NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
17854 | 2d85 | 11133 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 14.657 -0.313 -7.226 2 HA2 GLY 1 1HA GLY 1 16.220 -2.360 -6.930 3 HA3 GLY 1 2HA GLY 1 17.440 -1.221 -7.479 4 H SER 2 H SER 2 17.556 -2.539 -5.007 5 HA SER 2 HA SER 2 16.639 -0.730 -2.955 6 HB2 SER 2 1HB SER 2 17.768 -2.278 -1.403 7 HB3 SER 2 2HB SER 2 16.711 -3.143 -2.519 8 HG SER 2 HG SER 2 18.501 -3.778 -3.688 9 H SER 3 H SER 3 18.244 0.616 -4.765 10 HA SER 3 HA SER 3 20.959 0.778 -4.012 11 HB2 SER 3 1HB SER 3 19.154 2.773 -5.394 12 HB3 SER 3 2HB SER 3 20.894 2.995 -5.201 13 HG SER 3 HG SER 3 20.387 2.055 -7.217 14 H GLY 4 H GLY 4 21.643 1.309 -2.044 15 HA2 GLY 4 1HA GLY 4 21.882 3.517 -0.749 16 HA3 GLY 4 2HA GLY 4 20.146 3.348 -0.533 17 H SER 5 H SER 5 19.831 2.871 1.544 18 HA SER 5 HA SER 5 21.529 0.797 2.765 19 HB2 SER 5 1HB SER 5 20.198 3.238 3.881 20 HB3 SER 5 2HB SER 5 20.497 1.860 4.938 21 HG SER 5 HG SER 5 22.191 3.627 4.610 22 H SER 6 H SER 6 20.365 -1.005 2.155 23 HA SER 6 HA SER 6 17.538 -1.204 2.416 24 HB2 SER 6 1HB SER 6 19.084 -2.586 0.898 25 HB3 SER 6 2HB SER 6 19.427 -3.553 2.333 26 HG SER 6 HG SER 6 17.186 -3.979 2.485 27 H GLY 7 H GLY 7 16.741 -0.872 4.427 28 HA2 GLY 7 1HA GLY 7 16.490 -2.790 6.305 29 HA3 GLY 7 2HA GLY 7 18.012 -2.035 6.753 30 H ASN 8 H ASN 8 17.612 0.592 6.377 31 HA ASN 8 HA ASN 8 16.432 1.533 8.619 32 HB2 ASN 8 1HB ASN 8 17.708 2.770 6.686 33 HB3 ASN 8 2HB ASN 8 16.084 3.141 6.116 34 HD21 ASN 8 1HD2 ASN 8 18.573 4.214 7.970 35 HD22 ASN 8 2HD2 ASN 8 17.720 5.323 8.985 36 H ASP 9 H ASP 9 14.430 2.791 8.954 37 HA ASP 9 HA ASP 9 12.153 1.293 7.946 38 HB2 ASP 9 1HB ASP 9 12.639 3.161 10.218 39 HB3 ASP 9 2HB ASP 9 10.994 3.022 9.605 40 H ASP 10 H ASP 10 13.812 4.095 7.132 41 HA ASP 10 HA ASP 10 11.576 5.663 6.244 42 HB2 ASP 10 1HB ASP 10 14.553 5.885 5.792 43 HB3 ASP 10 2HB ASP 10 13.394 7.013 5.093 44 H ILE 11 H ILE 11 13.271 2.998 5.014 45 HA ILE 11 HA ILE 11 13.060 3.540 2.231 46 HB ILE 11 HB ILE 11 14.569 1.813 3.329 47 HG12 ILE 11 1HG1 ILE 11 12.940 0.632 1.092 48 HG13 ILE 11 2HG1 ILE 11 13.942 2.055 0.831 49 HG21 ILE 11 1HG2 ILE 11 12.708 -0.356 3.016 50 HG22 ILE 11 2HG2 ILE 11 13.713 0.068 4.402 51 HG23 ILE 11 3HG2 ILE 11 12.119 0.797 4.212 52 HD11 ILE 11 1HD1 ILE 11 15.466 0.042 2.169 53 HD12 ILE 11 2HD1 ILE 11 14.709 -0.632 0.725 54 HD13 ILE 11 3HD1 ILE 11 15.738 0.794 0.599 55 H ILE 12 H ILE 12 10.834 2.446 4.617 56 HA ILE 12 HA ILE 12 9.036 0.931 3.162 57 HB ILE 12 HB ILE 12 8.294 2.972 5.260 58 HG12 ILE 12 1HG1 ILE 12 9.153 0.087 5.566 59 HG13 ILE 12 2HG1 ILE 12 10.069 1.500 6.077 60 HG21 ILE 12 1HG2 ILE 12 6.250 2.005 5.397 61 HG22 ILE 12 2HG2 ILE 12 6.592 1.614 3.713 62 HG23 ILE 12 3HG2 ILE 12 6.857 0.405 4.968 63 HD11 ILE 12 1HD1 ILE 12 8.854 1.770 7.947 64 HD12 ILE 12 2HD1 ILE 12 7.349 1.276 7.171 65 HD13 ILE 12 3HD1 ILE 12 8.505 0.058 7.708 66 H VAL 13 H VAL 13 9.539 4.392 3.159 67 HA VAL 13 HA VAL 13 7.165 4.893 1.565 68 HB VAL 13 HB VAL 13 9.370 6.813 2.327 69 HG11 VAL 13 1HG1 VAL 13 6.701 7.121 1.014 70 HG12 VAL 13 2HG1 VAL 13 7.377 8.438 1.974 71 HG13 VAL 13 3HG1 VAL 13 8.254 7.827 0.571 72 HG21 VAL 13 1HG2 VAL 13 6.682 6.559 3.652 73 HG22 VAL 13 2HG2 VAL 13 8.110 5.704 4.238 74 HG23 VAL 13 3HG2 VAL 13 8.093 7.468 4.197 75 H ASN 14 H ASN 14 10.685 5.289 1.159 76 HA ASN 14 HA ASN 14 10.762 6.136 -1.453 77 HB2 ASN 14 1HB ASN 14 12.774 6.016 -0.111 78 HB3 ASN 14 2HB ASN 14 12.660 4.261 -0.028 79 HD21 ASN 14 1HD2 ASN 14 13.500 6.991 -1.979 80 HD22 ASN 14 2HD2 ASN 14 14.275 6.110 -3.246 81 H TRP 15 H TRP 15 10.744 2.769 -0.304 82 HA TRP 15 HA TRP 15 10.879 1.473 -2.742 83 HB2 TRP 15 1HB TRP 15 10.983 0.356 -0.525 84 HB3 TRP 15 2HB TRP 15 9.249 0.604 -0.347 85 HD1 TRP 15 HD TRP 15 11.625 -1.139 -2.883 86 HE1 TRP 15 1HE TRP 15 10.463 -3.285 -3.701 87 HE3 TRP 15 3HE TRP 15 7.200 -0.675 -0.366 88 HZ2 TRP 15 2HZ TRP 15 7.995 -4.606 -3.329 89 HZ3 TRP 15 3HZ TRP 15 5.491 -2.422 -0.652 90 HH2 TRP 15 HH TRP 15 5.882 -4.346 -2.104 91 H VAL 16 H VAL 16 7.927 2.388 -0.962 92 HA VAL 16 HA VAL 16 6.022 1.521 -2.743 93 HB VAL 16 HB VAL 16 5.911 4.091 -1.156 94 HG11 VAL 16 1HG1 VAL 16 4.110 4.208 -2.619 95 HG12 VAL 16 2HG1 VAL 16 3.841 2.465 -2.584 96 HG13 VAL 16 3HG1 VAL 16 3.408 3.453 -1.188 97 HG21 VAL 16 1HG2 VAL 16 6.389 1.746 -0.039 98 HG22 VAL 16 2HG2 VAL 16 5.289 2.908 0.700 99 HG23 VAL 16 3HG2 VAL 16 4.646 1.561 -0.238 100 H ASN 17 H ASN 17 7.756 4.618 -2.774 101 HA ASN 17 HA ASN 17 6.420 5.707 -5.005 102 HB2 ASN 17 1HB ASN 17 8.966 6.297 -3.561 103 HB3 ASN 17 2HB ASN 17 8.716 7.028 -5.143 104 HD21 ASN 17 1HD2 ASN 17 7.623 6.867 -1.851 105 HD22 ASN 17 2HD2 ASN 17 6.634 8.283 -1.897 106 H GLU 18 H GLU 18 9.669 4.243 -4.796 107 HA GLU 18 HA GLU 18 10.275 4.252 -7.496 108 HB2 GLU 18 1HB GLU 18 11.142 2.616 -5.168 109 HB3 GLU 18 2HB GLU 18 11.556 2.025 -6.771 110 HG2 GLU 18 1HG GLU 18 12.181 4.824 -5.890 111 HG3 GLU 18 2HG GLU 18 13.269 3.471 -5.584 112 H THR 19 H THR 19 8.991 1.474 -5.660 113 HA THR 19 HA THR 19 8.588 -0.341 -7.619 114 HB THR 19 HB THR 19 6.755 0.328 -5.320 115 HG1 THR 19 1HG THR 19 8.333 -1.994 -5.602 116 HG21 THR 19 1HG2 THR 19 6.010 -2.143 -5.793 117 HG22 THR 19 2HG2 THR 19 6.507 -1.760 -7.442 118 HG23 THR 19 3HG2 THR 19 5.252 -0.804 -6.655 119 H LEU 20 H LEU 20 6.470 2.408 -6.909 120 HA LEU 20 HA LEU 20 4.563 1.752 -8.932 121 HB2 LEU 20 1HB LEU 20 5.080 4.298 -7.409 122 HB3 LEU 20 2HB LEU 20 3.731 4.069 -8.519 123 HG LEU 20 HG LEU 20 4.097 2.235 -6.179 124 HD11 LEU 20 1HD1 LEU 20 3.286 3.687 -4.661 125 HD12 LEU 20 2HD1 LEU 20 2.282 4.530 -5.840 126 HD13 LEU 20 3HD1 LEU 20 4.005 4.888 -5.735 127 HD21 LEU 20 1HD2 LEU 20 2.411 1.399 -7.479 128 HD22 LEU 20 2HD2 LEU 20 1.933 2.986 -8.081 129 HD23 LEU 20 3HD2 LEU 20 1.488 2.491 -6.447 130 H ARG 21 H ARG 21 7.335 3.931 -8.728 131 HA ARG 21 HA ARG 21 6.973 5.277 -11.155 132 HB2 ARG 21 1HB ARG 21 8.641 5.747 -9.245 133 HB3 ARG 21 2HB ARG 21 9.683 4.583 -10.052 134 HG2 ARG 21 1HG ARG 21 10.199 6.914 -10.645 135 HG3 ARG 21 2HG ARG 21 9.739 5.937 -12.040 136 HD2 ARG 21 1HD ARG 21 7.652 6.962 -12.219 137 HD3 ARG 21 2HD ARG 21 7.705 7.569 -10.565 138 HE ARG 21 HE ARG 21 9.781 8.691 -12.151 139 HH11 ARG 21 1HH1 ARG 21 6.368 8.890 -11.495 140 HH12 ARG 21 2HH1 ARG 21 6.244 10.555 -11.957 141 HH21 ARG 21 1HH2 ARG 21 9.630 10.883 -12.762 142 HH22 ARG 21 2HH2 ARG 21 8.100 11.688 -12.678 143 H GLU 22 H GLU 22 8.908 2.377 -10.430 144 HA GLU 22 HA GLU 22 9.796 1.936 -13.062 145 HB2 GLU 22 1HB GLU 22 10.509 -0.215 -12.315 146 HB3 GLU 22 2HB GLU 22 10.746 0.901 -10.977 147 HG2 GLU 22 1HG GLU 22 8.996 0.013 -9.751 148 HG3 GLU 22 2HG GLU 22 8.240 -0.712 -11.170 149 H ALA 23 H ALA 23 6.789 1.279 -11.493 150 HA ALA 23 HA ALA 23 5.918 -0.583 -13.554 151 HB1 ALA 23 1HB ALA 23 4.542 0.483 -11.094 152 HB2 ALA 23 2HB ALA 23 3.809 -0.652 -12.229 153 HB3 ALA 23 3HB ALA 23 5.246 -1.119 -11.319 154 H GLU 24 H GLU 24 6.036 2.735 -13.126 155 HA GLU 24 HA GLU 24 5.221 4.468 -14.364 156 HB2 GLU 24 1HB GLU 24 3.668 2.531 -16.058 157 HB3 GLU 24 2HB GLU 24 4.345 4.089 -16.511 158 HG2 GLU 24 1HG GLU 24 6.213 1.942 -15.666 159 HG3 GLU 24 2HG GLU 24 5.455 1.820 -17.253 160 H LYS 25 H LYS 25 3.940 3.811 -12.024 161 HA LYS 25 HA LYS 25 1.072 3.909 -12.566 162 HB2 LYS 25 1HB LYS 25 2.760 3.273 -10.206 163 HB3 LYS 25 2HB LYS 25 1.185 3.986 -9.890 164 HG2 LYS 25 1HG LYS 25 1.267 1.481 -9.870 165 HG3 LYS 25 2HG LYS 25 0.056 2.193 -10.940 166 HD2 LYS 25 1HD LYS 25 1.842 1.978 -12.773 167 HD3 LYS 25 2HD LYS 25 2.666 0.890 -11.652 168 HE2 LYS 25 1HE LYS 25 1.407 -0.610 -12.843 169 HE3 LYS 25 2HE LYS 25 0.300 -0.244 -11.520 170 HZ1 LYS 25 1HZ LYS 25 -0.405 -0.135 -14.068 171 HZ2 LYS 25 2HZ LYS 25 0.115 1.461 -13.870 172 HZ3 LYS 25 3HZ LYS 25 -1.110 0.843 -12.881 173 H SER 26 H SER 26 -0.255 5.483 -11.343 174 HA SER 26 HA SER 26 1.075 8.105 -11.322 175 HB2 SER 26 1HB SER 26 -1.784 7.285 -11.820 176 HB3 SER 26 2HB SER 26 -1.342 8.956 -11.472 177 HG SER 26 HG SER 26 0.303 8.413 -13.289 178 H SER 27 H SER 27 0.680 5.924 -9.152 179 HA SER 27 HA SER 27 -0.539 7.663 -7.113 180 HB2 SER 27 1HB SER 27 -0.153 4.661 -7.141 181 HB3 SER 27 2HB SER 27 -0.779 5.570 -5.766 182 HG SER 27 HG SER 27 -1.939 5.566 -8.356 183 H SER 28 H SER 28 0.493 7.895 -5.087 184 HA SER 28 HA SER 28 3.015 6.764 -4.477 185 HB2 SER 28 1HB SER 28 4.434 8.740 -4.738 186 HB3 SER 28 2HB SER 28 3.752 8.270 -6.295 187 HG SER 28 HG SER 28 3.591 10.522 -5.940 188 H ILE 29 H ILE 29 4.087 8.068 -2.624 189 HA ILE 29 HA ILE 29 2.087 9.481 -1.014 190 HB ILE 29 HB ILE 29 2.969 8.155 1.001 191 HG12 ILE 29 1HG1 ILE 29 3.468 5.970 -0.987 192 HG13 ILE 29 2HG1 ILE 29 4.763 7.095 -0.598 193 HG21 ILE 29 1HG2 ILE 29 0.819 7.585 0.758 194 HG22 ILE 29 2HG2 ILE 29 0.952 7.464 -0.995 195 HG23 ILE 29 3HG2 ILE 29 1.442 6.110 0.021 196 HD11 ILE 29 1HD1 ILE 29 3.722 4.861 0.920 197 HD12 ILE 29 2HD1 ILE 29 5.250 5.727 1.077 198 HD13 ILE 29 3HD1 ILE 29 3.802 6.344 1.871 199 H SER 30 H SER 30 3.011 10.667 0.791 200 HA SER 30 HA SER 30 5.758 11.527 0.200 201 HB2 SER 30 1HB SER 30 3.441 12.939 1.527 202 HB3 SER 30 2HB SER 30 5.088 13.569 1.567 203 HG SER 30 HG SER 30 4.044 12.836 -0.913 204 H SER 31 H SER 31 3.643 10.354 2.729 205 HA SER 31 HA SER 31 5.842 9.422 4.283 206 HB2 SER 31 1HB SER 31 4.476 11.959 5.070 207 HB3 SER 31 2HB SER 31 4.947 10.833 6.343 208 HG SER 31 HG SER 31 6.598 12.118 4.438 209 H PHE 32 H PHE 32 4.987 8.605 6.499 210 HA PHE 32 HA PHE 32 3.031 6.693 6.046 211 HB2 PHE 32 1HB PHE 32 4.160 7.871 8.574 212 HB3 PHE 32 2HB PHE 32 2.915 6.627 8.626 213 HD1 PHE 32 2HD PHE 32 3.393 4.430 7.415 214 HD2 PHE 32 1HD PHE 32 6.397 7.296 8.348 215 HE1 PHE 32 2HE PHE 32 5.119 2.692 7.179 216 HE2 PHE 32 1HE PHE 32 8.129 5.564 8.113 217 HZ PHE 32 HZ PHE 32 7.491 3.258 7.529 218 H LYS 33 H LYS 33 2.674 10.019 6.710 219 HA LYS 33 HA LYS 33 -0.185 9.639 7.311 220 HB2 LYS 33 1HB LYS 33 1.677 11.901 8.042 221 HB3 LYS 33 2HB LYS 33 -0.068 11.978 8.243 222 HG2 LYS 33 1HG LYS 33 -0.065 10.333 9.906 223 HG3 LYS 33 2HG LYS 33 1.562 9.791 9.488 224 HD2 LYS 33 1HD LYS 33 2.570 11.580 10.544 225 HD3 LYS 33 2HD LYS 33 1.137 12.603 10.408 226 HE2 LYS 33 1HE LYS 33 0.095 10.773 11.987 227 HE3 LYS 33 2HE LYS 33 1.783 10.481 12.399 228 HZ1 LYS 33 1HZ LYS 33 0.143 12.438 13.427 229 HZ2 LYS 33 2HZ LYS 33 1.209 13.260 12.403 230 HZ3 LYS 33 3HZ LYS 33 1.813 12.292 13.652 231 H ASP 34 H ASP 34 0.500 9.417 4.703 232 HA ASP 34 HA ASP 34 0.286 11.976 3.378 233 HB2 ASP 34 1HB ASP 34 1.629 10.457 2.197 234 HB3 ASP 34 2HB ASP 34 0.497 9.129 2.438 235 HA PRO 35 HA PRO 35 -4.113 12.125 3.219 236 HB2 PRO 35 1HB PRO 35 -4.389 13.824 1.120 237 HB3 PRO 35 2HB PRO 35 -3.865 14.354 2.723 238 HG2 PRO 35 1HG PRO 35 -2.222 13.765 0.291 239 HG3 PRO 35 2HG PRO 35 -2.075 15.106 1.441 240 HD2 PRO 35 1HD PRO 35 -0.467 12.929 1.530 241 HD3 PRO 35 2HD PRO 35 -0.946 13.822 2.988 242 H LYS 36 H LYS 36 -2.406 11.710 0.124 243 HA LYS 36 HA LYS 36 -4.480 10.786 -1.442 244 HB2 LYS 36 1HB LYS 36 -1.625 9.793 -1.497 245 HB3 LYS 36 2HB LYS 36 -2.788 9.679 -2.811 246 HG2 LYS 36 1HG LYS 36 -1.824 12.278 -1.642 247 HG3 LYS 36 2HG LYS 36 -1.114 11.503 -3.060 248 HD2 LYS 36 1HD LYS 36 -3.416 11.550 -4.091 249 HD3 LYS 36 2HD LYS 36 -3.911 12.577 -2.744 250 HE2 LYS 36 1HE LYS 36 -2.249 14.233 -3.365 251 HE3 LYS 36 2HE LYS 36 -1.667 13.192 -4.664 252 HZ1 LYS 36 1HZ LYS 36 -3.066 14.617 -5.769 253 HZ2 LYS 36 2HZ LYS 36 -4.174 14.719 -4.495 254 HZ3 LYS 36 3HZ LYS 36 -4.113 13.326 -5.453 255 H ILE 37 H ILE 37 -2.791 9.166 1.120 256 HA ILE 37 HA ILE 37 -3.360 6.499 0.510 257 HB ILE 37 HB ILE 37 -2.970 7.906 3.141 258 HG12 ILE 37 1HG1 ILE 37 -1.288 5.915 1.603 259 HG13 ILE 37 2HG1 ILE 37 -1.015 7.653 1.663 260 HG21 ILE 37 1HG2 ILE 37 -2.642 5.371 3.868 261 HG22 ILE 37 2HG2 ILE 37 -4.200 6.190 3.981 262 HG23 ILE 37 3HG2 ILE 37 -3.859 5.128 2.615 263 HD11 ILE 37 1HD1 ILE 37 0.430 7.093 3.281 264 HD12 ILE 37 2HD1 ILE 37 -1.015 7.071 4.291 265 HD13 ILE 37 3HD1 ILE 37 -0.381 5.566 3.626 266 H SER 38 H SER 38 -5.361 9.019 1.855 267 HA SER 38 HA SER 38 -7.385 7.573 3.056 268 HB2 SER 38 1HB SER 38 -7.233 10.221 1.704 269 HB3 SER 38 2HB SER 38 -8.839 9.565 2.016 270 HG SER 38 HG SER 38 -8.400 9.527 4.181 271 H THR 39 H THR 39 -6.746 8.089 -0.345 272 HA THR 39 HA THR 39 -9.245 6.815 -1.128 273 HB THR 39 HB THR 39 -8.378 7.201 -3.470 274 HG1 THR 39 1HG THR 39 -6.138 7.717 -2.147 275 HG21 THR 39 1HG2 THR 39 -9.152 9.381 -3.517 276 HG22 THR 39 2HG2 THR 39 -8.375 9.799 -1.990 277 HG23 THR 39 3HG2 THR 39 -9.826 8.798 -1.996 278 H SER 40 H SER 40 -6.157 5.858 -0.283 279 HA SER 40 HA SER 40 -5.087 3.849 -0.345 280 HB2 SER 40 1HB SER 40 -7.474 2.679 -1.768 281 HB3 SER 40 2HB SER 40 -6.327 1.865 -0.703 282 HG SER 40 HG SER 40 -8.568 3.337 -0.088 283 H LEU 41 H LEU 41 -5.030 5.799 -2.573 284 HA LEU 41 HA LEU 41 -4.874 4.406 -5.038 285 HB2 LEU 41 1HB LEU 41 -3.973 7.070 -4.046 286 HB3 LEU 41 2HB LEU 41 -3.379 6.484 -5.600 287 HG LEU 41 HG LEU 41 -6.290 6.848 -4.894 288 HD11 LEU 41 1HD1 LEU 41 -4.333 8.611 -6.332 289 HD12 LEU 41 2HD1 LEU 41 -5.397 9.015 -4.985 290 HD13 LEU 41 3HD1 LEU 41 -6.073 8.731 -6.589 291 HD21 LEU 41 1HD2 LEU 41 -5.902 5.123 -6.570 292 HD22 LEU 41 2HD2 LEU 41 -4.921 6.245 -7.514 293 HD23 LEU 41 3HD2 LEU 41 -6.645 6.549 -7.295 294 HA PRO 42 HA PRO 42 -0.103 4.433 -4.190 295 HB2 PRO 42 1HB PRO 42 0.672 4.899 -1.630 296 HB3 PRO 42 2HB PRO 42 0.475 6.188 -2.824 297 HG2 PRO 42 1HG PRO 42 -1.403 5.299 -0.668 298 HG3 PRO 42 2HG PRO 42 -0.972 6.945 -1.168 299 HD2 PRO 42 1HD PRO 42 -3.270 5.743 -1.944 300 HD3 PRO 42 2HD PRO 42 -2.411 6.912 -2.967 301 H VAL 43 H VAL 43 -2.373 3.238 -1.819 302 HA VAL 43 HA VAL 43 -0.698 1.000 -1.061 303 HB VAL 43 HB VAL 43 -3.614 1.252 -0.390 304 HG11 VAL 43 1HG1 VAL 43 -2.555 0.280 1.801 305 HG12 VAL 43 2HG1 VAL 43 -2.868 -0.767 0.416 306 HG13 VAL 43 3HG1 VAL 43 -1.238 -0.168 0.717 307 HG21 VAL 43 1HG2 VAL 43 -3.278 3.153 0.708 308 HG22 VAL 43 2HG2 VAL 43 -2.099 2.327 1.727 309 HG23 VAL 43 3HG2 VAL 43 -1.573 3.149 0.258 310 H LEU 44 H LEU 44 -3.336 1.671 -3.240 311 HA LEU 44 HA LEU 44 -3.890 -1.112 -3.772 312 HB2 LEU 44 1HB LEU 44 -4.872 1.482 -4.912 313 HB3 LEU 44 2HB LEU 44 -5.266 -0.058 -5.671 314 HG LEU 44 HG LEU 44 -5.915 0.533 -2.795 315 HD11 LEU 44 1HD1 LEU 44 -8.008 1.363 -3.372 316 HD12 LEU 44 2HD1 LEU 44 -7.890 0.782 -5.033 317 HD13 LEU 44 3HD1 LEU 44 -6.925 2.162 -4.512 318 HD21 LEU 44 1HD2 LEU 44 -7.123 -1.415 -4.753 319 HD22 LEU 44 2HD2 LEU 44 -7.461 -1.287 -3.026 320 HD23 LEU 44 3HD2 LEU 44 -5.875 -1.826 -3.576 321 H ASP 45 H ASP 45 -2.479 1.603 -5.590 322 HA ASP 45 HA ASP 45 -1.795 0.120 -7.880 323 HB2 ASP 45 1HB ASP 45 -0.672 2.678 -6.735 324 HB3 ASP 45 2HB ASP 45 -0.158 2.013 -8.283 325 H LEU 46 H LEU 46 -0.123 0.677 -4.846 326 HA LEU 46 HA LEU 46 2.437 -0.162 -5.519 327 HB2 LEU 46 1HB LEU 46 2.146 0.805 -3.405 328 HB3 LEU 46 2HB LEU 46 0.852 -0.314 -2.978 329 HG LEU 46 HG LEU 46 2.443 -2.109 -2.691 330 HD11 LEU 46 1HD1 LEU 46 4.064 -0.559 -4.377 331 HD12 LEU 46 2HD1 LEU 46 4.431 -2.132 -3.668 332 HD13 LEU 46 3HD1 LEU 46 4.905 -0.654 -2.829 333 HD21 LEU 46 1HD2 LEU 46 3.359 0.410 -1.306 334 HD22 LEU 46 2HD2 LEU 46 3.697 -1.241 -0.783 335 HD23 LEU 46 3HD2 LEU 46 2.038 -0.638 -0.786 336 H ILE 47 H ILE 47 -0.365 -2.078 -4.508 337 HA ILE 47 HA ILE 47 0.968 -4.571 -4.449 338 HB ILE 47 HB ILE 47 -1.965 -4.000 -4.895 339 HG12 ILE 47 1HG1 ILE 47 -0.692 -4.892 -2.321 340 HG13 ILE 47 2HG1 ILE 47 -0.769 -3.185 -2.743 341 HG21 ILE 47 1HG2 ILE 47 -1.142 -6.275 -5.589 342 HG22 ILE 47 2HG2 ILE 47 -0.714 -6.549 -3.899 343 HG23 ILE 47 3HG2 ILE 47 -2.397 -6.268 -4.349 344 HD11 ILE 47 1HD1 ILE 47 -3.322 -4.544 -3.036 345 HD12 ILE 47 2HD1 ILE 47 -2.684 -4.594 -1.392 346 HD13 ILE 47 3HD1 ILE 47 -2.919 -3.044 -2.201 347 H ASP 48 H ASP 48 -1.200 -3.156 -6.901 348 HA ASP 48 HA ASP 48 -1.009 -5.168 -8.801 349 HB2 ASP 48 1HB ASP 48 -2.602 -3.276 -8.915 350 HB3 ASP 48 2HB ASP 48 -1.270 -2.200 -9.326 351 H ALA 49 H ALA 49 1.089 -2.367 -8.285 352 HA ALA 49 HA ALA 49 2.704 -2.500 -10.507 353 HB1 ALA 49 1HB ALA 49 2.773 -0.794 -8.650 354 HB2 ALA 49 2HB ALA 49 3.760 -1.942 -7.745 355 HB3 ALA 49 3HB ALA 49 4.339 -1.301 -9.282 356 H ILE 50 H ILE 50 2.652 -4.604 -7.722 357 HA ILE 50 HA ILE 50 5.099 -5.955 -8.550 358 HB ILE 50 HB ILE 50 3.300 -6.728 -6.259 359 HG12 ILE 50 1HG1 ILE 50 5.732 -4.953 -6.062 360 HG13 ILE 50 2HG1 ILE 50 4.099 -4.307 -6.197 361 HG21 ILE 50 1HG2 ILE 50 6.262 -7.143 -6.539 362 HG22 ILE 50 2HG2 ILE 50 5.143 -7.932 -5.429 363 HG23 ILE 50 3HG2 ILE 50 5.083 -8.302 -7.153 364 HD11 ILE 50 1HD1 ILE 50 3.468 -5.340 -4.125 365 HD12 ILE 50 2HD1 ILE 50 5.029 -6.154 -4.014 366 HD13 ILE 50 3HD1 ILE 50 4.940 -4.399 -3.881 367 H GLN 51 H GLN 51 1.638 -6.624 -8.194 368 HA GLN 51 HA GLN 51 1.995 -8.944 -9.969 369 HB2 GLN 51 1HB GLN 51 1.577 -9.573 -7.559 370 HB3 GLN 51 2HB GLN 51 -0.006 -8.825 -7.713 371 HG2 GLN 51 1HG GLN 51 -0.641 -10.401 -9.416 372 HG3 GLN 51 2HG GLN 51 0.979 -11.098 -9.419 373 HE21 GLN 51 1HE2 GLN 51 1.702 -11.856 -7.187 374 HE22 GLN 51 2HE2 GLN 51 0.539 -12.754 -6.279 375 HA PRO 52 HA PRO 52 -0.965 -6.181 -12.051 376 HB2 PRO 52 1HB PRO 52 -0.394 -7.109 -14.537 377 HB3 PRO 52 2HB PRO 52 0.582 -5.881 -13.723 378 HG2 PRO 52 1HG PRO 52 1.068 -8.824 -13.980 379 HG3 PRO 52 2HG PRO 52 2.215 -7.482 -14.147 380 HD2 PRO 52 1HD PRO 52 2.033 -8.970 -11.892 381 HD3 PRO 52 2HD PRO 52 2.469 -7.249 -11.867 382 H GLY 53 H GLY 53 -3.057 -6.680 -12.227 383 HA2 GLY 53 1HA GLY 53 -4.648 -8.100 -13.547 384 HA3 GLY 53 2HA GLY 53 -3.765 -9.471 -12.894 385 H SER 54 H SER 54 -3.496 -8.076 -10.265 386 HA SER 54 HA SER 54 -5.849 -9.143 -9.070 387 HB2 SER 54 1HB SER 54 -3.412 -7.720 -8.085 388 HB3 SER 54 2HB SER 54 -4.813 -7.823 -7.018 389 HG SER 54 HG SER 54 -4.011 -10.162 -8.296 390 H ILE 55 H ILE 55 -4.569 -5.826 -8.799 391 HA ILE 55 HA ILE 55 -7.096 -4.749 -8.062 392 HB ILE 55 HB ILE 55 -4.728 -3.203 -9.110 393 HG12 ILE 55 1HG1 ILE 55 -4.234 -4.838 -7.201 394 HG13 ILE 55 2HG1 ILE 55 -3.804 -3.151 -6.937 395 HG21 ILE 55 1HG2 ILE 55 -7.306 -2.502 -7.963 396 HG22 ILE 55 2HG2 ILE 55 -5.954 -1.760 -7.111 397 HG23 ILE 55 3HG2 ILE 55 -6.150 -1.504 -8.844 398 HD11 ILE 55 1HD1 ILE 55 -4.975 -4.455 -5.057 399 HD12 ILE 55 2HD1 ILE 55 -5.526 -2.820 -5.428 400 HD13 ILE 55 3HD1 ILE 55 -6.438 -4.213 -6.011 401 H ASN 56 H ASN 56 -8.730 -4.107 -9.298 402 HA ASN 56 HA ASN 56 -8.218 -3.635 -12.162 403 HB2 ASN 56 1HB ASN 56 -9.604 -5.728 -11.369 404 HB3 ASN 56 2HB ASN 56 -10.898 -4.548 -11.188 405 HD21 ASN 56 1HD2 ASN 56 -12.153 -5.328 -12.825 406 HD22 ASN 56 2HD2 ASN 56 -11.708 -5.231 -14.492 407 H TYR 57 H TYR 57 -8.044 -1.416 -12.023 408 HA TYR 57 HA TYR 57 -9.401 0.403 -10.553 409 HB2 TYR 57 1HB TYR 57 -8.300 0.459 -13.316 410 HB3 TYR 57 2HB TYR 57 -9.339 1.796 -12.832 411 HD1 TYR 57 1HD TYR 57 -6.967 -0.082 -10.681 412 HD2 TYR 57 2HD TYR 57 -7.797 3.567 -12.705 413 HE1 TYR 57 1HE TYR 57 -5.062 0.976 -9.541 414 HE2 TYR 57 2HE TYR 57 -5.894 4.636 -11.570 415 HH TYR 57 HH TYR 57 -3.742 3.903 -10.499 416 H ASP 58 H ASP 58 -10.657 -1.439 -13.238 417 HA ASP 58 HA ASP 58 -12.917 -0.019 -13.927 418 HB2 ASP 58 1HB ASP 58 -11.954 -2.313 -14.787 419 HB3 ASP 58 2HB ASP 58 -13.108 -2.992 -13.642 420 H LEU 59 H LEU 59 -12.494 -2.294 -11.244 421 HA LEU 59 HA LEU 59 -15.206 -1.918 -10.327 422 HB2 LEU 59 1HB LEU 59 -13.014 -3.212 -8.749 423 HB3 LEU 59 2HB LEU 59 -14.746 -3.530 -8.699 424 HG LEU 59 HG LEU 59 -12.891 -4.281 -10.959 425 HD11 LEU 59 1HD1 LEU 59 -12.326 -5.757 -9.274 426 HD12 LEU 59 2HD1 LEU 59 -13.619 -6.619 -10.106 427 HD13 LEU 59 3HD1 LEU 59 -13.954 -5.772 -8.596 428 HD21 LEU 59 1HD2 LEU 59 -15.246 -5.746 -11.107 429 HD22 LEU 59 2HD2 LEU 59 -14.759 -4.417 -12.159 430 HD23 LEU 59 3HD2 LEU 59 -15.770 -4.102 -10.749 431 H LEU 60 H LEU 60 -12.021 -0.695 -9.572 432 HA LEU 60 HA LEU 60 -12.631 0.456 -7.064 433 HB2 LEU 60 1HB LEU 60 -10.592 1.492 -9.015 434 HB3 LEU 60 2HB LEU 60 -10.579 1.627 -7.257 435 HG LEU 60 HG LEU 60 -10.157 -0.898 -8.856 436 HD11 LEU 60 1HD1 LEU 60 -7.982 -0.462 -8.805 437 HD12 LEU 60 2HD1 LEU 60 -8.033 -0.101 -7.080 438 HD13 LEU 60 3HD1 LEU 60 -8.384 1.165 -8.256 439 HD21 LEU 60 1HD2 LEU 60 -10.618 -0.377 -5.974 440 HD22 LEU 60 2HD2 LEU 60 -9.388 -1.565 -6.403 441 HD23 LEU 60 3HD2 LEU 60 -11.050 -1.776 -6.958 442 H LYS 61 H LYS 61 -12.386 2.932 -6.773 443 HA LYS 61 HA LYS 61 -14.258 4.225 -8.644 444 HB2 LYS 61 1HB LYS 61 -13.892 4.378 -5.692 445 HB3 LYS 61 2HB LYS 61 -14.406 5.840 -6.525 446 HG2 LYS 61 1HG LYS 61 -16.439 4.959 -6.044 447 HG3 LYS 61 2HG LYS 61 -16.159 4.176 -7.600 448 HD2 LYS 61 1HD LYS 61 -15.057 2.309 -6.159 449 HD3 LYS 61 2HD LYS 61 -15.985 3.030 -4.842 450 HE2 LYS 61 1HE LYS 61 -18.038 2.591 -5.917 451 HE3 LYS 61 2HE LYS 61 -17.247 2.239 -7.452 452 HZ1 LYS 61 1HZ LYS 61 -17.704 0.522 -5.181 453 HZ2 LYS 61 2HZ LYS 61 -16.136 0.424 -5.809 454 HZ3 LYS 61 3HZ LYS 61 -17.468 0.125 -6.809 455 H THR 62 H THR 62 -11.725 5.234 -6.339 456 HA THR 62 HA THR 62 -10.243 6.979 -6.427 457 HB THR 62 HB THR 62 -9.043 5.320 -7.747 458 HG1 THR 62 1HG THR 62 -8.465 7.746 -7.661 459 HG21 THR 62 1HG2 THR 62 -10.617 4.832 -9.486 460 HG22 THR 62 2HG2 THR 62 -9.153 5.456 -10.247 461 HG23 THR 62 3HG2 THR 62 -10.566 6.495 -10.071 462 H GLU 63 H GLU 63 -12.966 7.682 -7.153 463 HA GLU 63 HA GLU 63 -12.367 10.159 -8.569 464 HB2 GLU 63 1HB GLU 63 -14.300 9.940 -10.051 465 HB3 GLU 63 2HB GLU 63 -13.145 8.644 -10.326 466 HG2 GLU 63 1HG GLU 63 -14.642 7.317 -8.670 467 HG3 GLU 63 2HG GLU 63 -15.851 8.531 -9.080 468 H ASN 64 H ASN 64 -13.019 11.714 -7.251 469 HA ASN 64 HA ASN 64 -14.100 12.752 -5.511 470 HB2 ASN 64 1HB ASN 64 -16.475 13.134 -5.969 471 HB3 ASN 64 2HB ASN 64 -15.531 13.250 -7.451 472 HD21 ASN 64 1HD2 ASN 64 -15.811 11.746 -9.055 473 HD22 ASN 64 2HD2 ASN 64 -17.094 10.590 -9.047 474 H LEU 65 H LEU 65 -13.328 10.233 -4.701 475 HA LEU 65 HA LEU 65 -15.227 8.492 -3.732 476 HB2 LEU 65 1HB LEU 65 -12.537 9.314 -2.707 477 HB3 LEU 65 2HB LEU 65 -13.519 8.152 -1.818 478 HG LEU 65 HG LEU 65 -12.960 7.646 -4.703 479 HD11 LEU 65 1HD1 LEU 65 -10.870 6.513 -4.113 480 HD12 LEU 65 2HD1 LEU 65 -11.000 7.136 -2.469 481 HD13 LEU 65 3HD1 LEU 65 -10.780 8.250 -3.818 482 HD21 LEU 65 1HD2 LEU 65 -14.162 6.276 -2.546 483 HD22 LEU 65 2HD2 LEU 65 -12.674 5.416 -2.946 484 HD23 LEU 65 3HD2 LEU 65 -13.892 5.700 -4.191 485 H ASN 66 H ASN 66 -15.528 8.176 -1.216 486 HA ASN 66 HA ASN 66 -15.892 10.570 0.311 487 HB2 ASN 66 1HB ASN 66 -18.463 9.967 0.515 488 HB3 ASN 66 2HB ASN 66 -17.877 11.036 -0.757 489 HD21 ASN 66 1HD2 ASN 66 -19.525 8.183 -0.036 490 HD22 ASN 66 2HD2 ASN 66 -19.689 7.579 -1.647 491 H ASP 67 H ASP 67 -17.000 10.084 2.424 492 HA ASP 67 HA ASP 67 -15.778 8.205 3.898 493 HB2 ASP 67 1HB ASP 67 -17.481 9.964 4.650 494 HB3 ASP 67 2HB ASP 67 -18.711 8.743 4.334 495 H ASP 68 H ASP 68 -18.521 7.650 1.788 496 HA ASP 68 HA ASP 68 -18.930 4.940 2.659 497 HB2 ASP 68 1HB ASP 68 -19.944 6.227 0.120 498 HB3 ASP 68 2HB ASP 68 -20.604 4.815 0.942 499 H GLU 69 H GLU 69 -18.020 6.256 -0.533 500 HA GLU 69 HA GLU 69 -17.111 3.867 -1.622 501 HB2 GLU 69 1HB GLU 69 -16.110 6.656 -2.224 502 HB3 GLU 69 2HB GLU 69 -15.907 5.247 -3.255 503 HG2 GLU 69 1HG GLU 69 -18.640 6.139 -2.451 504 HG3 GLU 69 2HG GLU 69 -17.784 6.948 -3.763 505 H LYS 70 H LYS 70 -15.136 6.476 -0.201 506 HA LYS 70 HA LYS 70 -12.637 5.531 -0.361 507 HB2 LYS 70 1HB LYS 70 -13.901 6.649 2.148 508 HB3 LYS 70 2HB LYS 70 -12.170 6.525 1.865 509 HG2 LYS 70 1HG LYS 70 -12.359 8.048 -0.029 510 HG3 LYS 70 2HG LYS 70 -14.102 8.162 0.234 511 HD2 LYS 70 1HD LYS 70 -13.406 10.034 1.353 512 HD3 LYS 70 2HD LYS 70 -13.342 8.854 2.664 513 HE2 LYS 70 1HE LYS 70 -10.907 8.495 1.981 514 HE3 LYS 70 2HE LYS 70 -11.079 9.972 1.035 515 HZ1 LYS 70 1HZ LYS 70 -10.508 11.008 2.906 516 HZ2 LYS 70 2HZ LYS 70 -10.779 9.644 3.869 517 HZ3 LYS 70 3HZ LYS 70 -12.067 10.662 3.464 518 H LEU 71 H LEU 71 -15.030 4.397 2.000 519 HA LEU 71 HA LEU 71 -13.395 2.605 3.384 520 HB2 LEU 71 1HB LEU 71 -15.492 3.146 4.314 521 HB3 LEU 71 2HB LEU 71 -16.350 2.657 2.854 522 HG LEU 71 HG LEU 71 -15.837 0.314 3.336 523 HD11 LEU 71 1HD1 LEU 71 -13.733 0.566 4.490 524 HD12 LEU 71 2HD1 LEU 71 -14.875 -0.288 5.525 525 HD13 LEU 71 3HD1 LEU 71 -14.527 1.416 5.817 526 HD21 LEU 71 1HD2 LEU 71 -17.232 1.972 5.403 527 HD22 LEU 71 2HD2 LEU 71 -17.124 0.221 5.573 528 HD23 LEU 71 3HD2 LEU 71 -17.919 0.923 4.163 529 H ASN 72 H ASN 72 -15.825 1.740 0.916 530 HA ASN 72 HA ASN 72 -15.289 -0.869 0.519 531 HB2 ASN 72 1HB ASN 72 -15.695 1.121 -1.725 532 HB3 ASN 72 2HB ASN 72 -16.005 -0.611 -1.805 533 HD21 ASN 72 1HD2 ASN 72 -17.014 2.405 -0.336 534 HD22 ASN 72 2HD2 ASN 72 -18.618 1.897 0.055 535 H ASN 73 H ASN 73 -13.343 1.821 -0.664 536 HA ASN 73 HA ASN 73 -11.582 0.286 -2.260 537 HB2 ASN 73 1HB ASN 73 -11.430 3.022 -1.023 538 HB3 ASN 73 2HB ASN 73 -10.043 2.337 -1.863 539 HD21 ASN 73 1HD2 ASN 73 -10.416 4.270 -3.209 540 HD22 ASN 73 2HD2 ASN 73 -11.519 4.137 -4.532 541 H ALA 74 H ALA 74 -11.428 1.398 1.100 542 HA ALA 74 HA ALA 74 -8.839 0.453 1.666 543 HB1 ALA 74 1HB ALA 74 -9.706 1.993 3.192 544 HB2 ALA 74 2HB ALA 74 -11.210 1.093 3.387 545 HB3 ALA 74 3HB ALA 74 -9.712 0.466 4.076 546 H LYS 75 H LYS 75 -12.024 -1.060 2.028 547 HA LYS 75 HA LYS 75 -11.133 -3.427 3.268 548 HB2 LYS 75 1HB LYS 75 -13.545 -3.139 1.473 549 HB3 LYS 75 2HB LYS 75 -13.298 -4.338 2.735 550 HG2 LYS 75 1HG LYS 75 -13.223 -2.418 4.371 551 HG3 LYS 75 2HG LYS 75 -13.793 -1.394 3.052 552 HD2 LYS 75 1HD LYS 75 -15.211 -3.880 4.000 553 HD3 LYS 75 2HD LYS 75 -15.602 -2.248 4.546 554 HE2 LYS 75 1HE LYS 75 -16.368 -1.600 2.436 555 HE3 LYS 75 2HE LYS 75 -15.550 -2.937 1.628 556 HZ1 LYS 75 1HZ LYS 75 -17.989 -3.049 3.305 557 HZ2 LYS 75 2HZ LYS 75 -17.114 -4.432 2.879 558 HZ3 LYS 75 3HZ LYS 75 -17.825 -3.478 1.676 559 H TYR 76 H TYR 76 -11.519 -2.523 -0.119 560 HA TYR 76 HA TYR 76 -11.052 -5.086 -1.211 561 HB2 TYR 76 1HB TYR 76 -12.057 -3.109 -2.413 562 HB3 TYR 76 2HB TYR 76 -10.434 -2.438 -2.528 563 HD1 TYR 76 1HD TYR 76 -12.309 -5.567 -3.335 564 HD2 TYR 76 2HD TYR 76 -9.181 -2.894 -4.418 565 HE1 TYR 76 1HE TYR 76 -11.932 -6.854 -5.396 566 HE2 TYR 76 2HE TYR 76 -8.796 -4.174 -6.484 567 HH TYR 76 HH TYR 76 -10.316 -5.755 -7.980 568 H ALA 77 H ALA 77 -8.883 -2.286 -0.817 569 HA ALA 77 HA ALA 77 -6.555 -3.296 -1.834 570 HB1 ALA 77 1HB ALA 77 -5.839 -1.934 0.541 571 HB2 ALA 77 2HB ALA 77 -5.844 -1.323 -1.114 572 HB3 ALA 77 3HB ALA 77 -7.283 -1.155 -0.106 573 H ILE 78 H ILE 78 -7.487 -3.509 1.607 574 HA ILE 78 HA ILE 78 -5.414 -5.163 2.435 575 HB ILE 78 HB ILE 78 -8.235 -5.077 3.513 576 HG12 ILE 78 1HG1 ILE 78 -5.746 -3.564 4.333 577 HG13 ILE 78 2HG1 ILE 78 -7.141 -2.881 3.508 578 HG21 ILE 78 1HG2 ILE 78 -6.334 -6.937 4.098 579 HG22 ILE 78 2HG2 ILE 78 -6.025 -5.712 5.327 580 HG23 ILE 78 3HG2 ILE 78 -7.626 -6.438 5.189 581 HD11 ILE 78 1HD1 ILE 78 -8.473 -3.702 5.548 582 HD12 ILE 78 2HD1 ILE 78 -6.897 -3.819 6.332 583 HD13 ILE 78 3HD1 ILE 78 -7.461 -2.267 5.713 584 H SER 79 H SER 79 -8.563 -5.997 1.066 585 HA SER 79 HA SER 79 -8.574 -8.731 1.486 586 HB2 SER 79 1HB SER 79 -10.449 -7.384 0.510 587 HB3 SER 79 2HB SER 79 -9.567 -7.349 -1.016 588 HG SER 79 HG SER 79 -10.415 -9.694 0.344 589 H MET 80 H MET 80 -7.232 -6.955 -1.291 590 HA MET 80 HA MET 80 -6.282 -9.155 -2.718 591 HB2 MET 80 1HB MET 80 -5.602 -6.255 -2.631 592 HB3 MET 80 2HB MET 80 -4.499 -7.335 -3.471 593 HG2 MET 80 1HG MET 80 -6.315 -6.193 -4.839 594 HG3 MET 80 2HG MET 80 -6.090 -7.926 -5.059 595 HE1 MET 80 1HE MET 80 -8.692 -9.632 -4.711 596 HE2 MET 80 2HE MET 80 -9.519 -8.400 -5.664 597 HE3 MET 80 3HE MET 80 -7.808 -8.729 -5.941 598 H ALA 81 H ALA 81 -4.661 -7.165 -0.264 599 HA ALA 81 HA ALA 81 -2.122 -8.067 -0.271 600 HB1 ALA 81 1HB ALA 81 -2.881 -8.171 2.447 601 HB2 ALA 81 2HB ALA 81 -2.097 -6.850 1.581 602 HB3 ALA 81 3HB ALA 81 -3.857 -6.921 1.678 603 H ARG 82 H ARG 82 -4.646 -9.678 1.678 604 HA ARG 82 HA ARG 82 -3.140 -11.923 2.351 605 HB2 ARG 82 1HB ARG 82 -5.387 -11.155 3.303 606 HB3 ARG 82 2HB ARG 82 -6.124 -11.978 1.934 607 HG2 ARG 82 1HG ARG 82 -4.206 -13.467 3.661 608 HG3 ARG 82 2HG ARG 82 -5.853 -13.187 4.230 609 HD2 ARG 82 1HD ARG 82 -6.585 -14.111 1.951 610 HD3 ARG 82 2HD ARG 82 -4.931 -14.706 1.812 611 HE ARG 82 HE ARG 82 -6.089 -15.482 4.283 612 HH11 ARG 82 1HH1 ARG 82 -6.092 -16.210 0.880 613 HH12 ARG 82 2HH1 ARG 82 -6.541 -17.868 1.102 614 HH21 ARG 82 1HH2 ARG 82 -6.680 -17.663 4.589 615 HH22 ARG 82 2HH2 ARG 82 -6.875 -18.693 3.212 616 H LYS 83 H LYS 83 -5.207 -11.310 -0.444 617 HA LYS 83 HA LYS 83 -5.375 -13.820 -1.558 618 HB2 LYS 83 1HB LYS 83 -6.234 -11.443 -2.352 619 HB3 LYS 83 2HB LYS 83 -4.800 -11.514 -3.367 620 HG2 LYS 83 1HG LYS 83 -6.461 -12.372 -4.728 621 HG3 LYS 83 2HG LYS 83 -5.681 -13.820 -4.088 622 HD2 LYS 83 1HD LYS 83 -7.956 -14.277 -3.858 623 HD3 LYS 83 2HD LYS 83 -7.484 -13.719 -2.251 624 HE2 LYS 83 1HE LYS 83 -8.352 -11.504 -2.744 625 HE3 LYS 83 2HE LYS 83 -8.758 -12.006 -4.384 626 HZ1 LYS 83 1HZ LYS 83 -10.298 -13.638 -3.435 627 HZ2 LYS 83 2HZ LYS 83 -10.708 -12.057 -2.999 628 HZ3 LYS 83 3HZ LYS 83 -9.947 -13.071 -1.880 629 H ILE 84 H ILE 84 -2.825 -11.408 -2.192 630 HA ILE 84 HA ILE 84 -1.233 -13.263 -3.683 631 HB ILE 84 HB ILE 84 0.522 -11.483 -3.551 632 HG12 ILE 84 1HG1 ILE 84 -1.628 -9.834 -2.219 633 HG13 ILE 84 2HG1 ILE 84 -0.321 -10.603 -1.326 634 HG21 ILE 84 1HG2 ILE 84 -2.236 -10.876 -4.561 635 HG22 ILE 84 2HG2 ILE 84 -0.886 -9.778 -4.836 636 HG23 ILE 84 3HG2 ILE 84 -0.825 -11.425 -5.462 637 HD11 ILE 84 1HD1 ILE 84 1.226 -9.124 -2.056 638 HD12 ILE 84 2HD1 ILE 84 0.435 -8.895 -3.616 639 HD13 ILE 84 3HD1 ILE 84 -0.200 -8.095 -2.179 640 H GLY 85 H GLY 85 -1.635 -12.559 -0.361 641 HA2 GLY 85 1HA GLY 85 -0.730 -14.177 1.216 642 HA3 GLY 85 2HA GLY 85 0.736 -14.210 0.248 643 H ALA 86 H ALA 86 -1.253 -11.664 1.765 644 HA ALA 86 HA ALA 86 1.201 -10.670 3.058 645 HB1 ALA 86 1HB ALA 86 -0.984 -9.050 1.760 646 HB2 ALA 86 2HB ALA 86 0.285 -8.370 2.781 647 HB3 ALA 86 3HB ALA 86 0.704 -9.164 1.264 648 H ARG 87 H ARG 87 -0.436 -12.447 4.350 649 HA ARG 87 HA ARG 87 -2.590 -11.801 5.778 650 HB2 ARG 87 1HB ARG 87 -0.970 -13.797 6.064 651 HB3 ARG 87 2HB ARG 87 -0.186 -12.799 7.281 652 HG2 ARG 87 1HG ARG 87 -2.162 -12.738 8.612 653 HG3 ARG 87 2HG ARG 87 -3.108 -13.505 7.335 654 HD2 ARG 87 1HD ARG 87 -2.694 -15.321 8.658 655 HD3 ARG 87 2HD ARG 87 -1.288 -15.394 7.597 656 HE ARG 87 HE ARG 87 0.027 -15.008 9.418 657 HH11 ARG 87 1HH1 ARG 87 -3.203 -13.923 10.134 658 HH12 ARG 87 2HH1 ARG 87 -2.848 -13.541 11.786 659 HH21 ARG 87 1HH2 ARG 87 0.506 -14.509 11.591 660 HH22 ARG 87 2HH2 ARG 87 -0.738 -13.874 12.614 661 H VAL 88 H VAL 88 -3.047 -9.721 6.294 662 HA VAL 88 HA VAL 88 -1.179 -8.336 8.107 663 HB VAL 88 HB VAL 88 -1.558 -7.185 5.940 664 HG11 VAL 88 1HG1 VAL 88 -3.907 -5.985 5.926 665 HG12 VAL 88 2HG1 VAL 88 -3.692 -7.586 5.215 666 HG13 VAL 88 3HG1 VAL 88 -4.389 -7.422 6.827 667 HG21 VAL 88 1HG2 VAL 88 -1.568 -5.088 6.875 668 HG22 VAL 88 2HG2 VAL 88 -2.857 -5.481 8.015 669 HG23 VAL 88 3HG2 VAL 88 -1.219 -6.074 8.295 670 H TYR 89 H TYR 89 -2.081 -7.102 9.837 671 HA TYR 89 HA TYR 89 -4.773 -7.990 10.641 672 HB2 TYR 89 1HB TYR 89 -2.668 -8.866 11.922 673 HB3 TYR 89 2HB TYR 89 -2.669 -7.264 12.650 674 HD1 TYR 89 2HD TYR 89 -4.623 -10.374 12.257 675 HD2 TYR 89 1HD TYR 89 -4.249 -6.677 14.329 676 HE1 TYR 89 2HE TYR 89 -6.309 -11.122 13.884 677 HE2 TYR 89 1HE TYR 89 -5.933 -7.414 15.962 678 HH TYR 89 HH TYR 89 -6.726 -10.022 16.737 679 H ALA 90 H ALA 90 -5.528 -6.038 9.571 680 HA ALA 90 HA ALA 90 -5.545 -3.790 11.419 681 HB1 ALA 90 1HB ALA 90 -4.337 -3.704 8.705 682 HB2 ALA 90 2HB ALA 90 -5.258 -2.301 9.254 683 HB3 ALA 90 3HB ALA 90 -3.868 -2.861 10.183 684 H LEU 91 H LEU 91 -7.059 -2.007 10.415 685 HA LEU 91 HA LEU 91 -9.370 -3.370 9.198 686 HB2 LEU 91 1HB LEU 91 -9.470 -2.666 11.691 687 HB3 LEU 91 2HB LEU 91 -9.657 -1.036 11.049 688 HG LEU 91 HG LEU 91 -11.684 -1.794 9.840 689 HD11 LEU 91 1HD1 LEU 91 -12.274 -3.930 9.688 690 HD12 LEU 91 2HD1 LEU 91 -12.118 -4.168 11.428 691 HD13 LEU 91 3HD1 LEU 91 -10.705 -4.333 10.387 692 HD21 LEU 91 1HD2 LEU 91 -12.818 -2.458 12.242 693 HD22 LEU 91 2HD2 LEU 91 -12.519 -0.815 11.670 694 HD23 LEU 91 3HD2 LEU 91 -11.355 -1.605 12.736 695 HA PRO 92 HA PRO 92 -9.077 -0.299 6.043 696 HB2 PRO 92 1HB PRO 92 -11.553 -0.612 4.974 697 HB3 PRO 92 2HB PRO 92 -10.243 -1.773 4.723 698 HG2 PRO 92 1HG PRO 92 -12.533 -1.889 6.647 699 HG3 PRO 92 2HG PRO 92 -11.859 -3.176 5.630 700 HD2 PRO 92 1HD PRO 92 -11.279 -2.946 8.265 701 HD3 PRO 92 2HD PRO 92 -10.119 -3.585 7.083 702 H GLU 93 H GLU 93 -11.342 -0.220 8.625 703 HA GLU 93 HA GLU 93 -12.760 2.129 7.933 704 HB2 GLU 93 1HB GLU 93 -12.217 0.857 10.619 705 HB3 GLU 93 2HB GLU 93 -13.309 2.213 10.376 706 HG2 GLU 93 1HG GLU 93 -14.777 0.896 9.047 707 HG3 GLU 93 2HG GLU 93 -13.623 -0.435 8.989 708 H ASP 94 H ASP 94 -9.854 1.560 9.875 709 HA ASP 94 HA ASP 94 -9.511 4.345 10.497 710 HB2 ASP 94 1HB ASP 94 -7.549 2.060 10.785 711 HB3 ASP 94 2HB ASP 94 -7.412 3.649 11.533 712 H LEU 95 H LEU 95 -8.478 2.180 7.991 713 HA LEU 95 HA LEU 95 -6.238 3.593 7.048 714 HB2 LEU 95 1HB LEU 95 -6.565 1.374 6.298 715 HB3 LEU 95 2HB LEU 95 -8.186 1.737 5.709 716 HG LEU 95 HG LEU 95 -7.221 3.094 3.909 717 HD11 LEU 95 1HD1 LEU 95 -4.498 2.061 4.409 718 HD12 LEU 95 2HD1 LEU 95 -5.047 3.383 5.438 719 HD13 LEU 95 3HD1 LEU 95 -5.025 3.582 3.686 720 HD21 LEU 95 1HD2 LEU 95 -6.383 0.235 4.222 721 HD22 LEU 95 2HD2 LEU 95 -5.979 1.146 2.767 722 HD23 LEU 95 3HD2 LEU 95 -7.667 0.918 3.224 723 H VAL 96 H VAL 96 -9.679 3.963 6.456 724 HA VAL 96 HA VAL 96 -9.568 5.682 4.248 725 HB VAL 96 HB VAL 96 -11.610 5.389 6.443 726 HG11 VAL 96 1HG1 VAL 96 -11.940 7.613 5.786 727 HG12 VAL 96 2HG1 VAL 96 -11.596 7.258 4.092 728 HG13 VAL 96 3HG1 VAL 96 -13.099 6.694 4.826 729 HG21 VAL 96 1HG2 VAL 96 -12.478 4.795 3.765 730 HG22 VAL 96 2HG2 VAL 96 -11.014 3.892 4.152 731 HG23 VAL 96 3HG2 VAL 96 -12.435 3.749 5.185 732 H GLU 97 H GLU 97 -9.039 6.253 7.640 733 HA GLU 97 HA GLU 97 -8.934 9.151 7.183 734 HB2 GLU 97 1HB GLU 97 -9.094 7.502 9.702 735 HB3 GLU 97 2HB GLU 97 -8.758 9.228 9.718 736 HG2 GLU 97 1HG GLU 97 -10.953 9.303 8.251 737 HG3 GLU 97 2HG GLU 97 -11.271 7.786 9.090 738 H VAL 98 H VAL 98 -6.883 7.404 6.174 739 HA VAL 98 HA VAL 98 -4.618 6.942 6.339 740 HB VAL 98 HB VAL 98 -4.517 9.896 6.936 741 HG11 VAL 98 1HG1 VAL 98 -2.452 8.256 6.767 742 HG12 VAL 98 2HG1 VAL 98 -2.704 8.499 5.038 743 HG13 VAL 98 3HG1 VAL 98 -2.396 9.882 6.087 744 HG21 VAL 98 1HG2 VAL 98 -4.497 10.043 4.362 745 HG22 VAL 98 2HG2 VAL 98 -5.259 8.453 4.415 746 HG23 VAL 98 3HG2 VAL 98 -6.046 9.834 5.180 747 H ASN 99 H ASN 99 -5.550 6.085 8.679 748 HA ASN 99 HA ASN 99 -4.135 7.407 10.852 749 HB2 ASN 99 1HB ASN 99 -6.211 5.280 10.644 750 HB3 ASN 99 2HB ASN 99 -5.159 5.254 12.055 751 HD21 ASN 99 1HD2 ASN 99 -7.608 5.583 12.725 752 HD22 ASN 99 2HD2 ASN 99 -8.011 7.225 13.080 753 HA PRO 100 HA PRO 100 -0.603 4.774 10.057 754 HB2 PRO 100 1HB PRO 100 0.973 5.897 11.962 755 HB3 PRO 100 2HB PRO 100 0.687 6.647 10.387 756 HG2 PRO 100 1HG PRO 100 -0.603 7.232 13.024 757 HG3 PRO 100 2HG PRO 100 -0.023 8.362 11.786 758 HD2 PRO 100 1HD PRO 100 -2.639 7.715 12.060 759 HD3 PRO 100 2HD PRO 100 -1.910 8.103 10.488 760 H LYS 101 H LYS 101 -2.737 4.793 12.603 761 HA LYS 101 HA LYS 101 -1.275 3.196 14.481 762 HB2 LYS 101 1HB LYS 101 -4.186 3.920 14.194 763 HB3 LYS 101 2HB LYS 101 -3.616 2.827 15.449 764 HG2 LYS 101 1HG LYS 101 -3.578 4.781 16.605 765 HG3 LYS 101 2HG LYS 101 -1.947 4.817 15.929 766 HD2 LYS 101 1HD LYS 101 -2.957 6.119 13.985 767 HD3 LYS 101 2HD LYS 101 -4.390 6.306 15.000 768 HE2 LYS 101 1HE LYS 101 -2.575 7.102 16.760 769 HE3 LYS 101 2HE LYS 101 -1.677 7.485 15.292 770 HZ1 LYS 101 1HZ LYS 101 -2.814 9.409 15.520 771 HZ2 LYS 101 2HZ LYS 101 -4.102 8.702 16.358 772 HZ3 LYS 101 3HZ LYS 101 -4.005 8.554 14.675 773 H MET 102 H MET 102 -3.498 2.574 11.832 774 HA MET 102 HA MET 102 -3.303 -0.311 12.349 775 HB2 MET 102 1HB MET 102 -5.302 1.417 10.970 776 HB3 MET 102 2HB MET 102 -5.105 -0.234 10.398 777 HG2 MET 102 1HG MET 102 -6.891 -0.165 11.984 778 HG3 MET 102 2HG MET 102 -5.534 -1.042 12.688 779 HE1 MET 102 1HE MET 102 -4.582 0.067 15.508 780 HE2 MET 102 2HE MET 102 -6.300 0.030 15.904 781 HE3 MET 102 3HE MET 102 -5.636 -1.122 14.745 782 H VAL 103 H VAL 103 -2.464 2.197 10.095 783 HA VAL 103 HA VAL 103 -1.866 0.550 7.866 784 HB VAL 103 HB VAL 103 -0.902 3.306 8.624 785 HG11 VAL 103 1HG1 VAL 103 -0.428 1.770 6.072 786 HG12 VAL 103 2HG1 VAL 103 -0.090 3.488 6.301 787 HG13 VAL 103 3HG1 VAL 103 0.794 2.281 7.236 788 HG21 VAL 103 1HG2 VAL 103 -2.379 3.862 6.607 789 HG22 VAL 103 2HG2 VAL 103 -3.038 2.238 6.805 790 HG23 VAL 103 3HG2 VAL 103 -3.183 3.413 8.111 791 H MET 104 H MET 104 -0.245 1.140 10.824 792 HA MET 104 HA MET 104 2.426 0.896 10.213 793 HB2 MET 104 1HB MET 104 2.776 0.431 12.440 794 HB3 MET 104 2HB MET 104 1.161 1.124 12.508 795 HG2 MET 104 1HG MET 104 1.720 -1.827 12.372 796 HG3 MET 104 2HG MET 104 1.474 -0.932 13.871 797 HE1 MET 104 1HE MET 104 0.137 -3.204 13.683 798 HE2 MET 104 2HE MET 104 -1.246 -2.484 14.508 799 HE3 MET 104 3HE MET 104 -1.476 -3.343 12.983 800 H THR 105 H THR 105 -0.047 -1.576 10.233 801 HA THR 105 HA THR 105 1.937 -3.664 9.721 802 HB THR 105 HB THR 105 0.126 -4.105 11.371 803 HG1 THR 105 1HG THR 105 0.448 -6.099 10.767 804 HG21 THR 105 1HG2 THR 105 -1.902 -3.318 10.807 805 HG22 THR 105 2HG2 THR 105 -2.054 -4.803 9.869 806 HG23 THR 105 3HG2 THR 105 -1.524 -3.315 9.086 807 H VAL 106 H VAL 106 -0.165 -1.589 8.053 808 HA VAL 106 HA VAL 106 -0.879 -3.217 5.854 809 HB VAL 106 HB VAL 106 -0.686 -0.235 6.198 810 HG11 VAL 106 1HG1 VAL 106 -0.230 -0.375 3.930 811 HG12 VAL 106 2HG1 VAL 106 -1.231 -1.812 3.714 812 HG13 VAL 106 3HG1 VAL 106 -1.988 -0.239 3.962 813 HG21 VAL 106 1HG2 VAL 106 -3.047 -2.057 5.747 814 HG22 VAL 106 2HG2 VAL 106 -2.519 -1.460 7.320 815 HG23 VAL 106 3HG2 VAL 106 -3.099 -0.328 6.098 816 H PHE 107 H PHE 107 1.360 -0.454 5.723 817 HA PHE 107 HA PHE 107 2.658 -1.378 3.392 818 HB2 PHE 107 1HB PHE 107 3.239 0.763 5.410 819 HB3 PHE 107 2HB PHE 107 4.443 0.362 4.189 820 HD1 PHE 107 2HD PHE 107 3.040 -0.047 1.772 821 HD2 PHE 107 1HD PHE 107 2.171 2.717 4.891 822 HE1 PHE 107 2HE PHE 107 1.886 1.408 0.158 823 HE2 PHE 107 1HE PHE 107 1.015 4.176 3.281 824 HZ PHE 107 HZ PHE 107 0.872 3.521 0.911 825 H ALA 108 H ALA 108 3.711 -1.324 6.793 826 HA ALA 108 HA ALA 108 6.200 -2.343 6.694 827 HB1 ALA 108 1HB ALA 108 5.035 -1.832 8.780 828 HB2 ALA 108 2HB ALA 108 4.054 -3.286 8.593 829 HB3 ALA 108 3HB ALA 108 5.794 -3.423 8.844 830 H CYS 109 H CYS 109 3.296 -4.417 6.775 831 HA CYS 109 HA CYS 109 4.541 -6.862 6.453 832 HB2 CYS 109 1HB CYS 109 1.831 -5.870 5.597 833 HB3 CYS 109 2HB CYS 109 2.332 -7.532 5.311 834 HG CYS 109 HG CYS 109 0.705 -7.570 7.542 835 H LEU 110 H LEU 110 3.407 -4.624 3.944 836 HA LEU 110 HA LEU 110 4.093 -6.235 1.739 837 HB2 LEU 110 1HB LEU 110 3.780 -3.257 2.030 838 HB3 LEU 110 2HB LEU 110 4.082 -4.047 0.485 839 HG LEU 110 HG LEU 110 1.725 -4.857 2.140 840 HD11 LEU 110 1HD1 LEU 110 0.416 -3.171 0.795 841 HD12 LEU 110 2HD1 LEU 110 1.959 -2.406 0.414 842 HD13 LEU 110 3HD1 LEU 110 1.419 -2.515 2.090 843 HD21 LEU 110 1HD2 LEU 110 1.274 -6.092 0.354 844 HD22 LEU 110 2HD2 LEU 110 2.794 -5.564 -0.369 845 HD23 LEU 110 3HD2 LEU 110 1.309 -4.664 -0.681 846 H MET 111 H MET 111 5.920 -3.908 3.635 847 HA MET 111 HA MET 111 8.168 -3.796 1.895 848 HB2 MET 111 1HB MET 111 7.708 -3.030 4.765 849 HB3 MET 111 2HB MET 111 9.312 -2.939 4.049 850 HG2 MET 111 1HG MET 111 6.857 -1.488 3.090 851 HG3 MET 111 2HG MET 111 8.203 -0.786 3.985 852 HE1 MET 111 1HE MET 111 11.119 -0.828 1.515 853 HE2 MET 111 2HE MET 111 10.597 -0.819 3.199 854 HE3 MET 111 3HE MET 111 10.774 -2.349 2.339 855 H GLY 112 H GLY 112 7.003 -6.218 3.908 856 HA2 GLY 112 1HA GLY 112 9.136 -7.377 5.156 857 HA3 GLY 112 2HA GLY 112 7.861 -8.304 4.378 858 H LYS 113 H LYS 113 8.706 -7.009 1.755 859 HA LYS 113 HA LYS 113 10.608 -9.065 1.044 860 HB2 LYS 113 1HB LYS 113 8.670 -8.445 -0.409 861 HB3 LYS 113 2HB LYS 113 9.433 -6.885 -0.690 862 HG2 LYS 113 1HG LYS 113 10.121 -8.016 -2.544 863 HG3 LYS 113 2HG LYS 113 11.458 -8.377 -1.449 864 HD2 LYS 113 1HD LYS 113 10.290 -10.497 -0.840 865 HD3 LYS 113 2HD LYS 113 9.100 -10.144 -2.094 866 HE2 LYS 113 1HE LYS 113 12.037 -10.242 -2.702 867 HE3 LYS 113 2HE LYS 113 11.054 -11.706 -2.678 868 HZ1 LYS 113 1HZ LYS 113 10.049 -9.456 -4.239 869 HZ2 LYS 113 2HZ LYS 113 9.963 -11.116 -4.554 870 HZ3 LYS 113 3HZ LYS 113 11.397 -10.271 -4.855 871 H GLY 114 H GLY 114 10.562 -5.564 1.399 872 HA2 GLY 114 1HA GLY 114 12.968 -4.901 0.182 873 HA3 GLY 114 2HA GLY 114 12.272 -4.040 1.547 874 H MET 115 H MET 115 12.691 -4.996 3.719 875 HA MET 115 HA MET 115 15.357 -5.147 4.306 876 HB2 MET 115 1HB MET 115 14.534 -6.498 6.382 877 HB3 MET 115 2HB MET 115 14.015 -4.831 6.164 878 HG2 MET 115 1HG MET 115 11.876 -5.493 5.417 879 HG3 MET 115 2HG MET 115 12.381 -7.171 5.235 880 HE1 MET 115 1HE MET 115 14.089 -7.456 8.134 881 HE2 MET 115 2HE MET 115 12.786 -8.353 8.912 882 HE3 MET 115 3HE MET 115 13.166 -8.645 7.214 883 H LYS 116 H LYS 116 16.921 -6.667 4.328 884 HA LYS 116 HA LYS 116 16.396 -9.469 4.268 885 HB2 LYS 116 1HB LYS 116 17.496 -9.844 2.026 886 HB3 LYS 116 2HB LYS 116 15.875 -9.164 1.968 887 HG2 LYS 116 1HG LYS 116 16.916 -7.830 0.449 888 HG3 LYS 116 2HG LYS 116 17.195 -6.886 1.914 889 HD2 LYS 116 1HD LYS 116 19.388 -8.222 2.103 890 HD3 LYS 116 2HD LYS 116 19.108 -8.646 0.413 891 HE2 LYS 116 1HE LYS 116 19.168 -6.357 -0.250 892 HE3 LYS 116 2HE LYS 116 19.148 -5.810 1.426 893 HZ1 LYS 116 1HZ LYS 116 21.330 -7.372 1.375 894 HZ2 LYS 116 2HZ LYS 116 21.352 -5.695 1.155 895 HZ3 LYS 116 3HZ LYS 116 21.361 -6.725 -0.188 896 H ARG 117 H ARG 117 18.586 -10.641 3.608 897 HA ARG 117 HA ARG 117 20.920 -9.100 4.415 898 HB2 ARG 117 1HB ARG 117 20.380 -11.672 5.864 899 HB3 ARG 117 2HB ARG 117 21.475 -10.366 6.299 900 HG2 ARG 117 1HG ARG 117 19.502 -8.936 6.765 901 HG3 ARG 117 2HG ARG 117 18.470 -10.334 6.460 902 HD2 ARG 117 1HD ARG 117 18.998 -9.876 8.879 903 HD3 ARG 117 2HD ARG 117 19.357 -11.507 8.316 904 HE ARG 117 HE ARG 117 21.259 -9.488 9.149 905 HH11 ARG 117 1HH1 ARG 117 20.737 -12.521 7.523 906 HH12 ARG 117 2HH1 ARG 117 22.379 -13.047 7.698 907 HH21 ARG 117 1HH2 ARG 117 23.423 -10.169 9.385 908 HH22 ARG 117 2HH2 ARG 117 23.905 -11.709 8.758 909 H VAL 118 H VAL 118 22.893 -10.046 3.821 910 HA VAL 118 HA VAL 118 22.780 -12.573 2.346 911 HB VAL 118 HB VAL 118 24.155 -10.159 1.179 912 HG11 VAL 118 1HG1 VAL 118 23.507 -12.914 0.162 913 HG12 VAL 118 2HG1 VAL 118 23.993 -11.590 -0.899 914 HG13 VAL 118 3HG1 VAL 118 25.093 -12.168 0.355 915 HG21 VAL 118 1HG2 VAL 118 21.579 -10.031 1.398 916 HG22 VAL 118 2HG2 VAL 118 22.322 -9.675 -0.161 917 HG23 VAL 118 3HG2 VAL 118 21.575 -11.247 0.121 918 H SER 119 H SER 119 24.945 -13.443 1.865 919 HA SER 119 HA SER 119 26.645 -13.200 4.160 920 HB2 SER 119 1HB SER 119 26.361 -15.383 3.170 921 HB3 SER 119 2HB SER 119 26.919 -14.795 1.603 922 HG SER 119 HG SER 119 28.839 -15.305 2.254 923 H GLY 120 H GLY 120 27.057 -12.536 0.683 924 HA2 GLY 120 1HA GLY 120 29.580 -11.174 1.229 925 HA3 GLY 120 2HA GLY 120 28.908 -11.527 -0.356 926 HA PRO 121 HA PRO 121 28.007 -7.079 1.215 927 HB2 PRO 121 1HB PRO 121 30.109 -5.745 0.131 928 HB3 PRO 121 2HB PRO 121 30.131 -6.400 1.771 929 HG2 PRO 121 1HG PRO 121 31.295 -7.541 -0.739 930 HG3 PRO 121 2HG PRO 121 32.000 -7.463 0.885 931 HD2 PRO 121 1HD PRO 121 30.861 -9.712 -0.100 932 HD3 PRO 121 2HD PRO 121 30.817 -9.296 1.625 933 H SER 122 H SER 122 26.354 -7.595 -0.402 934 HA SER 122 HA SER 122 27.022 -6.584 -3.087 935 HB2 SER 122 1HB SER 122 25.099 -8.677 -2.138 936 HB3 SER 122 2HB SER 122 24.761 -7.805 -3.633 937 HG SER 122 HG SER 122 25.951 -9.644 -4.111 938 H SER 123 H SER 123 25.967 -4.857 -3.880 939 HA SER 123 HA SER 123 24.024 -3.554 -2.111 940 HB2 SER 123 1HB SER 123 25.644 -2.452 -4.418 941 HB3 SER 123 2HB SER 123 24.504 -1.516 -3.452 942 HG SER 123 HG SER 123 25.885 -1.475 -1.839 943 H GLY 124 H GLY 124 22.062 -4.417 -2.601 944 HA2 GLY 124 1HA GLY 124 20.360 -3.531 -4.409 945 HA3 GLY 124 2HA GLY 124 21.269 -4.657 -5.406 Start of MODEL 2 1 H1 GLY 1 H GLY 1 17.077 11.649 -3.735 2 HA2 GLY 1 1HA GLY 1 16.397 13.766 -4.770 3 HA3 GLY 1 2HA GLY 1 15.155 12.863 -5.624 4 H SER 2 H SER 2 15.613 14.975 -3.192 5 HA SER 2 HA SER 2 14.465 15.600 -1.318 6 HB2 SER 2 1HB SER 2 12.378 14.551 -3.193 7 HB3 SER 2 2HB SER 2 11.903 15.050 -1.570 8 HG SER 2 HG SER 2 12.411 16.578 -3.698 9 H SER 3 H SER 3 15.838 13.311 -0.828 10 HA SER 3 HA SER 3 14.266 12.126 1.269 11 HB2 SER 3 1HB SER 3 15.094 10.498 -1.134 12 HB3 SER 3 2HB SER 3 14.754 9.762 0.432 13 HG SER 3 HG SER 3 12.940 9.877 -1.065 14 H GLY 4 H GLY 4 15.532 11.517 2.936 15 HA2 GLY 4 1HA GLY 4 18.410 11.869 2.610 16 HA3 GLY 4 2HA GLY 4 17.541 11.748 4.133 17 H SER 5 H SER 5 19.057 10.241 4.918 18 HA SER 5 HA SER 5 19.881 7.905 3.674 19 HB2 SER 5 1HB SER 5 19.431 8.476 6.609 20 HB3 SER 5 2HB SER 5 20.238 7.029 6.006 21 HG SER 5 HG SER 5 21.976 8.165 5.717 22 H SER 6 H SER 6 18.957 6.011 3.209 23 HA SER 6 HA SER 6 16.173 5.610 4.025 24 HB2 SER 6 1HB SER 6 16.126 3.910 2.211 25 HB3 SER 6 2HB SER 6 16.580 5.511 1.629 26 HG SER 6 HG SER 6 18.226 3.256 2.057 27 H GLY 7 H GLY 7 16.384 4.784 6.092 28 HA2 GLY 7 1HA GLY 7 18.163 2.579 6.638 29 HA3 GLY 7 2HA GLY 7 17.014 3.297 7.758 30 H ASN 8 H ASN 8 15.670 1.787 8.466 31 HA ASN 8 HA ASN 8 14.733 -0.263 6.575 32 HB2 ASN 8 1HB ASN 8 15.746 -1.397 8.354 33 HB3 ASN 8 2HB ASN 8 15.124 -0.268 9.553 34 HD21 ASN 8 1HD2 ASN 8 14.137 -1.734 10.849 35 HD22 ASN 8 2HD2 ASN 8 12.774 -2.681 10.365 36 H ASP 9 H ASP 9 13.625 1.808 9.243 37 HA ASP 9 HA ASP 9 10.850 1.298 8.654 38 HB2 ASP 9 1HB ASP 9 12.235 3.180 10.568 39 HB3 ASP 9 2HB ASP 9 10.483 3.105 10.399 40 H ASP 10 H ASP 10 13.234 3.698 7.846 41 HA ASP 10 HA ASP 10 11.344 5.647 6.904 42 HB2 ASP 10 1HB ASP 10 13.392 6.553 7.641 43 HB3 ASP 10 2HB ASP 10 14.337 5.380 6.729 44 H ILE 11 H ILE 11 13.370 3.149 5.456 45 HA ILE 11 HA ILE 11 12.978 3.798 2.763 46 HB ILE 11 HB ILE 11 14.623 2.120 3.660 47 HG12 ILE 11 1HG1 ILE 11 12.947 0.892 1.485 48 HG13 ILE 11 2HG1 ILE 11 13.821 2.396 1.214 49 HG21 ILE 11 1HG2 ILE 11 12.255 0.882 4.580 50 HG22 ILE 11 2HG2 ILE 11 12.984 -0.194 3.390 51 HG23 ILE 11 3HG2 ILE 11 13.922 0.341 4.784 52 HD11 ILE 11 1HD1 ILE 11 15.796 1.359 1.064 53 HD12 ILE 11 2HD1 ILE 11 15.423 0.233 2.370 54 HD13 ILE 11 3HD1 ILE 11 14.815 -0.070 0.743 55 H ILE 12 H ILE 12 10.805 2.526 5.068 56 HA ILE 12 HA ILE 12 9.100 0.911 3.649 57 HB ILE 12 HB ILE 12 8.289 3.034 5.638 58 HG12 ILE 12 1HG1 ILE 12 8.956 0.111 6.051 59 HG13 ILE 12 2HG1 ILE 12 9.996 1.462 6.491 60 HG21 ILE 12 1HG2 ILE 12 6.545 1.842 4.090 61 HG22 ILE 12 2HG2 ILE 12 6.790 0.496 5.202 62 HG23 ILE 12 3HG2 ILE 12 6.220 2.050 5.811 63 HD11 ILE 12 1HD1 ILE 12 7.307 1.632 7.611 64 HD12 ILE 12 2HD1 ILE 12 8.229 0.226 8.148 65 HD13 ILE 12 3HD1 ILE 12 8.879 1.849 8.379 66 H VAL 13 H VAL 13 9.337 4.424 3.565 67 HA VAL 13 HA VAL 13 7.044 4.714 1.836 68 HB VAL 13 HB VAL 13 9.146 6.721 2.660 69 HG11 VAL 13 1HG1 VAL 13 6.708 6.938 0.946 70 HG12 VAL 13 2HG1 VAL 13 7.226 8.315 1.923 71 HG13 VAL 13 3HG1 VAL 13 8.311 7.635 0.710 72 HG21 VAL 13 1HG2 VAL 13 8.045 6.822 4.586 73 HG22 VAL 13 2HG2 VAL 13 6.607 7.343 3.709 74 HG23 VAL 13 3HG2 VAL 13 6.877 5.628 4.019 75 H ASN 14 H ASN 14 10.560 5.177 1.495 76 HA ASN 14 HA ASN 14 10.673 5.895 -1.161 77 HB2 ASN 14 1HB ASN 14 12.694 5.988 0.047 78 HB3 ASN 14 2HB ASN 14 12.565 4.309 0.562 79 HD21 ASN 14 1HD2 ASN 14 13.438 6.463 -2.007 80 HD22 ASN 14 2HD2 ASN 14 14.237 5.292 -2.995 81 H TRP 15 H TRP 15 10.915 2.581 0.135 82 HA TRP 15 HA TRP 15 11.144 1.123 -2.142 83 HB2 TRP 15 1HB TRP 15 10.978 0.243 0.218 84 HB3 TRP 15 2HB TRP 15 9.228 0.375 0.071 85 HD1 TRP 15 HD TRP 15 12.190 -1.550 -1.487 86 HE1 TRP 15 1HE TRP 15 11.293 -3.765 -2.441 87 HE3 TRP 15 3HE TRP 15 7.195 -0.811 -0.693 88 HZ2 TRP 15 2HZ TRP 15 8.797 -5.033 -2.808 89 HZ3 TRP 15 3HZ TRP 15 5.618 -2.573 -1.374 90 HH2 TRP 15 HH TRP 15 6.405 -4.639 -2.411 91 H VAL 16 H VAL 16 7.964 1.843 -0.683 92 HA VAL 16 HA VAL 16 6.307 0.936 -2.636 93 HB VAL 16 HB VAL 16 5.965 3.504 -1.082 94 HG11 VAL 16 1HG1 VAL 16 3.469 2.389 -1.590 95 HG12 VAL 16 2HG1 VAL 16 4.156 3.833 -2.337 96 HG13 VAL 16 3HG1 VAL 16 4.334 2.264 -3.122 97 HG21 VAL 16 1HG2 VAL 16 5.469 0.631 -0.476 98 HG22 VAL 16 2HG2 VAL 16 6.095 1.910 0.564 99 HG23 VAL 16 3HG2 VAL 16 4.373 1.841 0.190 100 H ASN 17 H ASN 17 7.613 4.255 -2.507 101 HA ASN 17 HA ASN 17 6.573 5.308 -4.792 102 HB2 ASN 17 1HB ASN 17 9.185 5.687 -3.393 103 HB3 ASN 17 2HB ASN 17 8.961 6.445 -4.967 104 HD21 ASN 17 1HD2 ASN 17 7.325 6.059 -1.849 105 HD22 ASN 17 2HD2 ASN 17 6.683 7.663 -1.794 106 H GLU 18 H GLU 18 9.623 3.471 -4.605 107 HA GLU 18 HA GLU 18 10.226 3.474 -7.322 108 HB2 GLU 18 1HB GLU 18 10.954 1.753 -5.007 109 HB3 GLU 18 2HB GLU 18 11.287 1.125 -6.616 110 HG2 GLU 18 1HG GLU 18 12.534 3.230 -7.097 111 HG3 GLU 18 2HG GLU 18 12.324 3.673 -5.404 112 H THR 19 H THR 19 8.623 0.881 -5.468 113 HA THR 19 HA THR 19 8.045 -0.890 -7.452 114 HB THR 19 HB THR 19 6.226 -0.086 -5.176 115 HG1 THR 19 1HG THR 19 8.419 -1.804 -5.457 116 HG21 THR 19 1HG2 THR 19 6.026 -2.224 -7.239 117 HG22 THR 19 2HG2 THR 19 4.753 -1.286 -6.458 118 HG23 THR 19 3HG2 THR 19 5.535 -2.606 -5.590 119 H LEU 20 H LEU 20 6.298 2.091 -6.713 120 HA LEU 20 HA LEU 20 4.269 1.637 -8.687 121 HB2 LEU 20 1HB LEU 20 5.055 4.139 -7.201 122 HB3 LEU 20 2HB LEU 20 3.620 3.969 -8.210 123 HG LEU 20 HG LEU 20 4.000 2.116 -5.901 124 HD11 LEU 20 1HD1 LEU 20 3.138 3.634 -4.334 125 HD12 LEU 20 2HD1 LEU 20 2.727 4.816 -5.576 126 HD13 LEU 20 3HD1 LEU 20 4.417 4.516 -5.168 127 HD21 LEU 20 1HD2 LEU 20 2.136 1.549 -7.159 128 HD22 LEU 20 2HD2 LEU 20 1.726 3.232 -7.497 129 HD23 LEU 20 3HD2 LEU 20 1.453 2.563 -5.886 130 H ARG 21 H ARG 21 7.241 3.536 -8.499 131 HA ARG 21 HA ARG 21 6.979 4.951 -10.897 132 HB2 ARG 21 1HB ARG 21 8.678 5.456 -9.185 133 HB3 ARG 21 2HB ARG 21 9.513 3.959 -9.579 134 HG2 ARG 21 1HG ARG 21 10.281 4.761 -11.601 135 HG3 ARG 21 2HG ARG 21 9.018 5.989 -11.710 136 HD2 ARG 21 1HD ARG 21 10.116 7.055 -9.670 137 HD3 ARG 21 2HD ARG 21 11.479 5.983 -9.987 138 HE ARG 21 HE ARG 21 10.696 7.480 -12.295 139 HH11 ARG 21 1HH1 ARG 21 12.531 7.597 -9.338 140 HH12 ARG 21 2HH1 ARG 21 13.614 8.824 -9.905 141 HH21 ARG 21 1HH2 ARG 21 12.116 9.097 -13.053 142 HH22 ARG 21 2HH2 ARG 21 13.377 9.677 -12.018 143 H GLU 22 H GLU 22 8.611 1.851 -10.260 144 HA GLU 22 HA GLU 22 9.444 1.356 -12.888 145 HB2 GLU 22 1HB GLU 22 9.801 -0.916 -12.203 146 HB3 GLU 22 2HB GLU 22 10.229 0.132 -10.859 147 HG2 GLU 22 1HG GLU 22 8.367 -0.478 -9.620 148 HG3 GLU 22 2HG GLU 22 7.499 -1.071 -11.035 149 H ALA 23 H ALA 23 6.353 0.997 -11.356 150 HA ALA 23 HA ALA 23 5.281 -0.610 -13.534 151 HB1 ALA 23 1HB ALA 23 4.518 -1.230 -11.367 152 HB2 ALA 23 2HB ALA 23 4.054 0.430 -10.989 153 HB3 ALA 23 3HB ALA 23 3.161 -0.481 -12.206 154 H GLU 24 H GLU 24 5.744 2.648 -12.835 155 HA GLU 24 HA GLU 24 5.123 4.558 -13.909 156 HB2 GLU 24 1HB GLU 24 3.653 2.766 -15.847 157 HB3 GLU 24 2HB GLU 24 4.152 4.430 -16.116 158 HG2 GLU 24 1HG GLU 24 6.379 3.864 -16.359 159 HG3 GLU 24 2HG GLU 24 6.187 2.332 -15.509 160 H LYS 25 H LYS 25 3.694 3.941 -11.713 161 HA LYS 25 HA LYS 25 0.863 4.259 -12.387 162 HB2 LYS 25 1HB LYS 25 2.366 3.323 -10.001 163 HB3 LYS 25 2HB LYS 25 0.831 4.131 -9.711 164 HG2 LYS 25 1HG LYS 25 0.669 1.661 -9.858 165 HG3 LYS 25 2HG LYS 25 -0.346 2.516 -11.021 166 HD2 LYS 25 1HD LYS 25 1.332 2.138 -12.762 167 HD3 LYS 25 2HD LYS 25 2.349 1.284 -11.599 168 HE2 LYS 25 1HE LYS 25 0.979 -0.555 -11.545 169 HE3 LYS 25 2HE LYS 25 -0.459 0.369 -11.979 170 HZ1 LYS 25 1HZ LYS 25 0.003 0.232 -14.187 171 HZ2 LYS 25 2HZ LYS 25 0.710 -1.221 -13.686 172 HZ3 LYS 25 3HZ LYS 25 1.678 0.138 -13.966 173 H SER 26 H SER 26 -0.344 6.024 -11.780 174 HA SER 26 HA SER 26 1.147 8.460 -11.319 175 HB2 SER 26 1HB SER 26 -1.687 7.803 -12.035 176 HB3 SER 26 2HB SER 26 -1.311 9.399 -11.389 177 HG SER 26 HG SER 26 0.279 8.394 -13.457 178 H SER 27 H SER 27 0.491 6.214 -9.250 179 HA SER 27 HA SER 27 -0.581 7.988 -7.159 180 HB2 SER 27 1HB SER 27 -0.481 4.962 -7.213 181 HB3 SER 27 2HB SER 27 -1.182 5.947 -5.929 182 HG SER 27 HG SER 27 -2.577 6.817 -7.652 183 H SER 28 H SER 28 0.429 8.042 -5.119 184 HA SER 28 HA SER 28 2.749 6.594 -4.449 185 HB2 SER 28 1HB SER 28 4.506 8.123 -4.842 186 HB3 SER 28 2HB SER 28 3.579 8.122 -6.342 187 HG SER 28 HG SER 28 3.687 10.080 -4.321 188 H ILE 29 H ILE 29 4.013 7.901 -2.639 189 HA ILE 29 HA ILE 29 2.157 9.534 -1.073 190 HB ILE 29 HB ILE 29 2.724 8.223 0.982 191 HG12 ILE 29 1HG1 ILE 29 3.435 5.906 -0.761 192 HG13 ILE 29 2HG1 ILE 29 4.689 7.085 -0.391 193 HG21 ILE 29 1HG2 ILE 29 0.609 7.669 0.463 194 HG22 ILE 29 2HG2 ILE 29 0.997 7.357 -1.228 195 HG23 ILE 29 3HG2 ILE 29 1.320 6.125 -0.008 196 HD11 ILE 29 1HD1 ILE 29 4.350 4.972 1.102 197 HD12 ILE 29 2HD1 ILE 29 4.737 6.532 1.829 198 HD13 ILE 29 3HD1 ILE 29 3.074 5.946 1.833 199 H SER 30 H SER 30 3.139 10.912 0.414 200 HA SER 30 HA SER 30 5.968 11.400 -0.103 201 HB2 SER 30 1HB SER 30 3.718 13.020 1.030 202 HB3 SER 30 2HB SER 30 5.378 13.471 1.414 203 HG SER 30 HG SER 30 5.085 14.526 -0.424 204 H SER 31 H SER 31 3.786 10.657 2.565 205 HA SER 31 HA SER 31 5.945 9.514 4.082 206 HB2 SER 31 1HB SER 31 6.103 11.971 4.604 207 HB3 SER 31 2HB SER 31 4.484 11.870 5.295 208 HG SER 31 HG SER 31 5.605 11.413 7.034 209 H PHE 32 H PHE 32 5.150 8.581 6.160 210 HA PHE 32 HA PHE 32 3.069 6.867 5.851 211 HB2 PHE 32 1HB PHE 32 4.129 8.131 8.377 212 HB3 PHE 32 2HB PHE 32 2.923 6.849 8.396 213 HD1 PHE 32 2HD PHE 32 3.500 4.606 7.491 214 HD2 PHE 32 1HD PHE 32 6.413 7.666 8.015 215 HE1 PHE 32 2HE PHE 32 5.289 2.922 7.363 216 HE2 PHE 32 1HE PHE 32 8.206 5.987 7.886 217 HZ PHE 32 HZ PHE 32 7.645 3.610 7.561 218 H LYS 33 H LYS 33 2.897 10.208 6.884 219 HA LYS 33 HA LYS 33 0.022 9.997 7.361 220 HB2 LYS 33 1HB LYS 33 2.137 11.982 8.017 221 HB3 LYS 33 2HB LYS 33 0.504 12.592 7.791 222 HG2 LYS 33 1HG LYS 33 0.428 12.186 10.018 223 HG3 LYS 33 2HG LYS 33 -0.070 10.596 9.435 224 HD2 LYS 33 1HD LYS 33 2.838 11.101 9.773 225 HD3 LYS 33 2HD LYS 33 1.863 10.900 11.230 226 HE2 LYS 33 1HE LYS 33 1.032 8.759 10.358 227 HE3 LYS 33 2HE LYS 33 2.042 8.959 8.927 228 HZ1 LYS 33 1HZ LYS 33 3.974 9.065 10.504 229 HZ2 LYS 33 2HZ LYS 33 3.214 7.558 10.391 230 HZ3 LYS 33 3HZ LYS 33 2.923 8.554 11.727 231 H ASP 34 H ASP 34 0.823 9.560 4.713 232 HA ASP 34 HA ASP 34 0.511 11.969 3.180 233 HB2 ASP 34 1HB ASP 34 1.815 10.329 2.117 234 HB3 ASP 34 2HB ASP 34 0.666 9.046 2.491 235 HA PRO 35 HA PRO 35 -3.894 12.132 3.152 236 HB2 PRO 35 1HB PRO 35 -4.217 13.699 0.959 237 HB3 PRO 35 2HB PRO 35 -3.651 14.326 2.512 238 HG2 PRO 35 1HG PRO 35 -2.072 13.577 0.081 239 HG3 PRO 35 2HG PRO 35 -1.892 14.987 1.142 240 HD2 PRO 35 1HD PRO 35 -0.290 12.812 1.324 241 HD3 PRO 35 2HD PRO 35 -0.728 13.796 2.735 242 H LYS 36 H LYS 36 -2.303 11.572 0.012 243 HA LYS 36 HA LYS 36 -4.381 10.569 -1.455 244 HB2 LYS 36 1HB LYS 36 -1.572 9.452 -1.439 245 HB3 LYS 36 2HB LYS 36 -2.738 9.317 -2.749 246 HG2 LYS 36 1HG LYS 36 -1.663 11.936 -1.731 247 HG3 LYS 36 2HG LYS 36 -0.970 11.043 -3.087 248 HD2 LYS 36 1HD LYS 36 -3.439 11.091 -3.974 249 HD3 LYS 36 2HD LYS 36 -3.582 12.473 -2.885 250 HE2 LYS 36 1HE LYS 36 -2.992 13.280 -5.063 251 HE3 LYS 36 2HE LYS 36 -1.601 13.479 -3.998 252 HZ1 LYS 36 1HZ LYS 36 -0.898 12.608 -6.111 253 HZ2 LYS 36 2HZ LYS 36 -1.986 11.318 -5.999 254 HZ3 LYS 36 3HZ LYS 36 -0.681 11.419 -4.927 255 H ILE 37 H ILE 37 -2.538 8.933 1.051 256 HA ILE 37 HA ILE 37 -3.257 6.308 0.685 257 HB ILE 37 HB ILE 37 -3.075 7.753 3.332 258 HG12 ILE 37 1HG1 ILE 37 -1.014 6.382 1.603 259 HG13 ILE 37 2HG1 ILE 37 -1.026 8.058 2.140 260 HG21 ILE 37 1HG2 ILE 37 -3.464 5.820 4.354 261 HG22 ILE 37 2HG2 ILE 37 -3.918 5.144 2.789 262 HG23 ILE 37 3HG2 ILE 37 -2.258 4.997 3.366 263 HD11 ILE 37 1HD1 ILE 37 0.239 7.474 3.852 264 HD12 ILE 37 2HD1 ILE 37 -1.077 6.465 4.457 265 HD13 ILE 37 3HD1 ILE 37 0.140 5.777 3.382 266 H SER 38 H SER 38 -5.199 8.938 1.948 267 HA SER 38 HA SER 38 -7.280 7.535 3.128 268 HB2 SER 38 1HB SER 38 -7.128 9.950 3.307 269 HB3 SER 38 2HB SER 38 -7.373 10.130 1.569 270 HG SER 38 HG SER 38 -9.308 8.734 3.014 271 H THR 39 H THR 39 -6.673 8.228 -0.266 272 HA THR 39 HA THR 39 -9.192 7.054 -1.098 273 HB THR 39 HB THR 39 -8.248 7.433 -3.425 274 HG1 THR 39 1HG THR 39 -6.012 7.708 -2.182 275 HG21 THR 39 1HG2 THR 39 -9.391 9.211 -1.584 276 HG22 THR 39 2HG2 THR 39 -9.366 9.362 -3.341 277 HG23 THR 39 3HG2 THR 39 -8.097 10.112 -2.374 278 H SER 40 H SER 40 -6.175 5.904 -0.241 279 HA SER 40 HA SER 40 -5.231 3.833 -0.329 280 HB2 SER 40 1HB SER 40 -7.686 2.901 -1.825 281 HB3 SER 40 2HB SER 40 -6.573 1.928 -0.863 282 HG SER 40 HG SER 40 -7.462 2.664 0.950 283 H LEU 41 H LEU 41 -5.006 5.847 -2.495 284 HA LEU 41 HA LEU 41 -4.849 4.513 -4.994 285 HB2 LEU 41 1HB LEU 41 -3.874 7.109 -3.903 286 HB3 LEU 41 2HB LEU 41 -3.231 6.537 -5.441 287 HG LEU 41 HG LEU 41 -6.139 7.066 -4.837 288 HD11 LEU 41 1HD1 LEU 41 -5.669 8.835 -6.673 289 HD12 LEU 41 2HD1 LEU 41 -3.989 8.658 -6.167 290 HD13 LEU 41 3HD1 LEU 41 -5.210 9.174 -5.005 291 HD21 LEU 41 1HD2 LEU 41 -5.973 5.304 -6.442 292 HD22 LEU 41 2HD2 LEU 41 -4.726 6.167 -7.341 293 HD23 LEU 41 3HD2 LEU 41 -6.377 6.787 -7.307 294 HA PRO 42 HA PRO 42 -0.106 4.295 -4.024 295 HB2 PRO 42 