 HA LEU 27 HA LEU 27 7.087 6.187 -5.730 183 HB2 LEU 27 1HB LEU 27 4.395 5.061 -4.894 184 HB3 LEU 27 2HB LEU 27 5.568 4.335 -6.002 185 HG LEU 27 HG LEU 27 5.861 4.833 -3.041 186 HD11 LEU 27 1HD1 LEU 27 5.864 2.352 -2.909 187 HD12 LEU 27 2HD1 LEU 27 5.617 2.266 -4.661 188 HD13 LEU 27 3HD1 LEU 27 4.393 3.011 -3.623 189 HD21 LEU 27 3HD2 LEU 27 8.026 3.445 -3.292 190 HD22 LEU 27 1HD2 LEU 27 8.061 5.143 -3.714 191 HD23 LEU 27 2HD2 LEU 27 7.964 3.941 -4.995 192 H THR 28 H THR 28 6.748 6.792 -7.774 193 HA THR 28 HA THR 28 4.930 8.863 -8.206 194 HB THR 28 HB THR 28 5.948 7.688 -10.709 195 HG1 THR 28 1HG THR 28 8.138 7.877 -10.206 196 HG21 THR 28 3HG2 THR 28 5.337 10.063 -10.294 197 HG22 THR 28 1HG2 THR 28 7.063 9.957 -10.687 198 HG23 THR 28 2HG2 THR 28 6.552 10.128 -8.996 199 H SER 29 H SER 29 3.309 9.082 -9.872 200 HA SER 29 HA SER 29 1.204 7.338 -9.243 201 HB2 SER 29 1HB SER 29 1.391 9.934 -9.892 202 HB3 SER 29 2HB SER 29 0.967 9.322 -11.501 203 HG SER 29 HG SER 29 -0.817 8.253 -10.465 204 H SER 30 H SER 30 3.456 6.300 -11.246 205 HA SER 30 HA SER 30 1.569 4.645 -12.760 206 HB2 SER 30 1HB SER 30 3.851 5.758 -14.364 207 HB3 SER 30 2HB SER 30 2.281 5.162 -14.905 208 HG SER 30 HG SER 30 1.400 7.118 -13.942 209 H GLN 31 H GLN 31 3.970 4.711 -10.617 210 HA GLN 31 HA GLN 31 6.238 3.609 -11.883 211 HB2 GLN 31 1HB GLN 31 6.039 4.858 -9.663 212 HB3 GLN 31 2HB GLN 31 5.497 3.345 -8.934 213 HG2 GLN 31 1HG GLN 31 7.535 2.380 -9.102 214 HG3 GLN 31 2HG GLN 31 7.971 3.178 -10.574 215 HE21 GLN 31 1HE2 GLN 31 7.406 4.213 -7.174 216 HE22 GLN 31 2HE2 GLN 31 8.813 5.289 -7.158 217 H THR 32 H THR 32 7.189 1.550 -11.733 218 HA THR 32 HA THR 32 5.377 -0.728 -11.229 219 HB THR 32 HB THR 32 6.595 -1.743 -13.274 220 HG1 THR 32 1HG THR 32 7.006 -0.033 -14.837 221 HG21 THR 32 3HG2 THR 32 4.197 -1.033 -13.079 222 HG22 THR 32 1HG2 THR 32 4.847 -0.865 -14.717 223 HG23 THR 32 2HG2 THR 32 4.671 0.573 -13.678 224 H LYS 33 H LYS 33 8.255 0.739 -10.322 225 HA LYS 33 HA LYS 33 8.947 -1.771 -8.950 226 HB2 LYS 33 1HB LYS 33 10.346 -1.270 -11.229 227 HB3 LYS 33 2HB LYS 33 11.314 -0.301 -10.117 228 HG2 LYS 33 1HG LYS 33 10.512 -3.019 -9.223 229 HG3 LYS 33 2HG LYS 33 11.613 -3.018 -10.593 230 HD2 LYS 33 1HD LYS 33 12.359 -1.363 -8.182 231 HD3 LYS 33 2HD LYS 33 12.494 -3.108 -8.049 232 HE2 LYS 33 1HE LYS 33 13.681 -1.793 -10.483 233 HE3 LYS 33 2HE LYS 33 14.495 -1.525 -8.934 234 HZ1 LYS 33 3HZ LYS 33 15.206 -3.521 -10.308 235 HZ2 LYS 33 1HZ LYS 33 13.842 -4.272 -9.778 236 HZ3 LYS 33 2HZ LYS 33 15.008 -3.752 -8.725 237 H ALA 34 H ALA 34 10.168 -1.606 -7.075 238 HA ALA 34 HA ALA 34 9.604 0.664 -5.490 239 HB1 ALA 34 1HB ALA 34 11.185 -0.395 -3.858 240 HB2 ALA 34 2HB ALA 34 10.088 -1.590 -4.578 241 HB3 ALA 34 3HB ALA 34 11.775 -1.464 -5.139 242 HA PRO 35 HA PRO 35 12.830 3.462 -6.591 243 HB2 PRO 35 1HB PRO 35 13.238 4.910 -4.318 244 HB3 PRO 35 2HB PRO 35 11.758 5.057 -5.317 245 HG2 PRO 35 1HG PRO 35 12.156 3.381 -2.801 246 HG3 PRO 35 2HG PRO 35 10.811 4.496 -3.194 247 HD2 PRO 35 1HD PRO 35 10.530 1.830 -3.632 248 HD3 PRO 35 2HD PRO 35 9.905 3.021 -4.790 249 H ASN 36 H ASN 36 13.397 1.425 -3.610 250 HA ASN 36 HA ASN 36 16.218 1.127 -4.186 251 HB2 ASN 36 1HB ASN 36 15.085 2.787 -1.887 252 HB3 ASN 36 2HB ASN 36 16.545 1.841 -1.657 253 HD21 ASN 36 1HD2 ASN 36 16.366 4.579 -1.280 254 HD22 ASN 36 2HD2 ASN 36 17.491 5.345 -2.344 255 H VAL 37 H VAL 37 16.932 -0.665 -2.858 256 HA VAL 37 HA VAL 37 14.887 -2.619 -2.015 257 HB VAL 37 HB VAL 37 17.980 -2.530 -1.450 258 HG11 VAL 37 1HG1 VAL 37 16.844 -4.345 -0.465 259 HG12 VAL 37 2HG1 VAL 37 15.952 -4.713 -1.943 260 HG13 VAL 37 3HG1 VAL 37 17.685 -5.013 -1.881 261 HG21 VAL 37 3HG2 VAL 37 18.323 -3.787 -3.620 262 HG22 VAL 37 1HG2 VAL 37 16.803 -3.046 -4.183 263 HG23 VAL 37 2HG2 VAL 37 18.158 -2.022 -3.704 264 H LEU 38 H LEU 38 13.948 -2.406 -0.585 265 HA LEU 38 HA LEU 38 14.089 -1.592 2.055 266 HB2 LEU 38 1HB LEU 38 12.658 -4.004 0.988 267 HB3 LEU 38 2HB LEU 38 12.242 -2.928 2.268 268 HG LEU 38 HG LEU 38 10.904 -2.565 0.570 269 HD11 LEU 38 1HD1 LEU 38 12.578 -0.134 0.214 270 HD12 LEU 38 2HD1 LEU 38 11.568 -0.444 1.635 271 HD13 LEU 38 3HD1 LEU 38 10.822 -0.254 0.048 272 HD21 LEU 38 3HD2 LEU 38 12.675 -2.189 -1.663 273 HD22 LEU 38 1HD2 LEU 38 10.910 -2.259 -1.543 274 HD23 LEU 38 2HD2 LEU 38 11.821 -3.671 -1.094 275 H LYS 39 H LYS 39 15.092 -2.634 3.838 276 HA LYS 39 HA LYS 39 15.905 -5.482 3.554 277 HB2 LYS 39 1HB LYS 39 16.833 -3.304 5.447 278 HB3 LYS 39 2HB LYS 39 17.583 -4.882 5.204 279 HG2 LYS 39 1HG LYS 39 18.171 -4.262 2.880 280 HG3 LYS 39 2HG LYS 39 17.319 -2.722 3.018 281 HD2 LYS 39 1HD LYS 39 18.955 -2.404 5.100 282 HD3 LYS 39 2HD LYS 39 19.907 -3.534 4.110 283 HE2 LYS 39 1HE LYS 39 19.354 -1.917 2.128 284 HE3 LYS 39 2HE LYS 39 18.826 -0.781 3.377 285 HZ1 LYS 39 3HZ LYS 39 21.019 -0.265 2.936 286 HZ2 LYS 39 1HZ LYS 39 21.536 -1.802 2.860 287 HZ3 LYS 39 2HZ LYS 39 21.152 -1.126 4.329 288 H GLY 40 H GLY 40 15.563 -6.862 5.523 289 HA2 GLY 40 1HA GLY 40 14.379 -7.382 7.550 290 HA3 GLY 40 2HA GLY 40 13.447 -5.904 7.402 291 H ASN 41 H ASN 41 11.858 -7.927 7.816 292 HA ASN 41 HA ASN 41 10.796 -8.841 5.143 293 HB2 ASN 41 1HB ASN 41 11.446 -10.584 6.835 294 HB3 ASN 41 2HB ASN 41 10.203 -9.958 7.909 295 HD21 ASN 41 1HD2 ASN 41 8.090 -10.947 7.685 296 HD22 ASN 41 2HD2 ASN 41 7.746 -11.974 6.312 297 H LYS 42 H LYS 42 10.093 -6.685 7.732 298 HA LYS 42 HA LYS 42 7.176 -6.964 7.557 299 HB2 LYS 42 1HB LYS 42 8.972 -5.013 9.021 300 HB3 LYS 42 2HB LYS 42 7.236 -5.064 9.225 301 HG2 LYS 42 1HG LYS 42 9.147 -7.320 9.967 302 HG3 LYS 42 2HG LYS 42 8.438 -6.149 11.091 303 HD2 LYS 42 1HD LYS 42 6.163 -6.922 10.480 304 HD3 LYS 42 2HD LYS 42 6.887 -8.129 9.380 305 HE2 LYS 42 1HE LYS 42 8.083 -9.138 11.294 306 HE3 LYS 42 2HE LYS 42 7.281 -8.001 12.388 307 HZ1 LYS 42 3HZ LYS 42 6.144 -10.131 12.259 308 HZ2 LYS 42 1HZ LYS 42 5.923 -9.959 10.640 309 HZ3 LYS 42 2HZ LYS 42 5.149 -8.967 11.731 310 H LEU 43 H LEU 43 6.276 -6.273 5.759 311 HA LEU 43 HA LEU 43 7.385 -3.992 4.241 312 HB2 LEU 43 1HB LEU 43 6.345 -6.428 3.458 313 HB3 LEU 43 2HB LEU 43 4.884 -5.460 3.429 314 HG LEU 43 HG LEU 43 7.465 -4.902 1.916 315 HD11 LEU 43 1HD1 LEU 43 4.722 -5.787 0.919 316 HD12 LEU 43 2HD1 LEU 43 6.143 -6.837 1.093 317 HD13 LEU 43 3HD1 LEU 43 6.177 -5.517 -0.075 318 HD21 LEU 43 3HD2 LEU 43 4.830 -3.399 1.968 319 HD22 LEU 43 1HD2 LEU 43 6.001 -3.264 0.630 320 HD23 LEU 43 2HD2 LEU 43 6.473 -2.750 2.240 321 H TYR 44 H TYR 44 6.258 -1.990 4.254 322 HA TYR 44 HA TYR 44 3.552 -1.941 5.504 323 HB2 TYR 44 1HB TYR 44 5.806 0.043 5.980 324 HB3 TYR 44 2HB TYR 44 4.158 0.184 6.562 325 HD1 TYR 44 1HD TYR 44 3.223 -1.525 8.196 326 HD2 TYR 44 2HD TYR 44 7.434 -1.235 7.270 327 HE1 TYR 44 1HE TYR 44 3.773 -2.714 10.307 328 HE2 TYR 44 2HE TYR 44 7.981 -2.414 9.356 329 HH TYR 44 HH TYR 44 7.109 -3.354 11.435 330 H VAL 45 H VAL 45 2.093 -0.747 4.359 331 HA VAL 45 HA VAL 45 3.043 0.805 1.973 332 HB VAL 45 HB VAL 45 0.673 -1.071 1.795 333 HG11 VAL 45 1HG1 VAL 45 1.204 -0.841 -0.573 334 HG12 VAL 45 2HG1 VAL 45 0.725 0.670 0.202 335 HG13 VAL 45 3HG1 VAL 45 2.446 0.370 -0.105 336 HG21 VAL 45 3HG2 VAL 45 2.520 -2.588 2.279 337 HG22 VAL 45 1HG2 VAL 45 2.214 -2.625 0.547 338 HG23 VAL 45 2HG2 VAL 45 3.591 -1.682 1.192 339 H LYS 46 H LYS 46 1.816 2.579 1.495 340 HA LYS 46 HA LYS 46 -0.520 3.243 3.246 341 HB2 LYS 46 1HB LYS 46 1.652 4.377 3.819 342 HB3 LYS 46 2HB LYS 46 1.620 5.153 2.229 343 HG2 LYS 46 1HG LYS 46 -0.871 5.777 3.101 344 HG3 LYS 46 2HG LYS 46 -0.139 5.566 4.651 345 HD2 LYS 46 1HD LYS 46 0.831 7.451 2.459 346 HD3 LYS 46 2HD LYS 46 -0.142 7.926 3.858 347 HE2 LYS 46 1HE LYS 46 1.660 7.377 5.399 348 HE3 LYS 46 2HE LYS 46 2.639 6.706 4.076 349 HZ1 LYS 46 3HZ LYS 46 1.817 9.544 4.312 350 HZ2 LYS 46 1HZ LYS 46 2.708 8.891 3.089 351 HZ3 LYS 46 2HZ LYS 46 3.312 8.947 4.624 352 H ALA 47 H ALA 47 -1.284 1.992 1.067 353 HA ALA 47 HA ALA 47 -1.053 3.466 -1.433 354 HB1 ALA 47 1HB ALA 47 -1.230 0.995 -1.427 355 HB2 ALA 47 2HB ALA 47 -2.797 1.134 -0.630 356 HB3 ALA 47 3HB ALA 47 -2.601 1.727 -2.294 357 H ARG 48 H ARG 48 -2.328 5.164 -2.062 358 HA ARG 48 HA ARG 48 -4.337 6.214 -0.209 359 HB2 ARG 48 1HB ARG 48 -2.886 7.742 -1.317 360 HB3 ARG 48 2HB ARG 48 -3.262 7.102 -2.916 361 HG2 ARG 48 1HG ARG 48 -5.295 8.138 -3.062 362 HG3 ARG 48 2HG ARG 48 -5.588 8.247 -1.343 363 HD2 ARG 48 1HD ARG 48 -3.657 9.952 -3.001 364 HD3 ARG 48 2HD ARG 48 -5.207 10.423 -2.277 365 HE ARG 48 HE ARG 48 -3.183 9.526 -0.351 366 HH11 ARG 48 1HH1 ARG 48 -4.489 12.454 -2.011 367 HH12 ARG 48 2HH1 ARG 48 -3.749 13.500 -0.888 368 HH21 ARG 48 1HH2 ARG 48 -2.535 10.904 1.230 369 HH22 ARG 48 2HH2 ARG 48 -2.700 12.608 1.107 370 H PHE 49 H PHE 49 -6.456 6.155 -0.332 371 HA PHE 49 HA PHE 49 -7.788 4.519 -2.444 372 HB2 PHE 49 1HB PHE 49 -8.481 4.667 0.587 373 HB3 PHE 49 2HB PHE 49 -9.410 3.925 -0.706 374 HD1 PHE 49 2HD PHE 49 -5.845 3.082 -1.118 375 HD2 PHE 49 1HD PHE 49 -9.476 2.110 0.970 376 HE1 PHE 49 2HE PHE 49 -4.864 0.965 -0.427 377 HE2 PHE 49 1HE PHE 49 -8.526 -0.110 1.533 378 HZ PHE 49 HZ PHE 49 -6.223 -0.701 0.806 379 H MET 50 H MET 50 -8.402 6.436 -3.695 380 HA MET 50 HA MET 50 -9.713 8.605 -2.194 381 HB2 MET 50 1HB MET 50 -9.693 8.363 -5.205 382 HB3 MET 50 2HB MET 50 -9.941 9.787 -4.227 383 HG2 MET 50 1HG MET 50 -7.312 8.464 -3.879 384 HG3 MET 50 2HG MET 50 -7.598 9.144 -5.475 385 HE1 MET 50 3HE MET 50 -7.608 11.554 -1.553 386 HE2 MET 50 1HE MET 50 -9.099 10.800 -2.170 387 HE3 MET 50 2HE MET 50 -7.715 9.783 -1.685 388 H GLY 51 H GLY 51 -11.734 8.122 -1.571 389 HA2 GLY 51 1HA GLY 51 -14.059 7.823 -2.250 390 HA3 GLY 51 2HA GLY 51 -13.591 6.643 -3.423 391 H TYR 52 H TYR 52 -15.635 6.208 -1.574 392 HA TYR 52 HA TYR 52 -14.793 5.020 0.881 393 HB2 TYR 52 1HB TYR 52 -17.273 5.838 -0.381 394 HB3 TYR 52 2HB TYR 52 -17.469 4.212 0.188 395 HD1 TYR 52 1HD TYR 52 -17.269 3.651 2.636 396 HD2 TYR 52 2HD TYR 52 -16.962 7.682 1.146 397 HE1 TYR 52 1HE TYR 52 -17.731 4.521 4.898 398 HE2 TYR 52 2HE TYR 52 -17.406 8.572 3.417 399 HH TYR 52 HH TYR 52 -18.512 7.795 5.567 400 H THR 53 H THR 53 -14.241 3.021 1.342 401 HA THR 53 HA THR 53 -15.468 0.725 0.230 402 HB THR 53 HB THR 53 -13.698 0.955 -1.488 403 HG1 THR 53 1HG THR 53 -13.804 -1.053 -1.270 404 HG21 THR 53 3HG2 THR 53 -11.822 1.117 0.891 405 HG22 THR 53 1HG2 THR 53 -12.020 2.296 -0.424 406 HG23 THR 53 2HG2 THR 53 -11.259 0.724 -0.697 407 H LYS 54 H LYS 54 -15.016 -1.076 1.613 408 HA LYS 54 HA LYS 54 -13.197 -0.659 3.827 409 HB2 LYS 54 1HB LYS 54 -16.171 -0.836 4.221 410 HB3 LYS 54 2HB LYS 54 -15.175 -1.698 5.385 411 HG2 LYS 54 1HG LYS 54 -14.159 1.018 4.946 412 HG3 LYS 54 2HG LYS 54 -15.842 1.009 5.423 413 HD2 LYS 54 1HD LYS 54 -15.290 -0.147 7.490 414 HD3 LYS 54 2HD LYS 54 -13.660 -0.510 6.893 415 HE2 LYS 54 1HE LYS 54 -13.111 1.273 8.195 416 HE3 LYS 54 2HE LYS 54 -13.442 2.112 6.674 417 HZ1 LYS 54 3HZ LYS 54 -15.250 1.912 9.012 418 HZ2 LYS 54 1HZ LYS 54 -15.711 2.549 7.583 419 HZ3 LYS 54 2HZ LYS 54 -14.520 3.264 8.447 420 H LEU 55 H LEU 55 -13.051 -2.244 1.430 421 HA LEU 55 HA LEU 55 -12.975 -4.952 2.596 422 HB2 LEU 55 1HB LEU 55 -15.166 -4.277 1.147 423 HB3 LEU 55 2HB LEU 55 -14.105 -4.692 -0.170 424 HG LEU 55 HG LEU 55 -15.397 -6.592 0.360 425 HD11 LEU 55 1HD1 LEU 55 -12.667 -7.138 1.612 426 HD12 LEU 55 2HD1 LEU 55 -13.035 -7.129 -0.128 427 HD13 LEU 55 3HD1 LEU 55 -13.792 -8.325 0.932 428 HD21 LEU 55 3HD2 LEU 55 -14.450 -6.531 3.251 429 HD22 LEU 55 1HD2 LEU 55 -15.683 -7.573 2.475 430 HD23 LEU 55 2HD2 LEU 55 -15.993 -5.849 2.690 431 H THR 56 H THR 56 -10.729 -4.130 2.680 432 HA THR 56 HA THR 56 -9.285 -3.783 0.174 433 HB THR 56 HB THR 56 -8.126 -4.380 2.939 434 HG1 THR 56 1HG THR 56 -9.125 -2.597 3.480 435 HG21 THR 56 3HG2 THR 56 -6.607 -4.479 0.942 436 HG22 THR 56 1HG2 THR 56 -6.176 -3.193 2.037 437 HG23 THR 56 2HG2 THR 56 -7.070 -2.812 0.558 438 H VAL 57 H VAL 57 -8.171 -5.560 -0.970 439 HA VAL 57 HA VAL 57 -7.900 -8.066 0.598 440 HB VAL 57 HB VAL 57 -8.857 -7.867 -2.264 441 HG11 VAL 57 1HG1 VAL 57 -8.232 -10.329 -0.569 442 HG12 VAL 57 2HG1 VAL 57 -9.083 -10.337 -2.122 443 HG13 VAL 57 3HG1 VAL 57 -7.394 -9.814 -2.058 444 HG21 VAL 57 3HG2 VAL 57 -10.162 -8.867 0.324 445 HG22 VAL 57 1HG2 VAL 57 -10.645 -7.434 -0.608 446 HG23 VAL 57 2HG2 VAL 57 -10.868 -9.036 -1.298 447 H ILE 58 H ILE 58 -6.117 -9.213 0.250 448 HA ILE 58 HA ILE 58 -3.964 -8.409 -1.581 449 HB ILE 58 HB ILE 58 -3.625 -9.015 1.402 450 HG12 ILE 58 1HG1 ILE 58 -2.812 -6.398 0.078 451 HG13 ILE 58 2HG1 ILE 58 -4.376 -6.595 0.851 452 HG21 ILE 58 1HG2 ILE 58 -1.208 -8.636 0.998 453 HG22 ILE 58 2HG2 ILE 58 -1.805 -9.930 -0.037 454 HG23 ILE 58 3HG2 ILE 58 -1.538 -8.312 -0.709 455 HD11 ILE 58 3HD1 ILE 58 -2.971 -5.608 2.500 456 HD12 ILE 58 1HD1 ILE 58 -3.181 -7.298 2.987 457 HD13 ILE 58 2HD1 ILE 58 -1.671 -6.772 2.213 458 H THR 59 H THR 59 -3.823 -10.335 -2.778 459 HA THR 59 HA THR 59 -5.195 -12.671 -2.108 460 HB THR 59 HB THR 59 -3.068 -12.136 -4.209 461 HG1 THR 59 1HG THR 59 -5.871 -11.657 -4.324 462 HG21 THR 59 3HG2 THR 59 -4.314 -13.702 -5.641 463 HG22 THR 59 1HG2 THR 59 -5.441 -14.050 -4.308 464 HG23 THR 59 2HG2 THR 59 -3.722 -14.490 -4.193 465 H GLY 60 H GLY 60 -1.843 -11.722 -1.842 466 HA2 GLY 60 1HA GLY 60 0.091 -12.701 -1.145 467 HA3 GLY 60 2HA GLY 60 -0.826 -13.829 -0.155 468 H LYS 61 H LYS 61 0.910 -15.267 -0.735 469 HA LYS 61 HA LYS 61 0.682 -16.392 -3.435 470 HB2 LYS 61 1HB LYS 61 2.592 -17.598 -2.931 471 HB3 LYS 61 2HB LYS 61 2.779 -16.047 -2.090 472 HG2 LYS 61 1HG LYS 61 2.190 -17.124 0.061 473 HG3 LYS 61 2HG LYS 61 1.997 -18.664 -0.790 474 HD2 LYS 61 1HD LYS 61 4.150 -18.679 0.189 475 HD3 LYS 61 2HD LYS 61 4.362 -18.517 -1.561 476 HE2 LYS 61 1HE LYS 61 4.350 -15.860 -0.743 477 HE3 LYS 61 2HE LYS 61 4.977 -16.652 0.686 478 HZ1 LYS 61 3HZ LYS 61 6.248 -16.685 -1.970 479 HZ2 LYS 61 1HZ LYS 61 6.750 -17.600 -0.690 480 HZ3 LYS 61 2HZ LYS 61 6.756 -15.985 -0.582 481 H ASP 62 H ASP 62 -0.541 -17.054 -0.245 482 HA ASP 62 HA ASP 62 -1.433 -19.672 -0.571 483 HB2 ASP 62 1HB ASP 62 -1.421 -18.202 1.526 484 HB3 ASP 62 2HB ASP 62 -2.942 -17.515 0.947 485 H GLY 63 H GLY 63 -2.717 -16.814 -2.151 486 HA2 GLY 63 1HA GLY 63 -4.442 -16.591 -3.663 487 HA3 GLY 63 2HA GLY 63 -4.660 -18.342 -3.659 488 H LYS 64 H LYS 64 -4.735 -16.357 -0.727 489 HA LYS 64 HA LYS 64 -7.633 -16.213 -0.561 490 HB2 LYS 64 1HB LYS 64 -5.924 -17.541 1.605 491 HB3 LYS 64 2HB LYS 64 -7.622 -17.105 1.720 492 HG2 LYS 64 1HG LYS 64 -7.897 -18.683 -0.345 493 HG3 LYS 64 2HG LYS 64 -6.342 -19.356 0.169 494 HD2 LYS 64 1HD LYS 64 -7.284 -19.644 2.489 495 HD3 LYS 64 2HD LYS 64 -8.854 -19.084 1.891 496 HE2 LYS 64 1HE LYS 64 -8.807 -21.033 0.245 497 HE3 LYS 64 2HE LYS 64 -7.352 -21.604 1.089 498 HZ1 LYS 64 3HZ LYS 64 -8.732 -21.552 3.145 499 HZ2 LYS 64 1HZ LYS 64 -9.191 -22.690 2.049 500 HZ3 LYS 64 2HZ LYS 64 -10.064 -21.285 2.253 501 H ASN 65 H ASN 65 -8.165 -14.602 1.106 502 HA ASN 65 HA ASN 65 -6.439 -12.433 0.842 503 HB2 ASN 65 1HB ASN 65 -8.939 -12.335 1.287 504 HB3 ASN 65 2HB ASN 65 -8.563 -12.736 2.983 505 HD21 ASN 65 1HD2 ASN 65 -6.124 -10.600 1.621 506 HD22 ASN 65 2HD2 ASN 65 -6.888 -9.263 2.524 507 H LEU 66 H LEU 66 -4.379 -12.203 1.776 508 HA LEU 66 HA LEU 66 -3.500 -13.410 4.116 509 HB2 LEU 66 1HB LEU 66 -2.628 -10.697 3.040 510 HB3 LEU 66 2HB LEU 66 -1.761 -11.660 4.231 511 HG LEU 66 HG LEU 66 -2.235 -12.358 1.314 512 HD11 LEU 66 1HD1 LEU 66 0.245 -12.212 1.227 513 HD12 LEU 66 2HD1 LEU 66 0.302 -11.878 2.961 514 HD13 LEU 66 3HD1 LEU 66 -0.433 -10.699 1.854 515 HD21 LEU 66 3HD2 LEU 66 -1.167 -14.048 3.603 516 HD22 LEU 66 1HD2 LEU 66 -0.624 -14.341 1.948 517 HD23 LEU 66 2HD2 LEU 66 -2.338 -14.481 2.346 518 H LEU 67 H LEU 67 -5.307 -10.368 3.888 519 HA LEU 67 HA LEU 67 -4.974 -9.530 6.624 520 HB2 LEU 67 1HB LEU 67 -6.492 -8.726 4.255 521 HB3 LEU 67 2HB LEU 67 -7.559 -8.762 5.614 522 HG LEU 67 HG LEU 67 -5.872 -7.284 6.837 523 HD11 LEU 67 1HD1 LEU 67 -4.025 -7.684 5.124 524 HD12 LEU 67 2HD1 LEU 67 -4.255 -6.056 5.765 525 HD13 LEU 67 3HD1 LEU 67 -4.858 -6.449 4.156 526 HD21 LEU 67 3HD2 LEU 67 -6.807 -5.248 5.736 527 HD22 LEU 67 1HD2 LEU 67 -8.051 -6.509 5.921 528 HD23 LEU 67 2HD2 LEU 67 -7.313 -6.251 4.352 529 H TYR 68 H TYR 68 -6.554 -12.229 5.311 530 HA TYR 68 HA TYR 68 -8.213 -12.630 7.704 531 HB2 TYR 68 1HB TYR 68 -9.211 -11.973 5.250 532 HB3 TYR 68 2HB TYR 68 -8.990 -13.705 5.014 533 HD1 TYR 68 1HD TYR 68 -10.317 -11.366 7.660 534 HD2 TYR 68 2HD TYR 68 -10.727 -15.187 5.699 535 HE1 TYR 68 1HE TYR 68 -12.226 -11.889 9.095 536 HE2 TYR 68 2HE TYR 68 -12.694 -15.698 7.092 537 HH TYR 68 HH TYR 68 -13.751 -15.076 9.131 538 H ASN 69 H ASN 69 -5.420 -13.319 6.994 539 HA ASN 69 HA ASN 69 -5.544 -16.305 7.034 540 HB2 ASN 69 1HB ASN 69 -4.172 -15.246 5.230 541 HB3 ASN 69 2HB ASN 69 -3.163 -14.478 6.444 542 HD21 ASN 69 1HD2 ASN 69 -4.237 -17.727 5.215 543 HD22 ASN 69 2HD2 ASN 69 -2.982 -18.602 6.015 544 H GLY 70 H GLY 70 -3.605 -13.594 8.340 545 HA2 GLY 70 1HA GLY 70 -4.213 -13.673 10.984 546 HA3 GLY 70 2HA GLY 70 -3.031 -14.983 10.839 547 H THR 71 H THR 71 -1.597 -13.434 8.551 548 HA THR 71 HA THR 71 0.163 -12.053 10.401 549 HB THR 71 HB THR 71 0.494 -11.860 7.406 550 HG1 THR 71 1HG THR 71 0.331 -14.222 8.820 551 HG21 THR 71 3HG2 THR 71 2.878 -12.189 7.989 552 HG22 THR 71 1HG2 THR 71 2.440 -12.376 9.700 553 HG23 THR 71 2HG2 THR 71 2.190 -10.827 8.874 554 H ALA 72 H ALA 72 -1.707 -11.024 7.490 555 HA ALA 72 HA ALA 72 -0.790 -8.298 7.950 556 HB1 ALA 72 1HB ALA 72 -1.840 -7.875 5.755 557 HB2 ALA 72 2HB ALA 72 -0.799 -9.301 5.684 558 HB3 ALA 72 3HB ALA 72 -2.565 -9.501 5.772 559 H LYS 73 H LYS 73 -2.210 -6.467 8.037 560 HA LYS 73 HA LYS 73 -5.016 -6.815 8.795 561 HB2 LYS 73 1HB LYS 73 -3.833 -7.515 10.799 562 HB3 LYS 73 2HB LYS 73 -2.825 -6.073 10.787 563 HG2 LYS 73 1HG LYS 73 -4.433 -5.869 12.519 564 HG3 LYS 73 2HG LYS 73 -4.814 -4.722 11.263 565 HD2 LYS 73 1HD LYS 73 -6.892 -5.693 12.063 566 HD3 LYS 73 2HD LYS 73 -6.611 -6.272 10.433 567 HE2 LYS 73 1HE LYS 73 -6.821 -8.386 11.092 568 HE3 LYS 73 2HE LYS 73 -5.420 -8.228 12.144 569 HZ1 LYS 73 3HZ LYS 73 -8.125 -7.399 13.018 570 HZ2 LYS 73 1HZ LYS 73 -6.812 -7.724 13.964 571 HZ3 LYS 73 2HZ LYS 73 -7.607 -8.920 13.195 572 H MET 74 H MET 74 -6.074 -4.710 8.861 573 HA MET 74 HA MET 74 -4.479 -2.407 7.887 574 HB2 MET 74 1HB MET 74 -6.943 -2.815 7.031 575 HB3 MET 74 2HB MET 74 -7.405 -2.406 8.655 576 HG2 MET 74 1HG MET 74 -6.052 -0.257 8.405 577 HG3 MET 74 2HG MET 74 -5.730 -0.703 6.733 578 HE1 MET 74 3HE MET 74 -8.191 0.219 9.406 579 HE2 MET 74 1HE MET 74 -9.773 0.434 8.597 580 HE3 MET 74 2HE MET 74 -9.052 -1.192 8.748 581 H PHE 75 H PHE 75 -3.362 -1.521 9.567 582 HA PHE 75 HA PHE 75 -4.381 -2.006 12.330 583 HB2 PHE 75 1HB PHE 75 -2.153 -2.152 13.049 584 HB3 PHE 75 2HB PHE 75 -2.284 -3.170 11.630 585 HD1 PHE 75 1HD PHE 75 -1.501 -2.045 9.316 586 HD2 PHE 75 2HD PHE 75 -0.364 -0.650 13.244 587 HE1 PHE 75 1HE PHE 75 0.457 -0.862 8.345 588 HE2 PHE 75 2HE PHE 75 1.602 0.483 12.249 589 HZ PHE 75 HZ PHE 75 2.002 0.403 9.815 590 H LYS 76 H LYS 76 -3.917 0.516 10.089 591 HA LYS 76 HA LYS 76 -4.372 2.585 12.035 592 HB2 LYS 76 1HB LYS 76 -1.960 2.492 12.205 593 HB3 LYS 76 2HB LYS 76 -1.770 2.434 10.465 594 HG2 LYS 76 1HG LYS 76 -2.727 4.772 10.340 595 HG3 LYS 76 2HG LYS 76 -2.749 4.796 12.111 596 HD2 LYS 76 1HD LYS 76 -0.350 4.691 12.231 597 HD3 LYS 76 2HD LYS 76 -0.220 4.180 10.544 598 HE2 LYS 76 1HE LYS 76 0.473 6.452 10.604 599 HE3 LYS 76 2HE LYS 76 -1.106 6.407 9.825 600 HZ1 LYS 76 3HZ LYS 76 -0.535 7.282 12.596 601 HZ2 LYS 76 1HZ LYS 76 -2.065 7.125 11.974 602 HZ3 LYS 76 2HZ LYS 76 -1.036 8.210 11.360 603 H SER 77 H SER 77 -5.291 4.440 10.833 604 HA SER 77 HA SER 77 -5.570 4.266 7.945 605 HB2 SER 77 1HB SER 77 -8.072 4.143 8.118 606 HB3 SER 77 2HB SER 77 -7.216 2.635 8.486 607 HG SER 77 HG SER 77 -7.931 4.466 10.510 608 H ASP 78 H ASP 78 -5.388 6.685 7.411 609 HA ASP 78 HA ASP 78 -6.675 8.338 9.554 610 HB2 ASP 78 1HB ASP 78 -4.060 8.470 8.966 611 HB3 ASP 78 2HB ASP 78 -4.665 9.627 7.822 612 H ALA 79 H ALA 79 -6.823 10.708 8.152 613 HA ALA 79 HA ALA 79 -8.835 10.024 6.050 614 HB1 ALA 79 1HB ALA 79 -9.888 10.867 8.091 615 HB2 ALA 79 2HB ALA 79 -8.860 12.316 8.040 616 HB3 ALA 79 3HB ALA 79 -10.055 12.032 6.754 617 H ILE 80 H ILE 80 -8.903 11.363 4.252 618 HA ILE 80 HA ILE 80 -6.474 13.019 3.780 619 HB ILE 80 HB ILE 80 -8.062 11.352 1.816 620 HG12 ILE 80 1HG1 ILE 80 -5.284 10.764 2.940 621 HG13 ILE 80 2HG1 ILE 80 -6.743 9.932 3.446 622 HG21 ILE 80 1HG2 ILE 80 -5.448 12.867 1.499 623 HG22 ILE 80 2HG2 ILE 80 -6.269 11.910 0.239 624 HG23 ILE 80 3HG2 ILE 80 -7.040 13.357 0.853 625 HD11 ILE 80 3HD1 ILE 80 -5.514 8.575 1.849 626 HD12 ILE 80 1HD1 ILE 80 -7.096 9.028 1.192 627 HD13 ILE 80 2HD1 ILE 80 -5.638 9.841 0.629 628 H LEU 81 H LEU 81 -7.256 14.970 4.194 629 HA LEU 81 HA LEU 81 -9.914 15.827 3.248 630 HB2 LEU 81 1HB LEU 81 -7.716 17.557 4.427 631 HB3 LEU 81 2HB LEU 81 -9.370 18.027 4.091 632 HG LEU 81 HG LEU 81 -8.413 16.067 6.215 633 HD11 LEU 81 1HD1 LEU 81 -9.344 17.738 7.744 634 HD12 LEU 81 2HD1 LEU 81 -9.882 18.746 6.362 635 HD13 LEU 81 3HD1 LEU 81 -8.158 18.483 6.679 636 HD21 LEU 81 3HD2 LEU 81 -10.524 15.170 5.354 637 HD22 LEU 81 1HD2 LEU 81 -11.292 16.772 5.462 638 HD23 LEU 81 2HD2 LEU 81 -10.783 15.894 6.931 639 H GLY 82 H GLY 82 -10.259 16.632 1.313 640 HA2 GLY 82 1HA GLY 82 -8.094 17.810 -0.363 641 HA3 GLY 82 2HA GLY 82 -9.721 17.363 -0.907 642 H GLN 83 H GLN 83 -8.874 19.775 -1.417 643 HA GLN 83 HA GLN 83 -8.409 21.832 0.026 644 HB2 GLN 83 1HB GLN 83 -9.309 23.206 -1.926 645 HB3 GLN 83 2HB GLN 83 -8.311 21.837 -2.397 646 HG2 GLN 83 1HG GLN 