1HB PRO 42 0.625 4.680 -1.438 296 HB3 PRO 42 2HB PRO 42 0.518 5.997 -2.613 297 HG2 PRO 42 1HG PRO 42 -1.453 5.160 -0.520 298 HG3 PRO 42 2HG PRO 42 -0.932 6.793 -0.979 299 HD2 PRO 42 1HD PRO 42 -3.265 5.715 -1.832 300 HD3 PRO 42 2HD PRO 42 -2.327 6.859 -2.813 301 H VAL 43 H VAL 43 -2.406 3.221 -1.588 302 HA VAL 43 HA VAL 43 -0.891 0.901 -0.836 303 HB VAL 43 HB VAL 43 -3.827 1.391 -0.348 304 HG11 VAL 43 1HG1 VAL 43 -1.774 -0.467 0.780 305 HG12 VAL 43 2HG1 VAL 43 -3.155 0.034 1.759 306 HG13 VAL 43 3HG1 VAL 43 -3.416 -0.811 0.233 307 HG21 VAL 43 1HG2 VAL 43 -1.692 2.976 0.524 308 HG22 VAL 43 2HG2 VAL 43 -3.351 2.992 1.121 309 HG23 VAL 43 3HG2 VAL 43 -2.142 1.977 1.906 310 H LEU 44 H LEU 44 -3.638 1.565 -2.956 311 HA LEU 44 HA LEU 44 -4.056 -1.192 -3.627 312 HB2 LEU 44 1HB LEU 44 -5.076 1.391 -4.781 313 HB3 LEU 44 2HB LEU 44 -5.499 -0.183 -5.452 314 HG LEU 44 HG LEU 44 -6.069 0.592 -2.598 315 HD11 LEU 44 1HD1 LEU 44 -8.198 0.558 -4.669 316 HD12 LEU 44 2HD1 LEU 44 -7.161 1.978 -4.556 317 HD13 LEU 44 3HD1 LEU 44 -8.101 1.462 -3.157 318 HD21 LEU 44 1HD2 LEU 44 -5.986 -1.829 -3.235 319 HD22 LEU 44 2HD2 LEU 44 -7.323 -1.520 -4.342 320 HD23 LEU 44 3HD2 LEU 44 -7.541 -1.282 -2.608 321 H ASP 45 H ASP 45 -2.560 1.595 -5.233 322 HA ASP 45 HA ASP 45 -1.894 0.247 -7.626 323 HB2 ASP 45 1HB ASP 45 -0.809 2.733 -6.308 324 HB3 ASP 45 2HB ASP 45 -0.195 2.144 -7.850 325 H LEU 46 H LEU 46 -0.246 0.621 -4.546 326 HA LEU 46 HA LEU 46 2.296 -0.280 -5.295 327 HB2 LEU 46 1HB LEU 46 2.112 0.725 -3.191 328 HB3 LEU 46 2HB LEU 46 0.778 -0.321 -2.711 329 HG LEU 46 HG LEU 46 2.287 -2.188 -2.437 330 HD11 LEU 46 1HD1 LEU 46 4.277 -2.321 -3.408 331 HD12 LEU 46 2HD1 LEU 46 4.799 -0.800 -2.686 332 HD13 LEU 46 3HD1 LEU 46 3.918 -0.794 -4.213 333 HD21 LEU 46 1HD2 LEU 46 3.446 -1.456 -0.508 334 HD22 LEU 46 2HD2 LEU 46 1.990 -0.466 -0.616 335 HD23 LEU 46 3HD2 LEU 46 3.548 0.200 -1.109 336 H ILE 47 H ILE 47 -0.580 -2.052 -4.261 337 HA ILE 47 HA ILE 47 0.631 -4.603 -4.128 338 HB ILE 47 HB ILE 47 -2.265 -3.957 -4.697 339 HG12 ILE 47 1HG1 ILE 47 -1.137 -4.683 -2.009 340 HG13 ILE 47 2HG1 ILE 47 -1.114 -3.013 -2.562 341 HG21 ILE 47 1HG2 ILE 47 -1.437 -6.301 -5.168 342 HG22 ILE 47 2HG2 ILE 47 -1.137 -6.442 -3.436 343 HG23 ILE 47 3HG2 ILE 47 -2.775 -6.165 -4.027 344 HD11 ILE 47 1HD1 ILE 47 -3.097 -3.987 -1.125 345 HD12 ILE 47 2HD1 ILE 47 -3.365 -2.780 -2.382 346 HD13 ILE 47 3HD1 ILE 47 -3.682 -4.482 -2.713 347 H ASP 48 H ASP 48 -1.394 -3.121 -6.663 348 HA ASP 48 HA ASP 48 -1.230 -5.195 -8.516 349 HB2 ASP 48 1HB ASP 48 -2.835 -3.575 -9.010 350 HB3 ASP 48 2HB ASP 48 -1.710 -2.243 -8.760 351 H ALA 49 H ALA 49 0.823 -2.312 -8.182 352 HA ALA 49 HA ALA 49 2.487 -2.447 -10.287 353 HB1 ALA 49 1HB ALA 49 2.996 -0.758 -8.799 354 HB2 ALA 49 2HB ALA 49 3.045 -1.848 -7.413 355 HB3 ALA 49 3HB ALA 49 4.362 -1.852 -8.586 356 H ILE 50 H ILE 50 2.718 -4.525 -7.419 357 HA ILE 50 HA ILE 50 4.977 -5.976 -8.426 358 HB ILE 50 HB ILE 50 3.104 -6.752 -6.189 359 HG12 ILE 50 1HG1 ILE 50 5.748 -5.301 -5.989 360 HG13 ILE 50 2HG1 ILE 50 4.185 -4.493 -5.931 361 HG21 ILE 50 1HG2 ILE 50 4.629 -8.353 -5.556 362 HG22 ILE 50 2HG2 ILE 50 4.769 -8.424 -7.312 363 HG23 ILE 50 3HG2 ILE 50 5.973 -7.548 -6.368 364 HD11 ILE 50 1HD1 ILE 50 5.635 -5.811 -3.842 365 HD12 ILE 50 2HD1 ILE 50 4.186 -4.811 -3.745 366 HD13 ILE 50 3HD1 ILE 50 4.044 -6.544 -4.040 367 H GLN 51 H GLN 51 1.615 -6.966 -7.741 368 HA GLN 51 HA GLN 51 1.918 -9.070 -9.776 369 HB2 GLN 51 1HB GLN 51 1.407 -9.930 -7.558 370 HB3 GLN 51 2HB GLN 51 0.003 -8.877 -7.446 371 HG2 GLN 51 1HG GLN 51 -0.942 -10.896 -8.002 372 HG3 GLN 51 2HG GLN 51 -0.790 -10.113 -9.574 373 HE21 GLN 51 1HE2 GLN 51 0.438 -11.035 -11.114 374 HE22 GLN 51 2HE2 GLN 51 1.323 -12.504 -10.910 375 HA PRO 52 HA PRO 52 -0.839 -6.217 -11.976 376 HB2 PRO 52 1HB PRO 52 -0.298 -7.258 -14.425 377 HB3 PRO 52 2HB PRO 52 0.753 -6.082 -13.629 378 HG2 PRO 52 1HG PRO 52 1.024 -9.059 -13.793 379 HG3 PRO 52 2HG PRO 52 2.270 -7.809 -13.978 380 HD2 PRO 52 1HD PRO 52 1.943 -9.214 -11.685 381 HD3 PRO 52 2HD PRO 52 2.504 -7.530 -11.701 382 H GLY 53 H GLY 53 -2.951 -6.534 -12.333 383 HA2 GLY 53 1HA GLY 53 -4.662 -7.825 -13.534 384 HA3 GLY 53 2HA GLY 53 -3.852 -9.277 -12.965 385 H SER 54 H SER 54 -3.418 -8.279 -10.279 386 HA SER 54 HA SER 54 -5.708 -9.234 -9.024 387 HB2 SER 54 1HB SER 54 -4.757 -8.183 -6.950 388 HB3 SER 54 2HB SER 54 -3.609 -9.184 -7.840 389 HG SER 54 HG SER 54 -2.879 -7.173 -8.821 390 H ILE 55 H ILE 55 -4.596 -5.843 -8.958 391 HA ILE 55 HA ILE 55 -7.180 -4.900 -8.152 392 HB ILE 55 HB ILE 55 -4.840 -3.278 -9.157 393 HG12 ILE 55 1HG1 ILE 55 -4.279 -4.754 -7.219 394 HG13 ILE 55 2HG1 ILE 55 -4.155 -3.037 -6.857 395 HG21 ILE 55 1HG2 ILE 55 -6.388 -1.942 -7.196 396 HG22 ILE 55 2HG2 ILE 55 -6.162 -1.518 -8.892 397 HG23 ILE 55 3HG2 ILE 55 -7.491 -2.576 -8.418 398 HD11 ILE 55 1HD1 ILE 55 -6.679 -4.495 -6.239 399 HD12 ILE 55 2HD1 ILE 55 -5.285 -4.647 -5.168 400 HD13 ILE 55 3HD1 ILE 55 -5.992 -3.061 -5.477 401 H ASN 56 H ASN 56 -8.694 -3.780 -9.333 402 HA ASN 56 HA ASN 56 -8.238 -3.536 -12.225 403 HB2 ASN 56 1HB ASN 56 -9.691 -5.574 -11.367 404 HB3 ASN 56 2HB ASN 56 -10.946 -4.344 -11.253 405 HD21 ASN 56 1HD2 ASN 56 -12.236 -4.536 -12.929 406 HD22 ASN 56 2HD2 ASN 56 -11.745 -4.749 -14.572 407 H TYR 57 H TYR 57 -7.978 -1.314 -12.053 408 HA TYR 57 HA TYR 57 -9.327 0.539 -10.610 409 HB2 TYR 57 1HB TYR 57 -8.527 0.775 -13.518 410 HB3 TYR 57 2HB TYR 57 -8.947 2.132 -12.479 411 HD1 TYR 57 2HD TYR 57 -7.578 1.581 -9.997 412 HD2 TYR 57 1HD TYR 57 -6.266 0.899 -13.988 413 HE1 TYR 57 2HE TYR 57 -5.240 1.734 -9.249 414 HE2 TYR 57 1HE TYR 57 -3.925 1.049 -13.250 415 HH TYR 57 HH TYR 57 -2.634 2.023 -11.407 416 H ASP 58 H ASP 58 -10.485 -1.091 -13.508 417 HA ASP 58 HA ASP 58 -12.674 0.337 -14.235 418 HB2 ASP 58 1HB ASP 58 -11.774 -2.039 -14.982 419 HB3 ASP 58 2HB ASP 58 -13.059 -2.607 -13.918 420 H LEU 59 H LEU 59 -12.541 -1.995 -11.558 421 HA LEU 59 HA LEU 59 -15.247 -1.417 -10.750 422 HB2 LEU 59 1HB LEU 59 -13.229 -2.860 -9.071 423 HB3 LEU 59 2HB LEU 59 -14.978 -3.070 -9.125 424 HG LEU 59 HG LEU 59 -13.071 -3.904 -11.309 425 HD11 LEU 59 1HD1 LEU 59 -14.176 -6.182 -10.331 426 HD12 LEU 59 2HD1 LEU 59 -13.986 -5.230 -8.859 427 HD13 LEU 59 3HD1 LEU 59 -12.587 -5.563 -9.881 428 HD21 LEU 59 1HD2 LEU 59 -15.984 -3.725 -11.096 429 HD22 LEU 59 2HD2 LEU 59 -15.394 -5.301 -11.626 430 HD23 LEU 59 3HD2 LEU 59 -14.952 -3.847 -12.522 431 H LEU 60 H LEU 60 -12.015 -0.451 -9.810 432 HA LEU 60 HA LEU 60 -12.679 0.749 -7.340 433 HB2 LEU 60 1HB LEU 60 -10.437 1.488 -9.215 434 HB3 LEU 60 2HB LEU 60 -10.533 1.854 -7.494 435 HG LEU 60 HG LEU 60 -10.239 -0.892 -8.711 436 HD11 LEU 60 1HD1 LEU 60 -8.049 -0.635 -7.281 437 HD12 LEU 60 2HD1 LEU 60 -8.330 1.082 -7.565 438 HD13 LEU 60 3HD1 LEU 60 -8.138 -0.017 -8.931 439 HD21 LEU 60 1HD2 LEU 60 -11.337 -1.382 -6.769 440 HD22 LEU 60 2HD2 LEU 60 -10.767 0.071 -5.947 441 HD23 LEU 60 3HD2 LEU 60 -9.681 -1.302 -6.164 442 H LYS 61 H LYS 61 -12.561 3.097 -6.892 443 HA LYS 61 HA LYS 61 -14.100 4.568 -8.909 444 HB2 LYS 61 1HB LYS 61 -13.913 4.658 -5.941 445 HB3 LYS 61 2HB LYS 61 -14.251 6.171 -6.773 446 HG2 LYS 61 1HG LYS 61 -16.365 5.386 -6.345 447 HG3 LYS 61 2HG LYS 61 -16.089 4.789 -7.984 448 HD2 LYS 61 1HD LYS 61 -15.159 2.683 -6.720 449 HD3 LYS 61 2HD LYS 61 -16.156 3.298 -5.399 450 HE2 LYS 61 1HE LYS 61 -18.113 3.274 -6.857 451 HE3 LYS 61 2HE LYS 61 -17.120 2.695 -8.194 452 HZ1 LYS 61 1HZ LYS 61 -16.566 0.785 -6.574 453 HZ2 LYS 61 2HZ LYS 61 -18.050 0.768 -7.385 454 HZ3 LYS 61 3HZ LYS 61 -17.975 1.263 -5.769 455 H THR 62 H THR 62 -11.553 5.267 -6.508 456 HA THR 62 HA THR 62 -9.888 6.833 -6.490 457 HB THR 62 HB THR 62 -8.422 6.841 -8.411 458 HG1 THR 62 1HG THR 62 -9.078 6.036 -10.391 459 HG21 THR 62 1HG2 THR 62 -8.353 4.834 -7.048 460 HG22 THR 62 2HG2 THR 62 -8.112 4.409 -8.744 461 HG23 THR 62 3HG2 THR 62 -9.675 4.129 -7.976 462 H GLU 63 H GLU 63 -12.536 7.878 -6.953 463 HA GLU 63 HA GLU 63 -11.772 10.402 -8.218 464 HB2 GLU 63 1HB GLU 63 -14.042 10.500 -9.312 465 HB3 GLU 63 2HB GLU 63 -12.920 9.339 -10.008 466 HG2 GLU 63 1HG GLU 63 -14.026 7.546 -8.736 467 HG3 GLU 63 2HG GLU 63 -15.184 8.724 -8.123 468 H ASN 64 H ASN 64 -12.021 11.883 -6.691 469 HA ASN 64 HA ASN 64 -12.709 12.797 -4.680 470 HB2 ASN 64 1HB ASN 64 -14.969 13.733 -4.887 471 HB3 ASN 64 2HB ASN 64 -14.076 13.894 -6.397 472 HD21 ASN 64 1HD2 ASN 64 -14.512 12.308 -8.073 473 HD22 ASN 64 2HD2 ASN 64 -16.099 11.639 -8.200 474 H LEU 65 H LEU 65 -12.574 9.984 -4.439 475 HA LEU 65 HA LEU 65 -14.696 8.561 -3.555 476 HB2 LEU 65 1HB LEU 65 -11.948 8.741 -2.342 477 HB3 LEU 65 2HB LEU 65 -13.138 7.532 -1.865 478 HG LEU 65 HG LEU 65 -12.396 7.733 -4.742 479 HD11 LEU 65 1HD1 LEU 65 -10.219 7.562 -4.188 480 HD12 LEU 65 2HD1 LEU 65 -10.641 5.874 -3.905 481 HD13 LEU 65 3HD1 LEU 65 -10.566 7.001 -2.551 482 HD21 LEU 65 1HD2 LEU 65 -12.659 5.242 -4.498 483 HD22 LEU 65 2HD2 LEU 65 -14.117 6.191 -4.211 484 HD23 LEU 65 3HD2 LEU 65 -13.207 5.538 -2.849 485 H ASN 66 H ASN 66 -15.759 8.221 -1.564 486 HA ASN 66 HA ASN 66 -15.517 10.410 0.385 487 HB2 ASN 66 1HB ASN 66 -18.089 10.089 0.636 488 HB3 ASN 66 2HB ASN 66 -17.475 11.051 -0.705 489 HD21 ASN 66 1HD2 ASN 66 -19.070 8.147 0.241 490 HD22 ASN 66 2HD2 ASN 66 -19.486 7.605 -1.346 491 H ASP 67 H ASP 67 -16.498 9.877 2.507 492 HA ASP 67 HA ASP 67 -15.423 7.818 3.810 493 HB2 ASP 67 1HB ASP 67 -18.248 8.806 4.253 494 HB3 ASP 67 2HB ASP 67 -17.305 7.880 5.418 495 H ASP 68 H ASP 68 -18.249 7.592 1.748 496 HA ASP 68 HA ASP 68 -18.901 4.903 2.459 497 HB2 ASP 68 1HB ASP 68 -20.363 6.765 1.317 498 HB3 ASP 68 2HB ASP 68 -19.687 6.102 -0.169 499 H GLU 69 H GLU 69 -17.715 6.218 -0.640 500 HA GLU 69 HA GLU 69 -16.983 3.780 -1.760 501 HB2 GLU 69 1HB GLU 69 -15.661 6.452 -2.252 502 HB3 GLU 69 2HB GLU 69 -15.639 5.062 -3.329 503 HG2 GLU 69 1HG GLU 69 -18.240 6.278 -2.514 504 HG3 GLU 69 2HG GLU 69 -17.269 7.023 -3.782 505 H LYS 70 H LYS 70 -14.886 6.150 -0.119 506 HA LYS 70 HA LYS 70 -12.460 4.999 -0.220 507 HB2 LYS 70 1HB LYS 70 -13.747 6.146 2.265 508 HB3 LYS 70 2HB LYS 70 -12.021 5.875 2.062 509 HG2 LYS 70 1HG LYS 70 -12.154 7.412 0.055 510 HG3 LYS 70 2HG LYS 70 -13.775 7.832 0.611 511 HD2 LYS 70 1HD LYS 70 -12.947 8.736 2.637 512 HD3 LYS 70 2HD LYS 70 -11.347 8.037 2.377 513 HE2 LYS 70 1HE LYS 70 -10.802 9.588 0.732 514 HE3 LYS 70 2HE LYS 70 -12.489 10.000 0.425 515 HZ1 LYS 70 1HZ LYS 70 -11.893 10.599 3.097 516 HZ2 LYS 70 2HZ LYS 70 -12.312 11.662 1.851 517 HZ3 LYS 70 3HZ LYS 70 -10.687 11.283 2.127 518 H LEU 71 H LEU 71 -14.984 4.068 2.110 519 HA LEU 71 HA LEU 71 -13.634 2.106 3.497 520 HB2 LEU 71 1HB LEU 71 -15.828 2.844 4.152 521 HB3 LEU 71 2HB LEU 71 -16.529 2.201 2.669 522 HG LEU 71 HG LEU 71 -15.947 -0.086 3.454 523 HD11 LEU 71 1HD1 LEU 71 -15.264 -0.468 5.710 524 HD12 LEU 71 2HD1 LEU 71 -15.349 1.254 6.083 525 HD13 LEU 71 3HD1 LEU 71 -14.115 0.652 4.976 526 HD21 LEU 71 1HD2 LEU 71 -18.064 -0.074 4.112 527 HD22 LEU 71 2HD2 LEU 71 -17.994 1.666 4.394 528 HD23 LEU 71 3HD2 LEU 71 -17.556 0.545 5.684 529 H ASN 72 H ASN 72 -15.810 1.501 0.731 530 HA ASN 72 HA ASN 72 -15.312 -1.167 0.357 531 HB2 ASN 72 1HB ASN 72 -15.759 0.936 -1.773 532 HB3 ASN 72 2HB ASN 72 -15.901 -0.800 -2.030 533 HD21 ASN 72 1HD2 ASN 72 -17.288 1.996 -0.491 534 HD22 ASN 72 2HD2 ASN 72 -18.830 1.292 -0.154 535 H ASN 73 H ASN 73 -13.393 1.569 -0.789 536 HA ASN 73 HA ASN 73 -11.567 0.033 -2.322 537 HB2 ASN 73 1HB ASN 73 -11.554 2.822 -1.210 538 HB3 ASN 73 2HB ASN 73 -10.102 2.159 -1.954 539 HD21 ASN 73 1HD2 ASN 73 -10.470 3.988 -3.423 540 HD22 ASN 73 2HD2 ASN 73 -11.515 3.751 -4.779 541 H ALA 74 H ALA 74 -11.548 1.223 1.006 542 HA ALA 74 HA ALA 74 -8.924 0.436 1.657 543 HB1 ALA 74 1HB ALA 74 -11.365 0.893 3.355 544 HB2 ALA 74 2HB ALA 74 -9.782 0.506 4.030 545 HB3 ALA 74 3HB ALA 74 -10.003 1.980 3.089 546 H LYS 75 H LYS 75 -12.036 -1.232 2.018 547 HA LYS 75 HA LYS 75 -11.019 -3.533 3.294 548 HB2 LYS 75 1HB LYS 75 -13.509 -3.079 1.648 549 HB3 LYS 75 2HB LYS 75 -13.160 -4.598 2.464 550 HG2 LYS 75 1HG LYS 75 -13.577 -3.748 4.530 551 HG3 LYS 75 2HG LYS 75 -13.066 -2.118 4.085 552 HD2 LYS 75 1HD LYS 75 -15.329 -1.803 4.248 553 HD3 LYS 75 2HD LYS 75 -15.199 -2.235 2.541 554 HE2 LYS 75 1HE LYS 75 -17.016 -3.469 3.517 555 HE3 LYS 75 2HE LYS 75 -15.702 -4.586 3.152 556 HZ1 LYS 75 1HZ LYS 75 -16.952 -4.532 5.484 557 HZ2 LYS 75 2HZ LYS 75 -15.710 -3.436 5.823 558 HZ3 LYS 75 3HZ LYS 75 -15.337 -5.008 5.321 559 H TYR 76 H TYR 76 -11.557 -2.740 -0.110 560 HA TYR 76 HA TYR 76 -10.941 -5.286 -1.154 561 HB2 TYR 76 1HB TYR 76 -12.063 -3.293 -2.327 562 HB3 TYR 76 2HB TYR 76 -10.429 -2.698 -2.608 563 HD1 TYR 76 1HD TYR 76 -12.342 -5.893 -2.996 564 HD2 TYR 76 2HD TYR 76 -9.486 -3.204 -4.645 565 HE1 TYR 76 1HE TYR 76 -12.179 -7.306 -5.002 566 HE2 TYR 76 2HE TYR 76 -9.315 -4.609 -6.656 567 HH TYR 76 HH TYR 76 -10.915 -7.726 -6.860 568 H ALA 77 H ALA 77 -8.947 -2.427 -0.536 569 HA ALA 77 HA ALA 77 -6.566 -3.317 -1.686 570 HB1 ALA 77 1HB ALA 77 -6.168 -1.195 -1.126 571 HB2 ALA 77 2HB ALA 77 -7.371 -1.220 0.163 572 HB3 ALA 77 3HB ALA 77 -5.740 -1.818 0.468 573 H ILE 78 H ILE 78 -7.460 -3.418 1.771 574 HA ILE 78 HA ILE 78 -5.290 -4.954 2.620 575 HB ILE 78 HB ILE 78 -8.068 -4.849 3.801 576 HG12 ILE 78 1HG1 ILE 78 -5.607 -3.329 4.667 577 HG13 ILE 78 2HG1 ILE 78 -6.783 -2.669 3.538 578 HG21 ILE 78 1HG2 ILE 78 -7.390 -6.352 5.284 579 HG22 ILE 78 2HG2 ILE 78 -5.834 -6.473 4.465 580 HG23 ILE 78 3HG2 ILE 78 -6.063 -5.291 5.753 581 HD11 ILE 78 1HD1 ILE 78 -7.336 -3.520 6.369 582 HD12 ILE 78 2HD1 ILE 78 -7.184 -1.862 5.785 583 HD13 ILE 78 3HD1 ILE 78 -8.523 -2.872 5.239 584 H SER 79 H SER 79 -8.522 -5.958 1.561 585 HA SER 79 HA SER 79 -8.320 -8.680 2.088 586 HB2 SER 79 1HB SER 79 -9.925 -7.015 0.213 587 HB3 SER 79 2HB SER 79 -9.877 -8.753 -0.085 588 HG SER 79 HG SER 79 -10.488 -8.972 2.186 589 H MET 80 H MET 80 -7.422 -6.891 -0.846 590 HA MET 80 HA MET 80 -6.581 -9.105 -2.353 591 HB2 MET 80 1HB MET 80 -6.997 -6.681 -3.111 592 HB3 MET 80 2HB MET 80 -5.348 -6.369 -2.584 593 HG2 MET 80 1HG MET 80 -5.483 -6.800 -4.982 594 HG3 MET 80 2HG MET 80 -4.502 -8.003 -4.148 595 HE1 MET 80 1HE MET 80 -8.799 -8.653 -5.626 596 HE2 MET 80 2HE MET 80 -8.152 -7.207 -4.851 597 HE3 MET 80 3HE MET 80 -7.726 -7.579 -6.523 598 H ALA 81 H ALA 81 -4.737 -6.878 -0.284 599 HA ALA 81 HA ALA 81 -2.184 -7.763 -0.666 600 HB1 ALA 81 1HB ALA 81 -2.215 -6.020 0.790 601 HB2 ALA 81 2HB ALA 81 -3.624 -6.627 1.661 602 HB3 ALA 81 3HB ALA 81 -2.035 -7.335 1.953 603 H ARG 82 H ARG 82 -4.532 -9.141 1.632 604 HA ARG 82 HA ARG 82 -2.812 -11.256 2.450 605 HB2 ARG 82 1HB ARG 82 -4.643 -10.426 3.865 606 HB3 ARG 82 2HB ARG 82 -5.815 -11.000 2.687 607 HG2 ARG 82 1HG ARG 82 -4.603 -13.301 3.101 608 HG3 ARG 82 2HG ARG 82 -4.167 -12.530 4.627 609 HD2 ARG 82 1HD ARG 82 -6.998 -12.539 3.637 610 HD3 ARG 82 2HD ARG 82 -6.336 -13.912 4.524 611 HE ARG 82 HE ARG 82 -5.742 -11.842 6.134 612 HH11 ARG 82 1HH1 ARG 82 -8.689 -12.825 4.564 613 HH12 ARG 82 2HH1 ARG 82 -9.717 -12.177 5.798 614 HH21 ARG 82 1HH2 ARG 82 -7.085 -10.983 7.766 615 HH22 ARG 82 2HH2 ARG 82 -8.804 -11.128 7.619 616 H LYS 83 H LYS 83 -5.188 -10.867 -0.079 617 HA LYS 83 HA LYS 83 -5.679 -13.536 -0.721 618 HB2 LYS 83 1HB LYS 83 -6.644 -11.256 -1.666 619 HB3 LYS 83 2HB LYS 83 -5.432 -11.522 -2.911 620 HG2 LYS 83 1HG LYS 83 -7.269 -12.527 -3.841 621 HG3 LYS 83 2HG LYS 83 -6.494 -13.898 -3.044 622 HD2 LYS 83 1HD LYS 83 -8.051 -13.924 -1.308 623 HD3 LYS 83 2HD LYS 83 -8.574 -12.268 -1.627 624 HE2 LYS 83 1HE LYS 83 -9.652 -12.969 -3.675 625 HE3 LYS 83 2HE LYS 83 -9.042 -14.610 -3.471 626 HZ1 LYS 83 1HZ LYS 83 -11.000 -13.218 -1.727 627 HZ2 LYS 83 2HZ LYS 83 -10.340 -14.740 -1.395 628 HZ3 LYS 83 3HZ LYS 83 -11.312 -14.521 -2.762 629 H ILE 84 H ILE 84 -3.284 -11.330 -2.179 630 HA ILE 84 HA ILE 84 -2.047 -13.306 -3.770 631 HB ILE 84 HB ILE 84 -0.163 -11.698 -3.959 632 HG12 ILE 84 1HG1 ILE 84 -1.795 -9.813 -2.273 633 HG13 ILE 84 2HG1 ILE 84 -0.561 -10.844 -1.556 634 HG21 ILE 84 1HG2 ILE 84 -2.078 -9.745 -4.521 635 HG22 ILE 84 2HG2 ILE 84 -1.442 -10.965 -5.622 636 HG23 ILE 84 3HG2 ILE 84 -2.913 -11.287 -4.704 637 HD11 ILE 84 1HD1 ILE 84 -0.292 -8.406 -3.130 638 HD12 ILE 84 2HD1 ILE 84 0.811 -9.139 -1.964 639 HD13 ILE 84 3HD1 ILE 84 0.787 -9.707 -3.633 640 H GLY 85 H GLY 85 -1.803 -12.545 -0.425 641 HA2 GLY 85 1HA GLY 85 -0.814 -14.370 0.928 642 HA3 GLY 85 2HA GLY 85 0.527 -14.352 -0.207 643 H ALA 86 H ALA 86 -1.214 -11.776 1.533 644 HA ALA 86 HA ALA 86 1.359 -10.979 2.726 645 HB1 ALA 86 1HB ALA 86 1.079 -8.767 2.193 646 HB2 ALA 86 2HB ALA 86 0.351 -9.534 0.782 647 HB3 ALA 86 3HB ALA 86 -0.675 -8.905 2.070 648 H ARG 87 H ARG 87 0.907 -11.945 4.700 649 HA ARG 87 HA ARG 87 -1.493 -11.809 6.109 650 HB2 ARG 87 1HB ARG 87 1.347 -12.328 6.824 651 HB3 ARG 87 2HB ARG 87 0.241 -11.960 8.140 652 HG2 ARG 87 1HG ARG 87 -0.601 -14.004 6.164 653 HG3 ARG 87 2HG ARG 87 0.672 -14.432 7.308 654 HD2 ARG 87 1HD ARG 87 -1.455 -15.073 8.228 655 HD3 ARG 87 2HD ARG 87 -0.813 -13.718 9.157 656 HE ARG 87 HE ARG 87 -2.637 -13.012 7.022 657 HH11 ARG 87 1HH1 ARG 87 -2.241 -13.754 10.401 658 HH12 ARG 87 2HH1 ARG 87 -3.708 -12.968 10.880 659 HH21 ARG 87 1HH2 ARG 87 -4.572 -11.974 7.640 660 HH22 ARG 87 2HH2 ARG 87 -5.035 -11.958 9.309 661 H VAL 88 H VAL 88 -2.467 -9.841 6.232 662 HA VAL 88 HA VAL 88 -0.967 -7.686 7.575 663 HB VAL 88 HB VAL 88 -3.297 -7.472 5.664 664 HG11 VAL 88 1HG1 VAL 88 -1.880 -5.386 7.305 665 HG12 VAL 88 2HG1 VAL 88 -2.849 -4.996 5.882 666 HG13 VAL 88 3HG1 VAL 88 -3.601 -5.767 7.279 667 HG21 VAL 88 1HG2 VAL 88 -1.626 -7.601 4.170 668 HG22 VAL 88 2HG2 VAL 88 -1.280 -5.942 4.660 669 HG23 VAL 88 3HG2 VAL 88 -0.385 -7.279 5.381 670 H TYR 89 H TYR 89 -1.792 -6.768 9.385 671 HA TYR 89 HA TYR 89 -4.376 -7.807 10.349 672 HB2 TYR 89 1HB TYR 89 -2.308 -8.621 11.571 673 HB3 TYR 89 2HB TYR 89 -2.069 -6.961 12.105 674 HD1 TYR 89 2HD TYR 89 -4.537 -9.746 12.172 675 HD2 TYR 89 1HD TYR 89 -3.147 -6.175 14.024 676 HE1 TYR 89 2HE TYR 89 -6.053 -10.145 14.066 677 HE2 TYR 89 1HE TYR 89 -4.660 -6.566 15.923 678 HH TYR 89 HH TYR 89 -7.196 -8.680 15.849 679 H ALA 90 H ALA 90 -4.794 -5.713 8.926 680 HA ALA 90 HA ALA 90 -4.980 -3.463 10.820 681 HB1 ALA 90 1HB ALA 90 -3.839 -3.537 8.151 682 HB2 ALA 90 2HB ALA 90 -5.082 -2.298 8.321 683 HB3 ALA 90 3HB ALA 90 -3.695 -2.310 9.410 684 H LEU 91 H LEU 91 -6.714 -1.847 10.036 685 HA LEU 91 HA LEU 91 -9.062 -3.363 9.098 686 HB2 LEU 91 1HB LEU 91 -8.966 -2.659 11.559 687 HB3 LEU 91 2HB LEU 91 -9.202 -1.017 10.966 688 HG LEU 91 HG LEU 91 -11.333 -1.816 9.899 689 HD11 LEU 91 1HD1 LEU 91 -11.087 -4.192 11.713 690 HD12 LEU 91 2HD1 LEU 91 -10.582 -4.254 10.025 691 HD13 LEU 91 3HD1 LEU 91 -12.260 -3.895 10.429 692 HD21 LEU 91 1HD2 LEU 91 -11.088 -0.652 12.155 693 HD22 LEU 91 2HD2 LEU 91 -11.342 -2.245 12.872 694 HD23 LEU 91 3HD2 LEU 91 -12.591 -1.525 11.855 695 HA PRO 92 HA PRO 92 -9.311 -0.363 5.871 696 HB2 PRO 92 1HB PRO 92 -11.867 -0.851 5.096 697 HB3 PRO 92 2HB PRO 92 -10.525 -1.938 4.720 698 HG2 PRO 92 1HG PRO 92 -12.573 -2.140 6.894 699 HG3 PRO 92 2HG PRO 92 -11.940 -3.410 5.833 700 HD2 PRO 92 1HD PRO 92 -11.081 -3.078 8.379 701 HD3 PRO 92 2HD PRO 92 -10.024 -3.678 7.085 702 H GLU 93 H GLU 93 -11.333 -0.378 8.664 703 HA GLU 93 HA GLU 93 -12.866 1.945 8.056 704 HB2 GLU 93 1HB GLU 93 -12.372 0.276 10.471 705 HB3 GLU 93 2HB GLU 93 -12.996 1.901 10.719 706 HG2 GLU 93 1HG GLU 93 -14.297 -0.016 8.818 707 HG3 GLU 93 2HG GLU 93 -14.677 -0.003 10.540 708 H ASP 94 H ASP 94 -9.756 1.370 9.550 709 HA ASP 94 HA ASP 94 -9.483 4.123 10.416 710 HB2 ASP 94 1HB ASP 94 -7.482 3.465 11.459 711 HB3 ASP 94 2HB ASP 94 -8.529 2.057 11.618 712 H LEU 95 H LEU 95 -8.322 2.038 7.836 713 HA LEU 95 HA LEU 95 -6.302 3.643 6.792 714 HB2 LEU 95 1HB LEU 95 -6.587 1.405 6.013 715 HB3 LEU 95 2HB LEU 95 -8.218 1.753 5.442 716 HG LEU 95 HG LEU 95 -7.263 3.225 3.706 717 HD11 LEU 95 1HD1 LEU 95 -5.103 3.505 5.173 718 HD12 LEU 95 2HD1 LEU 95 -5.024 3.595 3.414 719 HD13 LEU 95 3HD1 LEU 95 -4.556 2.111 4.242 720 HD21 LEU 95 1HD2 LEU 95 -6.502 1.478 2.266 721 HD22 LEU 95 2HD2 LEU 95 -7.746 0.805 3.322 722 HD23 LEU 95 3HD2 LEU 95 -6.042 0.471 3.640 723 H VAL 96 H VAL 96 -9.775 3.622 6.041 724 HA VAL 96 HA VAL 96 -9.889 5.455 4.007 725 HB VAL 96 HB VAL 96 -11.799 5.103 6.316 726 HG11 VAL 96 1HG1 VAL 96 -13.440 6.190 4.687 727 HG12 VAL 96 2HG1 VAL 96 -12.304 7.252 5.522 728 HG13 VAL 96 3HG1 VAL 96 -12.014 6.793 3.844 729 HG21 VAL 96 1HG2 VAL 96 -12.775 3.455 5.129 730 HG22 VAL 96 2HG2 VAL 96 -12.518 4.270 3.586 731 HG23 VAL 96 3HG2 VAL 96 -11.204 3.361 4.332 732 H GLU 97 H GLU 97 -9.325 6.043 7.409 733 HA GLU 97 HA GLU 97 -9.297 8.940 6.917 734 HB2 GLU 97 1HB GLU 97 -9.317 7.434 9.537 735 HB3 GLU 97 2HB GLU 97 -9.363 9.182 9.362 736 HG2 GLU 97 1HG GLU 97 -11.502 8.906 8.090 737 HG3 GLU 97 2HG GLU 97 -11.474 7.204 8.549 738 H VAL 98 H VAL 98 -7.179 7.208 6.006 739 HA VAL 98 HA VAL 98 -4.910 6.826 6.208 740 HB VAL 98 HB VAL 98 -5.004 9.783 6.822 741 HG11 VAL 98 1HG1 VAL 98 -2.787 9.851 6.526 742 HG12 VAL 98 2HG1 VAL 98 -2.831 8.107 6.793 743 HG13 VAL 98 3HG1 VAL 98 -2.846 8.750 5.150 744 HG21 VAL 98 1HG2 VAL 98 -6.138 8.568 4.659 745 HG22 VAL 98 2HG2 VAL 98 -5.538 10.226 4.688 746 HG23 VAL 98 3HG2 VAL 98 -4.517 8.930 4.064 747 H ASN 99 H ASN 99 -5.820 5.831 8.462 748 HA ASN 99 HA ASN 99 -4.613 7.146 10.753 749 HB2 ASN 99 1HB ASN 99 -6.852 5.732 10.618 750 HB3 ASN 99 2HB ASN 99 -5.750 4.389 10.913 751 HD21 ASN 99 1HD2 ASN 99 -7.656 4.875 12.729 752 HD22 ASN 99 2HD2 ASN 99 -6.979 5.556 14.165 753 HA PRO 100 HA PRO 100 -0.810 4.914 9.880 754 HB2 PRO 100 1HB PRO 100 0.657 6.229 11.748 755 HB3 PRO 100 2HB PRO 100 0.282 6.917 10.164 756 HG2 PRO 100 1HG PRO 100 -1.037 7.411 12.806 757 HG3 PRO 100 2HG PRO 100 -0.591 8.573 11.543 758 HD2 PRO 100 1HD PRO 100 -3.122 7.662 11.855 759 HD3 PRO 100 2HD PRO 100 -2.452 8.096 10.269 760 H LYS 101 H LYS 101 -2.874 4.834 12.517 761 HA LYS 101 HA LYS 101 -1.289 3.470 14.429 762 HB2 LYS 101 1HB LYS 101 -4.288 3.416 14.047 763 HB3 LYS 101 2HB LYS 101 -3.428 2.884 15.485 764 HG2 LYS 101 1HG LYS 101 -3.402 5.697 14.411 765 HG3 LYS 101 2HG LYS 101 -4.436 5.120 15.721 766 HD2 LYS 101 1HD LYS 101 -2.214 4.363 16.815 767 HD3 LYS 101 2HD LYS 101 -1.461 5.480 15.674 768 HE2 LYS 101 1HE LYS 101 -1.780 6.828 17.520 769 HE3 LYS 101 2HE LYS 101 -3.228 7.164 16.573 770 HZ1 LYS 101 1HZ LYS 101 -4.535 6.276 18.129 771 HZ2 LYS 101 2HZ LYS 101 -3.206 6.420 19.166 772 HZ3 LYS 101 3HZ LYS 101 -3.516 4.950 18.389 773 H MET 102 H MET 102 -3.395 2.380 11.810 774 HA MET 102 HA MET 102 -2.615 -0.396 12.368 775 HB2 MET 102 1HB MET 102 -4.869 0.764 10.730 776 HB3 MET 102 2HB MET 102 -4.467 -0.948 10.742 777 HG2 MET 102 1HG MET 102 -4.933 0.398 13.345 778 HG3 MET 102 2HG MET 102 -6.323 0.066 12.314 779 HE1 MET 102 1HE MET 102 -3.376 -1.142 14.233 780 HE2 MET 102 2HE MET 102 -3.659 -2.852 14.558 781 HE3 MET 102 3HE MET 102 -2.986 -2.348 13.007 782 H VAL 103 H VAL 103 -2.511 2.129 9.945 783 HA VAL 103 HA VAL 103 -1.707 0.671 7.717 784 HB VAL 103 HB VAL 103 -0.830 3.457 8.495 785 HG11 VAL 103 1HG1 VAL 103 -0.480 3.779 6.083 786 HG12 VAL 103 2HG1 VAL 103 0.577 2.529 6.745 787 HG13 VAL 103 3HG1 VAL 103 -0.851 2.077 5.812 788 HG21 VAL 103 1HG2 VAL 103 -2.765 4.289 7.618 789 HG22 VAL 103 2HG2 VAL 103 -2.986 2.928 6.519 790 HG23 VAL 103 3HG2 VAL 103 -3.367 2.749 8.231 791 H MET 104 H MET 104 -0.028 1.294 10.631 792 HA MET 104 HA MET 104 2.629 1.336 9.870 793 HB2 MET 104 1HB MET 104 3.147 0.864 12.070 794 HB3 MET 104 2HB MET 104 1.500 1.458 12.228 795 HG2 MET 104 1HG MET 104 2.222 -1.454 12.041 796 HG3 MET 104 2HG MET 104 2.014 -0.582 13.557 797 HE1 MET 104 1HE MET 104 0.762 -2.615 13.923 798 HE2 MET 104 2HE MET 104 -0.920 -2.213 14.268 799 HE3 MET 104 3HE MET 104 -0.523 -3.232 12.883 800 H THR 105 H THR 105 0.403 -1.362 10.030 801 HA THR 105 HA THR 105 2.538 -3.253 9.379 802 HB THR 105 HB THR 105 0.607 -4.941 9.528 803 HG1 THR 105 1HG THR 105 -1.274 -3.981 9.705 804 HG21 THR 105 1HG2 THR 105 0.622 -4.823 12.057 805 HG22 THR 105 2HG2 THR 105 1.574 -3.348 11.895 806 HG23 THR 105 3HG2 THR 105 2.204 -4.877 11.282 807 H VAL 106 H VAL 106 -0.518 -2.019 8.077 808 HA VAL 106 HA VAL 106 -0.985 -3.491 5.882 809 HB VAL 106 HB VAL 106 -0.950 -0.471 5.959 810 HG11 VAL 106 1HG1 VAL 106 -2.769 -0.875 4.142 811 HG12 VAL 106 2HG1 VAL 106 -1.062 -0.900 3.692 812 HG13 VAL 106 3HG1 VAL 106 -1.939 -2.415 3.916 813 HG21 VAL 106 1HG2 VAL 106 -3.081 -0.531 6.799 814 HG22 VAL 106 2HG2 VAL 106 -3.422 -2.125 6.125 815 HG23 VAL 106 3HG2 VAL 106 -2.408 -1.973 7.560 816 H PHE 107 H PHE 107 1.578 -1.065 6.165 817 HA PHE 107 HA PHE 107 2.535 -1.653 3.484 818 HB2 PHE 107 1HB PHE 107 3.190 0.383 5.574 819 HB3 PHE 107 2HB PHE 107 4.385 0.029 4.330 820 HD1 PHE 107 2HD PHE 107 3.036 -0.236 1.895 821 HD2 PHE 107 1HD PHE 107 2.054 2.319 5.153 822 HE1 PHE 107 2HE PHE 107 1.877 1.284 0.347 823 HE2 PHE 107 1HE PHE 107 0.890 3.844 3.611 824 HZ PHE 107 HZ PHE 107 0.802 3.328 1.205 825 H ALA 108 H ALA 108 3.630 -1.988 6.837 826 HA ALA 108 HA ALA 108 6.160 -2.892 6.620 827 HB1 ALA 108 1HB ALA 108 4.370 -2.872 8.626 828 HB2 ALA 108 2HB ALA 108 4.480 -4.607 8.332 829 HB3 ALA 108 3HB ALA 108 5.932 -3.684 8.721 830 H CYS 109 H CYS 109 3.253 -4.784 5.920 831 HA CYS 109 HA CYS 109 4.626 -7.213 5.387 832 HB2 CYS 109 1HB CYS 109 2.071 -6.702 5.860 833 HB3 CYS 109 2HB CYS 109 1.996 -6.614 4.104 834 HG CYS 109 HG CYS 109 2.564 -9.187 3.595 835 H LEU 110 H LEU 110 3.614 -4.489 3.405 836 HA LEU 110 HA LEU 110 4.294 -5.740 0.918 837 HB2 LEU 110 1HB LEU 110 3.847 -2.832 1.574 838 HB3 LEU 110 2HB LEU 110 3.944 -3.518 -0.047 839 HG LEU 110 HG LEU 110 1.841 -4.422 1.892 840 HD11 LEU 110 1HD1 LEU 110 2.109 -1.784 0.942 841 HD12 LEU 110 2HD1 LEU 110 0.735 -2.506 1.777 842 HD13 LEU 110 3HD1 LEU 110 0.810 -2.535 0.014 843 HD21 LEU 110 1HD2 LEU 110 0.771 -4.456 -0.592 844 HD22 LEU 110 2HD2 LEU 110 1.598 -5.825 0.152 845 HD23 LEU 110 3HD2 LEU 110 2.468 -4.766 -0.959 846 H MET 111 H MET 111 5.714 -2.959 2.652 847 HA MET 111 HA MET 111 8.005 -2.716 1.100 848 HB2 MET 111 1HB MET 111 8.895 -1.356 2.829 849 HB3 MET 111 2HB MET 111 7.154 -1.110 2.863 850 HG2 MET 111 1HG MET 111 7.701 -1.311 5.096 851 HG3 MET 111 2HG MET 111 7.142 -2.928 4.675 852 HE1 MET 111 1HE MET 111 11.288 -1.383 5.502 853 HE2 MET 111 2HE MET 111 11.173 -1.810 3.794 854 HE3 MET 111 3HE MET 111 10.044 -0.647 4.492 855 H GLY 112 H GLY 112 7.251 -4.958 3.662 856 HA2 GLY 112 1HA GLY 112 9.581 -5.857 4.648 857 HA3 GLY 112 2HA GLY 112 8.313 -6.964 4.146 858 H LYS 113 H LYS 113 8.446 -6.488 1.361 859 HA LYS 113 HA LYS 113 10.334 -8.345 0.556 860 HB2 LYS 113 1HB LYS 113 8.312 -7.450 -0.728 861 HB3 LYS 113 2HB LYS 113 9.350 -6.121 -1.224 862 HG2 LYS 113 1HG LYS 113 10.317 -8.897 -1.655 863 HG3 LYS 113 2HG LYS 113 9.051 -8.269 -2.713 864 HD2 LYS 113 1HD LYS 113 10.421 -6.575 -3.545 865 HD3 LYS 113 2HD LYS 113 11.543 -6.686 -2.188 866 HE2 LYS 113 1HE LYS 113 11.884 -9.129 -3.126 867 HE3 LYS 113 2HE LYS 113 11.316 -8.387 -4.621 868 HZ1 LYS 113 1HZ LYS 113 13.538 -7.260 -3.021 869 HZ2 LYS 113 2HZ LYS 113 13.102 -6.874 -4.608 870 HZ3 LYS 113 3HZ LYS 113 13.786 -8.382 -4.262 871 H GLY 114 H GLY 114 10.558 -4.803 0.553 872 HA2 GLY 114 1HA GLY 114 13.000 -4.501 -0.731 873 HA3 GLY 114 2HA GLY 114 12.385 -3.414 0.505 874 H MET 115 H MET 115 12.380 -5.114 2.710 875 HA MET 115 HA MET 115 14.943 -4.842 3.699 876 HB2 MET 115 1HB MET 115 12.576 -6.474 4.489 877 HB3 MET 115 2HB MET 115 14.115 -6.823 5.264 878 HG2 MET 115 1HG MET 115 13.104 -4.018 5.147 879 HG3 MET 115 2HG MET 115 12.471 -5.142 6.347 880 HE1 MET 115 1HE MET 115 14.313 -6.847 7.401 881 HE2 MET 115 2HE MET 115 15.591 -6.128 8.380 882 HE3 MET 115 3HE MET 115 13.904 -5.715 8.689 883 H LYS 116 H LYS 116 16.460 -5.587 2.195 884 HA LYS 116 HA LYS 116 16.769 -8.512 2.157 885 HB2 LYS 116 1HB LYS 116 15.984 -7.293 -0.049 886 HB3 LYS 116 2HB LYS 116 17.692 -6.893 -0.179 887 HG2 LYS 116 1HG LYS 116 16.824 -9.719 0.272 888 HG3 LYS 116 2HG LYS 116 16.806 -9.012 -1.345 889 HD2 LYS 116 1HD LYS 116 19.246 -8.875 0.399 890 HD3 LYS 116 2HD LYS 116 18.910 -10.287 -0.605 891 HE2 LYS 116 1HE LYS 116 18.841 -7.556 -1.813 892 HE3 LYS 116 2HE LYS 116 20.392 -8.341 -1.521 893 HZ1 LYS 116 1HZ LYS 116 18.512 -8.814 -3.589 894 HZ2 LYS 116 2HZ LYS 116 18.802 -10.241 -2.730 895 HZ3 LYS 116 3HZ LYS 116 20.092 -9.398 -3.429 896 H ARG 117 H ARG 117 18.247 -8.305 3.890 897 HA ARG 117 HA ARG 117 20.865 -7.237 3.069 898 HB2 ARG 117 1HB ARG 117 19.539 -7.036 5.775 899 HB3 ARG 117 2HB ARG 117 21.249 -6.722 5.510 900 HG2 ARG 117 1HG ARG 117 20.742 -4.872 4.067 901 HG3 ARG 117 2HG ARG 117 19.018 -5.241 4.136 902 HD2 ARG 117 1HD ARG 117 19.494 -3.401 5.616 903 HD3 ARG 117 2HD ARG 117 19.067 -4.819 6.573 904 HE ARG 117 HE ARG 117 21.197 -4.847 7.435 905 HH11 ARG 117 1HH1 ARG 117 21.067 -2.680 4.714 906 HH12 ARG 117 2HH1 ARG 117 22.643 -2.019 4.999 907 HH21 ARG 117 1HH2 ARG 117 23.273 -3.985 7.820 908 HH22 ARG 117 2HH2 ARG 117 23.897 -2.763 6.765 909 H VAL 118 H VAL 118 22.568 -8.123 4.795 910 HA VAL 118 HA VAL 118 22.066 -10.808 5.696 911 HB VAL 118 HB VAL 118 22.455 -11.196 3.291 912 HG11 VAL 118 1HG1 VAL 118 24.343 -10.533 2.151 913 HG12 VAL 118 2HG1 VAL 118 24.089 -9.158 3.226 914 HG13 VAL 118 3HG1 VAL 118 25.306 -10.373 3.619 915 HG21 VAL 118 1HG2 VAL 118 23.474 -13.128 3.769 916 HG22 VAL 118 2HG2 VAL 118 24.933 -12.317 4.340 917 HG23 VAL 118 3HG2 VAL 118 23.560 -12.530 5.426 918 H SER 119 H SER 119 23.671 -11.590 7.075 919 HA SER 119 HA SER 119 24.959 -9.968 8.764 920 HB2 SER 119 1HB SER 119 25.837 -12.665 7.742 921 HB3 SER 119 2HB SER 119 26.710 -11.830 9.027 922 HG SER 119 HG SER 119 25.206 -13.128 10.004 923 H GLY 120 H GLY 120 26.548 -8.516 8.726 924 HA2 GLY 120 1HA GLY 120 28.584 -8.709 6.605 925 HA3 GLY 120 2HA GLY 120 27.730 -7.196 6.869 926 HA PRO 121 HA PRO 121 31.603 -7.636 9.591 927 HB2 PRO 121 1HB PRO 121 33.196 -5.877 8.272 928 HB3 PRO 121 2HB PRO 121 33.160 -7.605 7.901 929 HG2 PRO 121 1HG PRO 121 31.791 -5.339 6.504 930 HG3 PRO 121 2HG PRO 121 32.643 -6.731 5.809 931 HD2 PRO 121 1HD PRO 121 29.943 -6.614 5.986 932 HD3 PRO 121 2HD PRO 121 30.842 -8.139 6.106 933 H SER 122 H SER 122 29.846 -5.004 8.104 934 HA SER 122 HA SER 122 29.554 -2.802 8.742 935 HB2 SER 122 1HB SER 122 28.273 -2.662 10.765 936 HB3 SER 122 2HB SER 122 27.902 -4.219 10.024 937 HG SER 122 HG SER 122 28.423 -4.964 11.921 938 H SER 123 H SER 123 32.270 -3.359 8.810 939 HA SER 123 HA SER 123 33.423 -2.625 11.324 940 HB2 SER 123 1HB SER 123 34.470 -3.959 9.326 941 HB3 SER 123 2HB SER 123 34.890 -2.357 8.720 942 HG SER 123 HG SER 123 36.506 -3.385 10.084 943 H GLY 124 H GLY 124 33.178 -0.946 8.183 944 HA2 GLY 124 1HA GLY 124 33.040 1.597 9.649 945 HA3 GLY 124 2HA GLY 124 34.263 1.406 8.401 Start of MODEL 3 1 H1 GLY 1 H GLY 1 22.603 11.960 -10.214 2 HA2 GLY 1 1HA GLY 1 22.211 9.731 -10.841 3 HA3 GLY 1 2HA GLY 1 23.818 9.310 -10.270 4 H SER 2 H SER 2 20.641 8.839 -9.696 5 HA SER 2 HA SER 2 20.042 9.151 -7.084 6 HB2 SER 2 1HB SER 2 18.591 8.000 -8.738 7 HB3 SER 2 2HB SER 2 19.610 6.568 -8.603 8 HG SER 2 HG SER 2 18.277 7.769 -6.407 9 H SER 3 H SER 3 20.562 8.279 -5.130 10 HA SER 3 HA SER 3 23.013 6.686 -5.049 11 HB2 SER 3 1HB SER 3 22.992 8.737 -3.717 12 HB3 SER 3 2HB SER 3 21.558 8.182 -2.855 13 HG SER 3 HG SER 3 24.078 7.710 -2.253 14 H GLY 4 H GLY 4 23.190 4.750 -3.926 15 HA2 GLY 4 1HA GLY 4 20.703 3.257 -3.718 16 HA3 GLY 4 2HA GLY 4 22.328 2.598 -3.610 17 H SER 5 H SER 5 19.717 2.629 -1.900 18 HA SER 5 HA SER 5 21.123 2.578 0.628 19 HB2 SER 5 1HB SER 5 18.822 4.489 0.160 20 HB3 SER 5 2HB SER 5 19.495 4.099 1.743 21 HG SER 5 HG SER 5 21.462 4.987 1.071 22 H SER 6 H SER 6 20.213 1.192 2.078 23 HA SER 6 HA SER 6 17.493 0.343 1.947 24 HB2 SER 6 1HB SER 6 18.659 -0.867 -0.004 25 HB3 SER 6 2HB SER 6 19.483 -1.808 1.239 26 HG SER 6 HG SER 6 16.756 -1.737 0.570 27 H GLY 7 H GLY 7 16.873 -0.470 3.870 28 HA2 GLY 7 1HA GLY 7 17.684 -2.122 5.660 29 HA3 GLY 7 2HA GLY 7 19.006 -0.979 5.837 30 H ASN 8 H ASN 8 18.031 1.416 5.974 31 HA ASN 8 HA ASN 8 16.936 1.697 8.486 32 HB2 ASN 8 1HB ASN 8 16.878 3.550 6.104 33 HB3 ASN 8 2HB ASN 8 16.264 4.024 7.685 34 HD21 ASN 8 1HD2 ASN 8 18.259 5.454 6.567 35 HD22 ASN 8 2HD2 ASN 8 19.742 5.182 7.410 36 H ASP 9 H ASP 9 14.779 3.065 8.775 37 HA ASP 9 HA ASP 9 12.655 1.324 7.788 38 HB2 ASP 9 1HB ASP 9 12.986 3.155 10.111 39 HB3 ASP 9 2HB ASP 9 11.354 2.922 9.490 40 H ASP 10 H ASP 10 14.040 4.284 7.033 41 HA ASP 10 HA ASP 10 11.710 5.723 6.241 42 HB2 ASP 10 1HB ASP 10 14.528 6.117 5.225 43 HB3 ASP 10 2HB ASP 10 13.223 7.300 5.241 44 H ILE 11 H ILE 11 13.255 3.044 4.954 45 HA ILE 11 HA ILE 11 12.966 3.546 2.175 46 HB ILE 11 HB ILE 11 14.416 1.757 3.242 47 HG12 ILE 11 1HG1 ILE 11 12.628 0.610 1.112 48 HG13 ILE 11 2HG1 ILE 11 13.681 1.978 0.767 49 HG21 ILE 11 1HG2 ILE 11 11.728 0.429 3.482 50 HG22 ILE 11 2HG2 ILE 11 13.245 -0.467 3.486 51 HG23 ILE 11 3HG2 ILE 11 12.918 0.718 4.750 52 HD11 ILE 11 1HD1 ILE 11 14.397 -0.575 0.415 53 HD12 ILE 11 2HD1 ILE 11 15.543 0.714 0.786 54 HD13 ILE 11 3HD1 ILE 11 14.951 -0.337 2.072 55 H ILE 12 H ILE 12 10.741 2.757 4.643 56 HA ILE 12 HA ILE 12 8.811 1.266 3.318 57 HB ILE 12 HB ILE 12 8.345 3.439 5.364 58 HG12 ILE 12 1HG1 ILE 12 8.642 0.456 5.768 59 HG13 ILE 12 2HG1 ILE 12 9.932 1.623 6.043 60 HG21 ILE 12 1HG2 ILE 12 6.364 2.611 3.989 61 HG22 ILE 12 2HG2 ILE 12 6.579 1.072 4.821 62 HG23 ILE 12 3HG2 ILE 12 6.215 2.529 5.745 63 HD11 ILE 12 1HD1 ILE 12 9.016 2.381 7.969 64 HD12 ILE 12 2HD1 ILE 12 7.361 2.088 7.430 65 HD13 ILE 12 3HD1 ILE 12 8.360 0.745 7.984 66 H VAL 13 H VAL 13 9.530 4.687 3.131 67 HA VAL 13 HA VAL 13 7.149 5.286 1.597 68 HB VAL 13 HB VAL 13 9.554 7.012 2.201 69 HG11 VAL 13 1HG1 VAL 13 7.709 8.806 1.680 70 HG12 VAL 13 2HG1 VAL 13 8.645 8.069 0.378 71 HG13 VAL 13 3HG1 VAL 13 7.012 7.498 0.725 72 HG21 VAL 13 1HG2 VAL 13 6.870 7.387 3.440 73 HG22 VAL 13 2HG2 VAL 13 7.943 6.144 4.080 74 HG23 VAL 13 3HG2 VAL 13 8.464 7.828 4.052 75 H ASN 14 H ASN 14 10.662 5.333 0.992 76 HA ASN 14 HA ASN 14 10.621 5.978 -1.694 77 HB2 ASN 14 1HB ASN 14 12.749 5.961 -0.759 78 HB3 ASN 14 2HB ASN 14 12.512 4.393 0.007 79 HD21 ASN 14 1HD2 ASN 14 13.309 6.061 -2.931 80 HD22 ASN 14 2HD2 ASN 14 13.921 4.689 -3.784 81 H TRP 15 H TRP 15 10.672 2.707 -0.278 82 HA TRP 15 HA TRP 15 10.627 1.146 -2.495 83 HB2 TRP 15 1HB TRP 15 10.471 0.467 -0.016 84 HB3 TRP 15 2HB TRP 15 8.726 0.588 -0.226 85 HD1 TRP 15 HD TRP 15 11.718 -1.357 -1.738 86 HE1 TRP 15 1HE TRP 15 10.856 -3.651 -2.525 87 HE3 TRP 15 3HE TRP 15 6.740 -0.732 -0.758 88 HZ2 TRP 15 2HZ TRP 15 8.391 -5.013 -2.709 89 HZ3 TRP 15 3HZ TRP 15 5.197 -2.579 -1.269 90 HH2 TRP 15 HH TRP 15 6.007 -4.674 -2.225 91 H VAL 16 H VAL 16 7.602 2.129 -0.872 92 HA VAL 16 HA VAL 16 5.796 1.327 -2.756 93 HB VAL 16 HB VAL 16 5.674 3.850 -1.098 94 HG11 VAL 16 1HG1 VAL 16 3.418 2.372 -2.449 95 HG12 VAL 16 2HG1 VAL 16 3.287 3.830 -1.463 96 HG13 VAL 16 3HG1 VAL 16 4.117 3.887 -3.019 97 HG21 VAL 16 1HG2 VAL 16 3.949 2.058 0.012 98 HG22 VAL 16 2HG2 VAL 16 5.252 1.004 -0.536 99 HG23 VAL 16 3HG2 VAL 16 5.601 2.339 0.562 100 H ASN 17 H ASN 17 7.238 4.589 -2.599 101 HA ASN 17 HA ASN 17 6.130 5.634 -4.904 102 HB2 ASN 17 1HB ASN 17 8.933 6.188 -3.913 103 HB3 ASN 17 2HB ASN 17 7.929 7.252 -4.894 104 HD21 ASN 17 1HD2 ASN 17 8.318 8.824 -3.229 105 HD22 ASN 17 2HD2 ASN 17 7.360 8.805 -1.791 106 H GLU 18 H GLU 18 9.478 4.418 -4.705 107 HA GLU 18 HA GLU 18 10.099 4.362 -7.357 108 HB2 GLU 18 1HB GLU 18 10.932 2.693 -5.035 109 HB3 GLU 18 2HB GLU 18 11.402 2.153 -6.642 110 HG2 GLU 18 1HG GLU 18 11.938 4.948 -5.711 111 HG3 GLU 18 2HG GLU 18 13.034 3.619 -5.339 112 H THR 19 H THR 19 8.918 1.482 -5.611 113 HA THR 19 HA THR 19 8.540 -0.253 -7.649 114 HB THR 19 HB THR 19 6.660 0.212 -5.328 115 HG1 THR 19 1HG THR 19 7.887 -1.829 -4.714 116 HG21 THR 19 1HG2 THR 19 6.675 -1.830 -7.494 117 HG22 THR 19 2HG2 THR 19 5.316 -1.093 -6.648 118 HG23 THR 19 3HG2 THR 19 6.267 -2.351 -5.860 119 H LEU 20 H LEU 20 6.493 2.499 -6.870 120 HA LEU 20 HA LEU 20 4.481 1.824 -8.807 121 HB2 LEU 20 1HB LEU 20 5.021 4.317 -7.208 122 HB3 LEU 20 2HB LEU 20 3.664 4.151 -8.321 123 HG LEU 20 HG LEU 20 4.003 2.182 -6.097 124 HD11 LEU 20 1HD1 LEU 20 4.204 4.336 -5.003 125 HD12 LEU 20 2HD1 LEU 20 2.631 3.619 -4.657 126 HD13 LEU 20 3HD1 LEU 20 2.765 4.920 -5.841 127 HD21 LEU 20 1HD2 LEU 20 1.661 3.316 -7.619 128 HD22 LEU 20 2HD2 LEU 20 1.518 2.212 -6.250 129 HD23 LEU 20 3HD2 LEU 20 2.322 1.683 -7.729 130 H ARG 21 H ARG 21 7.243 4.014 -8.651 131 HA ARG 21 HA ARG 21 6.764 5.385 -11.061 132 HB2 ARG 21 1HB ARG 21 8.466 5.853 -9.132 133 HB3 ARG 21 2HB ARG 21 9.540 4.830 -10.076 134 HG2 ARG 21 1HG ARG 21 9.989 7.090 -10.655 135 HG3 ARG 21 2HG ARG 21 9.154 6.344 -12.019 136 HD2 ARG 21 1HD ARG 21 7.053 7.351 -11.286 137 HD3 ARG 21 2HD ARG 21 7.878 8.082 -9.910 138 HE ARG 21 HE ARG 21 7.974 8.952 -12.669 139 HH11 ARG 21 1HH1 ARG 21 9.409 9.129 -9.501 140 HH12 ARG 21 2HH1 ARG 21 10.192 10.645 -9.798 141 HH21 ARG 21 1HH2 ARG 21 9.001 10.949 -13.070 142 HH22 ARG 21 2HH2 ARG 21 9.959 11.680 -11.828 143 H GLU 22 H GLU 22 8.768 2.532 -10.356 144 HA GLU 22 HA GLU 22 9.733 2.133 -12.956 145 HB2 GLU 22 1HB GLU 22 10.488 0.036 -12.222 146 HB3 GLU 22 2HB GLU 22 10.491 1.029 -10.771 147 HG2 GLU 22 1HG GLU 22 8.410 0.042 -10.045 148 HG3 GLU 22 2HG GLU 22 8.306 -0.894 -11.535 149 H ALA 23 H ALA 23 6.645 1.511 -11.557 150 HA ALA 23 HA ALA 23 5.853 -0.246 -13.756 151 HB1 ALA 23 1HB ALA 23 5.026 -1.140 -11.799 152 HB2 ALA 23 2HB ALA 23 4.661 0.441 -11.107 153 HB3 ALA 23 3HB ALA 23 3.641 -0.219 -12.385 154 H GLU 24 H GLU 24 5.879 3.023 -12.998 155 HA GLU 24 HA GLU 24 5.065 4.841 -14.112 156 HB2 GLU 24 1HB GLU 24 3.569 2.969 -15.939 157 HB3 GLU 24 2HB GLU 24 4.089 4.616 -16.266 158 HG2 GLU 24 1HG GLU 24 6.277 4.002 -16.627 159 HG3 GLU 24 2HG GLU 24 6.126 2.520 -15.684 160 H LYS 25 H LYS 25 3.803 3.964 -11.825 161 HA LYS 25 HA LYS 25 0.939 3.970 -12.288 162 HB2 LYS 25 1HB LYS 25 2.731 3.504 -9.966 163 HB3 LYS 25 2HB LYS 25 1.128 4.134 -9.615 164 HG2 LYS 25 1HG LYS 25 1.293 1.663 -9.509 165 HG3 LYS 25 2HG LYS 25 0.084 2.251 -10.652 166 HD2 LYS 25 1HD LYS 25 1.678 1.916 -12.491 167 HD3 LYS 25 2HD LYS 25 2.866 1.303 -11.339 168 HE2 LYS 25 1HE LYS 25 0.147 0.087 -11.812 169 HE3 LYS 25 2HE LYS 25 1.639 -0.480 -12.560 170 HZ1 LYS 25 1HZ LYS 25 0.690 -1.469 -10.297 171 HZ2 LYS 25 2HZ LYS 25 1.656 -0.235 -9.660 172 HZ3 LYS 25 3HZ LYS 25 2.344 -1.421 -10.651 173 H SER 26 H SER 26 -0.494 5.553 -11.477 174 HA SER 26 HA SER 26 0.664 8.230 -11.449 175 HB2 SER 26 1HB SER 26 -1.244 7.771 -12.952 176 HB3 SER 26 2HB SER 26 -2.239 7.371 -11.552 177 HG SER 26 HG SER 26 -1.360 9.667 -10.928 178 H SER 27 H SER 27 0.522 6.145 -9.162 179 HA SER 27 HA SER 27 -0.730 7.901 -7.157 180 HB2 SER 27 1HB SER 27 -1.234 6.036 -5.850 181 HB3 SER 27 2HB SER 27 -1.472 5.420 -7.485 182 HG SER 27 HG SER 27 0.671 4.960 -5.711 183 H SER 28 H SER 28 0.346 8.087 -5.080 184 HA SER 28 HA SER 28 2.986 7.218 -4.620 185 HB2 SER 28 1HB SER 28 4.283 9.174 -5.036 186 HB3 SER 28 2HB SER 28 3.353 8.884 -6.505 187 HG SER 28 HG SER 28 2.664 10.713 -4.445 188 H ILE 29 H ILE 29 3.925 8.181 -2.672 189 HA ILE 29 HA ILE 29 1.993 9.658 -1.026 190 HB ILE 29 HB ILE 29 2.682 8.237 0.930 191 HG12 ILE 29 1HG1 ILE 29 3.466 6.099 -0.999 192 HG13 ILE 29 2HG1 ILE 29 4.667 7.310 -0.569 193 HG21 ILE 29 1HG2 ILE 29 0.938 7.483 -1.299 194 HG22 ILE 29 2HG2 ILE 29 1.369 6.152 -0.227 195 HG23 ILE 29 3HG2 ILE 29 0.592 7.594 0.426 196 HD11 ILE 29 1HD1 ILE 29 3.168 5.912 1.590 197 HD12 ILE 29 2HD1 ILE 29 4.494 5.088 0.768 198 HD13 ILE 29 3HD1 ILE 29 4.788 6.610 1.610 199 H SER 30 H SER 30 2.876 11.004 0.543 200 HA SER 30 HA SER 30 5.666 11.714 0.082 201 HB2 SER 30 1HB SER 30 3.656 13.368 0.186 202 HB3 SER 30 2HB SER 30 3.822 13.198 1.934 203 HG SER 30 HG SER 30 5.094 14.894 0.607 204 H SER 31 H SER 31 3.582 10.427 2.576 205 HA SER 31 HA SER 31 5.747 9.333 4.031 206 HB2 SER 31 1HB SER 31 5.794 10.665 5.990 207 HB3 SER 31 2HB SER 31 5.850 11.815 4.655 208 HG SER 31 HG SER 31 3.322 11.469 5.120 209 H PHE 32 H PHE 32 4.954 8.437 6.201 210 HA PHE 32 HA PHE 32 2.833 6.726 5.802 211 HB2 PHE 32 1HB PHE 32 3.786 7.774 8.475 212 HB3 PHE 32 2HB PHE 32 2.898 6.279 8.200 213 HD1 PHE 32 2HD PHE 32 4.539 5.723 5.563 214 HD2 PHE 32 1HD PHE 32 5.574 6.574 9.602 215 HE1 PHE 32 2HE PHE 32 6.663 4.516 5.269 216 HE2 PHE 32 1HE PHE 32 7.700 5.370 9.316 217 HZ PHE 32 HZ PHE 32 8.246 4.337 7.147 218 H LYS 33 H LYS 33 2.760 10.046 6.649 219 HA LYS 33 HA LYS 33 -0.077 9.866 7.403 220 HB2 LYS 33 1HB LYS 33 2.120 11.752 8.086 221 HB3 LYS 33 2HB LYS 33 0.498 12.419 7.958 222 HG2 LYS 33 1HG LYS 33 -0.141 10.440 9.528 223 HG3 LYS 33 2HG LYS 33 1.584 10.438 9.904 224 HD2 LYS 33 1HD LYS 33 1.279 12.969 10.285 225 HD3 LYS 33 2HD LYS 33 -0.445 12.600 10.360 226 HE2 LYS 33 1HE LYS 33 0.149 12.450 12.579 227 HE3 LYS 33 2HE LYS 33 0.313 10.773 12.062 228 HZ1 LYS 33 1HZ LYS 33 2.600 10.898 12.085 229 HZ2 LYS 33 2HZ LYS 33 2.195 11.859 13.416 230 HZ3 LYS 33 3HZ LYS 33 2.633 12.584 11.951 231 H ASP 34 H ASP 34 0.663 9.574 4.698 232 HA ASP 34 HA ASP 34 0.264 12.100 3.361 233 HB2 ASP 34 1HB ASP 34 1.625 10.718 2.092 234 HB3 ASP 34 2HB ASP 34 0.700 9.272 2.486 235 HA PRO 35 HA PRO 35 -4.143 12.000 3.338 236 HB2 PRO 35 1HB PRO 35 -4.564 13.735 1.292 237 HB3 PRO 35 2HB PRO 35 -4.033 14.252 2.897 238 HG2 PRO 35 1HG PRO 35 -2.416 13.822 0.415 239 HG3 PRO 35 2HG PRO 35 -2.320 15.138 1.599 240 HD2 PRO 35 1HD PRO 35 -0.588 13.056 1.591 241 HD3 PRO 35 2HD PRO 35 -1.083 13.882 3.084 242 H LYS 36 H LYS 36 -2.427 11.673 0.246 243 HA LYS 36 HA LYS 36 -4.469 10.732 -1.353 244 HB2 LYS 36 1HB LYS 36 -1.516 10.374 -1.317 245 HB3 LYS 36 2HB LYS 36 -2.446 9.291 -2.345 246 HG2 LYS 36 1HG LYS 36 -2.023 10.969 -3.821 247 HG3 LYS 36 2HG LYS 36 -3.547 11.546 -3.145 248 HD2 LYS 36 1HD LYS 36 -2.412 13.068 -1.696 249 HD3 LYS 36 2HD LYS 36 -0.843 12.367 -2.096 250 HE2 LYS 36 1HE LYS 36 -0.872 14.278 -3.397 251 HE3 LYS 36 2HE LYS 36 -1.444 13.051 -4.526 252 HZ1 LYS 36 1HZ LYS 36 -3.353 14.635 -2.929 253 HZ2 LYS 36 2HZ LYS 36 -3.609 13.822 -4.389 254 HZ3 LYS 36 3HZ LYS 36 -2.712 15.255 -4.366 255 H ILE 37 H ILE 37 -2.746 9.099 1.190 256 HA ILE 37 HA ILE 37 -3.284 6.436 0.557 257 HB ILE 37 HB ILE 37 -2.974 7.794 3.228 258 HG12 ILE 37 1HG1 ILE 37 -1.144 5.951 1.676 259 HG13 ILE 37 2HG1 ILE 37 -1.001 7.705 1.727 260 HG21 ILE 37 1HG2 ILE 37 -3.846 5.073 2.605 261 HG22 ILE 37 2HG2 ILE 37 -2.465 5.154 3.698 262 HG23 ILE 37 3HG2 ILE 37 -3.965 5.988 4.109 263 HD11 ILE 37 1HD1 ILE 37 0.134 7.622 3.625 264 HD12 ILE 37 2HD1 ILE 37 -1.082 6.594 4.383 265 HD13 ILE 37 3HD1 ILE 37 0.207 5.872 3.420 266 H SER 38 H SER 38 -5.328 8.912 1.923 267 HA SER 38 HA SER 38 -7.335 7.434 3.103 268 HB2 SER 38 1HB SER 38 -7.306 10.060 1.659 269 HB3 SER 38 2HB SER 38 -8.846 9.372 2.175 270 HG SER 38 HG SER 38 -8.131 10.617 3.847 271 H THR 39 H THR 39 -6.913 8.230 -0.320 272 HA THR 39 HA THR 39 -9.315 6.854 -1.110 273 HB THR 39 HB THR 39 -8.543 7.278 -3.425 274 HG1 THR 39 1HG THR 39 -6.285 8.409 -2.098 275 HG21 THR 39 1HG2 THR 39 -8.213 9.914 -2.919 276 HG22 THR 39 2HG2 THR 39 -8.891 9.376 -1.382 277 HG23 THR 39 3HG2 THR 39 -9.774 9.095 -2.881 278 H SER 40 H SER 40 -6.247 5.857 -0.239 279 HA SER 40 HA SER 40 -5.217 3.826 -0.277 280 HB2 SER 40 1HB SER 40 -7.679 2.796 -1.703 281 HB3 SER 40 2HB SER 40 -6.482 1.844 -0.825 282 HG SER 40 HG SER 40 -7.155 3.251 1.032 283 H LEU 41 H LEU 41 -5.053 5.787 -2.479 284 HA LEU 41 HA LEU 41 -4.872 4.419 -4.955 285 HB2 LEU 41 1HB LEU 41 -3.942 7.049 -3.906 286 HB3 LEU 41 2HB LEU 41 -3.296 6.467 -5.439 287 HG LEU 41 HG LEU 41 -6.214 6.939 -4.830 288 HD11 LEU 41 1HD1 LEU 41 -6.060 8.877 -6.196 289 HD12 LEU 41 2HD1 LEU 41 -4.401 8.500 -6.656 290 HD13 LEU 41 3HD1 LEU 41 -4.770 8.982 -5.000 291 HD21 LEU 41 1HD2 LEU 41 -6.708 5.860 -6.709 292 HD22 LEU 41 2HD2 LEU 41 -5.044 5.277 -6.740 293 HD23 LEU 41 3HD2 LEU 41 -5.481 6.747 -7.612 294 HA PRO 42 HA PRO 42 -0.124 4.308 -3.990 295 HB2 PRO 42 1HB PRO 42 0.598 4.726 -1.406 296 HB3 PRO 42 2HB PRO 42 0.466 6.031 -2.591 297 HG2 PRO 42 1HG PRO 42 -1.488 5.173 -0.493 298 HG3 PRO 42 2HG PRO 42 -1.000 6.811 -0.963 299 HD2 PRO 42 1HD PRO 42 -3.310 5.681 -1.809 300 HD3 PRO 42 2HD PRO 42 -2.394 6.836 -2.798 301 H VAL 43 H VAL 43 -2.529 3.113 -1.780 302 HA VAL 43 HA VAL 43 -0.921 0.837 -0.965 303 HB VAL 43 HB VAL 43 -3.852 1.243 -0.398 304 HG11 VAL 43 1HG1 VAL 43 -1.694 -0.524 0.609 305 HG12 VAL 43 2HG1 VAL 43 -2.891 0.048 1.772 306 HG13 VAL 43 3HG1 VAL 43 -3.405 -0.859 0.350 307 HG21 VAL 43 1HG2 VAL 43 -2.125 2.017 1.774 308 HG22 VAL 43 2HG2 VAL 43 -1.809 2.999 0.343 309 HG23 VAL 43 3HG2 VAL 43 -3.439 2.914 1.013 310 H LEU 44 H LEU 44 -3.559 1.576 -3.152 311 HA LEU 44 HA LEU 44 -4.081 -1.189 -3.781 312 HB2 LEU 44 1HB LEU 44 -5.052 1.418 -4.916 313 HB3 LEU 44 2HB LEU 44 -5.488 -0.137 -5.621 314 HG LEU 44 HG LEU 44 -6.066 0.547 -2.749 315 HD11 LEU 44 1HD1 LEU 44 -8.003 1.594 -3.268 316 HD12 LEU 44 2HD1 LEU 44 -8.223 0.691 -4.767 317 HD13 LEU 44 3HD1 LEU 44 -7.090 2.040 -4.710 318 HD21 LEU 44 1HD2 LEU 44 -6.336 -1.722 -2.953 319 HD22 LEU 44 2HD2 LEU 44 -6.804 -1.627 -4.652 320 HD23 LEU 44 3HD2 LEU 44 -7.949 -1.162 -3.391 321 H ASP 45 H ASP 45 -2.606 1.579 -5.451 322 HA ASP 45 HA ASP 45 -1.928 0.187 -7.808 323 HB2 ASP 45 1HB ASP 45 -0.752 2.672 -6.552 324 HB3 ASP 45 2HB ASP 45 -0.297 2.076 -8.146 325 H LEU 46 H LEU 46 -0.164 0.769 -4.801 326 HA LEU 46 HA LEU 46 2.332 -0.207 -5.544 327 HB2 LEU 46 1HB LEU 46 2.158 0.899 -3.478 328 HB3 LEU 46 2HB LEU 46 0.872 -0.170 -2.922 329 HG LEU 46 HG LEU 46 2.458 -1.984 -2.646 330 HD11 LEU 46 1HD1 LEU 46 4.893 -0.460 -2.979 331 HD12 LEU 46 2HD1 LEU 46 3.993 -0.593 -4.489 332 HD13 LEU 46 3HD1 LEU 46 4.459 -2.049 -3.610 333 HD21 LEU 46 1HD2 LEU 46 2.212 -0.670 -0.708 334 HD22 LEU 46 2HD2 LEU 46 3.189 0.639 -1.372 335 HD23 LEU 46 3HD2 LEU 46 3.951 -0.885 -0.911 336 H ILE 47 H ILE 47 -0.473 -1.949 -4.246 337 HA ILE 47 HA ILE 47 0.703 -4.476 -4.035 338 HB ILE 47 HB ILE 47 -2.168 -3.739 -4.601 339 HG12 ILE 47 1HG1 ILE 47 -1.003 -4.733 -2.010 340 HG13 ILE 47 2HG1 ILE 47 -0.986 -3.022 -2.422 341 HG21 ILE 47 1HG2 ILE 47 -2.039 -5.957 -5.303 342 HG22 ILE 47 2HG2 ILE 47 -0.872 -6.384 -4.052 343 HG23 ILE 47 3HG2 ILE 47 -2.556 -6.085 -3.622 344 HD11 ILE 47 1HD1 ILE 47 -2.896 -3.226 -1.152 345 HD12 ILE 47 2HD1 ILE 47 -3.523 -3.342 -2.796 346 HD13 ILE 47 3HD1 ILE 47 -3.305 -4.801 -1.830 347 H ASP 48 H ASP 48 -1.253 -3.133 -6.695 348 HA ASP 48 HA ASP 48 -1.166 -5.264 -8.437 349 HB2 ASP 48 1HB ASP 48 -2.470 -3.168 -8.778 350 HB3 ASP 48 2HB ASP 48 -0.975 -2.349 -9.224 351 H ALA 49 H ALA 49 1.182 -2.605 -8.167 352 HA ALA 49 HA ALA 49 2.911 -3.209 -10.192 353 HB1 ALA 49 1HB ALA 49 3.308 -1.265 -8.905 354 HB2 ALA 49 2HB ALA 49 3.496 -2.198 -7.420 355 HB3 ALA 49 3HB ALA 49 4.721 -2.298 -8.684 356 H ILE 50 H ILE 50 2.487 -4.916 -7.173 357 HA ILE 50 HA ILE 50 4.859 -6.509 -7.433 358 HB ILE 50 HB ILE 50 2.469 -7.202 -5.740 359 HG12 ILE 50 1HG1 ILE 50 3.121 -4.819 -5.390 360 HG13 ILE 50 2HG1 ILE 50 3.364 -5.825 -3.966 361 HG21 ILE 50 1HG2 ILE 50 5.327 -7.988 -5.853 362 HG22 ILE 50 2HG2 ILE 50 4.559 -7.898 -4.269 363 HG23 ILE 50 3HG2 ILE 50 3.897 -8.960 -5.510 364 HD11 ILE 50 1HD1 ILE 50 5.703 -5.854 -4.276 365 HD12 ILE 50 2HD1 ILE 50 5.567 -5.164 -5.894 366 HD13 ILE 50 3HD1 ILE 50 5.187 -4.180 -4.481 367 H GLN 51 H GLN 51 1.381 -7.129 -7.867 368 HA GLN 51 HA GLN 51 2.096 -9.354 -9.652 369 HB2 GLN 51 1HB GLN 51 0.311 -9.357 -7.282 370 HB3 GLN 51 2HB GLN 51 -0.251 -10.243 -8.693 371 HG2 GLN 51 1HG GLN 51 0.877 -11.818 -7.390 372 HG3 GLN 51 2HG GLN 51 2.003 -11.402 -8.681 373 HE21 GLN 51 1HE2 GLN 51 1.183 -10.741 -5.320 374 HE22 GLN 51 2HE2 GLN 51 2.785 -10.334 -4.819 375 HA PRO 52 HA PRO 52 -0.473 -6.807 -12.297 376 HB2 PRO 52 1HB PRO 52 0.014 -8.237 -14.553 377 HB3 PRO 52 2HB PRO 52 1.159 -7.062 -13.894 378 HG2 PRO 52 1HG PRO 52 1.142 -10.043 -13.626 379 HG3 PRO 52 2HG PRO 52 2.507 -8.955 -13.942 380 HD2 PRO 52 1HD PRO 52 1.996 -9.977 -11.486 381 HD3 PRO 52 2HD PRO 52 2.719 -8.373 -11.722 382 H GLY 53 H GLY 53 -2.616 -7.044 -12.148 383 HA2 GLY 53 1HA GLY 53 -4.509 -8.183 -13.275 384 HA3 GLY 53 2HA GLY 53 -3.760 -9.695 -12.784 385 H SER 54 H SER 54 -3.031 -8.529 -10.141 386 HA SER 54 HA SER 54 -5.201 -9.455 -8.656 387 HB2 SER 54 1HB SER 54 -4.088 -8.328 -6.718 388 HB3 SER 54 2HB SER 54 -2.997 -9.334 -7.669 389 HG SER 54 HG SER 54 -1.853 -7.545 -7.606 390 H ILE 55 H ILE 55 -4.144 -6.067 -9.035 391 HA ILE 55 HA ILE 55 -6.687 -5.113 -8.032 392 HB ILE 55 HB ILE 55 -4.413 -3.487 -9.169 393 HG12 ILE 55 1HG1 ILE 55 -3.742 -4.956 -7.246 394 HG13 ILE 55 2HG1 ILE 55 -3.576 -3.232 -6.931 395 HG21 ILE 55 1HG2 ILE 55 -6.062 -1.945 -9.047 396 HG22 ILE 55 2HG2 ILE 55 -6.980 -2.861 -7.853 397 HG23 ILE 55 3HG2 ILE 55 -5.586 -1.907 -7.350 398 HD11 ILE 55 1HD1 ILE 55 -4.779 -3.499 -5.099 399 HD12 ILE 55 2HD1 ILE 55 -6.160 -3.958 -6.098 400 HD13 ILE 55 3HD1 ILE 55 -5.058 -5.194 -5.493 401 H ASN 56 H ASN 56 -8.110 -3.741 -9.192 402 HA ASN 56 HA ASN 56 -7.800 -3.667 -12.099 403 HB2 ASN 56 1HB ASN 56 -9.253 -5.668 -11.154 404 HB3 ASN 56 2HB ASN 56 -10.486 -4.418 -11.028 405 HD21 ASN 56 1HD2 ASN 56 -11.812 -5.158 -12.608 406 HD22 ASN 56 2HD2 ASN 56 -11.381 -5.206 -14.280 407 H TYR 57 H TYR 57 -7.796 -1.539 -12.453 408 HA TYR 57 HA TYR 57 -8.945 0.427 -10.861 409 HB2 TYR 57 1HB TYR 57 -8.373 0.527 -13.830 410 HB3 TYR 57 2HB TYR 57 -8.666 1.926 -12.804 411 HD1 TYR 57 2HD TYR 57 -7.091 1.472 -10.450 412 HD2 TYR 57 1HD TYR 57 -6.162 0.523 -14.492 413 HE1 TYR 57 2HE TYR 57 -4.692 1.588 -9.920 414 HE2 TYR 57 1HE TYR 57 -3.761 0.635 -13.973 415 HH TYR 57 HH TYR 57 -2.320 0.351 -11.859 416 H ASP 58 H ASP 58 -10.313 -1.450 -13.482 417 HA ASP 58 HA ASP 58 -12.555 -0.018 -14.150 418 HB2 ASP 58 1HB ASP 58 -11.673 -2.400 -14.895 419 HB3 ASP 58 2HB ASP 58 -12.866 -2.957 -13.725 420 H LEU 59 H LEU 59 -12.071 -2.092 -11.332 421 HA LEU 59 HA LEU 59 -14.765 -1.606 -10.375 422 HB2 LEU 59 1HB LEU 59 -12.590 -2.919 -8.791 423 HB3 LEU 59 2HB LEU 59 -14.330 -3.177 -8.709 424 HG LEU 59 HG LEU 59 -12.510 -4.090 -10.936 425 HD11 LEU 59 1HD1 LEU 59 -12.338 -6.083 -9.926 426 HD12 LEU 59 2HD1 LEU 59 -14.005 -6.051 -9.354 427 HD13 LEU 59 3HD1 LEU 59 -12.750 -5.192 -8.460 428 HD21 LEU 59 1HD2 LEU 59 -14.370 -4.157 -12.155 429 HD22 LEU 59 2HD2 LEU 59 -15.382 -3.764 -10.765 430 HD23 LEU 59 3HD2 LEU 59 -14.926 -5.439 -11.079 431 H LEU 60 H LEU 60 -11.480 -0.579 -9.670 432 HA LEU 60 HA LEU 60 -11.926 0.703 -7.227 433 HB2 LEU 60 1HB LEU 60 -9.987 1.436 -9.415 434 HB3 LEU 60 2HB LEU 60 -9.916 2.014 -7.751 435 HG LEU 60 HG LEU 60 -9.565 -0.849 -8.643 436 HD11 LEU 60 1HD1 LEU 60 -7.514 -0.127 -9.167 437 HD12 LEU 60 2HD1 LEU 60 -7.255 -0.069 -7.424 438 HD13 LEU 60 3HD1 LEU 60 -7.719 1.392 -8.296 439 HD21 LEU 60 1HD2 LEU 60 -9.798 0.460 -5.983 440 HD22 LEU 60 2HD2 LEU 60 -8.653 -0.869 -6.167 441 HD23 LEU 60 3HD2 LEU 60 -10.362 -1.122 -6.520 442 H LYS 61 H LYS 61 -12.296 2.883 -6.696 443 HA LYS 61 HA LYS 61 -13.975 4.278 -8.634 444 HB2 LYS 61 1HB LYS 61 -13.628 4.392 -5.667 445 HB3 LYS 61 2HB LYS 61 -14.275 5.801 -6.498 446 HG2 LYS 61 1HG LYS 61 -16.216 4.730 -6.008 447 HG3 LYS 61 2HG LYS 61 -15.872 3.992 -7.573 448 HD2 LYS 61 1HD LYS 61 -14.584 2.231 -6.133 449 HD3 LYS 61 2HD LYS 61 -15.605 2.840 -4.828 450 HE2 LYS 61 1HE LYS 61 -16.686 1.891 -7.474 451 HE3 LYS 61 2HE LYS 61 -16.496 0.837 -6.073 452 HZ1 LYS 61 1HZ LYS 61 -18.132 3.315 -6.122 453 HZ2 LYS 61 2HZ LYS 61 -18.001 2.227 -4.834 454 HZ3 LYS 61 3HZ LYS 61 -18.747 1.746 -6.274 455 H THR 62 H THR 62 -11.446 5.213 -6.295 456 HA THR 62 HA THR 62 -10.062 7.049 -6.276 457 HB THR 62 HB THR 62 -8.830 5.410 -7.653 458 HG1 THR 62 1HG THR 62 -8.360 7.909 -8.863 459 HG21 THR 62 1HG2 THR 62 -10.075 6.872 -9.985 460 HG22 THR 62 2HG2 THR 62 -10.410 5.209 -9.506 461 HG23 THR 62 3HG2 THR 62 -8.809 5.651 -10.095 462 H GLU 63 H GLU 63 -12.828 7.588 -7.197 463 HA GLU 63 HA GLU 63 -12.253 10.105 -8.596 464 HB2 GLU 63 1HB GLU 63 -14.186 9.861 -10.013 465 HB3 GLU 63 2HB GLU 63 -13.165 8.443 -10.206 466 HG2 GLU 63 1HG GLU 63 -14.726 7.429 -8.376 467 HG3 GLU 63 2HG GLU 63 -15.832 8.695 -8.907 468 H ASN 64 H ASN 64 -12.692 11.611 -7.123 469 HA ASN 64 HA ASN 64 -13.673 12.692 -5.356 470 HB2 ASN 64 1HB ASN 64 -16.304 11.938 -6.596 471 HB3 ASN 64 2HB ASN 64 -15.830 13.461 -5.847 472 HD21 ASN 64 1HD2 ASN 64 -15.298 11.396 -8.648 473 HD22 ASN 64 2HD2 ASN 64 -14.872 12.671 -9.734 474 H LEU 65 H LEU 65 -13.096 9.988 -4.757 475 HA LEU 65 HA LEU 65 -15.049 8.396 -3.718 476 HB2 LEU 65 1HB LEU 65 -12.301 9.019 -2.681 477 HB3 LEU 65 2HB LEU 65 -13.337 7.817 -1.914 478 HG LEU 65 HG LEU 65 -12.761 7.577 -4.832 479 HD11 LEU 65 1HD1 LEU 65 -10.556 7.647 -4.377 480 HD12 LEU 65 2HD1 LEU 65 -10.838 6.008 -3.792 481 HD13 LEU 65 3HD1 LEU 65 -10.790 7.354 -2.654 482 HD21 LEU 65 1HD2 LEU 65 -14.233 5.939 -4.190 483 HD22 LEU 65 2HD2 LEU 65 -13.558 5.813 -2.566 484 HD23 LEU 65 3HD2 LEU 65 -12.696 5.114 -3.936 485 H ASN 66 H ASN 66 -15.978 8.123 -1.627 486 HA ASN 66 HA ASN 66 -15.956 10.495 0.098 487 HB2 ASN 66 1HB ASN 66 -18.538 9.882 0.342 488 HB3 ASN 66 2HB ASN 66 -17.959 10.992 -0.897 489 HD21 ASN 66 1HD2 ASN 66 -19.820 8.328 -0.319 490 HD22 ASN 66 2HD2 ASN 66 -19.915 7.698 -1.924 491 H ASP 67 H ASP 67 -17.005 10.041 2.238 492 HA ASP 67 HA ASP 67 -15.793 8.192 3.726 493 HB2 ASP 67 1HB ASP 67 -17.714 9.924 4.304 494 HB3 ASP 67 2HB ASP 67 -18.716 8.476 4.265 495 H ASP 68 H ASP 68 -18.485 7.552 1.581 496 HA ASP 68 HA ASP 68 -18.900 4.862 2.479 497 HB2 ASP 68 1HB ASP 68 -19.764 6.044 -0.162 498 HB3 ASP 68 2HB ASP 68 -20.476 4.676 0.689 499 H GLU 69 H GLU 69 -17.839 6.067 -0.708 500 HA GLU 69 HA GLU 69 -16.830 3.654 -1.641 501 HB2 GLU 69 1HB GLU 69 -15.654 6.334 -2.363 502 HB3 GLU 69 2HB GLU 69 -15.763 4.893 -3.365 503 HG2 GLU 69 1HG GLU 69 -18.327 5.210 -3.067 504 HG3 GLU 69 2HG GLU 69 -17.881 6.864 -2.647 505 H LYS 70 H LYS 70 -15.015 6.353 -0.184 506 HA LYS 70 HA LYS 70 -12.479 5.480 -0.196 507 HB2 LYS 70 1HB LYS 70 -13.898 6.625 2.216 508 HB3 LYS 70 2HB LYS 70 -12.153 6.560 2.011 509 HG2 LYS 70 1HG LYS 70 -12.416 7.966 -0.032 510 HG3 LYS 70 2HG LYS 70 -14.124 8.142 0.378 511 HD2 LYS 70 1HD LYS 70 -13.303 10.016 1.390 512 HD3 LYS 70 2HD LYS 70 -13.104 8.867 2.715 513 HE2 LYS 70 1HE LYS 70 -10.777 8.521 2.075 514 HE3 LYS 70 2HE LYS 70 -10.972 9.633 0.722 515 HZ1 LYS 70 1HZ LYS 70 -11.779 10.827 3.176 516 HZ2 LYS 70 2HZ LYS 70 -10.634 11.361 2.051 517 HZ3 LYS 70 3HZ LYS 70 -10.182 10.277 3.268 518 H LEU 71 H LEU 71 -15.021 4.253 1.926 519 HA LEU 71 HA LEU 71 -13.371 2.557 3.473 520 HB2 LEU 71 1HB LEU 71 -15.480 3.089 4.361 521 HB3 LEU 71 2HB LEU 71 -16.313 2.610 2.885 522 HG LEU 71 HG LEU 71 -15.620 0.236 3.415 523 HD11 LEU 71 1HD1 LEU 71 -14.902 1.537 6.035 524 HD12 LEU 71 2HD1 LEU 71 -13.836 0.631 4.960 525 HD13 LEU 71 3HD1 LEU 71 -15.136 -0.198 5.815 526 HD21 LEU 71 1HD2 LEU 71 -17.504 1.798 5.159 527 HD22 LEU 71 2HD2 LEU 71 -17.360 0.043 5.258 528 HD23 LEU 71 3HD2 LEU 71 -17.877 0.803 3.751 529 H ASN 72 H ASN 72 -15.572 1.804 0.766 530 HA ASN 72 HA ASN 72 -15.086 -0.877 0.490 531 HB2 ASN 72 1HB ASN 72 -15.504 1.177 -1.690 532 HB3 ASN 72 2HB ASN 72 -15.590 -0.563 -1.942 533 HD21 ASN 72 1HD2 ASN 72 -17.035 2.146 -0.245 534 HD22 ASN 72 2HD2 ASN 72 -18.589 1.422 -0.027 535 H ASN 73 H ASN 73 -13.158 1.796 -0.811 536 HA ASN 73 HA ASN 73 -11.319 0.237 -2.254 537 HB2 ASN 73 1HB ASN 73 -11.244 3.007 -1.096 538 HB3 ASN 73 2HB ASN 73 -9.803 2.316 -1.833 539 HD21 ASN 73 1HD2 ASN 73 -10.145 4.216 -3.248 540 HD22 ASN 73 2HD2 ASN 73 -11.161 4.017 -4.631 541 H ALA 74 H ALA 74 -11.161 1.553 1.045 542 HA ALA 74 HA ALA 74 -8.628 0.638 1.736 543 HB1 ALA 74 1HB ALA 74 -9.520 0.677 4.100 544 HB2 ALA 74 2HB ALA 74 -9.691 2.173 3.183 545 HB3 ALA 74 3HB ALA 74 -11.082 1.113 3.408 546 H LYS 75 H LYS 75 -11.770 -0.982 2.100 547 HA LYS 75 HA LYS 75 -10.759 -3.326 3.308 548 HB2 LYS 75 1HB LYS 75 -13.279 -2.907 1.690 549 HB3 LYS 75 2HB LYS 75 -12.934 -4.332 2.663 550 HG2 LYS 75 1HG LYS 75 -13.309 -3.252 4.631 551 HG3 LYS 75 2HG LYS 75 -12.813 -1.683 3.994 552 HD2 LYS 75 1HD LYS 75 -15.139 -1.516 4.311 553 HD3 LYS 75 2HD LYS 75 -14.926 -1.766 2.577 554 HE2 LYS 75 1HE LYS 75 -16.695 -3.187 3.219 555 HE3 LYS 75 2HE LYS 75 -15.287 -4.231 3.025 556 HZ1 LYS 75 1HZ LYS 75 -16.821 -3.636 5.390 557 HZ2 LYS 75 2HZ LYS 75 -15.150 -3.539 5.626 558 HZ3 LYS 75 3HZ LYS 75 -15.839 -4.970 5.044 559 H TYR 76 H TYR 76 -11.196 -2.359 -0.037 560 HA TYR 76 HA TYR 76 -10.804 -4.895 -1.215 561 HB2 TYR 76 1HB TYR 76 -11.744 -2.845 -2.349 562 HB3 TYR 76 2HB TYR 76 -10.101 -2.226 -2.444 563 HD1 TYR 76 1HD TYR 76 -11.878 -5.429 -3.222 564 HD2 TYR 76 2HD TYR 76 -9.066 -2.493 -4.480 565 HE1 TYR 76 1HE TYR 76 -11.544 -6.658 -5.327 566 HE2 TYR 76 2HE TYR 76 -8.725 -3.713 -6.587 567 HH TYR 76 HH TYR 76 -10.485 -6.725 -7.272 568 H ALA 77 H ALA 77 -8.551 -2.202 -0.637 569 HA ALA 77 HA ALA 77 -6.258 -3.390 -1.693 570 HB1 ALA 77 1HB ALA 77 -5.440 -1.397 -1.177 571 HB2 ALA 77 2HB ALA 77 -6.891 -1.038 -0.243 572 HB3 ALA 77 3HB ALA 77 -5.507 -1.801 0.537 573 H ILE 78 H ILE 78 -7.650 -3.583 1.552 574 HA ILE 78 HA ILE 78 -5.506 -5.056 2.695 575 HB ILE 78 HB ILE 78 -8.384 -4.779 3.561 576 HG12 ILE 78 1HG1 ILE 78 -5.867 -3.514 4.658 577 HG13 ILE 78 2HG1 ILE 78 -6.985 -2.712 3.559 578 HG21 ILE 78 1HG2 ILE 78 -6.510 -6.695 4.390 579 