83 -10.206 20.496 -3.004 647 HG3 GLN 83 2HG GLN 83 -11.346 21.613 -2.280 648 HE21 GLN 83 1HE2 GLN 83 -10.772 24.085 -3.385 649 HE22 GLN 83 2HE2 GLN 83 -10.726 23.940 -5.152 650 H ASN 84 H ASN 84 -11.579 20.677 0.410 651 HA ASN 84 HA ASN 84 -12.344 23.170 1.799 652 HB2 ASN 84 1HB ASN 84 -14.336 21.850 -0.084 653 HB3 ASN 84 2HB ASN 84 -14.590 23.257 0.937 654 HD21 ASN 84 1HD2 ASN 84 -13.769 22.255 -2.170 655 HD22 ASN 84 2HD2 ASN 84 -13.174 23.793 -2.784 656 H LYS 85 H LYS 85 -11.244 21.068 2.939 657 HA LYS 85 HA LYS 85 -11.397 19.393 4.446 658 HB2 LYS 85 1HB LYS 85 -14.036 20.754 5.130 659 HB3 LYS 85 2HB LYS 85 -13.125 19.677 6.192 660 HG2 LYS 85 1HG LYS 85 -11.227 21.255 6.237 661 HG3 LYS 85 2HG LYS 85 -12.053 22.321 5.092 662 HD2 LYS 85 1HD LYS 85 -13.920 22.578 6.753 663 HD3 LYS 85 2HD LYS 85 -12.895 21.735 7.943 664 HE2 LYS 85 1HE LYS 85 -11.105 23.442 7.536 665 HE3 LYS 85 2HE LYS 85 -12.168 24.262 6.382 666 HZ1 LYS 85 3HZ LYS 85 -13.734 24.610 8.247 667 HZ2 LYS 85 1HZ LYS 85 -12.288 25.357 8.457 668 HZ3 LYS 85 2HZ LYS 85 -12.622 23.977 9.283 669 H VAL 86 H VAL 86 -12.342 18.767 1.828 670 HA VAL 86 HA VAL 86 -14.764 17.119 2.037 671 HB VAL 86 HB VAL 86 -12.753 17.426 -0.252 672 HG11 VAL 86 1HG1 VAL 86 -15.614 16.346 -0.185 673 HG12 VAL 86 2HG1 VAL 86 -14.628 16.553 -1.649 674 HG13 VAL 86 3HG1 VAL 86 -14.160 15.374 -0.415 675 HG21 VAL 86 3HG2 VAL 86 -13.714 19.597 0.182 676 HG22 VAL 86 1HG2 VAL 86 -14.348 18.927 -1.307 677 HG23 VAL 86 2HG2 VAL 86 -15.358 18.918 0.153 678 H VAL 87 H VAL 87 -14.622 14.988 2.799 679 HA VAL 87 HA VAL 87 -11.951 13.815 3.200 680 HB VAL 87 HB VAL 87 -14.625 12.501 3.775 681 HG11 VAL 87 1HG1 VAL 87 -13.228 11.285 5.408 682 HG12 VAL 87 2HG1 VAL 87 -12.557 11.089 3.774 683 HG13 VAL 87 3HG1 VAL 87 -11.791 12.204 4.916 684 HG21 VAL 87 3HG2 VAL 87 -14.287 13.291 6.119 685 HG22 VAL 87 1HG2 VAL 87 -12.960 14.333 5.561 686 HG23 VAL 87 2HG2 VAL 87 -14.639 14.620 5.018 687 H ILE 88 H ILE 88 -11.247 13.747 1.083 688 HA ILE 88 HA ILE 88 -12.792 12.416 -1.021 689 HB ILE 88 HB ILE 88 -10.743 12.795 -2.387 690 HG12 ILE 88 1HG1 ILE 88 -9.655 14.362 -0.005 691 HG13 ILE 88 2HG1 ILE 88 -9.100 12.749 -0.423 692 HG21 ILE 88 1HG2 ILE 88 -11.722 15.257 -0.892 693 HG22 ILE 88 2HG2 ILE 88 -11.095 15.203 -2.557 694 HG23 ILE 88 3HG2 ILE 88 -12.634 14.422 -2.171 695 HD11 ILE 88 3HD1 ILE 88 -7.551 14.340 -1.356 696 HD12 ILE 88 1HD1 ILE 88 -8.454 13.633 -2.707 697 HD13 ILE 88 2HD1 ILE 88 -8.848 15.265 -2.122 698 H GLY 89 H GLY 89 -10.624 11.382 1.457 699 HA2 GLY 89 1HA GLY 89 -10.923 8.626 0.726 700 HA3 GLY 89 2HA GLY 89 -9.303 9.212 0.309 701 H TRP 90 H TRP 90 -8.962 7.376 1.966 702 HA TRP 90 HA TRP 90 -8.356 8.535 4.586 703 HB2 TRP 90 1HB TRP 90 -9.852 5.893 4.188 704 HB3 TRP 90 2HB TRP 90 -9.241 6.465 5.717 705 HD1 TRP 90 HD TRP 90 -10.623 8.480 6.858 706 HE1 TRP 90 1HE TRP 90 -12.995 9.414 6.443 707 HE3 TRP 90 3HE TRP 90 -11.435 6.430 2.290 708 HZ2 TRP 90 2HZ TRP 90 -14.854 9.524 4.201 709 HZ3 TRP 90 3HZ TRP 90 -13.396 7.119 0.942 710 HH2 TRP 90 HH TRP 90 -15.056 8.733 1.863 711 H ASP 91 H ASP 91 -6.208 8.051 4.867 712 HA ASP 91 HA ASP 91 -4.887 6.242 3.046 713 HB2 ASP 91 1HB ASP 91 -2.938 6.849 4.762 714 HB3 ASP 91 2HB ASP 91 -3.570 8.034 3.615 715 H LYS 92 H LYS 92 -5.523 4.250 3.349 716 HA LYS 92 HA LYS 92 -5.668 3.008 6.033 717 HB2 LYS 92 1HB LYS 92 -5.874 1.710 3.288 718 HB3 LYS 92 2HB LYS 92 -6.313 1.011 4.844 719 HG2 LYS 92 1HG LYS 92 -7.803 2.988 3.140 720 HG3 LYS 92 2HG LYS 92 -8.356 1.499 3.902 721 HD2 LYS 92 1HD LYS 92 -7.906 2.871 6.136 722 HD3 LYS 92 2HD LYS 92 -8.058 4.259 5.001 723 HE2 LYS 92 1HE LYS 92 -10.282 3.758 4.492 724 HE3 LYS 92 2HE LYS 92 -10.152 2.092 5.050 725 HZ1 LYS 92 3HZ LYS 92 -10.297 2.796 7.282 726 HZ2 LYS 92 1HZ LYS 92 -11.449 3.608 6.416 727 HZ3 LYS 92 2HZ LYS 92 -10.149 4.408 6.891 728 H TYR 93 H TYR 93 -3.961 2.005 7.007 729 HA TYR 93 HA TYR 93 -1.462 1.633 5.447 730 HB2 TYR 93 1HB TYR 93 -1.937 1.833 8.436 731 HB3 TYR 93 2HB TYR 93 -0.384 1.582 7.665 732 HD1 TYR 93 1HD TYR 93 -3.204 4.080 7.854 733 HD2 TYR 93 2HD TYR 93 0.982 3.416 7.057 734 HE1 TYR 93 1HE TYR 93 -2.880 6.487 7.674 735 HE2 TYR 93 2HE TYR 93 1.318 5.829 6.863 736 HH TYR 93 HH TYR 93 -1.456 8.097 6.858 737 H PHE 94 H PHE 94 -0.571 -0.413 5.441 738 HA PHE 94 HA PHE 94 -2.139 -2.571 6.771 739 HB2 PHE 94 1HB PHE 94 -1.063 -2.555 3.937 740 HB3 PHE 94 2HB PHE 94 -1.863 -3.914 4.746 741 HD1 PHE 94 2HD PHE 94 -4.285 -3.651 5.496 742 HD2 PHE 94 1HD PHE 94 -2.298 -0.775 2.967 743 HE1 PHE 94 2HE PHE 94 -6.494 -2.686 4.831 744 HE2 PHE 94 1HE PHE 94 -4.470 0.183 2.332 745 HZ PHE 94 HZ PHE 94 -6.588 -0.787 3.264 746 H GLU 95 H GLU 95 -0.988 -3.933 7.886 747 HA GLU 95 HA GLU 95 1.967 -3.981 7.797 748 HB2 GLU 95 1HB GLU 95 0.597 -3.984 9.920 749 HB3 GLU 95 2HB GLU 95 -0.113 -5.527 9.455 750 HG2 GLU 95 1HG GLU 95 1.905 -6.689 9.852 751 HG3 GLU 95 2HG GLU 95 2.885 -5.234 9.630 752 H ILE 96 H ILE 96 2.920 -5.465 6.362 753 HA ILE 96 HA ILE 96 1.360 -7.795 5.540 754 HB ILE 96 HB ILE 96 3.016 -7.147 3.373 755 HG12 ILE 96 1HG1 ILE 96 2.650 -4.792 3.997 756 HG13 ILE 96 2HG1 ILE 96 2.247 -5.385 2.398 757 HG21 ILE 96 1HG2 ILE 96 0.055 -7.626 3.680 758 HG22 ILE 96 2HG2 ILE 96 0.891 -7.442 2.114 759 HG23 ILE 96 3HG2 ILE 96 1.315 -8.778 3.174 760 HD11 ILE 96 3HD1 ILE 96 0.224 -4.958 4.559 761 HD12 ILE 96 1HD1 ILE 96 0.640 -3.766 3.302 762 HD13 ILE 96 2HD1 ILE 96 -0.078 -5.335 2.860 763 HA PRO 97 HA PRO 97 5.598 -9.612 6.143 764 HB2 PRO 97 1HB PRO 97 5.117 -11.981 4.837 765 HB3 PRO 97 2HB PRO 97 4.687 -11.701 6.555 766 HG2 PRO 97 1HG PRO 97 2.942 -11.475 4.084 767 HG3 PRO 97 2HG PRO 97 2.552 -12.294 5.633 768 HD2 PRO 97 1HD PRO 97 1.707 -9.809 4.975 769 HD3 PRO 97 2HD PRO 97 2.106 -10.200 6.666 770 H MET 98 H MET 98 7.262 -9.575 4.538 771 HA MET 98 HA MET 98 6.599 -9.028 1.710 772 HB2 MET 98 1HB MET 98 9.244 -9.685 3.084 773 HB3 MET 98 2HB MET 98 9.063 -9.482 1.340 774 HG2 MET 98 1HG MET 98 8.252 -7.192 1.661 775 HG3 MET 98 2HG MET 98 8.419 -7.382 3.415 776 HE1 MET 98 3HE MET 98 11.334 -5.105 3.179 777 HE2 MET 98 1HE MET 98 9.683 -4.948 2.538 778 HE3 MET 98 2HE MET 98 9.944 -5.710 4.127 779 H ASP 99 H ASP 99 8.173 -11.732 3.524 780 HA ASP 99 HA ASP 99 8.493 -13.223 1.176 781 HB2 ASP 99 1HB ASP 99 9.977 -13.398 3.055 782 HB3 ASP 99 2HB ASP 99 8.699 -14.046 4.078 783 H ALA 100 H ALA 100 5.659 -13.149 3.242 784 HA ALA 100 HA ALA 100 4.603 -15.652 2.164 785 HB1 ALA 100 1HB ALA 100 2.935 -13.548 3.501 786 HB2 ALA 100 2HB ALA 100 2.680 -15.283 3.414 787 HB3 ALA 100 3HB ALA 100 3.995 -14.655 4.425 788 H LEU 101 H LEU 101 5.053 -12.705 0.590 789 HA LEU 101 HA LEU 101 2.419 -12.424 -0.638 790 HB2 LEU 101 1HB LEU 101 5.132 -11.260 -1.337 791 HB3 LEU 101 2HB LEU 101 3.666 -10.834 -2.198 792 HG LEU 101 HG LEU 101 3.941 -10.453 0.804 793 HD11 LEU 101 1HD1 LEU 101 5.662 -9.222 -0.407 794 HD12 LEU 101 2HD1 LEU 101 4.448 -8.133 0.281 795 HD13 LEU 101 3HD1 LEU 101 4.443 -8.501 -1.475 796 HD21 LEU 101 3HD2 LEU 101 1.604 -10.466 0.024 797 HD22 LEU 101 1HD2 LEU 101 1.997 -9.282 -1.245 798 HD23 LEU 101 2HD2 LEU 101 2.094 -8.835 0.473 799 H GLN 102 H GLN 102 2.067 -12.509 -2.956 800 HA GLN 102 HA GLN 102 2.391 -15.026 -3.984 801 HB2 GLN 102 1HB GLN 102 0.690 -13.240 -4.512 802 HB3 GLN 102 2HB GLN 102 1.893 -12.468 -5.553 803 HG2 GLN 102 1HG GLN 102 2.002 -14.502 -6.927 804 HG3 GLN 102 2HG GLN 102 0.931 -15.342 -5.805 805 HE21 GLN 102 1HE2 GLN 102 1.109 -13.469 -8.650 806 HE22 GLN 102 2HE2 GLN 102 -0.602 -13.125 -8.835 807 H ASP 103 H ASP 103 4.627 -12.288 -4.341 808 HA ASP 103 HA ASP 103 6.626 -13.850 -5.667 809 HB2 ASP 103 1HB ASP 103 4.953 -13.216 -7.508 810 HB3 ASP 103 2HB ASP 103 5.394 -11.534 -7.203 811 H ASN 104 H ASN 104 8.336 -11.853 -6.481 812 HA ASN 104 HA ASN 104 8.885 -10.124 -4.187 813 HB2 ASN 104 1HB ASN 104 10.331 -10.695 -6.805 814 HB3 ASN 104 2HB ASN 104 10.881 -9.561 -5.590 815 HD21 ASN 104 1HD2 ASN 104 12.592 -10.442 -4.564 816 HD22 ASN 104 2HD2 ASN 104 12.676 -12.089 -3.961 817 H SER 105 H SER 105 6.376 -9.598 -5.525 818 HA SER 105 HA SER 105 6.965 -6.814 -5.889 819 HB2 SER 105 1HB SER 105 5.443 -6.378 -7.786 820 HB3 SER 105 2HB SER 105 6.766 -7.443 -8.235 821 HG SER 105 HG SER 105 5.613 -9.156 -8.296 822 H ILE 106 H ILE 106 5.171 -5.539 -5.316 823 HA ILE 106 HA ILE 106 3.222 -6.924 -3.566 824 HB ILE 106 HB ILE 106 4.821 -5.692 -2.299 825 HG12 ILE 106 1HG1 ILE 106 3.531 -4.219 -0.944 826 HG13 ILE 106 2HG1 ILE 106 2.301 -4.007 -2.183 827 HG21 ILE 106 1HG2 ILE 106 5.308 -3.370 -2.440 828 HG22 ILE 106 2HG2 ILE 106 5.587 -4.053 -4.014 829 HG23 ILE 106 3HG2 ILE 106 4.108 -3.120 -3.739 830 HD11 ILE 106 3HD1 ILE 106 2.990 -6.648 -0.814 831 HD12 ILE 106 1HD1 ILE 106 1.640 -5.598 -0.371 832 HD13 ILE 106 2HD1 ILE 106 1.651 -6.380 -1.951 833 H GLN 107 H GLN 107 1.239 -5.262 -3.348 834 HA GLN 107 HA GLN 107 0.154 -3.756 -5.363 835 HB2 GLN 107 1HB GLN 107 0.333 -5.693 -6.871 836 HB3 GLN 107 2HB GLN 107 -0.382 -6.760 -5.658 837 HG2 GLN 107 1HG GLN 107 -2.549 -5.729 -5.979 838 HG3 GLN 107 2HG GLN 107 -1.842 -4.430 -6.965 839 HE21 GLN 107 1HE2 GLN 107 -2.523 -4.763 -9.076 840 HE22 GLN 107 2HE2 GLN 107 -2.438 -6.318 -9.892 841 H ILE 108 H ILE 108 -2.242 -3.577 -4.860 842 HA ILE 108 HA ILE 108 -3.320 -5.166 -2.705 843 HB ILE 108 HB ILE 108 -4.021 -2.240 -2.584 844 HG12 ILE 108 1HG1 ILE 108 -1.463 -3.333 -1.407 845 HG13 ILE 108 2HG1 ILE 108 -1.711 -1.877 -2.368 846 HG21 ILE 108 1HG2 ILE 108 -5.227 -4.102 -1.330 847 HG22 ILE 108 2HG2 ILE 108 -3.761 -4.288 -0.347 848 HG23 ILE 108 3HG2 ILE 108 -4.682 -2.758 -0.363 849 HD11 ILE 108 3HD1 ILE 108 -2.419 -2.358 0.542 850 HD12 ILE 108 1HD1 ILE 108 -1.319 -1.155 -0.143 851 HD13 ILE 108 2HD1 ILE 108 -3.080 -0.996 -0.381 852 H LYS 109 H LYS 109 -5.812 -4.972 -2.911 853 HA LYS 109 HA LYS 109 -6.763 -3.549 -5.255 854 HB2 LYS 109 1HB LYS 109 -7.897 -5.606 -6.196 855 HB3 LYS 109 2HB LYS 109 -6.160 -5.642 -6.279 856 HG2 LYS 109 1HG LYS 109 -6.626 -7.007 -3.896 857 HG3 LYS 109 2HG LYS 109 -8.052 -7.399 -4.833 858 HD2 LYS 109 1HD LYS 109 -6.433 -9.099 -5.200 859 HD3 LYS 109 2HD LYS 109 -6.535 -8.190 -6.703 860 HE2 LYS 109 1HE LYS 109 -4.386 -7.037 -6.193 861 HE3 LYS 109 2HE LYS 109 -4.424 -7.720 -4.549 862 HZ1 LYS 109 3HZ LYS 109 -2.952 -9.037 -5.792 863 HZ2 LYS 109 1HZ LYS 109 -3.989 -9.290 -7.027 864 HZ3 LYS 109 2HZ LYS 109 -4.253 -9.954 -5.555 865 H ALA 110 H ALA 110 -9.223 -3.187 -5.089 866 HA ALA 110 HA ALA 110 -10.315 -3.964 -2.425 867 HB1 ALA 110 1HB ALA 110 -9.296 -1.952 -1.730 868 HB2 ALA 110 2HB ALA 110 -9.615 -1.139 -3.284 869 HB3 ALA 110 3HB ALA 110 -10.932 -1.462 -2.144 870 H LEU 111 H LEU 111 -12.503 -3.930 -2.295 871 HA LEU 111 HA LEU 111 -14.043 -3.916 -4.730 872 HB2 LEU 111 1HB LEU 111 -14.592 -5.276 -2.653 873 HB3 LEU 111 2HB LEU 111 -15.042 -3.754 -1.872 874 HG LEU 111 HG LEU 111 -16.746 -3.389 -3.735 875 HD11 LEU 111 1HD1 LEU 111 -17.522 -5.349 -4.972 876 HD12 LEU 111 2HD1 LEU 111 -16.242 -6.353 -4.276 877 HD13 LEU 111 3HD1 LEU 111 -15.839 -5.038 -5.400 878 HD21 LEU 111 3HD2 LEU 111 -17.412 -4.087 -1.534 879 HD22 LEU 111 1HD2 LEU 111 -16.958 -5.781 -1.868 880 HD23 LEU 111 2HD2 LEU 111 -18.327 -5.039 -2.714 881 H SER 112 H SER 112 -14.730 -2.198 -5.732 882 HA SER 112 HA SER 112 -14.798 0.496 -4.465 883 HB2 SER 112 1HB SER 112 -13.529 0.596 -6.420 884 HB3 SER 112 2HB SER 112 -14.512 -0.588 -7.254 885 HG SER 112 HG SER 112 -14.817 1.589 -8.005 886 H SER 113 H SER 113 -16.816 -1.090 -6.978 887 HA SER 113 HA SER 113 -19.292 -0.161 -5.663 888 HB2 SER 113 1HB SER 113 -18.251 1.661 -7.041 889 HB3 SER 113 2HB SER 113 -18.268 0.601 -8.444 890 HG SER 113 HG SER 113 -19.993 2.100 -8.305 891 H GLY 114 H GLY 114 -20.758 -1.768 -5.859 892 HA2 GLY 114 1HA GLY 114 -21.900 -3.597 -6.578 893 HA3 GLY 114 2HA GLY 114 -21.285 -3.297 -8.212 894 H THR 115 H THR 115 -19.381 -4.315 -8.881 895 HA THR 115 HA THR 115 -18.042 -6.277 -7.097 896 HB THR 115 HB THR 115 -17.993 -7.780 -9.189 897 HG1 THR 115 1HG THR 115 -19.870 -7.408 -10.550 898 HG21 THR 115 3HG2 THR 115 -20.192 -8.756 -8.664 899 HG22 THR 115 1HG2 THR 115 -20.680 -7.269 -7.837 900 HG23 THR 115 2HG2 THR 115 -19.357 -8.258 -7.182 901 H THR 116 H THR 116 -17.564 -3.484 -8.640 902 HA THR 116 HA THR 116 -15.215 -3.971 -10.270 903 HB THR 116 HB THR 116 -16.078 -1.524 -8.704 904 HG1 THR 116 1HG THR 116 -17.399 -2.242 -10.504 905 HG21 THR 116 3HG2 THR 116 -13.632 -1.372 -9.089 906 HG22 THR 116 1HG2 THR 116 -14.502 -0.237 -10.119 907 HG23 THR 116 2HG2 THR 116 -13.890 -1.752 -10.809 908 H PHE 117 H PHE 117 -13.292 -4.414 -9.584 909 HA PHE 117 HA PHE 117 -12.529 -3.976 -6.768 910 HB2 PHE 117 1HB PHE 117 -12.876 -6.455 -8.075 911 HB3 PHE 117 2HB PHE 117 -11.122 -6.211 -8.007 912 HD1 PHE 117 1HD PHE 117 -10.076 -5.765 -5.719 913 HD2 PHE 117 2HD PHE 117 -14.185 -6.951 -6.174 914 HE1 PHE 117 1HE PHE 117 -10.163 -6.395 -3.304 915 HE2 PHE 117 2HE PHE 117 -14.260 -7.616 -3.773 916 HZ PHE 117 HZ PHE 117 -12.260 -7.335 -2.348 917 H VAL 118 H VAL 118 -11.131 -2.260 -6.950 918 HA VAL 118 HA VAL 118 -9.655 -1.780 -9.449 919 HB VAL 118 HB VAL 118 -10.133 0.164 -8.027 920 HG11 VAL 118 1HG1 VAL 118 -9.379 0.602 -5.931 921 HG12 VAL 118 2HG1 VAL 118 -10.610 -0.641 -6.071 922 HG13 VAL 118 3HG1 VAL 118 -8.894 -1.113 -5.734 923 HG21 VAL 118 3HG2 VAL 118 -8.196 1.341 -8.127 924 HG22 VAL 118 1HG2 VAL 118 -7.206 -0.163 -7.926 925 HG23 VAL 118 2HG2 VAL 118 -8.117 0.158 -9.411 926 H TYR 119 H TYR 119 -7.555 -2.255 -9.821 927 HA TYR 119 HA TYR 119 -6.114 -3.781 -7.726 928 HB2 TYR 119 1HB TYR 119 -5.696 -4.032 -10.745 929 HB3 TYR 119 2HB TYR 119 -5.027 -5.068 -9.500 930 HD1 TYR 119 2HD TYR 119 -8.069 -4.228 -11.490 931 HD2 TYR 119 1HD TYR 119 -6.366 -6.888 -8.549 932 HE1 TYR 119 2HE TYR 119 -10.015 -5.719 -11.719 933 HE2 TYR 119 1HE TYR 119 -8.348 -8.364 -8.749 934 HH TYR 119 HH TYR 119 -11.222 -7.499 -10.613 935 H SER 120 H SER 120 -4.446 -2.686 -6.962 936 HA SER 120 HA SER 120 -3.758 -0.108 -8.056 937 HB2 SER 120 1HB SER 120 -2.503 0.080 -6.189 938 HB3 SER 120 2HB SER 120 -3.522 -1.122 -5.614 939 HG SER 120 HG SER 120 -1.062 -1.894 -6.795 940 H GLN 121 H GLN 121 -1.390 0.324 -8.656 941 HA GLN 121 HA GLN 121 -0.510 -1.325 -10.784 942 HB2 GLN 121 1HB GLN 121 1.453 0.141 -10.814 943 HB3 GLN 121 2HB GLN 121 -0.034 1.076 -10.627 944 HG2 GLN 121 1HG GLN 121 0.569 0.853 -8.028 945 HG3 GLN 121 2HG GLN 121 2.174 0.487 -8.648 946 HE21 GLN 121 1HE2 GLN 121 3.089 2.408 -7.748 947 HE22 GLN 121 2HE2 GLN 121 2.386 4.010 -7.968 948 H LYS 122 H LYS 122 1.404 -2.538 -10.937 949 HA LYS 122 HA LYS 122 2.057 -4.255 -8.612 950 HB2 LYS 122 1HB LYS 122 1.481 -5.255 -10.763 951 HB3 LYS 122 2HB LYS 122 2.632 -4.267 -11.626 952 HG2 LYS 122 1HG LYS 122 3.588 -6.236 -9.516 953 HG3 LYS 122 2HG LYS 122 3.144 -6.760 -11.136 954 HD2 LYS 122 1HD LYS 122 4.800 -4.994 -12.037 955 HD3 LYS 122 2HD LYS 122 5.390 -4.871 -10.379 956 HE2 LYS 122 1HE LYS 122 6.827 -6.367 -11.525 957 HE3 LYS 122 2HE LYS 122 5.900 -7.313 -10.374 958 HZ1 LYS 122 3HZ LYS 122 6.117 -8.349 -12.551 959 HZ2 LYS 122 1HZ LYS 122 5.344 -7.136 -13.288 960 HZ3 LYS 122 2HZ LYS 122 4.532 -8.113 -12.228 961 H ILE 123 H ILE 123 3.780 -3.627 -7.329 962 HA ILE 123 HA ILE 123 6.104 -2.311 -8.669 963 HB ILE 123 HB ILE 123 5.161 -2.062 -5.774 964 HG12 ILE 123 1HG1 ILE 123 3.600 -0.728 -7.050 965 HG13 ILE 123 2HG1 ILE 123 4.678 0.318 -6.154 966 HG21 ILE 123 1HG2 ILE 123 7.340 -0.487 -7.202 967 HG22 ILE 123 2HG2 ILE 123 6.862 -0.295 -5.507 968 HG23 ILE 123 3HG2 ILE 123 7.618 -1.793 -6.024 969 HD11 ILE 123 3HD1 ILE 123 4.662 -0.244 -9.127 970 HD12 ILE 123 1HD1 ILE 123 4.329 1.283 -8.313 971 HD13 ILE 123 2HD1 ILE 123 5.970 0.676 -8.359 972 H ASP 124 H ASP 124 7.398 -3.749 -9.201 973 HA ASP 124 HA ASP 124 8.148 -6.112 -7.681 974 HB2 ASP 124 1HB ASP 124 8.998 -4.712 -10.108 975 HB3 ASP 124 2HB ASP 124 10.362 -5.114 -9.071 976 H PHE 125 H PHE 125 9.688 -6.293 -6.050 977 HA PHE 125 HA PHE 125 11.146 -3.875 -5.325 978 HB2 PHE 125 1HB PHE 125 10.624 -4.013 -3.016 979 HB3 PHE 125 2HB PHE 125 9.143 -3.776 -3.871 980 HD1 PHE 125 1HD PHE 125 11.191 -6.149 -1.869 981 HD2 PHE 125 2HD PHE 125 7.407 -5.507 -3.826 982 HE1 PHE 125 1HE PHE 125 10.232 -8.011 -0.588 983 HE2 PHE 125 2HE PHE 125 6.431 -7.397 -2.528 984 HZ PHE 125 HZ PHE 125 7.842 -8.658 -0.915 985 H GLU 126 H GLU 126 12.939 -4.437 -3.826 986 HA GLU 126 HA GLU 126 13.852 -7.201 -4.352 987 HB2 GLU 126 1HB GLU 126 15.327 -4.589 -4.250 988 HB3 GLU 126 2HB GLU 126 16.126 -6.182 -4.278 989 HG2 GLU 126 1HG GLU 126 14.661 -6.599 -6.433 990 HG3 GLU 126 2HG GLU 126 14.337 -4.873 -6.399 991 H ARG 127 H ARG 127 15.111 -8.130 -2.758 992 HA ARG 127 HA ARG 127 14.356 -7.236 -0.030 993 HB2 ARG 127 1HB ARG 127 14.714 -10.099 -0.925 994 HB3 ARG 127 2HB ARG 127 14.161 -9.508 0.641 995 HG2 ARG 127 1HG ARG 127 12.314 -8.388 -1.060 996 HG3 ARG 127 2HG ARG 127 12.732 -9.839 -1.977 997 HD2 ARG 127 1HD ARG 127 11.721 -9.683 0.870 998 HD3 ARG 127 2HD ARG 127 10.787 -10.199 -0.557 999 HE ARG 127 HE ARG 127 13.188 -11.690 0.459 1000 HH11 ARG 127 1HH1 ARG 127 9.916 -11.962 -1.041 1001 HH12 ARG 127 2HH1 ARG 127 9.806 -13.625 -0.656 1002 HH21 ARG 127 1HH2 ARG 127 12.727 -13.778 1.314 1003 HH22 ARG 127 2HH2 ARG 127 11.285 -14.617 0.821 1004 H GLU 128 H GLU 128 16.045 -6.197 0.447 1005 HA GLU 128 HA GLU 128 18.216 -5.617 0.937 1006 HB2 GLU 128 1HB GLU 128 19.190 -7.241 2.599 1007 HB3 GLU 128 2HB GLU 128 17.551 -6.739 2.905 1008 HG2 GLU 128 1HG GLU 128 16.587 -8.799 2.228 1009 HG3 GLU 128 2HG GLU 128 18.064 -9.315 1.428 Start of MODEL 20 1 H1 GLY 1 H GLY 1 -22.170 17.547 -7.032 2 HA2 GLY 1 1HA GLY 1 -21.703 17.430 -4.615 3 HA3 GLY 1 2HA GLY 1 -22.542 15.990 -5.220 4 H ALA 2 H ALA 2 -21.591 15.009 -3.242 5 HA ALA 2 HA ALA 2 -19.179 13.518 -3.748 6 HB1 ALA 2 1HB ALA 2 -18.092 15.587 -2.957 7 HB2 ALA 2 2HB ALA 2 -19.172 15.650 -1.544 8 HB3 ALA 2 3HB ALA 2 -17.980 14.346 -1.705 9 H GLU 3 H GLU 3 -21.374 12.318 -3.612 10 HA GLU 3 HA GLU 3 -22.801 12.185 -1.172 11 HB2 GLU 3 1HB GLU 3 -23.445 11.833 -3.722 12 HB3 GLU 3 2HB GLU 3 -23.017 10.160 -3.406 13 HG2 GLU 3 1HG GLU 3 -25.389 10.403 -3.157 14 HG3 GLU 3 2HG GLU 3 -24.742 10.132 -1.549 15 H ALA 4 H ALA 4 -19.959 11.277 -0.871 16 HA ALA 4 HA ALA 4 -18.588 9.588 -0.246 17 HB1 ALA 4 1HB ALA 4 -19.551 7.716 1.197 18 HB2 ALA 4 2HB ALA 4 -19.739 9.378 1.823 19 HB3 ALA 4 3HB ALA 4 -21.107 8.510 1.084 20 H LEU 5 H LEU 5 -18.803 9.457 -2.931 21 HA LEU 5 HA LEU 5 -19.911 7.336 -4.099 22 HB2 LEU 5 1HB LEU 5 -17.134 8.349 -4.704 23 HB3 LEU 5 2HB LEU 5 -18.423 7.969 -5.817 24 HG LEU 5 HG LEU 5 -18.020 10.226 -5.832 25 HD11 LEU 5 1HD1 LEU 5 -20.628 9.907 -4.381 26 HD12 LEU 5 2HD1 LEU 5 -20.326 9.486 -6.078 27 HD13 LEU 5 3HD1 LEU 5 -20.186 11.181 -5.573 28 HD21 LEU 5 3HD2 LEU 5 -17.100 10.347 -3.494 29 HD22 LEU 5 1HD2 LEU 5 -18.702 11.063 -3.140 30 HD23 LEU 5 2HD2 LEU 5 -17.666 11.779 -4.379 31 HA PRO 6 HA PRO 6 -17.248 3.995 -2.726 32 HB2 PRO 6 1HB PRO 6 -17.523 2.222 -4.727 33 HB3 PRO 6 2HB PRO 6 -18.921 2.742 -3.747 34 HG2 PRO 6 1HG PRO 6 -18.107 3.734 -6.482 35 HG3 PRO 6 2HG PRO 6 -19.728 3.233 -5.896 36 HD2 PRO 6 1HD PRO 6 -18.716 5.916 -5.915 37 HD3 PRO 6 2HD PRO 6 -20.095 5.347 -4.965 38 H LEU 7 H LEU 7 -15.305 2.929 -3.379 39 HA LEU 7 HA LEU 7 -13.173 4.470 -3.970 40 HB2 LEU 7 1HB LEU 7 -13.051 2.246 -3.041 41 HB3 LEU 7 2HB LEU 7 -13.532 1.539 -4.584 42 HG LEU 7 HG LEU 7 -11.378 2.487 -5.569 43 HD11 LEU 7 1HD1 LEU 7 -10.759 2.824 -2.612 44 HD12 LEU 7 2HD1 LEU 7 -10.792 4.100 -3.821 45 HD13 LEU 7 3HD1 LEU 7 -9.545 2.850 -3.908 46 HD21 LEU 7 3HD2 LEU 7 -11.298 0.367 -3.413 47 HD22 LEU 7 1HD2 LEU 7 -10.047 0.613 -4.658 48 HD23 LEU 7 2HD2 LEU 7 -11.689 0.129 -5.115 49 H TYR 8 H TYR 8 -12.443 5.594 -5.638 50 HA TYR 8 HA TYR 8 -12.964 4.661 -8.420 51 HB2 TYR 8 1HB TYR 8 -12.978 7.120 -8.996 52 HB3 TYR 8 2HB TYR 8 -14.351 6.446 -8.175 53 HD1 TYR 8 2HD TYR 8 -11.246 8.455 -7.574 54 HD2 TYR 8 1HD TYR 8 -15.229 7.476 -6.263 55 HE1 TYR 8 2HE TYR 8 -11.144 10.285 -5.881 56 HE2 TYR 8 1HE TYR 8 -15.173 9.298 -4.602 57 HH TYR 8 HH TYR 8 -12.391 11.531 -4.320 58 H TYR 9 H TYR 9 -10.448 5.167 -6.209 59 HA TYR 9 HA TYR 9 -8.435 5.239 -8.370 60 HB2 TYR 9 1HB TYR 9 -8.846 7.567 -7.916 61 HB3 TYR 9 2HB TYR 9 -8.744 7.242 -6.202 62 HD1 TYR 9 2HD TYR 9 -6.533 6.645 -5.113 63 HD2 TYR 9 1HD TYR 9 -6.854 8.105 -9.164 64 HE1 TYR 9 2HE TYR 9 -4.229 7.477 -4.995 65 HE2 TYR 9 1HE TYR 9 -4.492 8.838 -9.088 66 HH TYR 9 HH TYR 9 -2.666 8.870 -6.023 67 H LEU 10 H LEU 10 -6.792 3.781 -7.788 68 HA LEU 10 HA LEU 10 -6.271 3.250 -4.932 69 HB2 LEU 10 1HB LEU 10 -7.498 1.376 -6.266 70 HB3 LEU 10 2HB LEU 10 -6.065 1.296 -7.282 71 HG LEU 10 HG LEU 10 -5.749 -0.435 -5.791 72 HD11 LEU 10 1HD1 LEU 10 -4.313 1.690 -4.245 73 HD12 LEU 10 2HD1 LEU 10 -3.766 1.017 -5.786 74 HD13 LEU 10 3HD1 LEU 10 -3.974 -0.023 -4.363 75 HD21 LEU 10 3HD2 LEU 10 -7.614 -0.086 -4.329 76 HD22 LEU 10 1HD2 LEU 10 -6.861 1.350 -3.606 77 HD23 LEU 10 2HD2 LEU 10 -6.163 -0.276 -3.329 78 H GLN 11 H GLN 11 -4.102 3.747 -4.556 79 HA GLN 11 HA GLN 11 -2.129 3.317 -6.643 80 HB2 GLN 11 1HB GLN 11 -3.178 5.841 -6.658 81 HB3 GLN 11 2HB GLN 11 -1.910 6.087 -5.500 82 HG2 GLN 11 1HG GLN 11 -0.620 6.522 -7.292 83 HG3 GLN 11 2HG GLN 11 -0.536 4.796 -7.516 84 HE21 GLN 11 1HE2 GLN 11 -3.120 4.220 -8.618 85 HE22 GLN 11 2HE2 GLN 11 -3.203 5.018 -10.162 86 H ILE 12 H ILE 12 -0.338 2.503 -5.628 87 HA ILE 12 HA ILE 12 -0.374 2.104 -2.876 88 HB ILE 12 HB ILE 12 2.086 1.972 -4.651 89 HG12 ILE 12 1HG1 ILE 12 0.414 0.486 -5.564 90 HG13 ILE 12 2HG1 ILE 12 1.622 -0.449 -4.701 91 HG21 ILE 12 1HG2 ILE 12 2.842 1.918 -2.329 92 HG22 ILE 12 2HG2 ILE 12 1.467 0.941 -1.852 93 HG23 ILE 12 3HG2 ILE 12 2.768 0.226 -2.817 94 HD11 ILE 12 3HD1 ILE 12 0.023 -0.622 -2.733 95 HD12 ILE 12 1HD1 ILE 12 -1.208 0.137 -3.770 96 HD13 ILE 12 2HD1 ILE 12 -0.502 -1.426 -4.206 97 H THR 13 H THR 13 1.227 4.898 -4.500 98 HA THR 13 HA THR 13 1.767 6.869 -3.690 99 HB THR 13 HB THR 13 -0.021 6.077 -1.368 100 HG1 THR 13 1HG THR 13 -1.125 5.796 -3.205 101 HG21 THR 13 3HG2 THR 13 1.101 8.222 -0.897 102 HG22 THR 13 1HG2 THR 13 -0.608 8.458 -1.299 103 HG23 THR 13 2HG2 THR 13 0.646 8.825 -2.506 104 H GLY 14 H GLY 14 2.339 4.616 -0.852 105 HA2 GLY 14 1HA GLY 14 5.124 5.480 -0.935 106 HA3 GLY 14 2HA GLY 14 4.286 5.922 0.543 107 H ILE 15 H ILE 15 6.458 4.138 0.376 108 HA ILE 15 HA ILE 15 5.316 1.681 1.499 109 HB ILE 15 HB ILE 15 5.451 1.194 -0.905 110 HG12 ILE 15 1HG1 ILE 15 7.690 -0.236 0.577 111 HG13 ILE 15 2HG1 ILE 15 5.965 -0.572 0.812 112 HG21 ILE 15 1HG2 ILE 15 8.469 1.436 -0.900 113 HG22 ILE 15 2HG2 ILE 15 7.344 1.405 -2.263 114 HG23 ILE 15 3HG2 ILE 15 7.489 2.857 -1.249 115 HD11 ILE 15 3HD1 ILE 15 5.702 -1.345 -1.424 116 HD12 ILE 15 1HD1 ILE 15 7.340 -0.809 -1.895 117 HD13 ILE 15 2HD1 ILE 15 7.151 -2.143 -0.787 118 H THR 16 H THR 16 6.861 0.665 2.931 119 HA THR 16 HA THR 16 9.603 1.291 2.733 120 HB THR 16 HB THR 16 8.898 3.360 3.864 121 HG1 THR 16 1HG THR 16 10.894 2.472 4.272 122 HG21 THR 16 3HG2 THR 16 7.991 3.420 6.079 123 HG22 THR 16 1HG2 THR 16 8.104 1.656 6.254 124 HG23 THR 16 2HG2 THR 16 6.923 2.374 5.147 125 H SER 17 H SER 17 10.470 0.323 5.210 126 HA SER 17 HA SER 17 8.837 -1.901 6.043 127 HB2 SER 17 1HB SER 17 10.720 -3.554 5.694 128 HB3 SER 17 2HB SER 17 9.971 -2.993 4.196 129 HG SER 17 HG SER 17 12.448 -3.057 4.729 130 H ASP 18 H ASP 18 9.825 -2.986 7.873 131 HA ASP 18 HA ASP 18 10.538 -1.160 9.917 132 HB2 ASP 18 1HB ASP 18 9.455 -3.337 10.307 133 HB3 ASP 18 2HB ASP 18 10.916 -4.180 9.762 134 H GLY 19 H GLY 19 12.653 -3.282 7.894 135 HA2 GLY 19 1HA GLY 19 15.064 -2.407 9.212 136 HA3 GLY 19 2HA GLY 19 14.920 -3.337 7.729 137 H ASN 20 H ASN 20 13.114 -0.346 7.412 138 HA ASN 20 HA ASN 20 15.465 0.778 5.951 139 HB2 ASN 20 1HB ASN 20 13.266 -0.170 4.686 140 HB3 ASN 20 2HB ASN 20 12.760 1.518 4.978 141 HD21 ASN 20 1HD2 ASN 20 13.538 0.201 2.364 142 HD22 ASN 20 2HD2 ASN 20 14.875 1.156 1.784 143 H ASP 21 H ASP 21 14.523 1.486 8.729 144 HA ASP 21 HA ASP 21 14.255 3.333 9.983 145 HB2 ASP 21 1HB ASP 21 16.158 4.031 8.241 146 HB3 ASP 21 2HB ASP 21 14.960 5.186 7.699 147 H PHE 22 H PHE 22 12.072 2.375 8.178 148 HA PHE 22 HA PHE 22 9.969 2.780 7.579 149 HB2 PHE 22 1HB PHE 22 10.132 4.811 9.826 150 HB3 PHE 22 2HB PHE 22 8.658 4.389 8.979 151 HD1 PHE 22 2HD PHE 22 11.417 2.116 10.424 152 HD2 PHE 22 1HD PHE 22 7.262 3.334 10.499 153 HE1 PHE 22 2HE PHE 22 10.908 0.278 11.920 154 HE2 PHE 22 1HE PHE 22 6.780 1.499 12.071 155 HZ PHE 22 HZ PHE 22 8.588 -0.095 12.738 156 H ALA 23 H ALA 23 12.152 4.172 6.169 157 HA ALA 23 HA ALA 23 11.439 6.752 5.383 158 HB1 ALA 23 1HB ALA 23 13.082 6.442 3.562 159 HB2 ALA 23 2HB ALA 23 13.684 5.967 5.170 160 HB3 ALA 23 3HB ALA 23 13.186 4.720 3.998 161 H TRP 24 H TRP 24 9.235 6.826 4.826 162 HA TRP 24 HA TRP 24 7.844 5.096 3.268 163 HB2 TRP 24 1HB TRP 24 7.480 8.028 3.916 164 HB3 TRP 24 2HB TRP 24 6.321 7.237 2.877 165 HD1 TRP 24 HD TRP 24 6.802 7.909 6.409 166 HE1 TRP 24 1HE TRP 24 5.324 6.406 7.850 167 HE3 TRP 24 3HE TRP 24 5.612 4.431 2.901 168 HZ2 TRP 24 2HZ TRP 24 3.804 3.944 7.494 169 HZ3 TRP 24 3HZ TRP 24 4.198 2.477 3.464 170 HH2 TRP 24 HH TRP 24 3.289 2.220 5.770 171 H ASP 25 H ASP 25 10.070 7.097 1.819 172 HA ASP 25 HA ASP 25 10.469 7.905 -0.371 173 HB2 ASP 25 1HB ASP 25 9.979 4.953 -0.463 174 HB3 ASP 25 2HB ASP 25 10.437 5.861 -1.910 175 H ASN 26 H ASN 26 8.998 9.364 -1.186 176 HA ASN 26 HA ASN 26 6.225 8.667 -1.509 177 HB2 ASN 26 1HB ASN 26 7.741 11.140 -2.450 178 HB3 ASN 26 2HB ASN 26 6.022 10.887 -2.698 179 HD21 ASN 26 1HD2 ASN 26 8.298 10.518 0.105 180 HD22 ASN 26 2HD2 ASN 26 7.264 11.290 1.257 181 H LEU 27 H LEU 27 5.948 7.070 -2.916 182 HA LEU 27 HA LEU 27 7.287 6.650 -5.298 183 HB2 LEU 27 1HB LEU 27 4.423 5.801 -4.715 184 HB3 LEU 27 2HB LEU 27 5.510 5.068 -5.908 185 HG LEU 27 HG LEU 27 5.934 5.061 -2.890 186 HD11 LEU 27 1HD1 LEU 27 5.318 2.736 -2.923 187 HD12 LEU 27 2HD1 LEU 27 5.143 2.725 -4.677 188 HD13 LEU 27 3HD1 LEU 27 4.010 3.664 -3.649 189 HD21 LEU 27 3HD2 LEU 27 8.078 4.966 -4.132 190 HD22 LEU 27 1HD2 LEU 27 7.462 3.542 -5.056 191 HD23 LEU 27 2HD2 LEU 27 7.728 3.475 -3.312 192 H THR 28 H THR 28 6.998 7.072 -7.417 193 HA THR 28 HA THR 28 5.597 9.352 -8.338 194 HB THR 28 HB THR 28 6.160 7.717 -10.554 195 HG1 THR 28 1HG THR 28 8.392 7.521 -8.854 196 HG21 THR 28 3HG2 THR 28 7.941 9.699 -9.071 197 HG22 THR 28 1HG2 THR 28 6.784 10.091 -10.345 198 HG23 THR 28 2HG2 THR 28 8.232 9.138 -10.730 199 H SER 29 H SER 29 3.907 9.269 -10.091 200 HA SER 29 HA SER 29 1.585 8.021 -9.093 201 HB2 SER 29 1HB SER 29 2.052 9.175 -11.873 202 HB3 SER 29 2HB SER 29 0.510 9.009 -11.022 203 HG SER 29 HG SER 29 1.518 11.124 -10.917 204 H SER 30 H SER 30 3.160 7.396 -12.293 205 HA SER 30 HA SER 30 2.541 4.496 -12.019 206 HB2 SER 30 1HB SER 30 3.345 6.157 -14.430 207 HB3 SER 30 2HB SER 30 3.202 4.397 -14.412 208 HG SER 30 HG SER 30 1.078 6.112 -13.626 209 H GLN 31 H GLN 31 4.145 4.971 -10.182 210 HA GLN 31 HA GLN 31 6.933 4.406 -10.921 211 HB2 GLN 31 1HB GLN 31 6.115 5.149 -8.596 212 HB3 GLN 31 2HB GLN 31 5.314 3.597 -8.494 213 HG2 GLN 31 1HG GLN 31 7.189 3.040 -7.415 214 HG3 GLN 31 2HG GLN 31 7.737 2.704 -9.032 215 HE21 GLN 31 1HE2 GLN 31 7.944 4.872 -6.309 216 HE22 GLN 31 2HE2 GLN 31 9.445 5.641 -6.706 217 H THR 32 H THR 32 7.618 2.147 -11.317 218 HA THR 32 HA THR 32 5.475 0.072 -11.345 219 HB THR 32 HB THR 32 6.703 -0.845 -13.365 220 HG1 THR 32 1HG THR 32 8.468 0.206 -13.815 221 HG21 THR 32 3HG2 THR 32 4.522 0.350 -13.433 222 HG22 THR 32 1HG2 THR 32 5.477 0.574 -14.903 223 HG23 THR 32 2HG2 THR 32 5.381 1.881 -13.706 224 H LYS 33 H LYS 33 8.375 1.051 -9.967 225 HA LYS 33 HA LYS 33 8.939 -1.649 -8.973 226 HB2 LYS 33 1HB LYS 33 10.249 -0.923 -11.225 227 HB3 LYS 33 2HB LYS 33 11.269 -0.065 -10.072 228 HG2 LYS 33 1HG LYS 33 10.514 -2.984 -9.769 229 HG3 LYS 33 2HG LYS 33 11.830 -2.510 -10.805 230 HD2 LYS 33 1HD LYS 33 12.205 -1.305 -8.176 231 HD3 LYS 33 2HD LYS 33 11.956 -3.054 -8.046 232 HE2 LYS 33 1HE LYS 33 14.300 -2.537 -8.203 233 HE3 LYS 33 2HE LYS 33 13.799 -3.392 -9.666 234 HZ1 LYS 33 3HZ LYS 33 15.220 -1.237 -9.684 235 HZ2 LYS 33 1HZ LYS 33 13.758 -0.479 -9.779 236 HZ3 LYS 33 2HZ LYS 33 14.175 -1.584 -10.925 237 H ALA 34 H ALA 34 10.281 -1.601 -7.109 238 HA ALA 34 HA ALA 34 9.564 0.485 -5.348 239 HB1 ALA 34 1HB ALA 34 11.163 -0.711 -3.761 240 HB2 ALA 34 2HB ALA 34 9.940 -1.735 -4.520 241 HB3 ALA 34 3HB ALA 34 11.625 -1.754 -5.117 242 HA PRO 35 HA PRO 35 12.905 3.379 -5.801 243 HB2 PRO 35 1HB PRO 35 13.119 4.410 -3.264 244 HB3 PRO 35 2HB PRO 35 11.724 4.735 -4.336 245 HG2 PRO 35 1HG PRO 35 11.941 2.612 -2.172 246 HG3 PRO 35 2HG PRO 35 10.610 3.785 -2.423 247 HD2 PRO 35 1HD PRO 35 10.369 1.321 -3.335 248 HD3 PRO 35 2HD PRO 35 9.832 2.704 -4.329 249 H ASN 36 H ASN 36 13.217 0.758 -3.281 250 HA ASN 36 HA ASN 36 16.107 0.682 -3.664 251 HB2 ASN 36 1HB ASN 36 14.811 1.227 -0.965 252 HB3 ASN 36 2HB ASN 36 16.465 0.765 -1.186 253 HD21 ASN 36 1HD2 ASN 36 14.373 3.412 -0.949 254 HD22 ASN 36 2HD2 ASN 36 15.477 4.646 -1.538 255 H VAL 37 H VAL 37 16.929 -1.143 -2.315 256 HA VAL 37 HA VAL 37 15.248 -3.505 -2.225 257 HB VAL 37 HB VAL 37 18.033 -2.957 -1.124 258 HG11 VAL 37 1HG1 VAL 37 18.289 -5.382 -1.078 259 HG12 VAL 37 2HG1 VAL 37 16.892 -4.890 -0.123 260 HG13 VAL 37 3HG1 VAL 37 16.647 -5.616 -1.705 261 HG21 VAL 37 3HG2 VAL 37 18.235 -2.622 -3.478 262 HG22 VAL 37 1HG2 VAL 37 18.746 -4.306 -3.212 263 HG23 VAL 37 2HG2 VAL 37 17.139 -3.944 -3.846 264 H LEU 38 H LEU 38 13.655 -3.442 -0.783 265 HA LEU 38 HA LEU 38 13.692 -1.964 1.714 266 HB2 LEU 38 1HB LEU 38 11.768 -4.113 0.731 267 HB3 LEU 38 2HB LEU 38 11.502 -3.002 2.073 268 HG LEU 38 HG LEU 38 11.730 -2.271 -0.874 269 HD11 LEU 38 1HD1 LEU 38 9.409 -1.637 -0.660 270 HD12 LEU 38 2HD1 LEU 38 9.392 -2.106 1.062 271 HD13 LEU 38 3HD1 LEU 38 9.613 -3.341 -0.203 272 HD21 LEU 38 3HD2 LEU 38 11.349 -0.459 1.549 273 HD22 LEU 38 1HD2 LEU 38 11.068 0.036 -0.137 274 HD23 LEU 38 2HD2 LEU 38 12.687 -0.431 0.358 275 H LYS 39 H LYS 39 14.994 -2.653 3.336 276 HA LYS 39 HA LYS 39 15.672 -5.468 3.639 277 HB2 LYS 39 1HB LYS 39 16.141 -3.254 5.676 278 HB3 LYS 39 2HB LYS 39 16.956 -4.798 5.579 279 HG2 LYS 39 1HG LYS 39 18.572 -3.578 4.675 280 HG3 LYS 39 2HG LYS 39 17.705 -3.891 3.166 281 HD2 LYS 39 1HD LYS 39 16.581 -1.670 3.362 282 HD3 LYS 39 2HD LYS 39 17.407 -1.373 4.892 283 HE2 LYS 39 1HE LYS 39 18.757 -1.696 2.179 284 HE3 LYS 39 2HE LYS 39 18.395 -0.182 3.006 285 HZ1 LYS 39 3HZ LYS 39 19.799 -1.014 4.854 286 HZ2 LYS 39 1HZ LYS 39 20.594 -0.637 3.476 287 HZ3 LYS 39 2HZ LYS 39 20.342 -2.223 3.841 288 H GLY 40 H GLY 40 15.382 -6.638 5.803 289 HA2 GLY 40 1HA GLY 40 14.033 -7.189 7.675 290 HA3 GLY 40 2HA GLY 40 13.000 -5.817 7.345 291 H ASN 41 H ASN 41 11.422 -7.723 7.870 292 HA ASN 41 HA ASN 41 10.407 -8.719 5.221 293 HB2 ASN 41 1HB ASN 41 11.065 -10.529 6.817 294 HB3 ASN 41 2HB ASN 41 9.876 -9.893 7.961 295 HD21 ASN 41 1HD2 ASN 41 8.065 -11.270 7.932 296 HD22 ASN 41 2HD2 ASN 41 7.458 -12.025 6.472 297 H LYS 42 H LYS 42 9.579 -6.700 7.985 298 HA LYS 42 HA LYS 42 6.702 -6.854 7.368 299 HB2 LYS 42 1HB LYS 42 8.382 -5.159 9.221 300 HB3 LYS 42 2HB LYS 42 6.765 -4.627 8.797 301 HG2 LYS 42 1HG LYS 42 7.286 -7.393 9.948 302 HG3 LYS 42 2HG LYS 42 6.958 -5.968 10.951 303 HD2 LYS 42 1HD LYS 42 4.778 -5.629 9.829 304 HD3 LYS 42 2HD LYS 42 5.088 -6.993 8.753 305 HE2 LYS 42 1HE LYS 42 3.599 -7.741 10.434 306 HE3 LYS 42 2HE LYS 42 5.156 -8.526 10.716 307 HZ1 LYS 42 3HZ LYS 42 4.126 -7.734 12.716 308 HZ2 LYS 42 1HZ LYS 42 4.151 -6.159 12.200 309 HZ3 LYS 42 2HZ LYS 42 5.552 -6.950 12.519 310 H LEU 43 H LEU 43 5.833 -5.912 5.691 311 HA LEU 43 HA LEU 43 7.361 -3.901 4.132 312 HB2 LEU 43 1HB LEU 43 6.741 -6.301 3.254 313 HB3 LEU 43 2HB LEU 43 5.117 -5.678 3.086 314 HG LEU 43 HG LEU 43 7.651 -4.591 1.786 315 HD11 LEU 43 1HD1 LEU 43 6.944 -5.433 -0.247 316 HD12 LEU 43 2HD1 LEU 43 5.256 -5.599 0.246 317 HD13 LEU 43 3HD1 LEU 43 6.469 -6.740 0.848 318 HD21 LEU 43 3HD2 LEU 43 4.833 -3.512 1.851 319 HD22 LEU 43 1HD2 LEU 43 5.864 -3.223 0.459 320 HD23 LEU 43 2HD2 LEU 43 6.391 -2.656 2.059 321 H TYR 44 H TYR 44 6.607 -1.961 4.971 322 HA TYR 44 HA TYR 44 3.770 -1.717 5.723 323 HB2 TYR 44 1HB TYR 44 6.060 0.267 6.061 324 HB3 TYR 44 2HB TYR 44 4.436 0.456 6.644 325 HD1 TYR 44 1HD TYR 44 3.543 -1.871 7.908 326 HD2 TYR 44 2HD TYR 44 7.559 -0.289 7.839 327 HE1 TYR 44 1HE TYR 44 4.036 -3.096 9.989 328 HE2 TYR 44 2HE TYR 