HG22 ILE 78 2HG2 ILE 78 -6.588 -5.493 5.677 580 HG23 ILE 78 3HG2 ILE 78 -8.058 -6.306 5.139 581 HD11 ILE 78 1HD1 ILE 78 -7.254 -3.318 6.437 582 HD12 ILE 78 2HD1 ILE 78 -7.779 -1.909 5.516 583 HD13 ILE 78 3HD1 ILE 78 -8.714 -3.404 5.452 584 H SER 79 H SER 79 -8.618 -5.982 1.277 585 HA SER 79 HA SER 79 -8.431 -8.738 1.838 586 HB2 SER 79 1HB SER 79 -10.432 -7.242 0.951 587 HB3 SER 79 2HB SER 79 -9.850 -7.796 -0.617 588 HG SER 79 HG SER 79 -11.157 -9.178 1.368 589 H MET 80 H MET 80 -7.509 -6.836 -1.010 590 HA MET 80 HA MET 80 -6.764 -8.864 -2.726 591 HB2 MET 80 1HB MET 80 -5.669 -6.089 -2.325 592 HB3 MET 80 2HB MET 80 -5.042 -7.154 -3.576 593 HG2 MET 80 1HG MET 80 -7.974 -6.648 -3.403 594 HG3 MET 80 2HG MET 80 -6.915 -5.440 -4.125 595 HE1 MET 80 1HE MET 80 -8.513 -9.262 -5.708 596 HE2 MET 80 2HE MET 80 -7.079 -9.691 -4.776 597 HE3 MET 80 3HE MET 80 -8.377 -8.762 -4.023 598 H ALA 81 H ALA 81 -4.562 -7.092 -0.543 599 HA ALA 81 HA ALA 81 -2.235 -8.406 -0.893 600 HB1 ALA 81 1HB ALA 81 -3.432 -6.925 1.256 601 HB2 ALA 81 2HB ALA 81 -2.437 -8.235 1.895 602 HB3 ALA 81 3HB ALA 81 -1.734 -7.052 0.793 603 H ARG 82 H ARG 82 -4.888 -9.549 1.183 604 HA ARG 82 HA ARG 82 -3.587 -11.940 1.973 605 HB2 ARG 82 1HB ARG 82 -6.351 -10.850 2.149 606 HB3 ARG 82 2HB ARG 82 -6.148 -12.584 2.357 607 HG2 ARG 82 1HG ARG 82 -4.663 -12.246 4.211 608 HG3 ARG 82 2HG ARG 82 -4.667 -10.501 3.945 609 HD2 ARG 82 1HD ARG 82 -6.173 -10.789 5.697 610 HD3 ARG 82 2HD ARG 82 -7.210 -10.667 4.277 611 HE ARG 82 HE ARG 82 -6.580 -13.373 4.800 612 HH11 ARG 82 1HH1 ARG 82 -8.520 -10.736 5.988 613 HH12 ARG 82 2HH1 ARG 82 -9.731 -11.766 6.675 614 HH21 ARG 82 1HH2 ARG 82 -8.169 -14.739 5.703 615 HH22 ARG 82 2HH2 ARG 82 -9.530 -14.042 6.514 616 H LYS 83 H LYS 83 -6.038 -11.246 -0.502 617 HA LYS 83 HA LYS 83 -6.505 -13.800 -1.436 618 HB2 LYS 83 1HB LYS 83 -6.622 -11.084 -2.644 619 HB3 LYS 83 2HB LYS 83 -6.682 -12.456 -3.743 620 HG2 LYS 83 1HG LYS 83 -8.915 -11.738 -3.171 621 HG3 LYS 83 2HG LYS 83 -8.607 -13.347 -2.512 622 HD2 LYS 83 1HD LYS 83 -7.925 -12.077 -0.364 623 HD3 LYS 83 2HD LYS 83 -8.798 -10.720 -1.079 624 HE2 LYS 83 1HE LYS 83 -10.405 -11.777 0.234 625 HE3 LYS 83 2HE LYS 83 -10.726 -12.391 -1.386 626 HZ1 LYS 83 1HZ LYS 83 -9.977 -13.814 0.960 627 HZ2 LYS 83 2HZ LYS 83 -8.901 -14.132 -0.304 628 HZ3 LYS 83 3HZ LYS 83 -10.556 -14.410 -0.513 629 H ILE 84 H ILE 84 -4.030 -11.511 -2.588 630 HA ILE 84 HA ILE 84 -2.840 -13.402 -4.365 631 HB ILE 84 HB ILE 84 -1.019 -11.753 -4.587 632 HG12 ILE 84 1HG1 ILE 84 -2.572 -10.037 -2.649 633 HG13 ILE 84 2HG1 ILE 84 -1.187 -11.009 -2.161 634 HG21 ILE 84 1HG2 ILE 84 -3.508 -10.129 -4.683 635 HG22 ILE 84 2HG2 ILE 84 -2.238 -10.325 -5.890 636 HG23 ILE 84 3HG2 ILE 84 -3.427 -11.604 -5.646 637 HD11 ILE 84 1HD1 ILE 84 -0.329 -9.560 -4.383 638 HD12 ILE 84 2HD1 ILE 84 -1.260 -8.427 -3.403 639 HD13 ILE 84 3HD1 ILE 84 0.100 -9.295 -2.694 640 H GLY 85 H GLY 85 -2.374 -12.521 -1.025 641 HA2 GLY 85 1HA GLY 85 -1.381 -14.354 0.331 642 HA3 GLY 85 2HA GLY 85 -0.123 -14.434 -0.894 643 H ALA 86 H ALA 86 -1.495 -12.447 1.670 644 HA ALA 86 HA ALA 86 1.024 -11.624 2.620 645 HB1 ALA 86 1HB ALA 86 1.099 -9.318 1.994 646 HB2 ALA 86 2HB ALA 86 0.940 -10.277 0.522 647 HB3 ALA 86 3HB ALA 86 -0.462 -9.434 1.180 648 H ARG 87 H ARG 87 0.799 -11.057 4.695 649 HA ARG 87 HA ARG 87 -1.818 -10.924 5.848 650 HB2 ARG 87 1HB ARG 87 0.901 -10.483 7.094 651 HB3 ARG 87 2HB ARG 87 -0.607 -10.640 7.984 652 HG2 ARG 87 1HG ARG 87 -0.734 -12.888 7.654 653 HG3 ARG 87 2HG ARG 87 0.132 -12.823 6.118 654 HD2 ARG 87 1HD ARG 87 1.569 -13.891 7.677 655 HD3 ARG 87 2HD ARG 87 2.202 -12.264 7.427 656 HE ARG 87 HE ARG 87 0.508 -12.156 9.625 657 HH11 ARG 87 1HH1 ARG 87 3.490 -13.708 8.719 658 HH12 ARG 87 2HH1 ARG 87 4.106 -13.761 10.338 659 HH21 ARG 87 1HH2 ARG 87 1.309 -12.219 11.760 660 HH22 ARG 87 2HH2 ARG 87 2.864 -12.914 12.066 661 H VAL 88 H VAL 88 -2.681 -9.189 7.093 662 HA VAL 88 HA VAL 88 -1.609 -6.540 6.371 663 HB VAL 88 HB VAL 88 -4.019 -5.747 6.474 664 HG11 VAL 88 1HG1 VAL 88 -2.937 -5.845 4.364 665 HG12 VAL 88 2HG1 VAL 88 -3.073 -7.603 4.300 666 HG13 VAL 88 3HG1 VAL 88 -4.517 -6.600 4.158 667 HG21 VAL 88 1HG2 VAL 88 -5.042 -8.361 5.695 668 HG22 VAL 88 2HG2 VAL 88 -4.498 -8.306 7.371 669 HG23 VAL 88 3HG2 VAL 88 -5.717 -7.165 6.803 670 H TYR 89 H TYR 89 -3.217 -8.536 8.758 671 HA TYR 89 HA TYR 89 -3.850 -8.098 10.934 672 HB2 TYR 89 1HB TYR 89 -0.948 -7.538 10.598 673 HB3 TYR 89 2HB TYR 89 -1.678 -7.100 12.138 674 HD1 TYR 89 2HD TYR 89 -1.429 -9.972 9.768 675 HD2 TYR 89 1HD TYR 89 -1.837 -8.701 13.807 676 HE1 TYR 89 2HE TYR 89 -1.234 -12.307 10.516 677 HE2 TYR 89 1HE TYR 89 -1.642 -11.033 14.567 678 HH TYR 89 HH TYR 89 -1.905 -13.670 12.489 679 H ALA 90 H ALA 90 -4.857 -6.072 9.367 680 HA ALA 90 HA ALA 90 -4.816 -3.856 11.261 681 HB1 ALA 90 1HB ALA 90 -3.995 -3.640 8.391 682 HB2 ALA 90 2HB ALA 90 -4.737 -2.271 9.219 683 HB3 ALA 90 3HB ALA 90 -3.231 -2.958 9.827 684 H LEU 91 H LEU 91 -6.444 -2.086 10.241 685 HA LEU 91 HA LEU 91 -8.800 -3.524 9.226 686 HB2 LEU 91 1HB LEU 91 -8.848 -3.104 11.724 687 HB3 LEU 91 2HB LEU 91 -8.944 -1.387 11.337 688 HG LEU 91 HG LEU 91 -11.052 -1.929 10.045 689 HD11 LEU 91 1HD1 LEU 91 -12.128 -3.973 10.303 690 HD12 LEU 91 2HD1 LEU 91 -11.118 -4.446 11.667 691 HD13 LEU 91 3HD1 LEU 91 -10.445 -4.429 10.037 692 HD21 LEU 91 1HD2 LEU 91 -10.690 -1.187 12.598 693 HD22 LEU 91 2HD2 LEU 91 -11.576 -2.692 12.849 694 HD23 LEU 91 3HD2 LEU 91 -12.280 -1.407 11.868 695 HA PRO 92 HA PRO 92 -8.913 -0.234 6.289 696 HB2 PRO 92 1HB PRO 92 -11.450 -0.604 5.395 697 HB3 PRO 92 2HB PRO 92 -10.112 -1.675 4.961 698 HG2 PRO 92 1HG PRO 92 -12.231 -2.039 7.044 699 HG3 PRO 92 2HG PRO 92 -11.583 -3.219 5.889 700 HD2 PRO 92 1HD PRO 92 -10.802 -3.138 8.480 701 HD3 PRO 92 2HD PRO 92 -9.712 -3.634 7.169 702 H GLU 93 H GLU 93 -11.760 -0.610 8.401 703 HA GLU 93 HA GLU 93 -13.032 1.750 8.160 704 HB2 GLU 93 1HB GLU 93 -12.406 0.141 10.617 705 HB3 GLU 93 2HB GLU 93 -13.331 1.631 10.738 706 HG2 GLU 93 1HG GLU 93 -14.743 0.489 8.820 707 HG3 GLU 93 2HG GLU 93 -14.075 -0.976 9.539 708 H ASP 94 H ASP 94 -9.902 1.261 9.637 709 HA ASP 94 HA ASP 94 -9.767 4.034 10.526 710 HB2 ASP 94 1HB ASP 94 -7.899 1.683 10.832 711 HB3 ASP 94 2HB ASP 94 -7.470 3.314 11.342 712 H LEU 95 H LEU 95 -8.355 1.892 8.118 713 HA LEU 95 HA LEU 95 -6.287 3.455 7.166 714 HB2 LEU 95 1HB LEU 95 -6.498 1.268 6.329 715 HB3 LEU 95 2HB LEU 95 -8.151 1.549 5.786 716 HG LEU 95 HG LEU 95 -7.314 3.005 4.002 717 HD11 LEU 95 1HD1 LEU 95 -5.235 3.648 5.328 718 HD12 LEU 95 2HD1 LEU 95 -5.041 3.391 3.595 719 HD13 LEU 95 3HD1 LEU 95 -4.534 2.143 4.733 720 HD21 LEU 95 1HD2 LEU 95 -5.799 0.410 3.920 721 HD22 LEU 95 2HD2 LEU 95 -6.534 1.297 2.584 722 HD23 LEU 95 3HD2 LEU 95 -7.555 0.486 3.771 723 H VAL 96 H VAL 96 -9.733 3.647 6.428 724 HA VAL 96 HA VAL 96 -9.717 5.411 4.305 725 HB VAL 96 HB VAL 96 -11.664 5.089 6.576 726 HG11 VAL 96 1HG1 VAL 96 -13.143 6.412 4.789 727 HG12 VAL 96 2HG1 VAL 96 -12.272 7.221 6.094 728 HG13 VAL 96 3HG1 VAL 96 -11.582 7.169 4.471 729 HG21 VAL 96 1HG2 VAL 96 -11.176 3.551 4.373 730 HG22 VAL 96 2HG2 VAL 96 -12.699 3.595 5.261 731 HG23 VAL 96 3HG2 VAL 96 -12.492 4.583 3.815 732 H GLU 97 H GLU 97 -9.156 6.037 7.699 733 HA GLU 97 HA GLU 97 -9.000 8.920 7.169 734 HB2 GLU 97 1HB GLU 97 -9.195 7.349 9.737 735 HB3 GLU 97 2HB GLU 97 -8.865 9.075 9.694 736 HG2 GLU 97 1HG GLU 97 -11.050 9.075 8.197 737 HG3 GLU 97 2HG GLU 97 -11.368 7.604 9.114 738 H VAL 98 H VAL 98 -6.966 7.148 6.208 739 HA VAL 98 HA VAL 98 -4.710 6.655 6.396 740 HB VAL 98 HB VAL 98 -4.608 9.616 6.970 741 HG11 VAL 98 1HG1 VAL 98 -2.698 8.393 5.117 742 HG12 VAL 98 2HG1 VAL 98 -2.433 9.547 6.425 743 HG13 VAL 98 3HG1 VAL 98 -2.567 7.824 6.780 744 HG21 VAL 98 1HG2 VAL 98 -6.137 8.773 5.035 745 HG22 VAL 98 2HG2 VAL 98 -5.020 10.109 4.753 746 HG23 VAL 98 3HG2 VAL 98 -4.607 8.484 4.206 747 H ASN 99 H ASN 99 -5.759 5.888 8.764 748 HA ASN 99 HA ASN 99 -4.509 7.182 10.994 749 HB2 ASN 99 1HB ASN 99 -6.195 4.762 10.586 750 HB3 ASN 99 2HB ASN 99 -5.210 4.830 12.044 751 HD21 ASN 99 1HD2 ASN 99 -7.656 4.721 12.682 752 HD22 ASN 99 2HD2 ASN 99 -8.358 6.252 13.066 753 HA PRO 100 HA PRO 100 -0.550 5.236 10.334 754 HB2 PRO 100 1HB PRO 100 0.658 6.349 12.495 755 HB3 PRO 100 2HB PRO 100 0.372 7.234 10.992 756 HG2 PRO 100 1HG PRO 100 -1.200 7.271 13.540 757 HG3 PRO 100 2HG PRO 100 -0.728 8.625 12.497 758 HD2 PRO 100 1HD PRO 100 -3.208 7.538 12.440 759 HD3 PRO 100 2HD PRO 100 -2.436 8.231 11.000 760 H LYS 101 H LYS 101 -2.846 4.599 12.653 761 HA LYS 101 HA LYS 101 -1.235 2.971 14.407 762 HB2 LYS 101 1HB LYS 101 -4.247 3.038 14.184 763 HB3 LYS 101 2HB LYS 101 -3.292 2.459 15.543 764 HG2 LYS 101 1HG LYS 101 -3.271 5.313 14.594 765 HG3 LYS 101 2HG LYS 101 -4.346 4.705 15.855 766 HD2 LYS 101 1HD LYS 101 -2.175 3.849 16.967 767 HD3 LYS 101 2HD LYS 101 -1.361 4.983 15.887 768 HE2 LYS 101 1HE LYS 101 -1.736 6.096 17.966 769 HE3 LYS 101 2HE LYS 101 -2.848 6.780 16.780 770 HZ1 LYS 101 1HZ LYS 101 -4.267 6.439 18.502 771 HZ2 LYS 101 2HZ LYS 101 -3.414 5.113 19.115 772 HZ3 LYS 101 3HZ LYS 101 -4.410 4.925 17.759 773 H MET 102 H MET 102 -3.084 2.540 11.507 774 HA MET 102 HA MET 102 -2.846 -0.380 11.742 775 HB2 MET 102 1HB MET 102 -4.592 1.362 10.003 776 HB3 MET 102 2HB MET 102 -4.437 -0.374 9.767 777 HG2 MET 102 1HG MET 102 -5.546 1.053 12.168 778 HG3 MET 102 2HG MET 102 -6.417 0.041 11.020 779 HE1 MET 102 1HE MET 102 -7.164 -0.997 13.801 780 HE2 MET 102 2HE MET 102 -5.828 -1.518 14.827 781 HE3 MET 102 3HE MET 102 -5.932 0.163 14.299 782 H VAL 103 H VAL 103 -2.191 2.340 9.571 783 HA VAL 103 HA VAL 103 -1.156 1.071 7.377 784 HB VAL 103 HB VAL 103 -0.130 3.595 8.682 785 HG11 VAL 103 1HG1 VAL 103 1.571 2.746 7.206 786 HG12 VAL 103 2HG1 VAL 103 0.385 2.481 5.927 787 HG13 VAL 103 3HG1 VAL 103 0.782 4.123 6.437 788 HG21 VAL 103 1HG2 VAL 103 -2.089 3.154 6.430 789 HG22 VAL 103 2HG2 VAL 103 -2.480 3.704 8.059 790 HG23 VAL 103 3HG2 VAL 103 -1.512 4.722 6.993 791 H MET 104 H MET 104 0.147 1.156 10.559 792 HA MET 104 HA MET 104 2.864 0.808 10.122 793 HB2 MET 104 1HB MET 104 2.843 -0.447 12.299 794 HB3 MET 104 2HB MET 104 2.074 1.133 12.350 795 HG2 MET 104 1HG MET 104 -0.048 0.245 12.540 796 HG3 MET 104 2HG MET 104 0.431 -1.307 11.856 797 HE1 MET 104 1HE MET 104 0.519 -3.464 13.734 798 HE2 MET 104 2HE MET 104 -0.447 -2.860 15.080 799 HE3 MET 104 3HE MET 104 -0.895 -2.458 13.422 800 H THR 105 H THR 105 0.242 -1.543 9.986 801 HA THR 105 HA THR 105 2.137 -3.669 9.312 802 HB THR 105 HB THR 105 -0.023 -5.085 9.319 803 HG1 THR 105 1HG THR 105 -1.052 -3.087 11.005 804 HG21 THR 105 1HG2 THR 105 0.000 -5.197 11.819 805 HG22 THR 105 2HG2 THR 105 1.067 -3.793 11.819 806 HG23 THR 105 3HG2 THR 105 1.595 -5.303 11.075 807 H VAL 106 H VAL 106 -0.697 -1.997 7.998 808 HA VAL 106 HA VAL 106 -1.235 -3.327 5.708 809 HB VAL 106 HB VAL 106 -0.927 -0.325 5.826 810 HG11 VAL 106 1HG1 VAL 106 -1.993 -0.197 3.855 811 HG12 VAL 106 2HG1 VAL 106 -1.462 -1.868 3.649 812 HG13 VAL 106 3HG1 VAL 106 -3.086 -1.525 4.247 813 HG21 VAL 106 1HG2 VAL 106 -2.434 -0.486 7.483 814 HG22 VAL 106 2HG2 VAL 106 -3.578 -0.824 6.183 815 HG23 VAL 106 3HG2 VAL 106 -2.846 -2.153 7.081 816 H PHE 107 H PHE 107 1.273 -0.799 5.947 817 HA PHE 107 HA PHE 107 2.336 -1.467 3.358 818 HB2 PHE 107 1HB PHE 107 2.910 0.559 5.457 819 HB3 PHE 107 2HB PHE 107 4.223 0.148 4.358 820 HD1 PHE 107 2HD PHE 107 2.838 -0.276 1.832 821 HD2 PHE 107 1HD PHE 107 2.188 2.662 4.843 822 HE1 PHE 107 2HE PHE 107 1.897 1.244 0.141 823 HE2 PHE 107 1HE PHE 107 1.246 4.186 3.157 824 HZ PHE 107 HZ PHE 107 1.101 3.479 0.802 825 H ALA 108 H ALA 108 3.803 -1.435 6.611 826 HA ALA 108 HA ALA 108 6.161 -2.634 6.232 827 HB1 ALA 108 1HB ALA 108 6.054 -3.541 8.443 828 HB2 ALA 108 2HB ALA 108 5.179 -2.009 8.436 829 HB3 ALA 108 3HB ALA 108 4.290 -3.532 8.416 830 H CYS 109 H CYS 109 3.132 -4.476 6.616 831 HA CYS 109 HA CYS 109 4.108 -7.028 6.316 832 HB2 CYS 109 1HB CYS 109 1.493 -5.874 5.333 833 HB3 CYS 109 2HB CYS 109 1.848 -7.597 5.386 834 HG CYS 109 HG CYS 109 0.315 -6.072 7.615 835 H LEU 110 H LEU 110 3.264 -4.706 3.787 836 HA LEU 110 HA LEU 110 3.706 -6.472 1.612 837 HB2 LEU 110 1HB LEU 110 3.375 -3.537 1.948 838 HB3 LEU 110 2HB LEU 110 4.057 -4.128 0.434 839 HG LEU 110 HG LEU 110 1.454 -5.200 1.466 840 HD11 LEU 110 1HD1 LEU 110 0.237 -3.437 0.743 841 HD12 LEU 110 2HD1 LEU 110 1.395 -3.008 -0.515 842 HD13 LEU 110 3HD1 LEU 110 1.705 -2.554 1.160 843 HD21 LEU 110 1HD2 LEU 110 1.519 -6.354 -0.425 844 HD22 LEU 110 2HD2 LEU 110 3.097 -5.657 -0.794 845 HD23 LEU 110 3HD2 LEU 110 1.626 -4.859 -1.355 846 H MET 111 H MET 111 5.670 -3.722 2.767 847 HA MET 111 HA MET 111 7.928 -4.431 1.199 848 HB2 MET 111 1HB MET 111 9.034 -2.844 3.041 849 HB3 MET 111 2HB MET 111 8.062 -2.217 1.716 850 HG2 MET 111 1HG MET 111 6.650 -2.950 4.212 851 HG3 MET 111 2HG MET 111 7.667 -1.511 4.239 852 HE1 MET 111 1HE MET 111 7.659 -0.256 1.715 853 HE2 MET 111 2HE MET 111 6.156 0.563 1.293 854 HE3 MET 111 3HE MET 111 6.913 0.860 2.859 855 H GLY 112 H GLY 112 6.641 -5.841 3.929 856 HA2 GLY 112 1HA GLY 112 8.546 -6.453 5.718 857 HA3 GLY 112 2HA GLY 112 7.446 -7.677 5.099 858 H LYS 113 H LYS 113 8.588 -7.428 2.370 859 HA LYS 113 HA LYS 113 10.441 -9.512 2.486 860 HB2 LYS 113 1HB LYS 113 9.789 -7.489 0.355 861 HB3 LYS 113 2HB LYS 113 11.019 -8.721 0.106 862 HG2 LYS 113 1HG LYS 113 9.326 -10.458 0.543 863 HG3 LYS 113 2HG LYS 113 8.105 -9.194 0.699 864 HD2 LYS 113 1HD LYS 113 8.953 -8.470 -1.657 865 HD3 LYS 113 2HD LYS 113 9.585 -10.117 -1.731 866 HE2 LYS 113 1HE LYS 113 7.490 -10.363 -2.672 867 HE3 LYS 113 2HE LYS 113 7.187 -10.788 -0.987 868 HZ1 LYS 113 1HZ LYS 113 6.514 -8.407 -0.673 869 HZ2 LYS 113 2HZ LYS 113 5.474 -9.328 -1.638 870 HZ3 LYS 113 3HZ LYS 113 6.551 -8.238 -2.356 871 H GLY 114 H GLY 114 10.970 -6.016 2.120 872 HA2 GLY 114 1HA GLY 114 13.690 -5.944 1.743 873 HA3 GLY 114 2HA GLY 114 12.800 -4.726 2.645 874 H MET 115 H MET 115 12.006 -6.054 4.879 875 HA MET 115 HA MET 115 14.498 -6.274 6.315 876 HB2 MET 115 1HB MET 115 12.481 -5.093 7.216 877 HB3 MET 115 2HB MET 115 11.687 -6.656 7.356 878 HG2 MET 115 1HG MET 115 12.578 -5.955 9.490 879 HG3 MET 115 2HG MET 115 13.411 -7.397 8.914 880 HE1 MET 115 1HE MET 115 16.025 -5.880 10.948 881 HE2 MET 115 2HE MET 115 14.924 -4.508 11.085 882 HE3 MET 115 3HE MET 115 14.293 -6.155 11.139 883 H LYS 116 H LYS 116 15.101 -8.064 7.639 884 HA LYS 116 HA LYS 116 15.559 -10.264 7.996 885 HB2 LYS 116 1HB LYS 116 12.610 -10.446 7.380 886 HB3 LYS 116 2HB LYS 116 13.565 -11.828 7.900 887 HG2 LYS 116 1HG LYS 116 13.923 -10.934 10.025 888 HG3 LYS 116 2HG LYS 116 13.471 -9.307 9.514 889 HD2 LYS 116 1HD LYS 116 11.634 -10.085 10.757 890 HD3 LYS 116 2HD LYS 116 11.151 -10.269 9.068 891 HE2 LYS 116 1HE LYS 116 10.521 -12.254 10.248 892 HE3 LYS 116 2HE LYS 116 11.876 -12.648 9.191 893 HZ1 LYS 116 1HZ LYS 116 13.065 -13.290 10.929 894 HZ2 LYS 116 2HZ LYS 116 11.698 -13.096 11.906 895 HZ3 LYS 116 3HZ LYS 116 12.805 -11.828 11.739 896 H ARG 117 H ARG 117 16.541 -9.526 5.665 897 HA ARG 117 HA ARG 117 15.603 -10.812 3.357 898 HB2 ARG 117 1HB ARG 117 18.334 -9.846 4.181 899 HB3 ARG 117 2HB ARG 117 18.050 -10.599 2.619 900 HG2 ARG 117 1HG ARG 117 16.480 -8.868 2.021 901 HG3 ARG 117 2HG ARG 117 16.630 -8.143 3.624 902 HD2 ARG 117 1HD ARG 117 18.010 -6.848 2.232 903 HD3 ARG 117 2HD ARG 117 19.108 -7.907 3.115 904 HE ARG 117 HE ARG 117 18.731 -9.319 0.898 905 HH11 ARG 117 1HH1 ARG 117 19.365 -5.922 1.327 906 HH12 ARG 117 2HH1 ARG 117 20.195 -5.753 -0.185 907 HH21 ARG 117 1HH2 ARG 117 19.822 -9.109 -1.094 908 HH22 ARG 117 2HH2 ARG 117 20.453 -7.566 -1.561 909 H VAL 118 H VAL 118 16.344 -12.699 2.287 910 HA VAL 118 HA VAL 118 17.048 -14.843 4.139 911 HB VAL 118 HB VAL 118 16.159 -14.968 1.253 912 HG11 VAL 118 1HG1 VAL 118 17.390 -16.918 1.558 913 HG12 VAL 118 2HG1 VAL 118 16.889 -17.087 3.242 914 HG13 VAL 118 3HG1 VAL 118 15.744 -17.417 1.941 915 HG21 VAL 118 1HG2 VAL 118 14.027 -15.663 2.088 916 HG22 VAL 118 2HG2 VAL 118 14.630 -15.704 3.745 917 HG23 VAL 118 3HG2 VAL 118 14.464 -14.162 2.904 918 H SER 119 H SER 119 19.262 -14.380 4.430 919 HA SER 119 HA SER 119 20.954 -14.764 2.053 920 HB2 SER 119 1HB SER 119 22.740 -13.662 3.313 921 HB3 SER 119 2HB SER 119 21.304 -12.639 3.265 922 HG SER 119 HG SER 119 21.522 -14.387 5.414 923 H GLY 120 H GLY 120 23.224 -15.693 2.819 924 HA2 GLY 120 1HA GLY 120 22.636 -18.098 4.434 925 HA3 GLY 120 2HA GLY 120 23.644 -18.134 2.995 926 HA PRO 121 HA PRO 121 26.517 -17.852 6.571 927 HB2 PRO 121 1HB PRO 121 28.384 -19.486 5.470 928 HB3 PRO 121 2HB PRO 121 26.993 -20.091 6.376 929 HG2 PRO 121 1HG PRO 121 27.382 -19.885 3.414 930 HG3 PRO 121 2HG PRO 121 26.685 -21.212 4.361 931 HD2 PRO 121 1HD PRO 121 25.158 -19.413 3.033 932 HD3 PRO 121 2HD PRO 121 24.639 -20.170 4.553 933 H SER 122 H SER 122 26.592 -17.008 3.278 934 HA SER 122 HA SER 122 29.200 -15.680 3.556 935 HB2 SER 122 1HB SER 122 29.180 -17.035 1.602 936 HB3 SER 122 2HB SER 122 27.577 -16.468 1.135 937 HG SER 122 HG SER 122 29.806 -14.736 1.330 938 H SER 123 H SER 123 29.436 -13.486 2.981 939 HA SER 123 HA SER 123 26.955 -11.939 2.719 940 HB2 SER 123 1HB SER 123 27.708 -10.330 4.392 941 HB3 SER 123 2HB SER 123 27.622 -11.939 5.106 942 HG SER 123 HG SER 123 29.784 -12.051 5.164 943 H GLY 124 H GLY 124 27.133 -10.012 1.582 944 HA2 GLY 124 1HA GLY 124 27.963 -8.656 -0.076 945 HA3 GLY 124 2HA GLY 124 29.439 -8.654 0.878 Start of MODEL 4 1 H1 GLY 1 H GLY 1 11.990 9.238 2.192 2 HA2 GLY 1 1HA GLY 1 12.775 10.315 0.059 3 HA3 GLY 1 2HA GLY 1 13.700 11.387 1.100 4 H SER 2 H SER 2 15.780 10.904 1.131 5 HA SER 2 HA SER 2 16.563 8.069 0.931 6 HB2 SER 2 1HB SER 2 17.203 9.472 -1.037 7 HB3 SER 2 2HB SER 2 18.183 10.467 0.040 8 HG SER 2 HG SER 2 19.583 8.840 0.301 9 H SER 3 H SER 3 16.718 7.616 3.097 10 HA SER 3 HA SER 3 19.010 8.789 4.460 11 HB2 SER 3 1HB SER 3 16.244 8.717 5.690 12 HB3 SER 3 2HB SER 3 17.725 9.137 6.549 13 HG SER 3 HG SER 3 17.909 10.775 4.734 14 H GLY 4 H GLY 4 19.453 7.579 6.557 15 HA2 GLY 4 1HA GLY 4 18.585 4.769 6.345 16 HA3 GLY 4 2HA GLY 4 20.291 5.168 6.487 17 H SER 5 H SER 5 18.204 3.729 8.223 18 HA SER 5 HA SER 5 19.272 4.640 10.727 19 HB2 SER 5 1HB SER 5 16.426 5.225 9.975 20 HB3 SER 5 2HB SER 5 16.843 4.901 11.658 21 HG SER 5 HG SER 5 18.573 6.653 10.535 22 H SER 6 H SER 6 18.811 3.207 12.471 23 HA SER 6 HA SER 6 18.978 0.569 12.055 24 HB2 SER 6 1HB SER 6 19.098 1.514 14.294 25 HB3 SER 6 2HB SER 6 17.373 1.881 14.263 26 HG SER 6 HG SER 6 18.354 -0.239 15.236 27 H GLY 7 H GLY 7 17.796 -1.020 11.208 28 HA2 GLY 7 1HA GLY 7 15.956 -2.242 10.538 29 HA3 GLY 7 2HA GLY 7 14.943 -1.123 11.436 30 H ASN 8 H ASN 8 13.754 -1.826 9.283 31 HA ASN 8 HA ASN 8 14.353 0.221 7.248 32 HB2 ASN 8 1HB ASN 8 13.445 -2.605 7.036 33 HB3 ASN 8 2HB ASN 8 12.791 -1.459 5.871 34 HD21 ASN 8 1HD2 ASN 8 13.850 -2.353 4.136 35 HD22 ASN 8 2HD2 ASN 8 15.560 -2.232 3.917 36 H ASP 9 H ASP 9 13.054 1.430 9.042 37 HA ASP 9 HA ASP 9 10.171 1.076 8.712 38 HB2 ASP 9 1HB ASP 9 11.766 2.847 10.574 39 HB3 ASP 9 2HB ASP 9 10.007 2.774 10.531 40 H ASP 10 H ASP 10 12.754 3.326 7.987 41 HA ASP 10 HA ASP 10 10.983 5.395 7.050 42 HB2 ASP 10 1HB ASP 10 13.978 5.040 6.849 43 HB3 ASP 10 2HB ASP 10 13.117 6.450 6.239 44 H ILE 11 H ILE 11 12.959 2.855 5.614 45 HA ILE 11 HA ILE 11 12.725 3.620 2.927 46 HB ILE 11 HB ILE 11 14.286 1.874 3.784 47 HG12 ILE 11 1HG1 ILE 11 12.572 0.710 1.602 48 HG13 ILE 11 2HG1 ILE 11 13.511 2.175 1.338 49 HG21 ILE 11 1HG2 ILE 11 11.782 0.626 4.517 50 HG22 ILE 11 2HG2 ILE 11 12.790 -0.454 3.554 51 HG23 ILE 11 3HG2 ILE 11 13.424 0.252 5.041 52 HD11 ILE 11 1HD1 ILE 11 14.363 -0.604 1.448 53 HD12 ILE 11 2HD1 ILE 11 15.133 0.795 0.699 54 HD13 ILE 11 3HD1 ILE 11 15.360 0.479 2.419 55 H ILE 12 H ILE 12 10.353 2.559 5.069 56 HA ILE 12 HA ILE 12 8.664 0.972 3.563 57 HB ILE 12 HB ILE 12 7.923 3.121 5.548 58 HG12 ILE 12 1HG1 ILE 12 8.322 0.134 5.811 59 HG13 ILE 12 2HG1 ILE 12 9.320 1.397 6.524 60 HG21 ILE 12 1HG2 ILE 12 6.253 1.679 3.785 61 HG22 ILE 12 2HG2 ILE 12 6.007 1.017 5.400 62 HG23 ILE 12 3HG2 ILE 12 5.782 2.741 5.112 63 HD11 ILE 12 1HD1 ILE 12 7.224 0.080 7.730 64 HD12 ILE 12 2HD1 ILE 12 7.986 1.571 8.288 65 HD13 ILE 12 3HD1 ILE 12 6.537 1.642 7.286 66 H VAL 13 H VAL 13 9.080 4.469 3.490 67 HA VAL 13 HA VAL 13 6.909 4.870 1.633 68 HB VAL 13 HB VAL 13 9.072 6.775 2.539 69 HG11 VAL 13 1HG1 VAL 13 6.476 7.663 1.382 70 HG12 VAL 13 2HG1 VAL 13 8.045 8.472 1.391 71 HG13 VAL 13 3HG1 VAL 13 7.753 7.124 0.291 72 HG21 VAL 13 1HG2 VAL 13 7.247 7.746 3.920 73 HG22 VAL 13 2HG2 VAL 13 6.229 6.380 3.463 74 HG23 VAL 13 3HG2 VAL 13 7.699 6.109 4.397 75 H ASN 14 H ASN 14 10.453 5.246 1.474 76 HA ASN 14 HA ASN 14 10.730 5.897 -1.179 77 HB2 ASN 14 1HB ASN 14 12.507 5.559 0.718 78 HB3 ASN 14 2HB ASN 14 12.639 3.937 0.046 79 HD21 ASN 14 1HD2 ASN 14 12.611 4.121 -2.529 80 HD22 ASN 14 2HD2 ASN 14 13.822 5.186 -3.145 81 H TRP 15 H TRP 15 10.489 2.648 0.226 82 HA TRP 15 HA TRP 15 10.856 1.163 -2.098 83 HB2 TRP 15 1HB TRP 15 10.684 0.331 0.312 84 HB3 TRP 15 2HB TRP 15 8.936 0.381 0.093 85 HD1 TRP 15 HD TRP 15 12.048 -1.436 -1.281 86 HE1 TRP 15 1HE TRP 15 11.292 -3.689 -2.270 87 HE3 TRP 15 3HE TRP 15 6.989 -0.875 -0.805 88 HZ2 TRP 15 2HZ TRP 15 8.871 -5.048 -2.781 89 HZ3 TRP 15 3HZ TRP 15 5.523 -2.697 -1.568 90 HH2 TRP 15 HH TRP 15 6.447 -4.740 -2.535 91 H VAL 16 H VAL 16 7.795 2.263 -0.643 92 HA VAL 16 HA VAL 16 6.033 1.258 -2.517 93 HB VAL 16 HB VAL 16 5.785 3.913 -1.097 94 HG11 VAL 16 1HG1 VAL 16 3.274 2.969 -1.294 95 HG12 VAL 16 2HG1 VAL 16 4.006 4.050 -2.483 96 HG13 VAL 16 3HG1 VAL 16 3.965 2.311 -2.777 97 HG21 VAL 16 1HG2 VAL 16 6.205 1.675 0.215 98 HG22 VAL 16 2HG2 VAL 16 4.998 2.836 0.770 99 HG23 VAL 16 3HG2 VAL 16 4.497 1.406 -0.132 100 H ASN 17 H ASN 17 7.566 4.476 -2.515 101 HA ASN 17 HA ASN 17 6.487 5.465 -4.859 102 HB2 ASN 17 1HB ASN 17 9.054 5.950 -3.402 103 HB3 ASN 17 2HB ASN 17 8.836 6.663 -4.997 104 HD21 ASN 17 1HD2 ASN 17 7.457 6.448 -1.770 105 HD22 ASN 17 2HD2 ASN 17 6.654 7.978 -1.812 106 H GLU 18 H GLU 18 9.595 3.750 -4.501 107 HA GLU 18 HA GLU 18 10.269 3.645 -7.198 108 HB2 GLU 18 1HB GLU 18 10.997 2.063 -4.786 109 HB3 GLU 18 2HB GLU 18 11.400 1.377 -6.353 110 HG2 GLU 18 1HG GLU 18 12.381 3.796 -6.759 111 HG3 GLU 18 2HG GLU 18 12.479 3.783 -4.999 112 H THR 19 H THR 19 8.858 0.977 -5.290 113 HA THR 19 HA THR 19 8.363 -0.865 -7.192 114 HB THR 19 HB THR 19 6.470 -0.043 -4.984 115 HG1 THR 19 1HG THR 19 8.714 -1.701 -5.182 116 HG21 THR 19 1HG2 THR 19 5.823 -2.576 -5.318 117 HG22 THR 19 2HG2 THR 19 6.357 -2.264 -6.970 118 HG23 THR 19 3HG2 THR 19 5.049 -1.309 -6.270 119 H LEU 20 H LEU 20 6.514 2.091 -6.680 120 HA LEU 20 HA LEU 20 4.579 1.430 -8.717 121 HB2 LEU 20 1HB LEU 20 5.085 3.970 -7.178 122 HB3 LEU 20 2HB LEU 20 3.754 3.737 -8.309 123 HG LEU 20 HG LEU 20 4.103 1.977 -5.899 124 HD11 LEU 20 1HD1 LEU 20 3.108 3.448 -4.503 125 HD12 LEU 20 2HD1 LEU 20 2.166 4.204 -5.787 126 HD13 LEU 20 3HD1 LEU 20 3.866 4.624 -5.576 127 HD21 LEU 20 1HD2 LEU 20 1.638 2.752 -7.448 128 HD22 LEU 20 2HD2 LEU 20 1.789 1.494 -6.220 129 HD23 LEU 20 3HD2 LEU 20 2.595 1.308 -7.779 130 H ARG 21 H ARG 21 7.433 3.467 -8.404 131 HA ARG 21 HA ARG 21 7.201 4.917 -10.782 132 HB2 ARG 21 1HB ARG 21 8.858 5.277 -8.892 133 HB3 ARG 21 2HB ARG 21 9.806 3.972 -9.591 134 HG2 ARG 21 1HG ARG 21 10.158 5.212 -11.603 135 HG3 ARG 21 2HG ARG 21 9.028 6.464 -11.084 136 HD2 ARG 21 1HD ARG 21 11.002 7.466 -10.522 137 HD3 ARG 21 2HD ARG 21 10.666 6.602 -9.022 138 HE ARG 21 HE ARG 21 12.508 5.307 -9.404 139 HH11 ARG 21 1HH1 ARG 21 11.595 6.874 -12.376 140 HH12 ARG 21 2HH1 ARG 21 12.997 6.338 -13.242 141 HH21 ARG 21 1HH2 ARG 21 14.359 4.595 -10.534 142 HH22 ARG 21 2HH2 ARG 21 14.568 5.042 -12.192 143 H GLU 22 H GLU 22 8.756 1.789 -10.148 144 HA GLU 22 HA GLU 22 9.713 1.396 -12.778 145 HB2 GLU 22 1HB GLU 22 10.215 -0.828 -12.114 146 HB3 GLU 22 2HB GLU 22 10.474 0.181 -10.698 147 HG2 GLU 22 1HG GLU 22 8.519 -0.582 -9.656 148 HG3 GLU 22 2HG GLU 22 7.892 -1.272 -11.153 149 H ALA 23 H ALA 23 6.638 0.808 -11.247 150 HA ALA 23 HA ALA 23 5.645 -0.797 -13.448 151 HB1 ALA 23 1HB ALA 23 4.815 -1.471 -11.359 152 HB2 ALA 23 2HB ALA 23 4.425 0.183 -10.885 153 HB3 ALA 23 3HB ALA 23 3.473 -0.625 -12.131 154 H GLU 24 H GLU 24 6.076 2.458 -12.881 155 HA GLU 24 HA GLU 24 5.409 4.332 -13.988 156 HB2 GLU 24 1HB GLU 24 3.857 2.555 -15.862 157 HB3 GLU 24 2HB GLU 24 4.520 4.151 -16.184 158 HG2 GLU 24 1HG GLU 24 6.401 1.976 -15.449 159 HG3 GLU 24 2HG GLU 24 5.683 1.955 -17.059 160 H LYS 25 H LYS 25 3.990 3.663 -11.752 161 HA LYS 25 HA LYS 25 1.156 3.954 -12.392 162 HB2 LYS 25 1HB LYS 25 2.714 3.162 -9.985 163 HB3 LYS 25 2HB LYS 25 1.152 3.925 -9.722 164 HG2 LYS 25 1HG LYS 25 1.233 1.380 -9.825 165 HG3 LYS 25 2HG LYS 25 -0.005 2.200 -10.780 166 HD2 LYS 25 1HD LYS 25 1.421 2.008 -12.770 167 HD3 LYS 25 2HD LYS 25 2.638 1.165 -11.809 168 HE2 LYS 25 1HE LYS 25 1.549 -0.631 -12.696 169 HE3 LYS 25 2HE LYS 25 0.583 -0.399 -11.240 170 HZ1 LYS 25 1HZ LYS 25 -0.245 1.058 -13.627 171 HZ2 LYS 25 2HZ LYS 25 -1.184 0.341 -12.418 172 HZ3 LYS 25 3HZ LYS 25 -0.494 -0.616 -13.630 173 H SER 26 H SER 26 -0.106 5.685 -11.700 174 HA SER 26 HA SER 26 1.354 8.179 -11.395 175 HB2 SER 26 1HB SER 26 -0.632 7.823 -12.981 176 HB3 SER 26 2HB SER 26 -1.645 7.886 -11.538 177 HG SER 26 HG SER 26 -0.115 9.905 -12.739 178 H SER 27 H SER 27 0.690 5.967 -9.259 179 HA SER 27 HA SER 27 -0.489 7.732 -7.232 180 HB2 SER 27 1HB SER 27 -0.908 5.745 -5.928 181 HB3 SER 27 2HB SER 27 -1.467 5.449 -7.574 182 HG SER 27 HG SER 27 0.139 4.060 -7.894 183 H SER 28 H SER 28 0.485 7.890 -5.137 184 HA SER 28 HA SER 28 3.036 6.863 -4.516 185 HB2 SER 28 1HB SER 28 4.454 8.770 -4.815 186 HB3 SER 28 2HB SER 28 3.637 8.494 -6.354 187 HG SER 28 HG SER 28 2.127 10.133 -5.701 188 H ILE 29 H ILE 29 3.946 7.857 -2.532 189 HA ILE 29 HA ILE 29 1.921 9.311 -0.970 190 HB ILE 29 HB ILE 29 2.761 7.929 1.025 191 HG12 ILE 29 1HG1 ILE 29 3.308 5.781 -0.978 192 HG13 ILE 29 2HG1 ILE 29 4.589 6.932 -0.612 193 HG21 ILE 29 1HG2 ILE 29 0.533 7.645 0.380 194 HG22 ILE 29 2HG2 ILE 29 0.978 6.885 -1.147 195 HG23 ILE 29 3HG2 ILE 29 1.198 6.013 0.369 196 HD11 ILE 29 1HD1 ILE 29 5.122 5.664 1.117 197 HD12 ILE 29 2HD1 ILE 29 3.590 6.120 1.863 198 HD13 ILE 29 3HD1 ILE 29 3.694 4.657 0.884 199 H SER 30 H SER 30 2.684 10.821 0.458 200 HA SER 30 HA SER 30 5.463 11.596 0.112 201 HB2 SER 30 1HB SER 30 3.319 13.137 0.130 202 HB3 SER 30 2HB SER 30 3.570 13.101 1.875 203 HG SER 30 HG SER 30 5.425 13.943 -0.101 204 H SER 31 H SER 31 3.306 10.436 2.630 205 HA SER 31 HA SER 31 5.443 9.415 4.187 206 HB2 SER 31 1HB SER 31 5.406 10.849 6.087 207 HB3 SER 31 2HB SER 31 5.554 11.911 4.687 208 HG SER 31 HG SER 31 3.691 11.944 6.562 209 H PHE 32 H PHE 32 4.593 8.657 6.398 210 HA PHE 32 HA PHE 32 2.506 6.898 6.050 211 HB2 PHE 32 1HB PHE 32 3.595 8.140 8.577 212 HB3 PHE 32 2HB PHE 32 2.398 6.850 8.586 213 HD1 PHE 32 2HD PHE 32 3.084 4.786 7.019 214 HD2 PHE 32 1HD PHE 32 5.785 7.533 8.831 215 HE1 PHE 32 2HE PHE 32 4.883 3.117 6.859 216 HE2 PHE 32 1HE PHE 32 7.588 5.866 8.674 217 HZ PHE 32 HZ PHE 32 7.138 3.654 7.689 218 H LYS 33 H LYS 33 2.386 10.267 6.830 219 HA LYS 33 HA LYS 33 -0.485 10.098 7.419 220 HB2 LYS 33 1HB LYS 33 1.628 12.146 7.989 221 HB3 LYS 33 2HB LYS 33 -0.066 12.622 7.953 222 HG2 LYS 33 1HG LYS 33 -0.554 10.941 9.679 223 HG3 LYS 33 2HG LYS 33 1.162 10.533 9.742 224 HD2 LYS 33 1HD LYS 33 1.714 12.750 10.497 225 HD3 LYS 33 2HD LYS 33 0.045 13.284 10.277 226 HE2 LYS 33 1HE LYS 33 0.033 12.877 12.525 227 HE3 LYS 33 2HE LYS 33 -0.443 11.287 11.930 228 HZ1 LYS 33 1HZ LYS 33 2.173 10.987 11.934 229 HZ2 LYS 33 2HZ LYS 33 1.226 10.664 13.297 230 HZ3 LYS 33 3HZ LYS 33 2.054 12.134 13.172 231 H ASP 34 H ASP 34 0.397 9.684 4.761 232 HA ASP 34 HA ASP 34 0.075 12.111 3.260 233 HB2 ASP 34 1HB ASP 34 1.443 10.453 2.253 234 HB3 ASP 34 2HB ASP 34 0.228 9.200 2.488 235 HA PRO 35 HA PRO 35 -4.339 12.177 3.209 236 HB2 PRO 35 1HB PRO 35 -4.656 13.905 1.139 237 HB3 PRO 35 2HB PRO 35 -4.138 14.419 2.748 238 HG2 PRO 35 1HG PRO 35 -2.491 13.904 0.303 239 HG3 PRO 35 2HG PRO 35 -2.369 15.228 1.474 240 HD2 PRO 35 1HD PRO 35 -0.716 13.084 1.522 241 HD3 PRO 35 2HD PRO 35 -1.208 13.944 2.996 242 H LYS 36 H LYS 36 -2.639 11.857 0.097 243 HA LYS 36 HA LYS 36 -4.707 10.905 -1.465 244 HB2 LYS 36 1HB LYS 36 -1.748 10.576 -1.503 245 HB3 LYS 36 2HB LYS 36 -2.699 9.518 -2.538 246 HG2 LYS 36 1HG LYS 36 -2.278 11.254 -3.964 247 HG3 LYS 36 2HG LYS 36 -3.827 11.758 -3.282 248 HD2 LYS 36 1HD LYS 36 -2.764 13.285 -1.795 249 HD3 LYS 36 2HD LYS 36 -1.166 12.637 -2.172 250 HE2 LYS 36 1HE LYS 36 -2.905 13.871 -4.284 251 HE3 LYS 36 2HE LYS 36 -1.861 14.855 -3.260 252 HZ1 LYS 36 1HZ LYS 36 -0.096 14.277 -4.448 253 HZ2 LYS 36 2HZ LYS 36 -1.142 13.573 -5.574 254 HZ3 LYS 36 3HZ LYS 36 -0.459 12.628 -4.348 255 H ILE 37 H ILE 37 -2.859 9.255 0.989 256 HA ILE 37 HA ILE 37 -3.385 6.598 0.341 257 HB ILE 37 HB ILE 37 -3.015 7.926 3.020 258 HG12 ILE 37 1HG1 ILE 37 -1.228 6.199 1.294 259 HG13 ILE 37 2HG1 ILE 37 -1.057 7.930 1.568 260 HG21 ILE 37 1HG2 ILE 37 -3.847 5.189 2.384 261 HG22 ILE 37 2HG2 ILE 37 -2.460 5.301 3.466 262 HG23 ILE 37 3HG2 ILE 37 -3.975 6.095 3.892 263 HD11 ILE 37 1HD1 ILE 37 -1.012 6.972 4.108 264 HD12 ILE 37 2HD1 ILE 37 -0.224 5.669 3.218 265 HD13 ILE 37 3HD1 ILE 37 0.413 7.310 3.126 266 H SER 38 H SER 38 -5.431 9.023 1.785 267 HA SER 38 HA SER 38 -7.383 7.434 2.967 268 HB2 SER 38 1HB SER 38 -8.828 9.342 2.856 269 HB3 SER 38 2HB SER 38 -7.190 9.951 3.095 270 HG SER 38 HG SER 38 -7.332 9.926 0.580 271 H THR 39 H THR 39 -6.659 7.943 -0.357 272 HA THR 39 HA THR 39 -9.237 6.871 -1.229 273 HB THR 39 HB THR 39 -8.442 7.350 -3.520 274 HG1 THR 39 1HG THR 39 -6.249 8.762 -2.477 275 HG21 THR 39 1HG2 THR 39 -7.872 9.883 -2.091 276 HG22 THR 39 2HG2 THR 39 -9.419 9.107 -1.751 277 HG23 THR 39 3HG2 THR 39 -9.000 9.552 -3.404 278 H SER 40 H SER 40 -6.213 5.748 -0.362 279 HA SER 40 HA SER 40 -5.211 3.707 -0.490 280 HB2 SER 40 1HB SER 40 -7.769 2.781 -1.817 281 HB3 SER 40 2HB SER 40 -6.551 1.763 -1.048 282 HG SER 40 HG SER 40 -7.339 3.631 0.688 283 H LEU 41 H LEU 41 -5.110 5.692 -2.691 284 HA LEU 41 HA LEU 41 -5.034 4.332 -5.177 285 HB2 LEU 41 1HB LEU 41 -3.989 6.940 -4.162 286 HB3 LEU 41 2HB LEU 41 -3.486 6.354 -5.748 287 HG LEU 41 HG LEU 41 -6.360 6.789 -4.944 288 HD11 LEU 41 1HD1 LEU 41 -6.134 8.781 -6.503 289 HD12 LEU 41 2HD1 LEU 41 -4.391 8.604 -6.305 290 HD13 LEU 41 3HD1 LEU 41 -5.407 8.936 -4.903 291 HD21 LEU 41 1HD2 LEU 41 -5.142 6.494 -7.683 292 HD22 LEU 41 2HD2 LEU 41 -6.853 6.528 -7.257 293 HD23 LEU 41 3HD2 LEU 41 -5.852 5.155 -6.780 294 HA PRO 42 HA PRO 42 -0.256 4.162 -4.378 295 HB2 PRO 42 1HB PRO 42 0.557 4.540 -1.816 296 HB3 PRO 42 2HB PRO 42 0.401 5.862 -2.979 297 HG2 PRO 42 1HG PRO 42 -1.493 4.998 -0.827 298 HG3 PRO 42 2HG PRO 42 -1.002 6.637 -1.294 299 HD2 PRO 42 1HD PRO 42 -3.352 5.542 -2.076 300 HD3 PRO 42 2HD PRO 42 -2.456 6.700 -3.081 301 H VAL 43 H VAL 43 -2.363 3.107 -1.740 302 HA VAL 43 HA VAL 43 -0.839 0.794 -1.076 303 HB VAL 43 HB VAL 43 -3.785 1.083 -0.548 304 HG11 VAL 43 1HG1 VAL 43 -2.503 -1.023 0.010 305 HG12 VAL 43 2HG1 VAL 43 -1.624 -0.065 1.203 306 HG13 VAL 43 3HG1 VAL 43 -3.370 -0.269 1.347 307 HG21 VAL 43 1HG2 VAL 43 -2.241 2.072 1.635 308 HG22 VAL 43 2HG2 VAL 43 -1.801 2.964 0.178 309 HG23 VAL 43 3HG2 VAL 43 -3.485 2.899 0.697 310 H LEU 44 H LEU 44 -3.600 1.407 -3.186 311 HA LEU 44 HA LEU 44 -4.068 -1.337 -3.808 312 HB2 LEU 44 1HB LEU 44 -4.938 1.251 -5.059 313 HB3 LEU 44 2HB LEU 44 -5.368 -0.313 -5.750 314 HG LEU 44 HG LEU 44 -6.072 0.467 -2.929 315 HD11 LEU 44 1HD1 LEU 44 -7.013 1.814 -5.088 316 HD12 LEU 44 2HD1 LEU 44 -7.903 1.581 -3.585 317 HD13 LEU 44 3HD1 LEU 44 -8.192 0.508 -4.955 318 HD21 LEU 44 1HD2 LEU 44 -6.040 -1.968 -3.849 319 HD22 LEU 44 2HD2 LEU 44 -7.525 -1.482 -4.667 320 HD23 LEU 44 3HD2 LEU 44 -7.421 -1.405 -2.907 321 H ASP 45 H ASP 45 -2.675 1.340 -5.710 322 HA ASP 45 HA ASP 45 -1.884 -0.150 -7.919 323 HB2 ASP 45 1HB ASP 45 -0.988 2.433 -6.715 324 HB3 ASP 45 2HB ASP 45 -0.011 1.721 -7.997 325 H LEU 46 H LEU 46 -0.057 0.625 -4.973 326 HA LEU 46 HA LEU 46 2.388 -0.446 -5.563 327 HB2 LEU 46 1HB LEU 46 2.109 0.645 -3.493 328 HB3 LEU 46 2HB LEU 46 0.817 -0.449 -3.004 329 HG LEU 46 HG LEU 46 2.366 -2.215 -2.589 330 HD11 LEU 46 1HD1 LEU 46 4.197 -2.415 -3.820 331 HD12 LEU 46 2HD1 LEU 46 4.902 -1.056 -2.944 332 HD13 LEU 46 3HD1 LEU 46 4.007 -0.773 -4.437 333 HD21 LEU 46 1HD2 LEU 46 3.208 -1.400 -0.657 334 HD22 LEU 46 2HD2 LEU 46 2.231 0.005 -1.086 335 HD23 LEU 46 3HD2 LEU 46 3.959 -0.010 -1.442 336 H ILE 47 H ILE 47 -0.539 -2.169 -4.625 337 HA ILE 47 HA ILE 47 0.697 -4.725 -4.397 338 HB ILE 47 HB ILE 47 -2.209 -4.063 -4.889 339 HG12 ILE 47 1HG1 ILE 47 -0.952 -4.798 -2.254 340 HG13 ILE 47 2HG1 ILE 47 -1.037 -3.125 -2.794 341 HG21 ILE 47 1HG2 ILE 47 -1.365 -6.540 -3.505 342 HG22 ILE 47 2HG2 ILE 47 -2.739 -6.246 -4.570 343 HG23 ILE 47 3HG2 ILE 47 -1.128 -6.471 -5.250 344 HD11 ILE 47 1HD1 ILE 47 -3.073 -3.000 -1.952 345 HD12 ILE 47 2HD1 ILE 47 -3.610 -4.215 -3.111 346 HD13 ILE 47 3HD1 ILE 47 -3.030 -4.708 -1.520 347 H ASP 48 H ASP 48 -1.423 -3.325 -6.901 348 HA ASP 48 HA ASP 48 -1.366 -5.393 -8.722 349 HB2 ASP 48 1HB ASP 48 -2.739 -3.291 -8.878 350 HB3 ASP 48 2HB ASP 48 -1.298 -2.462 -9.461 351 H ALA 49 H ALA 49 0.964 -2.753 -8.333 352 HA ALA 49 HA ALA 49 2.588 -3.020 -10.483 353 HB1 ALA 49 1HB ALA 49 3.482 -2.677 -7.624 354 HB2 ALA 49 2HB ALA 49 4.466 -2.337 -9.047 355 HB3 ALA 49 3HB ALA 49 3.008 -1.395 -8.738 356 H ILE 50 H ILE 50 2.884 -4.969 -7.511 357 HA ILE 50 HA ILE 50 4.875 -6.685 -8.649 358 HB ILE 50 HB ILE 50 3.206 -7.206 -6.189 359 HG12 ILE 50 1HG1 ILE 50 5.898 -5.840 -6.323 360 HG13 ILE 50 2HG1 ILE 50 4.373 -4.974 -6.178 361 HG21 ILE 50 1HG2 ILE 50 5.888 -8.238 -7.098 362 HG22 ILE 50 2HG2 ILE 50 5.189 -8.528 -5.506 363 HG23 ILE 50 3HG2 ILE 50 4.391 -9.158 -6.946 364 HD11 ILE 50 1HD1 ILE 50 4.414 -5.234 -3.987 365 HD12 ILE 50 2HD1 ILE 50 4.484 -6.986 -4.168 366 HD13 ILE 50 3HD1 ILE 50 5.973 -6.044 -4.130 367 H GLN 51 H GLN 51 1.439 -7.090 -7.808 368 HA GLN 51 HA GLN 51 1.386 -9.468 -9.547 369 HB2 GLN 51 1HB GLN 51 0.814 -9.605 -7.002 370 HB3 GLN 51 2HB GLN 51 -0.718 -8.894 -7.490 371 HG2 GLN 51 1HG GLN 51 -1.240 -11.109 -7.584 372 HG3 GLN 51 2HG GLN 51 -0.709 -10.839 -9.243 373 HE21 GLN 51 1HE2 GLN 51 0.634 -11.707 -6.074 374 HE22 GLN 51 2HE2 GLN 51 1.718 -12.912 -6.673 375 HA PRO 52 HA PRO 52 -1.064 -6.415 -11.891 376 HB2 PRO 52 1HB PRO 52 -0.570 -7.566 -14.299 377 HB3 PRO 52 2HB PRO 52 0.552 -6.441 -13.524 378 HG2 PRO 52 1HG PRO 52 0.617 -9.433 -13.595 379 HG3 PRO 52 2HG PRO 52 1.948 -8.279 -13.800 380 HD2 PRO 52 1HD PRO 52 1.499 -9.585 -11.471 381 HD3 PRO 52 2HD PRO 52 2.176 -7.945 -11.531 382 H GLY 53 H GLY 53 -3.201 -6.702 -11.818 383 HA2 GLY 53 1HA GLY 53 -5.011 -7.854 -13.129 384 HA3 GLY 53 2HA GLY 53 -4.278 -9.348 -12.568 385 H SER 54 H SER 54 -3.730 -8.457 -9.900 386 HA SER 54 HA SER 54 -6.059 -9.222 -8.603 387 HB2 SER 54 1HB SER 54 -4.883 -7.902 -6.614 388 HB3 SER 54 2HB SER 54 -4.232 -9.425 -7.221 389 HG SER 54 HG SER 54 -3.406 -6.828 -8.019 390 H ILE 55 H ILE 55 -4.862 -5.985 -9.352 391 HA ILE 55 HA ILE 55 -7.325 -4.829 -8.249 392 HB ILE 55 HB ILE 55 -4.953 -3.268 -9.246 393 HG12 ILE 55 1HG1 ILE 55 -4.157 -4.853 -7.546 394 HG13 ILE 55 2HG1 ILE 55 -4.131 -3.202 -6.935 395 HG21 ILE 55 1HG2 ILE 55 -5.885 -1.687 -7.443 396 HG22 ILE 55 2HG2 ILE 55 -6.765 -1.837 -8.964 397 HG23 ILE 55 3HG2 ILE 55 -7.336 -2.686 -7.528 398 HD11 ILE 55 1HD1 ILE 55 -5.954 -5.453 -6.210 399 HD12 ILE 55 2HD1 ILE 55 -4.986 -4.412 -5.165 400 HD13 ILE 55 3HD1 ILE 55 -6.437 -3.779 -5.941 401 H ASN 56 H ASN 56 -8.557 -3.331 -9.472 402 HA ASN 56 HA ASN 56 -8.027 -3.159 -12.333 403 HB2 ASN 56 1HB ASN 56 -9.503 -5.205 -11.774 404 HB3 ASN 56 2HB ASN 56 -10.761 -4.023 -11.421 405 HD21 ASN 56 1HD2 ASN 56 -12.056 -4.719 -13.101 406 HD22 ASN 56 2HD2 ASN 56 -11.677 -4.402 -14.757 407 H TYR 57 H TYR 57 -7.931 -1.003 -12.506 408 HA TYR 57 HA TYR 57 -9.140 0.908 -10.946 409 HB2 TYR 57 1HB TYR 57 -8.065 0.875 -13.719 410 HB3 TYR 57 2HB TYR 57 -9.047 2.259 -13.252 411 HD1 TYR 57 1HD TYR 57 -6.727 0.329 -11.089 412 HD2 TYR 57 2HD TYR 57 -7.441 3.973 -13.165 413 HE1 TYR 57 1HE TYR 57 -4.775 1.335 -9.983 414 HE2 TYR 57 2HE TYR 57 -5.490 4.989 -12.066 415 HH TYR 57 HH TYR 57 -4.115 4.705 -10.128 416 H ASP 58 H ASP 58 -10.418 -0.667 -13.842 417 HA ASP 58 HA ASP 58 -12.665 0.797 -14.360 418 HB2 ASP 58 1HB ASP 58 -11.739 -1.470 -15.373 419 HB3 ASP 58 2HB ASP 58 -12.962 -2.174 -14.318 420 H LEU 59 H LEU 59 -12.175 -1.513 -11.753 421 HA LEU 59 HA LEU 59 -14.918 -1.237 -10.839 422 HB2 LEU 59 1HB LEU 59 -12.663 -2.671 -9.458 423 HB3 LEU 59 2HB LEU 59 -14.394 -2.898 -9.219 424 HG LEU 59 HG LEU 59 -12.854 -3.654 -11.701 425 HD11 LEU 59 1HD1 LEU 59 -12.196 -5.239 -10.163 426 HD12 LEU 59 2HD1 LEU 59 -13.642 -5.981 -10.847 427 HD13 LEU 59 3HD1 LEU 59 -13.723 -5.173 -9.281 428 HD21 LEU 59 1HD2 LEU 59 -15.243 -4.989 -11.732 429 HD22 LEU 59 2HD2 LEU 59 -14.874 -3.532 -12.653 430 HD23 LEU 59 3HD2 LEU 59 -15.701 -3.407 -11.101 431 H LEU 60 H LEU 60 -11.689 -0.184 -9.939 432 HA LEU 60 HA LEU 60 -12.239 0.823 -7.391 433 HB2 LEU 60 1HB LEU 60 -10.291 1.928 -9.408 434 HB3 LEU 60 2HB LEU 60 -10.251 2.182 -7.665 435 HG LEU 60 HG LEU 60 -9.782 -0.433 -9.097 436 HD11 LEU 60 1HD1 LEU 60 -8.032 1.728 -8.152 437 HD12 LEU 60 2HD1 LEU 60 -7.759 0.497 -9.384 438 HD13 LEU 60 3HD1 LEU 60 -7.541 0.101 -7.680 439 HD21 LEU 60 1HD2 LEU 60 -10.756 -1.038 -7.066 440 HD22 LEU 60 2HD2 LEU 60 -9.989 0.287 -6.193 441 HD23 LEU 60 3HD2 LEU 60 -9.025 -1.088 -6.731 442 H LYS 61 H LYS 61 -12.635 2.959 -6.661 443 HA LYS 61 HA LYS 61 -14.496 4.399 -8.339 444 HB2 LYS 61 1HB LYS 61 -13.544 4.887 -5.512 445 HB3 LYS 61 2HB LYS 61 -14.781 5.841 -6.320 446 HG2 LYS 61 1HG LYS 61 -14.945 2.891 -5.735 447 HG3 LYS 61 2HG LYS 61 -15.753 4.173 -4.830 448 HD2 LYS 61 1HD LYS 61 -16.996 4.806 -6.845 449 HD3 LYS 61 2HD LYS 61 -16.190 3.518 -7.745 450 HE2 LYS 61 1HE LYS 61 -17.214 1.838 -6.372 451 HE3 LYS 61 2HE LYS 61 -17.880 3.062 -5.291 452 HZ1 LYS 61 1HZ LYS 61 -18.696 2.402 -8.050 453 HZ2 LYS 61 2HZ LYS 61 -19.069 3.906 -7.371 454 HZ3 LYS 61 3HZ LYS 61 -19.649 2.487 -6.655 455 H THR 62 H THR 62 -11.754 5.528 -6.358 456 HA THR 62 HA THR 62 -10.383 7.345 -6.611 457 HB THR 62 HB THR 62 -9.346 5.689 -8.138 458 HG1 THR 62 1HG THR 62 -8.349 7.728 -7.862 459 HG21 THR 62 1HG2 THR 62 -9.660 6.161 -10.620 460 HG22 THR 62 2HG2 THR 62 -11.112 7.051 -10.160 461 HG23 THR 62 3HG2 THR 62 -10.982 5.329 -9.803 462 H GLU 63 H GLU 63 -13.184 7.936 -6.942 463 HA GLU 63 HA GLU 63 -12.907 10.441 -8.392 464 HB2 GLU 63 1HB GLU 63 -15.073 10.092 -9.577 465 HB3 GLU 63 2HB GLU 63 -13.782 9.034 -10.129 466 HG2 GLU 63 1HG GLU 63 -14.750 7.306 -8.519 467 HG3 GLU 63 2HG GLU 63 -16.165 8.354 -8.445 468 H ASN 64 H ASN 64 -13.303 11.788 -6.746 469 HA ASN 64 HA ASN 64 -14.294 12.760 -4.935 470 HB2 ASN 64 1HB ASN 64 -16.927 11.771 -5.988 471 HB3 ASN 64 2HB ASN 64 -16.547 13.316 -5.233 472 HD21 ASN 64 1HD2 ASN 64 -16.125 11.387 -8.137 473 HD22 ASN 64 2HD2 ASN 64 -15.887 12.720 -9.210 474 H LEU 65 H LEU 65 -13.299 10.350 -4.226 475 HA LEU 65 HA LEU 65 -15.068 8.485 -3.136 476 HB2 LEU 65 1HB LEU 65 -12.248 9.261 -2.485 477 HB3 LEU 65 2HB LEU 65 -13.093 8.036 -1.540 478 HG LEU 65 HG LEU 65 -12.986 7.710 -4.497 479 HD11 LEU 65 1HD1 LEU 65 -10.776 6.334 -3.500 480 HD12 LEU 65 2HD1 LEU 65 -10.646 7.963 -2.840 481 HD13 LEU 65 3HD1 LEU 65 -10.769 7.726 -4.582 482 HD21 LEU 65 1HD2 LEU 65 -14.254 6.094 -3.327 483 HD22 LEU 65 2HD2 LEU 65 -13.007 5.898 -2.096 484 HD23 LEU 65 3HD2 LEU 65 -12.725 5.316 -3.737 485 H ASN 66 H ASN 66 -15.359 8.044 -0.776 486 HA ASN 66 HA ASN 66 -15.275 10.300 1.015 487 HB2 ASN 66 1HB ASN 66 -17.561 10.688 1.289 488 HB3 ASN 66 2HB ASN 66 -17.404 10.499 -0.455 489 HD21 ASN 66 1HD2 ASN 66 -17.904 8.381 -1.347 490 HD22 ASN 66 2HD2 ASN 66 -19.124 7.422 -0.590 491 H ASP 67 H ASP 67 -16.218 9.710 3.181 492 HA ASP 67 HA ASP 67 -15.041 7.597 4.348 493 HB2 ASP 67 1HB ASP 67 -17.712 8.837 4.989 494 HB3 ASP 67 2HB ASP 67 -16.985 7.601 6.012 495 H ASP 68 H ASP 68 -17.960 7.487 2.435 496 HA ASP 68 HA ASP 68 -18.636 4.789 3.145 497 HB2 ASP 68 1HB ASP 68 -20.126 6.744 2.160 498 HB3 ASP 68 2HB ASP 68 -19.623 6.046 0.623 499 H GLU 69 H GLU 69 -17.571 6.241 0.061 500 HA GLU 69 HA GLU 69 -16.968 3.762 -1.151 501 HB2 GLU 69 1HB GLU 69 -15.840 6.475 -1.856 502 HB3 GLU 69 2HB GLU 69 -15.914 5.064 -2.903 503 HG2 GLU 69 1HG GLU 69 -18.455 6.096 -1.773 504 HG3 GLU 69 2HG GLU 69 -17.678 7.018 -3.060 505 H LYS 70 H LYS 70 -14.782 6.296 0.085 506 HA LYS 70 HA LYS 70 -12.343 5.264 -0.260 507 HB2 LYS 70 1HB LYS 70 -13.470 6.525 2.235 508 HB3 LYS 70 2HB LYS 70 -11.764 6.129 2.076 509 HG2 LYS 70 1HG LYS 70 -11.768 7.545 -0.021 510 HG3 LYS 70 2HG LYS 70 -13.367 8.103 0.479 511 HD2 LYS 70 1HD LYS 70 -12.441 8.935 2.571 512 HD3 LYS 70 2HD LYS 70 -10.846 8.321 2.127 513 HE2 LYS 70 1HE LYS 70 -10.714 9.853 0.279 514 HE3 LYS 70 2HE LYS 70 -12.379 10.371 0.534 515 HZ1 LYS 70 1HZ LYS 70 -11.294 10.869 2.927 516 HZ2 LYS 70 2HZ LYS 70 -11.408 12.013 1.687 517 HZ3 LYS 70 3HZ LYS 70 -9.966 11.162 1.921 518 H LEU 71 H LEU 71 -14.646 4.125 2.169 519 HA LEU 71 HA LEU 71 -12.983 2.308 3.489 520 HB2 LEU 71 1HB LEU 71 -15.043 2.828 4.493 521 HB3 LEU 71 2HB LEU 71 -15.949 2.405 3.042 522 HG LEU 71 HG LEU 71 -15.458 0.036 3.428 523 HD11 LEU 71 1HD1 LEU 71 -14.516 0.410 6.169 524 HD12 LEU 71 2HD1 LEU 71 -13.364 0.921 4.937 525 HD13 LEU 71 3HD1 LEU 71 -13.988 -0.729 4.929 526 HD21 LEU 71 1HD2 LEU 71 -16.509 0.395 6.022 527 HD22 LEU 71 2HD2 LEU 71 -17.384 0.057 4.527 528 HD23 LEU 71 3HD2 LEU 71 -17.108 1.725 5.031 529 H ASN 72 H ASN 72 -15.416 1.572 0.980 530 HA ASN 72 HA ASN 72 -14.932 -1.062 0.552 531 HB2 ASN 72 1HB ASN 72 -15.444 1.055 -1.547 532 HB3 ASN 72 2HB ASN 72 -15.578 -0.679 -1.830 533 HD21 ASN 72 1HD2 ASN 72 -16.895 2.039 -0.062 534 HD22 ASN 72 2HD2 ASN 72 -18.437 1.330 0.257 535 H ASN 73 H ASN 73 -13.053 1.635 -0.768 536 HA ASN 73 HA ASN 73 -11.312 0.104 -2.360 537 HB2 ASN 73 1HB ASN 73 -11.299 2.859 -1.233 538 HB3 ASN 73 2HB ASN 73 -9.762 2.211 -1.800 539 HD21 ASN 73 1HD2 ASN 73 -10.602 4.345 -3.072 540 HD22 ASN 73 2HD2 ASN 73 -11.238 3.963 -4.632 541 H ALA 74 H ALA 74 -11.009 1.276 0.977 542 HA ALA 74 HA ALA 74 -8.428 0.275 1.462 543 HB1 ALA 74 1HB ALA 74 -8.834 0.701 3.756 544 HB2 ALA 74 2HB ALA 74 -9.695 1.950 2.856 545 HB3 ALA 74 3HB ALA 74 -10.580 0.586 3.541 546 H LYS 75 H LYS 75 -11.630 -1.161 1.925 547 HA LYS 75 HA LYS 75 -10.793 -3.506 3.231 548 HB2 LYS 75 1HB LYS 75 -13.175 -3.220 1.395 549 HB3 LYS 75 2HB LYS 75 -12.965 -4.405 2.677 550 HG2 LYS 75 1HG LYS 75 -12.731 -2.216 4.151 551 HG3 LYS 75 2HG LYS 75 -13.697 -1.538 2.839 552 HD2 LYS 75 1HD LYS 75 -14.413 -4.005 4.423 553 HD3 LYS 75 2HD LYS 75 -15.078 -2.394 4.700 554 HE2 LYS 75 1HE LYS 75 -15.244 -3.614 1.980 555 HE3 LYS 75 2HE LYS 75 -16.373 -4.129 3.232 556 HZ1 LYS 75 1HZ LYS 75 -15.979 -1.355 2.245 557 HZ2 LYS 75 2HZ LYS 75 -16.998 -1.785 3.526 558 HZ3 LYS 75 3HZ LYS 75 -17.325 -2.342 1.963 559 H TYR 76 H TYR 76 -11.059 -2.677 -0.180 560 HA TYR 76 HA TYR 76 -10.537 -5.328 -1.120 561 HB2 TYR 76 1HB TYR 76 -11.743 -3.485 -2.394 562 HB3 TYR 76 2HB TYR 76 -10.160 -2.771 -2.678 563 HD1 TYR 76 1HD TYR 76 -11.754 -6.148 -2.955 564 HD2 TYR 76 2HD TYR 76 -9.214 -3.228 -4.723 565 HE1 TYR 76 1HE TYR 76 -11.458 -7.602 -4.917 566 HE2 TYR 76 2HE TYR 76 -8.912 -4.672 -6.690 567 HH TYR 76 HH TYR 76 -9.220 -7.583 -6.898 568 H ALA 77 H ALA 77 -8.599 -2.363 -0.845 569 HA ALA 77 HA ALA 77 -6.228 -3.261 -1.948 570 HB1 ALA 77 1HB ALA 77 -5.304 -1.353 -1.154 571 HB2 ALA 77 2HB ALA 77 -6.994 -0.944 -0.855 572 HB3 ALA 77 3HB ALA 77 -5.990 -1.560 0.458 573 H ILE 78 H ILE 78 -7.181 -3.371 1.486 574 HA ILE 78 HA ILE 78 -4.899 -4.767 2.368 575 HB ILE 78 HB ILE 78 -7.659 -4.642 3.584 576 HG12 ILE 78 1HG1 ILE 78 -5.181 -3.158 4.448 577 HG13 ILE 78 2HG1 ILE 78 -6.298 -2.496 3.260 578 HG21 ILE 78 1HG2 ILE 78 -5.611 -6.401 4.219 579 HG22 ILE 78 2HG2 ILE 78 -5.475 -5.116 5.419 580 HG23 ILE 78 3HG2 ILE 78 -6.997 -5.987 5.229 581 HD11 ILE 78 1HD1 ILE 78 -7.479 -3.437 5.792 582 HD12 ILE 78 2HD1 ILE 78 -6.470 -1.992 5.870 583 HD13 ILE 78 3HD1 ILE 78 -7.873 -2.032 4.803 584 H SER 79 H SER 79 -8.158 -5.906 1.522 585 HA SER 79 HA SER 79 -7.906 -8.581 2.113 586 HB2 SER 79 1HB SER 79 -9.499 -7.036 0.130 587 HB3 SER 79 2HB SER 79 -9.421 -8.784 -0.084 588 HG SER 79 HG SER 79 -11.069 -7.612 1.437 589 H MET 80 H MET 80 -7.060 -6.979 -0.952 590 HA MET 80 HA MET 80 -6.170 -9.210 -2.344 591 HB2 MET 80 1HB MET 80 -5.171 -6.361 -2.483 592 HB3 MET 80 2HB MET 80 -4.801 -7.605 -3.669 593 HG2 MET 80 1HG MET 80 -7.651 -7.043 -3.051 594 HG3 MET 80 2HG MET 80 -6.754 -5.886 -4.032 595 HE1 MET 80 1HE MET 80 -8.097 -9.792 -4.062 596 HE2 MET 80 2HE MET 80 -9.108 -8.348 -4.026 597 HE3 MET 80 3HE MET 80 -8.987 -9.305 -5.504 598 H ALA 81 H ALA 81 -4.226 -6.924 -0.417 599 HA ALA 81 HA ALA 81 -1.729 -7.906 -0.655 600 HB1 ALA 81 1HB ALA 81 -2.469 -7.474 2.157 601 HB2 ALA 81 2HB ALA 81 -1.225 -6.698 1.175 602 HB3 ALA 81 3HB ALA 81 -2.903 -6.167 1.055 603 H ARG 82 H ARG 82 -4.117 -9.186 1.665 604 HA ARG 82 HA ARG 82 -2.484 -11.331 2.530 605 HB2 ARG 82 1HB ARG 82 -4.582 -10.288 3.644 606 HB3 ARG 82 2HB ARG 82 -5.486 -11.396 2.621 607 HG2 ARG 82 1HG ARG 82 -4.160 -13.267 3.609 608 HG3 ARG 82 2HG ARG 82 -3.473 -12.100 4.741 609 HD2 ARG 82 1HD ARG 82 -5.350 -13.294 5.741 610 HD3 ARG 82 2HD ARG 82 -5.706 -11.577 5.570 611 HE ARG 82 HE ARG 82 -6.980 -13.774 4.174 612 HH11 ARG 82 1HH1 ARG 82 -6.449 -10.339 4.363 613 HH12 ARG 82 2HH1 ARG 82 -7.861 -9.938 3.442 614 HH21 ARG 82 1HH2 ARG 82 -8.842 -13.259 2.960 615 HH22 ARG 82 2HH2 ARG 82 -9.221 -11.600 2.645 616 H LYS 83 H LYS 83 -4.892 -11.000 -0.011 617 HA LYS 83 HA LYS 83 -5.261 -13.688 -0.655 618 HB2 LYS 83 1HB LYS 83 -6.423 -11.530 -1.555 619 HB3 LYS 83 2HB LYS 83 -5.165 -11.575 -2.783 620 HG2 LYS 83 1HG LYS 83 -6.908 -12.701 -3.792 621 HG3 LYS 83 2HG LYS 83 -5.923 -14.015 -3.146 622 HD2 LYS 83 1HD LYS 83 -7.480 -13.739 -1.053 623 HD3 LYS 83 2HD LYS 83 -8.570 -12.988 -2.222 624 HE2 LYS 83 1HE LYS 83 -9.247 -15.166 -2.388 625 HE3 LYS 83 2HE LYS 83 -7.996 -15.140 -3.629 626 HZ1 LYS 83 1HZ LYS 83 -6.452 -16.122 -2.108 627 HZ2 LYS 83 2HZ LYS 83 -7.851 -17.071 -2.129 628 HZ3 LYS 83 3HZ LYS 83 -7.557 -16.027 -0.831 629 H ILE 84 H ILE 84 -2.973 -11.358 -2.087 630 HA ILE 84 HA ILE 84 -1.678 -13.279 -3.722 631 HB ILE 84 HB ILE 84 0.120 -11.559 -3.936 632 HG12 ILE 84 1HG1 ILE 84 -1.658 -9.762 -2.300 633 HG13 ILE 84 2HG1 ILE 84 -0.347 -10.674 -1.560 634 HG21 ILE 84 1HG2 ILE 84 -2.728 -10.664 -4.344 635 HG22 ILE 84 2HG2 ILE 84 -1.322 -9.879 -5.061 636 HG23 ILE 84 3HG2 ILE 84 -1.714 -11.544 -5.486 637 HD11 ILE 84 1HD1 ILE 84 0.942 -9.499 -3.630 638 HD12 ILE 84 2HD1 ILE 84 -0.268 -8.277 -3.235 639 HD13 ILE 84 3HD1 ILE 84 0.854 -8.842 -1.996 640 H GLY 85 H GLY 85 -1.496 -12.599 -0.388 641 HA2 GLY 85 1HA GLY 85 -0.214 -14.565 0.682 642 HA3 GLY 85 2HA GLY 85 1.154 -13.861 -0.167 643 H ALA 86 H ALA 86 1.530 -11.487 0.316 644 HA ALA 86 HA ALA 86 2.358 -10.997 2.800 645 HB1 ALA 86 1HB ALA 86 0.953 -8.671 1.651 646 HB2 ALA 86 2HB ALA 86 2.623 -8.838 2.194 647 HB3 ALA 86 3HB ALA 86 2.144 -9.454 0.612 648 H ARG 87 H ARG 87 1.297 -11.589 4.604 649 HA ARG 87 HA ARG 87 -1.446 -11.532 5.045 650 HB2 ARG 87 1HB ARG 87 0.920 -11.501 6.895 651 HB3 ARG 87 2HB ARG 87 -0.717 -11.415 7.532 652 HG2 ARG 87 1HG ARG 87 -1.268 -13.539 6.551 653 HG3 ARG 87 2HG ARG 87 0.299 -13.609 5.740 654 HD2 ARG 87 1HD ARG 87 0.667 -14.945 7.583 655 HD3 ARG 87 2HD ARG 87 1.249 -13.381 8.153 656 HE ARG 87 HE ARG 87 -1.512 -13.829 8.761 657 HH11 ARG 87 1HH1 ARG 87 1.753 -14.455 9.791 658 HH12 ARG 87 2HH1 ARG 87 1.326 -14.673 11.455 659 HH21 ARG 87 1HH2 ARG 87 -2.089 -14.115 10.949 660 HH22 ARG 87 2HH2 ARG 87 -0.861 -14.481 12.112 661 H VAL 88 H VAL 88 -2.473 -10.187 6.875 662 HA VAL 88 HA VAL 88 -1.582 -7.405 6.870 663 HB VAL 88 HB VAL 88 -4.040 -6.738 6.467 664 HG11 VAL 88 1HG1 VAL 88 -2.702 -5.957 4.808 665 HG12 VAL 88 2HG1 VAL 88 -1.979 -7.537 4.495 666 HG13 VAL 88 3HG1 VAL 88 -3.587 -7.163 3.874 667 HG21 VAL 88 1HG2 VAL 88 -5.016 -8.436 4.729 668 HG22 VAL 88 2HG2 VAL 88 -4.022 -9.597 5.609 669 HG23 VAL 88 3HG2 VAL 88 -5.271 -8.684 6.456 670 H TYR 89 H TYR 89 -1.900 -6.428 8.779 671 HA TYR 89 HA TYR 89 -3.758 -7.682 10.688 672 HB2 TYR 89 1HB TYR 89 -1.166 -8.008 11.017 673 HB3 TYR 89 2HB TYR 89 -1.248 -6.369 11.655 674 HD1 TYR 89 2HD TYR 89 -2.762 -9.748 12.059 675 HD2 TYR 89 1HD TYR 89 -1.850 -6.012 13.878 676 HE1 TYR 89 2HE TYR 89 -3.487 -10.637 14.234 677 HE2 TYR 89 1HE TYR 89 -2.572 -6.891 16.059 678 HH TYR 89 HH TYR 89 -4.214 -9.916 16.369 679 H ALA 90 H ALA 90 -4.031 -5.350 8.889 680 HA ALA 90 HA ALA 90 -4.352 -3.218 10.895 681 HB1 ALA 90 1HB ALA 90 -4.662 -2.258 8.215 682 HB2 ALA 90 2HB ALA 90 -3.470 -1.802 9.433 683 HB3 ALA 90 3HB ALA 90 -3.154 -3.161 8.355 684 H LEU 91 H LEU 91 -6.155 -1.593 9.908 685 HA LEU 91 HA LEU 91 -8.520 -3.231 9.280 686 HB2 LEU 91 1HB LEU 91 -8.406 -2.513 11.676 687 HB3 LEU 91 2HB LEU 91 -8.500 -0.844 11.117 688 HG LEU 91 HG LEU 91 -10.710 -1.675 9.973 689 HD11 LEU 91 1HD1 LEU 91 -10.727 -3.957 10.384 690 HD12 LEU 91 2HD1 LEU 91 -11.791 -3.321 11.639 691 HD13 LEU 91 3HD1 LEU 91 -10.132 -3.768 12.033 692 HD21 LEU 91 1HD2 LEU 91 -11.016 0.013 11.484 693 HD22 LEU 91 2HD2 LEU 91 -10.170 -0.836 12.777 694 HD23 LEU 91 3HD2 LEU 91 -11.813 -1.307 12.340 695 HA PRO 92 HA PRO 92 -8.996 -0.386 5.932 696 HB2 PRO 92 1HB PRO 92 -11.539 -1.051 5.253 697 HB3 PRO 92 2HB PRO 92 -10.146 -2.072 4.877 698 HG2 PRO 92 1HG PRO 92 -12.117 -2.307 7.118 699 HG3 PRO 92 2HG PRO 92 -11.440 -3.581 6.085 700 HD2 PRO 92 1HD PRO 92 -10.533 -3.100 8.590 701 HD3 PRO 92 2HD PRO 92 -9.477 -3.687 7.289 702 H GLU 93 H GLU 93 -11.521 -0.638 8.413 703 HA GLU 93 HA GLU 93 -12.902 1.717 7.825 704 HB2 GLU 93 1HB GLU 93 -12.593 0.013 10.254 705 HB3 GLU 93 2HB GLU 93 -13.328 1.600 10.440 706 HG2 GLU 93 1HG GLU 93 -14.327 -0.234 8.316 707 HG3 GLU 93 2HG GLU 93 -14.801 -0.500 9.992 708 H ASP 94 H ASP 94 -9.837 1.217 9.324 709 HA ASP 94 HA ASP 94 -9.752 3.926 10.407 710 HB2 ASP 94 1HB ASP 94 -8.030 1.491 10.670 711 HB3 ASP 94 2HB ASP 94 -7.333 3.074 11.004 712 H LEU 95 H LEU 95 -8.244 1.951 7.903 713 HA LEU 95 HA LEU 95 -6.251 3.682 7.055 714 HB2 LEU 95 1HB LEU 95 -6.213 1.549 6.128 715 HB3 LEU 95 2HB LEU 95 -7.908 1.624 5.652 716 HG LEU 95 HG LEU 95 -7.308 3.234 3.880 717 HD11 LEU 95 1HD1 LEU 95 -4.453 2.630 3.984 718 HD12 LEU 95 2HD1 LEU 95 -5.020 3.635 5.316 719 HD13 LEU 95 3HD1 LEU 95 -5.284 4.150 3.650 720 HD21 LEU 95 1HD2 LEU 95 -6.670 0.450 4.007 721 HD22 LEU 95 2HD2 LEU 95 -5.509 1.272 2.963 722 HD23 LEU 95 3HD2 LEU 95 -7.238 1.401 2.634 723 H VAL 96 H VAL 96 -9.692 3.690 6.342 724 HA VAL 96 HA VAL 96 -9.854 5.406 4.207 725 HB VAL 96 HB VAL 96 -11.645 5.150 6.614 726 HG11 VAL 96 1HG1 VAL 96 -12.265 7.270 6.020 727 HG12 VAL 96 2HG1 VAL 96 -11.797 7.053 4.332 728 HG13 VAL 96 3HG1 VAL 96 -13.292 6.335 4.933 729 HG21 VAL 96 1HG2 VAL 96 -11.278 3.664 4.226 730 HG22 VAL 96 2HG2 VAL 96 -12.456 3.400 5.512 731 HG23 VAL 96 3HG2 VAL 96 -12.860 4.439 4.145 732 H GLU 97 H GLU 97 -9.119 6.164 7.545 733 HA GLU 97 HA GLU 97 -8.989 9.022 6.869 734 HB2 GLU 97 1HB GLU 97 -9.030 7.688 9.582 735 HB3 GLU 97 2HB GLU 97 -8.988 9.422 9.298 736 HG2 GLU 97 1HG GLU 97 -11.192 7.820 8.103 737 HG3 GLU 97 2HG GLU 97 -11.235 8.193 9.825 738 H VAL 98 H VAL 98 -6.975 7.085 6.075 739 HA VAL 98 HA VAL 98 -4.718 6.691 6.160 740 HB VAL 98 HB VAL 98 -4.586 9.604 6.940 741 HG11 VAL 98 1HG1 VAL 98 -2.675 8.560 5.003 742 HG12 VAL 98 2HG1 VAL 98 -2.405 9.516 6.462 743 HG13 VAL 98 3HG1 VAL 98 -2.576 7.764 6.573 744 HG21 VAL 98 1HG2 VAL 98 -4.608 8.642 4.106 745 HG22 VAL 98 2HG2 VAL 98 -6.124 8.945 4.956 746 HG23 VAL 98 3HG2 VAL 98 -4.956 10.249 4.744 747 H ASN 99 H ASN 99 -5.946 5.942 8.550 748 HA ASN 99 HA ASN 99 -4.777 7.002 10.870 749 HB2 ASN 99 1HB ASN 99 -6.729 5.237 10.482 750 HB3 ASN 99 2HB ASN 99 -5.419 4.092 10.751 751 HD21 ASN 99 1HD2 ASN 99 -7.716 6.055 12.190 752 HD22 ASN 99 2HD2 ASN 99 -7.149 5.964 13.819 753 HA PRO 100 HA PRO 100 -0.616 5.539 10.032 754 HB2 PRO 100 1HB PRO 100 0.517 6.860 12.116 755 HB3 PRO 100 2HB PRO 100 0.099 7.650 10.591 756 HG2 PRO 100 1HG PRO 100 -1.404 7.615 13.181 757 HG3 PRO 100 2HG PRO 100 -1.109 8.971 12.076 758 HD2 PRO 100 1HD PRO 100 -3.455 7.621 12.130 759 HD3 PRO 100 2HD PRO 100 -2.799 8.336 10.644 760 H LYS 101 H LYS 101 -2.465 5.300 12.986 761 HA LYS 101 HA LYS 101 -0.653 3.612 14.391 762 HB2 LYS 101 1HB LYS 101 -3.534 4.368 14.725 763 HB3 LYS 101 2HB LYS 101 -2.863 3.050 15.677 764 HG2 LYS 101 1HG LYS 101 -2.485 4.757 17.116 765 HG3 LYS 101 2HG LYS 101 -0.993 4.857 16.180 766 HD2 LYS 101 1HD LYS 101 -1.822 6.668 14.889 767 HD3 LYS 101 2HD LYS 101 -3.462 6.441 15.501 768 HE2 LYS 101 1HE LYS 101 -2.975 7.394 17.540 769 HE3 LYS 101 2HE LYS 101 -1.258 7.013 17.427 770 HZ1 LYS 101 1HZ LYS 101 -1.004 8.734 15.769 771 HZ2 LYS 101 2HZ LYS 101 -1.692 9.387 17.170 772 HZ3 LYS 101 3HZ LYS 101 -2.660 9.079 15.817 773 H MET 102 H MET 102 -2.954 3.091 11.892 774 HA MET 102 HA MET 102 -2.921 0.192 12.359 775 HB2 MET 102 1HB MET 102 -4.693 1.892 10.598 776 HB3 MET 102 2HB MET 102 -4.762 0.137 10.672 777 HG2 MET 102 1HG MET 102 -5.240 1.981 13.001 778 HG3 MET 102 2HG MET 102 -6.500 1.232 12.021 779 HE1 MET 102 1HE MET 102 -5.871 1.450 14.959 780 HE2 MET 102 2HE MET 102 -6.666 -0.038 15.474 781 HE3 MET 102 3HE MET 102 -4.931 0.167 15.724 782 H VAL 103 H VAL 103 -2.590 2.547 9.704 783 HA VAL 103 HA VAL 103 -1.792 0.903 7.667 784 HB VAL 103 HB VAL 103 -0.699 3.647 8.304 785 HG11 VAL 103 1HG1 VAL 103 -0.237 3.731 5.845 786 HG12 VAL 103 2HG1 VAL 103 0.784 2.609 6.748 787 HG13 VAL 103 3HG1 VAL 103 -0.563 1.999 5.787 788 HG21 VAL 103 1HG2 VAL 103 -2.505 3.670 6.137 789 HG22 VAL 103 2HG2 VAL 103 -3.266 2.744 7.432 790 HG23 VAL 103 3HG2 VAL 103 -2.712 4.392 7.733 791 H MET 104 H MET 104 -0.091 1.605 10.565 792 HA MET 104 HA MET 104 2.550 1.393 10.007 793 HB2 MET 104 1HB MET 104 2.787 0.146 12.171 794 HB3 MET 104 2HB MET 104 1.834 1.620 12.277 795 HG2 MET 104 1HG MET 104 -0.156 0.470 12.545 796 HG3 MET 104 2HG MET 104 0.495 -1.016 11.855 797 HE1 MET 104 1HE MET 104 -0.701 -2.186 13.466 798 HE2 MET 104 2HE MET 104 0.702 -3.115 13.993 799 HE3 MET 104 3HE MET 104 -0.351 -2.356 15.188 800 H THR 105 H THR 105 0.201 -1.236 9.991 801 HA THR 105 HA THR 105 2.280 -3.136 9.197 802 HB THR 105 HB THR 105 0.626 -3.780 10.962 803 HG1 THR 105 1HG THR 105 1.437 -5.568 10.088 804 HG21 THR 105 1HG2 THR 105 -1.369 -4.070 8.733 805 HG22 THR 105 2HG2 THR 105 -1.293 -2.612 9.722 806 HG23 THR 105 3HG2 THR 105 -1.636 -4.170 10.473 807 H VAL 106 H VAL 106 -0.685 -1.641 8.013 808 HA VAL 106 HA VAL 106 -1.348 -2.993 5.792 809 HB VAL 106 HB VAL 106 -1.039 -0.004 6.051 810 HG11 VAL 106 1HG1 VAL 106 -1.082 -0.132 3.769 811 HG12 VAL 106 2HG1 VAL 106 -1.954 -1.666 3.760 812 HG13 VAL 106 3HG1 VAL 106 -2.813 -0.163 4.103 813 HG21 VAL 106 1HG2 VAL 106 -3.387 -1.879 6.287 814 HG22 VAL 106 2HG2 VAL 106 -2.660 -0.905 7.565 815 HG23 VAL 106 3HG2 VAL 106 -3.526 -0.121 6.243 816 H PHE 107 H PHE 107 1.444 -0.830 6.061 817 HA PHE 107 HA PHE 107 2.293 -1.509 3.357 818 HB2 PHE 107 1HB PHE 107 3.123 0.525 5.386 819 HB3 PHE 107 2HB PHE 107 4.261 0.070 4.122 820 HD1 PHE 107 2HD PHE 107 2.553 -0.285 1.800 821 HD2 PHE 107 1HD PHE 107 2.384 2.648 4.879 822 HE1 PHE 107 2HE PHE 107 1.454 1.275 0.248 823 HE2 PHE 107 1HE PHE 107 1.282 4.213 3.332 824 HZ PHE 107 HZ PHE 107 0.816 3.528 1.013 825 H ALA 108 H ALA 108 3.658 -1.617 6.647 826 HA ALA 108 HA ALA 108 6.039 -2.800 6.319 827 HB1 ALA 108 1HB ALA 108 5.838 -2.855 8.528 828 HB2 ALA 108 2HB ALA 108 4.080 -2.758 8.412 829 HB3 ALA 108 3HB ALA 108 4.882 -4.329 8.368 830 H CYS 109 H CYS 109 2.955 -4.574 6.301 831 HA CYS 109 HA CYS 109 4.014 -7.129 5.883 832 HB2 CYS 109 1HB CYS 109 1.755 -7.709 5.029 833 HB3 CYS 109 2HB CYS 109 1.705 -6.826 6.550 834 HG CYS 109 HG CYS 109 0.080 -5.028 5.728 835 H LEU 110 H LEU 110 3.151 -4.580 3.607 836 HA LEU 110 HA LEU 110 3.671 -6.217 1.295 837 HB2 LEU 110 1HB LEU 110 3.198 -3.259 1.609 838 HB3 LEU 110 2HB LEU 110 3.397 -4.071 0.058 839 HG LEU 110 HG LEU 110 1.233 -4.936 1.936 840 HD11 LEU 110 1HD1 LEU 110 -0.278 -3.325 1.085 841 HD12 LEU 110 2HD1 LEU 110 0.897 -2.738 -0.091 842 HD13 LEU 110 3HD1 LEU 110 1.145 -2.438 1.629 843 HD21 LEU 110 1HD2 LEU 110 2.032 -5.400 -0.833 844 HD22 LEU 110 2HD2 LEU 110 0.322 -5.009 -0.649 845 HD23 LEU 110 3HD2 LEU 110 1.016 -6.369 0.235 846 H MET 111 H MET 111 5.153 -3.164 2.404 847 HA MET 111 HA MET 111 7.388 -3.191 0.810 848 HB2 MET 111 1HB MET 111 8.356 -1.626 2.287 849 HB3 MET 111 2HB MET 111 6.621 -1.383 2.428 850 HG2 MET 111 1HG MET 111 7.341 -1.318 4.620 851 HG3 MET 111 2HG MET 111 6.773 -2.976 4.437 852 HE1 MET 111 1HE MET 111 11.187 -1.664 4.504 853 HE2 MET 111 2HE MET 111 10.286 -1.617 2.989 854 HE3 MET 111 3HE MET 111 9.787 -0.604 4.344 855 H GLY 112 H GLY 112 6.642 -5.287 3.420 856 HA2 GLY 112 1HA GLY 112 9.050 -6.040 4.480 857 HA3 GLY 112 2HA GLY 112 7.737 -7.166 4.175 858 H LYS 113 H LYS 113 8.049 -6.407 1.215 859 HA LYS 113 HA LYS 113 9.893 -8.543 0.605 860 HB2 LYS 113 1HB LYS 113 7.636 -7.944 -0.567 861 HB3 LYS 113 2HB LYS 113 8.614 -6.792 -1.467 862 HG2 LYS 113 1HG