44 8.065 -1.450 9.923 329 HH TYR 44 HH TYR 44 7.208 -2.906 11.683 330 H VAL 45 H VAL 45 2.364 -1.063 4.305 331 HA VAL 45 HA VAL 45 3.188 0.621 1.958 332 HB VAL 45 HB VAL 45 0.626 -0.978 2.100 333 HG11 VAL 45 1HG1 VAL 45 0.819 -0.889 -0.298 334 HG12 VAL 45 2HG1 VAL 45 0.919 0.740 0.386 335 HG13 VAL 45 3HG1 VAL 45 2.404 -0.080 -0.148 336 HG21 VAL 45 3HG2 VAL 45 2.461 -2.677 2.456 337 HG22 VAL 45 1HG2 VAL 45 1.706 -2.818 0.877 338 HG23 VAL 45 2HG2 VAL 45 3.289 -2.019 1.031 339 H LYS 46 H LYS 46 2.017 2.541 1.629 340 HA LYS 46 HA LYS 46 -0.004 3.374 3.647 341 HB2 LYS 46 1HB LYS 46 2.109 4.433 4.304 342 HB3 LYS 46 2HB LYS 46 2.486 4.804 2.618 343 HG2 LYS 46 1HG LYS 46 0.217 6.274 2.893 344 HG3 LYS 46 2HG LYS 46 0.640 6.109 4.559 345 HD2 LYS 46 1HD LYS 46 3.093 6.850 3.367 346 HD3 LYS 46 2HD LYS 46 1.860 7.737 2.430 347 HE2 LYS 46 1HE LYS 46 0.848 8.402 4.688 348 HE3 LYS 46 2HE LYS 46 2.278 7.662 5.434 349 HZ1 LYS 46 3HZ LYS 46 2.192 9.958 3.575 350 HZ2 LYS 46 1HZ LYS 46 3.607 9.311 4.076 351 HZ3 LYS 46 2HZ LYS 46 2.531 10.053 5.144 352 H ALA 47 H ALA 47 -1.747 3.109 2.131 353 HA ALA 47 HA ALA 47 -1.167 4.121 -0.623 354 HB1 ALA 47 1HB ALA 47 -2.819 1.726 0.097 355 HB2 ALA 47 2HB ALA 47 -2.340 2.320 -1.526 356 HB3 ALA 47 3HB ALA 47 -1.114 1.682 -0.419 357 H ARG 48 H ARG 48 -2.655 5.166 -1.833 358 HA ARG 48 HA ARG 48 -4.636 6.573 -0.171 359 HB2 ARG 48 1HB ARG 48 -2.982 7.826 -1.432 360 HB3 ARG 48 2HB ARG 48 -3.472 7.071 -2.941 361 HG2 ARG 48 1HG ARG 48 -4.905 8.813 -3.241 362 HG3 ARG 48 2HG ARG 48 -5.889 8.139 -1.945 363 HD2 ARG 48 1HD ARG 48 -5.450 10.395 -1.315 364 HD3 ARG 48 2HD ARG 48 -4.376 9.368 -0.330 365 HE ARG 48 HE ARG 48 -3.166 10.255 -2.786 366 HH11 ARG 48 1HH1 ARG 48 -3.722 11.177 0.565 367 HH12 ARG 48 2HH1 ARG 48 -2.418 12.263 0.671 368 HH21 ARG 48 1HH2 ARG 48 -1.684 12.103 -2.787 369 HH22 ARG 48 2HH2 ARG 48 -1.286 12.840 -1.278 370 H PHE 49 H PHE 49 -6.528 5.625 -0.068 371 HA PHE 49 HA PHE 49 -7.811 4.441 -2.502 372 HB2 PHE 49 1HB PHE 49 -8.664 4.321 0.432 373 HB3 PHE 49 2HB PHE 49 -9.521 3.613 -0.912 374 HD1 PHE 49 2HD PHE 49 -6.282 3.521 0.911 375 HD2 PHE 49 1HD PHE 49 -8.928 1.347 -1.707 376 HE1 PHE 49 2HE PHE 49 -4.860 1.520 1.164 377 HE2 PHE 49 1HE PHE 49 -7.619 -0.702 -1.314 378 HZ PHE 49 HZ PHE 49 -5.567 -0.643 0.089 379 H MET 50 H MET 50 -8.942 6.015 -3.605 380 HA MET 50 HA MET 50 -10.074 8.287 -2.014 381 HB2 MET 50 1HB MET 50 -10.008 8.305 -4.995 382 HB3 MET 50 2HB MET 50 -10.134 9.642 -3.893 383 HG2 MET 50 1HG MET 50 -7.578 8.134 -3.772 384 HG3 MET 50 2HG MET 50 -7.908 8.930 -5.305 385 HE1 MET 50 3HE MET 50 -7.629 11.083 -1.240 386 HE2 MET 50 1HE MET 50 -9.162 10.472 -1.905 387 HE3 MET 50 2HE MET 50 -7.859 9.334 -1.491 388 H GLY 51 H GLY 51 -12.159 8.274 -1.780 389 HA2 GLY 51 1HA GLY 51 -14.449 7.716 -2.208 390 HA3 GLY 51 2HA GLY 51 -13.949 6.516 -3.394 391 H TYR 52 H TYR 52 -15.814 5.993 -1.415 392 HA TYR 52 HA TYR 52 -14.712 4.844 0.970 393 HB2 TYR 52 1HB TYR 52 -17.327 5.443 -0.173 394 HB3 TYR 52 2HB TYR 52 -17.362 3.847 0.482 395 HD1 TYR 52 2HD TYR 52 -16.522 3.464 2.920 396 HD2 TYR 52 1HD TYR 52 -17.452 7.319 1.243 397 HE1 TYR 52 2HE TYR 52 -16.973 4.347 5.185 398 HE2 TYR 52 1HE TYR 52 -17.974 8.194 3.509 399 HH TYR 52 HH TYR 52 -18.587 7.369 5.706 400 H THR 53 H THR 53 -13.864 2.851 1.328 401 HA THR 53 HA THR 53 -15.152 0.608 0.163 402 HB THR 53 HB THR 53 -13.554 0.787 -1.650 403 HG1 THR 53 1HG THR 53 -12.080 -1.026 -0.265 404 HG21 THR 53 3HG2 THR 53 -11.384 1.048 0.484 405 HG22 THR 53 1HG2 THR 53 -11.862 2.264 -0.729 406 HG23 THR 53 2HG2 THR 53 -11.099 0.745 -1.231 407 H LYS 54 H LYS 54 -14.957 -1.141 1.472 408 HA LYS 54 HA LYS 54 -13.051 -1.058 3.730 409 HB2 LYS 54 1HB LYS 54 -16.058 -1.157 3.872 410 HB3 LYS 54 2HB LYS 54 -15.178 -2.124 5.037 411 HG2 LYS 54 1HG LYS 54 -14.312 0.753 4.664 412 HG3 LYS 54 2HG LYS 54 -15.783 0.411 5.545 413 HD2 LYS 54 1HD LYS 54 -14.707 -0.750 7.236 414 HD3 LYS 54 2HD LYS 54 -13.314 -1.149 6.230 415 HE2 LYS 54 1HE LYS 54 -12.314 0.349 7.585 416 HE3 LYS 54 2HE LYS 54 -12.861 1.455 6.307 417 HZ1 LYS 54 3HZ LYS 54 -14.689 2.075 7.701 418 HZ2 LYS 54 1HZ LYS 54 -13.329 2.199 8.622 419 HZ3 LYS 54 2HZ LYS 54 -14.355 0.929 8.808 420 H LEU 55 H LEU 55 -13.370 -2.550 1.029 421 HA LEU 55 HA LEU 55 -13.113 -5.334 2.087 422 HB2 LEU 55 1HB LEU 55 -14.479 -4.324 -0.429 423 HB3 LEU 55 2HB LEU 55 -14.012 -6.008 -0.202 424 HG LEU 55 HG LEU 55 -15.878 -4.522 1.704 425 HD11 LEU 55 1HD1 LEU 55 -16.893 -4.564 -0.505 426 HD12 LEU 55 2HD1 LEU 55 -17.719 -5.704 0.552 427 HD13 LEU 55 3HD1 LEU 55 -16.564 -6.305 -0.667 428 HD21 LEU 55 3HD2 LEU 55 -15.334 -7.505 1.294 429 HD22 LEU 55 1HD2 LEU 55 -16.558 -6.813 2.379 430 HD23 LEU 55 2HD2 LEU 55 -14.852 -6.537 2.704 431 H THR 56 H THR 56 -10.936 -5.626 2.051 432 HA THR 56 HA THR 56 -9.387 -4.550 -0.260 433 HB THR 56 HB THR 56 -8.280 -4.865 2.540 434 HG1 THR 56 1HG THR 56 -9.941 -3.589 2.979 435 HG21 THR 56 3HG2 THR 56 -6.810 -3.043 1.767 436 HG22 THR 56 1HG2 THR 56 -7.692 -2.955 0.232 437 HG23 THR 56 2HG2 THR 56 -6.752 -4.410 0.650 438 H VAL 57 H VAL 57 -8.141 -6.061 -1.359 439 HA VAL 57 HA VAL 57 -7.726 -8.642 0.015 440 HB VAL 57 HB VAL 57 -8.673 -8.555 -2.844 441 HG11 VAL 57 1HG1 VAL 57 -9.347 -10.876 -2.256 442 HG12 VAL 57 2HG1 VAL 57 -7.608 -10.637 -1.952 443 HG13 VAL 57 3HG1 VAL 57 -8.767 -10.645 -0.608 444 HG21 VAL 57 3HG2 VAL 57 -10.528 -7.505 -1.633 445 HG22 VAL 57 1HG2 VAL 57 -10.944 -9.191 -1.955 446 HG23 VAL 57 2HG2 VAL 57 -10.421 -8.725 -0.336 447 H ILE 58 H ILE 58 -5.902 -9.464 -0.115 448 HA ILE 58 HA ILE 58 -3.881 -8.920 -2.192 449 HB ILE 58 HB ILE 58 -3.249 -9.049 0.794 450 HG12 ILE 58 1HG1 ILE 58 -3.237 -6.422 -0.699 451 HG13 ILE 58 2HG1 ILE 58 -4.603 -6.914 0.303 452 HG21 ILE 58 1HG2 ILE 58 -1.071 -8.448 0.200 453 HG22 ILE 58 2HG2 ILE 58 -1.548 -9.695 -0.945 454 HG23 ILE 58 3HG2 ILE 58 -1.546 -7.990 -1.453 455 HD11 ILE 58 3HD1 ILE 58 -1.775 -6.553 1.302 456 HD12 ILE 58 1HD1 ILE 58 -3.159 -5.488 1.621 457 HD13 ILE 58 2HD1 ILE 58 -3.131 -7.130 2.288 458 H THR 59 H THR 59 -4.039 -11.093 -3.027 459 HA THR 59 HA THR 59 -5.221 -13.036 -1.389 460 HB THR 59 HB THR 59 -5.448 -12.306 -3.864 461 HG1 THR 59 1HG THR 59 -6.782 -13.935 -3.281 462 HG21 THR 59 3HG2 THR 59 -4.407 -13.729 -5.486 463 HG22 THR 59 1HG2 THR 59 -3.496 -14.576 -4.236 464 HG23 THR 59 2HG2 THR 59 -3.137 -12.884 -4.564 465 H GLY 60 H GLY 60 -2.161 -12.253 -2.459 466 HA2 GLY 60 1HA GLY 60 0.080 -12.972 -1.728 467 HA3 GLY 60 2HA GLY 60 -0.741 -14.029 -0.572 468 H LYS 61 H LYS 61 1.044 -15.428 -1.260 469 HA LYS 61 HA LYS 61 0.967 -16.727 -3.844 470 HB2 LYS 61 1HB LYS 61 2.504 -18.257 -2.851 471 HB3 LYS 61 2HB LYS 61 2.880 -16.592 -2.350 472 HG2 LYS 61 1HG LYS 61 1.822 -17.042 -0.126 473 HG3 LYS 61 2HG LYS 61 1.538 -18.696 -0.636 474 HD2 LYS 61 1HD LYS 61 3.547 -18.597 0.728 475 HD3 LYS 61 2HD LYS 61 3.902 -19.089 -0.923 476 HE2 LYS 61 1HE LYS 61 4.398 -16.407 -1.142 477 HE3 LYS 61 2HE LYS 61 4.767 -16.627 0.560 478 HZ1 LYS 61 3HZ LYS 61 6.357 -18.279 -0.002 479 HZ2 LYS 61 1HZ LYS 61 6.672 -16.971 -0.969 480 HZ3 LYS 61 2HZ LYS 61 5.930 -18.274 -1.598 481 H ASP 62 H ASP 62 -0.711 -17.159 -0.820 482 HA ASP 62 HA ASP 62 -1.603 -19.808 -1.320 483 HB2 ASP 62 1HB ASP 62 -2.257 -17.578 0.630 484 HB3 ASP 62 2HB ASP 62 -3.265 -19.006 0.620 485 H GLY 63 H GLY 63 -2.747 -16.809 -2.588 486 HA2 GLY 63 1HA GLY 63 -4.576 -16.371 -3.966 487 HA3 GLY 63 2HA GLY 63 -4.919 -18.081 -4.021 488 H LYS 64 H LYS 64 -4.729 -16.339 -0.913 489 HA LYS 64 HA LYS 64 -7.653 -16.294 -0.635 490 HB2 LYS 64 1HB LYS 64 -5.781 -17.700 1.344 491 HB3 LYS 64 2HB LYS 64 -7.519 -17.451 1.526 492 HG2 LYS 64 1HG LYS 64 -7.811 -18.769 -0.655 493 HG3 LYS 64 2HG LYS 64 -6.101 -19.190 -0.515 494 HD2 LYS 64 1HD LYS 64 -6.619 -20.135 1.784 495 HD3 LYS 64 2HD LYS 64 -8.336 -19.992 1.385 496 HE2 LYS 64 1HE LYS 64 -6.263 -21.508 -0.284 497 HE3 LYS 64 2HE LYS 64 -7.264 -22.264 0.939 498 HZ1 LYS 64 3HZ LYS 64 -8.156 -22.574 -1.234 499 HZ2 LYS 64 1HZ LYS 64 -8.198 -20.993 -1.553 500 HZ3 LYS 64 2HZ LYS 64 -9.200 -21.665 -0.379 501 H ASN 65 H ASN 65 -8.271 -14.652 0.727 502 HA ASN 65 HA ASN 65 -6.824 -12.281 0.774 503 HB2 ASN 65 1HB ASN 65 -9.382 -12.843 1.171 504 HB3 ASN 65 2HB ASN 65 -8.922 -13.014 2.861 505 HD21 ASN 65 1HD2 ASN 65 -7.067 -10.253 2.014 506 HD22 ASN 65 2HD2 ASN 65 -8.435 -9.199 2.308 507 H LEU 66 H LEU 66 -4.775 -12.255 1.603 508 HA LEU 66 HA LEU 66 -3.754 -13.456 3.868 509 HB2 LEU 66 1HB LEU 66 -3.058 -10.792 2.595 510 HB3 LEU 66 2HB LEU 66 -2.133 -11.515 3.890 511 HG LEU 66 HG LEU 66 -2.635 -12.779 1.171 512 HD11 LEU 66 1HD1 LEU 66 -0.125 -11.547 2.428 513 HD12 LEU 66 2HD1 LEU 66 -1.084 -10.829 1.127 514 HD13 LEU 66 3HD1 LEU 66 -0.182 -12.326 0.848 515 HD21 LEU 66 3HD2 LEU 66 -0.993 -13.772 3.545 516 HD22 LEU 66 1HD2 LEU 66 -0.809 -14.397 1.900 517 HD23 LEU 66 2HD2 LEU 66 -2.344 -14.608 2.741 518 H LEU 67 H LEU 67 -5.364 -10.332 3.733 519 HA LEU 67 HA LEU 67 -5.034 -9.582 6.442 520 HB2 LEU 67 1HB LEU 67 -7.181 -8.920 4.370 521 HB3 LEU 67 2HB LEU 67 -7.098 -8.132 5.927 522 HG LEU 67 HG LEU 67 -4.705 -8.051 4.073 523 HD11 LEU 67 1HD1 LEU 67 -5.529 -5.856 3.250 524 HD12 LEU 67 2HD1 LEU 67 -7.062 -6.127 4.107 525 HD13 LEU 67 3HD1 LEU 67 -6.597 -7.187 2.762 526 HD21 LEU 67 3HD2 LEU 67 -4.494 -7.367 6.468 527 HD22 LEU 67 1HD2 LEU 67 -5.683 -6.088 6.186 528 HD23 LEU 67 2HD2 LEU 67 -4.118 -6.078 5.321 529 H TYR 68 H TYR 68 -7.030 -12.145 5.171 530 HA TYR 68 HA TYR 68 -8.871 -12.054 7.479 531 HB2 TYR 68 1HB TYR 68 -9.670 -12.269 5.066 532 HB3 TYR 68 2HB TYR 68 -8.932 -13.869 5.067 533 HD1 TYR 68 2HD TYR 68 -11.424 -11.738 6.925 534 HD2 TYR 68 1HD TYR 68 -10.201 -15.745 5.863 535 HE1 TYR 68 2HE TYR 68 -13.512 -12.651 7.891 536 HE2 TYR 68 1HE TYR 68 -12.295 -16.643 6.766 537 HH TYR 68 HH TYR 68 -14.110 -16.103 8.225 538 H ASN 69 H ASN 69 -5.740 -13.066 7.247 539 HA ASN 69 HA ASN 69 -6.373 -15.518 8.817 540 HB2 ASN 69 1HB ASN 69 -4.431 -15.183 6.561 541 HB3 ASN 69 2HB ASN 69 -3.920 -16.103 7.976 542 HD21 ASN 69 1HD2 ASN 69 -4.684 -16.903 5.053 543 HD22 ASN 69 2HD2 ASN 69 -5.672 -18.279 5.378 544 H GLY 70 H GLY 70 -3.205 -13.849 8.360 545 HA2 GLY 70 1HA GLY 70 -3.391 -13.154 11.263 546 HA3 GLY 70 2HA GLY 70 -2.212 -14.288 10.650 547 H THR 71 H THR 71 -1.201 -13.010 8.342 548 HA THR 71 HA THR 71 0.547 -11.430 10.063 549 HB THR 71 HB THR 71 1.181 -11.685 7.158 550 HG1 THR 71 1HG THR 71 0.816 -13.828 8.894 551 HG21 THR 71 3HG2 THR 71 3.429 -12.216 8.024 552 HG22 THR 71 1HG2 THR 71 2.805 -12.157 9.684 553 HG23 THR 71 2HG2 THR 71 2.834 -10.687 8.681 554 H ALA 72 H ALA 72 -1.064 -10.631 6.878 555 HA ALA 72 HA ALA 72 -0.527 -7.790 7.278 556 HB1 ALA 72 1HB ALA 72 -2.043 -7.554 5.341 557 HB2 ALA 72 2HB ALA 72 -0.903 -8.874 5.005 558 HB3 ALA 72 3HB ALA 72 -2.558 -9.252 5.488 