LYS 113 8.629 -8.637 -2.844 863 HG3 LYS 113 2HG LYS 113 10.136 -8.832 -1.945 864 HD2 LYS 113 1HD LYS 113 8.982 -10.365 -0.397 865 HD3 LYS 113 2HD LYS 113 7.510 -10.201 -1.358 866 HE2 LYS 113 1HE LYS 113 8.902 -11.004 -3.331 867 HE3 LYS 113 2HE LYS 113 10.128 -11.453 -2.148 868 HZ1 LYS 113 1HZ LYS 113 8.054 -13.010 -2.952 869 HZ2 LYS 113 2HZ LYS 113 7.513 -12.410 -1.466 870 HZ3 LYS 113 3HZ LYS 113 8.979 -13.249 -1.556 871 H GLY 114 H GLY 114 10.632 -5.678 1.602 872 HA2 GLY 114 1HA GLY 114 12.074 -4.329 -0.356 873 HA3 GLY 114 2HA GLY 114 12.452 -4.302 1.360 874 H MET 115 H MET 115 14.111 -5.554 2.153 875 HA MET 115 HA MET 115 15.824 -6.774 0.102 876 HB2 MET 115 1HB MET 115 17.674 -6.438 1.639 877 HB3 MET 115 2HB MET 115 16.809 -4.925 1.410 878 HG2 MET 115 1HG MET 115 16.029 -4.881 3.548 879 HG3 MET 115 2HG MET 115 16.027 -6.636 3.700 880 HE1 MET 115 1HE MET 115 18.454 -4.053 5.890 881 HE2 MET 115 2HE MET 115 18.735 -3.401 4.276 882 HE3 MET 115 3HE MET 115 17.086 -3.682 4.840 883 H LYS 116 H LYS 116 13.736 -7.552 2.621 884 HA LYS 116 HA LYS 116 14.952 -10.223 2.892 885 HB2 LYS 116 1HB LYS 116 13.903 -10.369 5.109 886 HB3 LYS 116 2HB LYS 116 15.018 -9.012 5.008 887 HG2 LYS 116 1HG LYS 116 13.282 -7.985 6.044 888 HG3 LYS 116 2HG LYS 116 12.805 -7.712 4.366 889 HD2 LYS 116 1HD LYS 116 11.143 -9.316 4.441 890 HD3 LYS 116 2HD LYS 116 11.897 -10.184 5.779 891 HE2 LYS 116 1HE LYS 116 11.354 -8.240 7.246 892 HE3 LYS 116 2HE LYS 116 10.455 -7.540 5.902 893 HZ1 LYS 116 1HZ LYS 116 8.742 -8.900 6.252 894 HZ2 LYS 116 2HZ LYS 116 9.428 -9.203 7.768 895 HZ3 LYS 116 3HZ LYS 116 9.724 -10.260 6.481 896 H ARG 117 H ARG 117 13.304 -11.937 3.465 897 HA ARG 117 HA ARG 117 10.636 -11.436 2.405 898 HB2 ARG 117 1HB ARG 117 12.396 -13.627 1.293 899 HB3 ARG 117 2HB ARG 117 10.735 -13.286 0.831 900 HG2 ARG 117 1HG ARG 117 11.314 -11.359 -0.323 901 HG3 ARG 117 2HG ARG 117 12.859 -11.206 0.517 902 HD2 ARG 117 1HD ARG 117 12.287 -13.561 -1.245 903 HD3 ARG 117 2HD ARG 117 12.842 -12.035 -1.930 904 HE ARG 117 HE ARG 117 14.525 -12.827 0.200 905 HH11 ARG 117 1HH1 ARG 117 13.749 -13.596 -3.106 906 HH12 ARG 117 2HH1 ARG 117 15.321 -14.228 -3.465 907 HH21 ARG 117 1HH2 ARG 117 16.599 -13.656 -0.260 908 HH22 ARG 117 2HH2 ARG 117 16.941 -14.263 -1.846 909 H VAL 118 H VAL 118 9.145 -13.218 2.822 910 HA VAL 118 HA VAL 118 9.735 -14.463 5.379 911 HB VAL 118 HB VAL 118 7.180 -14.511 3.765 912 HG11 VAL 118 1HG1 VAL 118 8.014 -15.926 6.122 913 HG12 VAL 118 2HG1 VAL 118 6.664 -14.854 6.499 914 HG13 VAL 118 3HG1 VAL 118 6.507 -16.055 5.215 915 HG21 VAL 118 1HG2 VAL 118 8.388 -12.415 5.262 916 HG22 VAL 118 2HG2 VAL 118 6.821 -12.430 4.453 917 HG23 VAL 118 3HG2 VAL 118 6.954 -12.963 6.129 918 H SER 119 H SER 119 10.329 -16.512 5.637 919 HA SER 119 HA SER 119 11.160 -18.221 3.708 920 HB2 SER 119 1HB SER 119 10.777 -20.079 5.345 921 HB3 SER 119 2HB SER 119 11.603 -18.682 6.037 922 HG SER 119 HG SER 119 10.068 -18.792 7.471 923 H GLY 120 H GLY 120 7.960 -18.499 5.275 924 HA2 GLY 120 1HA GLY 120 6.010 -18.669 3.762 925 HA3 GLY 120 2HA GLY 120 6.988 -19.747 2.778 926 HA PRO 121 HA PRO 121 4.473 -21.985 6.179 927 HB2 PRO 121 1HB PRO 121 2.349 -22.799 4.699 928 HB3 PRO 121 2HB PRO 121 2.364 -21.281 5.603 929 HG2 PRO 121 1HG PRO 121 2.858 -21.754 2.689 930 HG3 PRO 121 2HG PRO 121 1.908 -20.477 3.469 931 HD2 PRO 121 1HD PRO 121 4.425 -20.069 2.557 932 HD3 PRO 121 2HD PRO 121 3.775 -19.223 3.975 933 H SER 122 H SER 122 5.001 -22.645 2.751 934 HA SER 122 HA SER 122 5.707 -25.413 3.467 935 HB2 SER 122 1HB SER 122 3.574 -25.373 2.234 936 HB3 SER 122 2HB SER 122 4.353 -24.498 0.916 937 HG SER 122 HG SER 122 5.812 -26.364 0.807 938 H SER 123 H SER 123 7.731 -25.943 2.998 939 HA SER 123 HA SER 123 9.070 -24.700 0.717 940 HB2 SER 123 1HB SER 123 10.948 -23.947 1.940 941 HB3 SER 123 2HB SER 123 9.558 -23.421 2.890 942 HG SER 123 HG SER 123 10.001 -25.704 3.878 943 H GLY 124 H GLY 124 11.276 -25.756 0.366 944 HA2 GLY 124 1HA GLY 124 12.560 -27.825 1.011 945 HA3 GLY 124 2HA GLY 124 11.008 -28.644 0.927 Start of MODEL 5 1 H1 GLY 1 H GLY 1 7.240 13.829 -2.574 2 HA2 GLY 1 1HA GLY 1 9.062 14.978 -1.697 3 HA3 GLY 1 2HA GLY 1 8.672 13.962 -0.318 4 H SER 2 H SER 2 11.258 14.957 -0.952 5 HA SER 2 HA SER 2 12.663 12.466 -1.664 6 HB2 SER 2 1HB SER 2 13.274 15.339 -2.222 7 HB3 SER 2 2HB SER 2 14.617 14.215 -2.016 8 HG SER 2 HG SER 2 14.005 13.127 -3.784 9 H SER 3 H SER 3 14.010 11.582 -0.215 10 HA SER 3 HA SER 3 14.571 13.112 2.241 11 HB2 SER 3 1HB SER 3 13.787 10.247 1.834 12 HB3 SER 3 2HB SER 3 14.765 10.693 3.233 13 HG SER 3 HG SER 3 12.900 12.451 3.242 14 H GLY 4 H GLY 4 15.771 10.316 0.372 15 HA2 GLY 4 1HA GLY 4 18.041 10.489 -0.562 16 HA3 GLY 4 2HA GLY 4 18.509 11.272 0.939 17 H SER 5 H SER 5 18.284 9.940 2.935 18 HA SER 5 HA SER 5 19.803 7.660 2.840 19 HB2 SER 5 1HB SER 5 19.164 7.245 5.102 20 HB3 SER 5 2HB SER 5 19.136 8.997 4.894 21 HG SER 5 HG SER 5 17.243 8.542 5.867 22 H SER 6 H SER 6 19.251 5.406 3.264 23 HA SER 6 HA SER 6 16.580 4.506 2.645 24 HB2 SER 6 1HB SER 6 17.381 3.083 0.717 25 HB3 SER 6 2HB SER 6 17.323 4.814 0.386 26 HG SER 6 HG SER 6 19.318 3.460 -0.155 27 H GLY 7 H GLY 7 16.397 2.124 2.770 28 HA2 GLY 7 1HA GLY 7 17.299 0.007 3.418 29 HA3 GLY 7 2HA GLY 7 18.620 0.852 4.212 30 H ASN 8 H ASN 8 17.448 2.614 5.846 31 HA ASN 8 HA ASN 8 16.600 1.044 8.012 32 HB2 ASN 8 1HB ASN 8 16.276 4.024 7.590 33 HB3 ASN 8 2HB ASN 8 16.120 3.188 9.132 34 HD21 ASN 8 1HD2 ASN 8 18.063 1.858 9.747 35 HD22 ASN 8 2HD2 ASN 8 19.611 2.565 9.457 36 H ASP 9 H ASP 9 14.483 2.070 9.236 37 HA ASP 9 HA ASP 9 12.288 0.864 8.007 38 HB2 ASP 9 1HB ASP 9 12.670 2.673 10.340 39 HB3 ASP 9 2HB ASP 9 11.032 2.485 9.718 40 H ASP 10 H ASP 10 13.752 3.806 7.296 41 HA ASP 10 HA ASP 10 11.441 5.278 6.479 42 HB2 ASP 10 1HB ASP 10 12.935 6.927 5.713 43 HB3 ASP 10 2HB ASP 10 13.755 6.206 7.096 44 H ILE 11 H ILE 11 12.959 2.599 5.209 45 HA ILE 11 HA ILE 11 12.810 3.163 2.426 46 HB ILE 11 HB ILE 11 14.210 1.350 3.422 47 HG12 ILE 11 1HG1 ILE 11 12.319 0.146 1.420 48 HG13 ILE 11 2HG1 ILE 11 13.351 1.501 0.975 49 HG21 ILE 11 1HG2 ILE 11 13.054 0.167 4.972 50 HG22 ILE 11 2HG2 ILE 11 11.525 0.313 4.105 51 HG23 ILE 11 3HG2 ILE 11 12.728 -0.864 3.579 52 HD11 ILE 11 1HD1 ILE 11 15.309 0.138 1.700 53 HD12 ILE 11 2HD1 ILE 11 14.209 -1.226 1.900 54 HD13 ILE 11 3HD1 ILE 11 14.436 -0.501 0.309 55 H ILE 12 H ILE 12 10.464 2.412 4.779 56 HA ILE 12 HA ILE 12 8.563 0.993 3.300 57 HB ILE 12 HB ILE 12 8.087 3.017 5.490 58 HG12 ILE 12 1HG1 ILE 12 8.504 0.024 5.534 59 HG13 ILE 12 2HG1 ILE 12 9.518 1.253 6.283 60 HG21 ILE 12 1HG2 ILE 12 6.258 1.622 3.812 61 HG22 ILE 12 2HG2 ILE 12 6.118 0.992 5.453 62 HG23 ILE 12 3HG2 ILE 12 5.916 2.717 5.151 63 HD11 ILE 12 1HD1 ILE 12 8.393 0.731 8.137 64 HD12 ILE 12 2HD1 ILE 12 7.119 1.743 7.456 65 HD13 ILE 12 3HD1 ILE 12 7.064 -0.007 7.242 66 H VAL 13 H VAL 13 9.414 4.371 3.295 67 HA VAL 13 HA VAL 13 7.085 5.084 1.689 68 HB VAL 13 HB VAL 13 9.351 6.773 2.754 69 HG11 VAL 13 1HG1 VAL 13 7.042 7.426 0.970 70 HG12 VAL 13 2HG1 VAL 13 7.683 8.641 2.077 71 HG13 VAL 13 3HG1 VAL 13 8.728 7.928 0.847 72 HG21 VAL 13 1HG2 VAL 13 7.115 7.737 3.898 73 HG22 VAL 13 2HG2 VAL 13 6.666 6.038 3.735 74 HG23 VAL 13 3HG2 VAL 13 8.120 6.485 4.629 75 H ASN 14 H ASN 14 10.635 5.182 1.427 76 HA ASN 14 HA ASN 14 10.860 6.137 -1.156 77 HB2 ASN 14 1HB ASN 14 12.556 4.450 0.607 78 HB3 ASN 14 2HB ASN 14 12.961 4.466 -1.107 79 HD21 ASN 14 1HD2 ASN 14 13.419 6.510 -2.096 80 HD22 ASN 14 2HD2 ASN 14 14.062 7.803 -1.147 81 H TRP 15 H TRP 15 10.743 2.722 -0.137 82 HA TRP 15 HA TRP 15 10.843 1.513 -2.607 83 HB2 TRP 15 1HB TRP 15 10.867 0.307 -0.444 84 HB3 TRP 15 2HB TRP 15 9.145 0.633 -0.262 85 HD1 TRP 15 HD TRP 15 11.382 -1.040 -2.976 86 HE1 TRP 15 1HE TRP 15 10.146 -3.131 -3.827 87 HE3 TRP 15 3HE TRP 15 7.129 -0.671 -0.164 88 HZ2 TRP 15 2HZ TRP 15 7.693 -4.449 -3.368 89 HZ3 TRP 15 3HZ TRP 15 5.386 -2.387 -0.430 90 HH2 TRP 15 HH TRP 15 5.664 -4.236 -2.000 91 H VAL 16 H VAL 16 7.775 1.949 -0.842 92 HA VAL 16 HA VAL 16 5.945 1.384 -2.700 93 HB VAL 16 HB VAL 16 5.848 3.849 -0.957 94 HG11 VAL 16 1HG1 VAL 16 4.146 4.131 -2.548 95 HG12 VAL 16 2HG1 VAL 16 3.736 2.415 -2.541 96 HG13 VAL 16 3HG1 VAL 16 3.340 3.424 -1.149 97 HG21 VAL 16 1HG2 VAL 16 6.236 1.721 0.246 98 HG22 VAL 16 2HG2 VAL 16 4.687 2.465 0.643 99 HG23 VAL 16 3HG2 VAL 16 4.747 1.086 -0.455 100 H ASN 17 H ASN 17 7.489 4.590 -2.476 101 HA ASN 17 HA ASN 17 6.274 5.782 -4.660 102 HB2 ASN 17 1HB ASN 17 8.893 6.181 -3.274 103 HB3 ASN 17 2HB ASN 17 8.593 7.037 -4.784 104 HD21 ASN 17 1HD2 ASN 17 7.853 6.793 -1.442 105 HD22 ASN 17 2HD2 ASN 17 6.833 8.185 -1.340 106 H GLU 18 H GLU 18 9.430 4.119 -4.603 107 HA GLU 18 HA GLU 18 9.957 4.274 -7.335 108 HB2 GLU 18 1HB GLU 18 10.870 2.496 -5.122 109 HB3 GLU 18 2HB GLU 18 11.245 2.023 -6.774 110 HG2 GLU 18 1HG GLU 18 12.374 4.151 -7.137 111 HG3 GLU 18 2HG GLU 18 11.982 4.646 -5.491 112 H THR 19 H THR 19 8.766 1.403 -5.581 113 HA THR 19 HA THR 19 8.236 -0.322 -7.564 114 HB THR 19 HB THR 19 6.347 0.311 -5.288 115 HG1 THR 19 1HG THR 19 7.511 -1.784 -4.613 116 HG21 THR 19 1HG2 THR 19 5.850 -2.239 -5.704 117 HG22 THR 19 2HG2 THR 19 6.372 -1.853 -7.344 118 HG23 THR 19 3HG2 THR 19 5.007 -0.996 -6.628 119 H LEU 20 H LEU 20 6.210 2.466 -6.746 120 HA LEU 20 HA LEU 20 4.226 1.904 -8.717 121 HB2 LEU 20 1HB LEU 20 4.878 4.443 -7.229 122 HB3 LEU 20 2HB LEU 20 3.459 4.213 -8.249 123 HG LEU 20 HG LEU 20 3.914 2.361 -5.951 124 HD11 LEU 20 1HD1 LEU 20 4.041 4.151 -4.588 125 HD12 LEU 20 2HD1 LEU 20 2.295 4.188 -4.829 126 HD13 LEU 20 3HD1 LEU 20 3.339 5.247 -5.778 127 HD21 LEU 20 1HD2 LEU 20 1.333 2.734 -5.965 128 HD22 LEU 20 2HD2 LEU 20 2.081 1.691 -7.175 129 HD23 LEU 20 3HD2 LEU 20 1.622 3.342 -7.595 130 H ARG 21 H ARG 21 6.895 4.251 -8.531 131 HA ARG 21 HA ARG 21 6.544 5.507 -10.970 132 HB2 ARG 21 1HB ARG 21 8.199 6.106 -9.159 133 HB3 ARG 21 2HB ARG 21 9.230 4.822 -9.777 134 HG2 ARG 21 1HG ARG 21 9.754 5.969 -11.688 135 HG3 ARG 21 2HG ARG 21 8.262 6.912 -11.660 136 HD2 ARG 21 1HD ARG 21 9.076 8.367 -10.024 137 HD3 ARG 21 2HD ARG 21 10.355 7.254 -9.541 138 HE ARG 21 HE ARG 21 10.480 9.211 -11.610 139 HH11 ARG 21 1HH1 ARG 21 11.635 6.068 -10.656 140 HH12 ARG 21 2HH1 ARG 21 13.091 6.176 -11.591 141 HH21 ARG 21 1HH2 ARG 21 12.392 9.365 -12.844 142 HH22 ARG 21 2HH2 ARG 21 13.520 8.052 -12.834 143 H GLU 22 H GLU 22 8.391 2.558 -10.256 144 HA GLU 22 HA GLU 22 9.483 2.069 -12.741 145 HB2 GLU 22 1HB GLU 22 8.386 0.041 -10.786 146 HB3 GLU 22 2HB GLU 22 9.485 -0.319 -12.110 147 HG2 GLU 22 1HG GLU 22 10.271 1.726 -10.096 148 HG3 GLU 22 2HG GLU 22 10.373 0.017 -9.676 149 H ALA 23 H ALA 23 6.247 1.258 -11.562 150 HA ALA 23 HA ALA 23 5.502 0.056 -14.091 151 HB1 ALA 23 1HB ALA 23 4.180 0.407 -11.442 152 HB2 ALA 23 2HB ALA 23 3.188 0.071 -12.861 153 HB3 ALA 23 3HB ALA 23 4.453 -1.061 -12.380 154 H GLU 24 H GLU 24 5.659 3.170 -12.847 155 HA GLU 24 HA GLU 24 5.057 5.180 -13.752 156 HB2 GLU 24 1HB GLU 24 3.497 3.740 -15.884 157 HB3 GLU 24 2HB GLU 24 4.239 5.332 -15.959 158 HG2 GLU 24 1HG GLU 24 5.996 2.975 -15.544 159 HG3 GLU 24 2HG GLU 24 5.313 3.247 -17.147 160 H LYS 25 H LYS 25 3.555 3.902 -11.717 161 HA LYS 25 HA LYS 25 0.752 4.215 -12.269 162 HB2 LYS 25 1HB LYS 25 2.417 3.396 -9.962 163 HB3 LYS 25 2HB LYS 25 0.866 4.126 -9.569 164 HG2 LYS 25 1HG LYS 25 0.793 1.661 -9.706 165 HG3 LYS 25 2HG LYS 25 -0.308 2.459 -10.832 166 HD2 LYS 25 1HD LYS 25 1.393 2.170 -12.618 167 HD3 LYS 25 2HD LYS 25 2.387 1.261 -11.476 168 HE2 LYS 25 1HE LYS 25 1.002 -0.555 -11.506 169 HE3 LYS 25 2HE LYS 25 -0.434 0.407 -11.850 170 HZ1 LYS 25 1HZ LYS 25 0.879 -1.106 -13.650 171 HZ2 LYS 25 2HZ LYS 25 1.522 0.426 -13.964 172 HZ3 LYS 25 3HZ LYS 25 -0.150 0.179 -14.038 173 H SER 26 H SER 26 -0.643 5.790 -11.418 174 HA SER 26 HA SER 26 0.578 8.404 -11.156 175 HB2 SER 26 1HB SER 26 -1.561 9.298 -11.541 176 HB3 SER 26 2HB SER 26 -1.548 7.825 -12.510 177 HG SER 26 HG SER 26 -3.370 8.398 -10.867 178 H SER 27 H SER 27 0.206 6.035 -9.033 179 HA SER 27 HA SER 27 -0.824 7.681 -6.840 180 HB2 SER 27 1HB SER 27 -0.119 4.736 -6.887 181 HB3 SER 27 2HB SER 27 -0.876 5.595 -5.546 182 HG SER 27 HG SER 27 -2.215 5.972 -7.878 183 H SER 28 H SER 28 0.359 8.030 -4.938 184 HA SER 28 HA SER 28 2.970 7.076 -4.478 185 HB2 SER 28 1HB SER 28 4.282 9.083 -4.950 186 HB3 SER 28 2HB SER 28 3.504 8.509 -6.425 187 HG SER 28 HG SER 28 2.878 10.529 -6.512 188 H ILE 29 H ILE 29 3.944 8.004 -2.575 189 HA ILE 29 HA ILE 29 2.077 9.625 -0.973 190 HB ILE 29 HB ILE 29 3.044 8.362 1.029 191 HG12 ILE 29 1HG1 ILE 29 3.526 6.107 -0.870 192 HG13 ILE 29 2HG1 ILE 29 4.799 7.303 -0.649 193 HG21 ILE 29 1HG2 ILE 29 0.968 7.612 -0.861 194 HG22 ILE 29 2HG2 ILE 29 1.552 6.244 0.083 195 HG23 ILE 29 3HG2 ILE 29 0.925 7.675 0.900 196 HD11 ILE 29 1HD1 ILE 29 3.969 6.633 1.924 197 HD12 ILE 29 2HD1 ILE 29 4.034 5.110 1.035 198 HD13 ILE 29 3HD1 ILE 29 5.458 6.147 1.115 199 H SER 30 H SER 30 3.040 10.942 0.671 200 HA SER 30 HA SER 30 5.762 11.778 -0.043 201 HB2 SER 30 1HB SER 30 3.691 13.279 1.576 202 HB3 SER 30 2HB SER 30 5.223 13.915 0.980 203 HG SER 30 HG SER 30 3.170 14.314 -0.269 204 H SER 31 H SER 31 3.757 10.749 2.648 205 HA SER 31 HA SER 31 6.061 9.904 4.132 206 HB2 SER 31 1HB SER 31 5.615 12.483 4.560 207 HB3 SER 31 2HB SER 31 4.386 11.853 5.656 208 HG SER 31 HG SER 31 6.964 10.771 5.765 209 H PHE 32 H PHE 32 5.352 9.041 6.346 210 HA PHE 32 HA PHE 32 3.503 7.034 6.043 211 HB2 PHE 32 1HB PHE 32 4.642 8.401 8.452 212 HB3 PHE 32 2HB PHE 32 3.371 7.202 8.661 213 HD1 PHE 32 2HD PHE 32 3.798 4.952 7.308 214 HD2 PHE 32 1HD PHE 32 6.815 7.685 8.551 215 HE1 PHE 32 2HE PHE 32 5.473 3.155 7.183 216 HE2 PHE 32 1HE PHE 32 8.495 5.892 8.427 217 HZ PHE 32 HZ PHE 32 7.824 3.622 7.743 218 H LYS 33 H LYS 33 2.957 10.364 6.856 219 HA LYS 33 HA LYS 33 0.115 9.809 7.367 220 HB2 LYS 33 1HB LYS 33 1.959 12.025 8.170 221 HB3 LYS 33 2HB LYS 33 0.234 12.347 8.050 222 HG2 LYS 33 1HG LYS 33 1.108 9.975 9.607 223 HG3 LYS 33 2HG LYS 33 1.351 11.576 10.309 224 HD2 LYS 33 1HD LYS 33 -1.305 11.005 9.125 225 HD3 LYS 33 2HD LYS 33 -0.904 10.184 10.635 226 HE2 LYS 33 1HE LYS 33 -0.805 13.161 10.160 227 HE3 LYS 33 2HE LYS 33 -2.067 12.299 11.038 228 HZ1 LYS 33 1HZ LYS 33 0.183 13.372 12.124 229 HZ2 LYS 33 2HZ LYS 33 0.559 11.725 12.025 230 HZ3 LYS 33 3HZ LYS 33 -0.821 12.227 12.863 231 H ASP 34 H ASP 34 0.934 9.598 4.743 232 HA ASP 34 HA ASP 34 0.536 12.062 3.329 233 HB2 ASP 34 1HB ASP 34 1.871 10.590 2.128 234 HB3 ASP 34 2HB ASP 34 0.883 9.192 2.547 235 HA PRO 35 HA PRO 35 -3.869 12.086 3.257 236 HB2 PRO 35 1HB PRO 35 -4.229 13.703 1.106 237 HB3 PRO 35 2HB PRO 35 -3.690 14.303 2.679 238 HG2 PRO 35 1HG PRO 35 -2.075 13.672 0.238 239 HG3 PRO 35 2HG PRO 35 -1.946 15.057 1.339 240 HD2 PRO 35 1HD PRO 35 -0.277 12.928 1.472 241 HD3 PRO 35 2HD PRO 35 -0.753 13.859 2.906 242 H LYS 36 H LYS 36 -2.167 11.547 0.184 243 HA LYS 36 HA LYS 36 -4.227 10.557 -1.355 244 HB2 LYS 36 1HB LYS 36 -1.390 9.514 -1.331 245 HB3 LYS 36 2HB LYS 36 -2.537 9.391 -2.659 246 HG2 LYS 36 1HG LYS 36 -1.595 12.023 -1.559 247 HG3 LYS 36 2HG LYS 36 -0.771 11.174 -2.870 248 HD2 LYS 36 1HD LYS 36 -3.219 11.116 -3.878 249 HD3 LYS 36 2HD LYS 36 -3.417 12.533 -2.846 250 HE2 LYS 36 1HE LYS 36 -2.737 13.275 -5.018 251 HE3 LYS 36 2HE LYS 36 -1.387 13.508 -3.908 252 HZ1 LYS 36 1HZ LYS 36 -1.700 11.301 -5.868 253 HZ2 LYS 36 2HZ LYS 36 -0.448 11.405 -4.735 254 HZ3 LYS 36 3HZ LYS 36 -0.589 12.574 -5.950 255 H ILE 37 H ILE 37 -2.535 9.028 1.275 256 HA ILE 37 HA ILE 37 -3.165 6.350 0.790 257 HB ILE 37 HB ILE 37 -2.789 7.818 3.398 258 HG12 ILE 37 1HG1 ILE 37 -0.993 6.025 1.751 259 HG13 ILE 37 2HG1 ILE 37 -0.803 7.756 2.004 260 HG21 ILE 37 1HG2 ILE 37 -2.261 5.201 3.949 261 HG22 ILE 37 2HG2 ILE 37 -3.763 6.034 4.341 262 HG23 ILE 37 3HG2 ILE 37 -3.648 5.070 2.868 263 HD11 ILE 37 1HD1 ILE 37 -0.889 6.586 4.554 264 HD12 ILE 37 2HD1 ILE 37 0.181 5.587 3.568 265 HD13 ILE 37 3HD1 ILE 37 0.492 7.314 3.734 266 H SER 38 H SER 38 -5.101 8.968 2.029 267 HA SER 38 HA SER 38 -7.138 7.562 3.302 268 HB2 SER 38 1HB SER 38 -8.533 9.529 2.914 269 HB3 SER 38 2HB SER 38 -6.901 10.027 3.358 270 HG SER 38 HG SER 38 -8.236 10.763 1.245 271 H THR 39 H THR 39 -6.623 8.232 -0.114 272 HA THR 39 HA THR 39 -9.149 7.037 -0.877 273 HB THR 39 HB THR 39 -8.329 7.413 -3.216 274 HG1 THR 39 1HG THR 39 -6.002 7.761 -1.917 275 HG21 THR 39 1HG2 THR 39 -7.957 10.019 -1.847 276 HG22 THR 39 2HG2 THR 39 -9.467 9.159 -1.544 277 HG23 THR 39 3HG2 THR 39 -9.011 9.587 -3.192 278 H SER 40 H SER 40 -6.114 5.899 -0.065 279 HA SER 40 HA SER 40 -5.176 3.823 -0.136 280 HB2 SER 40 1HB SER 40 -7.673 2.891 -1.562 281 HB3 SER 40 2HB SER 40 -6.531 1.910 -0.644 282 HG SER 40 HG SER 40 -7.859 4.041 0.613 283 H LEU 41 H LEU 41 -4.991 5.805 -2.337 284 HA LEU 41 HA LEU 41 -4.876 4.431 -4.817 285 HB2 LEU 41 1HB LEU 41 -3.880 7.045 -3.788 286 HB3 LEU 41 2HB LEU 41 -3.276 6.449 -5.333 287 HG LEU 41 HG LEU 41 -6.165 7.005 -4.655 288 HD11 LEU 41 1HD1 LEU 41 -4.086 8.744 -5.421 289 HD12 LEU 41 2HD1 LEU 41 -5.811 9.089 -5.315 290 HD13 LEU 41 3HD1 LEU 41 -5.118 8.523 -6.834 291 HD21 LEU 41 1HD2 LEU 41 -6.482 6.662 -7.109 292 HD22 LEU 41 2HD2 LEU 41 -6.070 5.199 -6.214 293 HD23 LEU 41 3HD2 LEU 41 -4.840 6.020 -7.175 294 HA PRO 42 HA PRO 42 -0.116 4.239 -3.928 295 HB2 PRO 42 1HB PRO 42 0.659 4.668 -1.362 296 HB3 PRO 42 2HB PRO 42 0.529 5.966 -2.556 297 HG2 PRO 42 1HG PRO 42 -1.403 5.159 -0.416 298 HG3 PRO 42 2HG PRO 42 -0.895 6.785 -0.909 299 HD2 PRO 42 1HD PRO 42 -3.239 5.687 -1.703 300 HD3 PRO 42 2HD PRO 42 -2.321 6.818 -2.719 301 H VAL 43 H VAL 43 -2.504 3.106 -1.669 302 HA VAL 43 HA VAL 43 -0.922 0.809 -0.860 303 HB VAL 43 HB VAL 43 -3.835 1.232 -0.242 304 HG11 VAL 43 1HG1 VAL 43 -3.342 -0.838 0.565 305 HG12 VAL 43 2HG1 VAL 43 -1.631 -0.469 0.783 306 HG13 VAL 43 3HG1 VAL 43 -2.818 0.123 1.946 307 HG21 VAL 43 1HG2 VAL 43 -1.755 3.005 0.430 308 HG22 VAL 43 2HG2 VAL 43 -3.408 2.990 1.047 309 HG23 VAL 43 3HG2 VAL 43 -2.141 2.102 1.894 310 H LEU 44 H LEU 44 -3.507 1.597 -3.069 311 HA LEU 44 HA LEU 44 -4.124 -1.170 -3.642 312 HB2 LEU 44 1HB LEU 44 -5.059 1.450 -4.774 313 HB3 LEU 44 2HB LEU 44 -5.525 -0.096 -5.481 314 HG LEU 44 HG LEU 44 -6.091 0.660 -2.620 315 HD11 LEU 44 1HD1 LEU 44 -7.279 2.242 -3.923 316 HD12 LEU 44 2HD1 LEU 44 -8.437 0.993 -3.464 317 HD13 LEU 44 3HD1 LEU 44 -7.764 1.017 -5.095 318 HD21 LEU 44 1HD2 LEU 44 -6.260 -1.766 -4.065 319 HD22 LEU 44 2HD2 LEU 44 -7.907 -1.204 -3.778 320 HD23 LEU 44 3HD2 LEU 44 -6.803 -1.430 -2.421 321 H ASP 45 H ASP 45 -2.559 1.544 -5.310 322 HA ASP 45 HA ASP 45 -1.933 0.072 -7.659 323 HB2 ASP 45 1HB ASP 45 -1.160 2.718 -6.525 324 HB3 ASP 45 2HB ASP 45 -0.147 2.042 -7.797 325 H LEU 46 H LEU 46 -0.226 0.721 -4.651 326 HA LEU 46 HA LEU 46 2.322 -0.147 -5.350 327 HB2 LEU 46 1HB LEU 46 2.061 0.928 -3.277 328 HB3 LEU 46 2HB LEU 46 0.805 -0.197 -2.761 329 HG LEU 46 HG LEU 46 2.457 -1.952 -2.477 330 HD11 LEU 46 1HD1 LEU 46 4.424 -1.917 -3.496 331 HD12 LEU 46 2HD1 LEU 46 4.867 -0.428 -2.662 332 HD13 LEU 46 3HD1 LEU 46 4.008 -0.354 -4.199 333 HD21 LEU 46 1HD2 LEU 46 2.908 0.677 -1.125 334 HD22 LEU 46 2HD2 LEU 46 3.921 -0.713 -0.732 335 HD23 LEU 46 3HD2 LEU 46 2.174 -0.796 -0.492 336 H ILE 47 H ILE 47 -0.533 -1.981 -4.437 337 HA ILE 47 HA ILE 47 0.766 -4.485 -4.132 338 HB ILE 47 HB ILE 47 -2.114 -3.799 -4.710 339 HG12 ILE 47 1HG1 ILE 47 -0.972 -4.956 -2.179 340 HG13 ILE 47 2HG1 ILE 47 -0.952 -3.222 -2.472 341 HG21 ILE 47 1HG2 ILE 47 -1.893 -5.966 -5.571 342 HG22 ILE 47 2HG2 ILE 47 -0.791 -6.458 -4.287 343 HG23 ILE 47 3HG2 ILE 47 -2.498 -6.200 -3.932 344 HD11 ILE 47 1HD1 ILE 47 -3.178 -3.009 -2.168 345 HD12 ILE 47 2HD1 ILE 47 -3.536 -4.604 -2.831 346 HD13 ILE 47 3HD1 ILE 47 -2.923 -4.450 -1.185 347 H ASP 48 H ASP 48 -1.375 -3.343 -6.751 348 HA ASP 48 HA ASP 48 -0.978 -5.407 -8.531 349 HB2 ASP 48 1HB ASP 48 -2.040 -4.098 -10.090 350 HB3 ASP 48 2HB ASP 48 -2.464 -3.209 -8.630 351 H ALA 49 H ALA 49 0.940 -2.443 -8.180 352 HA ALA 49 HA ALA 49 2.664 -2.505 -10.237 353 HB1 ALA 49 1HB ALA 49 2.850 -0.861 -8.482 354 HB2 ALA 49 2HB ALA 49 3.411 -2.087 -7.346 355 HB3 ALA 49 3HB ALA 49 4.414 -1.638 -8.724 356 H ILE 50 H ILE 50 2.900 -4.591 -7.375 357 HA ILE 50 HA ILE 50 5.211 -5.977 -8.391 358 HB ILE 50 HB ILE 50 3.430 -6.802 -6.099 359 HG12 ILE 50 1HG1 ILE 50 5.960 -5.156 -5.953 360 HG13 ILE 50 2HG1 ILE 50 4.344 -4.458 -5.910 361 HG21 ILE 50 1HG2 ILE 50 5.680 -7.791 -5.339 362 HG22 ILE 50 2HG2 ILE 50 4.791 -8.618 -6.617 363 HG23 ILE 50 3HG2 ILE 50 6.168 -7.594 -7.022 364 HD11 ILE 50 1HD1 ILE 50 5.880 -5.712 -3.807 365 HD12 ILE 50 2HD1 ILE 50 4.453 -4.679 -3.708 366 HD13 ILE 50 3HD1 ILE 50 4.270 -6.415 -3.964 367 H GLN 51 H GLN 51 1.811 -6.860 -7.794 368 HA GLN 51 HA GLN 51 2.154 -9.079 -9.703 369 HB2 GLN 51 1HB GLN 51 1.663 -9.936 -7.503 370 HB3 GLN 51 2HB GLN 51 0.302 -8.836 -7.328 371 HG2 GLN 51 1HG GLN 51 -0.798 -10.750 -7.868 372 HG3 GLN 51 2HG GLN 51 -0.558 -10.070 -9.477 373 HE21 GLN 51 1HE2 GLN 51 0.933 -12.257 -7.131 374 HE22 GLN 51 2HE2 GLN 51 1.586 -13.348 -8.299 375 HA PRO 52 HA PRO 52 -0.644 -6.308 -11.956 376 HB2 PRO 52 1HB PRO 52 -0.096 -7.394 -14.383 377 HB3 PRO 52 2HB PRO 52 0.941 -6.186 -13.616 378 HG2 PRO 52 1HG PRO 52 1.253 -9.162 -13.717 379 HG3 PRO 52 2HG PRO 52 2.481 -7.900 -13.932 380 HD2 PRO 52 1HD PRO 52 2.180 -9.258 -11.609 381 HD3 PRO 52 2HD PRO 52 2.717 -7.567 -11.663 382 H GLY 53 H GLY 53 -2.756 -6.737 -11.962 383 HA2 GLY 53 1HA GLY 53 -4.460 -8.060 -13.247 384 HA3 GLY 53 2HA GLY 53 -3.619 -9.480 -12.644 385 H SER 54 H SER 54 -3.176 -8.666 -10.000 386 HA SER 54 HA SER 54 -5.451 -9.516 -8.711 387 HB2 SER 54 1HB SER 54 -4.469 -8.414 -6.658 388 HB3 SER 54 2HB SER 54 -3.373 -9.491 -7.524 389 HG SER 54 HG SER 54 -2.773 -7.378 -8.643 390 H ILE 55 H ILE 55 -4.329 -6.128 -8.764 391 HA ILE 55 HA ILE 55 -6.834 -5.129 -7.830 392 HB ILE 55 HB ILE 55 -4.579 -3.603 -9.137 393 HG12 ILE 55 1HG1 ILE 55 -3.918 -4.929 -7.113 394 HG13 ILE 55 2HG1 ILE 55 -3.727 -3.189 -6.926 395 HG21 ILE 55 1HG2 ILE 55 -5.775 -1.920 -7.359 396 HG22 ILE 55 2HG2 ILE 55 -6.104 -1.960 -9.090 397 HG23 ILE 55 3HG2 ILE 55 -7.152 -2.833 -7.973 398 HD11 ILE 55 1HD1 ILE 55 -6.325 -4.174 -6.049 399 HD12 ILE 55 2HD1 ILE 55 -4.963 -4.850 -5.155 400 HD13 ILE 55 3HD1 ILE 55 -5.180 -3.102 -5.242 401 H ASN 56 H ASN 56 -8.479 -4.146 -8.930 402 HA ASN 56 HA ASN 56 -8.288 -4.047 -11.861 403 HB2 ASN 56 1HB ASN 56 -9.612 -6.059 -10.758 404 HB3 ASN 56 2HB ASN 56 -10.881 -4.846 -10.610 405 HD21 ASN 56 1HD2 ASN 56 -12.226 -4.722 -12.244 406 HD22 ASN 56 2HD2 ASN 56 -11.900 -5.198 -13.873 407 H TYR 57 H TYR 57 -8.238 -1.878 -12.113 408 HA TYR 57 HA TYR 57 -9.447 0.061 -10.567 409 HB2 TYR 57 1HB TYR 57 -8.474 -0.057 -13.375 410 HB3 TYR 57 2HB TYR 57 -9.493 1.309 -12.932 411 HD1 TYR 57 1HD TYR 57 -7.156 -0.343 -10.607 412 HD2 TYR 57 2HD TYR 57 -7.819 3.000 -13.154 413 HE1 TYR 57 1HE TYR 57 -5.206 0.787 -9.621 414 HE2 TYR 57 2HE TYR 57 -5.870 4.139 -12.176 415 HH TYR 57 HH TYR 57 -3.529 2.703 -10.544 416 H ASP 58 H ASP 58 -10.813 -1.894 -13.130 417 HA ASP 58 HA ASP 58 -13.101 -0.534 -13.788 418 HB2 ASP 58 1HB ASP 58 -12.180 -2.901 -14.509 419 HB3 ASP 58 2HB ASP 58 -13.313 -3.473 -13.287 420 H LEU 59 H LEU 59 -12.450 -2.402 -10.882 421 HA LEU 59 HA LEU 59 -15.161 -2.015 -9.902 422 HB2 LEU 59 1HB LEU 59 -12.902 -3.198 -8.330 423 HB3 LEU 59 2HB LEU 59 -14.632 -3.501 -8.179 424 HG LEU 59 HG LEU 59 -12.854 -4.456 -10.422 425 HD11 LEU 59 1HD1 LEU 59 -12.908 -5.471 -7.944 426 HD12 LEU 59 2HD1 LEU 59 -12.692 -6.457 -9.390 427 HD13 LEU 59 3HD1 LEU 59 -14.283 -6.327 -8.642 428 HD21 LEU 59 1HD2 LEU 59 -15.222 -5.869 -10.480 429 HD22 LEU 59 2HD2 LEU 59 -14.753 -4.576 -11.584 430 HD23 LEU 59 3HD2 LEU 59 -15.739 -4.212 -10.165 431 H LEU 60 H LEU 60 -11.919 -0.804 -9.366 432 HA LEU 60 HA LEU 60 -12.420 0.570 -6.949 433 HB2 LEU 60 1HB LEU 60 -10.421 1.335 -9.065 434 HB3 LEU 60 2HB LEU 60 -10.358 1.714 -7.344 435 HG LEU 60 HG LEU 60 -10.012 -1.011 -8.595 436 HD11 LEU 60 1HD1 LEU 60 -7.724 -0.803 -7.665 437 HD12 LEU 60 2HD1 LEU 60 -8.083 0.873 -7.252 438 HD13 LEU 60 3HD1 LEU 60 -8.075 0.364 -8.940 439 HD21 LEU 60 1HD2 LEU 60 -11.137 -1.229 -6.472 440 HD22 LEU 60 2HD2 LEU 60 -9.973 -0.147 -5.706 441 HD23 LEU 60 3HD2 LEU 60 -9.453 -1.726 -6.297 442 H LYS 61 H LYS 61 -12.319 2.983 -6.748 443 HA LYS 61 HA LYS 61 -14.132 4.189 -8.722 444 HB2 LYS 61 1HB LYS 61 -13.755 4.508 -5.791 445 HB3 LYS 61 2HB LYS 61 -14.227 5.939 -6.698 446 HG2 LYS 61 1HG LYS 61 -16.264 5.081 -6.071 447 HG3 LYS 61 2HG LYS 61 -16.065 4.385 -7.681 448 HD2 LYS 61 1HD LYS 61 -14.914 2.441 -6.298 449 HD3 LYS 61 2HD LYS 61 -15.939 3.081 -5.010 450 HE2 LYS 61 1HE LYS 61 -17.911 2.699 -6.278 451 HE3 LYS 61 2HE LYS 61 -16.985 2.357 -7.738 452 HZ1 LYS 61 1HZ LYS 61 -17.363 0.670 -5.353 453 HZ2 LYS 61 2HZ LYS 61 -16.008 0.450 -6.342 454 HZ3 LYS 61 3HZ LYS 61 -17.563 0.270 -6.985 455 H THR 62 H THR 62 -11.508 5.248 -6.547 456 HA THR 62 HA THR 62 -9.948 6.903 -6.765 457 HB THR 62 HB THR 62 -8.564 6.802 -8.722 458 HG1 THR 62 1HG THR 62 -9.847 6.803 -10.467 459 HG21 THR 62 1HG2 THR 62 -8.165 4.380 -8.918 460 HG22 THR 62 2HG2 THR 62 -9.707 4.071 -8.121 461 HG23 THR 62 3HG2 THR 62 -8.406 4.873 -7.243 462 H GLU 63 H GLU 63 -12.666 7.754 -7.142 463 HA GLU 63 HA GLU 63 -12.136 10.203 -8.639 464 HB2 GLU 63 1HB GLU 63 -14.289 10.099 -9.804 465 HB3 GLU 63 2HB GLU 63 -13.260 8.744 -10.247 466 HG2 GLU 63 1HG GLU 63 -14.582 7.556 -8.299 467 HG3 GLU 63 2HG GLU 63 -15.785 8.783 -8.691 468 H ASN 64 H ASN 64 -12.402 11.728 -7.151 469 HA ASN 64 HA ASN 64 -13.119 12.731 -5.198 470 HB2 ASN 64 1HB ASN 64 -15.879 12.374 -6.320 471 HB3 ASN 64 2HB ASN 64 -15.167 13.789 -5.547 472 HD21 ASN 64 1HD2 ASN 64 -15.269 11.873 -8.471 473 HD22 ASN 64 2HD2 ASN 64 -14.675 13.104 -9.527 474 H LEU 65 H LEU 65 -12.698 10.132 -4.562 475 HA LEU 65 HA LEU 65 -14.783 8.593 -3.619 476 HB2 LEU 65 1HB LEU 65 -12.012 8.981 -2.509 477 HB3 LEU 65 2HB LEU 65 -13.128 7.752 -1.919 478 HG LEU 65 HG LEU 65 -12.481 7.796 -4.825 479 HD11 LEU 65 1HD1 LEU 65 -10.675 6.369 -2.916 480 HD12 LEU 65 2HD1 LEU 65 -10.346 8.035 -3.392 481 HD13 LEU 65 3HD1 LEU 65 -10.417 6.767 -4.615 482 HD21 LEU 65 1HD2 LEU 65 -13.147 5.713 -2.761 483 HD22 LEU 65 2HD2 LEU 65 -12.587 5.307 -4.382 484 HD23 LEU 65 3HD2 LEU 65 -14.092 6.200 -4.168 485 H ASN 66 H ASN 66 -15.481 8.220 -1.371 486 HA ASN 66 HA ASN 66 -15.291 10.494 0.429 487 HB2 ASN 66 1HB ASN 66 -17.578 11.002 0.526 488 HB3 ASN 66 2HB ASN 66 -17.273 10.806 -1.197 489 HD21 ASN 66 1HD2 ASN 66 -17.808 8.725 -2.149 490 HD22 ASN 66 2HD2 ASN 66 -19.142 7.832 -1.510 491 H ASP 67 H ASP 67 -16.633 10.004 2.480 492 HA ASP 67 HA ASP 67 -15.629 7.934 3.872 493 HB2 ASP 67 1HB ASP 67 -17.371 9.820 4.523 494 HB3 ASP 67 2HB ASP 67 -18.524 8.500 4.337 495 H ASP 68 H ASP 68 -18.257 7.752 1.573 496 HA ASP 68 HA ASP 68 -18.981 5.053 2.251 497 HB2 ASP 68 1HB ASP 68 -19.768 6.977 0.085 498 HB3 ASP 68 2HB ASP 68 -20.213 5.277 -0.038 499 H GLU 69 H GLU 69 -17.773 6.406 -0.823 500 HA GLU 69 HA GLU 69 -16.950 3.962 -1.896 501 HB2 GLU 69 1HB GLU 69 -15.730 6.661 -2.493 502 HB3 GLU 69 2HB GLU 69 -15.741 5.249 -3.540 503 HG2 GLU 69 1HG GLU 69 -18.342 6.373 -2.644 504 HG3 GLU 69 2HG GLU 69 -17.429 7.226 -3.889 505 H LYS 70 H LYS 70 -14.927 6.506 -0.424 506 HA LYS 70 HA LYS 70 -12.460 5.486 -0.498 507 HB2 LYS 70 1HB LYS 70 -13.868 6.749 1.847 508 HB3 LYS 70 2HB LYS 70 -12.158 6.345 1.898 509 HG2 LYS 70 1HG LYS 70 -11.863 7.764 -0.150 510 HG3 LYS 70 2HG LYS 70 -13.532 8.297 0.070 511 HD2 LYS 70 1HD LYS 70 -13.017 9.256 2.199 512 HD3 LYS 70 2HD LYS 70 -11.404 8.539 2.192 513 HE2 LYS 70 1HE LYS 70 -10.745 9.937 0.339 514 HE3 LYS 70 2HE LYS 70 -12.383 10.575 0.194 515 HZ1 LYS 70 1HZ LYS 70 -11.641 12.203 1.502 516 HZ2 LYS 70 2HZ LYS 70 -10.273 11.338 1.991 517 HZ3 LYS 70 3HZ LYS 70 -11.753 11.092 2.773 518 H LEU 71 H LEU 71 -14.917 4.446 1.851 519 HA LEU 71 HA LEU 71 -13.413 2.593 3.259 520 HB2 LEU 71 1HB LEU 71 -15.556 3.169 4.068 521 HB3 LEU 71 2HB LEU 71 -16.335 2.675 2.566 522 HG LEU 71 HG LEU 71 -15.886 0.336 3.089 523 HD11 LEU 71 1HD1 LEU 71 -14.849 1.243 5.759 524 HD12 LEU 71 2HD1 LEU 71 -13.789 0.856 4.404 525 HD13 LEU 71 3HD1 LEU 71 -14.847 -0.384 5.078 526 HD21 LEU 71 1HD2 LEU 71 -17.423 2.086 4.916 527 HD22 LEU 71 2HD2 LEU 71 -17.182 0.413 5.417 528 HD23 LEU 71 3HD2 LEU 71 -17.968 0.769 3.877 529 H ASN 72 H ASN 72 -15.597 1.902 0.520 530 HA ASN 72 HA ASN 72 -15.177 -0.747 0.151 531 HB2 ASN 72 1HB ASN 72 -15.361 1.398 -1.971 532 HB3 ASN 72 2HB ASN 72 -15.470 -0.327 -2.312 533 HD21 ASN 72 1HD2 ASN 72 -16.981 2.352 -0.631 534 HD22 ASN 72 2HD2 ASN 72 -18.560 1.656 -0.550 535 H ASN 73 H ASN 73 -13.095 1.830 -1.152 536 HA ASN 73 HA ASN 73 -11.226 0.191 -2.418 537 HB2 ASN 73 1HB ASN 73 -11.234 2.985 -1.391 538 HB3 ASN 73 2HB ASN 73 -9.670 2.265 -1.763 539 HD21 ASN 73 1HD2 ASN 73 -10.295 4.380 -3.188 540 HD22 ASN 73 2HD2 ASN 73 -10.770 3.962 -4.796 541 H ALA 74 H ALA 74 -11.301 1.429 0.902 542 HA ALA 74 HA ALA 74 -8.816 0.457 1.740 543 HB1 ALA 74 1HB ALA 74 -10.416 2.061 2.934 544 HB2 ALA 74 2HB ALA 74 -11.195 0.607 3.559 545 HB3 ALA 74 3HB ALA 74 -9.500 0.924 3.923 546 H LYS 75 H LYS 75 -12.019 -1.060 1.787 547 HA LYS 75 HA LYS 75 -11.225 -3.425 3.113 548 HB2 LYS 75 1HB LYS 75 -13.517 -3.055 1.176 549 HB3 LYS 75 2HB LYS 75 -13.348 -4.350 2.355 550 HG2 LYS 75 1HG LYS 75 -13.351 -2.544 4.132 551 HG3 LYS 75 2HG LYS 75 -13.873 -1.439 2.858 552 HD2 LYS 75 1HD LYS 75 -15.316 -4.014 3.426 553 HD3 LYS 75 2HD LYS 75 -15.690 -2.522 4.291 554 HE2 LYS 75 1HE LYS 75 -17.202 -2.407 2.569 555 HE3 LYS 75 2HE LYS 75 -15.845 -1.526 1.870 556 HZ1 LYS 75 1HZ LYS 75 -16.980 -3.330 0.476 557 HZ2 LYS 75 2HZ LYS 75 -16.135 -4.430 1.443 558 HZ3 LYS 75 3HZ LYS 75 -15.289 -3.299 0.512 559 H TYR 76 H TYR 76 -11.552 -2.614 -0.323 560 HA TYR 76 HA TYR 76 -10.955 -5.149 -1.357 561 HB2 TYR 76 1HB TYR 76 -11.897 -3.202 -2.639 562 HB3 TYR 76 2HB TYR 76 -10.283 -2.497 -2.645 563 HD1 TYR 76 1HD TYR 76 -12.084 -5.620 -3.614 564 HD2 TYR 76 2HD TYR 76 -8.845 -2.975 -4.401 565 HE1 TYR 76 1HE TYR 76 -11.541 -6.899 -5.643 566 HE2 TYR 76 2HE TYR 76 -8.294 -4.247 -6.434 567 HH TYR 76 HH TYR 76 -10.280 -6.254 -7.943 568 H ALA 77 H ALA 77 -8.833 -2.376 -0.694 569 HA ALA 77 HA ALA 77 -6.436 -3.348 -1.627 570 HB1 ALA 77 1HB ALA 77 -6.382 -1.934 0.982 571 HB2 ALA 77 2HB ALA 77 -5.441 -1.650 -0.483 572 HB3 ALA 77 3HB ALA 77 -7.115 -1.103 -0.390 573 H ILE 78 H ILE 78 -7.417 -3.531 1.801 574 HA ILE 78 HA ILE 78 -5.445 -5.270 2.653 575 HB ILE 78 HB ILE 78 -8.283 -5.070 3.664 576 HG12 ILE 78 1HG1 ILE 78 -5.750 -3.780 4.697 577 HG13 ILE 78 2HG1 ILE 78 -6.944 -2.961 3.695 578 HG21 ILE 78 1HG2 ILE 78 -7.824 -6.555 5.265 579 HG22 ILE 78 2HG2 ILE 78 -6.455 -7.032 4.264 580 HG23 ILE 78 3HG2 ILE 78 -6.230 -5.863 5.566 581 HD11 ILE 78 1HD1 ILE 78 -8.273 -2.569 5.431 582 HD12 ILE 78 2HD1 ILE 78 -8.105 -4.214 6.045 583 HD13 ILE 78 3HD1 ILE 78 -6.887 -3.000 6.431 584 H SER 79 H SER 79 -8.588 -6.012 1.220 585 HA SER 79 HA SER 79 -8.615 -8.769 1.617 586 HB2 SER 79 1HB SER 79 -10.536 -7.429 0.766 587 HB3 SER 79 2HB SER 79 -9.709 -7.286 -0.785 588 HG SER 79 HG SER 79 -10.234 -9.278 -1.250 589 H MET 80 H MET 80 -7.299 -6.893 -1.097 590 HA MET 80 HA MET 80 -6.415 -9.100 -2.607 591 HB2 MET 80 1HB MET 80 -5.841 -6.177 -2.579 592 HB3 MET 80 2HB MET 80 -4.728 -7.222 -3.451 593 HG2 MET 80 1HG MET 80 -7.689 -6.973 -3.922 594 HG3 MET 80 2HG MET 80 -6.403 -6.336 -4.943 595 HE1 MET 80 1HE MET 80 -8.420 -9.017 -6.725 596 HE2 MET 80 2HE MET 80 -8.789 -9.704 -5.144 597 HE3 MET 80 3HE MET 80 -8.890 -7.960 -5.393 598 H ALA 81 H ALA 81 -4.702 -7.001 -0.304 599 HA ALA 81 HA ALA 81 -2.153 -7.841 -0.422 600 HB1 ALA 81 1HB ALA 81 -3.380 -6.319 1.312 601 HB2 ALA 81 2HB ALA 81 -3.391 -7.786 2.292 602 HB3 ALA 81 3HB ALA 81 -1.860 -7.107 1.738 603 H ARG 82 H ARG 82 -4.761 -9.614 1.216 604 HA ARG 82 HA ARG 82 -3.060 -11.793 1.965 605 HB2 ARG 82 1HB ARG 82 -5.095 -11.172 3.236 606 HB3 ARG 82 2HB ARG 82 -6.079 -11.667 1.866 607 HG2 ARG 82 1HG ARG 82 -5.725 -13.895 2.234 608 HG3 ARG 82 2HG ARG 82 -4.169 -13.629 3.022 609 HD2 ARG 82 1HD ARG 82 -5.613 -14.287 4.749 610 HD3 ARG 82 2HD ARG 82 -5.494 -12.534 4.902 611 HE ARG 82 HE ARG 82 -7.685 -12.930 3.327 612 HH11 ARG 82 1HH1 ARG 82 -6.689 -14.038 6.473 613 HH12 ARG 82 2HH1 ARG 82 -8.305 -14.165 7.085 614 HH21 ARG 82 1HH2 ARG 82 -9.817 -13.092 4.120 615 HH22 ARG 82 2HH2 ARG 82 -10.084 -13.628 5.745 616 H LYS 83 H LYS 83 -5.424 -11.210 -0.599 617 HA LYS 83 HA LYS 83 -5.664 -13.699 -1.720 618 HB2 LYS 83 1HB LYS 83 -6.583 -11.310 -2.423 619 HB3 LYS 83 2HB LYS 83 -5.255 -11.396 -3.572 620 HG2 LYS 83 1HG LYS 83 -6.906 -12.310 -4.834 621 HG3 LYS 83 2HG LYS 83 -6.294 -13.773 -4.059 622 HD2 LYS 83 1HD LYS 83 -8.471 -12.221 -2.733 623 HD3 LYS 83 2HD LYS 83 -8.865 -13.261 -4.103 624 HE2 LYS 83 1HE LYS 83 -7.420 -15.002 -2.742 625 HE3 LYS 83 2HE LYS 83 -7.883 -13.977 -1.386 626 HZ1 LYS 83 1HZ LYS 83 -9.587 -15.488 -1.435 627 HZ2 LYS 83 2HZ LYS 83 -9.579 -15.634 -3.120 628 HZ3 LYS 83 3HZ LYS 83 -10.242 -14.258 -2.394 629 H ILE 84 H ILE 84 -3.127 -11.304 -2.430 630 HA ILE 84 HA ILE 84 -1.691 -13.116 -4.134 631 HB ILE 84 HB ILE 84 0.083 -11.366 -4.105 632 HG12 ILE 84 1HG1 ILE 84 -1.869 -9.692 -2.531 633 HG13 ILE 84 2HG1 ILE 84 -0.576 -10.596 -1.750 634 HG21 ILE 84 1HG2 ILE 84 -1.202 -10.920 -5.899 635 HG22 ILE 84 2HG2 ILE 84 -2.700 -10.980 -4.972 636 HG23 ILE 84 3HG2 ILE 84 -1.705 -9.524 -4.947 637 HD11 ILE 84 1HD1 ILE 84 -0.232 -8.103 -2.360 638 HD12 ILE 84 2HD1 ILE 84 1.071 -9.259 -2.639 639 HD13 ILE 84 3HD1 ILE 84 0.061 -8.726 -3.983 640 H GLY 85 H GLY 85 -1.682 -12.309 -0.761 641 HA2 GLY 85 1HA GLY 85 -0.726 -14.061 0.693 642 HA3 GLY 85 2HA GLY 85 0.653 -14.083 -0.394 643 H ALA 86 H ALA 86 -0.866 -12.503 2.274 644 HA ALA 86 HA ALA 86 1.551 -11.356 3.171 645 HB1 ALA 86 1HB ALA 86 0.203 -9.798 1.245 646 HB2 ALA 86 2HB ALA 86 -0.028 -9.005 2.803 647 HB3 ALA 86 3HB ALA 86 1.601 -9.352 2.223 648 H ARG 87 H ARG 87 1.408 -11.140 5.315 649 HA ARG 87 HA ARG 87 -1.167 -11.479 6.587 650 HB2 ARG 87 1HB ARG 87 1.681 -11.541 7.479 651 HB3 ARG 87 2HB ARG 87 0.432 -11.254 8.683 652 HG2 ARG 87 1HG ARG 87 0.557 -13.513 8.817 653 HG3 ARG 87 2HG ARG 87 -0.649 -13.377 7.536 654 HD2 ARG 87 1HD ARG 87 1.027 -15.009 6.919 655 HD3 ARG 87 2HD ARG 87 1.138 -13.604 5.859 656 HE ARG 87 HE ARG 87 2.930 -13.113 7.868 657 HH11 ARG 87 1HH1 ARG 87 2.438 -15.659 5.545 658 HH12 ARG 87 2HH1 ARG 87 4.119 -16.067 5.442 659 HH21 ARG 87 1HH2 ARG 87 5.145 -13.642 7.742 660 HH22 ARG 87 2HH2 ARG 87 5.658 -14.920 6.693 661 H VAL 88 H VAL 88 -2.418 -9.735 6.780 662 HA VAL 88 HA VAL 88 -1.166 -7.174 7.513 663 HB VAL 88 HB VAL 88 -3.324 -6.150 6.750 664 HG11 VAL 88 1HG1 VAL 88 -1.542 -5.954 5.249 665 HG12 VAL 88 2HG1 VAL 88 -1.562 -7.676 4.860 666 HG13 VAL 88 3HG1 VAL 88 -2.853 -6.624 4.279 667 HG21 VAL 88 1HG2 VAL 88 -4.826 -7.463 5.367 668 HG22 VAL 88 2HG2 VAL 88 -3.843 -8.904 5.630 669 HG23 VAL 88 3HG2 VAL 88 -4.711 -8.171 6.979 670 H TYR 89 H TYR 89 -1.981 -5.955 9.213 671 HA TYR 89 HA TYR 89 -4.015 -7.236 10.905 672 HB2 TYR 89 1HB TYR 89 -1.625 -7.664 11.695 673 HB3 TYR 89 2HB TYR 89 -1.541 -5.942 12.049 674 HD1 TYR 89 2HD TYR 89 -4.106 -8.611 12.611 675 HD2 TYR 89 1HD TYR 89 -1.719 -5.521 14.303 676 HE1 TYR 89 2HE TYR 89 -5.147 -9.015 14.804 677 HE2 TYR 89 1HE TYR 89 -2.752 -5.919 16.500 678 HH TYR 89 HH TYR 89 -5.025 -6.914 17.312 679 H ALA 90 H ALA 90 -4.562 -5.181 9.161 680 HA ALA 90 HA ALA 90 -4.954 -2.905 10.992 681 HB1 ALA 90 1HB ALA 90 -4.220 -2.910 8.085 682 HB2 ALA 90 2HB ALA 90 -5.014 -1.521 8.829 683 HB3 ALA 90 3HB ALA 90 -3.446 -2.064 9.425 684 H LEU 91 H LEU 91 -6.728 -1.396 9.765 685 HA LEU 91 HA LEU 91 -8.979 -3.157 9.056 686 HB2 LEU 91 1HB LEU 91 -9.095 -2.336 11.409 687 HB3 LEU 91 2HB LEU 91 -9.169 -0.692 10.778 688 HG LEU 91 HG LEU 91 -11.267 -1.542 9.509 689 HD11 LEU 91 1HD1 LEU 91 -12.034 -3.579 9.940 690 HD12 LEU 91 2HD1 LEU 91 -11.953 -3.300 11.679 691 HD13 LEU 91 3HD1 LEU 91 -10.537 -3.901 10.815 692 HD21 LEU 91 1HD2 LEU 91 -10.950 -0.751 12.352 693 HD22 LEU 91 2HD2 LEU 91 -12.544 -1.285 11.819 694 HD23 LEU 91 3HD2 LEU 91 -11.761 0.083 11.026 695 HA PRO 92 HA PRO 92 -9.342 -0.509 5.543 696 HB2 PRO 92 1HB PRO 92 -11.840 -1.245 4.775 697 HB3 PRO 92 2HB PRO 92 -10.420 -2.268 4.531 698 HG2 PRO 92 1HG PRO 92 -12.503 -2.399 6.677 699 HG3 PRO 92 2HG PRO 92 -11.760 -3.720 5.757 700 HD2 PRO 92 1HD PRO 92 -10.989 -3.084 8.274 701 HD3 PRO 92 2HD PRO 92 -9.862 -3.732 7.064 702 H GLU 93 H GLU 93 -12.040 -0.667 7.852 703 HA GLU 93 HA GLU 93 -13.389 1.640 7.070 704 HB2 GLU 93 1HB GLU 93 -13.195 0.102 9.625 705 HB3 GLU 93 2HB GLU 93 -13.991 1.670 9.640 706 HG2 GLU 93 1HG GLU 93 -14.779 -0.356 7.602 707 HG3 GLU 93 2HG GLU 93 -15.365 -0.506 9.257 708 H ASP 94 H ASP 94 -10.726 1.234 9.370 709 HA ASP 94 HA ASP 94 -10.631 4.062 9.957 710 HB2 ASP 94 1HB ASP 94 -8.878 1.737 10.763 711 HB3 ASP 94 2HB ASP 94 -8.559 3.399 11.254 712 H LEU 95 H LEU 95 -9.028 1.806 7.844 713 HA LEU 95 HA LEU 95 -6.702 3.209 7.237 714 HB2 LEU 95 1HB LEU 95 -6.818 1.039 6.412 715 HB3 LEU 95 2HB LEU 95 -8.411 1.291 5.703 716 HG LEU 95 HG LEU 95 -7.456 2.583 3.904 717 HD11 LEU 95 1HD1 LEU 95 -5.319 3.358 3.798 718 HD12 LEU 95 2HD1 LEU 95 -4.671 2.035 4.769 719 HD13 LEU 95 3HD1 LEU 95 -5.534 3.361 5.548 720 HD21 LEU 95 1HD2 LEU 95 -6.130 0.856 2.812 721 HD22 LEU 95 2HD2 LEU 95 -7.505 0.148 3.661 722 HD23 LEU 95 3HD2 LEU 95 -5.888 0.047 4.360 723 H VAL 96 H VAL 96 -9.976 3.881 6.413 724 HA VAL 96 HA VAL 96 -9.575 5.429 4.087 725 HB VAL 96 HB VAL 96 -11.772 5.336 6.132 726 HG11 VAL 96 1HG1 VAL 96 -11.317 7.364 4.002 727 HG12 VAL 96 2HG1 VAL 96 -12.965 6.805 4.301 728 HG13 VAL 96 3HG1 VAL 96 -12.034 7.548 5.602 729 HG21 VAL 96 1HG2 VAL 96 -12.549 3.750 4.788 730 HG22 VAL 96 2HG2 VAL 96 -12.633 4.914 3.465 731 HG23 VAL 96 3HG2 VAL 96 -11.166 3.966 3.714 732 H GLU 97 H GLU 97 -9.119 6.091 7.456 733 HA GLU 97 HA GLU 97 -8.795 8.957 6.911 734 HB2 GLU 97 1HB GLU 97 -9.092 7.429 9.499 735 HB3 GLU 97 2HB GLU 97 -8.715 9.145 9.424 736 HG2 GLU 97 1HG GLU 97 -11.096 8.189 7.941 737 HG3 GLU 97 2HG GLU 97 -11.186 8.253 9.699 738 H VAL 98 H VAL 98 -6.845 7.111 5.973 739 HA VAL 98 HA VAL 98 -4.612 6.593 6.067 740 HB VAL 98 HB VAL 98 -4.436 9.421 7.112 741 HG11 VAL 98 1HG1 VAL 98 -2.453 7.497 6.590 742 HG12 VAL 98 2HG1 VAL 98 -2.379 8.665 5.269 743 HG13 VAL 98 3HG1 VAL 98 -2.232 9.211 6.939 744 HG21 VAL 98 1HG2 VAL 98 -3.981 9.627 4.458 745 HG22 VAL 98 2HG2 VAL 98 -5.181 8.334 4.478 746 HG23 VAL 98 3HG2 VAL 98 -5.554 9.895 5.211 747 H ASN 99 H ASN 99 -6.058 5.861 8.455 748 HA ASN 99 HA ASN 99 -5.121 6.491 10.889 749 HB2 ASN 99 1HB ASN 99 -5.212 3.981 11.420 750 HB3 ASN 99 2HB ASN 99 -6.676 4.725 10.786 751 HD21 ASN 99 1HD2 ASN 99 -7.146 2.431 10.321 752 HD22 ASN 99 2HD2 ASN 99 -6.602 1.782 8.815 753 HA PRO 100 HA PRO 100 -0.680 6.025 10.116 754 HB2 PRO 100 1HB PRO 100 0.058 7.574 12.220 755 HB3 PRO 100 2HB PRO 100 -0.442 8.244 10.663 756 HG2 PRO 100 1HG PRO 100 -2.024 7.928 13.184 757 HG3 PRO 100 2HG PRO 100 -1.963 9.304 12.067 758 HD2 PRO 100 1HD PRO 100 -3.982 7.500 12.047 759 HD3 PRO 100 2HD PRO 100 -3.419 8.319 10.576 760 H LYS 101 H LYS 101 -2.735 4.817 12.424 761 HA LYS 101 HA LYS 101 -0.578 3.650 14.039 762 HB2 LYS 101 1HB LYS 101 -3.559 3.723 14.540 763 HB3 LYS 101 2HB LYS 101 -2.365 3.016 15.620 764 HG2 LYS 101 1HG LYS 101 -1.610 5.039 16.343 765 HG3 LYS 101 2HG LYS 101 -2.014 5.856 14.831 766 HD2 LYS 101 1HD LYS 101 -4.288 6.014 15.398 767 HD3 LYS 101 2HD LYS 101 -4.139 4.811 16.682 768 HE2 LYS 101 1HE LYS 101 -2.673 7.432 16.775 769 HE3 LYS 101 2HE LYS 101 -4.324 7.267 17.371 770 HZ1 LYS 101 1HZ LYS 101 -2.174 5.470 18.303 771 HZ2 LYS 101 2HZ LYS 101 -3.655 5.815 19.041 772 HZ3 LYS 101 3HZ LYS 101 -2.427 6.979 19.025 773 H MET 102 H MET 102 -2.849 2.928 11.590 774 HA MET 102 HA MET 102 -2.602 0.042 12.060 775 HB2 MET 102 1HB MET 102 -4.453 1.615 10.262 776 HB3 MET 102 2HB MET 102 -4.392 -0.142 10.320 777 HG2 MET 102 1HG MET 102 -4.941 1.526 12.752 778 HG3 MET 102 2HG MET 102 -6.216 1.001 11.656 779 HE1 MET 102 1HE MET 102 -3.786 0.472 14.186 780 HE2 MET 102 2HE MET 102 -4.756 -0.596 15.200 781 HE3 MET 102 3HE MET 102 -3.413 -1.251 14.262 782 H VAL 103 H VAL 103 -2.184 2.498 9.533 783 HA VAL 103 HA VAL 103 -1.382 1.048 7.389 784 HB VAL 103 HB VAL 103 -0.229 3.626 8.436 785 HG11 VAL 103 1HG1 VAL 103 1.546 2.947 7.133 786 HG12 VAL 103 2HG1 VAL 103 0.520 2.041 6.019 787 HG13 VAL 103 3HG1 VAL 103 0.554 3.804 5.955 788 HG21 VAL 103 1HG2 VAL 103 -1.990 4.567 7.464 789 HG22 VAL 103 2HG2 VAL 103 -1.606 3.786 5.930 790 HG23 VAL 103 3HG2 VAL 103 -2.618 2.957 7.112 791 H MET 104 H MET 104 0.276 1.327 10.405 792 HA MET 104 HA MET 104 2.896 0.823 9.824 793 HB2 MET 104 1HB MET 104 3.089 -0.230 11.988 794 HB3 MET 104 2HB MET 104 1.965 1.116 12.107 795 HG2 MET 104 1HG MET 104 0.096 -0.511 11.897 796 HG3 MET 104 2HG MET 104 1.286 -1.809 11.970 797 HE1 MET 104 1HE MET 104 -0.990 -1.898 13.524 798 HE2 MET 104 2HE MET 104 -0.027 -2.787 14.704 799 HE3 MET 104 3HE MET 104 -0.975 -1.389 15.214 800 H THR 105 H THR 105 0.268 -1.550 9.986 801 HA THR 105 HA THR 105 2.033 -3.710 9.203 802 HB THR 105 HB THR 105 -0.069 -5.082 9.210 803 HG1 THR 105 1HG THR 105 -1.912 -4.060 9.281 804 HG21 THR 105 1HG2 THR 105 1.425 -4.110 11.337 805 HG22 THR 105 2HG2 THR 105 0.314 -5.479 11.378 806 HG23 THR 105 3HG2 THR 105 -0.247 -3.873 11.845 807 H VAL 106 H VAL 106 -0.742 -1.977 7.813 808 HA VAL 106 HA VAL 106 -1.211 -3.236 5.486 809 HB VAL 106 HB VAL 106 -0.866 -0.249 5.787 810 HG11 VAL 106 1HG1 VAL 106 -1.976 0.067 3.768 811 HG12 VAL 106 2HG1 VAL 106 -0.877 -1.268 3.417 812 HG13 VAL 106 3HG1 VAL 106 -2.584 -1.588 3.730 813 HG21 VAL 106 1HG2 VAL 106 -2.840 -0.207 6.820 814 HG22 VAL 106 2HG2 VAL 106 -3.571 -1.273 5.620 815 HG23 VAL 106 3HG2 VAL 106 -2.693 -1.956 6.988 816 H PHE 107 H PHE 107 1.535 -1.072 6.075 817 HA PHE 107 HA PHE 107 2.620 -1.623 3.435 818 HB2 PHE 107 1HB PHE 107 3.324 0.243 5.668 819 HB3 PHE 107 2HB PHE 107 4.537 -0.139 4.450 820 HD1 PHE 107 2HD PHE 107 2.986 -0.280 1.999 821 HD2 PHE 107 1HD PHE 107 2.654 2.413 5.279 822 HE1 PHE 107 2HE PHE 107 2.015 1.417 0.504 823 HE2 PHE 107 1HE PHE 107 1.682 4.114 3.789 824 HZ PHE 107 HZ PHE 107 1.363 3.616 1.398 825 H ALA 108 H ALA 108 3.768 -1.915 6.799 826 HA ALA 108 HA ALA 108 6.123 -3.168 6.554 827 HB1 ALA 108 1HB ALA 108 5.278 -4.657 8.548 828 HB2 ALA 108 2HB ALA 108 5.502 -2.919 8.744 829 HB3 ALA 108 3HB ALA 108 3.888 -3.575 8.477 830 H CYS 109 H CYS 109 3.020 -4.927 6.486 831 HA CYS 109 HA CYS 109 3.974 -7.468 6.008 832 HB2 CYS 109 1HB CYS 109 1.790 -7.988 5.080 833 HB3 CYS 109 2HB CYS 109 1.603 -6.914 6.461 834 HG CYS 109 HG CYS 109 0.730 -4.776 5.155 835 H LEU 110 H LEU 110 3.441 -4.846 3.714 836 HA LEU 110 HA LEU 110 4.072 -6.463 1.420 837 HB2 LEU 110 1HB LEU 110 3.759 -3.488 1.773 838 HB3 LEU 110 2HB LEU 110 4.058 -4.272 0.224 839 HG LEU 110 HG LEU 110 1.673 -5.037 1.864 840 HD11 LEU 110 1HD1 LEU 110 1.629 -2.593 1.703 841 HD12 LEU 110 2HD1 LEU 110 0.358 -3.336 0.734 842 HD13 LEU 110 3HD1 LEU 110 1.809 -2.708 -0.047 843 HD21 LEU 110 1HD2 LEU 110 2.623 -5.336 -0.928 844 HD22 LEU 110 2HD2 LEU 110 0.889 -5.129 -0.678 845 HD23 LEU 110 3HD2 LEU 110 1.739 -6.465 0.098 846 H MET 111 H MET 111 5.831 -4.596 3.715 847 HA MET 111 HA MET 111 8.161 -4.272 2.031 848 HB2 MET 111 1HB MET 111 7.357 -3.435 4.762 849 HB3 MET 111 2HB MET 111 9.080 -3.637 4.473 850 HG2 MET 111 1HG MET 111 7.521 -2.057 2.508 851 HG3 MET 111 2HG MET 111 7.845 -1.337 4.083 852 HE1 MET 111 1HE MET 111 9.975 -3.410 1.250 853 HE2 MET 111 2HE MET 111 8.932 -2.111 0.672 854 HE3 MET 111 3HE MET 111 10.685 -1.927 0.612 855 H GLY 112 H GLY 112 6.858 -6.714 3.964 856 HA2 GLY 112 1HA GLY 112 8.911 -7.933 5.275 857 HA3 GLY 112 2HA GLY 112 7.666 -8.827 4.416 858 H LYS 113 H LYS 113 8.581 -7.592 1.837 859 HA LYS 113 HA LYS 113 10.349 -9.665 1.063 860 HB2 LYS 113 1HB LYS 113 8.668 -8.369 -0.383 861 HB3 LYS 113 2HB LYS 113 9.904 -7.122 -0.489 862 HG2 LYS 113 1HG LYS 113 10.183 -8.397 -2.421 863 HG3 LYS 113 2HG LYS 113 11.453 -8.962 -1.334 864 HD2 LYS 113 1HD LYS 113 9.808 -10.786 -0.637 865 HD3 LYS 113 2HD LYS 113 8.863 -10.312 -2.050 866 HE2 LYS 113 1HE LYS 113 10.874 -10.708 -3.455 867 HE3 LYS 113 2HE LYS 113 11.713 -11.304 -2.023 868 HZ1 LYS 113 1HZ LYS 113 10.554 -12.964 -3.605 869 HZ2 LYS 113 2HZ LYS 113 9.138 -12.493 -2.810 870 HZ3 LYS 113 3HZ LYS 113 10.410 -13.182 -1.934 871 H GLY 114 H GLY 114 10.817 -6.209 1.705 872 HA2 GLY 114 1HA GLY 114 13.483 -5.980 0.930 873 HA3 GLY 114 2HA GLY 114 12.713 -5.003 2.170 874 H MET 115 H MET 115 12.374 -6.313 4.304 875 HA MET 115 HA MET 115 14.488 -8.211 4.857 876 HB2 MET 115 1HB MET 115 14.439 -5.480 6.148 877 HB3 MET 115 2HB MET 115 15.393 -6.833 6.741 878 HG2 MET 115 1HG MET 115 16.693 -6.872 4.727 879 HG3 MET 115 2HG MET 115 15.661 -5.650 3.989 880 HE1 MET 115 1HE MET 115 18.636 -6.499 5.123 881 HE2 MET 115 2HE MET 115 19.428 -4.932 4.953 882 HE3 MET 115 3HE MET 115 19.126 -5.599 6.558 883 H LYS 116 H LYS 116 13.463 -9.741 5.950 884 HA LYS 116 HA LYS 116 12.168 -9.227 8.423 885 HB2 LYS 116 1HB LYS 116 10.322 -8.494 7.052 886 HB3 LYS 116 2HB LYS 116 10.424 -9.945 6.062 887 HG2 LYS 116 1HG LYS 116 8.620 -10.370 7.448 888 HG3 LYS 116 2HG LYS 116 9.948 -11.212 8.250 889 HD2 LYS 116 1HD LYS 116 8.856 -10.081 9.982 890 HD3 LYS 116 2HD LYS 116 10.242 -9.055 9.606 891 HE2 LYS 116 1HE LYS 116 8.932 -7.453 8.561 892 HE3 LYS 116 2HE LYS 116 7.611 -8.582 8.261 893 HZ1 LYS 116 1HZ LYS 116 7.166 -6.927 10.037 894 HZ2 LYS 116 2HZ LYS 116 8.390 -7.637 10.963 895 HZ3 LYS 116 3HZ LYS 116 7.016 -8.532 10.550 896 H ARG 117 H ARG 117 11.727 -11.123 9.590 897 HA ARG 117 HA ARG 117 11.928 -13.712 8.385 898 HB2 ARG 117 1HB ARG 117 13.962 -14.384 9.709 899 HB3 ARG 117 2HB ARG 117 14.274 -13.292 8.366 900 HG2 ARG 117 1HG ARG 117 14.657 -11.472 9.782 901 HG3 ARG 117 2HG ARG 117 13.899 -12.274 11.160 902 HD2 ARG 117 1HD ARG 117 16.220 -12.372 11.561 903 HD3 ARG 117 2HD ARG 117 15.761 -13.984 11.012 904 HE ARG 117 HE ARG 117 16.531 -12.723 8.734 905 HH11 ARG 117 1HH1 ARG 117 18.019 -13.234 11.840 906 HH12 ARG 117 2HH1 ARG 117 19.632 -13.248 11.211 907 HH21 ARG 117 1HH2 ARG 117 18.651 -12.739 7.893 908 HH22 ARG 117 2HH2 ARG 117 19.992 -12.965 8.966 909 H VAL 118 H VAL 118 11.186 -15.326 9.726 910 HA VAL 118 HA VAL 118 10.714 -14.703 12.543 911 HB VAL 118 HB VAL 118 8.523 -15.563 10.648 912 HG11 VAL 118 1HG1 VAL 118 7.301 -15.029 13.014 913 HG12 VAL 118 2HG1 VAL 118 7.752 -16.643 12.462 914 HG13 VAL 118 3HG1 VAL 118 8.809 -15.759 13.563 915 HG21 VAL 118 1HG2 VAL 118 9.233 -12.996 11.971 916 HG22 VAL 118 2HG2 VAL 118 8.569 -13.293 10.364 917 HG23 VAL 118 3HG2 VAL 118 7.526 -13.396 11.782 918 H SER 119 H SER 119 10.572 -16.493 13.880 919 HA SER 119 HA SER 119 11.710 -18.917 12.798 920 HB2 SER 119 1HB SER 119 11.076 -17.922 15.559 921 HB3 SER 119 2HB SER 119 11.435 -19.629 15.297 922 HG SER 119 HG SER 119 13.357 -18.627 15.735 923 H GLY 120 H GLY 120 10.116 -19.828 11.507 924 HA2 GLY 120 1HA GLY 120 8.405 -21.681 12.634 925 HA3 GLY 120 2HA GLY 120 7.437 -20.234 12.394 926 HA PRO 121 HA PRO 121 7.681 -22.891 8.486 927 HB2 PRO 121 1HB PRO 121 5.083 -23.676 8.442 928 HB3 PRO 121 2HB PRO 121 6.352 -24.598 9.258 929 HG2 PRO 121 1HG PRO 121 4.353 -22.693 10.414 930 HG3 PRO 121 2HG PRO 121 4.886 -24.267 11.033 931 HD2 PRO 121 1HD PRO 121 5.825 -21.924 12.010 932 HD3 PRO 121 2HD PRO 121 6.814 -23.396 11.945 933 H SER 122 H SER 122 7.594 -21.608 6.762 934 HA SER 122 HA SER 122 5.805 -19.330 6.703 935 HB2 SER 122 1HB SER 122 8.096 -20.268 5.006 936 HB3 SER 122 2HB SER 122 6.997 -19.030 4.397 937 HG SER 122 HG SER 122 8.926 -18.871 6.348 938 H SER 123 H SER 123 4.858 -18.871 4.391 939 HA SER 123 HA SER 123 3.226 -21.217 3.717 940 HB2 SER 123 1HB SER 123 1.568 -19.688 2.891 941 HB3 SER 123 2HB SER 123 2.101 -19.087 4.461 942 HG SER 123 HG SER 123 2.175 -17.335 3.181 943 H GLY 124 H GLY 124 2.406 -21.088 1.327 944 HA2 GLY 124 1HA GLY 124 2.893 -21.207 -0.918 945 HA3 GLY 124 2HA GLY 124 4.155 -20.018 -0.638 Start of MODEL 6 1 H1 GLY 1 H GLY 1 14.516 12.150 -9.537 2 HA2 GLY 1 1HA GLY 1 13.508 10.327 -7.637 3 HA3 GLY 1 2HA GLY 1 13.674 9.504 -9.180 4 H SER 2 H SER 2 15.130 8.432 -7.299 5 HA SER 2 HA SER 2 17.838 8.998 -8.123 6 HB2 SER 2 1HB SER 2 18.748 9.463 -5.957 7 HB3 SER 2 2HB SER 2 17.395 10.568 -6.193 8 HG SER 2 HG SER 2 17.726 9.015 -4.169 9 H SER 3 H SER 3 19.386 7.408 -7.167 10 HA SER 3 HA SER 3 18.025 4.869 -6.541 11 HB2 SER 3 1HB SER 3 18.992 4.983 -8.863 12 HB3 SER 3 2HB SER 3 20.586 5.144 -8.126 13 HG SER 3 HG SER 3 19.048 2.925 -8.467 14 H GLY 4 H GLY 4 18.513 4.137 -4.588 15 HA2 GLY 4 1HA GLY 4 20.452 3.258 -3.260 16 HA3 GLY 4 2HA GLY 4 21.137 4.867 -3.440 17 H SER 5 H SER 5 19.482 2.877 -1.390 18 HA SER 5 HA SER 5 18.705 5.145 0.284 19 HB2 SER 5 1HB SER 5 16.727 4.121 -1.088 20 HB3 SER 5 2HB SER 5 16.828 2.812 0.089 21 HG SER 5 HG SER 5 16.805 5.417 1.072 22 H SER 6 H SER 6 18.457 4.594 2.539 23 HA SER 6 HA SER 6 19.569 1.999 3.325 24 HB2 SER 6 1HB SER 6 20.597 4.669 4.314 25 HB3 SER 6 2HB SER 6 21.085 3.096 4.943 26 HG SER 6 HG SER 6 22.600 3.586 3.453 27 H GLY 7 H GLY 7 18.428 1.093 4.908 28 HA2 GLY 7 1HA GLY 7 17.596 1.750 7.274 29 HA3 GLY 7 2HA GLY 7 16.506 2.779 6.359 30 H ASN 8 H ASN 8 15.292 1.092 7.974 31 HA ASN 8 HA ASN 8 14.372 -1.091 6.221 32 HB2 ASN 8 1HB ASN 8 15.628 -1.626 8.469 33 HB3 ASN 8 2HB ASN 8 14.070 -1.246 9.196 34 HD21 ASN 8 1HD2 ASN 8 15.702 -3.324 6.884 35 HD22 ASN 8 2HD2 ASN 8 14.565 -4.622 6.969 36 H ASP 9 H ASP 9 13.438 1.190 8.767 37 HA ASP 9 HA ASP 9 10.617 0.791 8.140 38 HB2 ASP 9 1HB ASP 9 11.930 2.519 10.249 39 HB3 ASP 9 2HB ASP 9 10.197 2.248 10.081 40 H ASP 10 H ASP 10 13.192 2.954 7.463 41 HA ASP 10 HA ASP 10 11.507 5.197 6.785 42 HB2 ASP 10 1HB ASP 10 13.740 5.635 7.631 43 HB3 ASP 10 2HB ASP 10 14.454 4.691 6.326 44 H ILE 11 H ILE 11 13.324 2.703 5.056 45 HA ILE 11 HA ILE 11 12.911 3.642 2.451 46 HB ILE 11 HB ILE 11 14.494 1.822 3.076 47 HG12 ILE 11 1HG1 ILE 11 12.631 0.769 0.969 48 HG13 ILE 11 2HG1 ILE 11 13.485 2.288 0.716 49 HG21 ILE 11 1HG2 ILE 11 13.450 0.348 4.480 50 HG22 ILE 11 2HG2 ILE 11 11.930 0.407 3.590 51 HG23 ILE 11 3HG2 ILE 11 13.288 -0.519 2.953 52 HD11 ILE 11 1HD1 ILE 11 15.022 0.937 -0.206 53 HD12 ILE 11 2HD1 ILE 11 15.532 0.721 1.469 54 HD13 ILE 11 3HD1 ILE 11 14.485 -0.476 0.705 55 H ILE 12 H ILE 12 10.690 2.403 4.683 56 HA ILE 12 HA ILE 12 8.868 0.970 3.194 57 HB ILE 12 HB ILE 12 8.267 2.996 5.352 58 HG12 ILE 12 1HG1 ILE 12 8.619 -0.006 5.497 59 HG13 ILE 12 2HG1 ILE 12 9.805 1.181 6.030 60 HG21 ILE 12 1HG2 ILE 12 6.343 2.310 3.848 61 HG22 ILE 12 2HG2 ILE 12 6.530 0.690 4.517 62 HG23 ILE 12 3HG2 ILE 12 6.125 2.041 5.576 63 HD11 ILE 12 1HD1 ILE 12 8.751 1.531 7.965 64 HD12 ILE 12 2HD1 ILE 12 7.157 1.525 7.213 65 HD13 ILE 12 3HD1 ILE 12 7.946 0.001 7.617 66 H VAL 13 H VAL 13 9.355 4.453 3.314 67 HA VAL 13 HA VAL 13 7.060 5.000 1.642 68 HB VAL 13 HB VAL 13 9.286 6.845 2.525 69 HG11 VAL 13 1HG1 VAL 13 6.562 7.644 1.543 70 HG12 VAL 13 2HG1 VAL 13 8.001 8.647 1.744 71 HG13 VAL 13 3HG1 VAL 13 7.931 7.451 0.448 72 HG21 VAL 13 1HG2 VAL 13 7.473 5.666 4.150 73 HG22 VAL 13 2HG2 VAL 13 8.168 7.262 4.437 74 HG23 VAL 13 3HG2 VAL 13 6.588 7.113 3.669 75 H ASN 14 H ASN 14 10.586 4.992 1.303 76 HA ASN 14 HA ASN 14 10.761 5.986 -1.296 77 HB2 ASN 14 1HB ASN 14 12.652 5.517 0.362 78 HB3 ASN 14 2HB ASN 14 12.585 3.849 -0.198 79 HD21 ASN 14 1HD2 ASN 14 12.827 7.162 -1.429 80 HD22 ASN 14 2HD2 ASN 14 13.914 6.787 -2.718 81 H TRP 15 H TRP 15 10.772 2.571 -0.261 82 HA TRP 15 HA TRP 15 10.805 1.331 -2.697 83 HB2 TRP 15 1HB TRP 15 10.843 0.165 -0.507 84 HB3 TRP 15 2HB TRP 15 9.119 0.480 -0.332 85 HD1 TRP 15 HD TRP 15 11.378 -1.230 -3.002 86 HE1 TRP 15 1HE TRP 15 10.155 -3.340 -3.826 87 HE3 TRP 15 3HE TRP 15 7.101 -0.822 -0.231 88 HZ2 TRP 15 2HZ TRP 15 7.702 -4.657 -3.362 89 HZ3 TRP 15 3HZ TRP 15 5.366 -2.548 -0.481 90 HH2 TRP 15 HH TRP 15 5.661 -4.425 -2.014 91 H VAL 16 H VAL 16 7.887 2.388 -0.946 92 HA VAL 16 HA VAL 16 5.963 1.604 -2.761 93 HB VAL 16 HB VAL 16 5.931 4.148 -1.130 94 HG11 VAL 16 1HG1 VAL 16 3.854 2.659 -2.671 95 HG12 VAL 16 2HG1 VAL 16 3.392 3.523 -1.202 96 HG13 VAL 16 3HG1 VAL 16 4.133 4.396 -2.544 97 HG21 VAL 16 1HG2 VAL 16 4.419 1.875 -0.125 98 HG22 VAL 16 2HG2 VAL 16 6.153 1.561 -0.204 99 HG23 VAL 16 3HG2 VAL 16 5.547 2.942 0.711 100 H ASN 17 H ASN 17 7.672 4.728 -2.651 101 HA ASN 17 HA ASN 17 6.461 5.917 -4.851 102 HB2 ASN 17 1HB ASN 17 9.053 6.273 -3.430 103 HB3 ASN 17 2HB ASN 17 8.886 7.027 -5.012 104 HD21 ASN 17 1HD2 ASN 17 7.700 6.929 -1.741 105 HD22 ASN 17 2HD2 ASN 17 6.868 8.443 -1.787 106 H GLU 18 H GLU 18 9.667 4.342 -4.827 107 HA GLU 18 HA GLU 18 10.089 4.337 -7.562 108 HB2 GLU 18 1HB GLU 18 11.075 2.633 -5.314 109 HB3 GLU 18 2HB GLU 18 11.435 2.146 -6.964 110 HG2 GLU 18 1HG GLU 18 12.391 4.442 -7.320 111 HG3 GLU 18 2HG GLU 18 12.228 4.693 -5.583 112 H THR 19 H THR 19 8.942 1.557 -5.639 113 HA THR 19 HA THR 19 8.388 -0.276 -7.519 114 HB THR 19 HB THR 19 6.594 0.488 -5.211 115 HG1 THR 19 1HG THR 19 7.705 -1.138 -4.156 116 HG21 THR 19 1HG2 THR 19 6.404 -1.719 -7.212 117 HG22 THR 19 2HG2 THR 19 5.122 -0.773 -6.455 118 HG23 THR 19 3HG2 THR 19 5.942 -2.038 -5.541 119 H LEU 20 H LEU 20 6.319 2.511 -6.785 120 HA LEU 20 HA LEU 20 4.344 1.844 -8.735 121 HB2 LEU 20 1HB LEU 20 4.947 4.385 -7.238 122 HB3 LEU 20 2HB LEU 20 3.590 4.212 -8.350 123 HG LEU 20 HG LEU 20 3.924 2.417 -5.964 124 HD11 LEU 20 1HD1 LEU 20 3.399 4.056 -4.572 125 HD12 LEU 20 2HD1 LEU 20 1.937 4.388 -5.501 126 HD13 LEU 20 3HD1 LEU 20 3.444 5.211 -5.904 127 HD21 LEU 20 1HD2 LEU 20 2.366 1.876 -7.899 128 HD22 LEU 20 2HD2 LEU 20 1.416 3.269 -7.383 129 HD23 LEU 20 3HD2 LEU 20 1.651 1.907 -6.286 130 H ARG 21 H ARG 21 7.089 4.082 -8.649 131 HA ARG 21 HA ARG 21 6.676 5.354 -11.092 132 HB2 ARG 21 1HB ARG 21 8.363 5.997 -9.356 133 HB3 ARG 21 2HB ARG 21 9.355 4.646 -9.889 134 HG2 ARG 21 1HG ARG 21 9.390 5.674 -12.166 135 HG3 ARG 21 2HG ARG 21 8.585 7.084 -11.471 136 HD2 ARG 21 1HD ARG 21 10.553 7.002 -9.757 137 HD3 ARG 21 2HD ARG 21 11.352 6.058 -11.014 138 HE ARG 21 HE ARG 21 10.233 8.505 -11.996 139 HH11 ARG 21 1HH1 ARG 21 12.982 7.077 -10.406 140 HH12 ARG 21 2HH1 ARG 21 14.085 8.310 -10.922 141 HH21 ARG 21 1HH2 ARG 21 11.676 10.134 -12.680 142 HH22 ARG 21 2HH2 ARG 21 13.340 10.048 -12.214 143 H GLU 22 H GLU 22 8.559 2.421 -10.376 144 HA GLU 22 HA GLU 22 9.554 1.880 -12.889 145 HB2 GLU 22 1HB GLU 22 8.550 -0.104 -10.839 146 HB3 GLU 22 2HB GLU 22 9.587 -0.498 -12.203 147 HG2 GLU 22 1HG GLU 22 11.117 1.363 -11.151 148 HG3 GLU 22 2HG GLU 22 10.225 0.947 -9.689 149 H ALA 23 H ALA 23 6.351 1.167 -11.589 150 HA ALA 23 HA ALA 23 5.517 -0.160 -14.025 151 HB1 ALA 23 1HB ALA 23 4.244 0.390 -11.380 152 HB2 ALA 23 2HB ALA 23 3.244 -0.065 -12.760 153 HB3 ALA 23 3HB ALA 23 4.516 -1.150 -12.198 154 H GLU 24 H GLU 24 5.813 3.010 -13.014 155 HA GLU 24 HA GLU 24 5.206 4.980 -13.989 156 HB2 GLU 24 1HB GLU 24 3.590 3.455 -16.018 157 HB3 GLU 24 2HB GLU 24 4.357 5.028 -16.190 158 HG2 GLU 24 1HG GLU 24 6.064 2.645 -15.685 159 HG3 GLU 24 2HG GLU 24 5.384 2.891 -17.293 160 H LYS 25 H LYS 25 3.769 4.021 -11.830 161 HA LYS 25 HA LYS 25 0.942 4.286 -12.362 162 HB2 LYS 25 1HB LYS 25 2.633 3.635 -10.009 163 HB3 LYS 25 2HB LYS 25 1.064 4.358 -9.681 164 HG2 LYS 25 1HG LYS 25 1.163 1.838 -9.690 165 HG3 LYS 25 2HG LYS 25 -0.087 2.575 -10.694 166 HD2 LYS 25 1HD LYS 25 1.473 2.353 -12.643 167 HD3 LYS 25 2HD LYS 25 2.548 1.421 -11.596 168 HE2 LYS 25 1HE LYS 25 1.147 -0.383 -11.535 169 HE3 LYS 25 2HE LYS 25 -0.302 0.596 -11.755 170 HZ1 LYS 25 1HZ LYS 25 0.209 -0.780 -13.698 171 HZ2 LYS 25 2HZ LYS 25 1.690 0.014 -13.878 172 HZ3 LYS 25 3HZ LYS 25 0.244 0.870 -14.071 173 H SER 26 H SER 26 -0.413 5.916 -11.465 174 HA SER 26 HA SER 26 0.909 8.519 -11.355 175 HB2 SER 26 1HB SER 26 -1.921 7.628 -11.843 176 HB3 SER 26 2HB SER 26 -1.572 9.300 -11.406 177 HG SER 26 HG SER 26 -1.597 8.593 -13.756 178 H SER 27 H SER 27 0.630 6.393 -9.136 179 HA SER 27 HA SER 27 -0.510 8.186 -7.093 180 HB2 SER 27 1HB SER 27 -1.182 6.313 -5.823 181 HB3 SER 27 2HB SER 27 -1.595 5.887 -7.485 182 HG SER 27 HG SER 27 -0.291 4.374 -5.978 183 H SER 28 H SER 28 0.535 8.168 -4.992 184 HA SER 28 HA SER 28 3.034 6.971 -4.509 185 HB2 SER 28 1HB SER 28 3.061 9.628 -5.852 186 HB3 SER 28 2HB SER 28 4.214 9.371 -4.543 187 HG SER 28 HG SER 28 5.215 7.853 -5.693 188 H ILE 29 H ILE 29 4.153 8.014 -2.588 189 HA ILE 29 HA ILE 29 2.270 9.498 -0.895 190 HB ILE 29 HB ILE 29 3.027 8.050 1.044 191 HG12 ILE 29 1HG1 ILE 29 3.613 5.942 -1.003 192 HG13 ILE 29 2HG1 ILE 29 4.891 7.047 -0.508 193 HG21 ILE 29 1HG2 ILE 29 1.540 6.048 -0.044 194 HG22 ILE 29 2HG2 ILE 29 0.881 7.522 0.665 195 HG23 ILE 29 3HG2 ILE 29 1.114 7.410 -1.079 196 HD11 ILE 29 1HD1 ILE 29 3.317 5.592 1.562 197 HD12 ILE 29 2HD1 ILE 29 4.605 4.765 0.687 198 HD13 ILE 29 3HD1 ILE 29 4.967 6.210 1.630 199 H SER 30 H SER 30 3.200 10.851 0.626 200 HA SER 30 HA SER 30 6.018 11.456 0.152 201 HB2 SER 30 1HB SER 30 4.268 13.260 0.047 202 HB3 SER 30 2HB SER 30 4.015 13.038 1.777 203 HG SER 30 HG SER 30 6.316 13.977 0.435 204 H SER 31 H SER 31 3.819 10.536 2.742 205 HA SER 31 HA SER 31 5.910 9.344 4.258 206 HB2 SER 31 1HB SER 31 6.172 11.848 4.732 207 HB3 SER 31 2HB SER 31 4.639 11.731 5.598 208 HG SER 31 HG SER 31 6.024 11.280 7.165 209 H PHE 32 H PHE 32 5.115 8.347 6.248 210 HA PHE 32 HA PHE 32 2.911 6.833 6.020 211 HB2 PHE 32 1HB PHE 32 4.035 8.038 8.550 212 HB3 PHE 32 2HB PHE 32 2.805 6.778 8.546 213 HD1 PHE 32 2HD PHE 32 3.369 4.586 7.360 214 HD2 PHE 32 1HD PHE 32 6.288 7.491 8.437 215 HE1 PHE 32 2HE PHE 32 5.126 2.871 7.211 216 HE2 PHE 32 1HE PHE 32 8.050 5.781 8.289 217 HZ PHE 32 HZ PHE 32 7.470 3.467 7.676 218 H LYS 33 H LYS 33 2.963 10.201 6.886 219 HA LYS 33 HA LYS 33 0.088 10.175 7.455 220 HB2 LYS 33 1HB LYS 33 2.229 12.263 7.856 221 HB3 LYS 33 2HB LYS 33 0.517 12.602 8.075 222 HG2 LYS 33 1HG LYS 33 1.159 12.133 10.221 223 HG3 LYS 33 2HG LYS 33 0.608 10.545 9.679 224 HD2 LYS 33 1HD LYS 33 3.001 10.053 9.062 225 HD3 LYS 33 2HD LYS 33 3.443 11.544 9.897 226 HE2 LYS 33 1HE LYS 33 2.099 10.520 11.873 227 HE3 LYS 33 2HE LYS 33 2.337 8.998 11.015 228 HZ1 LYS 33 1HZ LYS 33 4.811 9.996 10.993 229 HZ2 LYS 33 2HZ LYS 33 4.230 8.954 12.191 230 HZ3 LYS 33 3HZ LYS 33 4.250 10.624 12.461 231 H ASP 34 H ASP 34 0.737 9.639 4.821 232 HA ASP 34 HA ASP 34 0.527 12.092 3.293 233 HB2 ASP 34 1HB ASP 34 1.872 10.467 2.245 234 HB3 ASP 34 2HB ASP 34 0.714 9.178 2.564 235 HA PRO 35 HA PRO 35 -3.879 12.198 3.203 236 HB2 PRO 35 1HB PRO 35 -4.190 13.793 1.029 237 HB3 PRO 35 2HB PRO 35 -3.656 14.403 2.599 238 HG2 PRO 35 1HG PRO 35 -2.030 13.712 0.182 239 HG3 PRO 35 2HG PRO 35 -1.885 15.108 1.266 240 HD2 PRO 35 1HD PRO 35 -0.257 12.952 1.441 241 HD3 PRO 35 2HD PRO 35 -0.729 13.909 2.860 242 H LYS 36 H LYS 36 -2.217 11.680 0.095 243 HA LYS 36 HA LYS 36 -4.255 10.686 -1.432 244 HB2 LYS 36 1HB LYS 36 -1.445 9.572 -1.363 245 HB3 LYS 36 2HB LYS 36 -2.578 9.461 -2.703 246 HG2 LYS 36 1HG LYS 36 -1.470 12.040 -1.613 247 HG3 LYS 36 2HG LYS 36 -0.835 11.182 -3.019 248 HD2 LYS 36 1HD LYS 36 -3.213 11.335 -3.954 249 HD3 LYS 36 2HD LYS 36 -3.498 12.532 -2.689 250 HE2 LYS 36 1HE LYS 36 -1.997 14.043 -3.607 251 HE3 LYS 36 2HE LYS 36 -1.134 12.794 -4.503 252 HZ1 LYS 36 1HZ LYS 36 -2.971 12.603 -6.013 253 HZ2 LYS 36 2HZ LYS 36 -2.511 14.228 -5.926 254 HZ3 LYS 36 3HZ LYS 36 -3.896 13.697 -5.114 255 H ILE 37 H ILE 37 -2.397 8.984 1.037 256 HA ILE 37 HA ILE 37 -3.138 6.380 0.636 257 HB ILE 37 HB ILE 37 -2.963 7.771 3.311 258 HG12 ILE 37 1HG1 ILE 37 -0.885 6.404 1.596 259 HG13 ILE 37 2HG1 ILE 37 -0.919 8.096 2.080 260 HG21 ILE 37 1HG2 ILE 37 -3.714 5.122 2.649 261 HG22 ILE 37 2HG2 ILE 37 -2.114 5.060 3.388 262 HG23 ILE 37 3HG2 ILE 37 -3.452 5.822 4.247 263 HD11 ILE 37 1HD1 ILE 37 0.258 5.863 3.404 264 HD12 ILE 37 2HD1 ILE 37 0.345 7.576 3.814 265 HD13 ILE 37 3HD1 ILE 37 -0.967 6.584 4.446 266 H SER 38 H SER 38 -5.081 8.995 1.917 267 HA SER 38 HA SER 38 -7.159 7.645 3.117 268 HB2 SER 38 1HB SER 38 -8.490 9.587 2.777 269 HB3 SER 38 2HB SER 38 -6.829 10.164 2.915 270 HG SER 38 HG SER 38 -6.944 10.881 0.947 271 H THR 39 H THR 39 -6.731 8.361 -0.329 272 HA THR 39 HA THR 39 -9.165 7.016 -1.072 273 HB THR 39 HB THR 39 -8.239 7.315 -3.428 274 HG1 THR 39 1HG THR 39 -6.037 7.848 -2.093 275 HG21 THR 39 1HG2 THR 39 -9.675 8.973 -1.892 276 HG22 THR 39 2HG2 THR 39 -9.181 9.384 -3.534 277 HG23 THR 39 3HG2 THR 39 -8.262 9.992 -2.158 278 H SER 40 H SER 40 -6.111 5.975 -0.211 279 HA SER 40 HA SER 40 -5.118 3.925 -0.228 280 HB2 SER 40 1HB SER 40 -7.565 2.876 -1.657 281 HB3 SER 40 2HB SER 40 -6.418 1.968 -0.672 282 HG SER 40 HG SER 40 -8.526 3.604 0.096 283 H LEU 41 H LEU 41 -4.968 5.857 -2.475 284 HA LEU 41 HA LEU 41 -4.802 4.428 -4.920 285 HB2 LEU 41 1HB LEU 41 -3.870 7.088 -3.949 286 HB3 LEU 41 2HB LEU 41 -3.256 6.470 -5.480 287 HG LEU 41 HG LEU 41 -6.168 6.922 -4.829 288 HD11 LEU 41 1HD1 LEU 41 -4.891 9.014 -4.990 289 HD12 LEU 41 2HD1 LEU 41 -6.026 8.823 -6.326 290 HD13 LEU 41 3HD1 LEU 41 -4.305 8.523 -6.580 291 HD21 LEU 41 1HD2 LEU 41 -5.895 5.144 -6.430 292 HD22 LEU 41 2HD2 LEU 41 -4.764 6.114 -7.374 293 HD23 LEU 41 3HD2 LEU 41 -6.460 6.590 -7.266 294 HA PRO 42 HA PRO 42 -0.046 4.377 -3.996 295 HB2 PRO 42 1HB PRO 42 0.700 4.883 -1.435 296 HB3 PRO 42 2HB PRO 42 0.545 6.149 -2.658 297 HG2 PRO 42 1HG PRO 42 -1.381 5.342 -0.514 298 HG3 PRO 42 2HG PRO 42 -0.909 6.969 -1.040 299 HD2 PRO 42 1HD PRO 42 -3.220 5.795 -1.825 300 HD3 PRO 42 2HD PRO 42 -2.323 6.925 -2.860 301 H VAL 43 H VAL 43 -2.430 3.226 -1.747 302 HA VAL 43 HA VAL 43 -0.787 0.971 -0.910 303 HB VAL 43 HB VAL 43 -3.681 1.433 -0.209 304 HG11 VAL 43 1HG1 VAL 43 -2.615 0.277 1.941 305 HG12 VAL 43 2HG1 VAL 43 -3.238 -0.654 0.577 306 HG13 VAL 43 3HG1 VAL 43 -1.507 -0.353 0.722 307 HG21 VAL 43 1HG2 VAL 43 -3.167 3.145 1.112 308 HG22 VAL 43 2HG2 VAL 43 -1.864 2.230 1.870 309 HG23 VAL 43 3HG2 VAL 43 -1.554 3.154 0.401 310 H LEU 44 H LEU 44 -3.504 1.687 -3.000 311 HA LEU 44 HA LEU 44 -4.125 -1.077 -3.510 312 HB2 LEU 44 1HB LEU 44 -5.041 1.518 -4.711 313 HB3 LEU 44 2HB LEU 44 -5.540 -0.042 -5.361 314 HG LEU 44 HG LEU 44 -6.056 0.833 -2.523 315 HD11 LEU 44 1HD1 LEU 44 -8.139 0.752 -4.666 316 HD12 LEU 44 2HD1 LEU 44 -7.151 2.193 -4.435 317 HD13 LEU 44 3HD1 LEU 44 -8.156 1.595 -3.116 318 HD21 LEU 44 1HD2 LEU 44 -6.366 -1.399 -2.382 319 HD22 LEU 44 2HD2 LEU 44 -6.600 -1.588 -4.120 320 HD23 LEU 44 3HD2 LEU 44 -7.924 -1.007 -3.110 321 H ASP 45 H ASP 45 -2.738 1.579 -5.439 322 HA ASP 45 HA ASP 45 -2.126 0.036 -7.702 323 HB2 ASP 45 1HB ASP 45 -0.935 2.599 -6.640 324 HB3 ASP 45 2HB ASP 45 -0.464 1.892 -8.184 325 H LEU 46 H LEU 46 -0.138 0.924 -4.897 326 HA LEU 46 HA LEU 46 2.294 -0.094 -5.599 327 HB2 LEU 46 1HB LEU 46 2.123 1.001 -3.531 328 HB3 LEU 46 2HB LEU 46 0.854 -0.086 -2.967 329 HG LEU 46 HG LEU 46 2.459 -1.873 -2.683 330 HD11 LEU 46 1HD1 LEU 46 4.416 -1.941 -3.725 331 HD12 LEU 46 2HD1 LEU 46 4.896 -0.389 -3.042 332 HD13 LEU 46 3HD1 LEU 46 3.974 -0.443 -4.543 333 HD21 LEU 46 1HD2 LEU 46 2.134 -0.201 -0.874 334 HD22 LEU 46 2HD2 LEU 46 3.549 0.665 -1.474 335 HD23 LEU 46 3HD2 LEU 46 3.718 -0.975 -0.846 336 H ILE 47 H ILE 47 -0.399 -1.919 -4.161 337 HA ILE 47 HA ILE 47 0.848 -4.410 -4.032 338 HB ILE 47 HB ILE 47 -2.065 -3.742 -4.454 339 HG12 ILE 47 1HG1 ILE 47 -0.785 -4.775 -1.937 340 HG13 ILE 47 2HG1 ILE 47 -0.757 -3.056 -2.318 341 HG21 ILE 47 1HG2 ILE 47 -2.370 -5.896 -4.922 342 HG22 ILE 47 2HG2 ILE 47 -0.693 -6.288 -4.541 343 HG23 ILE 47 3HG2 ILE 47 -1.901 -6.239 -3.257 344 HD11 ILE 47 1HD1 ILE 47 -3.270 -3.202 -2.526 345 HD12 ILE 47 2HD1 ILE 47 -3.137 -4.804 -1.799 346 HD13 ILE 47 3HD1 ILE 47 -2.600 -3.382 -0.905 347 H ASP 48 H ASP 48 -1.221 -3.083 -6.610 348 HA ASP 48 HA ASP 48 -1.089 -5.252 -8.352 349 HB2 ASP 48 1HB ASP 48 -2.526 -3.098 -8.472 350 HB3 ASP 48 2HB ASP 48 -1.158 -2.417 -9.349 351 H ALA 49 H ALA 49 0.971 -2.355 -8.222 352 HA ALA 49 HA ALA 49 2.615 -2.641 -10.331 353 HB1 ALA 49 1HB ALA 49 4.343 -1.549 -9.103 354 HB2 ALA 49 2HB ALA 49 2.800 -0.922 -8.524 355 HB3 ALA 49 3HB ALA 49 3.685 -2.109 -7.567 356 H ILE 50 H ILE 50 2.854 -4.509 -7.326 357 HA ILE 50 HA ILE 50 5.120 -6.021 -8.236 358 HB ILE 50 HB ILE 50 3.274 -6.660 -5.935 359 HG12 ILE 50 1HG1 ILE 50 5.871 -5.116 -5.847 360 HG13 ILE 50 2HG1 ILE 50 4.284 -4.353 -5.852 361 HG21 ILE 50 1HG2 ILE 50 5.227 -7.869 -5.057 362 HG22 ILE 50 2HG2 ILE 50 4.674 -8.521 -6.597 363 HG23 ILE 50 3HG2 ILE 50 6.107 -7.496 -6.539 364 HD11 ILE 50 1HD1 ILE 50 4.431 -4.443 -3.637 365 HD12 ILE 50 2HD1 ILE 50 4.074 -6.162 -3.807 366 HD13 ILE 50 3HD1 ILE 50 5.746 -5.617 -3.683 367 H GLN 51 H GLN 51 1.718 -6.865 -7.561 368 HA GLN 51 HA GLN 51 2.029 -9.169 -9.368 369 HB2 GLN 51 1HB GLN 51 1.370 -9.454 -6.867 370 HB3 GLN 51 2HB GLN 51 -0.212 -8.892 -7.391 371 HG2 GLN 51 1HG GLN 51 1.135 -11.165 -8.789 372 HG3 GLN 51 2HG GLN 51 0.255 -11.422 -7.283 373 HE21 GLN 51 1HE2 GLN 51 -1.666 -12.232 -7.685 374 HE22 GLN 51 2HE2 GLN 51 -2.730 -11.755 -8.960 375 HA PRO 52 HA PRO 52 -0.662 -6.387 -11.783 376 HB2 PRO 52 1HB PRO 52 0.068 -7.433 -14.180 377 HB3 PRO 52 2HB PRO 52 1.016 -6.198 -13.342 378 HG2 PRO 52 1HG PRO 52 1.433 -9.161 -13.445 379 HG3 PRO 52 2HG PRO 52 2.628 -7.859 -13.576 380 HD2 PRO 52 1HD PRO 52 2.232 -9.247 -11.285 381 HD3 PRO 52 2HD PRO 52 2.716 -7.539 -11.295 382 H GLY 53 H GLY 53 -2.748 -6.946 -11.742 383 HA2 GLY 53 1HA GLY 53 -4.328 -8.302 -13.203 384 HA3 GLY 53 2HA GLY 53 -3.479 -9.691 -12.542 385 H SER 54 H SER 54 -3.243 -8.394 -9.888 386 HA SER 54 HA SER 54 -5.628 -9.425 -8.755 387 HB2 SER 54 1HB SER 54 -4.726 -8.445 -6.623 388 HB3 SER 54 2HB SER 54 -3.596 -9.504 -7.467 389 HG SER 54 HG SER 54 -2.560 -7.657 -8.276 390 H ILE 55 H ILE 55 -4.355 -6.091 -8.754 391 HA ILE 55 HA ILE 55 -6.824 -4.969 -7.880 392 HB ILE 55 HB ILE 55 -4.469 -3.587 -9.170 393 HG12 ILE 55 1HG1 ILE 55 -3.813 -4.775 -7.138 394 HG13 ILE 55 2HG1 ILE 55 -3.812 -3.038 -6.854 395 HG21 ILE 55 1HG2 ILE 55 -5.586 -1.675 -8.995 396 HG22 ILE 55 2HG2 ILE 55 -7.024 -2.613 -8.593 397 HG23 ILE 55 3HG2 ILE 55 -5.982 -2.002 -7.308 398 HD11 ILE 55 1HD1 ILE 55 -6.376 -3.994 -6.176 399 HD12 ILE 55 2HD1 ILE 55 -5.190 -5.076 -5.444 400 HD13 ILE 55 3HD1 ILE 55 -5.128 -3.345 -5.113 401 H ASN 56 H ASN 56 -8.455 -4.040 -9.011 402 HA ASN 56 HA ASN 56 -8.222 -3.989 -11.946 403 HB2 ASN 56 1HB ASN 56 -9.668 -5.880 -10.782 404 HB3 ASN 56 2HB ASN 56 -10.863 -4.590 -10.684 405 HD21 ASN 56 1HD2 ASN 56 -11.593 -3.622 -12.634 406 HD22 ASN 56 2HD2 ASN 56 -11.522 -4.491 -14.126 407 H TYR 57 H TYR 57 -7.772 -1.742 -11.783 408 HA TYR 57 HA TYR 57 -9.080 0.218 -10.436 409 HB2 TYR 57 1HB TYR 57 -8.188 0.349 -13.324 410 HB3 TYR 57 2HB TYR 57 -8.526 1.741 -12.300 411 HD1 TYR 57 2HD TYR 57 -7.219 1.348 -9.850 412 HD2 TYR 57 1HD TYR 57 -5.937 0.073 -13.701 413 HE1 TYR 57 2HE TYR 57 -4.889 1.340 -9.064 414 HE2 TYR 57 1HE TYR 57 -3.602 0.060 -12.926 415 HH TYR 57 HH TYR 57 -2.511 1.594 -10.354 416 H ASP 58 H ASP 58 -10.163 -1.360 -13.407 417 HA ASP 58 HA ASP 58 -12.290 0.163 -14.164 418 HB2 ASP 58 1HB ASP 58 -11.390 -2.184 -15.002 419 HB3 ASP 58 2HB ASP 58 -12.730 -2.787 -14.031 420 H LEU 59 H LEU 59 -12.202 -2.164 -11.505 421 HA LEU 59 HA LEU 59 -14.973 -1.704 -10.829 422 HB2 LEU 59 1HB LEU 59 -12.911 -3.138 -9.177 423 HB3 LEU 59 2HB LEU 59 -14.664 -3.305 -9.102 424 HG LEU 59 HG LEU 59 -12.913 -4.214 -11.387 425 HD11 LEU 59 1HD1 LEU 59 -14.367 -6.279 -10.024 426 HD12 LEU 59 2HD1 LEU 59 -13.342 -5.401 -8.889 427 HD13 LEU 59 3HD1 LEU 59 -12.635 -6.140 -10.325 428 HD21 LEU 59 1HD2 LEU 59 -15.321 -5.490 -11.598 429 HD22 LEU 59 2HD2 LEU 59 -14.832 -4.076 -12.531 430 HD23 LEU 59 3HD2 LEU 59 -15.799 -3.877 -11.068 431 H LEU 60 H LEU 60 -11.803 -0.732 -9.656 432 HA LEU 60 HA LEU 60 -12.657 0.473 -7.251 433 HB2 LEU 60 1HB LEU 60 -10.273 1.220 -8.935 434 HB3 LEU 60 2HB LEU 60 -10.503 1.560 -7.222 435 HG LEU 60 HG LEU 60 -10.116 -1.167 -8.456 436 HD11 LEU 60 1HD1 LEU 60 -8.097 0.252 -8.425 437 HD12 LEU 60 2HD1 LEU 60 -7.967 -1.148 -7.362 438 HD13 LEU 60 3HD1 LEU 60 -8.289 0.447 -6.683 439 HD21 LEU 60 1HD2 LEU 60 -10.987 -2.000 -6.596 440 HD22 LEU 60 2HD2 LEU 60 -11.275 -0.376 -5.970 441 HD23 LEU 60 3HD2 LEU 60 -9.735 -1.179 -5.663 442 H LYS 61 H LYS 61 -12.728 2.764 -6.758 443 HA LYS 61 HA LYS 61 -14.109 4.243 -8.854 444 HB2 LYS 61 1HB LYS 61 -13.937 4.412 -5.889 445 HB3 LYS 61 2HB LYS 61 -14.264 5.901 -6.765 446 HG2 LYS 61 1HG LYS 61 -16.393 5.194 -6.410 447 HG3 LYS 61 2HG LYS 61 -16.077 4.394 -7.952 448 HD2 LYS 61 1HD LYS 61 -15.370 2.944 -5.453 449 HD3 LYS 61 2HD LYS 61 -17.079 3.088 -5.874 450 HE2 LYS 61 1HE LYS 61 -16.436 2.221 -8.169 451 HE3 LYS 61 2HE LYS 61 -14.867 1.820 -7.472 452 HZ1 LYS 61 1HZ LYS 61 -16.060 -0.127 -7.243 453 HZ2 LYS 61 2HZ LYS 61 -17.508 0.662 -6.867 454 HZ3 LYS 61 3HZ LYS 61 -16.265 0.586 -5.723 455 H THR 62 H THR 62 -11.630 5.056 -6.417 456 HA THR 62 HA THR 62 -9.946 6.598 -6.434 457 HB THR 62 HB THR 62 -8.420 6.499 -8.288 458 HG1 THR 62 1HG THR 62 -9.203 5.241 -10.206 459 HG21 THR 62 1HG2 THR 62 -8.461 4.508 -6.902 460 HG22 THR 62 2HG2 THR 62 -8.174 4.055 -8.582 461 HG23 THR 62 3HG2 THR 62 -9.770 3.830 -7.868 462 H GLU 63 H GLU 63 -12.584 7.625 -7.010 463 HA GLU 63 HA GLU 63 -11.779 10.115 -8.299 464 HB2 GLU 63 1HB GLU 63 -13.836 10.193 -9.653 465 HB3 GLU 63 2HB GLU 63 -12.792 8.855 -10.112 466 HG2 GLU 63 1HG GLU 63 -14.243 7.426 -8.576 467 HG3 GLU 63 2HG GLU 63 -15.378 8.774 -8.602 468 H ASN 64 H ASN 64 -12.239 11.686 -6.921 469 HA ASN 64 HA ASN 64 -13.084 12.662 -5.003 470 HB2 ASN 64 1HB ASN 64 -15.578 13.176 -5.368 471 HB3 ASN 64 2HB ASN 64 -14.445 13.740 -6.593 472 HD21 ASN 64 1HD2 ASN 64 -14.328 12.630 -8.580 473 HD22 ASN 64 2HD2 ASN 64 -15.644 11.659 -9.136 474 H LEU 65 H LEU 65 -12.784 9.861 -4.623 475 HA LEU 65 HA LEU 65 -14.867 8.377 -3.723 476 HB2 LEU 65 1HB LEU 65 -12.148 8.725 -2.481 477 HB3 LEU 65 2HB LEU 65 -13.294 7.490 -1.967 478 HG LEU 65 HG LEU 65 -12.489 7.609 -4.837 479 HD11 LEU 65 1HD1 LEU 65 -10.627 6.011 -4.229 480 HD12 LEU 65 2HD1 LEU 65 -10.798 6.587 -2.572 481 HD13 LEU 65 3HD1 LEU 65 -10.347 7.712 -3.852 482 HD21 LEU 65 1HD2 LEU 65 -13.355 5.485 -2.893 483 HD22 LEU 65 2HD2 LEU 65 -12.688 5.107 -4.481 484 HD23 LEU 65 3HD2 LEU 65 -14.180 6.040 -4.350 485 H ASN 66 H ASN 66 -15.942 8.072 -1.731 486 HA ASN 66 HA ASN 66 -15.835 10.360 0.117 487 HB2 ASN 66 1HB ASN 66 -18.396 9.874 0.358 488 HB3 ASN 66 2HB ASN 66 -17.816 10.851 -0.987 489 HD21 ASN 66 1HD2 ASN 66 -19.732 8.300 -0.128 490 HD22 ASN 66 2HD2 ASN 66 -19.894 7.540 -1.671 491 H ASP 67 H ASP 67 -16.790 9.880 2.256 492 HA ASP 67 HA ASP 67 -15.620 7.939 3.659 493 HB2 ASP 67 1HB ASP 67 -18.478 8.853 4.043 494 HB3 ASP 67 2HB ASP 67 -17.538 7.977 5.247 495 H ASP 68 H ASP 68 -18.391 7.478 1.574 496 HA ASP 68 HA ASP 68 -18.910 4.789 2.427 497 HB2 ASP 68 1HB ASP 68 -19.806 6.154 -0.118 498 HB3 ASP 68 2HB ASP 68 -20.509 4.714 0.611 499 H GLU 69 H GLU 69 -17.865 6.045 -0.747 500 HA GLU 69 HA GLU 69 -17.009 3.606 -1.779 501 HB2 GLU 69 1HB GLU 69 -15.843 6.314 -2.437 502 HB3 GLU 69 2HB GLU 69 -15.825 4.882 -3.457 503 HG2 GLU 69 1HG GLU 69 -18.340 6.275 -2.576 504 HG3 GLU 69 2HG GLU 69 -17.504 6.613 -4.092 505 H LYS 70 H LYS 70 -15.029 6.183 -0.313 506 HA LYS 70 HA LYS 70 -12.537 5.180 -0.428 507 HB2 LYS 70 1HB LYS 70 -13.799 6.348 2.061 508 HB3 LYS 70 2HB LYS 70 -12.071 6.231 1.753 509 HG2 LYS 70 1HG LYS 70 -12.343 7.709 -0.197 510 HG3 LYS 70 2HG LYS 70 -14.059 7.865 0.187 511 HD2 LYS 70 1HD LYS 70 -13.268 9.727 1.245 512 HD3 LYS 70 2HD LYS 70 -13.085 8.555 2.554 513 HE2 LYS 70 1HE LYS 70 -10.749 8.250 1.992 514 HE3 LYS 70 2HE LYS 70 -10.914 9.327 0.607 515 HZ1 LYS 70 1HZ LYS 70 -11.811 10.825 2.683 516 HZ2 LYS 70 2HZ LYS 70 -10.264 10.915 2.005 517 HZ3 LYS 70 3HZ LYS 70 -10.531 9.963 3.377 518 H LEU 71 H LEU 71 -14.996 4.160 1.920 519 HA LEU 71 HA LEU 71 -13.448 2.364 3.379 520 HB2 LEU 71 1HB LEU 71 -15.563 2.938 4.233 521 HB3 LEU 71 2HB LEU 71 -16.380 2.464 2.746 522 HG LEU 71 HG LEU 71 -15.848 0.096 3.266 523 HD11 LEU 71 1HD1 LEU 71 -14.048 -0.035 4.652 524 HD12 LEU 71 2HD1 LEU 71 -15.334 -0.139 5.853 525 HD13 LEU 71 3HD1 LEU 71 -14.509 1.395 5.574 526 HD21 LEU 71 1HD2 LEU 71 -17.373 1.571 5.411 527 HD22 LEU 71 2HD2 LEU 71 -17.516 -0.146 5.027 528 HD23 LEU 71 3HD2 LEU 71 -18.016 1.067 3.848 529 H ASN 72 H ASN 72 -15.763 1.522 0.792 530 HA ASN 72 HA ASN 72 -15.226 -1.123 0.489 531 HB2 ASN 72 1HB ASN 72 -15.692 0.878 -1.733 532 HB3 ASN 72 2HB ASN 72 -15.846 -0.867 -1.900 533 HD21 ASN 72 1HD2 ASN 72 -17.264 2.028 -0.680 534 HD22 ASN 72 2HD2 ASN 72 -18.781 1.344 -0.217 535 H ASN 73 H ASN 73 -13.338 1.560 -0.829 536 HA ASN 73 HA ASN 73 -11.533 0.005 -2.335 537 HB2 ASN 73 1HB ASN 73 -11.559 2.794 -1.272 538 HB3 ASN 73 2HB ASN 73 -10.028 2.140 -1.850 539 HD21 ASN 73 1HD2 ASN 73 -10.461 4.053 -3.316 540 HD22 ASN 73 2HD2 ASN 73 -11.289 3.714 -4.794 541 H ALA 74 H ALA 74 -11.338 1.308 0.963 542 HA ALA 74 HA ALA 74 -8.762 0.394 1.571 543 HB1 ALA 74 1HB ALA 74 -11.096 0.806 3.439 544 HB2 ALA 74 2HB ALA 74 -9.402 0.672 3.916 545 HB3 ALA 74 3HB ALA 74 -9.938 2.038 2.936 546 H LYS 75 H LYS 75 -11.925 -1.149 2.019 547 HA LYS 75 HA LYS 75 -11.038 -3.443 3.361 548 HB2 LYS 75 1HB LYS 75 -13.409 -3.025 1.536 549 HB3 LYS 75 2HB LYS 75 -13.154 -4.482 2.485 550 HG2 LYS 75 1HG LYS 75 -13.693 -3.469 4.445 551 HG3 LYS 75 2HG LYS 75 -13.099 -1.891 3.922 552 HD2 LYS 75 1HD LYS 75 -15.474 -1.746 4.091 553 HD3 LYS 75 2HD LYS 75 -15.067 -1.766 2.374 554 HE2 LYS 75 1HE LYS 75 -15.625 -4.362 3.704 555 HE3 LYS 75 2HE LYS 75 -16.988 -3.289 3.391 556 HZ1 LYS 75 1HZ LYS 75 -16.837 -3.596 1.180 557 HZ2 LYS 75 2HZ LYS 75 -16.071 -5.038 1.620 558 HZ3 LYS 75 3HZ LYS 75 -15.148 -3.691 1.179 559 H TYR 76 H TYR 76 -11.133 -2.638 -0.051 560 HA TYR 76 HA TYR 76 -10.549 -5.286 -0.964 561 HB2 TYR 76 1HB TYR 76 -11.665 -3.380 -2.279 562 HB3 TYR 76 2HB TYR 76 -10.036 -2.760 -2.523 563 HD1 TYR 76 1HD TYR 76 -11.600 -6.159 -2.677 564 HD2 TYR 76 2HD TYR 76 -9.259 -3.199 -4.643 565 HE1 TYR 76 1HE TYR 76 -11.322 -7.665 -4.602 566 HE2 TYR 76 2HE TYR 76 -8.976 -4.697 -6.574 567 HH TYR 76 HH TYR 76 -9.051 -7.126 -7.044 568 H ALA 77 H ALA 77 -8.654 -2.366 -0.352 569 HA ALA 77 HA ALA 77 -6.204 -3.215 -1.383 570 HB1 ALA 77 1HB ALA 77 -5.376 -1.305 -0.524 571 HB2 ALA 77 2HB ALA 77 -7.076 -0.937 -0.231 572 HB3 ALA 77 3HB ALA 77 -6.079 -1.589 1.069 573 H ILE 78 H ILE 78 -7.277 -3.304 2.022 574 HA ILE 78 HA ILE 78 -5.093 -4.763 2.992 575 HB ILE 78 HB ILE 78 -7.916 -4.653 4.057 576 HG12 ILE 78 1HG1 ILE 78 -5.464 -3.146 4.975 577 HG13 ILE 78 2HG1 ILE 78 -6.645 -2.482 3.853 578 HG21 ILE 78 1HG2 ILE 78 -5.868 -6.393 4.788 579 HG22 ILE 78 2HG2 ILE 78 -5.858 -5.130 6.018 580 HG23 ILE 78 3HG2 ILE 78 -7.337 -6.037 5.697 581 HD11 ILE 78 1HD1 ILE 78 -6.929 -3.087 6.758 582 HD12 ILE 78 2HD1 ILE 78 -7.329 -1.616 5.870 583 HD13 ILE 78 3HD1 ILE 78 -8.352 -3.044 5.717 584 H SER 79 H SER 79 -8.261 -5.849 1.826 585 HA SER 79 HA SER 79 -7.984 -8.567 2.412 586 HB2 SER 79 1HB SER 79 -9.621 -7.001 0.458 587 HB3 SER 79 2HB SER 79 -9.572 -8.758 0.309 588 HG SER 79 HG SER 79 -10.908 -7.230 2.089 589 H MET 80 H MET 80 -7.242 -6.815 -0.597 590 HA MET 80 HA MET 80 -6.410 -8.861 -2.204 591 HB2 MET 80 1HB MET 80 -5.379 -6.051 -1.909 592 HB3 MET 80 2HB MET 80 -4.712 -7.145 -3.113 593 HG2 MET 80 1HG MET 80 -7.658 -6.801 -3.014 594 HG3 MET 80 2HG MET 80 -6.683 -5.487 -3.669 595 HE1 MET 80 1HE MET 80 -7.956 -9.250 -5.752 596 HE2 MET 80 2HE MET 80 -7.708 -9.250 -4.006 597 HE3 MET 80 3HE MET 80 -8.853 -8.122 -4.734 598 H ALA 81 H ALA 81 -4.435 -7.143 0.203 599 HA ALA 81 HA ALA 81 -1.979 -8.228 -0.148 600 HB1 ALA 81 1HB ALA 81 -3.100 -6.739 1.800 601 HB2 ALA 81 2HB ALA 81 -2.855 -8.257 2.663 602 HB3 ALA 81 3HB ALA 81 -1.486 -7.443 1.906 603 H ARG 82 H ARG 82 -4.605 -9.747 1.721 604 HA ARG 82 HA ARG 82 -3.140 -12.137 2.228 605 HB2 ARG 82 1HB ARG 82 -4.920 -11.486 3.724 606 HB3 ARG 82 2HB ARG 82 -6.091 -11.515 2.411 607 HG2 ARG 82 1HG ARG 82 -4.600 -14.012 3.008 608 HG3 ARG 82 2HG ARG 82 -5.868 -13.504 4.125 609 HD2 ARG 82 1HD ARG 82 -7.331 -13.249 2.033 610 HD3 ARG 82 2HD ARG 82 -6.093 -14.201 1.215 611 HE ARG 82 HE ARG 82 -8.092 -15.173 2.982 612 HH11 ARG 82 1HH1 ARG 82 -4.785 -15.657 2.007 613 HH12 ARG 82 2HH1 ARG 82 -4.768 -17.335 2.433 614 HH21 ARG 82 1HH2 ARG 82 -8.082 -17.384 3.546 615 HH22 ARG 82 2HH2 ARG 82 -6.644 -18.317 3.308 616 H LYS 83 H LYS 83 -5.581 -11.194 -0.150 617 HA LYS 83 HA LYS 83 -6.131 -13.627 -1.322 618 HB2 LYS 83 1HB LYS 83 -7.020 -11.225 -1.837 619 HB3 LYS 83 2HB LYS 83 -5.729 -11.196 -3.031 620 HG2 LYS 83 1HG LYS 83 -7.511 -11.935 -4.277 621 HG3 LYS 83 2HG LYS 83 -6.752 -13.457 -3.802 622 HD2 LYS 83 1HD LYS 83 -8.351 -13.561 -1.882 623 HD3 LYS 83 2HD LYS 83 -9.171 -12.154 -2.560 624 HE2 LYS 83 1HE LYS 83 -9.585 -13.413 -4.629 625 HE3 LYS 83 2HE LYS 83 -8.795 -14.820 -3.920 626 HZ1 LYS 83 1HZ LYS 83 -10.692 -14.070 -2.088 627 HZ2 LYS 83 2HZ LYS 83 -10.783 -15.383 -3.152 628 HZ3 LYS 83 3HZ LYS 83 -11.466 -13.897 -3.582 629 H ILE 84 H ILE 84 -3.579 -11.340 -2.309 630 HA ILE 84 HA ILE 84 -2.414 -13.189 -4.154 631 HB ILE 84 HB ILE 84 -0.557 -11.547 -4.289 632 HG12 ILE 84 1HG1 ILE 84 -2.185 -9.817 -2.432 633 HG13 ILE 84 2HG1 ILE 84 -0.869 -10.831 -1.848 634 HG21 ILE 84 1HG2 ILE 84 -3.306 -11.166 -4.988 635 HG22 ILE 84 2HG2 ILE 84 -2.552 -9.604 -4.669 636 HG23 ILE 84 3HG2 ILE 84 -1.857 -10.690 -5.872 637 HD11 ILE 84 1HD1 ILE 84 0.743 -9.565 -2.891 638 HD12 ILE 84 2HD1 ILE 84 -0.387 -8.914 -4.079 639 HD13 ILE 84 3HD1 ILE 84 -0.435 -8.343 -2.411 640 H GLY 85 H GLY 85 -2.032 -12.512 -0.780 641 HA2 GLY 85 1HA GLY 85 -1.016 -14.433 0.452 642 HA3 GLY 85 2HA GLY 85 0.300 -14.328 -0.709 643 H ALA 86 H ALA 86 -1.317 -12.644 1.935 644 HA ALA 86 HA ALA 86 1.103 -11.793 3.099 645 HB1 ALA 86 1HB ALA 86 1.565 -9.895 2.053 646 HB2 ALA 86 2HB ALA 86 0.165 -10.117 1.001 647 HB3 ALA 86 3HB ALA 86 -0.008 -9.254 2.529 648 H ARG 87 H ARG 87 0.561 -11.952 5.168 649 HA ARG 87 HA ARG 87 -2.155 -11.513 6.043 650 HB2 ARG 87 1HB ARG 87 0.364 -12.377 7.457 651 HB3 ARG 87 2HB ARG 87 -1.146 -12.092 8.312 652 HG2 ARG 87 1HG ARG 87 -1.301 -14.335 7.972 653 HG3 ARG 87 2HG ARG 87 -2.093 -13.755 6.506 654 HD2 ARG 87 1HD ARG 87 -0.562 -15.453 5.851 655 HD3 ARG 87 2HD ARG 87 0.132 -13.909 5.359 656 HE ARG 87 HE ARG 87 1.225 -14.351 7.802 657 HH11 ARG 87 1HH1 ARG 87 1.014 -16.225 4.875 658 HH12 ARG 87 2HH1 ARG 87 2.509 -17.058 5.147 659 HH21 ARG 87 1HH2 ARG 87 3.194 -15.441 8.170 660 HH22 ARG 87 2HH2 ARG 87 3.748 -16.612 7.022 661 H VAL 88 H VAL 88 -2.950 -9.718 6.931 662 HA VAL 88 HA VAL 88 -1.070 -7.695 7.951 663 HB VAL 88 HB VAL 88 -3.520 -7.116 6.279 664 HG11 VAL 88 1HG1 VAL 88 -2.951 -4.810 6.458 665 HG12 VAL 88 2HG1 VAL 88 -2.979 -5.469 8.095 666 HG13 VAL 88 3HG1 VAL 88 -1.439 -5.184 7.283 667 HG21 VAL 88 1HG2 VAL 88 -1.615 -6.070 4.816 668 HG22 VAL 88 2HG2 VAL 88 -0.606 -7.250 5.651 669 HG23 VAL 88 3HG2 VAL 88 -1.989 -7.790 4.700 670 H TYR 89 H TYR 89 -1.731 -6.540 9.734 671 HA TYR 89 HA TYR 89 -4.238 -7.454 10.983 672 HB2 TYR 89 1HB TYR 89 -1.714 -6.480 12.338 673 HB3 TYR 89 2HB TYR 89 -3.174 -7.031 13.152 674 HD1 TYR 89 2HD TYR 89 -0.360 -8.121 11.011 675 HD2 TYR 89 1HD TYR 89 -3.573 -9.336 13.521 676 HE1 TYR 89 2HE TYR 89 0.506 -10.423 10.994 677 HE2 TYR 89 1HE TYR 89 -2.715 -11.641 13.513 678 HH TYR 89 HH TYR 89 0.308 -12.474 12.637 679 H ALA 90 H ALA 90 -4.598 -5.453 9.267 680 HA ALA 90 HA ALA 90 -4.763 -3.037 10.950 681 HB1 ALA 90 1HB ALA 90 -3.407 -2.310 9.257 682 HB2 ALA 90 2HB ALA 90 -4.134 -3.384 8.062 683 HB3 ALA 90 3HB ALA 90 -4.988 -1.930 8.575 684 H LEU 91 H LEU 91 -6.540 -1.509 9.810 685 HA LEU 91 HA LEU 91 -8.932 -3.128 9.277 686 HB2 LEU 91 1HB LEU 91 -8.727 -2.322 11.689 687 HB3 LEU 91 2HB LEU 91 -8.989 -0.702 11.047 688 HG LEU 91 HG LEU 91 -11.162 -1.645 10.069 689 HD11 LEU 91 1HD1 LEU 91 -10.904 -3.689 12.240 690 HD12 LEU 91 2HD1 LEU 91 -10.358 -4.036 10.600 691 HD13 LEU 91 3HD1 LEU 91 -12.045 -3.623 10.897 692 HD21 LEU 91 1HD2 LEU 91 -10.839 -0.141 12.107 693 HD22 LEU 91 2HD2 LEU 91 -11.074 -1.600 13.070 694 HD23 LEU 91 3HD2 LEU 91 -12.353 -1.039 11.992 695 HA PRO 92 HA PRO 92 -9.383 -0.291 5.921 696 HB2 PRO 92 1HB PRO 92 -11.936 -0.924 5.251 697 HB3 PRO 92 2HB PRO 92 -10.558 -1.966 4.876 698 HG2 PRO 92 1HG PRO 92 -12.527 -2.165 7.123 699 HG3 PRO 92 2HG PRO 92 -11.869 -3.450 6.094 700 HD2 PRO 92 1HD PRO 92 -10.950 -2.973 8.595 701 HD3 PRO 92 2HD PRO 92 -9.905 -3.579 7.294 702 H GLU 93 H GLU 93 -11.545 -0.376 8.664 703 HA GLU 93 HA GLU 93 -13.035 1.955 8.001 704 HB2 GLU 93 1HB GLU 93 -12.570 0.833 10.765 705 HB3 GLU 93 2HB GLU 93 -13.911 1.838 10.232 706 HG2 GLU 93 1HG GLU 93 -14.580 -0.015 8.695 707 HG3 GLU 93 2HG GLU 93 -13.348 -1.013 9.463 708 H ASP 94 H ASP 94 -9.961 1.390 9.492 709 HA ASP 94 HA ASP 94 -9.779 4.113 10.511 710 HB2 ASP 94 1HB ASP 94 -7.916 3.432 11.710 711 HB3 ASP 94 2HB ASP 94 -8.846 1.938 11.632 712 H LEU 95 H LEU 95 -8.491 2.109 7.933 713 HA LEU 95 HA LEU 95 -6.423 3.727 7.028 714 HB2 LEU 95 1HB LEU 95 -6.734 1.510 6.166 715 HB3 LEU 95 2HB LEU 95 -8.307 1.941 5.501 716 HG LEU 95 HG LEU 95 -7.263 3.342 3.832 717 HD11 LEU 95 1HD1 LEU 95 -4.628 2.547 5.061 718 HD12 LEU 95 2HD1 LEU 95 -5.385 4.132 5.210 719 HD13 LEU 95 3HD1 LEU 95 -4.862 3.550 3.630 720 HD21 LEU 95 1HD2 LEU 95 -5.690 0.787 3.844 721 HD22 LEU 95 2HD2 LEU 95 -6.370 1.663 2.474 722 HD23 LEU 95 3HD2 LEU 95 -7.434 0.798 3.583 723 H VAL 96 H VAL 96 -9.865 3.796 6.162 724 HA VAL 96 HA VAL 96 -9.859 5.714 4.192 725 HB VAL 96 HB VAL 96 -11.902 5.364 6.389 726 HG11 VAL 96 1HG1 VAL 96 -12.430 6.571 3.696 727 HG12 VAL 96 2HG1 VAL 96 -13.411 6.652 5.161 728 HG13 VAL 96 3HG1 VAL 96 -11.902 7.561 5.056 729 HG21 VAL 96 1HG2 VAL 96 -11.155 3.629 4.352 730 HG22 VAL 96 2HG2 VAL 96 -12.637 3.563 5.304 731 HG23 VAL 96 3HG2 VAL 96 -12.620 4.408 3.756 732 H GLU 97 H GLU 97 -9.577 6.152 7.667 733 HA GLU 97 HA GLU 97 -9.605 9.055 7.382 734 HB2 GLU 97 1HB GLU 97 -9.378 7.306 9.837 735 HB3 GLU 97 2HB GLU 97 -9.456 9.062 9.857 736 HG2 GLU 97 1HG GLU 97 -11.679 8.936 8.784 737 HG3 GLU 97 2HG GLU 97 -11.599 7.179 8.900 738 H VAL 98 H VAL 98 -7.431 7.311 6.321 739 HA VAL 98 HA VAL 98 -5.142 7.114 6.338 740 HB VAL 98 HB VAL 98 -5.344 10.045 7.038 741 HG11 VAL 98 1HG1 VAL 98 -3.108 8.444 6.734 742 HG12 VAL 98 2HG1 VAL 98 -3.281 9.235 5.167 743 HG13 VAL 98 3HG1 VAL 98 -3.156 10.203 6.636 744 HG21 VAL 98 1HG2 VAL 98 -6.802 9.362 5.137 745 HG22 VAL 98 2HG2 VAL 98 -5.529 10.498 4.690 746 HG23 VAL 98 3HG2 VAL 98 -5.361 8.787 4.299 747 H ASN 99 H ASN 99 -5.888 6.045 8.638 748 HA ASN 99 HA ASN 99 -4.521 7.369 10.841 749 HB2 ASN 99 1HB ASN 99 -6.434 5.103 10.580 750 HB3 ASN 99 2HB ASN 99 -5.327 5.074 11.950 751 HD21 ASN 99 1HD2 ASN 99 -8.315 5.610 11.491 752 HD22 ASN 99 2HD2 ASN 99 -8.612 7.024 12.437 753 HA PRO 100 HA PRO 100 -0.828 5.069 9.767 754 HB2 PRO 100 1HB PRO 100 0.744 6.253 11.636 755 HB3 PRO 100 2HB PRO 100 0.324 7.027 10.104 756 HG2 PRO 100 1HG PRO 100 -0.877 7.420 12.818 757 HG3 PRO 100 2HG PRO 100 -0.451 8.634 11.597 758 HD2 PRO 100 1HD PRO 100 -2.990 7.768 11.968 759 HD3 PRO 100 2HD PRO 100 -2.373 8.265 10.379 760 H LYS 101 H LYS 101 -2.840 4.811 12.388 761 HA LYS 101 HA LYS 101 -1.208 3.352 14.207 762 HB2 LYS 101 1HB LYS 101 -4.214 3.225 13.947 763 HB3 LYS 101 2HB LYS 101 -3.252 2.833 15.366 764 HG2 LYS 101 1HG LYS 101 -3.340 5.581 14.153 765 HG3 LYS 101 2HG LYS 101 -4.440 5.044 15.424 766 HD2 LYS 101 1HD LYS 101 -1.453 4.865 15.711 767 HD3 LYS 101 2HD LYS 101 -2.353 6.319 16.150 768 HE2 LYS 101 1HE LYS 101 -2.256 5.190 18.162 769 HE3 LYS 101 2HE LYS 101 -3.818 4.673 17.529 770 HZ1 LYS 101 1HZ LYS 101 -1.656 2.986 16.689 771 HZ2 LYS 101 2HZ LYS 101 -3.135 2.572 17.400 772 HZ3 LYS 101 3HZ LYS 101 -1.829 3.030 18.372 773 H MET 102 H MET 102 -3.300 2.467 11.519 774 HA MET 102 HA MET 102 -2.642 -0.363 11.949 775 HB2 MET 102 1HB MET 102 -4.884 1.057 10.579 776 HB3 MET 102 2HB MET 102 -4.437 -0.548 10.019 777 HG2 MET 102 1HG MET 102 -6.162 -0.878 11.566 778 HG3 MET 102 2HG MET 102 -4.680 -1.310 12.414 779 HE1 MET 102 1HE MET 102 -3.726 0.340 14.647 780 HE2 MET 102 2HE MET 102 -5.215 0.289 15.590 781 HE3 MET 102 3HE MET 102 -4.756 -1.092 14.592 782 H VAL 103 H VAL 103 -2.523 2.228 9.560 783 HA VAL 103 HA VAL 103 -1.665 0.895 7.318 784 HB VAL 103 HB VAL 103 -0.822 3.601 8.348 785 HG11 VAL 103 1HG1 VAL 103 0.002 4.080 6.103 786 HG12 VAL 103 2HG1 VAL 103 0.891 2.740 6.828 787 HG13 VAL 103 3HG1 VAL 103 -0.346 2.423 5.612 788 HG21 VAL 103 1HG2 VAL 103 -3.105 2.549 6.864 789 HG22 VAL 103 2HG2 VAL 103 -2.935 4.059 7.760 790 HG23 VAL 103 3HG2 VAL 103 -2.350 3.947 6.100 791 H MET 104 H MET 104 0.003 1.309 10.293 792 HA MET 104 HA MET 104 2.668 1.170 9.516 793 HB2 MET 104 1HB MET 104 2.859 -0.143 11.791 794 HB3 MET 104 2HB MET 104 2.447 1.566 11.770 795 HG2 MET 104 1HG MET 104 0.298 1.205 12.420 796 HG3 MET 104 2HG MET 104 0.225 -0.390 11.673 797 HE1 MET 104 1HE MET 104 0.729 -2.819 13.685 798 HE2 MET 104 2HE MET 104 -0.509 -2.005 14.641 799 HE3 MET 104 3HE MET 104 -0.520 -1.867 12.883 800 H THR 105 H THR 105 0.242 -1.346 9.747 801 HA THR 105 HA THR 105 2.225 -3.401 9.107 802 HB THR 105 HB THR 105 0.781 -4.126 10.834 803 HG1 THR 105 1HG THR 105 0.679 -5.947 9.769 804 HG21 THR 105 1HG2 THR 105 -1.747 -4.185 10.396 805 HG22 THR 105 2HG2 THR 105 -1.421 -3.012 9.120 806 HG23 THR 105 3HG2 THR 105 -1.023 -2.629 10.795 807 H VAL 106 H VAL 106 -0.605 -1.792 7.781 808 HA VAL 106 HA VAL 106 -1.247 -3.357 5.630 809 HB VAL 106 HB VAL 106 -2.068 -0.936 6.423 810 HG11 VAL 106 1HG1 VAL 106 -1.477 0.801 4.925 811 HG12 VAL 106 2HG1 VAL 106 0.037 0.078 5.471 812 HG13 VAL 106 3HG1 VAL 106 -0.601 -0.309 3.872 813 HG21 VAL 106 1HG2 VAL 106 -2.351 -2.011 3.619 814 HG22 VAL 106 2HG2 VAL 106 -3.316 -2.494 5.014 815 HG23 VAL 106 3HG2 VAL 106 -3.428 -0.848 4.392 816 H PHE 107 H PHE 107 1.452 -1.104 5.922 817 HA PHE 107 HA PHE 107 2.331 -1.699 3.207 818 HB2 PHE 107 1HB PHE 107 3.073 0.317 5.281 819 HB3 PHE 107 2HB PHE 107 4.266 -0.098 4.054 820 HD1 PHE 107 2HD PHE 107 3.465 0.026 1.593 821 HD2 PHE 107 1HD PHE 107 1.494 1.941 4.843 822 HE1 PHE 107 2HE PHE 107 2.388 1.581 0.019 823 HE2 PHE 107 1HE PHE 107 0.412 3.499 3.274 824 HZ PHE 107 HZ PHE 107 0.861 3.320 0.859 825 H ALA 108 H ALA 108 3.598 -1.933 6.524 826 HA ALA 108 HA ALA 108 6.036 -3.001 6.236 827 HB1 ALA 108 1HB ALA 108 4.816 -4.712 8.112 828 HB2 ALA 108 2HB ALA 108 5.749 -3.248 8.420 829 HB3 ALA 108 3HB ALA 108 3.999 -3.155 8.232 830 H CYS 109 H CYS 109 3.082 -5.002 6.148 831 HA CYS 109 HA CYS 109 4.242 -7.434 5.559 832 HB2 CYS 109 1HB CYS 109 1.752 -6.778 6.003 833 HB3 CYS 109 2HB CYS 109 1.660 -6.647 4.252 834 HG CYS 109 HG CYS 109 2.906 -9.417 4.250 835 H LEU 110 H LEU 110 3.442 -4.781 3.390 836 HA LEU 110 HA LEU 110 4.082 -6.243 1.005 837 HB2 LEU 110 1HB LEU 110 3.781 -3.275 1.436 838 HB3 LEU 110 2HB LEU 110 3.845 -4.091 -0.125 839 HG LEU 110 HG LEU 110 1.683 -4.638 1.894 840 HD11 LEU 110 1HD1 LEU 110 1.207 -2.434 1.549 841 HD12 LEU 110 2HD1 LEU 110 0.388 -3.136 0.155 842 HD13 LEU 110 3HD1 LEU 110 1.979 -2.397 -0.036 843 HD21 LEU 110 1HD2 LEU 110 0.839 -4.918 -0.777 844 HD22 LEU 110 2HD2 LEU 110 1.094 -6.188 0.420 845 HD23 LEU 110 3HD2 LEU 110 2.410 -5.712 -0.655 846 H MET 111 H MET 111 5.822 -4.312 3.294 847 HA MET 111 HA MET 111 8.105 -3.942 1.545 848 HB2 MET 111 1HB MET 111 7.332 -3.038 4.272 849 HB3 MET 111 2HB MET 111 9.050 -3.141 3.912 850 HG2 MET 111 1HG MET 111 6.996 -1.517 2.429 851 HG3 MET 111 2HG MET 111 8.255 -0.909 3.502 852 HE1 MET 111 1HE MET 111 10.634 -3.030 2.513 853 HE2 MET 111 2HE MET 111 11.491 -1.905 1.459 854 HE3 MET 111 3HE MET 111 10.864 -1.354 3.013 855 H GLY 112 H GLY 112 6.922 -6.413 3.446 856 HA2 GLY 112 1HA GLY 112 9.081 -7.459 4.813 857 HA3 GLY 112 2HA GLY 112 7.823 -8.434 4.067 858 H LYS 113 H LYS 113 8.755 -7.076 1.436 859 HA LYS 113 HA LYS 113 10.472 -9.224 0.643 860 HB2 LYS 113 1HB LYS 113 10.350 -8.299 -1.555 861 HB3 LYS 113 2HB LYS 113 8.755 -8.134 -0.832 862 HG2 LYS 113 1HG LYS 113 8.884 -5.861 -0.722 863 HG3 LYS 113 2HG LYS 113 10.644 -5.856 -0.585 864 HD2 LYS 113 1HD LYS 113 9.259 -6.711 -3.109 865 HD3 LYS 113 2HD LYS 113 9.612 -5.014 -2.775 866 HE2 LYS 113 1HE LYS 113 11.609 -7.270 -2.934 867 HE3 LYS 113 2HE LYS 113 11.373 -5.995 -4.128 868 HZ1 LYS 113 1HZ LYS 113 13.238 -5.418 -2.803 869 HZ2 LYS 113 2HZ LYS 113 12.399 -5.695 -1.360 870 HZ3 LYS 113 3HZ LYS 113 11.977 -4.386 -2.345 871 H GLY 114 H GLY 114 10.918 -5.897 1.601 872 HA2 GLY 114 1HA GLY 114 13.538 -5.546 0.577 873 HA3 GLY 114 2HA GLY 114 12.801 -4.608 1.868 874 H MET 115 H MET 115 12.317 -6.828 3.626 875 HA MET 115 HA MET 115 14.625 -6.834 5.140 876 HB2 MET 115 1HB MET 115 12.516 -8.999 5.048 877 HB3 MET 115 2HB MET 115 13.659 -8.732 6.357 878 HG2 MET 115 1HG MET 115 12.650 -6.644 6.910 879 HG3 MET 115 2HG MET 115 11.632 -6.697 5.473 880 HE1 MET 115 1HE MET 115 12.843 -8.714 8.305 881 HE2 MET 115 2HE MET 115 11.440 -8.871 9.362 882 HE3 MET 115 3HE MET 115 11.769 -10.105 8.145 883 H LYS 116 H LYS 116 16.087 -8.619 5.667 884 HA LYS 116 HA LYS 116 17.319 -9.669 3.333 885 HB2 LYS 116 1HB LYS 116 17.788 -10.163 6.273 886 HB3 LYS 116 2HB LYS 116 18.774 -10.888 5.009 887 HG2 LYS 116 1HG LYS 116 19.787 -8.915 4.472 888 HG3 LYS 116 2HG LYS 116 18.413 -7.939 4.994 889 HD2 LYS 116 1HD LYS 116 19.039 -8.838 7.363 890 HD3 LYS 116 2HD LYS 116 20.608 -9.155 6.620 891 HE2 LYS 116 1HE LYS 116 19.271 -6.476 6.400 892 HE3 LYS 116 2HE LYS 116 20.260 -6.901 7.796 893 HZ1 LYS 116 1HZ LYS 116 21.279 -7.154 5.032 894 HZ2 LYS 116 2HZ LYS 116 22.160 -7.098 6.475 895 HZ3 LYS 116 3HZ LYS 116 21.398 -5.704 5.894 896 H ARG 117 H ARG 117 15.448 -11.144 5.964 897 HA ARG 117 HA ARG 117 15.620 -13.785 4.891 898 HB2 ARG 117 1HB ARG 117 13.687 -12.649 6.921 899 HB3 ARG 117 2HB ARG 117 13.949 -14.358 6.596 900 HG2 ARG 117 1HG ARG 117 16.334 -14.031 7.288 901 HG3 ARG 117 2HG ARG 117 15.887 -12.403 7.806 902 HD2 ARG 117 1HD ARG 117 15.724 -13.667 9.757 903 HD3 ARG 117 2HD ARG 117 14.059 -13.565 9.186 904 HE ARG 117 HE ARG 117 15.472 -15.903 8.277 905 HH11 ARG 117 1HH1 ARG 117 13.532 -14.518 10.816 906 HH12 ARG 117 2HH1 ARG 117 12.965 -16.049 11.396 907 HH21 ARG 117 1HH2 ARG 117 14.734 -17.925 9.033 908 HH22 ARG 117 2HH2 ARG 117 13.651 -17.987 10.381 909 H VAL 118 H VAL 118 13.880 -15.036 4.023 910 HA VAL 118 HA VAL 118 11.540 -13.627 3.034 911 HB VAL 118 HB VAL 118 13.071 -13.175 1.236 912 HG11 VAL 118 1HG1 VAL 118 13.913 -15.940 1.740 913 HG12 VAL 118 2HG1 VAL 118 13.805 -15.499 0.035 914 HG13 VAL 118 3HG1 VAL 118 14.831 -14.567 1.126 915 HG21 VAL 118 1HG2 VAL 118 10.705 -14.719 0.946 916 HG22 VAL 118 2HG2 VAL 118 11.385 -13.528 -0.164 917 HG23 VAL 118 3HG2 VAL 118 11.849 -15.225 -0.298 918 H SER 119 H SER 119 9.801 -14.923 2.950 919 HA SER 119 HA SER 119 10.253 -17.819 3.246 920 HB2 SER 119 1HB SER 119 8.186 -15.989 4.437 921 HB3 SER 119 2HB SER 119 7.866 -17.715 4.273 922 HG SER 119 HG SER 119 10.152 -17.745 5.335 923 H GLY 120 H GLY 120 10.266 -18.133 0.971 924 HA2 GLY 120 1HA GLY 120 8.600 -19.256 -0.498 925 HA3 GLY 120 2HA GLY 120 7.602 -17.827 -0.274 926 HA PRO 121 HA PRO 121 9.319 -16.408 -4.085 927 HB2 PRO 121 1HB PRO 121 8.412 -13.853 -3.956 928 HB3 PRO 121 2HB PRO 121 7.366 -15.225 -4.337 929 HG2 PRO 121 1HG PRO 121 7.740 -13.795 -1.735 930 HG3 PRO 121 2HG PRO 121 6.241 -14.357 -2.496 931 HD2 PRO 121 1HD PRO 121 7.459 -15.718 -0.498 932 HD3 PRO 121 2HD PRO 121 6.547 -16.529 -1.787 933 H SER 122 H SER 122 11.512 -16.311 -3.950 934 HA SER 122 HA SER 122 12.967 -14.719 -2.138 935 HB2 SER 122 1HB SER 122 13.673 -16.132 -4.696 936 HB3 SER 122 2HB SER 122 14.856 -15.109 -3.881 937 HG SER 122 HG SER 122 14.828 -17.415 -3.297 938 H SER 123 H SER 123 14.686 -13.112 -3.072 939 HA SER 123 HA SER 123 13.742 -11.422 -5.208 940 HB2 SER 123 1HB SER 123 12.312 -10.593 -3.434 941 HB3 SER 123 2HB SER 123 13.692 -10.432 -2.347 942 HG SER 123 HG SER 123 13.057 -8.912 -4.638 943 H GLY 124 H GLY 124 15.637 -11.302 -6.249 944 HA2 GLY 124 1HA GLY 124 18.181 -11.556 -5.394 945 HA3 GLY 124 2HA GLY 124 17.744 -10.443 -6.683 Start of MODEL 7 1 H1 GLY 1 H GLY 1 18.231 2.989 -8.905 2 HA2 GLY 1 1HA GLY 1 16.522 5.037 -8.105 3 HA3 GLY 1 2HA GLY 1 15.858 3.541 -7.465 4 H SER 2 H SER 2 17.542 2.133 -6.313 5 HA SER 2 HA SER 2 19.368 3.850 -4.765 6 HB2 SER 2 1HB SER 2 17.433 1.761 -3.769 7 HB3 SER 2 2HB SER 2 18.813 2.291 -2.807 8 HG SER 2 HG SER 2 17.130 3.586 -2.228 9 H SER 3 H SER 3 21.360 3.038 -4.322 10 HA SER 3 HA SER 3 21.921 0.278 -5.177 11 HB2 SER 3 1HB SER 3 23.708 2.672 -5.665 12 HB3 SER 3 2HB SER 3 24.040 1.008 -6.144 13 HG SER 3 HG SER 3 21.852 2.575 -7.049 14 H GLY 4 H GLY 4 22.471 -0.828 -3.418 15 HA2 GLY 4 1HA GLY 4 24.278 -1.291 -1.856 16 HA3 GLY 4 2HA GLY 4 24.354 0.434 -1.528 17 H SER 5 H SER 5 21.674 -1.912 -1.614 18 HA SER 5 HA SER 5 20.020 -0.899 0.240 19 HB2 SER 5 1HB SER 5 20.803 -3.789 -0.150 20 HB3 SER 5 2HB SER 5 19.480 -3.296 0.908 21 HG SER 5 HG SER 5 19.710 -2.870 -1.886 22 H SER 6 H SER 6 19.851 -0.683 2.422 23 HA SER 6 HA SER 6 22.181 -1.526 4.020 24 HB2 SER 6 1HB SER 6 20.527 0.996 4.267 25 HB3 SER 6 2HB SER 6 21.749 0.491 5.435 26 HG SER 6 HG SER 6 22.820 1.811 4.074 27 H GLY 7 H GLY 7 18.748 -0.593 4.279 28 HA2 GLY 7 1HA GLY 7 17.227 -2.297 5.212 29 HA3 GLY 7 2HA GLY 7 18.480 -2.639 6.395 30 H ASN 8 H ASN 8 16.917 0.338 5.205 31 HA ASN 8 HA ASN 8 16.481 1.099 8.015 32 HB2 ASN 8 1HB ASN 8 16.486 3.000 5.674 33 HB3 ASN 8 2HB ASN 8 16.657 3.378 7.386 34 HD21 ASN 8 1HD2 ASN 8 18.345 3.808 4.905 35 HD22 ASN 8 2HD2 ASN 8 19.918 3.266 5.374 36 H ASP 9 H ASP 9 14.471 1.579 8.724 37 HA ASP 9 HA ASP 9 12.226 0.641 7.340 38 HB2 ASP 9 1HB ASP 9 12.487 2.490 9.712 39 HB3 ASP 9 2HB ASP 9 10.931 1.930 9.107 40 H ASP 10 H ASP 10 13.975 3.464 6.872 41 HA ASP 10 HA ASP 10 11.849 5.218 6.122 42 HB2 ASP 10 1HB ASP 10 14.695 5.448 5.164 43 HB3 ASP 10 2HB ASP 10 13.529 6.736 5.455 44 H ILE 11 H ILE 11 13.190 2.507 4.670 45 HA ILE 11 HA ILE 11 12.999 3.317 1.932 46 HB ILE 11 HB ILE 11 14.461 1.455 2.716 47 HG12 ILE 11 1HG1 ILE 11 12.481 0.411 0.704 48 HG13 ILE 11 2HG1 ILE 11 13.533 1.771 0.329 49 HG21 ILE 11 1HG2 ILE 11 12.692 -0.712 2.655 50 HG22 ILE 11 2HG2 ILE 11 13.591 -0.098 4.042 51 HG23 ILE 11 3HG2 ILE 11 11.955 0.479 3.727 52 HD11 ILE 11 1HD1 ILE 11 14.252 -1.081 0.851 53 HD12 ILE 11 2HD1 ILE 11 14.677 -0.051 -0.518 54 HD13 ILE 11 3HD1 ILE 11 15.442 0.205 1.050 55 H ILE 12 H ILE 12 10.724 2.480 4.281 56 HA ILE 12 HA ILE 12 8.792 1.063 2.862 57 HB ILE 12 HB ILE 12 8.272 3.172 4.961 58 HG12 ILE 12 1HG1 ILE 12 8.483 0.223 5.487 59 HG13 ILE 12 2HG1 ILE 12 9.928 1.226 5.464 60 HG21 ILE 12 1HG2 ILE 12 6.610 0.743 4.379 61 HG22 ILE 12 2HG2 ILE 12 6.177 2.181 5.301 62 HG23 ILE 12 3HG2 ILE 12 6.346 2.275 3.548 63 HD11 ILE 12 1HD1 ILE 12 7.746 1.086 7.438 64 HD12 ILE 12 2HD1 ILE 12 9.470 1.381 7.663 65 HD13 ILE 12 3HD1 ILE 12 8.416 2.684 7.114 66 H VAL 13 H VAL 13 9.532 4.496 2.896 67 HA VAL 13 HA VAL 13 7.231 5.134 1.238 68 HB VAL 13 HB VAL 13 9.472 6.925 2.187 69 HG11 VAL 13 1HG1 VAL 13 6.973 7.405 0.626 70 HG12 VAL 13 2HG1 VAL 13 7.585 8.660 1.704 71 HG13 VAL 13 3HG1 VAL 13 8.592 8.061 0.386 72 HG21 VAL 13 1HG2 VAL 13 8.397 6.335 4.147 73 HG22 VAL 13 2HG2 VAL 13 7.508 7.779 3.664 74 HG23 VAL 13 3HG2 VAL 13 6.825 6.181 3.362 75 H ASN 14 H ASN 14 10.773 5.177 0.984 76 HA ASN 14 HA ASN 14 10.996 6.155 -1.609 77 HB2 ASN 14 1HB ASN 14 12.831 5.626 0.149 78 HB3 ASN 14 2HB ASN 14 12.836 4.018 -0.569 79 HD21 ASN 14 1HD2 ASN 14 12.633 7.333 -1.827 80 HD22 ASN 14 2HD2 ASN 14 13.917 7.156 -2.970 81 H TRP 15 H TRP 15 10.898 2.755 -0.545 82 HA TRP 15 HA TRP 15 11.011 1.539 -3.027 83 HB2 TRP 15 1HB TRP 15 11.134 0.329 -0.877 84 HB3 TRP 15 2HB TRP 15 9.414 0.617 -0.627 85 HD1 TRP 15 HD TRP 15 11.588 -1.022 -3.410 86 HE1 TRP 15 1HE TRP 15 10.360 -3.135 -4.219 87 HE3 TRP 15 3HE TRP 15 7.415 -0.711 -0.473 88 HZ2 TRP 15 2HZ TRP 15 7.941 -4.490 -3.683 89 HZ3 TRP 15 3HZ TRP 15 5.693 -2.454 -0.683 90 HH2 TRP 15 HH TRP 15 5.952 -4.302 -2.256 91 H VAL 16 H VAL 16 8.059 2.339 -1.187 92 HA VAL 16 HA VAL 16 6.138 1.565 -2.967 93 HB VAL 16 HB VAL 16 6.079 4.104 -1.329 94 HG11 VAL 16 1HG1 VAL 16 3.584 3.628 -1.373 95 HG12 VAL 16 2HG1 VAL 16 4.299 4.229 -2.870 96 HG13 VAL 16 3HG1 VAL 16 3.924 2.513 -2.695 97 HG21 VAL 16 1HG2 VAL 16 5.425 2.889 0.496 98 HG22 VAL 16 2HG2 VAL 16 4.769 1.571 -0.475 99 HG23 VAL 16 3HG2 VAL 16 6.513 1.730 -0.265 100 H ASN 17 H ASN 17 7.941 4.618 -2.989 101 HA ASN 17 HA ASN 17 6.592 5.836 -5.120 102 HB2 ASN 17 1HB ASN 17 9.277 6.177 -3.856 103 HB3 ASN 17 2HB ASN 17 8.970 6.972 -5.397 104 HD21 ASN 17 1HD2 ASN 17 7.467 6.500 -2.221 105 HD22 ASN 17 2HD2 ASN 17 6.850 8.109 -2.085 106 H GLU 18 H GLU 18 9.757 4.185 -5.199 107 HA GLU 18 HA GLU 18 10.098 4.182 -7.951 108 HB2 GLU 18 1HB GLU 18 11.141 2.525 -5.711 109 HB3 GLU 18 2HB GLU 18 11.372 1.916 -7.343 110 HG2 GLU 18 1HG GLU 18 12.135 4.722 -6.665 111 HG3 GLU 18 2HG GLU 18 13.200 3.379 -6.250 112 H THR 19 H THR 19 8.938 1.435 -5.988 113 HA THR 19 HA THR 19 8.285 -0.382 -7.855 114 HB THR 19 HB THR 19 6.524 0.399 -5.524 115 HG1 THR 19 1HG THR 19 7.661 -1.350 -4.518 116 HG21 THR 19 1HG2 THR 19 6.399 -1.840 -7.481 117 HG22 THR 19 2HG2 THR 19 5.093 -0.965 -6.682 118 HG23 THR 19 3HG2 THR 19 6.010 -2.183 -5.797 119 H LEU 20 H LEU 20 6.351 2.480 -7.072 120 HA LEU 20 HA LEU 20 4.286 1.851 -8.956 121 HB2 LEU 20 1HB LEU 20 4.961 4.376 -7.459 122 HB3 LEU 20 2HB LEU 20 3.553 4.202 -8.505 123 HG LEU 20 HG LEU 20 4.019 2.434 -6.116 124 HD11 LEU 20 1HD1 LEU 20 3.762 5.089 -5.830 125 HD12 LEU 20 2HD1 LEU 20 3.089 3.919 -4.696 126 HD13 LEU 20 3HD1 LEU 20 2.061 4.633 -5.939 127 HD21 LEU 20 1HD2 LEU 20 2.107 1.461 -6.696 128 HD22 LEU 20 2HD2 LEU 20 2.211 2.332 -8.227 129 HD23 LEU 20 3HD2 LEU 20 1.297 3.016 -6.883 130 H ARG 21 H ARG 21 7.085 4.016 -8.914 131 HA ARG 21 HA ARG 21 6.625 5.355 -11.315 132 HB2 ARG 21 1HB ARG 21 8.377 5.933 -9.632 133 HB3 ARG 21 2HB ARG 21 9.314 4.555 -10.194 134 HG2 ARG 21 1HG ARG 21 8.446 6.569 -12.196 135 HG3 ARG 21 2HG ARG 21 9.756 6.991 -11.090 136 HD2 ARG 21 1HD ARG 21 10.979 6.047 -12.765 137 HD3 ARG 21 2HD ARG 21 10.638 4.603 -11.813 138 HE ARG 21 HE ARG 21 9.308 3.827 -13.514 139 HH11 ARG 21 1HH1 ARG 21 10.023 7.193 -14.041 140 HH12 ARG 21 2HH1 ARG 21 9.357 7.219 -15.640 141 HH21 ARG 21 1HH2 ARG 21 8.428 3.848 -15.618 142 HH22 ARG 21 2HH2 ARG 21 8.449 5.315 -16.536 143 H GLU 22 H GLU 22 8.503 2.386 -10.730 144 HA GLU 22 HA GLU 22 9.279 1.913 -13.366 145 HB2 GLU 22 1HB GLU 22 8.661 -0.146 -11.239 146 HB3 GLU 22 2HB GLU 22 9.636 -0.406 -12.679 147 HG2 GLU 22 1HG GLU 22 10.440 1.766 -10.825 148 HG3 GLU 22 2HG GLU 22 10.720 0.097 -10.332 149 H ALA 23 H ALA 23 6.283 1.184 -11.694 150 HA ALA 23 HA ALA 23 5.239 -0.359 -13.917 151 HB1 ALA 23 1HB ALA 23 3.114 -0.241 -12.441 152 HB2 ALA 23 2HB ALA 23 4.485 -1.211 -11.901 153 HB3 ALA 23 3HB ALA 23 4.209 0.388 -11.210 154 H GLU 24 H GLU 24 5.560 2.884 -13.206 155 HA GLU 24 HA GLU 24 4.774 4.769 -14.216 156 HB2 GLU 24 1HB GLU 24 3.109 3.023 -16.020 157 HB3 GLU 24 2HB GLU 24 3.728 4.637 -16.341 158 HG2 GLU 24 1HG GLU 24 5.868 3.880 -16.758 159 HG3 GLU 24 2HG GLU 24 5.621 2.380 -15.867 160 H LYS 25 H LYS 25 3.587 4.102 -11.898 161 HA LYS 25 HA LYS 25 0.694 4.275 -12.285 162 HB2 LYS 25 1HB LYS 25 2.482 3.501 -10.038 163 HB3 LYS 25 2HB LYS 25 0.935 4.223 -9.621 164 HG2 LYS 25 1HG LYS 25 0.965 1.723 -9.710 165 HG3 LYS 25 2HG LYS 25 -0.268 2.496 -10.709 166 HD2 LYS 25 1HD LYS 25 1.142 2.216 -12.681 167 HD3 LYS 25 2HD LYS 25 2.398 1.472 -11.688 168 HE2 LYS 25 1HE LYS 25 -0.397 0.399 -12.061 169 HE3 LYS 25 2HE LYS 25 1.038 -0.188 -12.900 170 HZ1 LYS 25 1HZ LYS 25 1.937 -1.014 -10.917 171 HZ2 LYS 25 2HZ LYS 25 0.307 -1.469 -10.868 172 HZ3 LYS 25 3HZ LYS 25 0.847 -0.156 -9.947 173 H SER 26 H SER 26 -0.556 5.961 -11.484 174 HA SER 26 HA SER 26 0.868 8.488 -11.214 175 HB2 SER 26 1HB SER 26 -1.157 8.126 -12.744 176 HB3 SER 26 2HB SER 26 -2.127 8.131 -11.270 177 HG SER 26 HG SER 26 -1.172 10.212 -12.636 178 H SER 27 H SER 27 0.472 6.282 -9.084 179 HA SER 27 HA SER 27 -0.624 8.026 -6.978 180 HB2 SER 27 1HB SER 27 -1.304 6.105 -5.770 181 HB3 SER 27 2HB SER 27 -1.752 5.774 -7.443 182 HG SER 27 HG SER 27 -0.199 4.297 -7.589 183 H SER 28 H SER 28 0.430 8.012 -4.914 184 HA SER 28 HA SER 28 2.886 6.728 -4.413 185 HB2 SER 28 1HB SER 28 3.401 8.532 -6.262 186 HB3 SER 28 2HB SER 28 3.361 9.645 -4.895 187 HG SER 28 HG SER 28 5.034 7.379 -5.225 188 H ILE 29 H ILE 29 4.022 7.718 -2.484 189 HA ILE 29 HA ILE 29 2.142 9.218 -0.789 190 HB ILE 29 HB ILE 29 2.974 7.815 1.149 191 HG12 ILE 29 1HG1 ILE 29 3.581 5.667 -0.833 192 HG13 ILE 29 2HG1 ILE 29 4.830 6.859 -0.489 193 HG21 ILE 29 1HG2 ILE 29 1.545 5.751 0.121 194 HG22 ILE 29 2HG2 ILE 29 0.838 7.222 0.789 195 HG23 ILE 29 3HG2 ILE 29 1.067 7.067 -0.952 196 HD11 ILE 29 1HD1 ILE 29 4.823 6.270 1.835 197 HD12 ILE 29 2HD1 ILE 29 3.450 5.187 1.596 198 HD13 ILE 29 3HD1 ILE 29 5.011 4.807 0.868 199 H SER 30 H SER 30 3.078 10.523 0.817 200 HA SER 30 HA SER 30 5.869 11.229 0.264 201 HB2 SER 30 1HB SER 30 3.727 12.771 1.751 202 HB3 SER 30 2HB SER 30 5.354 13.355 1.402 203 HG SER 30 HG SER 30 4.422 12.588 -0.895 204 H SER 31 H SER 31 3.699 10.272 2.858 205 HA SER 31 HA SER 31 5.860 9.233 4.409 206 HB2 SER 31 1HB SER 31 5.933 11.720 4.906 207 HB3 SER 31 2HB SER 31 4.352 11.531 5.664 208 HG SER 31 HG SER 31 6.401 9.797 6.438 209 H PHE 32 H PHE 32 5.044 8.375 6.551 210 HA PHE 32 HA PHE 32 3.009 6.591 6.227 211 HB2 PHE 32 1HB PHE 32 4.239 7.847 8.641 212 HB3 PHE 32 2HB PHE 32 2.802 6.853 8.857 213 HD1 PHE 32 2HD PHE 32 2.872 4.490 7.812 214 HD2 PHE 32 1HD PHE 32 6.326 6.860 8.569 215 HE1 PHE 32 2HE PHE 32 4.268 2.464 7.772 216 HE2 PHE 32 1HE PHE 32 7.726 4.838 8.529 217 HZ PHE 32 HZ PHE 32 6.698 2.637 8.131 218 H LYS 33 H LYS 33 2.754 9.961 7.070 219 HA LYS 33 HA LYS 33 -0.143 9.680 7.463 220 HB2 LYS 33 1HB LYS 33 1.897 11.638 8.386 221 HB3 LYS 33 2HB LYS 33 0.275 12.247 8.080 222 HG2 LYS 33 1HG LYS 33 -0.639 11.097 9.822 223 HG3 LYS 33 2HG LYS 33 0.556 9.800 9.738 224 HD2 LYS 33 1HD LYS 33 1.494 12.518 10.494 225 HD3 LYS 33 2HD LYS 33 0.574 11.597 11.686 226 HE2 LYS 33 1HE LYS 33 2.151 9.804 11.617 227 HE3 LYS 33 2HE LYS 33 2.986 10.517 10.238 228 HZ1 LYS 33 1HZ LYS 33 3.172 12.497 11.998 229 HZ2 LYS 33 2HZ LYS 33 4.339 11.283 11.845 230 HZ3 LYS 33 3HZ LYS 33 3.166 11.180 13.060 231 H ASP 34 H ASP 34 0.615 9.341 4.880 232 HA ASP 34 HA ASP 34 0.488 11.849 3.451 233 HB2 ASP 34 1HB ASP 34 1.822 10.254 2.364 234 HB3 ASP 34 2HB ASP 34 0.655 8.963 2.629 235 HA PRO 35 HA PRO 35 -3.902 12.087 3.181 236 HB2 PRO 35 1HB PRO 35 -4.088 13.717 1.017 237 HB3 PRO 35 2HB PRO 35 -3.591 14.292 2.613 238 HG2 PRO 35 1HG PRO 35 -1.903 13.580 0.246 239 HG3 PRO 35 2HG PRO 35 -1.754 14.958 1.352 240 HD2 PRO 35 1HD PRO 35 -0.198 12.751 1.557 241 HD3 PRO 35 2HD PRO 35 -0.692 13.705 2.969 242 H LYS 36 H LYS 36 -2.158 11.571 0.117 243 HA LYS 36 HA LYS 36 -4.181 10.644 -1.476 244 HB2 LYS 36 1HB LYS 36 -1.385 9.495 -1.361 245 HB3 LYS 36 2HB LYS 36 -2.492 9.404 -2.725 246 HG2 LYS 36 1HG LYS 36 -1.496 12.007 -1.603 247 HG3 LYS 36 2HG LYS 36 -0.669 11.129 -2.891 248 HD2 LYS 36 1HD LYS 36 -2.890 11.174 -4.133 249 HD3 LYS 36 2HD LYS 36 -3.413 12.358 -2.934 250 HE2 LYS 36 1HE LYS 36 -1.498 13.783 -3.545 251 HE3 LYS 36 2HE LYS 36 -1.040 12.611 -4.779 252 HZ1 LYS 36 1HZ LYS 36 -2.275 14.387 -5.780 253 HZ2 LYS 36 2HZ LYS 36 -3.553 14.189 -4.690 254 HZ3 LYS 36 3HZ LYS 36 -3.218 12.984 -5.829 255 H ILE 37 H ILE 37 -2.476 8.917 1.066 256 HA ILE 37 HA ILE 37 -3.238 6.313 0.578 257 HB ILE 37 HB ILE 37 -3.112 7.621 3.298 258 HG12 ILE 37 1HG1 ILE 37 -0.965 6.402 1.556 259 HG13 ILE 37 2HG1 ILE 37 -1.050 8.058 2.149 260 HG21 ILE 37 1HG2 ILE 37 -3.022 5.534 4.242 261 HG22 ILE 37 2HG2 ILE 37 -4.109 5.227 2.890 262 HG23 ILE 37 3HG2 ILE 37 -2.409 4.776 2.774 263 HD11 ILE 37 1HD1 ILE 37 0.256 5.864 3.311 264 HD12 ILE 37 2HD1 ILE 37 0.087 7.496 3.956 265 HD13 ILE 37 3HD1 ILE 37 -1.103 6.259 4.363 266 H SER 38 H SER 38 -5.137 8.954 1.873 267 HA SER 38 HA SER 38 -7.260 7.663 3.039 268 HB2 SER 38 1HB SER 38 -6.788 10.217 2.616 269 HB3 SER 38 2HB SER 38 -7.821 9.968 1.209 270 HG SER 38 HG SER 38 -8.716 10.549 3.476 271 H THR 39 H THR 39 -6.731 8.271 -0.409 272 HA THR 39 HA THR 39 -9.191 6.955 -1.159 273 HB THR 39 HB THR 39 -8.443 7.323 -3.481 274 HG1 THR 39 1HG THR 39 -6.061 7.981 -2.153 275 HG21 THR 39 1HG2 THR 39 -7.837 9.952 -2.314 276 HG22 THR 39 2HG2 THR 39 -9.313 9.197 -1.710 277 HG23 THR 39 3HG2 THR 39 -9.109 9.475 -3.440 278 H SER 40 H SER 40 -6.139 5.921 -0.273 279 HA SER 40 HA SER 40 -5.140 3.875 -0.274 280 HB2 SER 40 1HB SER 40 -7.630 2.842 -1.649 281 HB3 SER 40 2HB SER 40 -6.444 1.903 -0.741 282 HG SER 40 HG SER 40 -7.334 2.523 1.077 283 H LEU 41 H LEU 41 -4.983 5.773 -2.538 284 HA LEU 41 HA LEU 41 -4.846 4.327 -4.974 285 HB2 LEU 41 1HB LEU 41 -3.847 6.974 -4.024 286 HB3 LEU 41 2HB LEU 41 -3.278 6.336 -5.564 287 HG LEU 41 HG LEU 41 -6.176 6.814 -4.876 288 HD11 LEU 41 1HD1 LEU 41 -5.285 8.525 -6.926 289 HD12 LEU 41 2HD1 LEU 41 -4.125 8.661 -5.604 290 HD13 LEU 41 3HD1 LEU 41 -5.838 8.960 -5.308 291 HD21 LEU 41 1HD2 LEU 41 -5.165 5.139 -6.754 292 HD22 LEU 41 2HD2 LEU 41 -5.280 6.644 -7.667 293 HD23 LEU 41 3HD2 LEU 41 -6.713 5.973 -6.888 294 HA PRO 42 HA PRO 42 -0.088 4.199 -4.059 295 HB2 PRO 42 1HB PRO 42 0.666 4.680 -1.496 296 HB3 PRO 42 2HB PRO 42 0.534 5.954 -2.714 297 HG2 PRO 42 1HG PRO 42 -1.406 5.172 -0.572 298 HG3 PRO 42 2HG PRO 42 -0.907 6.792 -1.093 299 HD2 PRO 42 1HD PRO 42 -3.237 5.662 -1.882 300 HD3 PRO 42 2HD PRO 42 -2.321 6.780 -2.912 301 H VAL 43 H VAL 43 -2.464 3.102 -1.759 302 HA VAL 43 HA VAL 43 -0.881 0.847 -0.873 303 HB VAL 43 HB VAL 43 -3.820 1.324 -0.386 304 HG11 VAL 43 1HG1 VAL 43 -3.119 0.033 1.757 305 HG12 VAL 43 2HG1 VAL 43 -3.386 -0.856 0.255 306 HG13 VAL 43 3HG1 VAL 43 -1.744 -0.483 0.780 307 HG21 VAL 43 1HG2 VAL 43 -2.102 1.987 1.834 308 HG22 VAL 43 2HG2 VAL 43 -1.717 2.971 0.422 309 HG23 VAL 43 3HG2 VAL 43 -3.361 2.952 1.061 310 H LEU 44 H LEU 44 -3.511 1.485 -3.113 311 HA LEU 44 HA LEU 44 -3.967 -1.306 -3.677 312 HB2 LEU 44 1HB LEU 44 -4.966 1.235 -4.944 313 HB3 LEU 44 2HB LEU 44 -5.410 -0.371 -5.520 314 HG LEU 44 HG LEU 44 -5.950 0.540 -2.703 315 HD11 LEU 44 1HD1 LEU 44 -7.006 1.873 -4.753 316 HD12 LEU 44 2HD1 LEU 44 -7.908 1.523 -3.278 317 HD13 LEU 44 3HD1 LEU 44 -8.128 0.512 -4.707 318 HD21 LEU 44 1HD2 LEU 44 -7.611 -1.249 -2.769 319 HD22 LEU 44 2HD2 LEU 44 -5.994 -1.868 -3.110 320 HD23 LEU 44 3HD2 LEU 44 -7.144 -1.630 -4.427 321 H ASP 45 H ASP 45 -2.657 1.456 -5.509 322 HA ASP 45 HA ASP 45 -1.893 0.015 -7.784 323 HB2 ASP 45 1HB ASP 45 -0.687 2.533 -6.618 324 HB3 ASP 45 2HB ASP 45 -0.378 1.927 -8.242 325 H LEU 46 H LEU 46 -0.091 0.799 -4.835 326 HA LEU 46 HA LEU 46 2.415 -0.111 -5.499 327 HB2 LEU 46 1HB LEU 46 2.154 0.928 -3.413 328 HB3 LEU 46 2HB LEU 46 0.886 -0.193 -2.920 329 HG LEU 46 HG LEU 46 2.495 -1.950 -2.589 330 HD11 LEU 46 1HD1 LEU 46 4.047 -0.499 -4.413 331 HD12 LEU 46 2HD1 LEU 46 4.460 -2.017 -3.615 332 HD13 LEU 46 3HD1 LEU 46 4.943 -0.482 -2.893 333 HD21 LEU 46 1HD2 LEU 46 2.238 -0.624 -0.666 334 HD22 LEU 46 2HD2 LEU 46 3.195 0.695 -1.344 335 HD23 LEU 46 3HD2 LEU 46 3.980 -0.811 -0.867 336 H ILE 47 H ILE 47 -0.392 -1.998 -4.496 337 HA ILE 47 HA ILE 47 0.969 -4.486 -4.326 338 HB ILE 47 HB ILE 47 -1.968 -3.921 -4.750 339 HG12 ILE 47 1HG1 ILE 47 -0.659 -4.809 -2.193 340 HG13 ILE 47 2HG1 ILE 47 -0.738 -3.104 -2.622 341 HG21 ILE 47 1HG2 ILE 47 -1.244 -6.436 -3.477 342 HG22 ILE 47 2HG2 ILE 47 -2.386 -6.114 -4.781 343 HG23 ILE 47 3HG2 ILE 47 -0.671 -6.313 -5.140 344 HD11 ILE 47 1HD1 ILE 47 -2.725 -3.060 -1.651 345 HD12 ILE 47 2HD1 ILE 47 -3.325 -4.046 -2.986 346 HD13 ILE 47 3HD1 ILE 47 -2.760 -4.817 -1.503 347 H ASP 48 H ASP 48 -1.068 -3.020 -6.846 348 HA ASP 48 HA ASP 48 -1.021 -5.097 -8.686 349 HB2 ASP 48 1HB ASP 48 -2.338 -2.890 -8.756 350 HB3 ASP 48 2HB ASP 48 -0.902 -2.202 -9.507 351 H ALA 49 H ALA 49 1.182 -2.304 -8.488 352 HA ALA 49 HA ALA 49 2.851 -2.667 -10.560 353 HB1 ALA 49 1HB ALA 49 3.264 -0.898 -9.025 354 HB2 ALA 49 2HB ALA 49 3.606 -2.029 -7.715 355 HB3 ALA 49 3HB ALA 49 4.720 -1.892 -9.076 356 H ILE 50 H ILE 50 2.986 -4.531 -7.542 357 HA ILE 50 HA ILE 50 5.176 -6.156 -8.431 358 HB ILE 50 HB ILE 50 3.274 -6.658 -6.140 359 HG12 ILE 50 1HG1 ILE 50 5.981 -5.308 -6.115 360 HG13 ILE 50 2HG1 ILE 50 4.440 -4.465 -6.000 361 HG21 ILE 50 1HG2 ILE 50 5.810 -7.685 -5.581 362 HG22 ILE 50 2HG2 ILE 50 4.347 -8.594 -5.954 363 HG23 ILE 50 3HG2 ILE 50 5.467 -8.159 -7.245 364 HD11 ILE 50 1HD1 ILE 50 5.980 -5.425 -3.909 365 HD12 ILE 50 2HD1 ILE 50 4.317 -4.841 -3.823 366 HD13 ILE 50 3HD1 ILE 50 4.638 -6.562 -4.031 367 H GLN 51 H GLN 51 1.810 -7.011 -7.599 368 HA GLN 51 HA GLN 51 1.993 -9.220 -9.532 369 HB2 GLN 51 1HB GLN 51 1.458 -9.572 -6.999 370 HB3 GLN 51 2HB GLN 51 -0.150 -9.020 -7.447 371 HG2 GLN 51 1HG GLN 51 -0.614 -10.891 -8.654 372 HG3 GLN 51 2HG GLN 51 1.075 -11.172 -9.076 373 HE21 GLN 51 1HE2 GLN 51 2.366 -12.355 -7.717 374 HE22 GLN 51 2HE2 GLN 51 1.752 -13.243 -6.369 375 HA PRO 52 HA PRO 52 -0.806 -6.343 -11.696 376 HB2 PRO 52 1HB PRO 52 -0.216 -7.305 -14.165 377 HB3 PRO 52 2HB PRO 52 0.785 -6.106 -13.336 378 HG2 PRO 52 1HG PRO 52 1.175 -9.065 -13.567 379 HG3 PRO 52 2HG PRO 52 2.370 -7.765 -13.717 380 HD2 PRO 52 1HD PRO 52 2.090 -9.232 -11.459 381 HD3 PRO 52 2HD PRO 52 2.585 -7.528 -11.434 382 H GLY 53 H GLY 53 -2.897 -6.718 -12.158 383 HA2 GLY 53 1HA GLY 53 -4.517 -8.088 -13.405 384 HA3 GLY 53 2HA GLY 53 -3.689 -9.500 -12.765 385 H SER 54 H SER 54 -3.403 -8.285 -10.097 386 HA SER 54 HA SER 54 -5.799 -9.266 -8.959 387 HB2 SER 54 1HB SER 54 -4.857 -8.300 -6.823 388 HB3 SER 54 2HB SER 54 -3.782 -9.410 -7.672 389 HG SER 54 HG SER 54 -2.654 -7.634 -8.477 390 H ILE 55 H ILE 55 -4.468 -5.955 -8.979 391 HA ILE 55 HA ILE 55 -6.981 -4.836 -8.130 392 HB ILE 55 HB ILE 55 -4.545 -3.377 -9.157 393 HG12 ILE 55 1HG1 ILE 55 -3.831 -4.694 -7.291 394 HG13 ILE 55 2HG1 ILE 55 -4.061 -3.053 -6.701 395 HG21 ILE 55 1HG2 ILE 55 -6.714 -2.384 -7.321 396 HG22 ILE 55 2HG2 ILE 55 -5.436 -1.447 -8.094 397 HG23 ILE 55 3HG2 ILE 55 -6.730 -2.143 -9.069 398 HD11 ILE 55 1HD1 ILE 55 -5.023 -4.330 -5.045 399 HD12 ILE 55 2HD1 ILE 55 -6.416 -3.892 -6.035 400 HD13 ILE 55 3HD1 ILE 55 -5.694 -5.494 -6.186 401 H ASN 56 H ASN 56 -8.375 -3.545 -9.318 402 HA ASN 56 HA ASN 56 -7.911 -3.343 -12.205 403 HB2 ASN 56 1HB ASN 56 -9.436 -5.348 -11.394 404 HB3 ASN 56 2HB ASN 56 -10.654 -4.081 -11.276 405 HD21 ASN 56 1HD2 ASN 56 -11.829 -5.123 -12.927 406 HD22 ASN 56 2HD2 ASN 56 -11.363 -4.973 -14.583 407 H TYR 57 H TYR 57 -7.811 -1.191 -12.423 408 HA TYR 57 HA TYR 57 -9.074 0.713 -10.829 409 HB2 TYR 57 1HB TYR 57 -8.201 0.973 -13.714 410 HB3 TYR 57 2HB TYR 57 -8.558 2.313 -12.632 411 HD1 TYR 57 2HD TYR 57 -7.235 1.681 -10.174 412 HD2 TYR 57 1HD TYR 57 -5.936 0.928 -14.155 413 HE1 TYR 57 2HE TYR 57 -4.898 1.689 -9.407 414 HE2 TYR 57 1HE TYR 57 -3.595 0.934 -13.398 415 HH TYR 57 HH TYR 57 -2.745 1.716 -10.060 416 H ASP 58 H ASP 58 -10.187 -0.970 -13.695 417 HA ASP 58 HA ASP 58 -12.338 0.569 -14.465 418 HB2 ASP 58 1HB ASP 58 -12.049 -1.198 -15.894 419 HB3 ASP 58 2HB ASP 58 -11.705 -2.334 -14.592 420 H LEU 59 H LEU 59 -12.098 -1.684 -11.773 421 HA LEU 59 HA LEU 59 -14.896 -1.331 -11.079 422 HB2 LEU 59 1HB LEU 59 -12.781 -2.771 -9.496 423 HB3 LEU 59 2HB LEU 59 -14.531 -2.956 -9.382 424 HG LEU 59 HG LEU 59 -12.794 -3.835 -11.688 425 HD11 LEU 59 1HD1 LEU 59 -13.207 -5.058 -9.243 426 HD12 LEU 59 2HD1 LEU 59 -12.647 -5.833 -10.724 427 HD13 LEU 59 3HD1 LEU 59 -14.362 -5.848 -10.317 428 HD21 LEU 59 1HD2 LEU 59 -14.708 -3.552 -12.836 429 HD22 LEU 59 2HD2 LEU 59 -15.699 -3.494 -11.379 430 HD23 LEU 59 3HD2 LEU 59 -15.186 -5.049 -12.037 431 H LEU 60 H LEU 60 -11.724 -0.318 -9.958 432 HA LEU 60 HA LEU 60 -12.435 0.763 -7.484 433 HB2 LEU 60 1HB LEU 60 -10.320 1.694 -9.419 434 HB3 LEU 60 2HB LEU 60 -10.427 2.167 -7.724 435 HG LEU 60 HG LEU 60 -9.917 -0.628 -8.741 436 HD11 LEU 60 1HD1 LEU 60 -7.819 0.070 -8.981 437 HD12 LEU 60 2HD1 LEU 60 -7.765 0.229 -7.226 438 HD13 LEU 60 3HD1 LEU 60 -8.171 1.625 -8.224 439 HD21 LEU 60 1HD2 LEU 60 -11.094 -0.717 -6.654 440 HD22 LEU 60 2HD2 LEU 60 -10.043 0.515 -5.954 441 HD23 LEU 60 3HD2 LEU 60 -9.394 -1.078 -6.351 442 H LYS 61 H LYS 61 -12.402 3.146 -6.965 443 HA LYS 61 HA LYS 61 -14.164 4.550 -8.854 444 HB2 LYS 61 1HB LYS 61 -13.933 4.517 -5.882 445 HB3 LYS 61 2HB LYS 61 -14.478 6.002 -6.650 446 HG2 LYS 61 1HG LYS 61 -16.441 4.864 -6.138 447 HG3 LYS 61 2HG LYS 61 -16.192 4.538 -7.854 448 HD2 LYS 61 1HD LYS 61 -15.584 2.339 -7.482 449 HD3 LYS 61 2HD LYS 61 -15.102 2.648 -5.812 450 HE2 LYS 61 1HE LYS 61 -17.075 1.574 -5.433 451 HE3 LYS 61 2HE LYS 61 -17.674 3.227 -5.566 452 HZ1 LYS 61 1HZ LYS 61 -18.467 2.846 -7.704 453 HZ2 LYS 61 2HZ LYS 61 -18.863 1.421 -6.885 454 HZ3 LYS 61 3HZ LYS 61 -17.530 1.455 -7.926 455 H THR 62 H THR 62 -11.603 5.272 -6.477 456 HA THR 62 HA THR 62 -10.186 7.080 -6.335 457 HB THR 62 HB THR 62 -9.008 5.525 -7.847 458 HG1 THR 62 1HG THR 62 -7.752 7.297 -8.930 459 HG21 THR 62 1HG2 THR 62 -10.218 7.185 -10.061 460 HG22 THR 62 2HG2 THR 62 -10.650 5.518 -9.677 461 HG23 THR 62 3HG2 THR 62 -9.028 5.899 -10.257 462 H GLU 63 H GLU 63 -12.946 7.757 -7.152 463 HA GLU 63 HA GLU 63 -12.334 10.328 -8.445 464 HB2 GLU 63 1HB GLU 63 -14.508 10.221 -9.611 465 HB3 GLU 63 2HB GLU 63 -13.417 8.936 -10.110 466 HG2 GLU 63 1HG GLU 63 -15.299 7.712 -9.862 467 HG3 GLU 63 2HG GLU 63 -14.701 7.616 -8.206 468 H ASN 64 H ASN 64 -12.609 11.811 -6.914 469 HA ASN 64 HA ASN 64 -13.383 12.830 -5.004 470 HB2 ASN 64 1HB ASN 64 -15.739 13.519 -5.206 471 HB3 ASN 64 2HB ASN 64 -14.887 13.684 -6.738 472 HD21 ASN 64 1HD2 ASN 64 -15.544 12.530 -8.472 473 HD22 ASN 64 2HD2 ASN 64 -16.915 11.479 -8.471 474 H LEU 65 H LEU 65 -12.952 10.091 -4.550 475 HA LEU 65 HA LEU 65 -14.911 8.526 -3.522 476 HB2 LEU 65 1HB LEU 65 -12.134 9.055 -2.517 477 HB3 LEU 65 2HB LEU 65 -13.185 7.872 -1.738 478 HG LEU 65 HG LEU 65 -12.717 7.637 -4.671 479 HD11 LEU 65 1HD1 LEU 65 -10.673 6.387 -4.318 480 HD12 LEU 65 2HD1 LEU 65 -10.740 6.719 -2.587 481 HD13 LEU 65 3HD1 LEU 65 -10.484 8.039 -3.729 482 HD21 LEU 65 1HD2 LEU 65 -13.065 5.332 -4.264 483 HD22 LEU 65 2HD2 LEU 65 -14.287 6.191 -3.325 484 HD23 LEU 65 3HD2 LEU 65 -12.859 5.532 -2.524 485 H ASN 66 H ASN 66 -15.620 8.124 -1.289 486 HA ASN 66 HA ASN 66 -15.593 10.449 0.474 487 HB2 ASN 66 1HB ASN 66 -18.172 9.974 0.753 488 HB3 ASN 66 2HB ASN 66 -17.588 11.026 -0.533 489 HD21 ASN 66 1HD2 ASN 66 -19.300 8.212 0.238 490 HD22 ASN 66 2HD2 ASN 66 -19.576 7.648 -1.371 491 H ASP 67 H ASP 67 -16.499 9.951 2.627 492 HA ASP 67 HA ASP 67 -15.351 7.924 3.940 493 HB2 ASP 67 1HB ASP 67 -18.067 9.138 4.431 494 HB3 ASP 