559 H LYS 73 H LYS 73 -1.785 -6.415 8.338 560 HA LYS 73 HA LYS 73 -4.624 -6.757 8.642 561 HB2 LYS 73 1HB LYS 73 -4.144 -7.933 10.576 562 HB3 LYS 73 2HB LYS 73 -2.704 -7.008 10.959 563 HG2 LYS 73 1HG LYS 73 -3.894 -5.194 11.794 564 HG3 LYS 73 2HG LYS 73 -5.438 -5.739 11.106 565 HD2 LYS 73 1HD LYS 73 -3.997 -7.463 13.129 566 HD3 LYS 73 2HD LYS 73 -5.032 -6.139 13.669 567 HE2 LYS 73 1HE LYS 73 -6.994 -7.131 12.929 568 HE3 LYS 73 2HE LYS 73 -6.183 -8.075 11.665 569 HZ1 LYS 73 3HZ LYS 73 -6.960 -9.357 13.703 570 HZ2 LYS 73 1HZ LYS 73 -5.732 -8.651 14.509 571 HZ3 LYS 73 2HZ LYS 73 -5.392 -9.583 13.211 572 H MET 74 H MET 74 -5.363 -4.501 9.708 573 HA MET 74 HA MET 74 -3.610 -2.330 8.704 574 HB2 MET 74 1HB MET 74 -5.876 -2.390 7.649 575 HB3 MET 74 2HB MET 74 -6.606 -2.401 9.242 576 HG2 MET 74 1HG MET 74 -4.619 -0.224 8.652 577 HG3 MET 74 2HG MET 74 -6.146 -0.180 7.775 578 HE1 MET 74 3HE MET 74 -8.792 0.114 10.462 579 HE2 MET 74 1HE MET 74 -8.399 0.704 8.834 580 HE3 MET 74 2HE MET 74 -8.229 -1.027 9.205 581 H PHE 75 H PHE 75 -2.839 -0.965 10.214 582 HA PHE 75 HA PHE 75 -3.841 -1.075 13.001 583 HB2 PHE 75 1HB PHE 75 -1.634 -1.212 13.823 584 HB3 PHE 75 2HB PHE 75 -1.868 -2.528 12.694 585 HD1 PHE 75 1HD PHE 75 -0.940 -2.225 10.259 586 HD2 PHE 75 2HD PHE 75 0.244 0.226 13.619 587 HE1 PHE 75 1HE PHE 75 1.075 -1.469 9.020 588 HE2 PHE 75 2HE PHE 75 2.320 0.855 12.385 589 HZ PHE 75 HZ PHE 75 2.728 -0.024 10.125 590 H LYS 76 H LYS 76 -3.845 1.020 10.478 591 HA LYS 76 HA LYS 76 -3.654 3.326 12.163 592 HB2 LYS 76 1HB LYS 76 -1.265 2.978 11.829 593 HB3 LYS 76 2HB LYS 76 -1.467 2.856 10.093 594 HG2 LYS 76 1HG LYS 76 -1.981 5.229 9.932 595 HG3 LYS 76 2HG LYS 76 -2.050 5.379 11.691 596 HD2 LYS 76 1HD LYS 76 0.276 4.968 11.951 597 HD3 LYS 76 2HD LYS 76 0.449 4.283 10.347 598 HE2 LYS 76 1HE LYS 76 1.534 6.465 10.603 599 HE3 LYS 76 2HE LYS 76 0.364 6.426 9.298 600 HZ1 LYS 76 3HZ LYS 76 0.344 8.433 10.758 601 HZ2 LYS 76 1HZ LYS 76 -0.316 7.511 11.944 602 HZ3 LYS 76 2HZ LYS 76 -1.126 7.743 10.525 603 H SER 77 H SER 77 -4.970 4.899 11.268 604 HA SER 77 HA SER 77 -5.773 4.711 8.435 605 HB2 SER 77 1HB SER 77 -8.101 4.423 9.024 606 HB3 SER 77 2HB SER 77 -7.154 3.083 9.657 607 HG SER 77 HG SER 77 -7.875 5.248 11.290 608 H ASP 78 H ASP 78 -5.002 6.776 8.001 609 HA ASP 78 HA ASP 78 -6.010 9.039 9.717 610 HB2 ASP 78 1HB ASP 78 -3.748 8.846 7.696 611 HB3 ASP 78 2HB ASP 78 -4.465 10.376 8.160 612 H ALA 79 H ALA 79 -6.695 10.985 8.412 613 HA ALA 79 HA ALA 79 -8.753 10.176 6.404 614 HB1 ALA 79 1HB ALA 79 -9.560 11.336 8.459 615 HB2 ALA 79 2HB ALA 79 -8.461 12.681 8.124 616 HB3 ALA 79 3HB ALA 79 -9.782 12.360 7.013 617 H ILE 80 H ILE 80 -8.847 11.392 4.382 618 HA ILE 80 HA ILE 80 -6.696 13.363 3.982 619 HB ILE 80 HB ILE 80 -7.525 11.091 2.029 620 HG12 ILE 80 1HG1 ILE 80 -4.994 11.173 3.682 621 HG13 ILE 80 2HG1 ILE 80 -6.320 10.043 3.850 622 HG21 ILE 80 1HG2 ILE 80 -5.205 13.026 1.711 623 HG22 ILE 80 2HG2 ILE 80 -5.743 11.789 0.552 624 HG23 ILE 80 3HG2 ILE 80 -6.764 13.131 0.877 625 HD11 ILE 80 3HD1 ILE 80 -4.660 8.855 2.640 626 HD12 ILE 80 1HD1 ILE 80 -5.894 9.298 1.443 627 HD13 ILE 80 2HD1 ILE 80 -4.353 10.190 1.580 628 H LEU 81 H LEU 81 -7.326 15.075 3.375 629 HA LEU 81 HA LEU 81 -9.930 15.351 2.286 630 HB2 LEU 81 1HB LEU 81 -8.027 17.389 3.462 631 HB3 LEU 81 2HB LEU 81 -9.744 17.496 3.279 632 HG LEU 81 HG LEU 81 -9.345 17.041 5.489 633 HD11 LEU 81 1HD1 LEU 81 -10.546 15.182 6.148 634 HD12 LEU 81 2HD1 LEU 81 -10.021 14.230 4.747 635 HD13 LEU 81 3HD1 LEU 81 -11.157 15.599 4.546 636 HD21 LEU 81 3HD2 LEU 81 -7.517 14.832 5.344 637 HD22 LEU 81 1HD2 LEU 81 -8.056 15.855 6.690 638 HD23 LEU 81 2HD2 LEU 81 -7.098 16.580 5.385 639 H GLY 82 H GLY 82 -10.380 16.823 0.644 640 HA2 GLY 82 1HA GLY 82 -8.526 16.799 -1.574 641 HA3 GLY 82 2HA GLY 82 -10.086 17.662 -1.538 642 H GLN 83 H GLN 83 -9.966 19.503 0.143 643 HA GLN 83 HA GLN 83 -7.547 21.131 0.275 644 HB2 GLN 83 1HB GLN 83 -8.254 21.452 -2.076 645 HB3 GLN 83 2HB GLN 83 -9.908 21.754 -1.563 646 HG2 GLN 83 1HG GLN 83 -8.959 23.831 -0.324 647 HG3 GLN 83 2HG GLN 83 -7.490 23.568 -1.289 648 HE21 GLN 83 1HE2 GLN 83 -7.611 24.046 -3.620 649 HE22 GLN 83 2HE2 GLN 83 -9.157 24.383 -4.388 650 H ASN 84 H ASN 84 -11.115 21.322 0.144 651 HA ASN 84 HA ASN 84 -11.345 23.040 2.458 652 HB2 ASN 84 1HB ASN 84 -13.504 21.644 0.806 653 HB3 ASN 84 2HB ASN 84 -13.745 22.953 1.959 654 HD21 ASN 84 1HD2 ASN 84 -13.127 22.299 -1.395 655 HD22 ASN 84 2HD2 ASN 84 -12.326 23.798 -1.769 656 H LYS 85 H LYS 85 -10.051 20.857 3.465 657 HA LYS 85 HA LYS 85 -10.084 19.014 4.803 658 HB2 LYS 85 1HB LYS 85 -12.437 20.280 6.172 659 HB3 LYS 85 2HB LYS 85 -11.136 19.351 6.893 660 HG2 LYS 85 1HG LYS 85 -9.565 21.135 6.584 661 HG3 LYS 85 2HG LYS 85 -10.743 22.118 5.683 662 HD2 LYS 85 1HD LYS 85 -12.215 22.101 7.724 663 HD3 LYS 85 2HD LYS 85 -10.888 21.365 8.625 664 HE2 LYS 85 1HE LYS 85 -10.842 24.047 7.152 665 HE3 LYS 85 2HE LYS 85 -11.002 23.843 8.895 666 HZ1 LYS 85 3HZ LYS 85 -8.629 23.057 7.302 667 HZ2 LYS 85 1HZ LYS 85 -8.806 22.865 8.930 668 HZ3 LYS 85 2HZ LYS 85 -8.744 24.376 8.252 669 H VAL 86 H VAL 86 -11.509 18.432 2.506 670 HA VAL 86 HA VAL 86 -14.095 17.271 3.251 671 HB VAL 86 HB VAL 86 -14.411 19.081 1.944 672 HG11 VAL 86 1HG1 VAL 86 -13.588 19.247 -0.338 673 HG12 VAL 86 2HG1 VAL 86 -12.300 19.184 0.892 674 HG13 VAL 86 3HG1 VAL 86 -12.664 17.729 -0.073 675 HG21 VAL 86 3HG2 VAL 86 -14.904 16.592 0.253 676 HG22 VAL 86 1HG2 VAL 86 -15.916 17.121 1.610 677 HG23 VAL 86 2HG2 VAL 86 -15.782 18.134 0.164 678 H VAL 87 H VAL 87 -14.316 15.055 3.223 679 HA VAL 87 HA VAL 87 -11.835 13.675 3.070 680 HB VAL 87 HB VAL 87 -14.560 12.476 3.605 681 HG11 VAL 87 1HG1 VAL 87 -13.206 11.003 5.072 682 HG12 VAL 87 2HG1 VAL 87 -12.676 10.873 3.385 683 HG13 VAL 87 3HG1 VAL 87 -11.722 11.816 4.543 684 HG21 VAL 87 3HG2 VAL 87 -14.406 14.426 5.075 685 HG22 VAL 87 1HG2 VAL 87 -14.047 12.977 6.007 686 HG23 VAL 87 2HG2 VAL 87 -12.724 14.019 5.498 687 H ILE 88 H ILE 88 -11.213 13.782 0.900 688 HA ILE 88 HA ILE 88 -12.645 12.501 -1.261 689 HB ILE 88 HB ILE 88 -10.365 12.569 -2.388 690 HG12 ILE 88 1HG1 ILE 88 -9.461 14.223 -0.036 691 HG13 ILE 88 2HG1 ILE 88 -8.986 12.556 -0.269 692 HG21 ILE 88 1HG2 ILE 88 -10.530 15.012 -2.742 693 HG22 ILE 88 2HG2 ILE 88 -12.136 14.294 -2.591 694 HG23 ILE 88 3HG2 ILE 88 -11.447 15.172 -1.216 695 HD11 ILE 88 3HD1 ILE 88 -8.396 14.801 -2.251 696 HD12 ILE 88 1HD1 ILE 88 -7.245 14.076 -1.126 697 HD13 ILE 88 2HD1 ILE 88 -7.941 13.113 -2.443 698 H GLY 89 H GLY 89 -10.507 11.340 1.303 699 HA2 GLY 89 1HA GLY 89 -11.069 8.583 0.738 700 HA3 GLY 89 2HA GLY 89 -9.497 9.075 0.078 701 H TRP 90 H TRP 90 -8.685 7.413 1.671 702 HA TRP 90 HA TRP 90 -8.085 8.717 4.237 703 HB2 TRP 90 1HB TRP 90 -9.308 5.978 3.933 704 HB3 TRP 90 2HB TRP 90 -8.577 6.574 5.428 705 HD1 TRP 90 HD TRP 90 -9.960 8.404 6.774 706 HE1 TRP 90 1HE TRP 90 -12.370 9.371 6.578 707 HE3 TRP 90 3HE TRP 90 -11.314 6.300 2.334 708 HZ2 TRP 90 2HZ TRP 90 -14.658 8.983 4.883 709 HZ3 TRP 90 3HZ TRP 90 -13.584 6.678 1.414 710 HH2 TRP 90 HH TRP 90 -15.247 8.022 2.677 711 H ASP 91 H ASP 91 -6.348 7.614 5.269 712 HA ASP 91 HA ASP 91 -4.371 6.641 3.279 713 HB2 ASP 91 1HB ASP 91 -4.268 8.750 5.005 714 HB3 ASP 91 2HB ASP 91 -3.807 7.476 6.115 715 H LYS 92 H LYS 92 -5.021 4.555 3.222 716 HA LYS 92 HA LYS 92 -5.479 3.014 5.730 717 HB2 LYS 92 1HB LYS 92 -6.137 2.595 2.876 718 HB3 LYS 92 2HB LYS 92 -5.767 1.140 3.771 719 HG2 LYS 92 1HG LYS 92 -8.147 1.537 3.533 720 HG3 LYS 92 2HG LYS 92 -7.640 1.405 5.209 721 HD2 LYS 92 1HD LYS 92 -7.874 3.796 5.552 722 HD3 LYS 92 2HD LYS 92 -8.112 4.066 3.806 723 HE2 LYS 92 1HE LYS 92 -10.239 3.007 3.787 724 HE3 LYS 92 2HE LYS 92 -9.949 2.189 5.327 725 HZ1 LYS 92 3HZ LYS 92 -10.285 4.250 6.477 726 HZ2 LYS 92 1HZ LYS 92 -11.528 4.096 5.422 727 HZ3 LYS 92 2HZ LYS 92 -10.331 5.108 5.076 728 H TYR 93 H TYR 93 -3.634 2.513 6.718 729 HA TYR 93 HA TYR 93 -1.234 1.730 5.199 730 HB2 TYR 93 1HB TYR 93 -1.856 1.977 8.165 731 HB3 TYR 93 2HB TYR 93 -0.281 1.565 7.525 732 HD1 TYR 93 1HD TYR 93 -2.851 4.312 7.542 733 HD2 TYR 93 2HD TYR 93 1.293 3.269 6.972 734 HE1 TYR 93 1HE TYR 93 -2.257 6.703 7.444 735 HE2 TYR 93 2HE TYR 93 1.879 5.662 6.839 736 HH TYR 93 HH TYR 93 -0.518 8.136 6.461 737 H PHE 94 H PHE 94 -0.286 -0.450 5.555 738 HA PHE 94 HA PHE 94 -1.895 -2.407 7.081 739 HB2 PHE 94 1HB PHE 94 -0.999 -2.863 4.207 740 HB3 PHE 94 2HB PHE 94 -1.747 -4.062 5.265 741 HD1 PHE 94 1HD PHE 94 -4.116 -3.881 5.931 742 HD2 PHE 94 2HD PHE 94 -2.364 -1.170 3.075 743 HE1 PHE 94 1HE PHE 94 -6.390 -3.161 5.230 744 HE2 PHE 94 2HE PHE 94 -4.617 -0.449 2.384 745 HZ PHE 94 HZ PHE 94 -6.642 -1.417 3.474 746 H GLU 95 H GLU 95 -0.669 -4.223 7.825 747 HA GLU 95 HA GLU 95 2.248 -3.721 7.901 748 HB2 GLU 95 1HB GLU 95 2.185 -4.673 10.038 749 HB3 GLU 95 2HB GLU 95 0.765 -3.653 9.916 750 HG2 GLU 95 1HG GLU 95 -0.403 -5.904 9.267 751 HG3 GLU 95 2HG GLU 95 0.938 -6.575 10.223 752 H ILE 96 H ILE 96 1.403 -5.024 5.575 753 HA ILE 96 HA ILE 96 1.176 -7.839 5.758 754 HB ILE 96 HB ILE 96 2.174 -6.219 3.406 755 HG12 ILE 96 1HG1 ILE 96 -0.759 -6.776 3.445 756 HG13 ILE 96 2HG1 ILE 96 -0.248 -5.572 4.594 757 HG21 ILE 96 1HG2 ILE 96 0.955 -7.888 1.985 758 HG22 ILE 96 2HG2 ILE 96 2.222 -8.641 2.946 759 HG23 ILE 96 3HG2 ILE 96 0.533 -8.806 3.423 760 HD11 ILE 96 3HD1 ILE 96 -0.843 -4.541 2.447 761 HD12 ILE 96 1HD1 ILE 96 0.855 -4.261 2.866 762 HD13 ILE 96 2HD1 ILE 96 0.433 -5.473 1.637 763 HA PRO 97 HA PRO 97 5.599 -8.990 5.954 764 HB2 PRO 97 1HB PRO 97 5.498 -11.497 4.877 765 HB3 PRO 97 2HB PRO 97 4.965 -11.109 6.544 766 HG2 PRO 97 1HG PRO 97 3.279 -11.294 4.026 767 HG3 PRO 97 2HG PRO 97 2.991 -12.120 5.598 768 HD2 PRO 97 1HD PRO 97 1.732 -9.840 4.987 769 HD3 PRO 97 2HD PRO 97 2.381 -10.023 6.624 770 H MET 98 H MET 98 7.258 -9.811 4.304 771 HA MET 98 HA MET 98 6.644 -9.132 1.461 772 HB2 MET 98 1HB MET 98 9.299 -9.902 2.757 773 HB3 MET 98 2HB MET 98 9.042 -9.476 1.074 774 HG2 MET 98 1HG MET 98 8.391 -7.215 1.688 775 HG3 MET 98 2HG MET 98 8.438 -7.630 3.402 776 HE1 MET 98 3HE MET 98 11.287 -5.148 3.424 777 HE2 MET 98 1HE MET 98 9.694 -5.038 2.622 778 HE3 MET 98 2HE MET 98 9.831 -5.754 4.245 779 H ASP 99 H ASP 99 8.121 -11.773 3.448 780 HA ASP 99 HA ASP 99 8.384 -13.362 1.187 781 HB2 ASP 99 1HB ASP 99 9.645 -13.237 3.464 782 HB3 ASP 99 2HB ASP 99 8.499 -14.466 3.998 783 H ALA 100 H ALA 100 5.507 -13.018 2.835 784 HA ALA 100 HA ALA 100 4.440 -15.718 2.238 785 HB1 ALA 100 1HB ALA 100 3.782 -14.476 4.336 786 HB2 ALA 100 2HB ALA 100 2.893 -13.338 3.286 787 HB3 ALA 100 3HB ALA 100 2.441 -15.044 3.329 788 H LEU 101 H LEU 101 5.055 -12.951 0.383 789 HA LEU 101 HA LEU 101 2.521 -12.843 -1.088 790 HB2 LEU 101 1HB LEU 101 5.268 -11.667 -1.638 791 HB3 LEU 101 2HB LEU 101 3.824 -11.279 -2.551 792 