67 2HB ASP 67 -17.340 7.982 5.545 495 H ASP 68 H ASP 68 -18.176 7.648 1.916 496 HA ASP 68 HA ASP 68 -18.827 4.976 2.760 497 HB2 ASP 68 1HB ASP 68 -20.370 6.808 1.693 498 HB3 ASP 68 2HB ASP 68 -19.772 6.153 0.172 499 H GLU 69 H GLU 69 -17.819 6.259 -0.416 500 HA GLU 69 HA GLU 69 -17.143 3.793 -1.531 501 HB2 GLU 69 1HB GLU 69 -15.905 6.473 -2.183 502 HB3 GLU 69 2HB GLU 69 -15.934 5.056 -3.223 503 HG2 GLU 69 1HG GLU 69 -18.500 6.227 -2.259 504 HG3 GLU 69 2HG GLU 69 -17.630 6.992 -3.588 505 H LYS 70 H LYS 70 -14.992 6.236 -0.078 506 HA LYS 70 HA LYS 70 -12.552 5.141 -0.322 507 HB2 LYS 70 1HB LYS 70 -13.738 6.335 2.187 508 HB3 LYS 70 2HB LYS 70 -12.021 6.022 1.968 509 HG2 LYS 70 1HG LYS 70 -12.077 7.525 -0.022 510 HG3 LYS 70 2HG LYS 70 -13.739 7.936 0.407 511 HD2 LYS 70 1HD LYS 70 -13.056 8.905 2.467 512 HD3 LYS 70 2HD LYS 70 -11.422 8.256 2.305 513 HE2 LYS 70 1HE LYS 70 -10.883 9.758 0.582 514 HE3 LYS 70 2HE LYS 70 -12.573 10.170 0.298 515 HZ1 LYS 70 1HZ LYS 70 -10.818 11.019 2.515 516 HZ2 LYS 70 2HZ LYS 70 -12.501 11.077 2.668 517 HZ3 LYS 70 3HZ LYS 70 -11.731 11.978 1.461 518 H LEU 71 H LEU 71 -14.832 4.228 2.261 519 HA LEU 71 HA LEU 71 -13.358 2.300 3.539 520 HB2 LEU 71 1HB LEU 71 -15.455 2.930 4.436 521 HB3 LEU 71 2HB LEU 71 -16.305 2.449 2.969 522 HG LEU 71 HG LEU 71 -15.792 0.086 3.490 523 HD11 LEU 71 1HD1 LEU 71 -14.716 1.221 6.068 524 HD12 LEU 71 2HD1 LEU 71 -13.774 0.426 4.806 525 HD13 LEU 71 3HD1 LEU 71 -14.973 -0.490 5.721 526 HD21 LEU 71 1HD2 LEU 71 -17.482 -0.170 5.119 527 HD22 LEU 71 2HD2 LEU 71 -17.891 1.294 4.223 528 HD23 LEU 71 3HD2 LEU 71 -17.153 1.415 5.821 529 H ASN 72 H ASN 72 -15.737 1.608 0.967 530 HA ASN 72 HA ASN 72 -15.272 -1.047 0.583 531 HB2 ASN 72 1HB ASN 72 -15.764 1.032 -1.559 532 HB3 ASN 72 2HB ASN 72 -15.947 -0.705 -1.784 533 HD21 ASN 72 1HD2 ASN 72 -17.203 2.125 -0.175 534 HD22 ASN 72 2HD2 ASN 72 -18.751 1.460 0.208 535 H ASN 73 H ASN 73 -13.354 1.638 -0.678 536 HA ASN 73 HA ASN 73 -11.620 0.068 -2.271 537 HB2 ASN 73 1HB ASN 73 -11.588 2.855 -1.202 538 HB3 ASN 73 2HB ASN 73 -10.085 2.187 -1.829 539 HD21 ASN 73 1HD2 ASN 73 -10.669 4.182 -3.220 540 HD22 ASN 73 2HD2 ASN 73 -11.500 3.827 -4.692 541 H ALA 74 H ALA 74 -11.474 1.187 1.074 542 HA ALA 74 HA ALA 74 -8.843 0.376 1.637 543 HB1 ALA 74 1HB ALA 74 -9.382 0.664 3.927 544 HB2 ALA 74 2HB ALA 74 -10.297 1.883 3.036 545 HB3 ALA 74 3HB ALA 74 -11.103 0.427 3.623 546 H LYS 75 H LYS 75 -11.939 -1.307 2.115 547 HA LYS 75 HA LYS 75 -10.932 -3.636 3.277 548 HB2 LYS 75 1HB LYS 75 -13.331 -3.394 1.453 549 HB3 LYS 75 2HB LYS 75 -13.025 -4.692 2.600 550 HG2 LYS 75 1HG LYS 75 -13.157 -3.058 4.440 551 HG3 LYS 75 2HG LYS 75 -13.549 -1.802 3.265 552 HD2 LYS 75 1HD LYS 75 -15.162 -4.326 3.600 553 HD3 LYS 75 2HD LYS 75 -15.521 -2.821 4.452 554 HE2 LYS 75 1HE LYS 75 -15.944 -1.675 2.408 555 HE3 LYS 75 2HE LYS 75 -15.311 -3.017 1.454 556 HZ1 LYS 75 1HZ LYS 75 -17.244 -4.105 1.570 557 HZ2 LYS 75 2HZ LYS 75 -17.914 -2.614 2.002 558 HZ3 LYS 75 3HZ LYS 75 -17.492 -3.731 3.202 559 H TYR 76 H TYR 76 -11.388 -2.786 -0.127 560 HA TYR 76 HA TYR 76 -10.725 -5.284 -1.223 561 HB2 TYR 76 1HB TYR 76 -11.792 -3.352 -2.438 562 HB3 TYR 76 2HB TYR 76 -10.206 -2.591 -2.494 563 HD1 TYR 76 1HD TYR 76 -11.543 -6.020 -3.186 564 HD2 TYR 76 2HD TYR 76 -9.207 -2.739 -4.559 565 HE1 TYR 76 1HE TYR 76 -11.032 -7.256 -5.250 566 HE2 TYR 76 2HE TYR 76 -8.690 -3.966 -6.627 567 HH TYR 76 HH TYR 76 -9.288 -7.275 -7.000 568 H ALA 77 H ALA 77 -8.710 -2.423 -0.596 569 HA ALA 77 HA ALA 77 -6.302 -3.335 -1.605 570 HB1 ALA 77 1HB ALA 77 -5.747 -1.894 0.777 571 HB2 ALA 77 2HB ALA 77 -5.677 -1.331 -0.893 572 HB3 ALA 77 3HB ALA 77 -7.175 -1.184 0.025 573 H ILE 78 H ILE 78 -7.487 -3.643 1.746 574 HA ILE 78 HA ILE 78 -5.334 -5.132 2.728 575 HB ILE 78 HB ILE 78 -8.213 -5.229 3.636 576 HG12 ILE 78 1HG1 ILE 78 -5.900 -3.532 4.601 577 HG13 ILE 78 2HG1 ILE 78 -7.261 -2.955 3.645 578 HG21 ILE 78 1HG2 ILE 78 -6.138 -6.886 4.374 579 HG22 ILE 78 2HG2 ILE 78 -6.149 -5.653 5.635 580 HG23 ILE 78 3HG2 ILE 78 -7.609 -6.584 5.301 581 HD11 ILE 78 1HD1 ILE 78 -8.763 -3.632 5.508 582 HD12 ILE 78 2HD1 ILE 78 -7.326 -4.000 6.462 583 HD13 ILE 78 3HD1 ILE 78 -7.624 -2.350 5.917 584 H SER 79 H SER 79 -8.434 -6.212 1.371 585 HA SER 79 HA SER 79 -8.162 -8.941 1.745 586 HB2 SER 79 1HB SER 79 -9.635 -7.237 -0.202 587 HB3 SER 79 2HB SER 79 -9.491 -8.955 -0.572 588 HG SER 79 HG SER 79 -10.151 -8.852 1.944 589 H MET 80 H MET 80 -7.110 -6.996 -1.042 590 HA MET 80 HA MET 80 -6.036 -9.058 -2.573 591 HB2 MET 80 1HB MET 80 -5.060 -6.203 -2.384 592 HB3 MET 80 2HB MET 80 -4.714 -7.324 -3.694 593 HG2 MET 80 1HG MET 80 -7.540 -6.664 -2.994 594 HG3 MET 80 2HG MET 80 -6.580 -5.553 -3.969 595 HE1 MET 80 1HE MET 80 -8.040 -8.822 -3.371 596 HE2 MET 80 2HE MET 80 -9.135 -8.661 -4.745 597 HE3 MET 80 3HE MET 80 -7.796 -9.808 -4.811 598 H ALA 81 H ALA 81 -4.327 -6.879 -0.325 599 HA ALA 81 HA ALA 81 -1.787 -7.801 -0.461 600 HB1 ALA 81 1HB ALA 81 -2.048 -7.530 2.246 601 HB2 ALA 81 2HB ALA 81 -1.781 -6.206 1.111 602 HB3 ALA 81 3HB ALA 81 -3.416 -6.593 1.645 603 H ARG 82 H ARG 82 -4.234 -9.175 1.748 604 HA ARG 82 HA ARG 82 -2.625 -11.362 2.539 605 HB2 ARG 82 1HB ARG 82 -4.544 -10.509 3.852 606 HB3 ARG 82 2HB ARG 82 -5.636 -11.116 2.616 607 HG2 ARG 82 1HG ARG 82 -3.729 -13.020 3.863 608 HG3 ARG 82 2HG ARG 82 -5.124 -12.486 4.802 609 HD2 ARG 82 1HD ARG 82 -6.626 -13.246 3.064 610 HD3 ARG 82 2HD ARG 82 -5.260 -13.683 2.038 611 HE ARG 82 HE ARG 82 -4.793 -15.175 4.199 612 HH11 ARG 82 1HH1 ARG 82 -7.708 -14.645 2.369 613 HH12 ARG 82 2HH1 ARG 82 -8.361 -16.213 2.710 614 HH21 ARG 82 1HH2 ARG 82 -5.643 -17.243 4.653 615 HH22 ARG 82 2HH2 ARG 82 -7.187 -17.690 4.009 616 H LYS 83 H LYS 83 -5.021 -10.928 -0.002 617 HA LYS 83 HA LYS 83 -5.399 -13.577 -0.761 618 HB2 LYS 83 1HB LYS 83 -6.660 -11.571 -1.607 619 HB3 LYS 83 2HB LYS 83 -5.283 -11.214 -2.640 620 HG2 LYS 83 1HG LYS 83 -6.629 -12.354 -4.092 621 HG3 LYS 83 2HG LYS 83 -5.642 -13.673 -3.459 622 HD2 LYS 83 1HD LYS 83 -8.110 -13.047 -1.958 623 HD3 LYS 83 2HD LYS 83 -8.329 -13.745 -3.564 624 HE2 LYS 83 1HE LYS 83 -6.330 -15.008 -1.769 625 HE3 LYS 83 2HE LYS 83 -8.035 -15.242 -1.384 626 HZ1 LYS 83 1HZ LYS 83 -8.143 -16.776 -2.955 627 HZ2 LYS 83 2HZ LYS 83 -6.505 -16.557 -3.317 628 HZ3 LYS 83 3HZ LYS 83 -7.679 -15.653 -4.132 629 H ILE 84 H ILE 84 -2.981 -11.242 -1.922 630 HA ILE 84 HA ILE 84 -1.696 -13.141 -3.634 631 HB ILE 84 HB ILE 84 0.042 -11.444 -3.917 632 HG12 ILE 84 1HG1 ILE 84 -1.491 -9.748 -1.945 633 HG13 ILE 84 2HG1 ILE 84 -0.063 -10.677 -1.502 634 HG21 ILE 84 1HG2 ILE 84 -2.079 -11.309 -5.184 635 HG22 ILE 84 2HG2 ILE 84 -2.703 -10.204 -3.963 636 HG23 ILE 84 3HG2 ILE 84 -1.315 -9.738 -4.945 637 HD11 ILE 84 1HD1 ILE 84 0.811 -9.291 -3.683 638 HD12 ILE 84 2HD1 ILE 84 -0.289 -8.143 -2.919 639 HD13 ILE 84 3HD1 ILE 84 1.056 -8.819 -2.001 640 H GLY 85 H GLY 85 -1.471 -12.325 -0.293 641 HA2 GLY 85 1HA GLY 85 -0.357 -14.175 0.998 642 HA3 GLY 85 2HA GLY 85 1.011 -13.915 -0.074 643 H ALA 86 H ALA 86 -0.912 -12.508 2.511 644 HA ALA 86 HA ALA 86 1.325 -11.369 3.788 645 HB1 ALA 86 1HB ALA 86 0.631 -8.948 3.485 646 HB2 ALA 86 2HB ALA 86 1.426 -9.719 2.111 647 HB3 ALA 86 3HB ALA 86 -0.325 -9.501 2.109 648 H ARG 87 H ARG 87 0.637 -11.900 5.767 649 HA ARG 87 HA ARG 87 -2.129 -11.672 6.536 650 HB2 ARG 87 1HB ARG 87 0.335 -12.403 8.129 651 HB3 ARG 87 2HB ARG 87 -1.311 -12.476 8.745 652 HG2 ARG 87 1HG ARG 87 -1.757 -14.037 6.745 653 HG3 ARG 87 2HG ARG 87 0.001 -14.184 6.672 654 HD2 ARG 87 1HD ARG 87 -1.665 -14.726 9.126 655 HD3 ARG 87 2HD ARG 87 -1.102 -15.966 8.007 656 HE ARG 87 HE ARG 87 0.462 -14.568 9.991 657 HH11 ARG 87 1HH1 ARG 87 0.509 -16.468 7.074 658 HH12 ARG 87 2HH1 ARG 87 2.137 -17.015 7.301 659 HH21 ARG 87 1HH2 ARG 87 2.605 -15.283 10.301 660 HH22 ARG 87 2HH2 ARG 87 3.328 -16.342 9.138 661 H VAL 88 H VAL 88 -2.639 -9.490 6.451 662 HA VAL 88 HA VAL 88 -1.102 -7.647 8.124 663 HB VAL 88 HB VAL 88 -3.404 -7.059 6.258 664 HG11 VAL 88 1HG1 VAL 88 -1.428 -5.079 7.340 665 HG12 VAL 88 2HG1 VAL 88 -3.003 -4.784 6.601 666 HG13 VAL 88 3HG1 VAL 88 -2.903 -5.482 8.218 667 HG21 VAL 88 1HG2 VAL 88 -0.778 -6.057 5.514 668 HG22 VAL 88 2HG2 VAL 88 -0.842 -7.818 5.573 669 HG23 VAL 88 3HG2 VAL 88 -1.970 -6.929 4.550 670 H TYR 89 H TYR 89 -1.793 -6.939 10.044 671 HA TYR 89 HA TYR 89 -4.457 -7.791 10.940 672 HB2 TYR 89 1HB TYR 89 -2.279 -8.446 12.174 673 HB3 TYR 89 2HB TYR 89 -2.278 -6.784 12.751 674 HD1 TYR 89 2HD TYR 89 -4.222 -9.935 12.743 675 HD2 TYR 89 1HD TYR 89 -3.688 -6.109 14.527 676 HE1 TYR 89 2HE TYR 89 -5.763 -10.569 14.551 677 HE2 TYR 89 1HE TYR 89 -5.227 -6.732 16.340 678 HH TYR 89 HH TYR 89 -6.329 -9.969 16.784 679 H ALA 90 H ALA 90 -4.805 -5.726 9.392 680 HA ALA 90 HA ALA 90 -5.088 -3.423 11.211 681 HB1 ALA 90 1HB ALA 90 -3.556 -2.586 9.722 682 HB2 ALA 90 2HB ALA 90 -4.185 -3.534 8.373 683 HB3 ALA 90 3HB ALA 90 -5.066 -2.115 8.942 684 H LEU 91 H LEU 91 -6.755 -1.810 10.037 685 HA LEU 91 HA LEU 91 -9.080 -3.401 9.189 686 HB2 LEU 91 1HB LEU 91 -9.068 -2.593 11.631 687 HB3 LEU 91 2HB LEU 91 -9.335 -0.988 10.953 688 HG LEU 91 HG LEU 91 -11.401 -1.925 9.848 689 HD11 LEU 91 1HD1 LEU 91 -11.835 -4.093 9.948 690 HD12 LEU 91 2HD1 LEU 91 -11.843 -4.033 11.709 691 HD13 LEU 91 3HD1 LEU 91 -10.338 -4.346 10.845 692 HD21 LEU 91 1HD2 LEU 91 -11.880 -2.306 12.718 693 HD22 LEU 91 2HD2 LEU 91 -12.605 -1.166 11.584 694 HD23 LEU 91 3HD2 LEU 91 -11.032 -0.816 12.303 695 HA PRO 92 HA PRO 92 -9.210 -0.514 5.851 696 HB2 PRO 92 1HB PRO 92 -11.710 -1.086 4.962 697 HB3 PRO 92 2HB PRO 92 -10.326 -2.152 4.690 698 HG2 PRO 92 1HG PRO 92 -12.480 -2.335 6.760 699 HG3 PRO 92 2HG PRO 92 -11.763 -3.623 5.775 700 HD2 PRO 92 1HD PRO 92 -11.047 -3.192 8.351 701 HD3 PRO 92 2HD PRO 92 -9.910 -3.805 7.133 702 H GLU 93 H GLU 93 -11.450 -0.524 8.494 703 HA GLU 93 HA GLU 93 -12.958 1.765 7.737 704 HB2 GLU 93 1HB GLU 93 -12.493 0.485 10.434 705 HB3 GLU 93 2HB GLU 93 -13.625 1.800 10.151 706 HG2 GLU 93 1HG GLU 93 -13.817 -0.736 8.581 707 HG3 GLU 93 2HG GLU 93 -14.495 -0.624 10.204 708 H ASP 94 H ASP 94 -9.992 1.271 9.550 709 HA ASP 94 HA ASP 94 -9.816 4.035 10.369 710 HB2 ASP 94 1HB ASP 94 -7.924 1.694 10.598 711 HB3 ASP 94 2HB ASP 94 -7.511 3.314 11.152 712 H LEU 95 H LEU 95 -8.349 1.948 7.933 713 HA LEU 95 HA LEU 95 -6.343 3.611 6.998 714 HB2 LEU 95 1HB LEU 95 -6.487 1.372 6.211 715 HB3 LEU 95 2HB LEU 95 -8.100 1.643 5.553 716 HG LEU 95 HG LEU 95 -7.146 3.107 3.833 717 HD11 LEU 95 1HD1 LEU 95 -4.633 2.564 5.348 718 HD12 LEU 95 2HD1 LEU 95 -5.242 4.080 4.685 719 HD13 LEU 95 3HD1 LEU 95 -4.563 2.859 3.611 720 HD21 LEU 95 1HD2 LEU 95 -6.200 0.291 4.136 721 HD22 LEU 95 2HD2 LEU 95 -5.666 1.249 2.756 722 HD23 LEU 95 3HD2 LEU 95 -7.387 0.965 3.019 723 H VAL 96 H VAL 96 -9.793 3.658 6.308 724 HA VAL 96 HA VAL 96 -9.921 5.333 4.133 725 HB VAL 96 HB VAL 96 -11.741 5.190 6.532 726 HG11 VAL 96 1HG1 VAL 96 -12.271 6.587 3.912 727 HG12 VAL 96 2HG1 VAL 96 -13.390 6.429 5.267 728 HG13 VAL 96 3HG1 VAL 96 -11.924 7.395 5.440 729 HG21 VAL 96 1HG2 VAL 96 -12.657 3.427 5.530 730 HG22 VAL 96 2HG2 VAL 96 -12.808 4.298 4.004 731 HG23 VAL 96 3HG2 VAL 96 -11.309 3.453 4.394 732 H GLU 97 H GLU 97 -9.522 6.216 7.538 733 HA GLU 97 HA GLU 97 -9.239 9.030 6.779 734 HB2 GLU 97 1HB GLU 97 -9.503 7.698 9.478 735 HB3 GLU 97 2HB GLU 97 -9.254 9.424 9.254 736 HG2 GLU 97 1HG GLU 97 -11.367 9.336 7.804 737 HG3 GLU 97 2HG GLU 97 -11.644 7.767 8.557 738 H VAL 98 H VAL 98 -7.182 7.378 5.921 739 HA VAL 98 HA VAL 98 -4.935 6.871 6.184 740 HB VAL 98 HB VAL 98 -4.852 9.807 6.873 741 HG11 VAL 98 1HG1 VAL 98 -2.791 8.111 6.782 742 HG12 VAL 98 2HG1 VAL 98 -2.891 8.521 5.069 743 HG13 VAL 98 3HG1 VAL 98 -2.667 9.793 6.269 744 HG21 VAL 98 1HG2 VAL 98 -6.080 8.640 4.646 745 HG22 VAL 98 2HG2 VAL 98 -5.656 10.337 4.868 746 HG23 VAL 98 3HG2 VAL 98 -4.526 9.241 4.072 747 H ASN 99 H ASN 99 -6.092 6.034 8.486 748 HA ASN 99 HA ASN 99 -4.849 7.241 10.786 749 HB2 ASN 99 1HB ASN 99 -6.668 4.922 10.305 750 HB3 ASN 99 2HB ASN 99 -5.753 4.967 11.811 751 HD21 ASN 99 1HD2 ASN 99 -8.588 5.120 11.509 752 HD22 ASN 99 2HD2 ASN 99 -9.088 6.645 12.147 753 HA PRO 100 HA PRO 100 -1.044 4.980 10.081 754 HB2 PRO 100 1HB PRO 100 0.315 6.158 12.115 755 HB3 PRO 100 2HB PRO 100 0.050 6.945 10.554 756 HG2 PRO 100 1HG PRO 100 -1.432 7.300 13.131 757 HG3 PRO 100 2HG PRO 100 -0.891 8.529 11.973 758 HD2 PRO 100 1HD PRO 100 -3.447 7.640 12.067 759 HD3 PRO 100 2HD PRO 100 -2.671 8.157 10.555 760 H LYS 101 H LYS 101 -3.225 4.860 12.658 761 HA LYS 101 HA LYS 101 -1.768 3.293 14.514 762 HB2 LYS 101 1HB LYS 101 -4.756 3.447 14.071 763 HB3 LYS 101 2HB LYS 101 -3.965 2.771 15.488 764 HG2 LYS 101 1HG LYS 101 -3.700 5.636 14.606 765 HG3 LYS 101 2HG LYS 101 -4.851 5.064 15.815 766 HD2 LYS 101 1HD LYS 101 -2.882 4.139 17.087 767 HD3 LYS 101 2HD LYS 101 -1.841 5.006 15.956 768 HE2 LYS 101 1HE LYS 101 -2.721 7.111 16.645 769 HE3 LYS 101 2HE LYS 101 -4.001 6.339 17.578 770 HZ1 LYS 101 1HZ LYS 101 -1.928 7.228 18.788 771 HZ2 LYS 101 2HZ LYS 101 -1.177 5.818 18.231 772 HZ3 LYS 101 3HZ LYS 101 -2.539 5.713 19.228 773 H MET 102 H MET 102 -3.686 2.522 11.681 774 HA MET 102 HA MET 102 -3.250 -0.343 12.158 775 HB2 MET 102 1HB MET 102 -5.135 1.086 10.277 776 HB3 MET 102 2HB MET 102 -4.942 -0.660 10.347 777 HG2 MET 102 1HG MET 102 -5.921 1.114 12.571 778 HG3 MET 102 2HG MET 102 -6.904 0.045 11.574 779 HE1 MET 102 1HE MET 102 -7.366 -0.129 14.432 780 HE2 MET 102 2HE MET 102 -6.478 -1.306 15.398 781 HE3 MET 102 3HE MET 102 -5.771 0.276 15.067 782 H VAL 103 H VAL 103 -2.786 2.221 9.774 783 HA VAL 103 HA VAL 103 -1.777 0.783 7.647 784 HB VAL 103 HB VAL 103 -0.844 3.490 8.613 785 HG11 VAL 103 1HG1 VAL 103 0.768 2.684 7.071 786 HG12 VAL 103 2HG1 VAL 103 -0.479 2.063 5.988 787 HG13 VAL 103 3HG1 VAL 103 -0.264 3.803 6.183 788 HG21 VAL 103 1HG2 VAL 103 -2.655 3.290 6.313 789 HG22 VAL 103 2HG2 VAL 103 -3.362 2.806 7.854 790 HG23 VAL 103 3HG2 VAL 103 -2.664 4.416 7.670 791 H MET 104 H MET 104 -0.412 1.207 10.751 792 HA MET 104 HA MET 104 2.308 1.123 10.337 793 HB2 MET 104 1HB MET 104 2.428 -0.109 12.512 794 HB3 MET 104 2HB MET 104 1.437 1.342 12.560 795 HG2 MET 104 1HG MET 104 -0.545 0.139 12.677 796 HG3 MET 104 2HG MET 104 0.205 -1.336 12.072 797 HE1 MET 104 1HE MET 104 -0.358 -2.949 15.414 798 HE2 MET 104 2HE MET 104 -1.469 -2.177 14.283 799 HE3 MET 104 3HE MET 104 -0.141 -3.169 13.677 800 H THR 105 H THR 105 -0.016 -1.526 10.194 801 HA THR 105 HA THR 105 2.120 -3.407 9.515 802 HB THR 105 HB THR 105 0.481 -4.162 11.171 803 HG1 THR 105 1HG THR 105 -0.059 -6.134 10.080 804 HG21 THR 105 1HG2 THR 105 -1.495 -2.990 10.589 805 HG22 THR 105 2HG2 THR 105 -1.848 -4.697 10.320 806 HG23 THR 105 3HG2 THR 105 -1.487 -3.645 8.951 807 H VAL 106 H VAL 106 -0.749 -1.890 8.157 808 HA VAL 106 HA VAL 106 -1.279 -3.271 5.901 809 HB VAL 106 HB VAL 106 -0.989 -0.268 6.057 810 HG11 VAL 106 1HG1 VAL 106 -1.892 -0.064 4.004 811 HG12 VAL 106 2HG1 VAL 106 -1.250 -1.691 3.771 812 HG13 VAL 106 3HG1 VAL 106 -2.943 -1.466 4.213 813 HG21 VAL 106 1HG2 VAL 106 -2.513 -1.128 7.732 814 HG22 VAL 106 2HG2 VAL 106 -3.420 -0.305 6.461 815 HG23 VAL 106 3HG2 VAL 106 -3.368 -2.068 6.508 816 H PHE 107 H PHE 107 0.984 -0.520 5.753 817 HA PHE 107 HA PHE 107 2.148 -1.429 3.320 818 HB2 PHE 107 1HB PHE 107 2.671 0.799 5.236 819 HB3 PHE 107 2HB PHE 107 3.935 0.377 4.086 820 HD1 PHE 107 2HD PHE 107 2.845 -0.068 1.607 821 HD2 PHE 107 1HD PHE 107 1.366 2.562 4.609 822 HE1 PHE 107 2HE PHE 107 1.713 1.266 -0.123 823 HE2 PHE 107 1HE PHE 107 0.232 3.899 2.883 824 HZ PHE 107 HZ PHE 107 0.405 3.253 0.513 825 H ALA 108 H ALA 108 3.383 -1.249 6.655 826 HA ALA 108 HA ALA 108 5.887 -2.188 6.472 827 HB1 ALA 108 1HB ALA 108 5.552 -3.353 8.632 828 HB2 ALA 108 2HB ALA 108 4.887 -1.718 8.609 829 HB3 ALA 108 3HB ALA 108 3.813 -3.109 8.456 830 H CYS 109 H CYS 109 3.077 -4.380 6.685 831 HA CYS 109 HA CYS 109 4.355 -6.785 6.370 832 HB2 CYS 109 1HB CYS 109 1.641 -5.803 5.584 833 HB3 CYS 109 2HB CYS 109 2.147 -7.407 5.068 834 HG CYS 109 HG CYS 109 1.484 -6.283 8.198 835 H LEU 110 H LEU 110 3.269 -4.581 3.813 836 HA LEU 110 HA LEU 110 4.014 -6.209 1.638 837 HB2 LEU 110 1HB LEU 110 3.726 -3.219 1.874 838 HB3 LEU 110 2HB LEU 110 3.998 -4.062 0.349 839 HG LEU 110 HG LEU 110 1.601 -4.494 2.128 840 HD11 LEU 110 1HD1 LEU 110 1.571 -3.026 -0.480 841 HD12 LEU 110 2HD1 LEU 110 1.903 -2.181 1.032 842 HD13 LEU 110 3HD1 LEU 110 0.373 -3.028 0.814 843 HD21 LEU 110 1HD2 LEU 110 2.485 -5.559 -0.520 844 HD22 LEU 110 2HD2 LEU 110 0.764 -5.389 -0.169 845 HD23 LEU 110 3HD2 LEU 110 1.777 -6.410 0.854 846 H MET 111 H MET 111 5.817 -4.031 3.678 847 HA MET 111 HA MET 111 8.131 -4.014 1.937 848 HB2 MET 111 1HB MET 111 7.374 -2.723 4.507 849 HB3 MET 111 2HB MET 111 9.089 -2.951 4.195 850 HG2 MET 111 1HG MET 111 7.427 -1.742 2.056 851 HG3 MET 111 2HG MET 111 7.814 -0.763 3.469 852 HE1 MET 111 1HE MET 111 10.248 -3.408 1.298 853 HE2 MET 111 2HE MET 111 8.862 -2.675 0.490 854 HE3 MET 111 3HE MET 111 10.497 -2.140 0.097 855 H GLY 112 H GLY 112 6.881 -5.951 4.472 856 HA2 GLY 112 1HA GLY 112 9.019 -6.945 5.831 857 HA3 GLY 112 2HA GLY 112 7.671 -7.948 5.316 858 H LYS 113 H LYS 113 8.258 -7.513 2.465 859 HA LYS 113 HA LYS 113 9.909 -9.743 2.025 860 HB2 LYS 113 1HB LYS 113 8.180 -8.915 0.441 861 HB3 LYS 113 2HB LYS 113 9.217 -7.544 0.068 862 HG2 LYS 113 1HG LYS 113 10.922 -9.063 -0.795 863 HG3 LYS 113 2HG LYS 113 9.887 -10.440 -0.416 864 HD2 LYS 113 1HD LYS 113 9.408 -10.131 -2.645 865 HD3 LYS 113 2HD LYS 113 8.148 -9.150 -1.892 866 HE2 LYS 113 1HE LYS 113 9.336 -7.142 -2.321 867 HE3 LYS 113 2HE LYS 113 10.797 -8.021 -2.767 868 HZ1 LYS 113 1HZ LYS 113 9.761 -7.275 -4.750 869 HZ2 LYS 113 2HZ LYS 113 8.253 -7.882 -4.284 870 HZ3 LYS 113 3HZ LYS 113 9.511 -8.946 -4.668 871 H GLY 114 H GLY 114 10.568 -6.268 1.870 872 HA2 GLY 114 1HA GLY 114 13.146 -6.370 0.802 873 HA3 GLY 114 2HA GLY 114 12.545 -5.103 1.861 874 H MET 115 H MET 115 12.228 -6.195 4.246 875 HA MET 115 HA MET 115 14.909 -6.609 5.136 876 HB2 MET 115 1HB MET 115 12.253 -6.692 6.566 877 HB3 MET 115 2HB MET 115 13.793 -6.924 7.384 878 HG2 MET 115 1HG MET 115 13.450 -4.497 5.711 879 HG3 MET 115 2HG MET 115 12.615 -4.570 7.261 880 HE1 MET 115 1HE MET 115 14.650 -5.508 9.655 881 HE2 MET 115 2HE MET 115 14.991 -3.785 9.812 882 HE3 MET 115 3HE MET 115 13.390 -4.325 9.302 883 H LYS 116 H LYS 116 15.299 -8.427 6.814 884 HA LYS 116 HA LYS 116 14.602 -10.951 5.495 885 HB2 LYS 116 1HB LYS 116 16.871 -10.091 7.263 886 HB3 LYS 116 2HB LYS 116 16.491 -11.797 7.071 887 HG2 LYS 116 1HG LYS 116 17.025 -9.963 4.750 888 HG3 LYS 116 2HG LYS 116 18.284 -10.897 5.562 889 HD2 LYS 116 1HD LYS 116 17.121 -12.966 5.022 890 HD3 LYS 116 2HD LYS 116 15.819 -12.052 4.257 891 HE2 LYS 116 1HE LYS 116 17.203 -12.805 2.500 892 HE3 LYS 116 2HE LYS 116 17.576 -11.096 2.710 893 HZ1 LYS 116 1HZ LYS 116 19.189 -13.054 4.173 894 HZ2 LYS 116 2HZ LYS 116 19.633 -11.551 3.537 895 HZ3 LYS 116 3HZ LYS 116 19.461 -12.885 2.511 896 H ARG 117 H ARG 117 12.732 -11.691 6.333 897 HA ARG 117 HA ARG 117 12.602 -11.998 9.261 898 HB2 ARG 117 1HB ARG 117 10.478 -11.165 7.310 899 HB3 ARG 117 2HB ARG 117 10.039 -11.961 8.816 900 HG2 ARG 117 1HG ARG 117 11.237 -10.190 10.056 901 HG3 ARG 117 2HG ARG 117 11.548 -9.374 8.522 902 HD2 ARG 117 1HD ARG 117 9.643 -8.334 9.482 903 HD3 ARG 117 2HD ARG 117 9.062 -9.341 8.156 904 HE ARG 117 HE ARG 117 7.944 -10.650 9.674 905 HH11 ARG 117 1HH1 ARG 117 10.185 -8.579 11.351 906 HH12 ARG 117 2HH1 ARG 117 9.573 -8.972 12.924 907 HH21 ARG 117 1HH2 ARG 117 7.131 -11.176 11.739 908 HH22 ARG 117 2HH2 ARG 117 7.837 -10.450 13.143 909 H VAL 118 H VAL 118 11.058 -13.775 9.918 910 HA VAL 118 HA VAL 118 11.683 -16.143 8.346 911 HB VAL 118 HB VAL 118 10.845 -17.415 10.267 912 HG11 VAL 118 1HG1 VAL 118 12.825 -15.227 10.865 913 HG12 VAL 118 2HG1 VAL 118 12.522 -16.585 11.951 914 HG13 VAL 118 3HG1 VAL 118 13.156 -16.874 10.331 915 HG21 VAL 118 1HG2 VAL 118 10.183 -14.687 11.362 916 HG22 VAL 118 2HG2 VAL 118 9.079 -16.031 11.068 917 HG23 VAL 118 3HG2 VAL 118 10.277 -16.140 12.357 918 H SER 119 H SER 119 10.299 -17.017 6.964 919 HA SER 119 HA SER 119 7.557 -17.399 7.470 920 HB2 SER 119 1HB SER 119 7.750 -14.857 6.937 921 HB3 SER 119 2HB SER 119 7.951 -15.392 5.269 922 HG SER 119 HG SER 119 5.709 -15.400 6.872 923 H GLY 120 H GLY 120 6.755 -18.948 6.147 924 HA2 GLY 120 1HA GLY 120 8.435 -19.695 3.832 925 HA3 GLY 120 2HA GLY 120 7.600 -20.860 4.848 926 HA PRO 121 HA PRO 121 4.839 -18.869 1.375 927 HB2 PRO 121 1HB PRO 121 5.827 -19.847 -0.957 928 HB3 PRO 121 2HB PRO 121 6.307 -18.282 -0.291 929 HG2 PRO 121 1HG PRO 121 7.723 -20.916 -0.151 930 HG3 PRO 121 2HG PRO 121 8.388 -19.303 -0.471 931 HD2 PRO 121 1HD PRO 121 8.555 -20.494 1.956 932 HD3 PRO 121 2HD PRO 121 8.417 -18.735 1.764 933 H SER 122 H SER 122 3.339 -20.081 -0.018 934 HA SER 122 HA SER 122 1.824 -21.804 -0.096 935 HB2 SER 122 1HB SER 122 3.805 -22.316 -1.742 936 HB3 SER 122 2HB SER 122 4.147 -23.628 -0.615 937 HG SER 122 HG SER 122 1.613 -23.187 -1.812 938 H SER 123 H SER 123 2.515 -21.314 2.533 939 HA SER 123 HA SER 123 3.213 -23.800 3.828 940 HB2 SER 123 1HB SER 123 3.737 -21.387 4.639 941 HB3 SER 123 2HB SER 123 2.083 -21.404 5.251 942 HG SER 123 HG SER 123 2.609 -22.906 6.694 943 H GLY 124 H GLY 124 0.313 -21.775 3.503 944 HA2 GLY 124 1HA GLY 124 -1.312 -23.717 4.919 945 HA3 GLY 124 2HA GLY 124 -1.863 -22.199 4.226 Start of MODEL 8 1 H1 GLY 1 H GLY 1 17.630 4.545 -10.669 2 HA2 GLY 1 1HA GLY 1 18.869 2.309 -11.532 3 HA3 GLY 1 2HA GLY 1 20.150 3.121 -10.644 4 H SER 2 H SER 2 20.249 1.441 -9.121 5 HA SER 2 HA SER 2 18.400 1.746 -6.937 6 HB2 SER 2 1HB SER 2 17.220 0.105 -8.378 7 HB3 SER 2 2HB SER 2 18.623 -0.958 -8.280 8 HG SER 2 HG SER 2 16.980 -1.479 -6.745 9 H SER 3 H SER 3 19.313 1.228 -5.005 10 HA SER 3 HA SER 3 22.084 0.259 -5.107 11 HB2 SER 3 1HB SER 3 20.617 1.937 -3.066 12 HB3 SER 3 2HB SER 3 22.231 1.279 -2.795 13 HG SER 3 HG SER 3 22.679 2.383 -4.931 14 H GLY 4 H GLY 4 19.221 0.056 -2.983 15 HA2 GLY 4 1HA GLY 4 18.326 -2.124 -2.395 16 HA3 GLY 4 2HA GLY 4 19.970 -2.746 -2.436 17 H SER 5 H SER 5 18.419 0.040 -0.840 18 HA SER 5 HA SER 5 20.007 -0.045 1.454 19 HB2 SER 5 1HB SER 5 18.656 1.912 0.840 20 HB3 SER 5 2HB SER 5 17.180 1.004 1.166 21 HG SER 5 HG SER 5 18.108 0.742 3.358 22 H SER 6 H SER 6 19.937 -1.164 3.315 23 HA SER 6 HA SER 6 18.632 -3.605 3.502 24 HB2 SER 6 1HB SER 6 20.623 -2.878 4.851 25 HB3 SER 6 2HB SER 6 19.528 -1.925 5.853 26 HG SER 6 HG SER 6 19.864 -4.684 5.701 27 H GLY 7 H GLY 7 17.080 -4.247 5.276 28 HA2 GLY 7 1HA GLY 7 14.619 -2.946 4.896 29 HA3 GLY 7 2HA GLY 7 14.950 -4.161 6.121 30 H ASN 8 H ASN 8 13.549 -1.391 5.966 31 HA ASN 8 HA ASN 8 14.263 -0.625 8.648 32 HB2 ASN 8 1HB ASN 8 15.870 0.550 6.941 33 HB3 ASN 8 2HB ASN 8 14.477 1.584 6.636 34 HD21 ASN 8 1HD2 ASN 8 15.324 3.420 7.501 35 HD22 ASN 8 2HD2 ASN 8 15.661 3.615 9.185 36 H ASP 9 H ASP 9 12.956 1.445 9.249 37 HA ASP 9 HA ASP 9 10.218 0.931 8.424 38 HB2 ASP 9 1HB ASP 9 11.498 2.473 10.656 39 HB3 ASP 9 2HB ASP 9 9.811 2.764 10.240 40 H ASP 10 H ASP 10 12.680 3.369 8.068 41 HA ASP 10 HA ASP 10 10.929 5.421 7.110 42 HB2 ASP 10 1HB ASP 10 13.930 5.104 6.917 43 HB3 ASP 10 2HB ASP 10 13.049 6.544 6.419 44 H ILE 11 H ILE 11 12.957 2.951 5.622 45 HA ILE 11 HA ILE 11 12.793 3.809 2.966 46 HB ILE 11 HB ILE 11 14.303 2.005 3.820 47 HG12 ILE 11 1HG1 ILE 11 12.689 0.962 1.507 48 HG13 ILE 11 2HG1 ILE 11 13.626 2.444 1.357 49 HG21 ILE 11 1HG2 ILE 11 12.737 -0.269 3.381 50 HG22 ILE 11 2HG2 ILE 11 13.400 0.297 4.913 51 HG23 ILE 11 3HG2 ILE 11 11.776 0.779 4.424 52 HD11 ILE 11 1HD1 ILE 11 15.178 0.984 0.617 53 HD12 ILE 11 2HD1 ILE 11 15.521 0.857 2.342 54 HD13 ILE 11 3HD1 ILE 11 14.522 -0.361 1.550 55 H ILE 12 H ILE 12 10.453 2.295 5.001 56 HA ILE 12 HA ILE 12 8.774 0.910 3.407 57 HB ILE 12 HB ILE 12 7.895 3.037 5.365 58 HG12 ILE 12 1HG1 ILE 12 8.311 0.069 5.782 59 HG13 ILE 12 2HG1 ILE 12 9.448 1.315 6.284 60 HG21 ILE 12 1HG2 ILE 12 5.830 2.552 4.699 61 HG22 ILE 12 2HG2 ILE 12 6.411 1.258 3.652 62 HG23 ILE 12 3HG2 ILE 12 6.069 0.931 5.350 63 HD11 ILE 12 1HD1 ILE 12 7.290 0.272 7.726 64 HD12 ILE 12 2HD1 ILE 12 8.344 1.613 8.173 65 HD13 ILE 12 3HD1 ILE 12 6.845 1.923 7.297 66 H VAL 13 H VAL 13 9.092 4.430 3.476 67 HA VAL 13 HA VAL 13 6.994 4.872 1.571 68 HB VAL 13 HB VAL 13 9.187 6.730 2.505 69 HG11 VAL 13 1HG1 VAL 13 6.960 8.196 1.677 70 HG12 VAL 13 2HG1 VAL 13 8.523 8.077 0.865 71 HG13 VAL 13 3HG1 VAL 13 7.212 6.983 0.422 72 HG21 VAL 13 1HG2 VAL 13 6.675 5.852 3.687 73 HG22 VAL 13 2HG2 VAL 13 8.032 6.710 4.419 74 HG23 VAL 13 3HG2 VAL 13 6.790 7.606 3.542 75 H ASN 14 H ASN 14 10.541 4.889 1.451 76 HA ASN 14 HA ASN 14 10.869 5.667 -1.199 77 HB2 ASN 14 1HB ASN 14 12.502 4.159 0.775 78 HB3 ASN 14 2HB ASN 14 12.978 4.032 -0.916 79 HD21 ASN 14 1HD2 ASN 14 12.743 6.354 -2.009 80 HD22 ASN 14 2HD2 ASN 14 13.614 7.589 -1.171 81 H TRP 15 H TRP 15 10.593 2.383 0.141 82 HA TRP 15 HA TRP 15 10.847 0.949 -2.221 83 HB2 TRP 15 1HB TRP 15 10.754 0.006 0.112 84 HB3 TRP 15 2HB TRP 15 9.006 0.216 0.062 85 HD1 TRP 15 HD TRP 15 11.808 -1.850 -1.577 86 HE1 TRP 15 1HE TRP 15 10.762 -3.975 -2.585 87 HE3 TRP 15 3HE TRP 15 6.871 -0.777 -0.791 88 HZ2 TRP 15 2HZ TRP 15 8.186 -5.054 -2.994 89 HZ3 TRP 15 3HZ TRP 15 5.180 -2.408 -1.521 90 HH2 TRP 15 HH TRP 15 5.825 -4.501 -2.599 91 H VAL 16 H VAL 16 7.916 2.296 -0.735 92 HA VAL 16 HA VAL 16 6.073 1.319 -2.604 93 HB VAL 16 HB VAL 16 5.913 3.884 -1.017 94 HG11 VAL 16 1HG1 VAL 16 4.310 3.838 -2.846 95 HG12 VAL 16 2HG1 VAL 16 3.747 2.247 -2.330 96 HG13 VAL 16 3HG1 VAL 16 3.489 3.653 -1.296 97 HG21 VAL 16 1HG2 VAL 16 6.051 1.276 -0.083 98 HG22 VAL 16 2HG2 VAL 16 5.468 2.682 0.807 99 HG23 VAL 16 3HG2 VAL 16 4.329 1.656 -0.064 100 H ASN 17 H ASN 17 7.533 4.570 -2.419 101 HA ASN 17 HA ASN 17 6.487 5.657 -4.715 102 HB2 ASN 17 1HB ASN 17 9.097 6.065 -3.292 103 HB3 ASN 17 2HB ASN 17 8.776 6.915 -4.800 104 HD21 ASN 17 1HD2 ASN 17 7.496 6.327 -1.569 105 HD22 ASN 17 2HD2 ASN 17 6.692 7.849 -1.416 106 H GLU 18 H GLU 18 9.621 3.972 -4.460 107 HA GLU 18 HA GLU 18 10.240 3.993 -7.180 108 HB2 GLU 18 1HB GLU 18 11.096 2.373 -4.836 109 HB3 GLU 18 2HB GLU 18 11.487 1.754 -6.434 110 HG2 GLU 18 1HG GLU 18 12.224 4.489 -5.421 111 HG3 GLU 18 2HG GLU 18 13.297 3.091 -5.441 112 H THR 19 H THR 19 8.839 1.318 -5.281 113 HA THR 19 HA THR 19 8.417 -0.549 -7.199 114 HB THR 19 HB THR 19 6.431 0.210 -5.048 115 HG1 THR 19 1HG THR 19 7.897 -0.616 -3.777 116 HG21 THR 19 1HG2 THR 19 5.188 -1.226 -6.345 117 HG22 THR 19 2HG2 THR 19 6.020 -2.379 -5.301 118 HG23 THR 19 3HG2 THR 19 6.606 -2.090 -6.939 119 H LEU 20 H LEU 20 6.486 2.355 -6.660 120 HA LEU 20 HA LEU 20 4.570 1.671 -8.701 121 HB2 LEU 20 1HB LEU 20 5.042 4.258 -7.226 122 HB3 LEU 20 2HB LEU 20 3.673 3.923 -8.284 123 HG LEU 20 HG LEU 20 4.174 2.204 -5.886 124 HD11 LEU 20 1HD1 LEU 20 3.102 3.649 -4.427 125 HD12 LEU 20 2HD1 LEU 20 2.437 4.635 -5.730 126 HD13 LEU 20 3HD1 LEU 20 4.154 4.730 -5.340 127 HD21 LEU 20 1HD2 LEU 20 1.762 2.987 -7.509 128 HD22 LEU 20 2HD2 LEU 20 1.673 2.081 -5.999 129 HD23 LEU 20 3HD2 LEU 20 2.515 1.397 -7.390 130 H ARG 21 H ARG 21 7.309 3.888 -8.377 131 HA ARG 21 HA ARG 21 7.067 5.266 -10.775 132 HB2 ARG 21 1HB ARG 21 8.756 5.531 -8.800 133 HB3 ARG 21 2HB ARG 21 9.760 4.441 -9.748 134 HG2 ARG 21 1HG ARG 21 10.494 6.543 -10.385 135 HG3 ARG 21 2HG ARG 21 9.374 6.098 -11.675 136 HD2 ARG 21 1HD ARG 21 7.602 7.385 -10.518 137 HD3 ARG 21 2HD ARG 21 8.794 7.892 -9.321 138 HE ARG 21 HE ARG 21 9.829 8.588 -11.784 139 HH11 ARG 21 1HH1 ARG 21 7.003 9.347 -9.898 140 HH12 ARG 21 2HH1 ARG 21 6.835 10.943 -10.552 141 HH21 ARG 21 1HH2 ARG 21 9.618 10.686 -12.653 142 HH22 ARG 21 2HH2 ARG 21 8.322 11.703 -12.120 143 H GLU 22 H GLU 22 8.836 2.247 -10.124 144 HA GLU 22 HA GLU 22 9.785 1.848 -12.733 145 HB2 GLU 22 1HB GLU 22 10.335 -0.358 -12.059 146 HB3 GLU 22 2HB GLU 22 10.530 0.651 -10.632 147 HG2 GLU 22 1HG GLU 22 8.543 -0.156 -9.662 148 HG3 GLU 22 2HG GLU 22 8.021 -0.903 -11.172 149 H ALA 23 H ALA 23 6.724 1.072 -11.217 150 HA ALA 23 HA ALA 23 5.805 -0.512 -13.454 151 HB1 ALA 23 1HB ALA 23 3.628 -0.476 -12.182 152 HB2 ALA 23 2HB ALA 23 4.998 -1.193 -11.334 153 HB3 ALA 23 3HB ALA 23 4.469 0.441 -10.932 154 H GLU 24 H GLU 24 6.059 2.768 -12.791 155 HA GLU 24 HA GLU 24 5.376 4.616 -13.937 156 HB2 GLU 24 1HB GLU 24 3.889 2.766 -15.799 157 HB3 GLU 24 2HB GLU 24 4.432 4.405 -16.126 158 HG2 GLU 24 1HG GLU 24 6.476 2.373 -15.421 159 HG3 GLU 24 2HG GLU 24 5.736 2.295 -17.020 160 H LYS 25 H LYS 25 3.977 3.874 -11.696 161 HA LYS 25 HA LYS 25 1.137 4.108 -12.322 162 HB2 LYS 25 1HB LYS 25 2.729 3.322 -9.941 163 HB3 LYS 25 2HB LYS 25 1.172 4.082 -9.639 164 HG2 LYS 25 1HG LYS 25 1.135 1.589 -9.707 165 HG3 LYS 25 2HG LYS 25 0.016 2.377 -10.821 166 HD2 LYS 25 1HD LYS 25 1.675 2.069 -12.635 167 HD3 LYS 25 2HD LYS 25 2.704 1.187 -11.503 168 HE2 LYS 25 1HE LYS 25 1.522 -0.452 -12.725 169 HE3 LYS 25 2HE LYS 25 0.748 -0.374 -11.143 170 HZ1 LYS 25 1HZ LYS 25 -0.626 -0.333 -13.380 171 HZ2 LYS 25 2HZ LYS 25 -0.338 1.329 -13.251 172 HZ3 LYS 25 3HZ LYS 25 -1.136 0.510 -12.003 173 H SER 26 H SER 26 -0.121 5.853 -11.817 174 HA SER 26 HA SER 26 1.255 8.364 -11.468 175 HB2 SER 26 1HB SER 26 -1.630 7.614 -11.925 176 HB3 SER 26 2HB SER 26 -1.141 9.276 -11.595 177 HG SER 26 HG SER 26 0.468 8.665 -13.430 178 H SER 27 H SER 27 0.576 6.117 -9.313 179 HA SER 27 HA SER 27 -0.589 7.858 -7.273 180 HB2 SER 27 1HB SER 27 -0.996 5.913 -5.994 181 HB3 SER 27 2HB SER 27 -1.323 5.426 -7.658 182 HG SER 27 HG SER 27 1.176 4.925 -7.386 183 H SER 28 H SER 28 0.412 8.058 -5.178 184 HA SER 28 HA SER 28 3.048 7.226 -4.626 185 HB2 SER 28 1HB SER 28 4.283 9.287 -4.900 186 HB3 SER 28 2HB SER 28 3.535 8.877 -6.444 187 HG SER 28 HG SER 28 1.832 10.359 -5.848 188 H ILE 29 H ILE 29 3.904 8.203 -2.639 189 HA ILE 29 HA ILE 29 1.891 9.624 -1.045 190 HB ILE 29 HB ILE 29 2.526 8.159 0.916 191 HG12 ILE 29 1HG1 ILE 29 3.291 6.049 -1.049 192 HG13 ILE 29 2HG1 ILE 29 4.514 7.222 -0.575 193 HG21 ILE 29 1HG2 ILE 29 0.900 7.306 -1.422 194 HG22 ILE 29 2HG2 ILE 29 1.129 6.168 -0.095 195 HG23 ILE 29 3HG2 ILE 29 0.393 7.740 0.210 196 HD11 ILE 29 1HD1 ILE 29 3.823 6.596 1.836 197 HD12 ILE 29 2HD1 ILE 29 3.133 5.161 1.077 198 HD13 ILE 29 3HD1 ILE 29 4.856 5.503 0.915 199 H SER 30 H SER 30 2.694 11.145 0.303 200 HA SER 30 HA SER 30 5.476 11.831 0.040 201 HB2 SER 30 1HB SER 30 4.027 13.693 0.064 202 HB3 SER 30 2HB SER 30 3.132 13.087 1.459 203 HG SER 30 HG SER 30 5.509 14.494 1.349 204 H SER 31 H SER 31 3.351 10.730 2.652 205 HA SER 31 HA SER 31 5.493 9.420 3.999 206 HB2 SER 31 1HB SER 31 5.887 11.821 4.641 207 HB3 SER 31 2HB SER 31 4.314 11.806 5.437 208 HG SER 31 HG SER 31 5.704 11.269 7.019 209 H PHE 32 H PHE 32 4.752 8.441 6.081 210 HA PHE 32 HA PHE 32 2.532 6.909 5.823 211 HB2 PHE 32 1HB PHE 32 3.664 7.994 8.410 212 HB3 PHE 32 2HB PHE 32 2.555 6.632 8.292 213 HD1 PHE 32 2HD PHE 32 3.325 4.652 6.811 214 HD2 PHE 32 1HD PHE 32 5.941 7.628 8.368 215 HE1 PHE 32 2HE PHE 32 5.231 3.125 6.518 216 HE2 PHE 32 1HE PHE 32 7.852 6.104 8.076 217 HZ PHE 32 HZ PHE 32 7.497 3.850 7.152 218 H LYS 33 H LYS 33 2.631 10.249 6.679 219 HA LYS 33 HA LYS 33 -0.209 10.219 7.428 220 HB2 LYS 33 1HB LYS 33 2.050 12.115 7.936 221 HB3 LYS 33 2HB LYS 33 0.398 12.718 7.960 222 HG2 LYS 33 1HG LYS 33 0.659 12.211 10.160 223 HG3 LYS 33 2HG LYS 33 0.034 10.668 9.574 224 HD2 LYS 33 1HD LYS 33 2.086 9.629 9.721 225 HD3 LYS 33 2HD LYS 33 2.981 11.143 9.576 226 HE2 LYS 33 1HE LYS 33 2.025 11.748 11.851 227 HE3 LYS 33 2HE LYS 33 1.514 10.065 11.970 228 HZ1 LYS 33 1HZ LYS 33 3.956 9.555 11.446 229 HZ2 LYS 33 2HZ LYS 33 3.567 10.083 13.005 230 HZ3 LYS 33 3HZ LYS 33 4.250 11.160 11.894 231 H ASP 34 H ASP 34 0.299 9.762 4.758 232 HA ASP 34 HA ASP 34 -0.077 12.310 3.380 233 HB2 ASP 34 1HB ASP 34 1.476 10.415 2.568 234 HB3 ASP 34 2HB ASP 34 -0.003 9.604 2.063 235 HA PRO 35 HA PRO 35 -4.463 11.874 3.253 236 HB2 PRO 35 1HB PRO 35 -4.964 13.596 1.215 237 HB3 PRO 35 2HB PRO 35 -4.515 14.133 2.838 238 HG2 PRO 35 1HG PRO 35 -2.809 13.856 0.393 239 HG3 PRO 35 2HG PRO 35 -2.843 15.163 1.592 240 HD2 PRO 35 1HD PRO 35 -0.958 13.219 1.608 241 HD3 PRO 35 2HD PRO 35 -1.551 13.987 3.096 242 H LYS 36 H LYS 36 -2.636 11.695 0.215 243 HA LYS 36 HA LYS 36 -4.517 10.670 -1.493 244 HB2 LYS 36 1HB LYS 36 -1.637 9.769 -1.312 245 HB3 LYS 36 2HB LYS 36 -2.682 9.626 -2.719 246 HG2 LYS 36 1HG LYS 36 -1.904 12.248 -1.467 247 HG3 LYS 36 2HG LYS 36 -1.050 11.503 -2.819 248 HD2 LYS 36 1HD LYS 36 -3.452 11.422 -3.878 249 HD3 LYS 36 2HD LYS 36 -3.773 12.719 -2.725 250 HE2 LYS 36 1HE LYS 36 -1.488 12.727 -4.691 251 HE3 LYS 36 2HE LYS 36 -3.047 13.494 -4.988 252 HZ1 LYS 36 1HZ LYS 36 -0.948 14.721 -3.868 253 HZ2 LYS 36 2HZ LYS 36 -1.790 14.224 -2.489 254 HZ3 LYS 36 3HZ LYS 36 -2.555 15.198 -3.641 255 H ILE 37 H ILE 37 -2.604 8.906 0.906 256 HA ILE 37 HA ILE 37 -3.253 6.305 0.287 257 HB ILE 37 HB ILE 37 -3.011 7.486 3.057 258 HG12 ILE 37 1HG1 ILE 37 -0.954 6.218 1.236 259 HG13 ILE 37 2HG1 ILE 37 -1.040 7.920 1.678 260 HG21 ILE 37 1HG2 ILE 37 -2.539 4.629 2.247 261 HG22 ILE 37 2HG2 ILE 37 -2.649 5.301 3.875 262 HG23 ILE 37 3HG2 ILE 37 -4.088 5.206 2.861 263 HD11 ILE 37 1HD1 ILE 37 -0.959 6.507 4.090 264 HD12 ILE 37 2HD1 ILE 37 0.237 5.753 3.037 265 HD13 ILE 37 3HD1 ILE 37 0.317 7.483 3.363 266 H SER 38 H SER 38 -5.250 8.757 1.758 267 HA SER 38 HA SER 38 -7.232 7.270 2.963 268 HB2 SER 38 1HB SER 38 -8.660 9.168 2.730 269 HB3 SER 38 2HB SER 38 -7.020 9.798 2.888 270 HG SER 38 HG SER 38 -8.291 10.751 1.166 271 H THR 39 H THR 39 -6.819 8.023 -0.459 272 HA THR 39 HA THR 39 -9.269 6.690 -1.209 273 HB THR 39 HB THR 39 -8.461 7.091 -3.554 274 HG1 THR 39 1HG THR 39 -6.149 7.269 -2.561 275 HG21 THR 39 1HG2 THR 39 -9.596 8.829 -1.773 276 HG22 THR 39 2HG2 THR 39 -9.397 9.135 -3.499 277 HG23 THR 39 3HG2 THR 39 -8.210 9.751 -2.351 278 H SER 40 H SER 40 -6.190 5.678 -0.402 279 HA SER 40 HA SER 40 -5.154 3.652 -0.489 280 HB2 SER 40 1HB SER 40 -7.684 2.650 -1.813 281 HB3 SER 40 2HB SER 40 -6.441 1.669 -1.036 282 HG SER 40 HG SER 40 -8.450 3.224 0.090 283 H LEU 41 H LEU 41 -5.093 5.620 -2.707 284 HA LEU 41 HA LEU 41 -4.972 4.234 -5.179 285 HB2 LEU 41 1HB LEU 41 -4.053 6.890 -4.184 286 HB3 LEU 41 2HB LEU 41 -3.461 6.307 -5.738 287 HG LEU 41 HG LEU 41 -6.356 6.746 -5.009 288 HD11 LEU 41 1HD1 LEU 41 -4.385 8.353 -6.607 289 HD12 LEU 41 2HD1 LEU 41 -5.369 8.869 -5.238 290 HD13 LEU 41 3HD1 LEU 41 -6.130 8.530 -6.793 291 HD21 LEU 41 1HD2 LEU 41 -5.035 5.859 -7.568 292 HD22 LEU 41 2HD2 LEU 41 -6.712 6.392 -7.447 293 HD23 LEU 41 3HD2 LEU 41 -6.181 4.948 -6.584 294 HA PRO 42 HA PRO 42 -0.192 4.226 -4.375 295 HB2 PRO 42 1HB PRO 42 0.609 4.683 -1.822 296 HB3 PRO 42 2HB PRO 42 0.410 5.975 -3.012 297 HG2 PRO 42 1HG PRO 42 -1.454 5.097 -0.841 298 HG3 PRO 42 2HG PRO 42 -1.015 6.740 -1.342 299 HD2 PRO 42 1HD PRO 42 -3.331 5.556 -2.098 300 HD3 PRO 42 2HD PRO 42 -2.472 6.720 -3.127 301 H VAL 43 H VAL 43 -2.417 3.068 -1.927 302 HA VAL 43 HA VAL 43 -0.768 0.833 -1.159 303 HB VAL 43 HB VAL 43 -3.712 1.166 -0.600 304 HG11 VAL 43 1HG1 VAL 43 -3.514 -0.583 0.779 305 HG12 VAL 43 2HG1 VAL 43 -2.009 -0.921 -0.078 306 HG13 VAL 43 3HG1 VAL 43 -1.980 -0.009 1.431 307 HG21 VAL 43 1HG2 VAL 43 -1.977 1.967 1.564 308 HG22 VAL 43 2HG2 VAL 43 -1.714 2.962 0.133 309 HG23 VAL 43 3HG2 VAL 43 -3.328 2.829 0.830 310 H LEU 44 H LEU 44 -3.551 1.378 -3.254 311 HA LEU 44 HA LEU 44 -3.932 -1.396 -3.857 312 HB2 LEU 44 1HB LEU 44 -4.974 1.145 -5.078 313 HB3 LEU 44 2HB LEU 44 -5.372 -0.448 -5.720 314 HG LEU 44 HG LEU 44 -5.938 0.248 -2.858 315 HD11 LEU 44 1HD1 LEU 44 -8.065 1.102 -3.404 316 HD12 LEU 44 2HD1 LEU 44 -7.895 0.653 -5.101 317 HD13 LEU 44 3HD1 LEU 44 -6.921 1.963 -4.435 318 HD21 LEU 44 1HD2 LEU 44 -7.207 -1.634 -2.838 319 HD22 LEU 44 2HD2 LEU 44 -6.060 -2.108 -4.092 320 HD23 LEU 44 3HD2 LEU 44 -7.651 -1.488 -4.540 321 H ASP 45 H ASP 45 -2.494 1.362 -5.569 322 HA ASP 45 HA ASP 45 -1.792 -0.049 -7.906 323 HB2 ASP 45 1HB ASP 45 -1.027 2.551 -6.676 324 HB3 ASP 45 2HB ASP 45 0.030 1.903 -7.928 325 H LEU 46 H LEU 46 -0.096 0.514 -4.868 326 HA LEU 46 HA LEU 46 2.431 -0.418 -5.590 327 HB2 LEU 46 1HB LEU 46 2.262 0.672 -3.530 328 HB3 LEU 46 2HB LEU 46 0.933 -0.352 -2.996 329 HG LEU 46 HG LEU 46 2.465 -2.215 -2.686 330 HD11 LEU 46 1HD1 LEU 46 4.434 -2.315 -3.695 331 HD12 LEU 46 2HD1 LEU 46 4.968 -0.855 -2.866 332 HD13 LEU 46 3HD1 LEU 46 4.127 -0.733 -4.411 333 HD21 LEU 46 1HD2 LEU 46 3.625 -1.398 -0.764 334 HD22 LEU 46 2HD2 LEU 46 2.092 -0.533 -0.877 335 HD23 LEU 46 3HD2 LEU 46 3.589 0.255 -1.377 336 H ILE 47 H ILE 47 -0.462 -2.158 -4.609 337 HA ILE 47 HA ILE 47 0.773 -4.696 -4.306 338 HB ILE 47 HB ILE 47 -2.112 -4.037 -4.915 339 HG12 ILE 47 1HG1 ILE 47 -0.986 -4.828 -2.241 340 HG13 ILE 47 2HG1 ILE 47 -0.974 -3.147 -2.762 341 HG21 ILE 47 1HG2 ILE 47 -2.501 -6.217 -5.046 342 HG22 ILE 47 2HG2 ILE 47 -0.769 -6.521 -4.919 343 HG23 ILE 47 3HG2 ILE 47 -1.765 -6.466 -3.463 344 HD11 ILE 47 1HD1 ILE 47 -3.555 -4.517 -3.023 345 HD12 ILE 47 2HD1 ILE 47 -2.972 -4.295 -1.373 346 HD13 ILE 47 3HD1 ILE 47 -3.176 -2.900 -2.433 347 H ASP 48 H ASP 48 -1.105 -3.249 -6.960 348 HA ASP 48 HA ASP 48 -1.006 -5.393 -8.730 349 HB2 ASP 48 1HB ASP 48 -1.855 -3.951 -10.308 350 HB3 ASP 48 2HB ASP 48 -2.208 -3.035 -8.845 351 H ALA 49 H ALA 49 1.254 -2.676 -8.366 352 HA ALA 49 HA ALA 49 2.992 -2.975 -10.389 353 HB1 ALA 49 1HB ALA 49 3.257 -1.374 -8.528 354 HB2 ALA 49 2HB ALA 49 3.866 -2.686 -7.518 355 HB3 ALA 49 3HB ALA 49 4.764 -2.188 -8.951 356 H ILE 50 H ILE 50 2.939 -5.028 -7.494 357 HA ILE 50 HA ILE 50 5.078 -6.697 -8.460 358 HB ILE 50 HB ILE 50 3.188 -7.211 -6.161 359 HG12 ILE 50 1HG1 ILE 50 5.955 -5.995 -6.080 360 HG13 ILE 50 2HG1 ILE 50 4.468 -5.057 -5.999 361 HG21 ILE 50 1HG2 ILE 50 4.298 -9.223 -6.842 362 HG22 ILE 50 2HG2 ILE 50 5.855 -8.400 -6.903 363 HG23 ILE 50 3HG2 ILE 50 5.051 -8.651 -5.354 364 HD11 ILE 50 1HD1 ILE 50 5.865 -6.051 -3.865 365 HD12 ILE 50 2HD1 ILE 50 4.188 -5.503 -3.840 366 HD13 ILE 50 3HD1 ILE 50 4.554 -7.215 -4.055 367 H GLN 51 H GLN 51 1.643 -7.319 -7.709 368 HA GLN 51 HA GLN 51 1.719 -9.548 -9.627 369 HB2 GLN 51 1HB GLN 51 1.099 -10.026 -7.228 370 HB3 GLN 51 2HB GLN 51 -0.349 -9.061 -7.482 371 HG2 GLN 51 1HG GLN 51 -1.130 -11.189 -7.831 372 HG3 GLN 51 2HG GLN 51 -0.762 -10.667 -9.474 373 HE21 GLN 51 1HE2 GLN 51 -0.203 -12.979 -7.078 374 HE22 GLN 51 2HE2 GLN 51 1.048 -13.865 -7.875 375 HA PRO 52 HA PRO 52 -0.712 -6.504 -11.972 376 HB2 PRO 52 1HB PRO 52 -0.193 -7.642 -14.381 377 HB3 PRO 52 2HB PRO 52 0.927 -6.533 -13.581 378 HG2 PRO 52 1HG PRO 52 0.966 -9.525 -13.673 379 HG3 PRO 52 2HG PRO 52 2.311 -8.382 -13.850 380 HD2 PRO 52 1HD PRO 52 1.814 -9.701 -11.538 381 HD3 PRO 52 2HD PRO 52 2.508 -8.067 -11.576 382 H GLY 53 H GLY 53 -2.800 -6.639 -12.624 383 HA2 GLY 53 1HA GLY 53 -4.611 -7.781 -13.718 384 HA3 GLY 53 2HA GLY 53 -3.905 -9.306 -13.207 385 H SER 54 H SER 54 -3.409 -8.395 -10.480 386 HA SER 54 HA SER 54 -5.759 -9.262 -9.262 387 HB2 SER 54 1HB SER 54 -4.750 -8.353 -7.153 388 HB3 SER 54 2HB SER 54 -3.658 -9.383 -8.079 389 HG SER 54 HG SER 54 -2.872 -7.327 -9.005 390 H ILE 55 H ILE 55 -4.444 -5.943 -9.250 391 HA ILE 55 HA ILE 55 -6.995 -4.879 -8.396 392 HB ILE 55 HB ILE 55 -4.568 -3.303 -9.244 393 HG12 ILE 55 1HG1 ILE 55 -3.923 -4.924 -7.514 394 HG13 ILE 55 2HG1 ILE 55 -3.908 -3.282 -6.881 395 HG21 ILE 55 1HG2 ILE 55 -5.573 -1.476 -8.351 396 HG22 ILE 55 2HG2 ILE 55 -7.025 -2.381 -8.775 397 HG23 ILE 55 3HG2 ILE 55 -6.423 -2.408 -7.118 398 HD11 ILE 55 1HD1 ILE 55 -5.212 -5.519 -5.828 399 HD12 ILE 55 2HD1 ILE 55 -5.321 -3.845 -5.279 400 HD13 ILE 55 3HD1 ILE 55 -6.479 -4.464 -6.456 401 H ASN 56 H ASN 56 -8.394 -3.643 -9.585 402 HA ASN 56 HA ASN 56 -7.758 -3.141 -12.399 403 HB2 ASN 56 1HB ASN 56 -9.124 -5.323 -11.973 404 HB3 ASN 56 2HB ASN 56 -10.465 -4.220 -11.681 405 HD21 ASN 56 1HD2 ASN 56 -11.697 -4.546 -13.425 406 HD22 ASN 56 2HD2 ASN 56 -11.181 -4.310 -15.057 407 H TYR 57 H TYR 57 -7.812 -0.975 -12.410 408 HA TYR 57 HA TYR 57 -9.195 0.729 -10.762 409 HB2 TYR 57 1HB TYR 57 -8.062 0.966 -13.502 410 HB3 TYR 57 2HB TYR 57 -9.154 2.239 -12.970 411 HD1 TYR 57 1HD TYR 57 -6.578 0.298 -11.091 412 HD2 TYR 57 2HD TYR 57 -7.851 4.101 -12.514 413 HE1 TYR 57 1HE TYR 57 -4.731 1.367 -9.869 414 HE2 TYR 57 2HE TYR 57 -6.007 5.180 -11.295 415 HH TYR 57 HH TYR 57 -3.830 4.619 -10.377 416 H ASP 58 H ASP 58 -10.307 -0.790 -13.745 417 HA ASP 58 HA ASP 58 -12.628 0.546 -14.274 418 HB2 ASP 58 1HB ASP 58 -11.544 -1.629 -15.329 419 HB3 ASP 58 2HB ASP 58 -12.739 -2.438 -14.319 420 H LEU 59 H LEU 59 -12.107 -1.912 -11.788 421 HA LEU 59 HA LEU 59 -14.860 -1.804 -10.914 422 HB2 LEU 59 1HB LEU 59 -12.564 -3.104 -9.478 423 HB3 LEU 59 2HB LEU 59 -14.280 -3.481 -9.347 424 HG LEU 59 HG LEU 59 -12.559 -4.010 -11.768 425 HD11 LEU 59 1HD1 LEU 59 -11.808 -5.683 -10.462 426 HD12 LEU 59 2HD1 LEU 59 -13.348 -6.430 -10.888 427 HD13 LEU 59 3HD1 LEU 59 -13.176 -5.577 -9.353 428 HD21 LEU 59 1HD2 LEU 59 -14.547 -4.037 -12.797 429 HD22 LEU 59 2HD2 LEU 59 -15.440 -4.073 -11.278 430 HD23 LEU 59 3HD2 LEU 59 -14.794 -5.568 -11.957 431 H LEU 60 H LEU 60 -11.741 -0.554 -9.889 432 HA LEU 60 HA LEU 60 -12.476 0.361 -7.340 433 HB2 LEU 60 1HB LEU 60 -10.471 1.643 -9.185 434 HB3 LEU 60 2HB LEU 60 -10.517 1.739 -7.426 435 HG LEU 60 HG LEU 60 -9.910 -0.737 -9.041 436 HD11 LEU 60 1HD1 LEU 60 -8.067 0.904 -7.316 437 HD12 LEU 60 2HD1 LEU 60 -8.162 1.046 -9.071 438 HD13 LEU 60 3HD1 LEU 60 -7.648 -0.473 -8.336 439 HD21 LEU 60 1HD2 LEU 60 -11.078 -0.944 -6.751 440 HD22 LEU 60 2HD2 LEU 60 -9.534 -0.412 -6.087 441 HD23 LEU 60 3HD2 LEU 60 -9.619 -1.891 -7.044 442 H LYS 61 H LYS 61 -12.435 2.791 -6.797 443 HA LYS 61 HA LYS 61 -14.490 4.068 -8.445 444 HB2 LYS 61 1HB LYS 61 -13.689 4.221 -5.586 445 HB3 LYS 61 2HB LYS 61 -14.351 5.680 -6.312 446 HG2 LYS 61 1HG LYS 61 -16.273 4.751 -5.551 447 HG3 LYS 61 2HG LYS 61 -16.208 3.982 -7.138 448 HD2 LYS 61 1HD LYS 61 -14.832 2.623 -4.883 449 HD3 LYS 61 2HD LYS 61 -16.596 2.591 -4.909 450 HE2 LYS 61 1HE LYS 61 -15.011 1.870 -7.346 451 HE3 LYS 61 2HE LYS 61 -15.284 0.686 -6.068 452 HZ1 LYS 61 1HZ LYS 61 -17.458 0.503 -6.578 453 HZ2 LYS 61 2HZ LYS 61 -16.942 1.029 -8.101 454 HZ3 LYS 61 3HZ LYS 61 -17.627 2.129 -7.014 455 H THR 62 H THR 62 -11.698 5.219 -6.544 456 HA THR 62 HA THR 62 -10.347 7.046 -6.854 457 HB THR 62 HB THR 62 -9.304 5.354 -8.323 458 HG1 THR 62 1HG THR 62 -7.927 6.844 -8.969 459 HG21 THR 62 1HG2 THR 62 -9.667 5.763 -10.835 460 HG22 THR 62 2HG2 THR 62 -11.163 6.561 -10.351 461 HG23 THR 62 3HG2 THR 62 -10.904 4.860 -9.961 462 H GLU 63 H GLU 63 -13.165 7.603 -7.214 463 HA GLU 63 HA GLU 63 -12.897 10.009 -8.863 464 HB2 GLU 63 1HB GLU 63 -15.140 9.664 -9.822 465 HB3 GLU 63 2HB GLU 63 -14.017 8.397 -10.297 466 HG2 GLU 63 1HG GLU 63 -15.017 7.117 -8.271 467 HG3 GLU 63 2HG GLU 63 -16.347 8.261 -8.439 468 H ASN 64 H ASN 64 -13.074 11.553 -7.363 469 HA ASN 64 HA ASN 64 -13.745 12.639 -5.447 470 HB2 ASN 64 1HB ASN 64 -16.546 12.097 -6.374 471 HB3 ASN 64 2HB ASN 64 -15.860 13.581 -5.719 472 HD21 ASN 64 1HD2 ASN 64 -15.885 11.461 -8.524 473 HD22 ASN 64 2HD2 ASN 64 -15.478 12.680 -9.679 474 H LEU 65 H LEU 65 -13.164 10.088 -4.720 475 HA LEU 65 HA LEU 65 -15.088 8.493 -3.579 476 HB2 LEU 65 1HB LEU 65 -12.280 9.120 -2.728 477 HB3 LEU 65 2HB LEU 65 -13.274 7.957 -1.853 478 HG LEU 65 HG LEU 65 -12.921 7.593 -4.787 479 HD11 LEU 65 1HD1 LEU 65 -10.684 7.727 -4.517 480 HD12 LEU 65 2HD1 LEU 65 -10.890 6.096 -3.879 481 HD13 LEU 65 3HD1 LEU 65 -10.766 7.465 -2.775 482 HD21 LEU 65 1HD2 LEU 65 -13.975 5.709 -4.278 483 HD22 LEU 65 2HD2 LEU 65 -13.956 6.130 -2.565 484 HD23 LEU 65 3HD2 LEU 65 -12.608 5.234 -3.268 485 H ASN 66 H ASN 66 -15.259 8.176 -1.078 486 HA ASN 66 HA ASN 66 -15.273 10.560 0.510 487 HB2 ASN 66 1HB ASN 66 -17.549 11.005 0.673 488 HB3 ASN 66 2HB ASN 66 -17.379 10.618 -1.036 489 HD21 ASN 66 1HD2 ASN 66 -17.910 8.431 -1.699 490 HD22 ASN 66 2HD2 ASN 66 -19.140 7.570 -0.844 491 H ASP 67 H ASP 67 -16.279 10.137 2.690 492 HA ASP 67 HA ASP 67 -15.140 8.169 4.080 493 HB2 ASP 67 1HB ASP 67 -16.467 9.833 5.207 494 HB3 ASP 67 2HB ASP 67 -17.947 9.216 4.477 495 H ASP 68 H ASP 68 -18.069 7.794 2.162 496 HA ASP 68 HA ASP 68 -18.572 5.103 2.980 497 HB2 ASP 68 1HB ASP 68 -19.652 6.930 0.874 498 HB3 ASP 68 2HB ASP 68 -19.977 5.203 0.744 499 H GLU 69 H GLU 69 -17.806 6.267 -0.300 500 HA GLU 69 HA GLU 69 -17.018 3.873 -1.383 501 HB2 GLU 69 1HB GLU 69 -15.817 6.580 -1.993 502 HB3 GLU 69 2HB GLU 69 -15.756 5.166 -3.037 503 HG2 GLU 69 1HG GLU 69 -18.420 6.149 -2.172 504 HG3 GLU 69 2HG GLU 69 -17.535 7.080 -3.380 505 H LYS 70 H LYS 70 -14.861 6.307 0.076 506 HA LYS 70 HA LYS 70 -12.435 5.135 -0.162 507 HB2 LYS 70 1HB LYS 70 -13.565 6.508 2.281 508 HB3 LYS 70 2HB LYS 70 -11.860 6.133 2.069 509 HG2 LYS 70 1HG LYS 70 -12.196 7.466 -0.178 510 HG3 LYS 70 2HG LYS 70 -13.538 8.178 0.720 511 HD2 LYS 70 1HD LYS 70 -12.007 8.822 2.510 512 HD3 LYS 70 2HD LYS 70 -10.662 8.087 1.636 513 HE2 LYS 70 1HE LYS 70 -10.587 9.757 0.073 514 HE3 LYS 70 2HE LYS 70 -12.302 10.133 0.233 515 HZ1 LYS 70 1HZ LYS 70 -10.082 10.935 2.016 516 HZ2 LYS 70 2HZ LYS 70 -11.697 11.012 2.511 517 HZ3 LYS 70 3HZ LYS 70 -11.174 11.928 1.190 518 H LEU 71 H LEU 71 -14.801 4.384 2.386 519 HA LEU 71 HA LEU 71 -13.324 2.478 3.766 520 HB2 LEU 71 1HB LEU 71 -15.339 3.292 4.712 521 HB3 LEU 71 2HB LEU 71 -16.284 2.763 3.321 522 HG LEU 71 HG LEU 71 -15.826 0.408 3.982 523 HD11 LEU 71 1HD1 LEU 71 -13.901 0.396 5.250 524 HD12 LEU 71 2HD1 LEU 71 -15.150 0.238 6.486 525 HD13 LEU 71 3HD1 LEU 71 -14.388 1.802 6.197 526 HD21 LEU 71 1HD2 LEU 71 -17.715 0.405 5.182 527 HD22 LEU 71 2HD2 LEU 71 -17.709 2.150 4.927 528 HD23 LEU 71 3HD2 LEU 71 -17.046 1.472 6.415 529 H ASN 72 H ASN 72 -15.699 1.938 1.162 530 HA ASN 72 HA ASN 72 -15.496 -0.801 0.941 531 HB2 ASN 72 1HB ASN 72 -15.882 1.225 -1.273 532 HB3 ASN 72 2HB ASN 72 -16.190 -0.503 -1.428 533 HD21 ASN 72 1HD2 ASN 72 -17.216 2.467 0.085 534 HD22 ASN 72 2HD2 ASN 72 -18.796 1.927 0.524 535 H ASN 73 H ASN 73 -13.378 1.682 -0.390 536 HA ASN 73 HA ASN 73 -11.795 -0.123 -1.933 537 HB2 ASN 73 1HB ASN 73 -11.557 2.746 -1.110 538 HB3 ASN 73 2HB ASN 73 -10.151 1.925 -1.784 539 HD21 ASN 73 1HD2 ASN 73 -10.585 3.753 -3.352 540 HD22 ASN 73 2HD2 ASN 73 -11.592 3.379 -4.706 541 H ALA 74 H ALA 74 -11.654 1.140 1.332 542 HA ALA 74 HA ALA 74 -9.008 0.368 1.940 543 HB1 ALA 74 1HB ALA 74 -11.323 0.620 3.855 544 HB2 ALA 74 2HB ALA 74 -9.604 0.706 4.246 545 HB3 ALA 74 3HB ALA 74 -10.352 1.971 3.270 546 H LYS 75 H LYS 75 -12.121 -1.246 2.556 547 HA LYS 75 HA LYS 75 -11.098 -3.530 3.803 548 HB2 LYS 75 1HB LYS 75 -13.595 -3.187 2.135 549 HB3 LYS 75 2HB LYS 75 -13.247 -4.605 3.115 550 HG2 LYS 75 1HG LYS 75 -13.367 -3.346 5.127 551 HG3 LYS 75 2HG LYS 75 -13.425 -1.821 4.238 552 HD2 LYS 75 1HD LYS 75 -15.531 -3.982 4.144 553 HD3 LYS 75 2HD LYS 75 -15.636 -2.492 5.085 554 HE2 LYS 75 1HE LYS 75 -15.334 -1.252 2.900 555 HE3 LYS 75 2HE LYS 75 -15.576 -2.800 2.092 556 HZ1 LYS 75 1HZ LYS 75 -17.501 -1.055 3.314 557 HZ2 LYS 75 2HZ LYS 75 -17.663 -2.662 3.814 558 HZ3 LYS 75 3HZ LYS 75 -17.728 -2.278 2.168 559 H TYR 76 H TYR 76 -11.644 -2.811 0.388 560 HA TYR 76 HA TYR 76 -11.015 -5.407 -0.566 561 HB2 TYR 76 1HB TYR 76 -12.287 -3.920 -1.966 562 HB3 TYR 76 2HB TYR 76 -11.010 -2.710 -1.928 563 HD1 TYR 76 1HD TYR 76 -11.985 -6.003 -3.267 564 HD2 TYR 76 2HD TYR 76 -9.120 -2.859 -3.387 565 HE1 TYR 76 1HE TYR 76 -11.017 -6.972 -5.310 566 HE2 TYR 76 2HE TYR 76 -8.144 -3.819 -5.431 567 HH TYR 76 HH TYR 76 -8.383 -5.356 -7.040 568 H ALA 77 H ALA 77 -9.124 -2.395 -0.421 569 HA ALA 77 HA ALA 77 -6.765 -3.219 -1.544 570 HB1 ALA 77 1HB ALA 77 -6.675 -1.010 -1.014 571 HB2 ALA 77 2HB ALA 77 -7.460 -1.236 0.549 572 HB3 ALA 77 3HB ALA 77 -5.757 -1.650 0.349 573 H ILE 78 H ILE 78 -7.421 -3.296 1.966 574 HA ILE 78 HA ILE 78 -5.170 -4.700 2.744 575 HB ILE 78 HB ILE 78 -7.926 -4.856 3.969 576 HG12 ILE 78 1HG1 ILE 78 -5.634 -3.171 4.941 577 HG13 ILE 78 2HG1 ILE 78 -6.717 -2.578 3.686 578 HG21 ILE 78 1HG2 ILE 78 -5.619 -6.350 4.552 579 HG22 ILE 78 2HG2 ILE 78 -5.770 -5.147 5.831 580 HG23 ILE 78 3HG2 ILE 78 -7.107 -6.247 5.493 581 HD11 ILE 78 1HD1 ILE 78 -7.231 -3.064 6.566 582 HD12 ILE 78 2HD1 ILE 78 -7.727 -1.723 5.534 583 HD13 ILE 78 3HD1 ILE 78 -8.561 -3.273 5.427 584 H SER 79 H SER 79 -8.284 -5.944 1.620 585 HA SER 79 HA SER 79 -7.895 -8.650 2.142 586 HB2 SER 79 1HB SER 79 -9.957 -7.311 1.166 587 HB3 SER 79 2HB SER 79 -9.283 -7.833 -0.378 588 HG SER 79 HG SER 79 -9.999 -9.519 1.793 589 H MET 80 H MET 80 -7.326 -6.948 -0.944 590 HA MET 80 HA MET 80 -6.282 -8.918 -2.474 591 HB2 MET 80 1HB MET 80 -5.187 -6.109 -2.238 592 HB3 MET 80 2HB MET 80 -4.878 -7.206 -3.577 593 HG2 MET 80 1HG MET 80 -7.472 -5.917 -2.796 594 HG3 MET 80 2HG MET 80 -6.562 -5.725 -4.292 595 HE1 MET 80 1HE MET 80 -6.819 -9.313 -5.775 596 HE2 MET 80 2HE MET 80 -6.953 -7.707 -6.491 597 HE3 MET 80 3HE MET 80 -5.685 -8.044 -5.312 598 H ALA 81 H ALA 81 -4.353 -6.928 -0.230 599 HA ALA 81 HA ALA 81 -1.873 -7.971 -0.534 600 HB1 ALA 81 1HB ALA 81 -1.945 -6.304 1.039 601 HB2 ALA 81 2HB ALA 81 -3.338 -6.996 1.871 602 HB3 ALA 81 3HB ALA 81 -1.742 -7.718 2.074 603 H ARG 82 H ARG 82 -4.455 -9.394 1.457 604 HA ARG 82 HA ARG 82 -2.916 -11.639 2.276 605 HB2 ARG 82 1HB ARG 82 -5.782 -10.841 2.424 606 HB3 ARG 82 2HB ARG 82 -5.392 -12.540 2.656 607 HG2 ARG 82 1HG ARG 82 -3.929 -10.442 4.199 608 HG3 ARG 82 2HG ARG 82 -5.538 -10.965 4.703 609 HD2 ARG 82 1HD ARG 82 -4.587 -13.348 4.529 610 HD3 ARG 82 2HD ARG 82 -3.007 -12.564 4.520 611 HE ARG 82 HE ARG 82 -4.546 -11.610 6.685 612 HH11 ARG 82 1HH1 ARG 82 -2.805 -14.429 5.615 613 HH12 ARG 82 2HH1 ARG 82 -2.445 -14.975 7.219 614 HH21 ARG 82 1HH2 ARG 82 -4.076 -12.319 8.801 615 HH22 ARG 82 2HH2 ARG 82 -3.168 -13.775 9.031 616 H LYS 83 H LYS 83 -5.309 -11.120 -0.282 617 HA LYS 83 HA LYS 83 -5.612 -13.699 -1.214 618 HB2 LYS 83 1HB LYS 83 -6.664 -11.423 -1.992 619 HB3 LYS 83 2HB LYS 83 -5.356 -11.445 -3.169 620 HG2 LYS 83 1HG LYS 83 -7.199 -12.401 -4.257 621 HG3 LYS 83 2HG LYS 83 -6.162 -13.759 -3.813 622 HD2 LYS 83 1HD LYS 83 -7.613 -14.515 -2.200 623 HD3 LYS 83 2HD LYS 83 -8.305 -12.915 -1.922 624 HE2 LYS 83 1HE LYS 83 -9.479 -13.037 -4.051 625 HE3 LYS 83 2HE LYS 83 -8.754 -14.612 -4.376 626 HZ1 LYS 83 1HZ LYS 83 -11.050 -14.727 -3.507 627 HZ2 LYS 83 2HZ LYS 83 -10.517 -14.037 -2.058 628 HZ3 LYS 83 3HZ LYS 83 -9.933 -15.550 -2.539 629 H ILE 84 H ILE 84 -3.191 -11.310 -2.275 630 HA ILE 84 HA ILE 84 -1.839 -13.105 -4.007 631 HB ILE 84 HB ILE 84 -0.027 -11.425 -4.020 632 HG12 ILE 84 1HG1 ILE 84 -1.745 -9.795 -2.154 633 HG13 ILE 84 2HG1 ILE 84 -0.420 -10.797 -1.574 634 HG21 ILE 84 1HG2 ILE 84 -1.178 -9.935 -5.331 635 HG22 ILE 84 2HG2 ILE 84 -2.326 -11.271 -5.270 636 HG23 ILE 84 3HG2 ILE 84 -2.555 -9.865 -4.232 637 HD11 ILE 84 1HD1 ILE 84 -0.055 -8.268 -2.056 638 HD12 ILE 84 2HD1 ILE 84 1.182 -9.444 -2.499 639 HD13 ILE 84 3HD1 ILE 84 0.090 -8.807 -3.729 640 H GLY 85 H GLY 85 -1.608 -12.400 -0.605 641 HA2 GLY 85 1HA GLY 85 -0.669 -14.284 0.717 642 HA3 GLY 85 2HA GLY 85 0.667 -14.281 -0.425 643 H ALA 86 H ALA 86 -0.896 -12.476 2.160 644 HA ALA 86 HA ALA 86 1.593 -11.610 3.218 645 HB1 ALA 86 1HB ALA 86 1.899 -9.617 2.290 646 HB2 ALA 86 2HB ALA 86 0.588 -9.986 1.170 647 HB3 ALA 86 3HB ALA 86 0.248 -9.131 2.675 648 H ARG 87 H ARG 87 1.279 -11.586 5.338 649 HA ARG 87 HA ARG 87 -1.304 -11.676 6.500 650 HB2 ARG 87 1HB ARG 87 1.466 -11.391 7.649 651 HB3 ARG 87 2HB ARG 87 0.033 -11.385 8.668 652 HG2 ARG 87 1HG ARG 87 -0.566 -13.609 7.712 653 HG3 ARG 87 2HG ARG 87 0.995 -13.611 6.891 654 HD2 ARG 87 1HD ARG 87 2.183 -13.739 8.893 655 HD3 ARG 87 2HD ARG 87 0.812 -13.177 9.849 656 HE ARG 87 HE ARG 87 -0.014 -15.331 9.895 657 HH11 ARG 87 1HH1 ARG 87 2.659 -15.118 7.676 658 HH12 ARG 87 2HH1 ARG 87 2.812 -16.833 7.489 659 HH21 ARG 87 1HH2 ARG 87 0.176 -17.593 9.658 660 HH22 ARG 87 2HH2 ARG 87 1.397 -18.240 8.616 661 H VAL 88 H VAL 88 -2.633 -9.998 6.634 662 HA VAL 88 HA VAL 88 -1.495 -7.333 7.165 663 HB VAL 88 HB VAL 88 -3.569 -6.406 6.194 664 HG11 VAL 88 1HG1 VAL 88 -2.739 -8.120 3.985 665 HG12 VAL 88 2HG1 VAL 88 -2.608 -6.370 4.175 666 HG13 VAL 88 3HG1 VAL 88 -1.386 -7.429 4.880 667 HG21 VAL 88 1HG2 VAL 88 -5.363 -7.703 6.003 668 HG22 VAL 88 2HG2 VAL 88 -4.546 -8.584 4.712 669 HG23 VAL 88 3HG2 VAL 88 -4.413 -9.142 6.380 670 H TYR 89 H TYR 89 -1.723 -6.734 9.210 671 HA TYR 89 HA TYR 89 -4.111 -7.621 10.687 672 HB2 TYR 89 1HB TYR 89 -1.629 -8.149 11.428 673 HB3 TYR 89 2HB TYR 89 -1.711 -6.517 12.082 674 HD1 TYR 89 2HD TYR 89 -3.849 -9.590 12.018 675 HD2 TYR 89 1HD TYR 89 -2.305 -6.346 14.298 676 HE1 TYR 89 2HE TYR 89 -4.998 -10.453 14.014 677 HE2 TYR 89 1HE TYR 89 -3.448 -7.201 16.300 678 HH TYR 89 HH TYR 89 -4.315 -9.875 16.922 679 H ALA 90 H ALA 90 -4.239 -5.412 8.935 680 HA ALA 90 HA ALA 90 -4.337 -3.115 10.770 681 HB1 ALA 90 1HB ALA 90 -3.037 -3.056 8.537 682 HB2 ALA 90 2HB ALA 90 -4.631 -2.884 7.801 683 HB3 ALA 90 3HB ALA 90 -4.062 -1.686 8.964 684 H LEU 91 H LEU 91 -6.137 -1.487 9.707 685 HA LEU 91 HA LEU 91 -8.624 -3.035 9.452 686 HB2 LEU 91 1HB LEU 91 -8.139 -2.019 11.769 687 HB3 LEU 91 2HB LEU 91 -8.493 -0.472 11.002 688 HG LEU 91 HG LEU 91 -10.743 -1.459 10.370 689 HD11 LEU 91 1HD1 LEU 91 -9.810 -3.558 12.318 690 HD12 LEU 91 2HD1 LEU 91 -10.312 -3.789 10.644 691 HD13 LEU 91 3HD1 LEU 91 -11.496 -3.314 11.861 692 HD21 LEU 91 1HD2 LEU 91 -11.505 -1.312 12.873 693 HD22 LEU 91 2HD2 LEU 91 -10.894 0.115 12.035 694 HD23 LEU 91 3HD2 LEU 91 -9.843 -0.782 13.131 695 HA PRO 92 HA PRO 92 -9.250 -0.433 5.937 696 HB2 PRO 92 1HB PRO 92 -11.876 -0.997 5.532 697 HB3 PRO 92 2HB PRO 92 -10.577 -2.125 5.125 698 HG2 PRO 92 1HG PRO 92 -12.352 -2.067 7.535 699 HG3 PRO 92 2HG PRO 92 -11.836 -3.455 6.558 700 HD2 PRO 92 1HD PRO 92 -10.687 -2.837 8.930 701 HD3 PRO 92 2HD PRO 92 -9.784 -3.584 7.598 702 H GLU 93 H GLU 93 -11.366 -0.285 8.751 703 HA GLU 93 HA GLU 93 -12.702 2.110 8.041 704 HB2 GLU 93 1HB GLU 93 -12.394 0.488 10.516 705 HB3 GLU 93 2HB GLU 93 -12.924 2.154 10.703 706 HG2 GLU 93 1HG GLU 93 -14.776 1.713 9.142 707 HG3 GLU 93 2HG GLU 93 -14.264 0.030 9.045 708 H ASP 94 H ASP 94 -9.756 1.425 9.844 709 HA ASP 94 HA ASP 94 -9.347 4.157 10.631 710 HB2 ASP 94 1HB ASP 94 -7.631 1.681 10.748 711 HB3 ASP 94 2HB ASP 94 -7.024 3.261 11.235 712 H LEU 95 H LEU 95 -8.129 2.032 8.091 713 HA LEU 95 HA LEU 95 -6.088 3.609 7.077 714 HB2 LEU 95 1HB LEU 95 -6.329 1.409 6.258 715 HB3 LEU 95 2HB LEU 95 -7.991 1.701 5.749 716 HG LEU 95 HG LEU 95 -7.149 3.198 3.973 717 HD11 LEU 95 1HD1 LEU 95 -4.865 3.450 3.497 718 HD12 LEU 95 2HD1 LEU 95 -4.402 2.168 4.615 719 HD13 LEU 95 3HD1 LEU 95 -5.001 3.706 5.236 720 HD21 LEU 95 1HD2 LEU 95 -5.936 1.311 2.687 721 HD22 LEU 95 2HD2 LEU 95 -7.609 1.066 3.189 722 HD23 LEU 95 3HD2 LEU 95 -6.295 0.333 4.110 723 H VAL 96 H VAL 96 -9.558 3.721 6.390 724 HA VAL 96 HA VAL 96 -9.678 5.469 4.295 725 HB VAL 96 HB VAL 96 -11.467 5.329 6.719 726 HG11 VAL 96 1HG1 VAL 96 -11.591 7.552 5.621 727 HG12 VAL 96 2HG1 VAL 96 -12.037 6.744 4.117 728 HG13 VAL 96 3HG1 VAL 96 -13.094 6.636 5.525 729 HG21 VAL 96 1HG2 VAL 96 -11.158 3.414 4.959 730 HG22 VAL 96 2HG2 VAL 96 -12.768 3.846 5.535 731 HG23 VAL 96 3HG2 VAL 96 -12.203 4.433 3.971 732 H GLU 97 H GLU 97 -8.999 6.208 7.663 733 HA GLU 97 HA GLU 97 -8.776 9.059 7.008 734 HB2 GLU 97 1HB GLU 97 -8.797 7.662 9.689 735 HB3 GLU 97 2HB GLU 97 -8.672 9.400 9.457 736 HG2 GLU 97 1HG GLU 97 -10.903 9.004 8.089 737 HG3 GLU 97 2HG GLU 97 -11.010 7.606 9.157 738 H VAL 98 H VAL 98 -6.812 7.198 6.065 739 HA VAL 98 HA VAL 98 -4.563 6.668 6.196 740 HB VAL 98 HB VAL 98 -4.387 9.642 6.681 741 HG11 VAL 98 1HG1 VAL 98 -2.369 7.858 6.560 742 HG12 VAL 98 2HG1 VAL 98 -2.540 8.258 4.849 743 HG13 VAL 98 3HG1 VAL 98 -2.231 9.534 6.027 744 HG21 VAL 98 1HG2 VAL 98 -5.236 10.060 4.665 745 HG22 VAL 98 2HG2 VAL 98 -4.236 8.818 3.911 746 HG23 VAL 98 3HG2 VAL 98 -5.786 8.385 4.635 747 H ASN 99 H ASN 99 -5.585 6.014 8.624 748 HA ASN 99 HA ASN 99 -4.206 7.330 10.768 749 HB2 ASN 99 1HB ASN 99 -6.003 4.962 10.508 750 HB3 ASN 99 2HB ASN 99 -4.990 5.077 11.945 751 HD21 ASN 99 1HD2 ASN 99 -7.707 5.106 12.154 752 HD22 ASN 99 2HD2 ASN 99 -8.240 6.675 12.644 753 HA PRO 100 HA PRO 100 -0.385 5.138 9.986 754 HB2 PRO 100 1HB PRO 100 1.019 6.382 11.949 755 HB3 PRO 100 2HB PRO 100 0.676 7.136 10.387 756 HG2 PRO 100 1HG PRO 100 -0.715 7.497 13.013 757 HG3 PRO 100 2HG PRO 100 -0.251 8.720 11.816 758 HD2 PRO 100 1HD PRO 100 -2.778 7.770 12.022 759 HD3 PRO 100 2HD PRO 100 -2.073 8.281 10.475 760 H LYS 101 H LYS 101 -2.561 4.809 12.458 761 HA LYS 101 HA LYS 101 -0.929 3.311 14.300 762 HB2 LYS 101 1HB LYS 101 -3.911 3.740 14.094 763 HB3 LYS 101 2HB LYS 101 -3.158 2.772 15.356 764 HG2 LYS 101 1HG LYS 101 -3.389 4.791 16.411 765 HG3 LYS 101 2HG LYS 101 -1.749 4.927 15.773 766 HD2 LYS 101 1HD LYS 101 -2.603 6.179 13.849 767 HD3 LYS 101 2HD LYS 101 -4.243 6.040 14.488 768 HE2 LYS 101 1HE LYS 101 -3.373 8.210 15.044 769 HE3 LYS 101 2HE LYS 101 -3.499 7.255 16.520 770 HZ1 LYS 101 1HZ LYS 101 -1.119 6.771 16.335 771 HZ2 LYS 101 2HZ LYS 101 -1.415 8.431 16.469 772 HZ3 LYS 101 3HZ LYS 101 -1.019 7.761 14.967 773 H MET 102 H MET 102 -3.298 2.586 11.779 774 HA MET 102 HA MET 102 -2.873 -0.280 12.173 775 HB2 MET 102 1HB MET 102 -4.795 1.146 10.327 776 HB3 MET 102 2HB MET 102 -4.749 -0.584 10.637 777 HG2 MET 102 1HG MET 102 -5.431 1.577 12.616 778 HG3 MET 102 2HG MET 102 -6.547 0.433 11.872 779 HE1 MET 102 1HE MET 102 -4.649 1.478 14.589 780 HE2 MET 102 2HE MET 102 -5.960 0.672 15.452 781 HE3 MET 102 3HE MET 102 -4.298 0.108 15.645 782 H VAL 103 H VAL 103 -2.703 2.163 9.596 783 HA VAL 103 HA VAL 103 -1.895 0.738 7.447 784 HB VAL 103 HB VAL 103 -0.643 3.334 8.354 785 HG11 VAL 103 1HG1 VAL 103 0.653 3.191 6.559 786 HG12 VAL 103 2HG1 VAL 103 -0.088 1.655 6.106 787 HG13 VAL 103 3HG1 VAL 103 -0.791 3.172 5.547 788 HG21 VAL 103 1HG2 VAL 103 -2.395 4.469 7.415 789 HG22 VAL 103 2HG2 VAL 103 -2.786 3.164 6.294 790 HG23 VAL 103 3HG2 VAL 103 -3.237 3.032 7.994 791 H MET 104 H MET 104 -0.112 1.193 10.380 792 HA MET 104 HA MET 104 2.497 0.827 9.719 793 HB2 MET 104 1HB MET 104 1.957 1.071 12.010 794 HB3 MET 104 2HB MET 104 0.904 -0.336 11.993 795 HG2 MET 104 1HG MET 104 3.819 -0.640 11.427 796 HG3 MET 104 2HG MET 104 3.245 -0.488 13.086 797 HE1 MET 104 1HE MET 104 0.193 -2.405 12.278 798 HE2 MET 104 2HE MET 104 0.882 -3.442 13.527 799 HE3 MET 104 3HE MET 104 0.996 -1.688 13.674 800 H THR 105 H THR 105 -0.052 -1.582 9.638 801 HA THR 105 HA THR 105 1.835 -3.687 8.923 802 HB THR 105 HB THR 105 -0.519 -4.938 8.702 803 HG1 THR 105 1HG THR 105 -1.816 -3.998 10.505 804 HG21 THR 105 1HG2 THR 105 -0.257 -5.661 11.009 805 HG22 THR 105 2HG2 THR 105 0.763 -4.264 11.354 806 HG23 THR 105 3HG2 THR 105 1.323 -5.511 10.241 807 H VAL 106 H VAL 106 -0.981 -2.019 7.545 808 HA VAL 106 HA VAL 106 -1.389 -3.254 5.189 809 HB VAL 106 HB VAL 106 -1.226 -0.284 5.676 810 HG11 VAL 106 1HG1 VAL 106 -1.227 -0.024 3.459 811 HG12 VAL 106 2HG1 VAL 106 -1.536 -1.739 3.175 812 HG13 VAL 106 3HG1 VAL 106 -2.879 -0.642 3.502 813 HG21 VAL 106 1HG2 VAL 106 -3.077 -0.836 6.835 814 HG22 VAL 106 2HG2 VAL 106 -3.830 -0.877 5.241 815 HG23 VAL 106 3HG2 VAL 106 -3.274 -2.373 5.991 816 H PHE 107 H PHE 107 1.302 -1.071 5.895 817 HA PHE 107 HA PHE 107 2.418 -1.499 3.237 818 HB2 PHE 107 1HB PHE 107 2.915 0.405 5.467 819 HB3 PHE 107 2HB PHE 107 4.278 0.020 4.420 820 HD1 PHE 107 2HD PHE 107 3.026 -0.242 1.805 821 HD2 PHE 107 1HD PHE 107 2.270 2.553 4.925 822 HE1 PHE 107 2HE PHE 107 2.211 1.383 0.148 823 HE2 PHE 107 1HE PHE 107 1.454 4.182 3.272 824 HZ PHE 107 HZ PHE 107 1.425 3.599 0.880 825 H ALA 108 H ALA 108 3.487 -1.850 6.620 826 HA ALA 108 HA ALA 108 5.909 -2.973 6.417 827 HB1 ALA 108 1HB ALA 108 3.671 -3.953 8.183 828 HB2 ALA 108 2HB ALA 108 5.373 -4.366 8.396 829 HB3 ALA 108 3HB ALA 108 4.844 -2.691 8.556 830 H CYS 109 H CYS 109 2.892 -4.845 6.092 831 HA CYS 109 HA CYS 109 4.041 -7.316 5.536 832 HB2 CYS 109 1HB CYS 109 1.871 -7.866 4.444 833 HB3 CYS 109 2HB CYS 109 1.684 -7.128 6.031 834 HG CYS 109 HG CYS 109 1.306 -4.519 4.724 835 H LEU 110 H LEU 110 3.245 -4.644 3.371 836 HA LEU 110 HA LEU 110 3.995 -6.080 1.001 837 HB2 LEU 110 1HB LEU 110 3.657 -3.108 1.334 838 HB3 LEU 110 2HB LEU 110 3.600 -4.027 -0.169 839 HG LEU 110 HG LEU 110 1.584 -4.404 2.033 840 HD11 LEU 110 1HD1 LEU 110 0.102 -2.949 0.670 841 HD12 LEU 110 2HD1 LEU 110 1.507 -2.490 -0.292 842 HD13 LEU 110 3HD1 LEU 110 1.445 -2.090 1.425 843 HD21 LEU 110 1HD2 LEU 110 1.579 -5.047 -0.914 844 HD22 LEU 110 2HD2 LEU 110 0.227 -5.300 0.191 845 HD23 LEU 110 3HD2 LEU 110 1.728 -6.202 0.410 846 H MET 111 H MET 111 5.343 -3.116 2.464 847 HA MET 111 HA MET 111 7.682 -2.960 1.052 848 HB2 MET 111 1HB MET 111 8.524 -1.557 2.750 849 HB3 MET 111 2HB MET 111 6.779 -1.354 2.813 850 HG2 MET 111 1HG MET 111 7.369 -1.528 5.037 851 HG3 MET 111 2HG MET 111 6.843 -3.161 4.635 852 HE1 MET 111 1HE MET 111 11.246 -1.853 4.984 853 HE2 MET 111 2HE MET 111 10.405 -1.739 3.437 854 HE3 MET 111 3HE MET 111 9.857 -0.779 4.812 855 H GLY 112 H GLY 112 6.895 -5.134 3.676 856 HA2 GLY 112 1HA GLY 112 9.301 -6.008 4.597 857 HA3 GLY 112 2HA GLY 112 7.943 -7.087 4.318 858 H LYS 113 H LYS 113 8.137 -6.318 1.369 859 HA LYS 113 HA LYS 113 9.893 -8.486 0.647 860 HB2 LYS 113 1HB LYS 113 8.096 -6.643 -0.918 861 HB3 LYS 113 2HB LYS 113 9.173 -7.782 -1.715 862 HG2 LYS 113 1HG LYS 113 7.991 -9.618 -0.993 863 HG3 LYS 113 2HG LYS 113 7.304 -8.764 0.390 864 HD2 LYS 113 1HD LYS 113 5.849 -7.496 -1.069 865 HD3 LYS 113 2HD LYS 113 6.597 -8.222 -2.493 866 HE2 LYS 113 1HE LYS 113 4.738 -9.540 -2.300 867 HE3 LYS 113 2HE LYS 113 5.874 -10.463 -1.317 868 HZ1 LYS 113 1HZ LYS 113 3.502 -9.870 -0.431 869 HZ2 LYS 113 2HZ LYS 113 4.242 -8.409 -0.009 870 HZ3 LYS 113 3HZ LYS 113 4.837 -9.867 0.610 871 H GLY 114 H GLY 114 10.768 -5.665 1.669 872 HA2 GLY 114 1HA GLY 114 12.390 -4.688 -0.511 873 HA3 GLY 114 2HA GLY 114 12.375 -4.077 1.137 874 H MET 115 H MET 115 13.911 -4.740 2.560 875 HA MET 115 HA MET 115 15.731 -6.881 1.699 876 HB2 MET 115 1HB MET 115 16.610 -4.525 1.236 877 HB3 MET 115 2HB MET 115 16.720 -4.341 2.981 878 HG2 MET 115 1HG MET 115 18.066 -6.564 1.474 879 HG3 MET 115 2HG MET 115 18.834 -5.013 1.806 880 HE1 MET 115 1HE MET 115 20.733 -6.021 2.772 881 HE2 MET 115 2HE MET 115 20.870 -6.656 4.411 882 HE3 MET 115 3HE MET 115 20.394 -7.723 3.088 883 H LYS 116 H LYS 116 14.569 -8.182 3.227 884 HA LYS 116 HA LYS 116 15.792 -8.261 5.781 885 HB2 LYS 116 1HB LYS 116 13.819 -7.853 7.177 886 HB3 LYS 116 2HB LYS 116 14.253 -6.420 6.254 887 HG2 LYS 116 1HG LYS 116 12.403 -6.570 4.891 888 HG3 LYS 116 2HG LYS 116 12.199 -8.299 5.181 889 HD2 LYS 116 1HD LYS 116 11.846 -6.289 7.383 890 HD3 LYS 116 2HD LYS 116 10.529 -6.683 6.275 891 HE2 LYS 116 1HE LYS 116 11.183 -9.153 6.913 892 HE3 LYS 116 2HE LYS 116 11.847 -8.371 8.347 893 HZ1 LYS 116 1HZ LYS 116 9.210 -7.455 7.702 894 HZ2 LYS 116 2HZ LYS 116 9.821 -8.036 9.169 895 HZ3 LYS 116 3HZ LYS 116 9.258 -9.121 7.999 896 H ARG 117 H ARG 117 14.789 -9.999 7.177 897 HA ARG 117 HA ARG 117 13.537 -12.060 5.481 898 HB2 ARG 117 1HB ARG 117 15.582 -12.461 7.672 899 HB3 ARG 117 2HB ARG 117 14.792 -13.746 6.768 900 HG2 ARG 117 1HG ARG 117 15.813 -12.887 4.700 901 HG3 ARG 117 2HG ARG 117 16.648 -11.657 5.649 902 HD2 ARG 117 1HD ARG 117 17.900 -13.310 6.827 903 HD3 ARG 117 2HD ARG 117 16.927 -14.613 6.146 904 HE ARG 117 HE ARG 117 19.104 -13.204 4.864 905 HH11 ARG 117 1HH1 ARG 117 16.337 -15.279 4.463 906 HH12 ARG 117 2HH1 ARG 117 16.870 -15.914 2.941 907 HH21 ARG 117 1HH2 ARG 117 19.817 -14.033 2.862 908 HH22 ARG 117 2HH2 ARG 117 18.851 -15.205 2.032 909 H VAL 118 H VAL 118 12.057 -13.472 6.477 910 HA VAL 118 HA VAL 118 10.662 -12.283 8.730 911 HB VAL 118 HB VAL 118 8.931 -13.983 8.293 912 HG11 VAL 118 1HG1 VAL 118 9.082 -13.150 5.583 913 HG12 VAL 118 2HG1 VAL 118 8.104 -12.476 6.888 914 HG13 VAL 118 3HG1 VAL 118 9.727 -11.854 6.590 915 HG21 VAL 118 1HG2 VAL 118 10.617 -14.843 5.950 916 HG22 VAL 118 2HG2 VAL 118 10.550 -15.722 7.479 917 HG23 VAL 118 3HG2 VAL 118 9.094 -15.543 6.499 918 H SER 119 H SER 119 9.665 -13.965 10.311 919 HA SER 119 HA SER 119 11.833 -15.129 11.744 920 HB2 SER 119 1HB SER 119 10.092 -15.878 13.330 921 HB3 SER 119 2HB SER 119 9.904 -14.176 12.912 922 HG SER 119 HG SER 119 8.523 -15.671 11.177 923 H GLY 120 H GLY 120 12.815 -16.885 10.944 924 HA2 GLY 120 1HA GLY 120 12.850 -19.272 10.848 925 HA3 GLY 120 2HA GLY 120 11.143 -19.248 10.430 926 HA PRO 121 HA PRO 121 12.831 -20.123 6.382 927 HB2 PRO 121 1HB PRO 121 10.428 -20.603 5.213 928 HB3 PRO 121 2HB PRO 121 11.253 -21.786 6.235 929 HG2 PRO 121 1HG PRO 121 9.023 -19.913 6.928 930 HG3 PRO 121 2HG PRO 121 9.226 -21.620 7.362 931 HD2 PRO 121 1HD PRO 121 9.789 -19.603 9.079 932 HD3 PRO 121 2HD PRO 121 10.680 -21.140 9.085 933 H SER 122 H SER 122 13.041 -18.960 4.506 934 HA SER 122 HA SER 122 11.342 -16.581 4.182 935 HB2 SER 122 1HB SER 122 13.424 -15.809 5.166 936 HB3 SER 122 2HB SER 122 14.360 -16.684 3.955 937 HG SER 122 HG SER 122 14.108 -15.058 2.661 938 H SER 123 H SER 123 11.430 -15.665 1.980 939 HA SER 123 HA SER 123 11.786 -17.807 -0.011 940 HB2 SER 123 1HB SER 123 9.809 -15.547 0.185 941 HB3 SER 123 2HB SER 123 10.140 -16.330 -1.360 942 HG SER 123 HG SER 123 8.462 -17.437 -0.469 943 H GLY 124 H GLY 124 12.044 -16.810 -2.316 944 HA2 GLY 124 1HA GLY 124 12.976 -14.905 -3.546 945 HA3 GLY 124 2HA GLY 124 14.009 -14.611 -2.156 Start of MODEL 9 1 H1 GLY 1 H GLY 1 22.060 -8.369 -11.512 2 HA2 GLY 1 1HA GLY 1 21.724 -6.157 -13.000 3 HA3 GLY 1 2HA GLY 1 20.644 -7.289 -13.800 4 H SER 2 H SER 2 19.020 -8.370 -12.378 5 HA SER 2 HA SER 2 17.369 -6.546 -11.143 6 HB2 SER 2 1HB SER 2 16.580 -8.746 -11.842 7 HB3 SER 2 2HB SER 2 17.575 -9.520 -10.609 8 HG SER 2 HG SER 2 15.493 -7.666 -10.075 9 H SER 3 H SER 3 17.535 -5.414 -9.336 10 HA SER 3 HA SER 3 18.637 -6.619 -6.934 11 HB2 SER 3 1HB SER 3 19.889 -4.253 -8.321 12 HB3 SER 3 2HB SER 3 20.087 -4.523 -6.590 13 HG SER 3 HG SER 3 21.223 -5.834 -8.718 14 H GLY 4 H GLY 4 17.855 -5.722 -5.053 15 HA2 GLY 4 1HA GLY 4 15.773 -3.667 -5.431 16 HA3 GLY 4 2HA GLY 4 15.758 -4.892 -4.171 17 H SER 5 H SER 5 15.622 -3.517 -2.439 18 HA SER 5 HA SER 5 18.085 -2.253 -1.637 19 HB2 SER 5 1HB SER 5 17.177 -0.023 -1.314 20 HB3 SER 5 2HB SER 5 16.986 -0.487 -3.005 21 HG SER 5 HG SER 5 14.886 -1.083 -1.278 22 H SER 6 H SER 6 18.062 -1.578 0.599 23 HA SER 6 HA SER 6 15.786 -2.090 2.255 24 HB2 SER 6 1HB SER 6 16.299 -4.389 2.041 25 HB3 SER 6 2HB SER 6 18.034 -4.097 2.154 26 HG SER 6 HG SER 6 17.063 -4.933 4.102 27 H GLY 7 H GLY 7 15.993 -1.165 4.255 28 HA2 GLY 7 1HA GLY 7 18.547 -0.510 5.388 29 HA3 GLY 7 2HA GLY 7 17.746 0.891 4.689 30 H ASN 8 H ASN 8 16.916 2.072 6.275 31 HA ASN 8 HA ASN 8 16.067 0.909 8.760 32 HB2 ASN 8 1HB ASN 8 15.609 3.747 7.833 33 HB3 ASN 8 2HB ASN 8 15.672 3.153 9.490 34 HD21 ASN 8 1HD2 ASN 8 17.587 3.016 10.507 35 HD22 ASN 8 2HD2 ASN 8 19.104 3.436 9.795 36 H ASP 9 H ASP 9 13.869 1.890 9.643 37 HA ASP 9 HA ASP 9 11.807 0.608 8.176 38 HB2 ASP 9 1HB ASP 9 10.389 2.000 9.957 39 HB3 ASP 9 2HB ASP 9 11.297 0.559 10.406 40 H ASP 10 H ASP 10 13.222 3.632 7.843 41 HA ASP 10 HA ASP 10 10.913 5.119 7.032 42 HB2 ASP 10 1HB ASP 10 13.202 6.000 7.892 43 HB3 ASP 10 2HB ASP 10 13.722 5.808 6.220 44 H ILE 11 H ILE 11 12.757 2.703 5.580 45 HA ILE 11 HA ILE 11 12.675 3.555 2.873 46 HB ILE 11 HB ILE 11 14.144 1.720 3.865 47 HG12 ILE 11 1HG1 ILE 11 12.696 0.821 1.385 48 HG13 ILE 11 2HG1 ILE 11 13.691 2.273 1.379 49 HG21 ILE 11 1HG2 ILE 11 12.373 -0.420 3.152 50 HG22 ILE 11 2HG2 ILE 11 13.233 -0.138 4.665 51 HG23 ILE 11 3HG2 ILE 11 11.641 0.577 4.409 52 HD11 ILE 11 1HD1 ILE 11 15.423 0.977 0.923 53 HD12 ILE 11 2HD1 ILE 11 15.278 0.306 2.549 54 HD13 ILE 11 3HD1 ILE 11 14.471 -0.483 1.194 55 H ILE 12 H ILE 12 10.318 2.263 4.993 56 HA ILE 12 HA ILE 12 8.619 0.812 3.415 57 HB ILE 12 HB ILE 12 7.896 2.867 5.503 58 HG12 ILE 12 1HG1 ILE 12 8.180 -0.144 5.594 59 HG13 ILE 12 2HG1 ILE 12 9.245 1.031 6.358 60 HG21 ILE 12 1HG2 ILE 12 6.203 0.949 3.954 61 HG22 ILE 12 2HG2 ILE 12 5.760 1.405 5.599 62 HG23 ILE 12 3HG2 ILE 12 5.901 2.641 4.348 63 HD11 ILE 12 1HD1 ILE 12 8.020 0.683 8.180 64 HD12 ILE 12 2HD1 ILE 12 6.798 1.683 7.394 65 HD13 ILE 12 3HD1 ILE 12 6.715 -0.074 7.268 66 H VAL 13 H VAL 13 9.081 4.295 3.439 67 HA VAL 13 HA VAL 13 6.877 4.825 1.671 68 HB VAL 13 HB VAL 13 9.175 6.565 2.573 69 HG11 VAL 13 1HG1 VAL 13 7.429 6.922 0.363 70 HG12 VAL 13 2HG1 VAL 13 6.987 8.093 1.607 71 HG13 VAL 13 3HG1 VAL 13 8.641 8.034 0.998 72 HG21 VAL 13 1HG2 VAL 13 7.936 6.551 4.449 73 HG22 VAL 13 2HG2 VAL 13 6.893 7.662 3.561 74 HG23 VAL 13 3HG2 VAL 13 6.503 5.943 3.619 75 H ASN 14 H ASN 14 10.422 5.056 1.327 76 HA ASN 14 HA ASN 14 10.552 5.671 -1.356 77 HB2 ASN 14 1HB ASN 14 12.422 5.320 0.481 78 HB3 ASN 14 2HB ASN 14 12.530 3.722 -0.251 79 HD21 ASN 14 1HD2 ASN 14 13.191 3.533 -2.404 80 HD22 ASN 14 2HD2 ASN 14 14.040 4.807 -3.205 81 H TRP 15 H TRP 15 10.684 2.404 0.066 82 HA TRP 15 HA TRP 15 10.828 0.881 -2.196 83 HB2 TRP 15 1HB TRP 15 10.714 0.136 0.259 84 HB3 TRP 15 2HB TRP 15 8.965 0.140 0.053 85 HD1 TRP 15 HD TRP 15 12.102 -1.771 -0.998 86 HE1 TRP 15 1HE TRP 15 11.392 -4.021 -2.027 87 HE3 TRP 15 3HE TRP 15 7.049 -1.015 -1.198 88 HZ2 TRP 15 2HZ TRP 15 9.006 -5.305 -2.819 89 HZ3 TRP 15 3HZ TRP 15 5.624 -2.803 -2.106 90 HH2 TRP 15 HH TRP 15 6.584 -4.903 -2.899 91 H VAL 16 H VAL 16 7.837 2.098 -0.696 92 HA VAL 16 HA VAL 16 6.056 1.030 -2.580 93 HB VAL 16 HB VAL 16 5.727 3.553 -0.949 94 HG11 VAL 16 1HG1 VAL 16 4.099 2.448 -2.969 95 HG12 VAL 16 2HG1 VAL 16 3.298 2.130 -1.428 96 HG13 VAL 16 3HG1 VAL 16 3.725 3.782 -1.877 97 HG21 VAL 16 1HG2 VAL 16 6.137 1.047 0.025 98 HG22 VAL 16 2HG2 VAL 16 5.225 2.308 0.854 99 HG23 VAL 16 3HG2 VAL 16 4.378 1.090 -0.100 100 H ASN 17 H ASN 17 7.506 4.277 -2.386 101 HA ASN 17 HA ASN 17 6.322 5.394 -4.631 102 HB2 ASN 17 1HB ASN 17 8.900 5.882 -3.190 103 HB3 ASN 17 2HB ASN 17 8.602 6.709 -4.717 104 HD21 ASN 17 1HD2 ASN 17 7.064 6.036 -1.599 105 HD22 ASN 17 2HD2 ASN 17 6.293 7.575 -1.452 106 H GLU 18 H GLU 18 9.580 3.941 -4.474 107 HA GLU 18 HA GLU 18 10.195 4.012 -7.157 108 HB2 GLU 18 1HB GLU 18 10.984 2.193 -4.921 109 HB3 GLU 18 2HB GLU 18 11.471 1.783 -6.559 110 HG2 GLU 18 1HG GLU 18 12.381 4.185 -6.663 111 HG3 GLU 18 2HG GLU 18 12.242 4.152 -4.906 112 H THR 19 H THR 19 8.899 1.150 -5.463 113 HA THR 19 HA THR 19 8.463 -0.561 -7.493 114 HB THR 19 HB THR 19 6.526 0.034 -5.250 115 HG1 THR 19 1HG THR 19 7.976 -1.001 -4.122 116 HG21 THR 19 1HG2 THR 19 6.084 -2.549 -5.809 117 HG22 THR 19 2HG2 THR 19 6.475 -1.971 -7.428 118 HG23 THR 19 3HG2 THR 19 5.147 -1.241 -6.529 119 H LEU 20 H LEU 20 6.532 2.298 -6.789 120 HA LEU 20 HA LEU 20 4.571 1.728 -8.811 121 HB2 LEU 20 1HB LEU 20 5.164 4.175 -7.164 122 HB3 LEU 20 2HB LEU 20 3.864 4.103 -8.350 123 HG LEU 20 HG LEU 20 3.940 2.061 -6.180 124 HD11 LEU 20 1HD1 LEU 20 3.188 3.425 -4.524 125 HD12 LEU 20 2HD1 LEU 20 2.504 4.601 -5.647 126 HD13 LEU 20 3HD1 LEU 20 4.244 4.562 -5.363 127 HD21 LEU 20 1HD2 LEU 20 2.299 2.317 -8.223 128 HD22 LEU 20 2HD2 LEU 20 1.521 3.492 -7.160 129 HD23 LEU 20 3HD2 LEU 20 1.710 1.817 -6.636 130 H ARG 21 H ARG 21 7.244 4.051 -8.480 131 HA ARG 21 HA ARG 21 6.974 5.333 -10.931 132 HB2 ARG 21 1HB ARG 21 8.589 5.753 -8.901 133 HB3 ARG 21 2HB ARG 21 9.697 4.756 -9.834 134 HG2 ARG 21 1HG ARG 21 10.265 6.881 -10.506 135 HG3 ARG 21 2HG ARG 21 9.137 6.384 -11.770 136 HD2 ARG 21 1HD ARG 21 7.326 7.552 -10.564 137 HD3 ARG 21 2HD ARG 21 8.504 8.100 -9.372 138 HE ARG 21 HE ARG 21 9.493 8.932 -11.787 139 HH11 ARG 21 1HH1 ARG 21 6.537 9.399 -10.010 140 HH12 ARG 21 2HH1 ARG 21 6.240 10.976 -10.664 141 HH21 ARG 21 1HH2 ARG 21 9.113 11.007 -12.656 142 HH22 ARG 21 2HH2 ARG 21 7.706 11.889 -12.170 143 H GLU 22 H GLU 22 8.982 2.505 -10.122 144 HA GLU 22 HA GLU 22 10.213 2.010 -12.498 145 HB2 GLU 22 1HB GLU 22 8.927 -0.068 -10.715 146 HB3 GLU 22 2HB GLU 22 10.174 -0.382 -11.914 147 HG2 GLU 22 1HG GLU 22 10.709 1.618 -9.778 148 HG3 GLU 22 2HG GLU 22 10.767 -0.098 -9.380 149 H ALA 23 H ALA 23 6.889 1.130 -11.639 150 HA ALA 23 HA ALA 23 6.396 0.047 -14.287 151 HB1 ALA 23 1HB ALA 23 5.288 -1.203 -12.691 152 HB2 ALA 23 2HB ALA 23 4.813 0.216 -11.757 153 HB3 ALA 23 3HB ALA 23 4.010 -0.143 -13.286 154 H GLU 24 H GLU 24 6.296 3.072 -12.805 155 HA GLU 24 HA GLU 24 5.700 5.119 -13.631 156 HB2 GLU 24 1HB GLU 24 4.380 3.798 -15.986 157 HB3 GLU 24 2HB GLU 24 5.094 5.401 -15.885 158 HG2 GLU 24 1HG GLU 24 7.226 4.626 -16.154 159 HG3 GLU 24 2HG GLU 24 6.852 3.039 -15.486 160 H LYS 25 H LYS 25 4.151 3.958 -11.730 161 HA LYS 25 HA LYS 25 1.373 3.988 -12.494 162 HB2 LYS 25 1HB LYS 25 2.928 3.383 -10.056 163 HB3 LYS 25 2HB LYS 25 1.318 4.035 -9.782 164 HG2 LYS 25 1HG LYS 25 1.257 1.622 -9.782 165 HG3 LYS 25 2HG LYS 25 0.370 2.251 -11.172 166 HD2 LYS 25 1HD LYS 25 2.510 1.911 -12.500 167 HD3 LYS 25 2HD LYS 25 3.096 0.980 -11.119 168 HE2 LYS 25 1HE LYS 25 0.516 0.394 -12.560 169 HE3 LYS 25 2HE LYS 25 2.053 -0.374 -12.958 170 HZ1 LYS 25 1HZ LYS 25 1.654 -0.583 -10.197 171 HZ2 LYS 25 2HZ LYS 25 1.703 -1.825 -11.344 172 HZ3 LYS 25 3HZ LYS 25 0.231 -1.087 -10.961 173 H SER 26 H SER 26 -0.212 5.443 -11.645 174 HA SER 26 HA SER 26 0.810 8.168 -11.435 175 HB2 SER 26 1HB SER 26 -1.906 6.998 -12.000 176 HB3 SER 26 2HB SER 26 -1.711 8.704 -11.600 177 HG SER 26 HG SER 26 -1.065 7.345 -13.904 178 H SER 27 H SER 27 0.631 5.960 -9.256 179 HA SER 27 HA SER 27 -0.665 7.658 -7.226 180 HB2 SER 27 1HB SER 27 -0.448 4.643 -7.323 181 HB3 SER 27 2HB SER 27 -1.035 5.548 -5.929 182 HG SER 27 HG SER 27 -2.264 5.017 -8.349 183 H SER 28 H SER 28 0.344 7.830 -5.193 184 HA SER 28 HA SER 28 2.739 6.532 -4.482 185 HB2 SER 28 1HB SER 28 4.374 8.283 -4.824 186 HB3 SER 28 2HB SER 28 3.613 7.916 -6.372 187 HG SER 28 HG SER 28 2.939 9.896 -6.452 188 H ILE 29 H ILE 29 3.938 7.988 -2.730 189 HA ILE 29 HA ILE 29 1.980 9.540 -1.203 190 HB ILE 29 HB ILE 29 2.773 8.341 0.893 191 HG12 ILE 29 1HG1 ILE 29 3.367 5.994 -0.857 192 HG13 ILE 29 2HG1 ILE 29 4.633 7.193 -0.607 193 HG21 ILE 29 1HG2 ILE 29 0.658 7.676 0.634 194 HG22 ILE 29 2HG2 ILE 29 0.838 7.504 -1.112 195 HG23 ILE 29 3HG2 ILE 29 1.331 6.192 -0.041 196 HD11 ILE 29 1HD1 ILE 29 3.936 6.818 1.927 197 HD12 ILE 29 2HD1 ILE 29 3.459 5.248 1.280 198 HD13 ILE 29 3HD1 ILE 29 5.123 5.806 1.105 199 H SER 30 H SER 30 2.920 10.879 0.445 200 HA SER 30 HA SER 30 5.656 11.668 -0.231 201 HB2 SER 30 1HB SER 30 3.617 13.284 -0.146 202 HB3 SER 30 2HB SER 30 3.848 13.219 1.602 203 HG SER 30 HG SER 30 5.706 14.077 -0.361 204 H SER 31 H SER 31 3.686 10.543 2.439 205 HA SER 31 HA SER 31 5.965 9.607 3.869 206 HB2 SER 31 1HB SER 31 5.921 11.023 5.783 207 HB3 SER 31 2HB SER 31 5.947 12.099 4.386 208 HG SER 31 HG SER 31 4.169 12.908 5.127 209 H PHE 32 H PHE 32 5.270 8.774 6.101 210 HA PHE 32 HA PHE 32 3.320 6.872 5.860 211 HB2 PHE 32 1HB PHE 32 4.488 8.237 8.265 212 HB3 PHE 32 2HB PHE 32 3.224 7.027 8.456 213 HD1 PHE 32 2HD PHE 32 3.801 4.941 6.654 214 HD2 PHE 32 1HD PHE 32 6.539 7.386 8.809 215 HE1 PHE 32 2HE PHE 32 5.491 3.157 6.525 216 HE2 PHE 32 1HE PHE 32 8.233 5.606 8.683 217 HZ PHE 32 HZ PHE 32 7.709 3.487 7.542 218 H LYS 33 H LYS 33 2.939 10.232 6.686 219 HA LYS 33 HA LYS 33 0.084 9.821 7.238 220 HB2 LYS 33 1HB LYS 33 1.934 12.147 7.764 221 HB3 LYS 33 2HB LYS 33 0.190 12.249 7.967 222 HG2 LYS 33 1HG LYS 33 0.442 10.239 9.530 223 HG3 LYS 33 2HG LYS 33 2.166 10.617 9.520 224 HD2 LYS 33 1HD LYS 33 1.520 11.857 11.325 225 HD3 LYS 33 2HD LYS 33 1.260 13.050 10.051 226 HE2 LYS 33 1HE LYS 33 -1.055 12.735 10.070 227 HE3 LYS 33 2HE LYS 33 -0.930 11.189 10.907 228 HZ1 LYS 33 1HZ LYS 33 -0.843 12.182 12.899 229 HZ2 LYS 33 2HZ LYS 33 -1.549 13.495 12.103 230 HZ3 LYS 33 3HZ LYS 33 0.123 13.461 12.359 231 H ASP 34 H ASP 34 0.800 9.464 4.609 232 HA ASP 34 HA ASP 34 0.462 11.894 3.112 233 HB2 ASP 34 1HB ASP 34 1.743 10.306 1.974 234 HB3 ASP 34 2HB ASP 34 0.662 8.984 2.404 235 HA PRO 35 HA PRO 35 -3.945 12.037 3.161 236 HB2 PRO 35 1HB PRO 35 -4.309 13.640 1.001 237 HB3 PRO 35 2HB PRO 35 -3.721 14.242 2.555 238 HG2 PRO 35 1HG PRO 35 -2.178 13.544 0.087 239 HG3 PRO 35 2HG PRO 35 -1.987 14.936 1.169 240 HD2 PRO 35 1HD PRO 35 -0.372 12.766 1.289 241 HD3 PRO 35 2HD PRO 35 -0.792 13.723 2.724 242 H LYS 36 H LYS 36 -2.369 11.491 0.015 243 HA LYS 36 HA LYS 36 -4.484 10.512 -1.439 244 HB2 LYS 36 1HB LYS 36 -1.547 10.032 -1.476 245 HB3 LYS 36 2HB LYS 36 -2.558 8.938 -2.414 246 HG2 LYS 36 1HG LYS 36 -2.117 10.512 -3.993 247 HG3 LYS 36 2HG LYS 36 -3.589 11.196 -3.299 248 HD2 LYS 36 1HD LYS 36 -2.111 13.007 -3.412 249 HD3 LYS 36 2HD LYS 36 -2.022 12.482 -1.728 250 HE2 LYS 36 1HE LYS 36 0.207 12.734 -2.256 251 HE3 LYS 36 2HE LYS 36 -0.041 11.019 -2.581 252 HZ1 LYS 36 1HZ LYS 36 -0.661 12.281 -4.932 253 HZ2 LYS 36 2HZ LYS 36 0.758 11.426 -4.595 254 HZ3 LYS 36 3HZ LYS 36 0.708 13.102 -4.373 255 H ILE 37 H ILE 37 -2.702 8.948 1.117 256 HA ILE 37 HA ILE 37 -3.352 6.284 0.681 257 HB ILE 37 HB ILE 37 -3.099 7.709 3.333 258 HG12 ILE 37 1HG1 ILE 37 -1.111 6.380 1.500 259 HG13 ILE 37 2HG1 ILE 37 -1.064 8.010 2.164 260 HG21 ILE 37 1HG2 ILE 37 -4.244 5.436 3.311 261 HG22 ILE 37 2HG2 ILE 37 -2.683 4.778 2.825 262 HG23 ILE 37 3HG2 ILE 37 -2.845 5.615 4.369 263 HD11 ILE 37 1HD1 ILE 37 -0.148 5.478 3.307 264 HD12 ILE 37 2HD1 ILE 37 0.402 7.128 3.599 265 HD13 ILE 37 3HD1 ILE 37 -1.031 6.517 4.425 266 H SER 38 H SER 38 -5.291 8.894 1.967 267 HA SER 38 HA SER 38 -7.329 7.477 3.208 268 HB2 SER 38 1HB SER 38 -7.533 9.751 3.543 269 HB3 SER 38 2HB SER 38 -7.157 10.139 1.865 270 HG SER 38 HG SER 38 -9.237 10.333 1.662 271 H THR 39 H THR 39 -6.731 8.050 -0.192 272 HA THR 39 HA THR 39 -9.277 6.864 -0.961 273 HB THR 39 HB THR 39 -8.456 7.280 -3.304 274 HG1 THR 39 1HG THR 39 -6.152 7.392 -2.382 275 HG21 THR 39 1HG2 THR 39 -9.442 9.287 -3.203 276 HG22 THR 39 2HG2 THR 39 -8.192 9.937 -2.141 277 HG23 THR 39 3HG2 THR 39 -9.541 9.027 -1.462 278 H SER 40 H SER 40 -6.215 5.793 -0.173 279 HA SER 40 HA SER 40 -5.212 3.751 -0.287 280 HB2 SER 40 1HB SER 40 -7.716 2.767 -1.667 281 HB3 SER 40 2HB SER 40 -6.524 1.802 -0.798 282 HG SER 40 HG SER 40 -8.195 3.793 0.346 283 H LEU 41 H LEU 41 -5.144 5.754 -2.487 284 HA LEU 41 HA LEU 41 -5.025 4.391 -4.972 285 HB2 LEU 41 1HB LEU 41 -4.107 7.036 -3.950 286 HB3 LEU 41 2HB LEU 41 -3.502 6.467 -5.504 287 HG LEU 41 HG LEU 41 -6.399 6.916 -4.789 288 HD11 LEU 41 1HD1 LEU 41 -6.137 8.680 -6.606 289 HD12 LEU 41 2HD1 LEU 41 -4.398 8.504 -6.367 290 HD13 LEU 41 3HD1 LEU 41 -5.421 9.033 -5.033 291 HD21 LEU 41 1HD2 LEU 41 -6.277 5.123 -6.350 292 HD22 LEU 41 2HD2 LEU 41 -5.067 5.966 -7.318 293 HD23 LEU 41 3HD2 LEU 41 -6.722 6.573 -7.251 294 HA PRO 42 HA PRO 42 -0.246 4.362 -4.173 295 HB2 PRO 42 1HB PRO 42 0.563 4.809 -1.620 296 HB3 PRO 42 2HB PRO 42 0.365 6.105 -2.805 297 HG2 PRO 42 1HG PRO 42 -1.497 5.226 -0.633 298 HG3 PRO 42 2HG PRO 42 -1.055 6.869 -1.129 299 HD2 PRO 42 1HD PRO 42 -3.374 5.694 -1.884 300 HD3 PRO 42 2HD PRO 42 -2.515 6.858 -2.913 301 H VAL 43 H VAL 43 -2.559 3.131 -1.893 302 HA VAL 43 HA VAL 43 -0.878 0.882 -1.133 303 HB VAL 43 HB VAL 43 -3.778 1.271 -0.414 304 HG11 VAL 43 1HG1 VAL 43 -3.225 -0.858 0.246 305 HG12 VAL 43 2HG1 VAL 43 -1.538 -0.442 0.553 306 HG13 VAL 43 3HG1 VAL 43 -2.792 0.058 1.689 307 HG21 VAL 43 1HG2 VAL 43 -1.668 3.007 0.241 308 HG22 VAL 43 2HG2 VAL 43 -3.288 2.970 0.935 309 HG23 VAL 43 3HG2 VAL 43 -1.986 2.048 1.686 310 H LEU 44 H LEU 44 -3.405 1.642 -3.370 311 HA LEU 44 HA LEU 44 -3.987 -1.159 -3.914 312 HB2 LEU 44 1HB LEU 44 -5.103 1.430 -4.948 313 HB3 LEU 44 2HB LEU 44 -5.524 -0.125 -5.662 314 HG LEU 44 HG LEU 44 -5.995 0.553 -2.764 315 HD11 LEU 44 1HD1 LEU 44 -8.138 0.517 -4.848 316 HD12 LEU 44 2HD1 LEU 44 -7.214 1.987 -4.538 317 HD13 LEU 44 3HD1 LEU 44 -8.150 1.243 -3.241 318 HD21 LEU 44 1HD2 LEU 44 -6.499 -1.599 -2.598 319 HD22 LEU 44 2HD2 LEU 44 -6.179 -1.841 -4.316 320 HD23 LEU 44 3HD2 LEU 44 -7.789 -1.365 -3.776 321 H ASP 45 H ASP 45 -2.688 1.675 -5.618 322 HA ASP 45 HA ASP 45 -2.098 0.330 -8.028 323 HB2 ASP 45 1HB ASP 45 -2.160 2.904 -7.399 324 HB3 ASP 45 2HB ASP 45 -0.435 2.648 -7.151 325 H LEU 46 H LEU 46 -0.420 0.590 -4.997 326 HA LEU 46 HA LEU 46 2.156 -0.165 -5.912 327 HB2 LEU 46 1HB LEU 46 2.086 0.884 -3.824 328 HB3 LEU 46 2HB LEU 46 0.801 -0.171 -3.238 329 HG LEU 46 HG LEU 46 2.347 -2.002 -2.994 330 HD11 LEU 46 1HD1 LEU 46 4.152 -2.146 -4.269 331 HD12 LEU 46 2HD1 LEU 46 4.862 -0.792 -3.391 332 HD13 LEU 46 3HD1 LEU 46 3.910 -0.497 -4.846 333 HD21 LEU 46 1HD2 LEU 46 2.308 0.237 -1.439 334 HD22 LEU 46 2HD2 LEU 46 4.030 0.065 -1.781 335 HD23 LEU 46 3HD2 LEU 46 3.142 -1.264 -1.033 336 H ILE 47 H ILE 47 -0.584 -1.986 -4.605 337 HA ILE 47 HA ILE 47 0.630 -4.492 -4.422 338 HB ILE 47 HB ILE 47 -2.247 -3.802 -5.027 339 HG12 ILE 47 1HG1 ILE 47 -1.044 -4.766 -2.433 340 HG13 ILE 47 2HG1 ILE 47 -1.177 -3.057 -2.832 341 HG21 ILE 47 1HG2 ILE 47 -2.058 -6.319 -3.782 342 HG22 ILE 47 2HG2 ILE 47 -2.609 -5.955 -5.417 343 HG23 ILE 47 3HG2 ILE 47 -0.911 -6.329 -5.121 344 HD11 ILE 47 1HD1 ILE 47 -3.057 -4.548 -1.525 345 HD12 ILE 47 2HD1 ILE 47 -3.344 -3.004 -2.330 346 HD13 ILE 47 3HD1 ILE 47 -3.672 -4.515 -3.178 347 H ASP 48 H ASP 48 -1.273 -3.120 -7.104 348 HA ASP 48 HA ASP 48 -1.152 -5.224 -8.875 349 HB2 ASP 48 1HB ASP 48 -2.500 -3.315 -9.398 350 HB3 ASP 48 2HB ASP 48 -1.096 -2.251 -9.402 351 H ALA 49 H ALA 49 1.153 -2.511 -8.666 352 HA ALA 49 HA ALA 49 2.939 -3.083 -10.597 353 HB1 ALA 49 1HB ALA 49 3.200 -1.948 -7.886 354 HB2 ALA 49 2HB ALA 49 4.697 -2.468 -8.661 355 HB3 ALA 49 3HB ALA 49 3.663 -1.277 -9.449 356 H ILE 50 H ILE 50 2.939 -4.623 -7.386 357 HA ILE 50 HA ILE 50 5.107 -6.357 -7.915 358 HB ILE 50 HB ILE 50 2.870 -6.796 -5.937 359 HG12 ILE 50 1HG1 ILE 50 5.520 -5.427 -5.457 360 HG13 ILE 50 2HG1 ILE 50 4.021 -4.557 -5.766 361 HG21 ILE 50 1HG2 ILE 50 5.712 -7.802 -5.949 362 HG22 ILE 50 2HG2 ILE 50 4.486 -8.140 -4.727 363 HG23 ILE 50 3HG2 ILE 50 4.290 -8.755 -6.368 364 HD11 ILE 50 1HD1 ILE 50 4.248 -4.549 -3.449 365 HD12 ILE 50 2HD1 ILE 50 3.083 -5.835 -3.768 366 HD13 ILE 50 3HD1 ILE 50 4.761 -6.236 -3.402 367 H GLN 51 H GLN 51 1.620 -7.093 -7.689 368 HA GLN 51 HA GLN 51 2.099 -9.430 -9.414 369 HB2 GLN 51 1HB GLN 51 1.166 -9.798 -7.090 370 HB3 GLN 51 2HB GLN 51 -0.289 -8.971 -7.628 371 HG2 GLN 51 1HG GLN 51 -0.832 -11.194 -7.904 372 HG3 GLN 51 2HG GLN 51 -0.311 -10.718 -9.521 373 HE21 GLN 51 1HE2 GLN 51 0.597 -12.427 -6.607 374 HE22 GLN 51 2HE2 GLN 51 1.834 -13.394 -7.328 375 HA PRO 52 HA PRO 52 -0.131 -6.726 -12.293 376 HB2 PRO 52 1HB PRO 52 0.697 -8.058 -14.509 377 HB3 PRO 52 2HB PRO 52 1.691 -6.847 -13.689 378 HG2 PRO 52 1HG PRO 52 1.801 -9.833 -13.498 379 HG3 PRO 52 2HG PRO 52 3.133 -8.670 -13.622 380 HD2 PRO 52 1HD PRO 52 2.391 -9.791 -11.271 381 HD3 PRO 52 2HD PRO 52 3.051 -8.146 -11.378 382 H GLY 53 H GLY 53 -2.254 -7.057 -12.475 383 HA2 GLY 53 1HA GLY 53 -4.011 -8.176 -13.719 384 HA3 GLY 53 2HA GLY 53 -3.171 -9.693 -13.431 385 H SER 54 H SER 54 -3.870 -7.128 -11.099 386 HA SER 54 HA SER 54 -5.733 -8.951 -9.735 387 HB2 SER 54 1HB SER 54 -4.743 -7.973 -7.562 388 HB3 SER 54 2HB SER 54 -3.797 -9.189 -8.419 389 HG SER 54 HG SER 54 -2.762 -7.284 -9.457 390 H ILE 55 H ILE 55 -4.464 -5.619 -9.582 391 HA ILE 55 HA ILE 55 -7.010 -4.621 -8.648 392 HB ILE 55 HB ILE 55 -4.594 -3.019 -9.486 393 HG12 ILE 55 1HG1 ILE 55 -4.090 -4.719 -7.714 394 HG13 ILE 55 2HG1 ILE 55 -3.870 -3.053 -7.191 395 HG21 ILE 55 1HG2 ILE 55 -7.221 -2.343 -8.514 396 HG22 ILE 55 2HG2 ILE 55 -5.973 -1.757 -7.416 397 HG23 ILE 55 3HG2 ILE 55 -5.941 -1.290 -9.117 398 HD11 ILE 55 1HD1 ILE 55 -5.349 -5.038 -5.931 399 HD12 ILE 55 2HD1 ILE 55 -5.319 -3.317 -5.542 400 HD13 ILE 55 3HD1 ILE 55 -6.545 -3.953 -6.639 401 H ASN 56 H ASN 56 -8.514 -3.520 -9.794 402 HA ASN 56 HA ASN 56 -7.939 -2.919 -12.614 403 HB2 ASN 56 1HB ASN 56 -9.372 -5.077 -12.052 404 HB3 ASN 56 2HB ASN 56 -10.664 -3.892 -11.872 405 HD21 ASN 56 1HD2 ASN 56 -11.797 -3.542 -13.626 406 HD22 ASN 56 2HD2 ASN 56 -11.244 -3.716 -15.254 407 H TYR 57 H TYR 57 -7.929 -0.748 -12.566 408 HA TYR 57 HA TYR 57 -9.343 0.917 -10.857 409 HB2 TYR 57 1HB TYR 57 -8.019 1.269 -13.500 410 HB3 TYR 57 2HB TYR 57 -9.093 2.551 -12.950 411 HD1 TYR 57 1HD TYR 57 -6.990 0.455 -10.748 412 HD2 TYR 57 2HD TYR 57 -7.472 4.252 -12.606 413 HE1 TYR 57 1HE TYR 57 -5.180 1.363 -9.349 414 HE2 TYR 57 2HE TYR 57 -5.664 5.169 -11.215 415 HH TYR 57 HH TYR 57 -4.444 3.577 -8.503 416 H ASP 58 H ASP 58 -10.390 -0.732 -13.720 417 HA ASP 58 HA ASP 58 -12.599 0.802 -14.453 418 HB2 ASP 58 1HB ASP 58 -11.508 -1.368 -15.505 419 HB3 ASP 58 2HB ASP 58 -12.777 -2.176 -14.588 420 H LEU 59 H LEU 59 -12.200 -1.547 -11.884 421 HA LEU 59 HA LEU 59 -15.031 -1.424 -11.200 422 HB2 LEU 59 1HB LEU 59 -12.890 -2.887 -9.687 423 HB3 LEU 59 2HB LEU 59 -14.626 -3.194 -9.698 424 HG LEU 59 HG LEU 59 -12.696 -3.745 -11.952 425 HD11 LEU 59 1HD1 LEU 59 -14.309 -5.721 -10.367 426 HD12 LEU 59 2HD1 LEU 59 -12.674 -5.248 -9.904 427 HD13 LEU 59 3HD1 LEU 59 -12.960 -6.027 -11.461 428 HD21 LEU 59 1HD2 LEU 59 -15.588 -3.461 -11.888 429 HD22 LEU 59 2HD2 LEU 59 -15.074 -5.041 -12.477 430 HD23 LEU 59 3HD2 LEU 59 -14.491 -3.574 -13.264 431 H LEU 60 H LEU 60 -11.912 -0.338 -10.020 432 HA LEU 60 HA LEU 60 -12.691 0.500 -7.458 433 HB2 LEU 60 1HB LEU 60 -10.587 1.750 -9.215 434 HB3 LEU 60 2HB LEU 60 -10.695 1.854 -7.459 435 HG LEU 60 HG LEU 60 -10.075 -0.623 -9.068 436 HD11 LEU 60 1HD1 LEU 60 -7.918 -0.368 -7.666 437 HD12 LEU 60 2HD1 LEU 60 -8.419 1.313 -7.502 438 HD13 LEU 60 3HD1 LEU 60 -8.130 0.632 -9.102 439 HD21 LEU 60 1HD2 LEU 60 -9.450 -1.214 -6.503 440 HD22 LEU 60 2HD2 LEU 60 -10.971 -1.652 -7.280 441 HD23 LEU 60 3HD2 LEU 60 -10.879 -0.207 -6.270 442 H LYS 61 H LYS 61 -12.446 2.976 -6.896 443 HA LYS 61 HA LYS 61 -14.370 4.402 -8.608 444 HB2 LYS 61 1HB LYS 61 -13.926 4.343 -5.653 445 HB3 LYS 61 2HB LYS 61 -14.585 5.800 -6.381 446 HG2 LYS 61 1HG LYS 61 -16.455 4.578 -5.717 447 HG3 LYS 61 2HG LYS 61 -16.326 4.275 -7.451 448 HD2 LYS 61 1HD LYS 61 -16.780 2.188 -6.383 449 HD3 LYS 61 2HD LYS 61 -15.093 2.165 -6.902 450 HE2 LYS 61 1HE LYS 61 -14.326 2.574 -4.687 451 HE3 LYS 61 2HE LYS 61 -15.956 2.931 -4.121 452 HZ1 LYS 61 1HZ LYS 61 -16.575 0.667 -4.382 453 HZ2 LYS 61 2HZ LYS 61 -15.122 0.686 -3.518 454 HZ3 LYS 61 3HZ LYS 61 -15.123 0.281 -5.160 455 H THR 62 H THR 62 -11.774 5.187 -6.286 456 HA THR 62 HA THR 62 -10.342 6.979 -6.213 457 HB THR 62 HB THR 62 -9.167 5.460 -7.734 458 HG1 THR 62 1HG THR 62 -7.967 7.176 -8.870 459 HG21 THR 62 1HG2 THR 62 -10.750 6.904 -9.854 460 HG22 THR 62 2HG2 THR 62 -10.700 5.172 -9.525 461 HG23 THR 62 3HG2 THR 62 -9.290 5.980 -10.208 462 H GLU 63 H GLU 63 -13.127 7.641 -6.919 463 HA GLU 63 HA GLU 63 -12.584 10.225 -8.208 464 HB2 GLU 63 1HB GLU 63 -14.469 10.106 -9.596 465 HB3 GLU 63 2HB GLU 63 -13.735 8.514 -9.732 466 HG2 GLU 63 1HG GLU 63 -15.357 7.763 -7.943 467 HG3 GLU 63 2HG GLU 63 -16.186 9.298 -8.191 468 H ASN 64 H ASN 64 -13.050 11.803 -6.840 469 HA ASN 64 HA ASN 64 -13.805 12.789 -4.894 470 HB2 ASN 64 1HB ASN 64 -16.533 12.066 -5.925 471 HB3 ASN 64 2HB ASN 64 -16.000 13.564 -5.168 472 HD21 ASN 64 1HD2 ASN 64 -15.709 11.598 -8.073 473 HD22 ASN 64 2HD2 ASN 64 -15.375 12.910 -9.146 474 H LEU 65 H LEU 65 -13.161 10.100 -4.386 475 HA LEU 65 HA LEU 65 -15.009 8.456 -3.240 476 HB2 LEU 65 1HB LEU 65 -12.196 9.102 -2.419 477 HB3 LEU 65 2HB LEU 65 -13.151 7.889 -1.570 478 HG LEU 65 HG LEU 65 -12.827 7.656 -4.525 479 HD11 LEU 65 1HD1 LEU 65 -10.671 7.439 -2.525 480 HD12 LEU 65 2HD1 LEU 65 -10.590 7.773 -4.254 481 HD13 LEU 65 3HD1 LEU 65 -10.798 6.117 -3.685 482 HD21 LEU 65 1HD2 LEU 65 -12.518 5.249 -3.030 483 HD22 LEU 65 2HD2 LEU 65 -13.810 5.707 -4.141 484 HD23 LEU 65 3HD2 LEU 65 -13.930 6.118 -2.429 485 H ASN 66 H ASN 66 -15.587 8.072 -0.979 486 HA ASN 66 HA ASN 66 -15.457 10.356 0.812 487 HB2 ASN 66 1HB ASN 66 -17.804 10.648 1.060 488 HB3 ASN 66 2HB ASN 66 -17.498 10.647 -0.674 489 HD21 ASN 66 1HD2 ASN 66 -17.794 8.551 -1.782 490 HD22 ASN 66 2HD2 ASN 66 -19.086 7.533 -1.253 491 H ASP 67 H ASP 67 -16.775 9.770 2.894 492 HA ASP 67 HA ASP 67 -15.562 7.706 4.200 493 HB2 ASP 67 1HB ASP 67 -17.238 9.591 5.012 494 HB3 ASP 67 2HB ASP 67 -18.405 8.275 4.915 495 H ASP 68 H ASP 68 -18.182 7.511 1.958 496 HA ASP 68 HA ASP 68 -18.943 4.826 2.730 497 HB2 ASP 68 1HB ASP 68 -20.400 6.754 1.641 498 HB3 ASP 68 2HB ASP 68 -19.807 6.040 0.143 499 H GLU 69 H GLU 69 -17.782 6.245 -0.335 500 HA GLU 69 HA GLU 69 -17.078 3.790 -1.503 501 HB2 GLU 69 1HB GLU 69 -15.966 6.543 -2.077 502 HB3 GLU 69 2HB GLU 69 -15.806 5.138 -3.122 503 HG2 GLU 69 1HG GLU 69 -18.522 6.064 -2.320 504 HG3 GLU 69 2HG GLU 69 -17.641 6.927 -3.579 505 H LYS 70 H LYS 70 -14.998 6.264 -0.001 506 HA LYS 70 HA LYS 70 -12.537 5.182 -0.222 507 HB2 LYS 70 1HB LYS 70 -13.723 6.399 2.279 508 HB3 LYS 70 2HB LYS 70 -12.003 6.149 2.011 509 HG2 LYS 70 1HG LYS 70 -12.066 7.664 0.105 510 HG3 LYS 70 2HG LYS 70 -13.799 7.902 0.344 511 HD2 LYS 70 1HD LYS 70 -13.480 9.069 2.345 512 HD3 LYS 70 2HD LYS 70 -11.835 8.462 2.543 513 HE2 LYS 70 1HE LYS 70 -11.002 9.871 0.850 514 HE3 LYS 70 2HE LYS 70 -12.619 10.233 0.245 515 HZ1 LYS 70 1HZ LYS 70 -11.232 11.307 2.597 516 HZ2 LYS 70 2HZ LYS 70 -12.919 11.196 2.634 517 HZ3 LYS 70 3HZ LYS 70 -12.158 12.113 1.433 518 H LEU 71 H LEU 71 -14.929 4.244 2.235 519 HA LEU 71 HA LEU 71 -13.422 2.371 3.613 520 HB2 LEU 71 1HB LEU 71 -15.516 3.013 4.496 521 HB3 LEU 71 2HB LEU 71 -16.365 2.528 3.030 522 HG LEU 71 HG LEU 71 -15.833 0.158 3.578 523 HD11 LEU 71 1HD1 LEU 71 -14.856 1.352 6.169 524 HD12 LEU 71 2HD1 LEU 71 -13.873 0.520 4.965 525 HD13 LEU 71 3HD1 LEU 71 -15.107 -0.366 5.859 526 HD21 LEU 71 1HD2 LEU 71 -17.525 1.921 5.272 527 HD22 LEU 71 2HD2 LEU 71 -17.330 0.235 5.751 528 HD23 LEU 71 3HD2 LEU 71 -17.990 0.632 4.163 529 H ASN 72 H ASN 72 -15.704 1.720 0.947 530 HA ASN 72 HA ASN 72 -15.279 -0.973 0.637 531 HB2 ASN 72 1HB ASN 72 -15.719 1.074 -1.550 532 HB3 ASN 72 2HB ASN 72 -15.933 -0.664 -1.734 533 HD21 ASN 72 1HD2 ASN 72 -17.121 2.206 -0.119 534 HD22 ASN 72 2HD2 ASN 72 -18.697 1.589 0.229 535 H ASN 73 H ASN 73 -13.301 1.690 -0.558 536 HA ASN 73 HA ASN 73 -11.556 0.081 -2.123 537 HB2 ASN 73 1HB ASN 73 -11.537 2.894 -1.117 538 HB3 ASN 73 2HB ASN 73 -10.030 2.210 -1.718 539 HD21 ASN 73 1HD2 ASN 73 -10.566 4.157 -3.171 540 HD22 ASN 73 2HD2 ASN 73 -11.398 3.776 -4.637 541 H ALA 74 H ALA 74 -11.492 1.253 1.201 542 HA ALA 74 HA ALA 74 -8.861 0.465 1.827 543 HB1 ALA 74 1HB ALA 74 -11.298 1.051 3.459 544 HB2 ALA 74 2HB ALA 74 -9.839 0.419 4.223 545 HB3 ALA 74 3HB ALA 74 -9.783 1.948 3.346 546 H LYS 75 H LYS 75 -11.968 -1.212 2.149 547 HA LYS 75 HA LYS 75 -10.962 -3.518 3.423 548 HB2 LYS 75 1HB LYS 75 -13.394 -3.272 1.643 549 HB3 LYS 75 2HB LYS 75 -13.076 -4.569 2.788 550 HG2 LYS 75 1HG LYS 75 -13.146 -2.915 4.622 551 HG3 LYS 75 2HG LYS 75 -13.574 -1.672 3.445 552 HD2 LYS 75 1HD LYS 75 -15.167 -4.193 3.893 553 HD3 LYS 75 2HD LYS 75 -15.517 -2.651 4.680 554 HE2 LYS 75 1HE LYS 75 -15.962 -1.604 2.578 555 HE3 LYS 75 2HE LYS 75 -15.379 -3.011 1.691 556 HZ1 LYS 75 1HZ LYS 75 -17.373 -3.934 3.361 557 HZ2 LYS 75 2HZ LYS 75 -17.457 -3.740 1.683 558 HZ3 LYS 75 3HZ LYS 75 -17.973 -2.494 2.705 559 H TYR 76 H TYR 76 -11.348 -2.646 0.032 560 HA TYR 76 HA TYR 76 -10.745 -5.200 -1.033 561 HB2 TYR 76 1HB TYR 76 -11.841 -3.191 -2.206 562 HB3 TYR 76 2HB TYR 76 -10.202 -2.597 -2.448 563 HD1 TYR 76 1HD TYR 76 -12.215 -5.704 -2.971 564 HD2 TYR 76 2HD TYR 76 -9.118 -3.165 -4.406 565 HE1 TYR 76 1HE TYR 76 -12.015 -7.097 -4.988 566 HE2 TYR 76 2HE TYR 76 -8.910 -4.549 -6.428 567 HH TYR 76 HH TYR 76 -10.822 -7.503 -6.835 568 H ALA 77 H ALA 77 -8.777 -2.396 -0.202 569 HA ALA 77 HA ALA 77 -6.361 -3.245 -1.353 570 HB1 ALA 77 1HB ALA 77 -5.597 -1.312 -0.559 571 HB2 ALA 77 2HB ALA 77 -7.218 -1.038 0.083 572 HB3 ALA 77 3HB ALA 77 -5.976 -1.761 1.104 573 H ILE 78 H ILE 78 -7.359 -3.421 2.070 574 HA ILE 78 HA ILE 78 -5.208 -4.999 2.924 575 HB ILE 78 HB ILE 78 -7.990 -4.814 4.086 576 HG12 ILE 78 1HG1 ILE 78 -5.451 -3.408 4.935 577 HG13 ILE 78 2HG1 ILE 78 -6.677 -2.677 3.905 578 HG21 ILE 78 1HG2 ILE 78 -7.403 -6.324 5.602 579 HG22 ILE 78 2HG2 ILE 78 -5.903 -6.595 4.719 580 HG23 ILE 78 3HG2 ILE 78 -5.961 -5.398 6.011 581 HD11 ILE 78 1HD1 ILE 78 -8.312 -2.872 5.686 582 HD12 ILE 78 2HD1 ILE 78 -7.113 -3.650 6.718 583 HD13 ILE 78 3HD1 ILE 78 -6.894 -1.972 6.226 584 H SER 79 H SER 79 -8.327 -5.863 1.557 585 HA SER 79 HA SER 79 -8.260 -8.617 2.146 586 HB2 SER 79 1HB SER 79 -9.758 -6.883 0.241 587 HB3 SER 79 2HB SER 79 -9.752 -8.618 -0.070 588 HG SER 79 HG SER 79 -11.275 -8.675 1.371 589 H MET 80 H MET 80 -7.128 -6.771 -0.657 590 HA MET 80 HA MET 80 -6.360 -8.942 -2.254 591 HB2 MET 80 1HB MET 80 -6.513 -6.398 -2.798 592 HB3 MET 80 2HB MET 80 -4.840 -6.356 -2.259 593 HG2 MET 80 1HG MET 80 -5.038 -6.578 -4.689 594 HG3 MET 80 2HG MET 80 -4.209 -7.948 -3.953 595 HE1 MET 80 1HE MET 80 -7.484 -7.975 -6.829 596 HE2 MET 80 2HE MET 80 -8.084 -7.076 -5.436 597 HE3 MET 80 3HE MET 80 -6.552 -6.623 -6.184 598 H ALA 81 H ALA 81 -4.399 -6.947 -0.045 599 HA ALA 81 HA ALA 81 -1.931 -7.977 -0.285 600 HB1 ALA 81 1HB ALA 81 -1.880 -7.841 2.338 601 HB2 ALA 81 2HB ALA 81 -2.050 -6.385 1.356 602 HB3 ALA 81 3HB ALA 81 -3.469 -7.110 2.112 603 H ARG 82 H ARG 82 -4.333 -9.416 1.933 604 HA ARG 82 HA ARG 82 -2.832 -11.712 2.519 605 HB2 ARG 82 1HB ARG 82 -4.994 -10.714 3.627 606 HB3 ARG 82 2HB ARG 82 -5.824 -11.785 2.505 607 HG2 ARG 82 1HG ARG 82 -4.995 -13.698 3.514 608 HG3 ARG 82 2HG ARG 82 -3.660 -12.834 4.280 609 HD2 ARG 82 1HD ARG 82 -5.405 -11.609 5.638 610 HD3 ARG 82 2HD ARG 82 -6.576 -12.772 5.017 611 HE ARG 82 HE ARG 82 -4.506 -14.258 6.072 612 HH11 ARG 82 1HH1 ARG 82 -6.803 -11.911 7.228 613 HH12 ARG 82 2HH1 ARG 82 -6.854 -12.561 8.834 614 HH21 ARG 82 1HH2 ARG 82 -4.565 -15.122 8.182 615 HH22 ARG 82 2HH2 ARG 82 -5.581 -14.386 9.375 616 H LYS 83 H LYS 83 -5.272 -11.088 0.039 617 HA LYS 83 HA LYS 83 -5.618 -13.654 -0.947 618 HB2 LYS 83 1HB LYS 83 -6.729 -11.370 -1.601 619 HB3 LYS 83 2HB LYS 83 -5.471 -11.329 -2.830 620 HG2 LYS 83 1HG LYS 83 -7.365 -12.267 -3.861 621 HG3 LYS 83 2HG LYS 83 -6.268 -13.614 -3.547 622 HD2 LYS 83 1HD LYS 83 -7.551 -14.342 -1.690 623 HD3 LYS 83 2HD LYS 83 -8.499 -12.852 -1.674 624 HE2 LYS 83 1HE LYS 83 -9.299 -13.509 -3.989 625 HE3 LYS 83 2HE LYS 83 -8.577 -15.089 -3.685 626 HZ1 LYS 83 1HZ LYS 83 -10.217 -14.277 -1.512 627 HZ2 LYS 83 2HZ LYS 83 -10.312 -15.674 -2.459 628 HZ3 LYS 83 3HZ LYS 83 -11.095 -14.259 -2.958 629 H ILE 84 H ILE 84 -3.288 -11.198 -2.062 630 HA ILE 84 HA ILE 84 -1.974 -12.995 -3.848 631 HB ILE 84 HB ILE 84 -0.243 -11.220 -4.012 632 HG12 ILE 84 1HG1 ILE 84 -2.021 -9.653 -2.138 633 HG13 ILE 84 2HG1 ILE 84 -0.538 -10.449 -1.626 634 HG21 ILE 84 1HG2 ILE 84 -1.546 -9.805 -5.313 635 HG22 ILE 84 2HG2 ILE 84 -2.496 -11.288 -5.265 636 HG23 ILE 84 3HG2 ILE 84 -2.935 -9.928 -4.231 637 HD11 ILE 84 1HD1 ILE 84 -0.216 -8.066 -2.045 638 HD12 ILE 84 2HD1 ILE 84 0.751 -9.060 -3.135 639 HD13 ILE 84 3HD1 ILE 84 -0.727 -8.294 -3.717 640 H GLY 85 H GLY 85 -1.706 -12.301 -0.485 641 HA2 GLY 85 1HA GLY 85 -0.496 -14.188 0.684 642 HA3 GLY 85 2HA GLY 85 0.848 -13.778 -0.371 643 H ALA 86 H ALA 86 -0.913 -12.946 2.481 644 HA ALA 86 HA ALA 86 1.257 -11.528 3.596 645 HB1 ALA 86 1HB ALA 86 -0.174 -9.326 3.781 646 HB2 ALA 86 2HB ALA 86 0.871 -9.622 2.390 647 HB3 ALA 86 3HB ALA 86 -0.863 -9.918 2.268 648 H ARG 87 H ARG 87 0.503 -10.315 5.660 649 HA ARG 87 HA ARG 87 -1.976 -11.125 6.826 650 HB2 ARG 87 1HB ARG 87 -1.119 -12.602 8.541 651 HB3 ARG 87 2HB ARG 87 -0.706 -13.248 6.959 652 HG2 ARG 87 1HG ARG 87 1.542 -11.995 7.330 653 HG3 ARG 87 2HG ARG 87 1.065 -12.035 9.028 654 HD2 ARG 87 1HD ARG 87 0.860 -14.460 8.928 655 HD3 ARG 87 2HD ARG 87 1.282 -14.436 7.215 656 HE ARG 87 HE ARG 87 3.409 -13.245 8.319 657 HH11 ARG 87 1HH1 ARG 87 1.707 -16.167 9.146 658 HH12 ARG 87 2HH1 ARG 87 3.110 -16.957 9.788 659 HH21 ARG 87 1HH2 ARG 87 5.263 -14.275 9.161 660 HH22 ARG 87 2HH2 ARG 87 5.131 -15.879 9.797 661 H VAL 88 H VAL 88 -2.487 -9.356 7.922 662 HA VAL 88 HA VAL 88 -0.515 -8.200 9.753 663 HB VAL 88 HB VAL 88 -1.290 -5.897 9.083 664 HG11 VAL 88 1HG1 VAL 88 0.153 -5.832 7.035 665 HG12 VAL 88 2HG1 VAL 88 0.892 -6.612 8.436 666 HG13 VAL 88 3HG1 VAL 88 0.243 -7.590 7.119 667 HG21 VAL 88 1HG2 VAL 88 -2.007 -6.792 6.391 668 HG22 VAL 88 2HG2 VAL 88 -3.181 -7.230 7.631 669 HG23 VAL 88 3HG2 VAL 88 -2.731 -5.540 7.400 670 H TYR 89 H TYR 89 -1.790 -6.239 10.924 671 HA TYR 89 HA TYR 89 -4.389 -7.343 11.768 672 HB2 TYR 89 1HB TYR 89 -2.369 -7.542 13.387 673 HB3 TYR 89 2HB TYR 89 -2.596 -5.814 13.633 674 HD1 TYR 89 2HD TYR 89 -4.098 -9.138 14.105 675 HD2 TYR 89 1HD TYR 89 -4.468 -4.972 14.884 676 HE1 TYR 89 2HE TYR 89 -5.847 -9.611 15.769 677 HE2 TYR 89 1HE TYR 89 -6.216 -5.433 16.551 678 HH TYR 89 HH TYR 89 -7.872 -8.209 16.758 679 H ALA 90 H ALA 90 -3.733 -5.254 9.785 680 HA ALA 90 HA ALA 90 -4.405 -2.722 10.946 681 HB1 ALA 90 1HB ALA 90 -4.824 -2.260 8.364 682 HB2 ALA 90 2HB ALA 90 -3.203 -2.357 9.051 683 HB3 ALA 90 3HB ALA 90 -3.889 -3.749 8.212 684 H LEU 91 H LEU 91 -6.271 -1.520 9.552 685 HA LEU 91 HA LEU 91 -8.647 -3.195 9.376 686 HB2 LEU 91 1HB LEU 91 -8.380 -2.323 11.746 687 HB3 LEU 91 2HB LEU 91 -8.672 -0.717 11.079 688 HG LEU 91 HG LEU 91 -10.866 -1.766 10.175 689 HD11 LEU 91 1HD1 LEU 91 -9.848 -3.844 12.021 690 HD12 LEU 91 2HD1 LEU 91 -10.848 -3.998 10.577 691 HD13 LEU 91 3HD1 LEU 91 -11.568 -3.465 12.096 692 HD21 LEU 91 1HD2 LEU 91 -12.023 -1.097 12.161 693 HD22 LEU 91 2HD2 LEU 91 -10.640 -0.025 11.941 694 HD23 LEU 91 3HD2 LEU 91 -10.572 -1.316 13.140 695 HA PRO 92 HA PRO 92 -9.313 -0.486 5.947 696 HB2 PRO 92 1HB PRO 92 -11.859 -1.244 5.385 697 HB3 PRO 92 2HB PRO 92 -10.451 -2.239 4.993 698 HG2 PRO 92 1HG PRO 92 -12.334 -2.449 7.311 699 HG3 PRO 92 2HG PRO 92 -11.658 -3.738 6.298 700 HD2 PRO 92 1HD PRO 92 -10.676 -3.146 8.752 701 HD3 PRO 92 2HD PRO 92 -9.652 -3.749 7.434 702 H GLU 93 H GLU 93 -11.690 -0.703 8.565 703 HA GLU 93 HA GLU 93 -13.182 1.583 7.939 704 HB2 GLU 93 1HB GLU 93 -12.641 0.165 10.541 705 HB3 GLU 93 2HB GLU 93 -13.682 1.579 10.451 706 HG2 GLU 93 1HG GLU 93 -15.167 -0.188 10.333 707 HG3 GLU 93 2HG GLU 93 -14.956 0.275 8.646 708 H ASP 94 H ASP 94 -10.149 1.189 9.649 709 HA ASP 94 HA ASP 94 -10.072 3.972 10.461 710 HB2 ASP 94 1HB ASP 94 -8.295 1.594 10.871 711 HB3 ASP 94 2HB ASP 94 -7.660 3.214 11.150 712 H LEU 95 H LEU 95 -8.563 1.871 8.073 713 HA LEU 95 HA LEU 95 -6.531 3.455 7.125 714 HB2 LEU 95 1HB LEU 95 -6.801 1.264 6.263 715 HB3 LEU 95 2HB LEU 95 -8.419 1.626 5.665 716 HG LEU 95 HG LEU 95 -7.500 3.030 3.922 717 HD11 LEU 95 1HD1 LEU 95 -5.618 4.054 4.818 718 HD12 LEU 95 2HD1 LEU 95 -4.944 2.929 3.639 719 HD13 LEU 95 3HD1 LEU 95 -4.920 2.525 5.357 720 HD21 LEU 95 1HD2 LEU 95 -7.648 0.514 3.672 721 HD22 LEU 95 2HD2 LEU 95 -5.906 0.480 3.946 722 HD23 LEU 95 3HD2 LEU 95 -6.565 1.348 2.559 723 H VAL 96 H VAL 96 -9.979 3.674 6.397 724 HA VAL 96 HA VAL 96 -9.978 5.478 4.317 725 HB VAL 96 HB VAL 96 -11.907 5.379 6.640 726 HG11 VAL 96 1HG1 VAL 96 -12.570 6.413 3.912 727 HG12 VAL 96 2HG1 VAL 96 -13.386 6.705 5.449 728 HG13 VAL 96 3HG1 VAL 96 -11.834 7.472 5.113 729 HG21 VAL 96 1HG2 VAL 96 -12.930 3.638 5.657 730 HG22 VAL 96 2HG2 VAL 96 -12.689 4.284 4.034 731 HG23 VAL 96 3HG2 VAL 96 -11.386 3.409 4.835 732 H GLU 97 H GLU 97 -9.710 6.139 7.785 733 HA GLU 97 HA GLU 97 -9.449 8.994 7.287 734 HB2 GLU 97 1HB GLU 97 -9.344 7.443 9.880 735 HB3 GLU 97 2HB GLU 97 -9.361 9.194 9.737 736 HG2 GLU 97 1HG GLU 97 -11.579 8.901 8.514 737 HG3 GLU 97 2HG GLU 97 -11.558 7.249 9.129 738 H VAL 98 H VAL 98 -7.424 7.398 6.144 739 HA VAL 98 HA VAL 98 -5.151 6.948 6.198 740 HB VAL 98 HB VAL 98 -5.131 9.862 6.994 741 HG11 VAL 98 1HG1 VAL 98 -2.959 9.920 6.438 742 HG12 VAL 98 2HG1 VAL 98 -3.018 8.171 6.671 743 HG13 VAL 98 3HG1 VAL 98 -3.184 8.852 5.053 744 HG21 VAL 98 1HG2 VAL 98 -6.296 8.624 4.714 745 HG22 VAL 98 2HG2 VAL 98 -6.153 10.342 5.083 746 HG23 VAL 98 3HG2 VAL 98 -4.871 9.522 4.194 747 H ASN 99 H ASN 99 -5.943 5.852 8.459 748 HA ASN 99 HA ASN 99 -4.710 7.020 10.779 749 HB2 ASN 99 1HB ASN 99 -6.199 4.492 10.198 750 HB3 ASN 99 2HB ASN 99 -5.230 4.591 11.666 751 HD21 ASN 99 1HD2 ASN 99 -7.175 4.388 12.858 752 HD22 ASN 99 2HD2 ASN 99 -8.217 5.746 13.083 753 HA PRO 100 HA PRO 100 -0.679 5.404 9.722 754 HB2 PRO 100 1HB PRO 100 0.592 6.463 11.874 755 HB3 PRO 100 2HB PRO 100 0.157 7.416 10.450 756 HG2 PRO 100 1HG PRO 100 -1.249 7.196 13.083 757 HG3 PRO 100 2HG PRO 100 -0.929 8.638 12.103 758 HD2 PRO 100 1HD PRO 100 -3.335 7.396 12.126 759 HD3 PRO 100 2HD PRO 100 -2.701 8.223 10.688 760 H LYS 101 H LYS 101 -2.663 4.698 12.403 761 HA LYS 101 HA LYS 101 -0.844 2.954 13.774 762 HB2 LYS 101 1HB LYS 101 -3.760 3.594 14.005 763 HB3 LYS 101 2HB LYS 101 -3.119 2.173 14.820 764 HG2 LYS 101 1HG LYS 101 -2.900 3.696 16.489 765 HG3 LYS 101 2HG LYS 101 -1.339 3.917 15.695 766 HD2 LYS 101 1HD LYS 101 -2.171 6.092 16.035 767 HD3 LYS 101 2HD LYS 101 -2.471 5.745 14.330 768 HE2 LYS 101 1HE LYS 101 -4.782 4.890 15.259 769 HE3 LYS 101 2HE LYS 101 -4.391 5.968 16.598 770 HZ1 LYS 101 1HZ LYS 101 -4.558 6.736 13.733 771 HZ2 LYS 101 2HZ LYS 101 -4.133 7.776 14.997 772 HZ3 LYS 101 3HZ LYS 101 -5.688 7.115 14.934 773 H MET 102 H MET 102 -3.231 2.629 11.248 774 HA MET 102 HA MET 102 -2.986 -0.287 11.298 775 HB2 MET 102 1HB MET 102 -4.883 1.621 9.970 776 HB3 MET 102 2HB MET 102 -4.738 -0.033 9.394 777 HG2 MET 102 1HG MET 102 -6.582 0.119 10.915 778 HG3 MET 102 2HG MET 102 -5.299 -0.838 11.652 779 HE1 MET 102 1HE MET 102 -6.984 -0.580 13.403 780 HE2 MET 102 2HE MET 102 -6.199 0.162 14.797 781 HE3 MET 102 3HE MET 102 -7.584 0.951 14.041 782 H VAL 103 H VAL 103 -2.481 2.481 9.146 783 HA VAL 103 HA VAL 103 -1.648 1.122 6.866 784 HB VAL 103 HB VAL 103 -0.652 3.791 7.874 785 HG11 VAL 103 1HG1 VAL 103 0.387 2.325 5.819 786 HG12 VAL 103 2HG1 VAL 103 -0.806 3.327 4.989 787 HG13 VAL 103 3HG1 VAL 103 0.464 4.081 5.953 788 HG21 VAL 103 1HG2 VAL 103 -3.229 3.066 7.188 789 HG22 VAL 103 2HG2 VAL 103 -2.585 4.707 7.238 790 HG23 VAL 103 3HG2 VAL 103 -2.599 3.810 5.719 791 H MET 104 H MET 104 0.148 2.014 9.760 792 HA MET 104 HA MET 104 2.746 1.618 8.977 793 HB2 MET 104 1HB MET 104 3.200 0.925 11.318 794 HB3 MET 104 2HB MET 104 2.211 2.375 11.207 795 HG2 MET 104 1HG MET 104 0.994 1.306 12.763 796 HG3 MET 104 2HG MET 104 0.272 0.545 11.347 797 HE1 MET 104 1HE MET 104 -0.043 -1.106 14.153 798 HE2 MET 104 2HE MET 104 -0.660 -1.330 12.516 799 HE3 MET 104 3HE MET 104 0.206 -2.641 13.319 800 H THR 105 H THR 105 0.251 -0.759 9.429 801 HA THR 105 HA THR 105 2.167 -2.956 9.171 802 HB THR 105 HB THR 105 -0.230 -4.208 9.301 803 HG1 THR 105 1HG THR 105 -1.509 -3.038 10.809 804 HG21 THR 105 1HG2 THR 105 1.353 -4.910 10.823 805 HG22 THR 105 2HG2 THR 105 0.207 -4.095 11.888 806 HG23 THR 105 3HG2 THR 105 1.687 -3.274 11.390 807 H VAL 106 H VAL 106 -0.764 -1.702 7.596 808 HA VAL 106 HA VAL 106 -1.223 -3.418 5.583 809 HB VAL 106 HB VAL 106 -1.087 -0.412 5.339 810 HG11 VAL 106 1HG1 VAL 106 -1.042 -1.067 3.118 811 HG12 VAL 106 2HG1 VAL 106 -2.013 -2.511 3.418 812 HG13 VAL 106 3HG1 VAL 106 -2.770 -0.917 3.434 813 HG21 VAL 106 1HG2 VAL 106 -3.482 -2.208 5.683 814 HG22 VAL 106 2HG2 VAL 106 -2.660 -1.401 7.019 815 HG23 VAL 106 3HG2 VAL 106 -3.438 -0.445 5.758 816 H PHE 107 H PHE 107 1.347 -0.963 5.546 817 HA PHE 107 HA PHE 107 2.371 -1.875 3.015 818 HB2 PHE 107 1HB PHE 107 3.264 0.175 5.026 819 HB3 PHE 107 2HB PHE 107 4.293 -0.275 3.671 820 HD1 PHE 107 2HD PHE 107 2.407 -0.581 1.485 821 HD2 PHE 107 1HD PHE 107 2.509 2.311 4.606 822 HE1 PHE 107 2HE PHE 107 1.204 1.011 0.045 823 HE2 PHE 107 1HE PHE 107 1.306 3.907 3.171 824 HZ PHE 107 HZ PHE 107 0.654 3.259 0.887 825 H ALA 108 H ALA 108 3.341 -2.113 6.410 826 HA ALA 108 HA ALA 108 5.798 -3.179 6.377 827 HB1 ALA 108 1HB ALA 108 3.770 -4.678 7.968 828 HB2 ALA 108 2HB ALA 108 5.376 -4.115 8.431 829 HB3 ALA 108 3HB ALA 108 4.041 -2.968 8.306 830 H CYS 109 H CYS 109 2.976 -5.362 6.254 831 HA CYS 109 HA CYS 109 4.220 -7.692 5.613 832 HB2 CYS 109 1HB CYS 109 2.092 -8.264 4.324 833 HB3 CYS 109 2HB CYS 109 1.892 -7.777 6.002 834 HG CYS 109 HG CYS 109 0.339 -6.617 3.458 835 H LEU 110 H LEU 110 3.234 -5.160 3.336 836 HA LEU 110 HA LEU 110 4.109 -6.535 1.012 837 HB2 LEU 110 1HB LEU 110 3.739 -3.574 1.433 838 HB3 LEU 110 2HB LEU 110 3.847 -4.399 -0.120 839 HG LEU 110 HG LEU 110 1.645 -4.919 1.867 840 HD11 LEU 110 1HD1 LEU 110 1.804 -2.513 1.043 841 HD12 LEU 110 2HD1 LEU 110 0.277 -3.356 0.784 842 HD13 LEU 110 3HD1 LEU 110 1.410 -3.157 -0.552 843 HD21 LEU 110 1HD2 LEU 110 1.752 -6.699 0.359 844 HD22 LEU 110 2HD2 LEU 110 2.157 -5.648 -0.998 845 HD23 LEU 110 3HD2 LEU 110 0.526 -5.632 -0.326 846 H MET 111 H MET 111 5.459 -3.510 2.329 847 HA MET 111 HA MET 111 7.830 -3.444 1.016 848 HB2 MET 111 1HB MET 111 8.575 -1.927 2.592 849 HB3 MET 111 2HB MET 111 6.837 -1.872 2.854 850 HG2 MET 111 1HG MET 111 7.673 -1.989 4.997 851 HG3 MET 111 2HG MET 111 7.276 -3.669 4.645 852 HE1 MET 111 1HE MET 111 9.902 -0.972 5.004 853 HE2 MET 111 2HE MET 111 11.452 -1.812 4.987 854 HE3 MET 111 3HE MET 111 10.574 -1.550 3.479 855 H GLY 112 H GLY 112 6.896 -5.709 3.446 856 HA2 GLY 112 1HA GLY 112 9.134 -6.605 4.648 857 HA3 GLY 112 2HA GLY 112 7.928 -7.709 4.003 858 H LYS 113 H LYS 113 8.510 -6.761 1.230 859 HA LYS 113 HA LYS 113 10.379 -8.741 0.526 860 HB2 LYS 113 1HB LYS 113 9.170 -6.425 -0.966 861 HB3 LYS 113 2HB LYS 113 10.370 -7.467 -1.719 862 HG2 LYS 113 1HG LYS 113 8.918 -9.407 -1.306 863 HG3 LYS 113 2HG LYS 113 7.705 -8.329 -0.611 864 HD2 LYS 113 1HD LYS 113 6.944 -8.515 -2.774 865 HD3 LYS 113 2HD LYS 113 7.956 -7.074 -2.899 866 HE2 LYS 113 1HE LYS 113 9.171 -9.751 -3.399 867 HE3 LYS 113 2HE LYS 113 8.157 -9.027 -4.646 868 HZ1 LYS 113 1HZ LYS 113 10.289 -8.302 -5.151 869 HZ2 LYS 113 2HZ LYS 113 10.703 -8.028 -3.534 870 HZ3 LYS 113 3HZ LYS 113 9.629 -6.984 -4.320 871 H GLY 114 H GLY 114 10.687 -5.211 0.774 872 HA2 GLY 114 1HA GLY 114 13.520 -5.339 0.143 873 HA3 GLY 114 2HA GLY 114 12.590 -3.887 0.481 874 H MET 115 H MET 115 12.636 -6.719 2.554 875 HA MET 115 HA MET 115 14.203 -5.188 4.522 876 HB2 MET 115 1HB MET 115 11.706 -5.345 4.995 877 HB3 MET 115 2HB MET 115 11.958 -7.068 5.243 878 HG2 MET 115 1HG MET 115 13.347 -6.693 7.115 879 HG3 MET 115 2HG MET 115 13.475 -4.971 6.762 880 HE1 MET 115 1HE MET 115 11.333 -5.736 10.166 881 HE2 MET 115 2HE MET 115 12.413 -6.917 9.424 882 HE3 MET 115 3HE MET 115 12.929 -5.239 9.601 883 H LYS 116 H LYS 116 15.554 -6.379 5.903 884 HA LYS 116 HA LYS 116 16.388 -8.942 4.792 885 HB2 LYS 116 1HB LYS 116 17.978 -7.008 5.359 886 HB3 LYS 116 2HB LYS 116 17.729 -7.456 7.042 887 HG2 LYS 116 1HG LYS 116 18.630 -9.656 6.632 888 HG3 LYS 116 2HG LYS 116 18.783 -9.303 4.909 889 HD2 LYS 116 1HD LYS 116 20.934 -8.933 5.683 890 HD3 LYS 116 2HD LYS 116 20.243 -7.309 5.710 891 HE2 LYS 116 1HE LYS 116 19.700 -7.657 8.118 892 HE3 LYS 116 2HE LYS 116 20.568 -9.190 8.045 893 HZ1 LYS 116 1HZ LYS 116 21.864 -7.235 8.896 894 HZ2 LYS 116 2HZ LYS 116 21.823 -6.604 7.327 895 HZ3 LYS 116 3HZ LYS 116 22.589 -8.084 7.623 896 H ARG 117 H ARG 117 15.185 -10.590 5.538 897 HA ARG 117 HA ARG 117 14.873 -10.826 8.459 898 HB2 ARG 117 1HB ARG 117 12.977 -11.604 6.248 899 HB3 ARG 117 2HB ARG 117 12.834 -12.246 7.879 900 HG2 ARG 117 1HG ARG 117 12.773 -9.805 8.638 901 HG3 ARG 117 2HG ARG 117 12.481 -9.423 6.939 902 HD2 ARG 117 1HD ARG 117 10.343 -9.586 7.880 903 HD3 ARG 117 2HD ARG 117 10.585 -11.129 7.063 904 HE ARG 117 HE ARG 117 11.326 -11.133 9.848 905 HH11 ARG 117 1HH1 ARG 117 8.756 -11.604 7.546 906 HH12 ARG 117 2HH1 ARG 117 7.821 -12.612 8.601 907 HH21 ARG 117 1HH2 ARG 117 10.104 -12.459 11.245 908 HH22 ARG 117 2HH2 ARG 117 8.588 -13.098 10.704 909 H VAL 118 H VAL 118 14.307 -13.264 8.978 910 HA VAL 118 HA VAL 118 16.601 -14.767 8.598 911 HB VAL 118 HB VAL 118 15.185 -16.748 9.280 912 HG11 VAL 118 1HG1 VAL 118 15.084 -14.240 10.952 913 HG12 VAL 118 2HG1 VAL 118 14.777 -15.869 11.557 914 HG13 VAL 118 3HG1 VAL 118 16.370 -15.446 10.929 915 HG21 VAL 118 1HG2 VAL 118 13.097 -15.683 8.238 916 HG22 VAL 118 2HG2 VAL 118 12.916 -16.507 9.787 917 HG23 VAL 118 3HG2 VAL 118 12.997 -14.746 9.728 918 H SER 119 H SER 119 13.687 -14.607 6.659 919 HA SER 119 HA SER 119 13.028 -15.778 4.787 920 HB2 SER 119 1HB SER 119 14.678 -13.996 4.043 921 HB3 SER 119 2HB SER 119 15.891 -15.275 3.959 922 HG SER 119 HG SER 119 14.009 -16.298 2.625 923 H GLY 120 H GLY 120 13.435 -17.673 6.598 924 HA2 GLY 120 1HA GLY 120 15.257 -19.650 5.403 925 HA3 GLY 120 2HA GLY 120 14.590 -19.727 7.028 926 HA PRO 121 HA PRO 121 11.784 -22.701 5.348 927 HB2 PRO 121 1HB PRO 121 10.170 -22.907 7.521 928 HB3 PRO 121 2HB PRO 121 11.778 -23.639 7.445 929 HG2 PRO 121 1HG PRO 121 10.922 -21.075 8.733 930 HG3 PRO 121 2HG PRO 121 12.020 -22.325 9.348 931 HD2 PRO 121 1HD PRO 121 12.911 -20.022 8.238 932 HD3 PRO 121 2HD PRO 121 13.799 -21.553 8.104 933 H SER 122 H SER 122 10.815 -19.605 6.646 934 HA SER 122 HA SER 122 8.258 -19.802 5.198 935 HB2 SER 122 1HB SER 122 7.411 -18.063 6.676 936 HB3 SER 122 2HB SER 122 8.078 -19.380 7.641 937 HG SER 122 HG SER 122 9.829 -17.336 6.975 938 H SER 123 H SER 123 8.087 -18.687 3.380 939 HA SER 123 HA SER 123 10.136 -16.991 2.425 940 HB2 SER 123 1HB SER 123 7.375 -17.686 1.473 941 HB3 SER 123 2HB SER 123 8.287 -16.405 0.676 942 HG SER 123 HG SER 123 9.909 -18.474 0.973 943 H GLY 124 H GLY 124 6.851 -16.305 3.611 944 HA2 GLY 124 1HA GLY 124 6.718 -14.337 5.133 945 HA3 GLY 124 2HA GLY 124 7.679 -13.487 3.933 Start of MODEL 10 1 H1 GLY 1 H GLY 1 18.426 -14.876 -7.621 2 HA2 GLY 1 1HA GLY 1 16.117 -16.403 -6.713 3 HA3 GLY 1 2HA GLY 1 17.582 -16.081 -5.797 4 H SER 2 H SER 2 15.626 -15.787 -4.232 5 HA SER 2 HA SER 2 15.337 -12.927 -3.865 6 HB2 SER 2 1HB SER 2 13.056 -14.722 -4.569 7 HB3 SER 2 2HB SER 2 12.777 -13.444 -3.386 8 HG SER 2 HG SER 2 12.979 -13.260 -6.060 9 H SER 3 H SER 3 15.722 -12.508 -1.801 10 HA SER 3 HA SER 3 15.574 -14.666 0.149 11 HB2 SER 3 1HB SER 3 16.808 -13.130 1.626 12 HB3 SER 3 2HB SER 3 17.616 -13.305 0.068 13 HG SER 3 HG SER 3 16.132 -11.315 -0.374 14 H GLY 4 H GLY 4 14.975 -13.715 2.478 15 HA2 GLY 4 1HA GLY 4 12.553 -12.069 2.270 16 HA3 GLY 4 2HA GLY 4 12.420 -13.671 2.981 17 H SER 5 H SER 5 13.025 -10.418 3.576 18 HA SER 5 HA SER 5 13.378 -10.903 6.384 19 HB2 SER 5 1HB SER 5 15.629 -9.644 4.802 20 HB3 SER 5 2HB SER 5 15.504 -9.597 6.560 21 HG SER 5 HG SER 5 15.611 -11.868 6.564 22 H SER 6 H SER 6 13.763 -8.694 7.530 23 HA SER 6 HA SER 6 11.796 -6.857 6.411 24 HB2 SER 6 1HB SER 6 11.784 -5.827 8.632 25 HB3 SER 6 2HB SER 6 11.572 -7.573 8.765 26 HG SER 6 HG SER 6 14.177 -6.603 8.870 27 H GLY 7 H GLY 7 12.275 -4.444 6.948 28 HA2 GLY 7 1HA GLY 7 15.086 -3.832 6.302 29 HA3 GLY 7 2HA GLY 7 13.783 -3.126 5.357 30 H ASN 8 H ASN 8 14.838 -1.098 6.038 31 HA ASN 8 HA ASN 8 14.794 -0.288 8.762 32 HB2 ASN 8 1HB ASN 8 14.745 1.608 6.423 33 HB3 ASN 8 2HB ASN 8 15.507 1.825 7.996 34 HD21 ASN 8 1HD2 ASN 8 16.025 1.081 4.815 35 HD22 ASN 8 2HD2 ASN 8 17.584 0.349 4.951 36 H ASP 9 H ASP 9 13.588 1.886 9.273 37 HA ASP 9 HA ASP 9 10.753 1.324 8.868 38 HB2 ASP 9 1HB ASP 9 10.620 3.297 10.603 39 HB3 ASP 9 2HB ASP 9 11.086 1.681 11.128 40 H ASP 10 H ASP 10 13.189 3.493 7.816 41 HA ASP 10 HA ASP 10 11.298 5.537 6.974 42 HB2 ASP 10 1HB ASP 10 13.546 6.135 7.891 43 HB3 ASP 10 2HB ASP 10 14.276 5.391 6.471 44 H ILE 11 H ILE 11 13.123 2.885 5.645 45 HA ILE 11 HA ILE 11 12.909 3.593 2.912 46 HB ILE 11 HB ILE 11 14.480 1.870 3.878 47 HG12 ILE 11 1HG1 ILE 11 12.871 0.700 1.623 48 HG13 ILE 11 2HG1 ILE 11 13.784 2.189 1.401 49 HG21 ILE 11 1HG2 ILE 11 12.045 0.693 4.689 50 HG22 ILE 11 2HG2 ILE 11 12.784 -0.393 3.513 51 HG23 ILE 11 3HG2 ILE 11 13.684 0.097 4.948 52 HD11 ILE 11 1HD1 ILE 11 14.694 -0.477 1.239 53 HD12 ILE 11 2HD1 ILE 11 15.611 1.014 1.024 54 HD13 ILE 11 3HD1 ILE 11 15.486 0.276 2.622 55 H ILE 12 H ILE 12 10.639 2.407 5.162 56 HA ILE 12 HA ILE 12 8.930 0.814 3.733 57 HB ILE 12 HB ILE 12 8.089 3.028 5.607 58 HG12 ILE 12 1HG1 ILE 12 8.746 0.129 6.177 59 HG13 ILE 12 2HG1 ILE 12 9.758 1.506 6.600 60 HG21 ILE 12 1HG2 ILE 12 5.995 2.221 5.570 61 HG22 ILE 12 2HG2 ILE 12 6.474 1.531 4.020 62 HG23 ILE 12 3HG2 ILE 12 6.534 0.545 5.481 63 HD11 ILE 12 1HD1 ILE 12 7.667 2.315 7.897 64 HD12 ILE 12 2HD1 ILE 12 7.170 0.626 7.787 65 HD13 ILE 12 3HD1 ILE 12 8.688 1.050 8.580 66 H VAL 13 H VAL 13 9.255 4.319 3.568 67 HA VAL 13 HA VAL 13 7.047 4.606 1.728 68 HB VAL 13 HB VAL 13 9.121 6.568 2.706 69 HG11 VAL 13 1HG1 VAL 13 7.462 8.246 1.665 70 HG12 VAL 13 2HG1 VAL 13 8.604 7.419 0.604 71 HG13 VAL 13 3HG1 VAL 13 6.926 6.878 0.690 72 HG21 VAL 13 1HG2 VAL 13 6.448 5.739 3.583 73 HG22 VAL 13 2HG2 VAL 13 7.753 6.505 4.489 74 HG23 VAL 13 3HG2 VAL 13 6.682 7.485 3.489 75 H ASN 14 H ASN 14 10.587 4.904 1.558 76 HA ASN 14 HA ASN 14 10.895 5.629 -1.074 77 HB2 ASN 14 1HB ASN 14 12.637 5.086 0.847 78 HB3 ASN 14 2HB ASN 14 12.726 3.536 0.014 79 HD21 ASN 14 1HD2 ASN 14 13.084 7.007 -0.398 80 HD22 ASN 14 2HD2 ASN 14 14.186 6.922 -1.726 81 H TRP 15 H TRP 15 10.600 2.328 0.214 82 HA TRP 15 HA TRP 15 10.840 0.940 -2.185 83 HB2 TRP 15 1HB TRP 15 10.774 -0.021 0.163 84 HB3 TRP 15 2HB TRP 15 9.019 0.122 0.080 85 HD1 TRP 15 HD TRP 15 11.928 -1.798 -1.554 86 HE1 TRP 15 1HE TRP 15 10.985 -3.949 -2.607 87 HE3 TRP 15 3HE TRP 15 6.943 -0.952 -0.803 88 HZ2 TRP 15 2HZ TRP 15 8.461 -5.130 -3.061 89 HZ3 TRP 15 3HZ TRP 15 5.330 -2.641 -1.577 90 HH2 TRP 15 HH TRP 15 6.075 -4.686 -2.683 91 H VAL 16 H VAL 16 7.903 2.155 -0.589 92 HA VAL 16 HA VAL 16 6.038 1.230 -2.444 93 HB VAL 16 HB VAL 16 5.915 3.758 -0.793 94 HG11 VAL 16 1HG1 VAL 16 3.550 2.224 -1.807 95 HG12 VAL 16 2HG1 VAL 16 3.633 3.887 -1.223 96 HG13 VAL 16 3HG1 VAL 16 4.316 3.469 -2.794 97 HG21 VAL 16 1HG2 VAL 16 5.944 1.061 -0.005 98 HG22 VAL 16 2HG2 VAL 16 5.561 2.470 0.984 99 HG23 VAL 16 3HG2 VAL 16 4.273 1.605 0.148 100 H ASN 17 H ASN 17 7.688 4.382 -2.306 101 HA ASN 17 HA ASN 17 6.517 5.507 -4.577 102 HB2 ASN 17 1HB ASN 17 9.133 5.972 -3.169 103 HB3 ASN 17 2HB ASN 17 8.738 6.849 -4.645 104 HD21 ASN 17 1HD2 ASN 17 7.462 6.070 -1.441 105 HD22 ASN 17 2HD2 ASN 17 6.647 7.576 -1.208 106 H GLU 18 H GLU 18 9.537 3.660 -4.257 107 HA GLU 18 HA GLU 18 10.306 3.791 -6.952 108 HB2 GLU 18 1HB GLU 18 10.981 2.048 -4.637 109 HB3 GLU 18 2HB GLU 18 11.414 1.469 -6.239 110 HG2 GLU 18 1HG GLU 18 12.618 3.611 -6.619 111 HG3 GLU 18 2HG GLU 18 12.291 4.035 -4.939 112 H THR 19 H THR 19 8.838 1.018 -5.250 113 HA THR 19 HA THR 19 8.378 -0.705 -7.263 114 HB THR 19 HB THR 19 6.558 0.020 -4.977 115 HG1 THR 19 1HG THR 19 7.609 -1.568 -4.005 116 HG21 THR 19 1HG2 THR 19 5.979 -1.662 -7.310 117 HG22 THR 19 2HG2 THR 19 4.884 -0.955 -6.121 118 HG23 THR 19 3HG2 THR 19 5.726 -2.461 -5.758 119 H LEU 20 H LEU 20 6.528 2.230 -6.638 120 HA LEU 20 HA LEU 20 4.662 1.708 -8.776 121 HB2 LEU 20 1HB LEU 20 5.136 4.162 -7.091 122 