HG LEU 101 HG LEU 101 4.092 -10.739 0.447 793 HD11 LEU 101 1HD1 LEU 101 4.522 -8.909 -1.941 794 HD12 LEU 101 2HD1 LEU 101 5.779 -9.594 -0.892 795 HD13 LEU 101 3HD1 LEU 101 4.617 -8.445 -0.215 796 HD21 LEU 101 3HD2 LEU 101 1.759 -10.910 -0.311 797 HD22 LEU 101 1HD2 LEU 101 2.094 -9.694 -1.564 798 HD23 LEU 101 2HD2 LEU 101 2.207 -9.276 0.162 799 H GLN 102 H GLN 102 2.321 -13.382 -3.402 800 HA GLN 102 HA GLN 102 3.514 -15.831 -4.178 801 HB2 GLN 102 1HB GLN 102 1.220 -14.771 -4.772 802 HB3 GLN 102 2HB GLN 102 2.123 -13.711 -5.825 803 HG2 GLN 102 1HG GLN 102 3.019 -15.817 -6.995 804 HG3 GLN 102 2HG GLN 102 1.925 -16.710 -5.926 805 HE21 GLN 102 1HE2 GLN 102 1.913 -13.940 -8.286 806 HE22 GLN 102 2HE2 GLN 102 0.402 -14.430 -9.048 807 H ASP 103 H ASP 103 4.381 -12.458 -4.603 808 HA ASP 103 HA ASP 103 6.265 -13.041 -6.835 809 HB2 ASP 103 1HB ASP 103 4.350 -10.692 -6.361 810 HB3 ASP 103 2HB ASP 103 5.635 -10.701 -7.550 811 H ASN 104 H ASN 104 8.214 -11.618 -6.669 812 HA ASN 104 HA ASN 104 8.638 -10.215 -4.127 813 HB2 ASN 104 1HB ASN 104 10.282 -10.627 -6.636 814 HB3 ASN 104 2HB ASN 104 10.683 -9.366 -5.493 815 HD21 ASN 104 1HD2 ASN 104 12.706 -10.465 -5.201 816 HD22 ASN 104 2HD2 ASN 104 12.834 -11.777 -4.062 817 H SER 105 H SER 105 6.181 -9.417 -5.364 818 HA SER 105 HA SER 105 6.789 -6.610 -5.659 819 HB2 SER 105 1HB SER 105 5.497 -6.156 -7.620 820 HB3 SER 105 2HB SER 105 6.756 -7.338 -8.015 821 HG SER 105 HG SER 105 5.255 -8.953 -8.031 822 H ILE 106 H ILE 106 5.233 -5.308 -4.944 823 HA ILE 106 HA ILE 106 3.096 -6.569 -3.336 824 HB ILE 106 HB ILE 106 4.700 -4.897 -2.409 825 HG12 ILE 106 1HG1 ILE 106 2.379 -5.344 -1.500 826 HG13 ILE 106 2HG1 ILE 106 3.342 -4.031 -0.866 827 HG21 ILE 106 1HG2 ILE 106 4.482 -2.546 -2.797 828 HG22 ILE 106 2HG2 ILE 106 4.873 -3.370 -4.308 829 HG23 ILE 106 3HG2 ILE 106 3.233 -2.791 -4.029 830 HD11 ILE 106 3HD1 ILE 106 1.158 -3.541 -2.920 831 HD12 ILE 106 1HD1 ILE 106 0.882 -3.524 -1.172 832 HD13 ILE 106 2HD1 ILE 106 2.001 -2.361 -1.916 833 H GLN 107 H GLN 107 0.881 -6.023 -3.705 834 HA GLN 107 HA GLN 107 0.091 -3.897 -5.461 835 HB2 GLN 107 1HB GLN 107 0.130 -5.499 -7.192 836 HB3 GLN 107 2HB GLN 107 -0.428 -6.802 -6.142 837 HG2 GLN 107 1HG GLN 107 -2.690 -5.851 -6.129 838 HG3 GLN 107 2HG GLN 107 -2.151 -4.510 -7.155 839 HE21 GLN 107 1HE2 GLN 107 -2.318 -4.788 -9.364 840 HE22 GLN 107 2HE2 GLN 107 -2.235 -6.360 -10.141 841 H ILE 108 H ILE 108 -2.342 -3.576 -5.006 842 HA ILE 108 HA ILE 108 -3.513 -5.399 -3.056 843 HB ILE 108 HB ILE 108 -3.773 -2.378 -2.704 844 HG12 ILE 108 1HG1 ILE 108 -2.174 -4.396 -1.062 845 HG13 ILE 108 2HG1 ILE 108 -1.556 -3.004 -1.964 846 HG21 ILE 108 1HG2 ILE 108 -5.006 -2.988 -0.611 847 HG22 ILE 108 2HG2 ILE 108 -5.822 -3.540 -2.049 848 HG23 ILE 108 3HG2 ILE 108 -4.885 -4.701 -1.072 849 HD11 ILE 108 3HD1 ILE 108 -2.887 -1.552 -0.368 850 HD12 ILE 108 1HD1 ILE 108 -3.069 -3.005 0.644 851 HD13 ILE 108 2HD1 ILE 108 -1.453 -2.375 0.265 852 H LYS 109 H LYS 109 -5.948 -5.370 -3.395 853 HA LYS 109 HA LYS 109 -6.884 -3.645 -5.543 854 HB2 LYS 109 1HB LYS 109 -8.176 -5.388 -6.664 855 HB3 LYS 109 2HB LYS 109 -6.461 -5.567 -6.864 856 HG2 LYS 109 1HG LYS 109 -7.226 -7.166 -4.574 857 HG3 LYS 109 2HG LYS 109 -8.387 -7.455 -5.848 858 HD2 LYS 109 1HD LYS 109 -6.527 -9.069 -5.956 859 HD3 LYS 109 2HD LYS 109 -6.644 -8.106 -7.398 860 HE2 LYS 109 1HE LYS 109 -4.340 -8.345 -6.886 861 HE3 LYS 109 2HE LYS 109 -4.734 -6.655 -6.595 862 HZ1 LYS 109 3HZ LYS 109 -4.375 -8.853 -4.659 863 HZ2 LYS 109 1HZ LYS 109 -5.022 -7.426 -4.152 864 HZ3 LYS 109 2HZ LYS 109 -3.462 -7.567 -4.756 865 H ALA 110 H ALA 110 -9.241 -3.296 -5.303 866 HA ALA 110 HA ALA 110 -10.447 -4.309 -2.776 867 HB1 ALA 110 1HB ALA 110 -11.026 -1.877 -2.251 868 HB2 ALA 110 2HB ALA 110 -9.327 -2.355 -1.999 869 HB3 ALA 110 3HB ALA 110 -9.786 -1.427 -3.439 870 H LEU 111 H LEU 111 -12.682 -4.211 -2.727 871 HA LEU 111 HA LEU 111 -14.047 -4.073 -5.346 872 HB2 LEU 111 1HB LEU 111 -14.416 -5.965 -3.628 873 HB3 LEU 111 2HB LEU 111 -15.183 -4.758 -2.605 874 HG LEU 111 HG LEU 111 -16.703 -4.264 -4.716 875 HD11 LEU 111 1HD1 LEU 111 -17.001 -6.230 -6.172 876 HD12 LEU 111 2HD1 LEU 111 -15.730 -7.097 -5.297 877 HD13 LEU 111 3HD1 LEU 111 -15.339 -5.670 -6.267 878 HD21 LEU 111 3HD2 LEU 111 -17.608 -5.210 -2.676 879 HD22 LEU 111 1HD2 LEU 111 -16.958 -6.824 -3.074 880 HD23 LEU 111 2HD2 LEU 111 -18.256 -6.093 -4.047 881 H SER 112 H SER 112 -15.006 -2.165 -5.964 882 HA SER 112 HA SER 112 -14.945 0.035 -4.108 883 HB2 SER 112 1HB SER 112 -15.939 1.359 -5.958 884 HB3 SER 112 2HB SER 112 -14.455 0.510 -6.359 885 HG SER 112 HG SER 112 -16.080 0.474 -7.945 886 H SER 113 H SER 113 -17.792 -1.467 -5.710 887 HA SER 113 HA SER 113 -19.102 -1.624 -3.107 888 HB2 SER 113 1HB SER 113 -20.108 0.285 -5.224 889 HB3 SER 113 2HB SER 113 -21.280 -0.655 -4.282 890 HG SER 113 HG SER 113 -20.636 1.461 -3.437 891 H GLY 114 H GLY 114 -19.772 -1.906 -6.630 892 HA2 GLY 114 1HA GLY 114 -21.652 -4.115 -6.229 893 HA3 GLY 114 2HA GLY 114 -21.277 -3.274 -7.728 894 H THR 115 H THR 115 -20.372 -4.711 -9.187 895 HA THR 115 HA THR 115 -18.883 -7.032 -8.311 896 HB THR 115 HB THR 115 -18.611 -7.178 -10.890 897 HG1 THR 115 1HG THR 115 -19.949 -5.823 -12.045 898 HG21 THR 115 3HG2 THR 115 -20.909 -7.943 -11.192 899 HG22 THR 115 1HG2 THR 115 -21.450 -7.038 -9.770 900 HG23 THR 115 2HG2 THR 115 -20.350 -8.410 -9.571 901 H THR 116 H THR 116 -18.144 -3.832 -9.522 902 HA THR 116 HA THR 116 -15.716 -4.181 -10.694 903 HB THR 116 HB THR 116 -16.817 -1.740 -9.242 904 HG1 THR 116 1HG THR 116 -17.252 -2.755 -11.850 905 HG21 THR 116 3HG2 THR 116 -15.671 -0.371 -10.854 906 HG22 THR 116 1HG2 THR 116 -14.919 -1.820 -11.594 907 HG23 THR 116 2HG2 THR 116 -14.522 -1.327 -9.927 908 H PHE 117 H PHE 117 -13.684 -4.217 -10.162 909 HA PHE 117 HA PHE 117 -12.841 -4.044 -7.332 910 HB2 PHE 117 1HB PHE 117 -13.175 -6.312 -8.986 911 HB3 PHE 117 2HB PHE 117 -11.440 -6.020 -8.993 912 HD1 PHE 117 1HD PHE 117 -10.455 -5.431 -6.528 913 HD2 PHE 117 2HD PHE 117 -14.022 -7.663 -7.357 914 HE1 PHE 117 1HE PHE 117 -10.325 -6.481 -4.251 915 HE2 PHE 117 2HE PHE 117 -13.920 -8.688 -5.099 916 HZ PHE 117 HZ PHE 117 -12.098 -8.072 -3.535 917 H VAL 118 H VAL 118 -11.308 -2.469 -7.181 918 HA VAL 118 HA VAL 118 -9.971 -1.526 -9.658 919 HB VAL 118 HB VAL 118 -9.932 -0.288 -6.881 920 HG11 VAL 118 1HG1 VAL 118 -9.283 0.815 -9.646 921 HG12 VAL 118 2HG1 VAL 118 -9.250 1.745 -8.135 922 HG13 VAL 118 3HG1 VAL 118 -8.105 0.417 -8.390 923 HG21 VAL 118 3HG2 VAL 118 -11.624 1.339 -7.790 924 HG22 VAL 118 1HG2 VAL 118 -11.825 0.284 -9.206 925 HG23 VAL 118 2HG2 VAL 118 -12.275 -0.287 -7.584 926 H TYR 119 H TYR 119 -7.928 -2.181 -10.045 927 HA TYR 119 HA TYR 119 -6.382 -3.589 -7.931 928 HB2 TYR 119 1HB TYR 119 -6.118 -3.620 -10.962 929 HB3 TYR 119 2HB TYR 119 -5.097 -4.495 -9.846 930 HD1 TYR 119 1HD TYR 119 -8.706 -4.183 -10.945 931 HD2 TYR 119 2HD TYR 119 -5.638 -6.711 -9.269 932 HE1 TYR 119 1HE TYR 119 -10.234 -6.077 -11.063 933 HE2 TYR 119 2HE TYR 119 -7.172 -8.668 -9.488 934 HH TYR 119 HH TYR 119 -10.561 -8.318 -10.575 935 H SER 120 H SER 120 -4.499 -2.663 -7.162 936 HA SER 120 HA SER 120 -3.605 -0.067 -8.097 937 HB2 SER 120 1HB SER 120 -2.005 -0.243 -6.418 938 HB3 SER 120 2HB SER 120 -3.226 -1.273 -5.740 939 HG SER 120 HG SER 120 -0.944 -2.232 -7.104 940 H GLN 121 H GLN 121 -1.289 0.149 -8.898 941 HA GLN 121 HA GLN 121 -0.594 -1.542 -11.103 942 HB2 GLN 121 1HB GLN 121 1.493 -0.246 -11.088 943 HB3 GLN 121 2HB GLN 121 0.104 0.819 -11.027 944 HG2 GLN 121 1HG GLN 121 1.572 0.018 -8.481 945 HG3 GLN 121 2HG GLN 121 2.253 1.188 -9.608 946 HE21 GLN 121 1HE2 GLN 121 2.231 2.876 -8.109 947 HE22 GLN 121 2HE2 GLN 121 0.781 3.738 -7.779 948 H LYS 122 H LYS 122 1.589 -2.573 -11.225 949 HA LYS 122 HA LYS 122 2.303 -4.293 -8.925 950 HB2 LYS 122 1HB LYS 122 2.148 -5.064 -11.364 951 HB3 LYS 122 2HB LYS 122 3.454 -3.969 -11.760 952 HG2 LYS 122 1HG LYS 122 4.260 -5.674 -9.527 953 HG3 LYS 122 2HG LYS 122 3.618 -6.667 -10.837 954 HD2 LYS 122 1HD LYS 122 5.178 -5.545 -12.437 955 HD3 LYS 122 2HD LYS 122 5.893 -4.653 -11.070 956 HE2 LYS 122 1HE LYS 122 6.494 -6.809 -9.992 957 HE3 LYS 122 2HE LYS 122 5.737 -7.697 -11.314 958 HZ1 LYS 122 3HZ LYS 122 7.429 -6.806 -12.801 959 HZ2 LYS 122 1HZ LYS 122 8.121 -7.573 -11.520 960 HZ3 LYS 122 2HZ LYS 122 8.136 -5.958 -11.592 961 H ILE 123 H ILE 123 4.102 -3.877 -7.659 962 HA ILE 123 HA ILE 123 6.251 -2.176 -8.711 963 HB ILE 123 HB ILE 123 5.073 -1.847 -5.930 964 HG12 ILE 123 1HG1 ILE 123 3.541 -0.743 -7.574 965 HG13 ILE 123 2HG1 ILE 123 4.204 0.288 -6.320 966 HG21 ILE 123 1HG2 ILE 123 7.540 -1.417 -6.093 967 HG22 ILE 123 2HG2 ILE 123 7.240 -0.311 -7.425 968 HG23 ILE 123 3HG2 ILE 123 6.696 0.114 -5.810 969 HD11 ILE 123 3HD1 ILE 123 4.124 1.368 -8.538 970 HD12 ILE 123 1HD1 ILE 123 5.757 1.289 -7.888 971 HD13 ILE 123 2HD1 ILE 123 5.273 0.148 -9.144 972 H ASP 124 H ASP 124 7.743 -3.529 -8.893 973 HA ASP 124 HA ASP 124 8.042 -5.887 -7.191 974 HB2 ASP 124 1HB ASP 124 8.463 -5.449 -9.723 975 HB3 ASP 124 2HB ASP 124 10.034 -4.927 -9.192 976 H PHE 125 H PHE 125 10.128 -6.400 -6.216 977 HA PHE 125 HA PHE 125 11.844 -4.225 -5.286 978 HB2 PHE 125 1HB PHE 125 11.273 -4.259 -2.942 979 HB3 PHE 125 2HB PHE 125 9.867 -3.838 -3.875 980 HD1 PHE 125 2HD PHE 125 7.941 -5.434 -4.126 981 HD2 PHE 125 1HD PHE 125 11.270 -6.189 -1.483 982 HE1 PHE 125 2HE PHE 125 6.604 -7.156 -2.911 983 HE2 PHE 125 1HE PHE 125 9.915 -7.874 -0.292 984 HZ PHE 125 HZ PHE 125 7.622 -8.390 -1.017 985 H GLU 126 H GLU 126 13.203 -5.180 -3.200 986 HA GLU 126 HA GLU 126 13.930 -8.004 -3.570 987 HB2 GLU 126 1HB GLU 126 15.744 -5.600 -3.806 988 HB3 GLU 126 2HB GLU 126 16.365 -7.203 -3.372 989 HG2 GLU 126 1HG GLU 126 15.866 -8.100 -5.508 990 HG3 GLU 126 2HG GLU 126 14.742 -6.796 -5.896 991 H ARG 127 H ARG 127 15.055 -8.743 -1.521 992 HA ARG 127 HA ARG 127 13.975 -7.198 0.771 993 HB2 ARG 127 1HB ARG 127 14.133 -10.189 0.841 994 HB3 ARG 127 2HB ARG 127 13.405 -9.071 1.951 995 HG2 ARG 127 1HG ARG 127 11.506 -9.770 0.924 996 HG3 ARG 127 2HG ARG 127 11.911 -8.418 -0.138 997 HD2 ARG 127 1HD ARG 127 11.240 -10.474 -1.397 998 HD3 ARG 127 2HD ARG 127 12.877 -9.931 -1.769 999 HE ARG 127 HE ARG 127 13.794 -11.667 -0.518 1000 HH11 ARG 127 1HH1 ARG 127 10.175 -12.082 -0.552 1001 HH12 ARG 127 2HH1 ARG 127 10.327 -13.681 0.161 1002 HH21 ARG 127 1HH2 ARG 127 13.773 -13.817 0.405 1003 HH22 ARG 127 2HH2 ARG 127 12.269 -14.583 0.733 1004 H GLU 128 H GLU 128 15.873 -6.207 1.076 1005 HA GLU 128 HA GLU 128 18.056 -5.724 1.414 1006 HB2 GLU 128 1HB GLU 128 19.243 -6.596 3.250 1007 HB3 GLU 128 2HB GLU 128 17.592 -6.215 3.631 1008 HG2 GLU 128 1HG GLU 128 17.062 -8.692 3.404 1009 HG3 GLU 128 2HG GLU 128 18.824 -8.903 3.295
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