HB3 LEU 20 2HB LEU 20 3.830 3.984 -8.261 123 HG LEU 20 HG LEU 20 4.103 2.067 -5.974 124 HD11 LEU 20 1HD1 LEU 20 2.830 3.439 -4.549 125 HD12 LEU 20 2HD1 LEU 20 2.488 4.597 -5.834 126 HD13 LEU 20 3HD1 LEU 20 4.117 4.473 -5.170 127 HD21 LEU 20 1HD2 LEU 20 2.568 1.509 -7.788 128 HD22 LEU 20 2HD2 LEU 20 1.756 3.063 -7.589 129 HD23 LEU 20 3HD2 LEU 20 1.690 1.859 -6.299 130 H ARG 21 H ARG 21 7.499 3.731 -8.243 131 HA ARG 21 HA ARG 21 7.341 5.259 -10.593 132 HB2 ARG 21 1HB ARG 21 8.847 5.680 -8.614 133 HB3 ARG 21 2HB ARG 21 9.881 4.391 -9.213 134 HG2 ARG 21 1HG ARG 21 10.243 5.638 -11.281 135 HG3 ARG 21 2HG ARG 21 9.204 6.931 -10.681 136 HD2 ARG 21 1HD ARG 21 10.760 7.175 -8.743 137 HD3 ARG 21 2HD ARG 21 11.833 6.017 -9.528 138 HE ARG 21 HE ARG 21 12.573 7.714 -10.849 139 HH11 ARG 21 1HH1 ARG 21 9.404 8.544 -9.672 140 HH12 ARG 21 2HH1 ARG 21 9.406 10.119 -10.393 141 HH21 ARG 21 1HH2 ARG 21 12.589 9.786 -11.803 142 HH22 ARG 21 2HH2 ARG 21 11.218 10.824 -11.605 143 H GLU 22 H GLU 22 9.159 2.271 -9.919 144 HA GLU 22 HA GLU 22 10.281 1.942 -12.450 145 HB2 GLU 22 1HB GLU 22 10.687 -0.341 -11.834 146 HB3 GLU 22 2HB GLU 22 10.896 0.655 -10.401 147 HG2 GLU 22 1HG GLU 22 8.933 -0.110 -9.427 148 HG3 GLU 22 2HG GLU 22 8.285 -0.689 -10.960 149 H ALA 23 H ALA 23 7.053 1.402 -11.333 150 HA ALA 23 HA ALA 23 6.358 -0.015 -13.809 151 HB1 ALA 23 1HB ALA 23 5.098 0.159 -11.112 152 HB2 ALA 23 2HB ALA 23 4.094 -0.214 -12.514 153 HB3 ALA 23 3HB ALA 23 5.455 -1.258 -12.100 154 H GLU 24 H GLU 24 6.750 3.026 -13.082 155 HA GLU 24 HA GLU 24 5.761 5.033 -13.576 156 HB2 GLU 24 1HB GLU 24 4.484 4.756 -15.918 157 HB3 GLU 24 2HB GLU 24 6.236 4.807 -15.785 158 HG2 GLU 24 1HG GLU 24 6.184 2.293 -15.657 159 HG3 GLU 24 2HG GLU 24 4.482 2.392 -16.104 160 H LYS 25 H LYS 25 4.257 3.862 -11.687 161 HA LYS 25 HA LYS 25 1.511 3.589 -12.475 162 HB2 LYS 25 1HB LYS 25 3.076 3.335 -9.996 163 HB3 LYS 25 2HB LYS 25 1.438 3.930 -9.763 164 HG2 LYS 25 1HG LYS 25 1.607 1.490 -9.547 165 HG3 LYS 25 2HG LYS 25 0.528 1.983 -10.855 166 HD2 LYS 25 1HD LYS 25 2.775 1.772 -12.261 167 HD3 LYS 25 2HD LYS 25 3.173 0.636 -10.970 168 HE2 LYS 25 1HE LYS 25 2.158 -0.658 -12.653 169 HE3 LYS 25 2HE LYS 25 0.917 -0.437 -11.421 170 HZ1 LYS 25 1HZ LYS 25 0.823 1.653 -13.338 171 HZ2 LYS 25 2HZ LYS 25 -0.389 0.564 -12.886 172 HZ3 LYS 25 3HZ LYS 25 0.711 0.149 -14.104 173 H SER 26 H SER 26 -0.203 4.914 -11.345 174 HA SER 26 HA SER 26 0.501 7.751 -11.611 175 HB2 SER 26 1HB SER 26 -1.329 6.862 -13.046 176 HB3 SER 26 2HB SER 26 -2.245 6.471 -11.590 177 HG SER 26 HG SER 26 -2.969 8.442 -12.110 178 H SER 27 H SER 27 0.637 5.748 -9.212 179 HA SER 27 HA SER 27 -0.743 7.500 -7.286 180 HB2 SER 27 1HB SER 27 -1.403 4.987 -7.518 181 HB3 SER 27 2HB SER 27 0.091 4.690 -6.631 182 HG SER 27 HG SER 27 -0.750 6.169 -5.023 183 H SER 28 H SER 28 0.314 7.765 -5.195 184 HA SER 28 HA SER 28 2.984 7.017 -4.711 185 HB2 SER 28 1HB SER 28 4.052 9.264 -4.996 186 HB3 SER 28 2HB SER 28 3.579 8.508 -6.517 187 HG SER 28 HG SER 28 1.910 10.341 -5.157 188 H ILE 29 H ILE 29 3.800 7.858 -2.726 189 HA ILE 29 HA ILE 29 1.825 9.354 -1.134 190 HB ILE 29 HB ILE 29 2.648 7.995 0.847 191 HG12 ILE 29 1HG1 ILE 29 3.384 5.876 -1.134 192 HG13 ILE 29 2HG1 ILE 29 4.585 7.084 -0.694 193 HG21 ILE 29 1HG2 ILE 29 0.822 7.180 -1.302 194 HG22 ILE 29 2HG2 ILE 29 1.303 5.887 -0.205 195 HG23 ILE 29 3HG2 ILE 29 0.538 7.343 0.431 196 HD11 ILE 29 1HD1 ILE 29 3.616 6.279 1.740 197 HD12 ILE 29 2HD1 ILE 29 3.610 4.790 0.795 198 HD13 ILE 29 3HD1 ILE 29 5.101 5.713 0.976 199 H SER 30 H SER 30 2.649 10.708 0.491 200 HA SER 30 HA SER 30 5.403 11.562 0.007 201 HB2 SER 30 1HB SER 30 3.032 12.878 1.326 202 HB3 SER 30 2HB SER 30 4.661 13.540 1.468 203 HG SER 30 HG SER 30 4.682 13.988 -0.652 204 H SER 31 H SER 31 3.342 10.240 2.498 205 HA SER 31 HA SER 31 5.504 9.251 4.009 206 HB2 SER 31 1HB SER 31 5.406 11.842 4.504 207 HB3 SER 31 2HB SER 31 4.085 11.370 5.572 208 HG SER 31 HG SER 31 5.526 10.701 6.928 209 H PHE 32 H PHE 32 4.778 8.230 6.055 210 HA PHE 32 HA PHE 32 2.649 6.564 5.751 211 HB2 PHE 32 1HB PHE 32 3.583 7.661 8.410 212 HB3 PHE 32 2HB PHE 32 2.738 6.139 8.144 213 HD1 PHE 32 2HD PHE 32 4.288 5.366 5.621 214 HD2 PHE 32 1HD PHE 32 5.516 6.766 9.449 215 HE1 PHE 32 2HE PHE 32 6.446 4.216 5.347 216 HE2 PHE 32 1HE PHE 32 7.676 5.619 9.179 217 HZ PHE 32 HZ PHE 32 8.144 4.341 7.126 218 H LYS 33 H LYS 33 2.564 9.892 6.636 219 HA LYS 33 HA LYS 33 -0.288 9.692 7.328 220 HB2 LYS 33 1HB LYS 33 1.832 11.720 7.980 221 HB3 LYS 33 2HB LYS 33 0.126 12.135 8.086 222 HG2 LYS 33 1HG LYS 33 -0.006 9.976 9.550 223 HG3 LYS 33 2HG LYS 33 1.727 10.248 9.744 224 HD2 LYS 33 1HD LYS 33 0.920 11.453 11.520 225 HD3 LYS 33 2HD LYS 33 0.943 12.705 10.276 226 HE2 LYS 33 1HE LYS 33 -1.495 11.022 10.729 227 HE3 LYS 33 2HE LYS 33 -1.170 12.433 11.734 228 HZ1 LYS 33 1HZ LYS 33 -2.124 12.298 9.035 229 HZ2 LYS 33 2HZ LYS 33 -0.813 13.352 9.204 230 HZ3 LYS 33 3HZ LYS 33 -2.201 13.574 10.144 231 H ASP 34 H ASP 34 0.488 9.462 4.635 232 HA ASP 34 HA ASP 34 0.154 12.015 3.341 233 HB2 ASP 34 1HB ASP 34 1.503 10.566 2.102 234 HB3 ASP 34 2HB ASP 34 0.450 9.183 2.392 235 HA PRO 35 HA PRO 35 -4.251 12.057 3.257 236 HB2 PRO 35 1HB PRO 35 -4.601 13.777 1.185 237 HB3 PRO 35 2HB PRO 35 -4.064 14.299 2.787 238 HG2 PRO 35 1HG PRO 35 -2.446 13.781 0.322 239 HG3 PRO 35 2HG PRO 35 -2.314 15.110 1.488 240 HD2 PRO 35 1HD PRO 35 -0.652 12.973 1.522 241 HD3 PRO 35 2HD PRO 35 -1.129 13.835 2.999 242 H LYS 36 H LYS 36 -2.577 11.716 0.134 243 HA LYS 36 HA LYS 36 -4.661 10.760 -1.406 244 HB2 LYS 36 1HB LYS 36 -1.700 10.380 -1.465 245 HB3 LYS 36 2HB LYS 36 -2.693 9.386 -2.523 246 HG2 LYS 36 1HG LYS 36 -2.286 11.126 -3.921 247 HG3 LYS 36 2HG LYS 36 -3.750 11.728 -3.139 248 HD2 LYS 36 1HD LYS 36 -2.392 13.563 -2.934 249 HD3 LYS 36 2HD LYS 36 -2.019 12.729 -1.424 250 HE2 LYS 36 1HE LYS 36 -0.037 11.746 -2.440 251 HE3 LYS 36 2HE LYS 36 -0.423 12.522 -3.975 252 HZ1 LYS 36 1HZ LYS 36 0.799 13.631 -1.606 253 HZ2 LYS 36 2HZ LYS 36 -0.404 14.607 -2.286 254 HZ3 LYS 36 3HZ LYS 36 0.922 14.125 -3.220 255 H ILE 37 H ILE 37 -2.879 9.162 1.104 256 HA ILE 37 HA ILE 37 -3.384 6.485 0.456 257 HB ILE 37 HB ILE 37 -3.040 7.799 3.150 258 HG12 ILE 37 1HG1 ILE 37 -1.167 6.234 1.364 259 HG13 ILE 37 2HG1 ILE 37 -1.079 7.954 1.725 260 HG21 ILE 37 1HG2 ILE 37 -2.347 5.186 3.505 261 HG22 ILE 37 2HG2 ILE 37 -3.888 5.898 3.979 262 HG23 ILE 37 3HG2 ILE 37 -3.745 5.050 2.440 263 HD11 ILE 37 1HD1 ILE 37 0.464 7.249 3.201 264 HD12 ILE 37 2HD1 ILE 37 -0.956 6.968 4.211 265 HD13 ILE 37 3HD1 ILE 37 -0.228 5.631 3.320 266 H SER 38 H SER 38 -5.410 8.932 1.888 267 HA SER 38 HA SER 38 -7.359 7.371 3.109 268 HB2 SER 38 1HB SER 38 -8.846 9.285 2.859 269 HB3 SER 38 2HB SER 38 -7.226 9.846 3.273 270 HG SER 38 HG SER 38 -8.712 10.392 1.090 271 H THR 39 H THR 39 -6.827 8.089 -0.270 272 HA THR 39 HA THR 39 -9.354 6.916 -1.082 273 HB THR 39 HB THR 39 -8.508 7.332 -3.405 274 HG1 THR 39 1HG THR 39 -6.193 7.475 -2.251 275 HG21 THR 39 1HG2 THR 39 -8.177 9.909 -1.963 276 HG22 THR 39 2HG2 THR 39 -9.695 9.038 -1.744 277 HG23 THR 39 3HG2 THR 39 -9.177 9.515 -3.361 278 H SER 40 H SER 40 -6.324 5.776 -0.252 279 HA SER 40 HA SER 40 -5.360 3.717 -0.362 280 HB2 SER 40 1HB SER 40 -7.879 2.790 -1.754 281 HB3 SER 40 2HB SER 40 -6.707 1.794 -0.892 282 HG SER 40 HG SER 40 -8.195 3.865 0.343 283 H LEU 41 H LEU 41 -5.220 5.714 -2.555 284 HA LEU 41 HA LEU 41 -5.119 4.355 -5.043 285 HB2 LEU 41 1HB LEU 41 -4.137 6.971 -4.008 286 HB3 LEU 41 2HB LEU 41 -3.537 6.390 -5.560 287 HG LEU 41 HG LEU 41 -6.424 6.923 -4.861 288 HD11 LEU 41 1HD1 LEU 41 -6.287 8.873 -6.109 289 HD12 LEU 41 2HD1 LEU 41 -4.794 8.379 -6.906 290 HD13 LEU 41 3HD1 LEU 41 -4.768 8.871 -5.213 291 HD21 LEU 41 1HD2 LEU 41 -6.388 5.137 -6.414 292 HD22 LEU 41 2HD2 LEU 41 -5.103 5.888 -7.359 293 HD23 LEU 41 3HD2 LEU 41 -6.718 6.598 -7.344 294 HA PRO 42 HA PRO 42 -0.349 4.195 -4.205 295 HB2 PRO 42 1HB PRO 42 0.450 4.611 -1.644 296 HB3 PRO 42 2HB PRO 42 0.297 5.916 -2.827 297 HG2 PRO 42 1HG PRO 42 -1.605 5.079 -0.673 298 HG3 PRO 42 2HG PRO 42 -1.115 6.712 -1.160 299 HD2 PRO 42 1HD PRO 42 -3.459 5.602 -1.939 300 HD3 PRO 42 2HD PRO 42 -2.561 6.748 -2.955 301 H VAL 43 H VAL 43 -2.527 3.145 -1.637 302 HA VAL 43 HA VAL 43 -0.973 0.823 -0.966 303 HB VAL 43 HB VAL 43 -3.879 1.198 -0.290 304 HG11 VAL 43 1HG1 VAL 43 -3.055 -0.927 0.348 305 HG12 VAL 43 2HG1 VAL 43 -1.562 -0.236 0.988 306 HG13 VAL 43 3HG1 VAL 43 -3.093 0.048 1.816 307 HG21 VAL 43 1HG2 VAL 43 -2.200 2.147 1.808 308 HG22 VAL 43 2HG2 VAL 43 -1.805 3.020 0.327 309 HG23 VAL 43 3HG2 VAL 43 -3.463 3.007 0.928 310 H LEU 44 H LEU 44 -3.518 1.582 -3.200 311 HA LEU 44 HA LEU 44 -4.137 -1.206 -3.722 312 HB2 LEU 44 1HB LEU 44 -5.146 1.392 -4.841 313 HB3 LEU 44 2HB LEU 44 -5.599 -0.165 -5.531 314 HG LEU 44 HG LEU 44 -6.117 0.599 -2.662 315 HD11 LEU 44 1HD1 LEU 44 -8.300 1.241 -3.237 316 HD12 LEU 44 2HD1 LEU 44 -8.147 0.609 -4.875 317 HD13 LEU 44 3HD1 LEU 44 -7.261 2.059 -4.404 318 HD21 LEU 44 1HD2 LEU 44 -6.718 -1.741 -4.388 319 HD22 LEU 44 2HD2 LEU 44 -7.933 -1.249 -3.209 320 HD23 LEU 44 3HD2 LEU 44 -6.305 -1.672 -2.675 321 H ASP 45 H ASP 45 -2.572 1.517 -5.353 322 HA ASP 45 HA ASP 45 -2.003 0.086 -7.749 323 HB2 ASP 45 1HB ASP 45 -2.035 2.684 -7.212 324 HB3 ASP 45 2HB ASP 45 -0.323 2.405 -6.909 325 H LEU 46 H LEU 46 -0.272 0.652 -4.744 326 HA LEU 46 HA LEU 46 2.269 -0.211 -5.502 327 HB2 LEU 46 1HB LEU 46 2.087 0.836 -3.418 328 HB3 LEU 46 2HB LEU 46 0.791 -0.237 -2.895 329 HG LEU 46 HG LEU 46 2.357 -2.053 -2.602 330 HD11 LEU 46 1HD1 LEU 46 4.857 -0.745 -2.847 331 HD12 LEU 46 2HD1 LEU 46 3.975 -0.511 -4.355 332 HD13 LEU 46 3HD1 LEU 46 4.254 -2.141 -3.742 333 HD21 LEU 46 1HD2 LEU 46 2.059 -0.111 -0.894 334 HD22 LEU 46 2HD2 LEU 46 3.725 0.276 -1.323 335 HD23 LEU 46 3HD2 LEU 46 3.332 -1.307 -0.649 336 H ILE 47 H ILE 47 -0.571 -2.036 -4.510 337 HA ILE 47 HA ILE 47 0.746 -4.552 -4.316 338 HB ILE 47 HB ILE 47 -2.182 -3.952 -4.754 339 HG12 ILE 47 1HG1 ILE 47 -0.840 -4.742 -2.174 340 HG13 ILE 47 2HG1 ILE 47 -1.016 -3.057 -2.652 341 HG21 ILE 47 1HG2 ILE 47 -2.633 -6.199 -4.093 342 HG22 ILE 47 2HG2 ILE 47 -1.440 -6.253 -5.391 343 HG23 ILE 47 3HG2 ILE 47 -0.934 -6.488 -3.718 344 HD11 ILE 47 1HD1 ILE 47 -2.943 -3.157 -1.542 345 HD12 ILE 47 2HD1 ILE 47 -3.552 -4.002 -2.965 346 HD13 ILE 47 3HD1 ILE 47 -2.980 -4.920 -1.572 347 H ASP 48 H ASP 48 -1.306 -3.085 -6.826 348 HA ASP 48 HA ASP 48 -1.315 -5.147 -8.663 349 HB2 ASP 48 1HB ASP 48 -2.710 -3.284 -9.099 350 HB3 ASP 48 2HB ASP 48 -1.358 -2.157 -9.036 351 H ALA 49 H ALA 49 1.091 -2.569 -8.272 352 HA ALA 49 HA ALA 49 2.724 -3.094 -10.431 353 HB1 ALA 49 1HB ALA 49 3.102 -1.864 -7.777 354 HB2 ALA 49 2HB ALA 49 4.568 -2.389 -8.607 355 HB3 ALA 49 3HB ALA 49 3.478 -1.242 -9.385 356 H ILE 50 H ILE 50 2.448 -4.831 -7.403 357 HA ILE 50 HA ILE 50 4.808 -6.403 -7.749 358 HB ILE 50 HB ILE 50 2.431 -7.157 -6.059 359 HG12 ILE 50 1HG1 ILE 50 3.069 -4.806 -5.609 360 HG13 ILE 50 2HG1 ILE 50 3.403 -5.862 -4.240 361 HG21 ILE 50 1HG2 ILE 50 5.352 -7.640 -5.542 362 HG22 ILE 50 2HG2 ILE 50 3.964 -8.406 -4.773 363 HG23 ILE 50 3HG2 ILE 50 4.348 -8.764 -6.457 364 HD11 ILE 50 1HD1 ILE 50 5.715 -5.805 -4.631 365 HD12 ILE 50 2HD1 ILE 50 5.507 -5.123 -6.244 366 HD13 ILE 50 3HD1 ILE 50 5.160 -4.143 -4.820 367 H GLN 51 H GLN 51 1.334 -7.100 -8.130 368 HA GLN 51 HA GLN 51 2.059 -9.198 -10.056 369 HB2 GLN 51 1HB GLN 51 1.287 -9.924 -7.626 370 HB3 GLN 51 2HB GLN 51 -0.311 -9.620 -8.293 371 HG2 GLN 51 1HG GLN 51 1.687 -11.413 -9.636 372 HG3 GLN 51 2HG GLN 51 0.547 -11.992 -8.422 373 HE21 GLN 51 1HE2 GLN 51 0.662 -12.897 -11.082 374 HE22 GLN 51 2HE2 GLN 51 -0.819 -12.467 -11.861 375 HA PRO 52 HA PRO 52 -0.804 -6.735 -12.439 376 HB2 PRO 52 1HB PRO 52 -0.512 -8.153 -14.736 377 HB3 PRO 52 2HB PRO 52 0.676 -6.968 -14.180 378 HG2 PRO 52 1HG PRO 52 0.710 -9.952 -13.925 379 HG3 PRO 52 2HG PRO 52 2.031 -8.850 -14.360 380 HD2 PRO 52 1HD PRO 52 1.757 -9.885 -11.873 381 HD3 PRO 52 2HD PRO 52 2.441 -8.274 -12.165 382 H GLY 53 H GLY 53 -2.932 -6.973 -12.183 383 HA2 GLY 53 1HA GLY 53 -4.891 -8.156 -13.136 384 HA3 GLY 53 2HA GLY 53 -4.098 -9.648 -12.654 385 H SER 54 H SER 54 -3.194 -8.576 -10.095 386 HA SER 54 HA SER 54 -5.226 -9.421 -8.438 387 HB2 SER 54 1HB SER 54 -4.019 -8.149 -6.625 388 HB3 SER 54 2HB SER 54 -2.992 -9.221 -7.578 389 HG SER 54 HG SER 54 -2.561 -7.245 -8.873 390 H ILE 55 H ILE 55 -4.324 -6.024 -9.050 391 HA ILE 55 HA ILE 55 -6.852 -5.134 -7.921 392 HB ILE 55 HB ILE 55 -4.705 -3.404 -9.138 393 HG12 ILE 55 1HG1 ILE 55 -3.941 -4.985 -7.254 394 HG13 ILE 55 2HG1 ILE 55 -3.602 -3.268 -7.066 395 HG21 ILE 55 1HG2 ILE 55 -5.663 -1.687 -7.662 396 HG22 ILE 55 2HG2 ILE 55 -6.845 -2.311 -8.813 397 HG23 ILE 55 3HG2 ILE 55 -6.886 -2.843 -7.133 398 HD11 ILE 55 1HD1 ILE 55 -4.621 -4.734 -5.117 399 HD12 ILE 55 2HD1 ILE 55 -5.044 -3.035 -5.334 400 HD13 ILE 55 3HD1 ILE 55 -6.129 -4.296 -5.920 401 H ASN 56 H ASN 56 -8.463 -4.080 -9.040 402 HA ASN 56 HA ASN 56 -8.196 -3.977 -11.969 403 HB2 ASN 56 1HB ASN 56 -9.597 -5.936 -10.969 404 HB3 ASN 56 2HB ASN 56 -10.809 -4.692 -10.676 405 HD21 ASN 56 1HD2 ASN 56 -12.233 -5.669 -12.122 406 HD22 ASN 56 2HD2 ASN 56 -12.010 -5.564 -13.832 407 H TYR 57 H TYR 57 -7.939 -1.781 -12.089 408 HA TYR 57 HA TYR 57 -9.148 0.197 -10.622 409 HB2 TYR 57 1HB TYR 57 -8.045 0.054 -13.383 410 HB3 TYR 57 2HB TYR 57 -9.007 1.470 -12.968 411 HD1 TYR 57 1HD TYR 57 -6.600 -0.502 -10.909 412 HD2 TYR 57 2HD TYR 57 -7.510 3.229 -12.738 413 HE1 TYR 57 1HE TYR 57 -4.638 0.503 -9.819 414 HE2 TYR 57 2HE TYR 57 -5.550 4.246 -11.654 415 HH TYR 57 HH TYR 57 -3.943 2.880 -9.111 416 H ASP 58 H ASP 58 -10.503 -1.716 -13.204 417 HA ASP 58 HA ASP 58 -12.679 -0.211 -13.979 418 HB2 ASP 58 1HB ASP 58 -11.836 -2.623 -14.676 419 HB3 ASP 58 2HB ASP 58 -13.076 -3.137 -13.536 420 H LEU 59 H LEU 59 -12.384 -2.354 -11.173 421 HA LEU 59 HA LEU 59 -15.070 -1.748 -10.286 422 HB2 LEU 59 1HB LEU 59 -12.944 -3.174 -8.715 423 HB3 LEU 59 2HB LEU 59 -14.694 -3.293 -8.540 424 HG LEU 59 HG LEU 59 -13.145 -4.314 -10.918 425 HD11 LEU 59 1HD1 LEU 59 -13.011 -5.379 -8.432 426 HD12 LEU 59 2HD1 LEU 59 -12.879 -6.309 -9.925 427 HD13 LEU 59 3HD1 LEU 59 -14.424 -6.214 -9.081 428 HD21 LEU 59 1HD2 LEU 59 -15.979 -4.013 -10.286 429 HD22 LEU 59 2HD2 LEU 59 -15.533 -5.649 -10.768 430 HD23 LEU 59 3HD2 LEU 59 -15.183 -4.289 -11.836 431 H LEU 60 H LEU 60 -11.811 -0.713 -9.614 432 HA LEU 60 HA LEU 60 -12.265 0.541 -7.132 433 HB2 LEU 60 1HB LEU 60 -10.263 1.278 -9.260 434 HB3 LEU 60 2HB LEU 60 -10.201 1.753 -7.564 435 HG LEU 60 HG LEU 60 -9.924 -1.061 -8.620 436 HD11 LEU 60 1HD1 LEU 60 -7.843 -0.375 -9.068 437 HD12 LEU 60 2HD1 LEU 60 -7.612 -0.429 -7.320 438 HD13 LEU 60 3HD1 LEU 60 -8.016 1.096 -8.108 439 HD21 LEU 60 1HD2 LEU 60 -9.102 -1.355 -6.179 440 HD22 LEU 60 2HD2 LEU 60 -10.833 -1.345 -6.513 441 HD23 LEU 60 3HD2 LEU 60 -10.051 0.098 -5.867 442 H LYS 61 H LYS 61 -12.632 2.712 -6.608 443 HA LYS 61 HA LYS 61 -14.333 4.106 -8.482 444 HB2 LYS 61 1HB LYS 61 -13.475 4.851 -5.679 445 HB3 LYS 61 2HB LYS 61 -14.714 5.673 -6.619 446 HG2 LYS 61 1HG LYS 61 -14.830 2.792 -5.751 447 HG3 LYS 61 2HG LYS 61 -15.648 4.135 -4.947 448 HD2 LYS 61 1HD LYS 61 -16.922 4.585 -6.982 449 HD3 LYS 61 2HD LYS 61 -16.090 3.262 -7.803 450 HE2 LYS 61 1HE LYS 61 -17.540 2.736 -5.245 451 HE3 LYS 61 2HE LYS 61 -18.454 2.892 -6.745 452 HZ1 LYS 61 1HZ LYS 61 -17.074 1.133 -7.702 453 HZ2 LYS 61 2HZ LYS 61 -17.906 0.594 -6.332 454 HZ3 LYS 61 3HZ LYS 61 -16.257 0.960 -6.230 455 H THR 62 H THR 62 -11.684 5.315 -6.426 456 HA THR 62 HA THR 62 -10.156 6.975 -6.761 457 HB THR 62 HB THR 62 -8.780 6.797 -8.700 458 HG1 THR 62 1HG THR 62 -10.568 5.078 -10.025 459 HG21 THR 62 1HG2 THR 62 -8.562 4.905 -7.217 460 HG22 THR 62 2HG2 THR 62 -8.431 4.341 -8.883 461 HG23 THR 62 3HG2 THR 62 -9.929 4.098 -7.985 462 H GLU 63 H GLU 63 -12.844 7.804 -7.044 463 HA GLU 63 HA GLU 63 -12.426 10.180 -8.662 464 HB2 GLU 63 1HB GLU 63 -14.623 9.950 -9.789 465 HB3 GLU 63 2HB GLU 63 -13.473 8.710 -10.270 466 HG2 GLU 63 1HG GLU 63 -14.583 7.235 -8.518 467 HG3 GLU 63 2HG GLU 63 -15.865 8.444 -8.484 468 H ASN 64 H ASN 64 -12.686 11.675 -7.129 469 HA ASN 64 HA ASN 64 -13.472 12.699 -5.222 470 HB2 ASN 64 1HB ASN 64 -15.916 13.311 -5.487 471 HB3 ASN 64 2HB ASN 64 -14.881 13.716 -6.854 472 HD21 ASN 64 1HD2 ASN 64 -15.025 12.486 -8.752 473 HD22 ASN 64 2HD2 ASN 64 -16.419 11.525 -9.099 474 H LEU 65 H LEU 65 -12.984 10.222 -4.426 475 HA LEU 65 HA LEU 65 -15.143 8.680 -3.519 476 HB2 LEU 65 1HB LEU 65 -12.293 8.936 -2.613 477 HB3 LEU 65 2HB LEU 65 -13.422 7.837 -1.823 478 HG LEU 65 HG LEU 65 -13.046 7.633 -4.774 479 HD11 LEU 65 1HD1 LEU 65 -10.785 7.772 -3.533 480 HD12 LEU 65 2HD1 LEU 65 -11.066 6.438 -4.651 481 HD13 LEU 65 3HD1 LEU 65 -11.212 6.177 -2.914 482 HD21 LEU 65 1HD2 LEU 65 -14.501 6.002 -4.304 483 HD22 LEU 65 2HD2 LEU 65 -14.146 6.057 -2.576 484 HD23 LEU 65 3HD2 LEU 65 -13.108 5.131 -3.662 485 H ASN 66 H ASN 66 -15.829 8.341 -1.283 486 HA ASN 66 HA ASN 66 -15.527 10.667 0.468 487 HB2 ASN 66 1HB ASN 66 -18.123 10.276 0.893 488 HB3 ASN 66 2HB ASN 66 -17.547 11.354 -0.375 489 HD21 ASN 66 1HD2 ASN 66 -19.724 9.049 0.261 490 HD22 ASN 66 2HD2 ASN 66 -19.942 8.380 -1.317 491 H ASP 67 H ASP 67 -16.616 10.205 2.647 492 HA ASP 67 HA ASP 67 -15.407 8.224 4.007 493 HB2 ASP 67 1HB ASP 67 -18.186 9.321 4.461 494 HB3 ASP 67 2HB ASP 67 -17.354 8.284 5.617 495 H ASP 68 H ASP 68 -18.234 7.873 1.984 496 HA ASP 68 HA ASP 68 -18.818 5.192 2.841 497 HB2 ASP 68 1HB ASP 68 -19.779 6.702 0.402 498 HB3 ASP 68 2HB ASP 68 -20.448 5.189 1.006 499 H GLU 69 H GLU 69 -17.976 6.394 -0.409 500 HA GLU 69 HA GLU 69 -17.196 3.958 -1.468 501 HB2 GLU 69 1HB GLU 69 -16.038 6.657 -2.184 502 HB3 GLU 69 2HB GLU 69 -16.053 5.222 -3.200 503 HG2 GLU 69 1HG GLU 69 -18.627 6.357 -2.210 504 HG3 GLU 69 2HG GLU 69 -17.798 7.110 -3.572 505 H LYS 70 H LYS 70 -15.084 6.494 -0.119 506 HA LYS 70 HA LYS 70 -12.623 5.452 -0.368 507 HB2 LYS 70 1HB LYS 70 -13.833 6.731 2.082 508 HB3 LYS 70 2HB LYS 70 -12.116 6.376 1.942 509 HG2 LYS 70 1HG LYS 70 -12.178 7.766 -0.195 510 HG3 LYS 70 2HG LYS 70 -13.758 8.323 0.360 511 HD2 LYS 70 1HD LYS 70 -12.810 9.248 2.351 512 HD3 LYS 70 2HD LYS 70 -11.246 8.500 2.018 513 HE2 LYS 70 1HE LYS 70 -10.888 9.923 0.136 514 HE3 LYS 70 2HE LYS 70 -12.539 10.538 0.214 515 HZ1 LYS 70 1HZ LYS 70 -10.491 10.942 2.325 516 HZ2 LYS 70 2HZ LYS 70 -12.042 11.614 2.284 517 HZ3 LYS 70 3HZ LYS 70 -10.888 12.083 1.141 518 H LEU 71 H LEU 71 -14.956 4.453 2.116 519 HA LEU 71 HA LEU 71 -13.363 2.611 3.460 520 HB2 LEU 71 1HB LEU 71 -15.395 3.179 4.465 521 HB3 LEU 71 2HB LEU 71 -16.318 2.812 3.010 522 HG LEU 71 HG LEU 71 -15.870 0.404 3.383 523 HD11 LEU 71 1HD1 LEU 71 -13.834 0.466 4.619 524 HD12 LEU 71 2HD1 LEU 71 -15.068 -0.247 5.659 525 HD13 LEU 71 3HD1 LEU 71 -14.573 1.428 5.899 526 HD21 LEU 71 1HD2 LEU 71 -17.051 1.262 5.946 527 HD22 LEU 71 2HD2 LEU 71 -17.696 0.199 4.694 528 HD23 LEU 71 3HD2 LEU 71 -17.776 1.950 4.491 529 H ASN 72 H ASN 72 -15.768 1.908 0.917 530 HA ASN 72 HA ASN 72 -15.409 -0.751 0.559 531 HB2 ASN 72 1HB ASN 72 -15.709 1.339 -1.609 532 HB3 ASN 72 2HB ASN 72 -15.934 -0.391 -1.857 533 HD21 ASN 72 1HD2 ASN 72 -17.161 2.448 -0.222 534 HD22 ASN 72 2HD2 ASN 72 -18.755 1.836 0.051 535 H ASN 73 H ASN 73 -13.381 1.789 -0.878 536 HA ASN 73 HA ASN 73 -11.636 0.061 -2.254 537 HB2 ASN 73 1HB ASN 73 -11.555 2.916 -1.394 538 HB3 ASN 73 2HB ASN 73 -10.046 2.164 -1.902 539 HD21 ASN 73 1HD2 ASN 73 -10.670 4.143 -3.410 540 HD22 ASN 73 2HD2 ASN 73 -11.387 3.666 -4.908 541 H ALA 74 H ALA 74 -11.497 1.469 0.988 542 HA ALA 74 HA ALA 74 -8.930 0.606 1.692 543 HB1 ALA 74 1HB ALA 74 -11.313 0.978 3.502 544 HB2 ALA 74 2HB ALA 74 -9.621 0.939 3.998 545 HB3 ALA 74 3HB ALA 74 -10.211 2.252 2.980 546 H LYS 75 H LYS 75 -12.085 -0.964 2.162 547 HA LYS 75 HA LYS 75 -11.144 -3.239 3.508 548 HB2 LYS 75 1HB LYS 75 -13.561 -2.946 1.713 549 HB3 LYS 75 2HB LYS 75 -13.277 -4.285 2.817 550 HG2 LYS 75 1HG LYS 75 -13.762 -3.048 4.670 551 HG3 LYS 75 2HG LYS 75 -13.249 -1.530 3.926 552 HD2 LYS 75 1HD LYS 75 -15.631 -1.475 4.177 553 HD3 LYS 75 2HD LYS 75 -15.263 -1.650 2.460 554 HE2 LYS 75 1HE LYS 75 -17.110 -3.113 3.211 555 HE3 LYS 75 2HE LYS 75 -15.744 -4.009 2.550 556 HZ1 LYS 75 1HZ LYS 75 -15.921 -3.540 5.450 557 HZ2 LYS 75 2HZ LYS 75 -15.142 -4.788 4.615 558 HZ3 LYS 75 3HZ LYS 75 -16.829 -4.783 4.745 559 H TYR 76 H TYR 76 -11.471 -2.522 0.074 560 HA TYR 76 HA TYR 76 -10.901 -5.143 -0.848 561 HB2 TYR 76 1HB TYR 76 -12.004 -3.295 -2.174 562 HB3 TYR 76 2HB TYR 76 -10.411 -2.567 -2.347 563 HD1 TYR 76 1HD TYR 76 -11.970 -5.942 -2.793 564 HD2 TYR 76 2HD TYR 76 -9.329 -2.982 -4.334 565 HE1 TYR 76 1HE TYR 76 -11.545 -7.354 -4.761 566 HE2 TYR 76 2HE TYR 76 -8.898 -4.387 -6.306 567 HH TYR 76 HH TYR 76 -10.425 -6.386 -7.512 568 H ALA 77 H ALA 77 -8.903 -2.270 -0.311 569 HA ALA 77 HA ALA 77 -6.502 -3.173 -1.370 570 HB1 ALA 77 1HB ALA 77 -6.591 -0.915 -0.768 571 HB2 ALA 77 2HB ALA 77 -7.118 -1.281 0.875 572 HB3 ALA 77 3HB ALA 77 -5.461 -1.630 0.383 573 H ILE 78 H ILE 78 -7.265 -3.136 2.116 574 HA ILE 78 HA ILE 78 -5.190 -4.714 2.990 575 HB ILE 78 HB ILE 78 -7.999 -4.551 4.082 576 HG12 ILE 78 1HG1 ILE 78 -5.417 -3.186 4.873 577 HG13 ILE 78 2HG1 ILE 78 -6.792 -2.427 4.077 578 HG21 ILE 78 1HG2 ILE 78 -6.159 -5.230 6.110 579 HG22 ILE 78 2HG2 ILE 78 -7.501 -6.191 5.490 580 HG23 ILE 78 3HG2 ILE 78 -5.897 -6.351 4.773 581 HD11 ILE 78 1HD1 ILE 78 -7.372 -1.822 6.143 582 HD12 ILE 78 2HD1 ILE 78 -7.955 -3.480 6.295 583 HD13 ILE 78 3HD1 ILE 78 -6.354 -3.051 6.895 584 H SER 79 H SER 79 -8.327 -5.739 1.725 585 HA SER 79 HA SER 79 -8.066 -8.484 2.278 586 HB2 SER 79 1HB SER 79 -9.732 -6.858 0.400 587 HB3 SER 79 2HB SER 79 -9.684 -8.609 0.193 588 HG SER 79 HG SER 79 -10.078 -8.435 2.673 589 H MET 80 H MET 80 -7.254 -6.589 -0.612 590 HA MET 80 HA MET 80 -6.484 -8.594 -2.328 591 HB2 MET 80 1HB MET 80 -5.386 -5.817 -1.932 592 HB3 MET 80 2HB MET 80 -4.811 -6.873 -3.216 593 HG2 MET 80 1HG MET 80 -7.735 -6.397 -2.950 594 HG3 MET 80 2HG MET 80 -6.719 -5.132 -3.638 595 HE1 MET 80 1HE MET 80 -8.261 -8.873 -5.570 596 HE2 MET 80 2HE MET 80 -7.223 -9.222 -4.187 597 HE3 MET 80 3HE MET 80 -8.631 -8.178 -3.991 598 H ALA 81 H ALA 81 -4.403 -6.906 0.021 599 HA ALA 81 HA ALA 81 -1.995 -8.060 -0.376 600 HB1 ALA 81 1HB ALA 81 -1.483 -7.089 1.558 601 HB2 ALA 81 2HB ALA 81 -3.187 -6.661 1.709 602 HB3 ALA 81 3HB ALA 81 -2.581 -8.140 2.453 603 H ARG 82 H ARG 82 -4.586 -9.511 1.598 604 HA ARG 82 HA ARG 82 -3.184 -11.919 2.106 605 HB2 ARG 82 1HB ARG 82 -6.012 -11.004 2.408 606 HB3 ARG 82 2HB ARG 82 -5.662 -12.723 2.532 607 HG2 ARG 82 1HG ARG 82 -3.814 -11.877 4.210 608 HG3 ARG 82 2HG ARG 82 -4.902 -10.494 4.339 609 HD2 ARG 82 1HD ARG 82 -6.744 -12.275 4.678 610 HD3 ARG 82 2HD ARG 82 -5.405 -13.367 5.026 611 HE ARG 82 HE ARG 82 -5.174 -12.356 7.059 612 HH11 ARG 82 1HH1 ARG 82 -6.993 -10.254 4.964 613 HH12 ARG 82 2HH1 ARG 82 -7.350 -9.106 6.211 614 HH21 ARG 82 1HH2 ARG 82 -5.637 -10.851 8.710 615 HH22 ARG 82 2HH2 ARG 82 -6.577 -9.445 8.341 616 H LYS 83 H LYS 83 -5.753 -11.092 -0.208 617 HA LYS 83 HA LYS 83 -6.234 -13.494 -1.396 618 HB2 LYS 83 1HB LYS 83 -6.187 -10.694 -2.400 619 HB3 LYS 83 2HB LYS 83 -6.291 -11.979 -3.596 620 HG2 LYS 83 1HG LYS 83 -8.506 -11.431 -3.176 621 HG3 LYS 83 2HG LYS 83 -8.238 -12.868 -2.184 622 HD2 LYS 83 1HD LYS 83 -7.880 -11.450 -0.224 623 HD3 LYS 83 2HD LYS 83 -8.134 -10.011 -1.215 624 HE2 LYS 83 1HE LYS 83 -10.218 -12.157 -1.072 625 HE3 LYS 83 2HE LYS 83 -10.097 -10.941 0.199 626 HZ1 LYS 83 1HZ LYS 83 -10.796 -10.587 -2.640 627 HZ2 LYS 83 2HZ LYS 83 -10.145 -9.295 -1.764 628 HZ3 LYS 83 3HZ LYS 83 -11.595 -10.011 -1.265 629 H ILE 84 H ILE 84 -3.584 -11.272 -2.226 630 HA ILE 84 HA ILE 84 -2.443 -13.100 -4.125 631 HB ILE 84 HB ILE 84 -0.565 -11.504 -4.226 632 HG12 ILE 84 1HG1 ILE 84 -2.106 -9.809 -2.264 633 HG13 ILE 84 2HG1 ILE 84 -0.795 -10.870 -1.762 634 HG21 ILE 84 1HG2 ILE 84 -2.087 -10.861 -5.782 635 HG22 ILE 84 2HG2 ILE 84 -3.390 -10.706 -4.605 636 HG23 ILE 84 3HG2 ILE 84 -2.170 -9.440 -4.741 637 HD11 ILE 84 1HD1 ILE 84 -0.135 -9.073 -3.979 638 HD12 ILE 84 2HD1 ILE 84 -0.500 -8.274 -2.449 639 HD13 ILE 84 3HD1 ILE 84 0.781 -9.483 -2.529 640 H GLY 85 H GLY 85 -2.108 -12.482 -0.730 641 HA2 GLY 85 1HA GLY 85 -1.101 -14.627 0.299 642 HA3 GLY 85 2HA GLY 85 0.318 -14.142 -0.616 643 H ALA 86 H ALA 86 0.754 -11.625 -0.229 644 HA ALA 86 HA ALA 86 1.890 -11.309 2.219 645 HB1 ALA 86 1HB ALA 86 0.636 -8.942 0.878 646 HB2 ALA 86 2HB ALA 86 2.176 -9.053 1.731 647 HB3 ALA 86 3HB ALA 86 1.994 -9.793 0.140 648 H ARG 87 H ARG 87 0.894 -11.740 4.099 649 HA ARG 87 HA ARG 87 -1.840 -11.016 4.595 650 HB2 ARG 87 1HB ARG 87 0.333 -12.281 6.243 651 HB3 ARG 87 2HB ARG 87 -1.185 -11.783 6.978 652 HG2 ARG 87 1HG ARG 87 -2.346 -13.207 5.245 653 HG3 ARG 87 2HG ARG 87 -0.752 -13.852 4.846 654 HD2 ARG 87 1HD ARG 87 -1.702 -15.365 6.392 655 HD3 ARG 87 2HD ARG 87 -0.512 -14.427 7.294 656 HE ARG 87 HE ARG 87 -3.104 -13.272 7.476 657 HH11 ARG 87 1HH1 ARG 87 -1.120 -15.857 8.699 658 HH12 ARG 87 2HH1 ARG 87 -1.968 -15.970 10.206 659 HH21 ARG 87 1HH2 ARG 87 -4.229 -13.410 9.455 660 HH22 ARG 87 2HH2 ARG 87 -3.737 -14.578 10.634 661 H VAL 88 H VAL 88 -2.598 -9.544 6.166 662 HA VAL 88 HA VAL 88 -0.704 -7.661 7.323 663 HB VAL 88 HB VAL 88 -1.223 -6.705 5.110 664 HG11 VAL 88 1HG1 VAL 88 -4.065 -6.462 6.079 665 HG12 VAL 88 2HG1 VAL 88 -3.422 -6.029 4.494 666 HG13 VAL 88 3HG1 VAL 88 -3.513 -7.723 4.977 667 HG21 VAL 88 1HG2 VAL 88 -2.263 -4.515 6.064 668 HG22 VAL 88 2HG2 VAL 88 -2.104 -5.335 7.616 669 HG23 VAL 88 3HG2 VAL 88 -0.677 -5.046 6.622 670 H TYR 89 H TYR 89 -1.427 -6.710 9.182 671 HA TYR 89 HA TYR 89 -4.119 -7.506 10.076 672 HB2 TYR 89 1HB TYR 89 -1.942 -8.355 11.262 673 HB3 TYR 89 2HB TYR 89 -1.935 -6.750 11.984 674 HD1 TYR 89 2HD TYR 89 -4.182 -9.685 11.471 675 HD2 TYR 89 1HD TYR 89 -3.128 -6.383 13.939 676 HE1 TYR 89 2HE TYR 89 -5.787 -10.449 13.170 677 HE2 TYR 89 1HE TYR 89 -4.730 -7.139 15.645 678 HH TYR 89 HH TYR 89 -7.067 -9.540 15.035 679 H ALA 90 H ALA 90 -5.409 -5.798 9.734 680 HA ALA 90 HA ALA 90 -5.143 -3.472 11.322 681 HB1 ALA 90 1HB ALA 90 -3.748 -2.316 10.004 682 HB2 ALA 90 2HB ALA 90 -4.031 -3.369 8.615 683 HB3 ALA 90 3HB ALA 90 -5.169 -2.073 8.986 684 H LEU 91 H LEU 91 -6.772 -1.700 10.354 685 HA LEU 91 HA LEU 91 -9.170 -3.156 9.454 686 HB2 LEU 91 1HB LEU 91 -9.234 -2.512 11.853 687 HB3 LEU 91 2HB LEU 91 -9.098 -0.825 11.362 688 HG LEU 91 HG LEU 91 -11.267 -1.321 10.010 689 HD11 LEU 91 1HD1 LEU 91 -12.259 -3.283 10.290 690 HD12 LEU 91 2HD1 LEU 91 -12.220 -3.104 12.043 691 HD13 LEU 91 3HD1 LEU 91 -10.850 -3.827 11.200 692 HD21 LEU 91 1HD2 LEU 91 -12.569 -0.989 12.247 693 HD22 LEU 91 2HD2 LEU 91 -11.476 0.268 11.665 694 HD23 LEU 91 3HD2 LEU 91 -10.954 -0.834 12.939 695 HA PRO 92 HA PRO 92 -9.245 -0.242 6.141 696 HB2 PRO 92 1HB PRO 92 -11.802 -0.659 5.329 697 HB3 PRO 92 2HB PRO 92 -10.492 -1.803 5.008 698 HG2 PRO 92 1HG PRO 92 -12.587 -1.871 7.146 699 HG3 PRO 92 2HG PRO 92 -11.980 -3.193 6.132 700 HD2 PRO 92 1HD PRO 92 -11.159 -2.821 8.685 701 HD3 PRO 92 2HD PRO 92 -10.100 -3.494 7.429 702 H GLU 93 H GLU 93 -12.109 -0.305 8.267 703 HA GLU 93 HA GLU 93 -13.232 2.114 7.734 704 HB2 GLU 93 1HB GLU 93 -12.913 0.629 10.325 705 HB3 GLU 93 2HB GLU 93 -13.755 2.171 10.270 706 HG2 GLU 93 1HG GLU 93 -15.298 1.230 8.592 707 HG3 GLU 93 2HG GLU 93 -14.489 -0.326 8.761 708 H ASP 94 H ASP 94 -10.223 1.514 9.364 709 HA ASP 94 HA ASP 94 -9.976 4.279 10.242 710 HB2 ASP 94 1HB ASP 94 -8.166 1.878 10.543 711 HB3 ASP 94 2HB ASP 94 -7.753 3.488 11.126 712 H LEU 95 H LEU 95 -8.681 2.104 7.811 713 HA LEU 95 HA LEU 95 -6.510 3.544 6.894 714 HB2 LEU 95 1HB LEU 95 -6.911 1.370 6.039 715 HB3 LEU 95 2HB LEU 95 -8.499 1.833 5.427 716 HG LEU 95 HG LEU 95 -7.506 3.130 3.667 717 HD11 LEU 95 1HD1 LEU 95 -5.528 3.806 5.163 718 HD12 LEU 95 2HD1 LEU 95 -5.242 3.598 3.436 719 HD13 LEU 95 3HD1 LEU 95 -4.764 2.333 4.567 720 HD21 LEU 95 1HD2 LEU 95 -7.000 1.367 2.362 721 HD22 LEU 95 2HD2 LEU 95 -7.464 0.432 3.783 722 HD23 LEU 95 3HD2 LEU 95 -5.762 0.767 3.467 723 H VAL 96 H VAL 96 -9.932 3.960 6.122 724 HA VAL 96 HA VAL 96 -9.736 5.805 4.059 725 HB VAL 96 HB VAL 96 -11.820 5.500 6.213 726 HG11 VAL 96 1HG1 VAL 96 -11.626 7.489 3.997 727 HG12 VAL 96 2HG1 VAL 96 -13.207 6.864 4.471 728 HG13 VAL 96 3HG1 VAL 96 -12.198 7.702 5.651 729 HG21 VAL 96 1HG2 VAL 96 -11.762 3.638 4.733 730 HG22 VAL 96 2HG2 VAL 96 -13.143 4.627 4.263 731 HG23 VAL 96 3HG2 VAL 96 -11.655 4.685 3.318 732 H GLU 97 H GLU 97 -9.058 6.185 7.417 733 HA GLU 97 HA GLU 97 -8.924 9.106 7.105 734 HB2 GLU 97 1HB GLU 97 -9.016 7.428 9.619 735 HB3 GLU 97 2HB GLU 97 -8.881 9.181 9.582 736 HG2 GLU 97 1HG GLU 97 -11.062 9.138 8.252 737 HG3 GLU 97 2HG GLU 97 -11.205 7.466 8.792 738 H VAL 98 H VAL 98 -6.942 7.070 6.196 739 HA VAL 98 HA VAL 98 -4.698 6.595 6.318 740 HB VAL 98 HB VAL 98 -4.478 9.528 6.986 741 HG11 VAL 98 1HG1 VAL 98 -2.322 9.402 6.354 742 HG12 VAL 98 2HG1 VAL 98 -2.511 7.688 6.725 743 HG13 VAL 98 3HG1 VAL 98 -2.660 8.252 5.060 744 HG21 VAL 98 1HG2 VAL 98 -4.489 9.876 4.514 745 HG22 VAL 98 2HG2 VAL 98 -5.023 8.205 4.332 746 HG23 VAL 98 3HG2 VAL 98 -6.042 9.369 5.179 747 H ASN 99 H ASN 99 -5.662 5.688 8.602 748 HA ASN 99 HA ASN 99 -4.524 6.907 10.926 749 HB2 ASN 99 1HB ASN 99 -6.028 4.405 10.335 750 HB3 ASN 99 2HB ASN 99 -5.074 4.452 11.815 751 HD21 ASN 99 1HD2 ASN 99 -7.211 6.662 10.035 752 HD22 ASN 99 2HD2 ASN 99 -8.146 7.133 11.410 753 HA PRO 100 HA PRO 100 -0.433 5.274 10.171 754 HB2 PRO 100 1HB PRO 100 0.703 6.410 12.359 755 HB3 PRO 100 2HB PRO 100 0.352 7.313 10.881 756 HG2 PRO 100 1HG PRO 100 -1.210 7.173 13.431 757 HG3 PRO 100 2HG PRO 100 -0.836 8.584 12.424 758 HD2 PRO 100 1HD PRO 100 -3.235 7.331 12.343 759 HD3 PRO 100 2HD PRO 100 -2.517 8.114 10.919 760 H LYS 101 H LYS 101 -2.658 4.468 12.533 761 HA LYS 101 HA LYS 101 -0.919 2.868 14.191 762 HB2 LYS 101 1HB LYS 101 -3.926 3.123 14.041 763 HB3 LYS 101 2HB LYS 101 -3.094 2.079 15.187 764 HG2 LYS 101 1HG LYS 101 -3.477 3.963 16.445 765 HG3 LYS 101 2HG LYS 101 -1.838 4.250 15.858 766 HD2 LYS 101 1HD LYS 101 -2.577 5.796 14.241 767 HD3 LYS 101 2HD LYS 101 -4.259 5.285 14.407 768 HE2 LYS 101 1HE LYS 101 -4.284 7.241 15.608 769 HE3 LYS 101 2HE LYS 101 -3.928 6.078 16.884 770 HZ1 LYS 101 1HZ LYS 101 -2.475 7.989 17.031 771 HZ2 LYS 101 2HZ LYS 101 -1.935 7.745 15.446 772 HZ3 LYS 101 3HZ LYS 101 -1.575 6.609 16.647 773 H MET 102 H MET 102 -3.135 2.358 11.510 774 HA MET 102 HA MET 102 -2.723 -0.527 11.622 775 HB2 MET 102 1HB MET 102 -4.269 -0.356 9.518 776 HB3 MET 102 2HB MET 102 -4.946 -0.135 11.126 777 HG2 MET 102 1HG MET 102 -5.316 2.088 10.822 778 HG3 MET 102 2HG MET 102 -3.974 2.271 9.696 779 HE1 MET 102 1HE MET 102 -3.810 1.369 7.587 780 HE2 MET 102 2HE MET 102 -5.052 0.560 6.631 781 HE3 MET 102 3HE MET 102 -4.917 2.320 6.597 782 H VAL 103 H VAL 103 -2.079 2.224 9.491 783 HA VAL 103 HA VAL 103 -1.039 0.969 7.281 784 HB VAL 103 HB VAL 103 -0.123 3.526 8.593 785 HG11 VAL 103 1HG1 VAL 103 0.696 2.259 6.000 786 HG12 VAL 103 2HG1 VAL 103 0.776 4.005 6.244 787 HG13 VAL 103 3HG1 VAL 103 1.715 2.925 7.275 788 HG21 VAL 103 1HG2 VAL 103 -2.328 2.772 6.851 789 HG22 VAL 103 2HG2 VAL 103 -2.098 4.229 7.817 790 HG23 VAL 103 3HG2 VAL 103 -1.378 4.114 6.211 791 H MET 104 H MET 104 0.237 1.017 10.460 792 HA MET 104 HA MET 104 2.959 0.792 10.112 793 HB2 MET 104 1HB MET 104 2.994 -0.490 12.195 794 HB3 MET 104 2HB MET 104 1.888 0.871 12.311 795 HG2 MET 104 1HG MET 104 -0.004 -0.601 11.969 796 HG3 MET 104 2HG MET 104 1.080 -1.975 11.763 797 HE1 MET 104 1HE MET 104 -0.898 -2.702 13.363 798 HE2 MET 104 2HE MET 104 0.446 -3.648 14.002 799 HE3 MET 104 3HE MET 104 -0.629 -2.786 15.104 800 H THR 105 H THR 105 0.498 -1.732 9.796 801 HA THR 105 HA THR 105 2.533 -3.651 8.949 802 HB THR 105 HB THR 105 0.399 -5.161 8.788 803 HG1 THR 105 1HG THR 105 -1.362 -4.158 9.373 804 HG21 THR 105 1HG2 THR 105 0.828 -5.944 10.933 805 HG22 THR 105 2HG2 THR 105 1.122 -4.327 11.574 806 HG23 THR 105 3HG2 THR 105 2.321 -5.096 10.534 807 H VAL 106 H VAL 106 -0.410 -2.089 7.740 808 HA VAL 106 HA VAL 106 -0.883 -3.246 5.365 809 HB VAL 106 HB VAL 106 -0.668 -0.256 5.745 810 HG11 VAL 106 1HG1 VAL 106 -1.284 -1.822 3.448 811 HG12 VAL 106 2HG1 VAL 106 -2.747 -0.984 3.971 812 HG13 VAL 106 3HG1 VAL 106 -1.282 -0.067 3.622 813 HG21 VAL 106 1HG2 VAL 106 -2.227 -1.937 7.188 814 HG22 VAL 106 2HG2 VAL 106 -2.647 -0.264 6.820 815 HG23 VAL 106 3HG2 VAL 106 -3.294 -1.574 5.832 816 H PHE 107 H PHE 107 1.597 -0.723 5.811 817 HA PHE 107 HA PHE 107 2.680 -1.210 3.178 818 HB2 PHE 107 1HB PHE 107 3.179 0.737 5.374 819 HB3 PHE 107 2HB PHE 107 4.499 0.427 4.250 820 HD1 PHE 107 2HD PHE 107 3.118 0.077 1.712 821 HD2 PHE 107 1HD PHE 107 2.372 2.837 4.866 822 HE1 PHE 107 2HE PHE 107 2.113 1.641 0.101 823 HE2 PHE 107 1HE PHE 107 1.365 4.406 3.260 824 HZ PHE 107 HZ PHE 107 1.236 3.810 0.873 825 H ALA 108 H ALA 108 3.955 -1.432 6.500 826 HA ALA 108 HA ALA 108 6.418 -2.448 6.147 827 HB1 ALA 108 1HB ALA 108 5.960 -3.905 8.194 828 HB2 ALA 108 2HB ALA 108 5.705 -2.167 8.358 829 HB3 ALA 108 3HB ALA 108 4.325 -3.245 8.145 830 H CYS 109 H CYS 109 3.546 -4.563 6.356 831 HA CYS 109 HA CYS 109 4.732 -6.963 5.752 832 HB2 CYS 109 1HB CYS 109 2.550 -7.740 5.027 833 HB3 CYS 109 2HB CYS 109 2.360 -6.679 6.417 834 HG CYS 109 HG CYS 109 0.692 -6.538 3.738 835 H LEU 110 H LEU 110 3.631 -4.461 3.514 836 HA LEU 110 HA LEU 110 4.207 -5.978 1.161 837 HB2 LEU 110 1HB LEU 110 3.646 -3.068 1.661 838 HB3 LEU 110 2HB LEU 110 4.012 -3.695 0.055 839 HG LEU 110 HG LEU 110 1.652 -4.468 1.770 840 HD11 LEU 110 1HD1 LEU 110 1.810 -2.157 0.564 841 HD12 LEU 110 2HD1 LEU 110 0.334 -3.117 0.462 842 HD13 LEU 110 3HD1 LEU 110 1.478 -3.114 -0.881 843 HD21 LEU 110 1HD2 LEU 110 2.867 -5.667 -0.610 844 HD22 LEU 110 2HD2 LEU 110 1.139 -5.348 -0.758 845 HD23 LEU 110 3HD2 LEU 110 1.741 -6.354 0.561 846 H MET 111 H MET 111 5.691 -2.931 2.279 847 HA MET 111 HA MET 111 7.923 -2.959 0.688 848 HB2 MET 111 1HB MET 111 8.959 -1.470 2.272 849 HB3 MET 111 2HB MET 111 7.241 -1.102 2.200 850 HG2 MET 111 1HG MET 111 7.745 -1.024 4.464 851 HG3 MET 111 2HG MET 111 7.013 -2.612 4.243 852 HE1 MET 111 1HE MET 111 10.772 -1.557 3.269 853 HE2 MET 111 2HE MET 111 10.249 -0.576 4.637 854 HE3 MET 111 3HE MET 111 11.505 -1.796 4.855 855 H GLY 112 H GLY 112 7.180 -5.075 3.273 856 HA2 GLY 112 1HA GLY 112 9.578 -5.825 4.353 857 HA3 GLY 112 2HA GLY 112 8.281 -6.960 4.011 858 H LYS 113 H LYS 113 8.595 -6.203 1.072 859 HA LYS 113 HA LYS 113 10.246 -8.372 0.343 860 HB2 LYS 113 1HB LYS 113 8.332 -7.342 -0.989 861 HB3 LYS 113 2HB LYS 113 9.472 -6.091 -1.471 862 HG2 LYS 113 1HG LYS 113 10.087 -8.990 -1.898 863 HG3 LYS 113 2HG LYS 113 9.097 -8.080 -3.043 864 HD2 LYS 113 1HD LYS 113 11.088 -6.367 -2.897 865 HD3 LYS 113 2HD LYS 113 11.989 -7.792 -2.375 866 HE2 LYS 113 1HE LYS 113 11.333 -8.965 -4.408 867 HE3 LYS 113 2HE LYS 113 10.386 -7.569 -4.922 868 HZ1 LYS 113 1HZ LYS 113 12.555 -7.653 -6.003 869 HZ2 LYS 113 2HZ LYS 113 13.327 -7.584 -4.500 870 HZ3 LYS 113 3HZ LYS 113 12.407 -6.270 -5.040 871 H GLY 114 H GLY 114 10.797 -4.881 0.447 872 HA2 GLY 114 1HA GLY 114 13.073 -4.437 -0.879 873 HA3 GLY 114 2HA GLY 114 12.831 -3.791 0.738 874 H MET 115 H MET 115 14.724 -5.797 -1.196 875 HA MET 115 HA MET 115 15.651 -7.708 0.631 876 HB2 MET 115 1HB MET 115 16.169 -8.003 -1.672 877 HB3 MET 115 2HB MET 115 16.941 -6.426 -1.773 878 HG2 MET 115 1HG MET 115 18.829 -7.145 -0.597 879 HG3 MET 115 2HG MET 115 18.012 -8.587 0.002 880 HE1 MET 115 1HE MET 115 16.919 -9.734 -3.462 881 HE2 MET 115 2HE MET 115 17.793 -11.005 -2.609 882 HE3 MET 115 3HE MET 115 16.704 -9.936 -1.723 883 H LYS 116 H LYS 116 15.865 -6.595 2.630 884 HA LYS 116 HA LYS 116 18.374 -5.067 2.836 885 HB2 LYS 116 1HB LYS 116 15.690 -4.493 4.047 886 HB3 LYS 116 2HB LYS 116 17.155 -3.961 4.861 887 HG2 LYS 116 1HG LYS 116 16.654 -3.292 1.986 888 HG3 LYS 116 2HG LYS 116 15.964 -2.324 3.291 889 HD2 LYS 116 1HD LYS 116 18.107 -1.742 4.116 890 HD3 LYS 116 2HD LYS 116 18.901 -2.957 3.112 891 HE2 LYS 116 1HE LYS 116 17.394 -0.585 2.023 892 HE3 LYS 116 2HE LYS 116 19.136 -0.607 2.290 893 HZ1 LYS 116 1HZ LYS 116 19.369 -2.368 0.709 894 HZ2 LYS 116 2HZ LYS 116 18.482 -1.123 -0.018 895 HZ3 LYS 116 3HZ LYS 116 17.692 -2.514 0.532 896 H ARG 117 H ARG 117 19.602 -5.389 4.713 897 HA ARG 117 HA ARG 117 18.716 -7.535 6.510 898 HB2 ARG 117 1HB ARG 117 21.396 -7.387 5.118 899 HB3 ARG 117 2HB ARG 117 21.019 -8.493 6.432 900 HG2 ARG 117 1HG ARG 117 19.136 -9.357 4.966 901 HG3 ARG 117 2HG ARG 117 19.892 -8.453 3.653 902 HD2 ARG 117 1HD ARG 117 21.424 -10.420 5.327 903 HD3 ARG 117 2HD ARG 117 20.517 -10.916 3.899 904 HE ARG 117 HE ARG 117 22.281 -8.748 3.340 905 HH11 ARG 117 1HH1 ARG 117 22.139 -12.198 3.790 906 HH12 ARG 117 2HH1 ARG 117 23.536 -12.514 2.815 907 HH21 ARG 117 1HH2 ARG 117 24.123 -9.152 2.054 908 HH22 ARG 117 2HH2 ARG 117 24.664 -10.781 1.829 909 H VAL 118 H VAL 118 20.044 -7.659 8.503 910 HA VAL 118 HA VAL 118 21.335 -5.113 9.199 911 HB VAL 118 HB VAL 118 19.268 -6.501 10.911 912 HG11 VAL 118 1HG1 VAL 118 20.180 -5.452 12.640 913 HG12 VAL 118 2HG1 VAL 118 21.408 -4.741 11.591 914 HG13 VAL 118 3HG1 VAL 118 19.873 -3.907 11.847 915 HG21 VAL 118 1HG2 VAL 118 18.344 -5.256 8.977 916 HG22 VAL 118 2HG2 VAL 118 17.876 -4.570 10.533 917 HG23 VAL 118 3HG2 VAL 118 19.141 -3.800 9.574 918 H SER 119 H SER 119 23.364 -5.693 9.632 919 HA SER 119 HA SER 119 24.317 -8.182 10.325 920 HB2 SER 119 1HB SER 119 25.584 -5.996 9.679 921 HB3 SER 119 2HB SER 119 25.633 -5.712 11.419 922 HG SER 119 HG SER 119 27.146 -7.151 11.570 923 H GLY 120 H GLY 120 24.919 -9.185 12.260 924 HA2 GLY 120 1HA GLY 120 24.161 -7.951 14.784 925 HA3 GLY 120 2HA GLY 120 23.234 -9.369 14.320 926 HA PRO 121 HA PRO 121 27.549 -10.340 16.243 927 HB2 PRO 121 1HB PRO 121 26.979 -10.327 18.898 928 HB3 PRO 121 2HB PRO 121 27.593 -8.909 18.041 929 HG2 PRO 121 1HG PRO 121 24.782 -9.583 18.815 930 HG3 PRO 121 2HG PRO 121 25.630 -8.029 18.922 931 HD2 PRO 121 1HD PRO 121 23.897 -8.608 16.923 932 HD3 PRO 121 2HD PRO 121 25.308 -7.556 16.690 933 H SER 122 H SER 122 24.451 -11.456 16.062 934 HA SER 122 HA SER 122 24.083 -13.566 17.711 935 HB2 SER 122 1HB SER 122 22.928 -14.719 15.839 936 HB3 SER 122 2HB SER 122 22.492 -13.013 15.951 937 HG SER 122 HG SER 122 23.825 -14.369 13.963 938 H SER 123 H SER 123 25.983 -13.714 14.700 939 HA SER 123 HA SER 123 27.249 -16.170 15.717 940 HB2 SER 123 1HB SER 123 27.083 -15.171 12.863 941 HB3 SER 123 2HB SER 123 27.790 -16.698 13.389 942 HG SER 123 HG SER 123 25.073 -15.913 13.633 943 H GLY 124 H GLY 124 29.129 -15.740 16.675 944 HA2 GLY 124 1HA GLY 124 31.418 -15.219 16.612 945 HA3 GLY 124 2HA GLY 124 31.129 -14.214 15.199 Start of MODEL 11 1 H1 GLY 1 H GLY 1 21.497 6.227 5.400 2 HA2 GLY 1 1HA GLY 1 19.365 8.049 5.180 3 HA3 GLY 1 2HA GLY 1 18.808 6.472 4.640 4 H SER 2 H SER 2 17.434 5.987 6.285 5 HA SER 2 HA SER 2 16.782 5.186 8.314 6 HB2 SER 2 1HB SER 2 19.741 5.058 8.942 7 HB3 SER 2 2HB SER 2 18.451 4.219 9.804 8 HG SER 2 HG SER 2 19.527 2.887 8.256 9 H SER 3 H SER 3 16.881 7.966 7.899 10 HA SER 3 HA SER 3 18.125 9.519 9.797 11 HB2 SER 3 1HB SER 3 15.540 9.762 8.317 12 HB3 SER 3 2HB SER 3 15.877 10.904 9.618 13 HG SER 3 HG SER 3 17.880 11.354 8.521 14 H GLY 4 H GLY 4 18.275 8.785 11.860 15 HA2 GLY 4 1HA GLY 4 17.640 8.296 14.010 16 HA3 GLY 4 2HA GLY 4 16.208 9.257 13.671 17 H SER 5 H SER 5 17.128 6.282 12.023 18 HA SER 5 HA SER 5 14.732 5.007 13.174 19 HB2 SER 5 1HB SER 5 15.919 4.861 10.409 20 HB3 SER 5 2HB SER 5 14.839 3.601 11.009 21 HG SER 5 HG SER 5 13.482 5.013 10.088 22 H SER 6 H SER 6 14.819 2.716 13.518 23 HA SER 6 HA SER 6 17.444 1.860 14.420 24 HB2 SER 6 1HB SER 6 14.734 0.539 14.707 25 HB3 SER 6 2HB SER 6 16.223 -0.008 15.477 26 HG SER 6 HG SER 6 16.285 1.951 16.616 27 H GLY 7 H GLY 7 14.903 0.721 12.213 28 HA2 GLY 7 1HA GLY 7 16.970 -0.850 10.815 29 HA3 GLY 7 2HA GLY 7 15.422 -1.579 11.215 30 H ASN 8 H ASN 8 14.363 -1.843 9.358 31 HA ASN 8 HA ASN 8 14.536 0.198 7.282 32 HB2 ASN 8 1HB ASN 8 13.468 -2.616 7.357 33 HB3 ASN 8 2HB ASN 8 13.104 -1.536 6.014 34 HD21 ASN 8 1HD2 ASN 8 14.227 -2.627 4.475 35 HD22 ASN 8 2HD2 ASN 8 15.948 -2.782 4.474 36 H ASP 9 H ASP 9 13.305 1.479 9.120 37 HA ASP 9 HA ASP 9 10.419 1.051 8.933 38 HB2 ASP 9 1HB ASP 9 12.122 2.819 10.689 39 HB3 ASP 9 2HB ASP 9 10.365 2.935 10.646 40 H ASP 10 H ASP 10 12.909 3.390 8.095 41 HA ASP 10 HA ASP 10 11.027 5.322 7.083 42 HB2 ASP 10 1HB ASP 10 13.275 5.905 8.063 43 HB3 ASP 10 2HB ASP 10 14.010 5.227 6.613 44 H ILE 11 H ILE 11 13.214 2.906 5.722 45 HA ILE 11 HA ILE 11 12.986 3.535 3.027 46 HB ILE 11 HB ILE 11 14.543 1.836 3.966 47 HG12 ILE 11 1HG1 ILE 11 12.886 0.544 1.815 48 HG13 ILE 11 2HG1 ILE 11 13.775 2.029 1.495 49 HG21 ILE 11 1HG2 ILE 11 12.081 0.635 4.796 50 HG22 ILE 11 2HG2 ILE 11 12.981 -0.493 3.782 51 HG23 ILE 11 3HG2 ILE 11 13.735 0.194 5.221 52 HD11 ILE 11 1HD1 ILE 11 15.855 0.952 1.984 53 HD12 ILE 11 2HD1 ILE 11 15.024 -0.510 2.515 54 HD13 ILE 11 3HD1 ILE 11 14.967 -0.029 0.819 55 H ILE 12 H ILE 12 10.630 2.275 5.165 56 HA ILE 12 HA ILE 12 8.993 0.720 3.616 57 HB ILE 12 HB ILE 12 8.059 2.857 5.534 58 HG12 ILE 12 1HG1 ILE 12 8.717 -0.055 6.034 59 HG13 ILE 12 2HG1 ILE 12 9.713 1.311 6.527 60 HG21 ILE 12 1HG2 ILE 12 5.999 2.196 5.049 61 HG22 ILE 12 2HG2 ILE 12 6.628 1.036 3.880 62 HG23 ILE 12 3HG2 ILE 12 6.410 0.560 5.564 63 HD11 ILE 12 1HD1 ILE 12 8.554 1.535 8.392 64 HD12 ILE 12 2HD1 ILE 12 7.040 1.653 7.493 65 HD13 ILE 12 3HD1 ILE 12 7.664 0.074 7.966 66 H VAL 13 H VAL 13 9.269 4.236 3.605 67 HA VAL 13 HA VAL 13 7.137 4.566 1.688 68 HB VAL 13 HB VAL 13 9.165 6.552 2.723 69 HG11 VAL 13 1HG1 VAL 13 7.017 7.990 1.836 70 HG12 VAL 13 2HG1 VAL 13 8.525 7.760 0.948 71 HG13 VAL 13 3HG1 VAL 13 7.140 6.719 0.621 72 HG21 VAL 13 1HG2 VAL 13 6.940 5.399 3.976 73 HG22 VAL 13 2HG2 VAL 13 7.870 6.797 4.514 74 HG23 VAL 13 3HG2 VAL 13 6.442 7.025 3.505 75 H ASN 14 H ASN 14 10.667 5.062 1.661 76 HA ASN 14 HA ASN 14 11.023 5.820 -0.952 77 HB2 ASN 14 1HB ASN 14 12.966 5.873 0.319 78 HB3 ASN 14 2HB ASN 14 12.718 4.250 0.955 79 HD21 ASN 14 1HD2 ASN 14 13.566 6.060 -1.941 80 HD22 ASN 14 2HD2 ASN 14 14.519 4.812 -2.662 81 H TRP 15 H TRP 15 10.582 2.560 0.321 82 HA TRP 15 HA TRP 15 11.136 1.138 -2.034 83 HB2 TRP 15 1HB TRP 15 10.812 0.242 0.352 84 HB3 TRP 15 2HB TRP 15 9.087 0.274 -0.001 85 HD1 TRP 15 HD TRP 15 12.327 -1.408 -1.274 86 HE1 TRP 15 1HE TRP 15 11.689 -3.657 -2.351 87 HE3 TRP 15 3HE TRP 15 7.237 -1.044 -0.961 88 HZ2 TRP 15 2HZ TRP 15 9.340 -5.086 -2.986 89 HZ3 TRP 15 3HZ TRP 15 5.866 -2.895 -1.828 90 HH2 TRP 15 HH TRP 15 6.898 -4.874 -2.819 91 H VAL 16 H VAL 16 7.989 2.152 -0.695 92 HA VAL 16 HA VAL 16 6.329 1.238 -2.690 93 HB VAL 16 HB VAL 16 6.030 3.849 -1.201 94 HG11 VAL 16 1HG1 VAL 16 4.504 2.803 -3.288 95 HG12 VAL 16 2HG1 VAL 16 3.589 2.446 -1.823 96 HG13 VAL 16 3HG1 VAL 16 4.055 4.108 -2.190 97 HG21 VAL 16 1HG2 VAL 16 5.764 1.048 -0.386 98 HG22 VAL 16 2HG2 VAL 16 5.980 2.500 0.592 99 HG23 VAL 16 3HG2 VAL 16 4.374 2.058 0.013 100 H ASN 17 H ASN 17 7.715 4.522 -2.499 101 HA ASN 17 HA ASN 17 6.822 5.611 -4.816 102 HB2 ASN 17 1HB ASN 17 9.356 5.898 -3.284 103 HB3 ASN 17 2HB ASN 17 9.305 6.606 -4.895 104 HD21 ASN 17 1HD2 ASN 17 7.947 6.667 -1.689 105 HD22 ASN 17 2HD2 ASN 17 7.191 8.215 -1.824 106 H GLU 18 H GLU 18 9.816 3.691 -4.546 107 HA GLU 18 HA GLU 18 10.428 3.659 -7.275 108 HB2 GLU 18 1HB GLU 18 11.182 1.976 -4.930 109 HB3 GLU 18 2HB GLU 18 11.569 1.381 -6.539 110 HG2 GLU 18 1HG GLU 18 12.667 3.648 -6.928 111 HG3 GLU 18 2HG GLU 18 12.546 3.869 -5.184 112 H THR 19 H THR 19 8.795 1.168 -5.315 113 HA THR 19 HA THR 19 8.265 -0.706 -7.237 114 HB THR 19 HB THR 19 6.457 0.165 -4.976 115 HG1 THR 19 1HG THR 19 8.647 -0.729 -4.556 116 HG21 THR 19 1HG2 THR 19 4.997 -1.048 -6.309 117 HG22 THR 19 2HG2 THR 19 5.676 -2.303 -5.272 118 HG23 THR 19 3HG2 THR 19 6.270 -2.102 -6.920 119 H LEU 20 H LEU 20 6.621 2.352 -6.705 120 HA LEU 20 HA LEU 20 4.555 1.781 -8.642 121 HB2 LEU 20 1HB LEU 20 5.294 4.273 -7.123 122 HB3 LEU 20 2HB LEU 20 3.948 4.183 -8.257 123 HG LEU 20 HG LEU 20 4.086 2.312 -5.924 124 HD11 LEU 20 1HD1 LEU 20 2.570 4.045 -4.793 125 HD12 LEU 20 2HD1 LEU 20 3.298 5.203 -5.905 126 HD13 LEU 20 3HD1 LEU 20 4.312 4.319 -4.764 127 HD21 LEU 20 1HD2 LEU 20 2.410 1.762 -7.494 128 HD22 LEU 20 2HD2 LEU 20 1.916 3.445 -7.672 129 HD23 LEU 20 3HD2 LEU 20 1.584 2.583 -6.170 130 H ARG 21 H ARG 21 7.487 3.748 -8.465 131 HA ARG 21 HA ARG 21 7.227 5.068 -10.921 132 HB2 ARG 21 1HB ARG 21 8.868 5.672 -9.162 133 HB3 ARG 21 2HB ARG 21 9.781 4.217 -9.543 134 HG2 ARG 21 1HG ARG 21 10.471 5.040 -11.605 135 HG3 ARG 21 2HG ARG 21 9.199 6.263 -11.648 136 HD2 ARG 21 1HD ARG 21 11.305 6.314 -9.519 137 HD3 ARG 21 2HD ARG 21 11.625 6.987 -11.117 138 HE ARG 21 HE ARG 21 9.197 7.961 -9.941 139 HH11 ARG 21 1HH1 ARG 21 12.648 8.380 -10.115 140 HH12 ARG 21 2HH1 ARG 21 12.599 10.053 -9.668 141 HH21 ARG 21 1HH2 ARG 21 9.118 10.163 -9.351 142 HH22 ARG 21 2HH2 ARG 21 10.591 11.066 -9.232 143 H GLU 22 H GLU 22 9.022 2.091 -10.131 144 HA GLU 22 HA GLU 22 9.948 1.505 -12.683 145 HB2 GLU 22 1HB GLU 22 10.262 -0.758 -11.917 146 HB3 GLU 22 2HB GLU 22 10.643 0.341 -10.598 147 HG2 GLU 22 1HG GLU 22 8.605 -0.143 -9.489 148 HG3 GLU 22 2HG GLU 22 7.978 -1.012 -10.888 149 H ALA 23 H ALA 23 6.803 0.959 -11.243 150 HA ALA 23 HA ALA 23 5.879 -0.629 -13.487 151 HB1 ALA 23 1HB ALA 23 4.917 -1.385 -11.529 152 HB2 ALA 23 2HB ALA 23 4.685 0.243 -10.891 153 HB3 ALA 23 3HB ALA 23 3.645 -0.353 -12.185 154 H GLU 24 H GLU 24 6.187 2.644 -12.760 155 HA GLU 24 HA GLU 24 5.591 4.513 -13.927 156 HB2 GLU 24 1HB GLU 24 4.016 2.758 -15.804 157 HB3 GLU 24 2HB GLU 24 4.694 4.347 -16.122 158 HG2 GLU 24 1HG GLU 24 6.553 2.149 -15.402 159 HG3 GLU 24 2HG GLU 24 5.832 2.146 -17.010 160 H LYS 25 H LYS 25 4.185 3.893 -11.690 161 HA LYS 25 HA LYS 25 1.344 4.115 -12.281 162 HB2 LYS 25 1HB LYS 25 2.983 3.518 -9.878 163 HB3 LYS 25 2HB LYS 25 1.436 4.308 -9.603 164 HG2 LYS 25 1HG LYS 25 1.327 1.847 -9.451 165 HG3 LYS 25 2HG LYS 25 0.262 2.519 -10.689 166 HD2 LYS 25 1HD LYS 25 2.067 2.024 -12.366 167 HD3 LYS 25 2HD LYS 25 2.920 1.155 -11.089 168 HE2 LYS 25 1HE LYS 25 1.660 -0.413 -12.416 169 HE3 LYS 25 2HE LYS 25 0.941 -0.300 -10.810 170 HZ1 LYS 25 1HZ LYS 25 -0.329 0.044 -13.237 171 HZ2 LYS 25 2HZ LYS 25 -0.237 1.591 -12.559 172 HZ3 LYS 25 3HZ LYS 25 -0.972 0.333 -11.699 173 H SER 26 H SER 26 0.052 5.862 -11.707 174 HA SER 26 HA SER 26 1.455 8.408 -11.600 175 HB2 SER 26 1HB SER 26 -0.615 7.767 -13.092 176 HB3 SER 26 2HB SER 26 -1.532 8.182 -11.644 177 HG SER 26 HG SER 26 -0.850 10.242 -11.782 178 H SER 27 H SER 27 0.832 6.341 -9.309 179 HA SER 27 HA SER 27 -0.362 8.239 -7.414 180 HB2 SER 27 1HB SER 27 -1.145 5.751 -7.745 181 HB3 SER 27 2HB SER 27 0.238 5.387 -6.715 182 HG SER 27 HG SER 27 -1.236 5.756 -5.225 183 H SER 28 H SER 28 0.569 8.096 -5.144 184 HA SER 28 HA SER 28 3.224 7.287 -4.692 185 HB2 SER 28 1HB SER 28 4.324 9.515 -4.637 186 HB3 SER 28 2HB SER 28 3.833 9.044 -6.263 187 HG SER 28 HG SER 28 1.805 10.300 -5.583 188 H ILE 29 H ILE 29 4.123 8.309 -2.653 189 HA ILE 29 HA ILE 29 2.046 9.402 -0.907 190 HB ILE 29 HB ILE 29 2.869 7.801 0.911 191 HG12 ILE 29 1HG1 ILE 29 3.495 5.900 -1.302 192 HG13 ILE 29 2HG1 ILE 29 4.744 7.041 -0.814 193 HG21 ILE 29 1HG2 ILE 29 1.057 7.193 -1.356 194 HG22 ILE 29 2HG2 ILE 29 1.423 5.891 -0.227 195 HG23 ILE 29 3HG2 ILE 29 0.700 7.388 0.360 196 HD11 ILE 29 1HD1 ILE 29 4.562 4.658 0.267 197 HD12 ILE 29 2HD1 ILE 29 5.031 6.064 1.223 198 HD13 ILE 29 3HD1 ILE 29 3.375 5.461 1.294 199 H SER 30 H SER 30 2.794 10.988 0.345 200 HA SER 30 HA SER 30 5.581 11.693 0.228 201 HB2 SER 30 1HB SER 30 3.534 13.286 0.257 202 HB3 SER 30 2HB SER 30 3.559 13.040 2.004 203 HG SER 30 HG SER 30 5.232 14.301 2.131 204 H SER 31 H SER 31 3.351 10.450 2.658 205 HA SER 31 HA SER 31 5.382 9.183 4.142 206 HB2 SER 31 1HB SER 31 5.648 11.727 4.695 207 HB3 SER 31 2HB SER 31 4.227 11.469 5.707 208 HG SER 31 HG SER 31 6.285 11.154 6.781 209 H PHE 32 H PHE 32 4.523 8.335 6.269 210 HA PHE 32 HA PHE 32 2.261 6.856 5.948 211 HB2 PHE 32 1HB PHE 32 3.224 7.967 8.592 212 HB3 PHE 32 2HB PHE 32 2.227 6.534 8.365 213 HD1 PHE 32 2HD PHE 32 3.698 5.409 5.973 214 HD2 PHE 32 1HD PHE 32 5.071 6.995 9.676 215 HE1 PHE 32 2HE PHE 32 5.726 4.025 5.810 216 HE2 PHE 32 1HE PHE 32 7.101 5.613 9.518 217 HZ PHE 32 HZ PHE 32 7.430 4.125 7.585 218 H LYS 33 H LYS 33 2.465 10.204 6.801 219 HA LYS 33 HA LYS 33 -0.402 10.297 7.417 220 HB2 LYS 33 1HB LYS 33 1.848 12.249 7.874 221 HB3 LYS 33 2HB LYS 33 0.160 12.706 8.060 222 HG2 LYS 33 1HG LYS 33 -0.073 10.862 9.728 223 HG3 LYS 33 2HG LYS 33 1.675 10.632 9.627 224 HD2 LYS 33 1HD LYS 33 1.949 13.033 10.265 225 HD3 LYS 33 2HD LYS 33 0.206 13.105 10.537 226 HE2 LYS 33 1HE LYS 33 0.304 11.717 12.381 227 HE3 LYS 33 2HE LYS 33 1.828 10.986 11.878 228 HZ1 LYS 33 1HZ LYS 33 2.924 13.112 12.377 229 HZ2 LYS 33 2HZ LYS 33 2.201 12.427 13.742 230 HZ3 LYS 33 3HZ LYS 33 1.459 13.728 12.955 231 H ASP 34 H ASP 34 0.305 9.803 4.756 232 HA ASP 34 HA ASP 34 0.099 12.317 3.317 233 HB2 ASP 34 1HB ASP 34 1.530 10.779 2.250 234 HB3 ASP 34 2HB ASP 34 0.405 9.443 2.477 235 HA PRO 35 HA PRO 35 -4.299 12.296 3.056 236 HB2 PRO 35 1HB PRO 35 -4.584 13.919 0.899 237 HB3 PRO 35 2HB PRO 35 -4.119 14.517 2.496 238 HG2 PRO 35 1HG PRO 35 -2.395 13.914 0.124 239 HG3 PRO 35 2HG PRO 35 -2.327 15.295 1.235 240 HD2 PRO 35 1HD PRO 35 -0.643 13.184 1.430 241 HD3 PRO 35 2HD PRO 35 -1.190 14.103 2.847 242 H LYS 36 H LYS 36 -2.524 11.885 -0.005 243 HA LYS 36 HA LYS 36 -4.491 10.849 -1.604 244 HB2 LYS 36 1HB LYS 36 -1.637 9.856 -1.488 245 HB3 LYS 36 2HB LYS 36 -2.735 9.713 -2.855 246 HG2 LYS 36 1HG LYS 36 -1.841 12.347 -1.711 247 HG3 LYS 36 2HG LYS 36 -1.026 11.527 -3.046 248 HD2 LYS 36 1HD LYS 36 -3.345 11.495 -4.163 249 HD3 LYS 36 2HD LYS 36 -3.783 12.712 -2.962 250 HE2 LYS 36 1HE LYS 36 -1.402 12.960 -4.789 251 HE3 LYS 36 2HE LYS 36 -2.996 13.605 -5.180 252 HZ1 LYS 36 1HZ LYS 36 -1.479 15.252 -4.174 253 HZ2 LYS 36 2HZ LYS 36 -1.449 14.336 -2.754 254 HZ3 LYS 36 3HZ LYS 36 -2.898 15.032 -3.281 255 H ILE 37 H ILE 37 -2.582 9.147 0.834 256 HA ILE 37 HA ILE 37 -3.296 6.536 0.341 257 HB ILE 37 HB ILE 37 -2.968 7.853 3.039 258 HG12 ILE 37 1HG1 ILE 37 -1.007 6.376 1.270 259 HG13 ILE 37 2HG1 ILE 37 -1.005 8.104 1.603 260 HG21 ILE 37 1HG2 ILE 37 -3.795 5.213 2.357 261 HG22 ILE 37 2HG2 ILE 37 -2.188 5.137 3.079 262 HG23 ILE 37 3HG2 ILE 37 -3.512 5.907 3.954 263 HD11 ILE 37 1HD1 ILE 37 0.512 6.310 2.905 264 HD12 ILE 37 2HD1 ILE 37 -0.011 7.846 3.596 265 HD13 ILE 37 3HD1 ILE 37 -0.895 6.366 3.967 266 H SER 38 H SER 38 -5.212 9.093 1.744 267 HA SER 38 HA SER 38 -7.211 7.714 3.036 268 HB2 SER 38 1HB SER 38 -7.004 10.202 2.907 269 HB3 SER 38 2HB SER 38 -7.641 10.131 1.265 270 HG SER 38 HG SER 38 -9.581 9.460 2.040 271 H THR 39 H THR 39 -6.773 8.208 -0.419 272 HA THR 39 HA THR 39 -9.274 6.883 -1.057 273 HB THR 39 HB THR 39 -8.466 7.170 -3.445 274 HG1 THR 39 1HG THR 39 -6.190 7.428 -2.671 275 HG21 THR 39 1HG2 THR 39 -9.189 9.396 -3.552 276 HG22 THR 39 2HG2 THR 39 -8.508 9.788 -1.974 277 HG23 THR 39 3HG2 THR 39 -9.947 8.775 -2.087 278 H SER 40 H SER 40 -6.118 5.956 -0.361 279 HA SER 40 HA SER 40 -5.089 3.921 -0.366 280 HB2 SER 40 1HB SER 40 -7.528 2.733 -1.684 281 HB3 SER 40 2HB SER 40 -6.355 1.938 -0.634 282 HG SER 40 HG SER 40 -7.843 4.100 0.356 283 H LEU 41 H LEU 41 -5.041 5.805 -2.629 284 HA LEU 41 HA LEU 41 -4.995 4.362 -5.070 285 HB2 LEU 41 1HB LEU 41 -3.982 7.019 -4.160 286 HB3 LEU 41 2HB LEU 41 -3.475 6.387 -5.726 287 HG LEU 41 HG LEU 41 -6.355 6.791 -4.930 288 HD11 LEU 41 1HD1 LEU 41 -5.389 8.953 -4.947 289 HD12 LEU 41 2HD1 LEU 41 -6.207 8.753 -6.497 290 HD13 LEU 41 3HD1 LEU 41 -4.453 8.599 -6.400 291 HD21 LEU 41 1HD2 LEU 41 -5.551 5.147 -6.802 292 HD22 LEU 41 2HD2 LEU 41 -5.322 6.633 -7.724 293 HD23 LEU 41 3HD2 LEU 41 -6.916 6.227 -7.085 294 HA PRO 42 HA PRO 42 -0.201 4.284 -4.359 295 HB2 PRO 42 1HB PRO 42 0.659 4.784 -1.833 296 HB3 PRO 42 2HB PRO 42 0.460 6.052 -3.048 297 HG2 PRO 42 1HG PRO 42 -1.376 5.257 -0.822 298 HG3 PRO 42 2HG PRO 42 -0.918 6.881 -1.368 299 HD2 PRO 42 1HD PRO 42 -3.268 5.723 -2.052 300 HD3 PRO 42 2HD PRO 42 -2.410 6.847 -3.125 301 H VAL 43 H VAL 43 -2.407 3.216 -1.857 302 HA VAL 43 HA VAL 43 -0.784 0.980 -1.046 303 HB VAL 43 HB VAL 43 -3.727 1.305 -0.494 304 HG11 VAL 43 1HG1 VAL 43 -1.460 -0.109 0.895 305 HG12 VAL 43 2HG1 VAL 43 -3.041 0.151 1.634 306 HG13 VAL 43 3HG1 VAL 43 -2.901 -0.820 0.169 307 HG21 VAL 43 1HG2 VAL 43 -1.752 3.176 0.158 308 HG22 VAL 43 2HG2 VAL 43 -3.386 3.072 0.814 309 HG23 VAL 43 3HG2 VAL 43 -2.051 2.266 1.639 310 H LEU 44 H LEU 44 -3.459 1.541 -3.246 311 HA LEU 44 HA LEU 44 -3.887 -1.262 -3.761 312 HB2 LEU 44 1HB LEU 44 -4.950 1.265 -4.987 313 HB3 LEU 44 2HB LEU 44 -5.329 -0.326 -5.643 314 HG LEU 44 HG LEU 44 -5.913 0.347 -2.779 315 HD11 LEU 44 1HD1 LEU 44 -8.058 1.161 -3.336 316 HD12 LEU 44 2HD1 LEU 44 -7.862 0.731 -5.036 317 HD13 LEU 44 3HD1 LEU 44 -6.919 2.053 -4.347 318 HD21 LEU 44 1HD2 LEU 44 -7.554 -1.427 -4.510 319 HD22 LEU 44 2HD2 LEU 44 -7.204 -1.536 -2.785 320 HD23 LEU 44 3HD2 LEU 44 -5.981 -2.010 -3.965 321 H ASP 45 H ASP 45 -2.588 1.484 -5.616 322 HA ASP 45 HA ASP 45 -1.856 0.036 -7.899 323 HB2 ASP 45 1HB ASP 45 -1.045 2.654 -6.716 324 HB3 ASP 45 2HB ASP 45 -0.074 1.993 -8.029 325 H LEU 46 H LEU 46 -0.209 0.548 -4.847 326 HA LEU 46 HA LEU 46 2.348 -0.340 -5.597 327 HB2 LEU 46 1HB LEU 46 2.195 0.791 -3.556 328 HB3 LEU 46 2HB LEU 46 0.879 -0.234 -2.988 329 HG LEU 46 HG LEU 46 2.383 -2.048 -2.569 330 HD11 LEU 46 1HD1 LEU 46 4.923 -0.838 -3.048 331 HD12 LEU 46 2HD1 LEU 46 3.974 -0.805 -4.535 332 HD13 LEU 46 3HD1 LEU 46 4.261 -2.336 -3.706 333 HD21 LEU 46 1HD2 LEU 46 4.195 -0.550 -1.205 334 HD22 LEU 46 2HD2 LEU 46 2.567 -0.924 -0.636 335 HD23 LEU 46 3HD2 LEU 46 2.888 0.612 -1.443 336 H ILE 47 H ILE 47 -0.421 -2.091 -4.231 337 HA ILE 47 HA ILE 47 0.819 -4.604 -4.043 338 HB ILE 47 HB ILE 47 -2.103 -3.966 -4.463 339 HG12 ILE 47 1HG1 ILE 47 -0.771 -4.724 -1.873 340 HG13 ILE 47 2HG1 ILE 47 -0.838 -3.048 -2.407 341 HG21 ILE 47 1HG2 ILE 47 -2.594 -6.179 -3.717 342 HG22 ILE 47 2HG2 ILE 47 -1.426 -6.305 -5.032 343 HG23 ILE 47 3HG2 ILE 47 -0.896 -6.495 -3.362 344 HD11 ILE 47 1HD1 ILE 47 -3.101 -4.864 -1.666 345 HD12 ILE 47 2HD1 ILE 47 -2.658 -3.305 -0.971 346 HD13 ILE 47 3HD1 ILE 47 -3.352 -3.383 -2.590 347 H ASP 48 H ASP 48 -1.251 -3.243 -6.598 348 HA ASP 48 HA ASP 48 -1.243 -5.429 -8.319 349 HB2 ASP 48 1HB ASP 48 -2.759 -3.703 -8.831 350 HB3 ASP 48 2HB ASP 48 -1.503 -2.470 -8.796 351 H ALA 49 H ALA 49 1.020 -2.703 -8.132 352 HA ALA 49 HA ALA 49 2.617 -3.055 -10.284 353 HB1 ALA 49 1HB ALA 49 4.060 -2.746 -7.712 354 HB2 ALA 49 2HB ALA 49 4.189 -1.816 -9.206 355 HB3 ALA 49 3HB ALA 49 2.834 -1.542 -8.111 356 H ILE 50 H ILE 50 2.671 -5.017 -7.341 357 HA ILE 50 HA ILE 50 4.862 -6.643 -8.245 358 HB ILE 50 HB ILE 50 2.933 -7.239 -6.003 359 HG12 ILE 50 1HG1 ILE 50 5.613 -5.870 -5.759 360 HG13 ILE 50 2HG1 ILE 50 4.098 -4.980 -5.875 361 HG21 ILE 50 1HG2 ILE 50 5.793 -8.094 -6.122 362 HG22 ILE 50 2HG2 ILE 50 4.441 -8.817 -5.251 363 HG23 ILE 50 3HG2 ILE 50 4.563 -9.002 -7.000 364 HD11 ILE 50 1HD1 ILE 50 4.383 -7.085 -3.792 365 HD12 ILE 50 2HD1 ILE 50 5.156 -5.517 -3.556 366 HD13 ILE 50 3HD1 ILE 50 3.410 -5.614 -3.787 367 H GLN 51 H GLN 51 1.427 -7.351 -7.579 368 HA GLN 51 HA GLN 51 1.610 -9.573 -9.500 369 HB2 GLN 51 1HB GLN 51 1.026 -10.193 -7.167 370 HB3 GLN 51 2HB GLN 51 -0.404 -9.176 -7.281 371 HG2 GLN 51 1HG GLN 51 -1.241 -11.283 -7.695 372 HG3 GLN 51 2HG GLN 51 -1.005 -10.634 -9.317 373 HE21 GLN 51 1HE2 GLN 51 -0.279 -13.132 -7.164 374 HE22 GLN 51 2HE2 GLN 51 0.882 -13.967 -8.135 375 HA PRO 52 HA PRO 52 -0.947 -6.635 -11.834 376 HB2 PRO 52 1HB PRO 52 -0.433 -7.783 -14.239 377 HB3 PRO 52 2HB PRO 52 0.670 -6.641 -13.465 378 HG2 PRO 52 1HG PRO 52 0.781 -9.631 -13.531 379 HG3 PRO 52 2HG PRO 52 2.095 -8.458 -13.736 380 HD2 PRO 52 1HD PRO 52 1.662 -9.766 -11.406 381 HD3 PRO 52 2HD PRO 52 2.315 -8.116 -11.468 382 H GLY 53 H GLY 53 -3.082 -6.930 -11.835 383 HA2 GLY 53 1HA GLY 53 -4.867 -8.123 -13.127 384 HA3 GLY 53 2HA GLY 53 -4.119 -9.604 -12.549 385 H SER 54 H SER 54 -3.597 -8.418 -9.889 386 HA SER 54 HA SER 54 -5.900 -9.311 -8.571 387 HB2 SER 54 1HB SER 54 -4.878 -8.212 -6.546 388 HB3 SER 54 2HB SER 54 -3.800 -9.312 -7.405 389 HG SER 54 HG SER 54 -2.725 -7.584 -8.264 390 H ILE 55 H ILE 55 -4.670 -5.962 -8.689 391 HA ILE 55 HA ILE 55 -7.214 -4.906 -7.864 392 HB ILE 55 HB ILE 55 -4.831 -3.384 -8.919 393 HG12 ILE 55 1HG1 ILE 55 -4.198 -4.790 -7.002 394 HG13 ILE 55 2HG1 ILE 55 -4.182 -3.082 -6.575 395 HG21 ILE 55 1HG2 ILE 55 -7.304 -2.597 -7.410 396 HG22 ILE 55 2HG2 ILE 55 -5.855 -1.594 -7.420 397 HG23 ILE 55 3HG2 ILE 55 -6.688 -1.952 -8.932 398 HD11 ILE 55 1HD1 ILE 55 -5.289 -3.827 -4.769 399 HD12 ILE 55 2HD1 ILE 55 -6.684 -3.716 -5.844 400 HD13 ILE 55 3HD1 ILE 55 -5.885 -5.268 -5.592 401 H ASN 56 H ASN 56 -8.592 -3.568 -9.069 402 HA ASN 56 HA ASN 56 -8.153 -3.415 -11.954 403 HB2 ASN 56 1HB ASN 56 -9.551 -5.490 -11.247 404 HB3 ASN 56 2HB ASN 56 -10.834 -4.321 -10.946 405 HD21 ASN 56 1HD2 ASN 56 -12.175 -4.960 -12.561 406 HD22 ASN 56 2HD2 ASN 56 -11.800 -4.796 -14.240 407 H TYR 57 H TYR 57 -8.159 -1.269 -12.213 408 HA TYR 57 HA TYR 57 -9.368 0.645 -10.648 409 HB2 TYR 57 1HB TYR 57 -8.397 0.571 -13.459 410 HB3 TYR 57 2HB TYR 57 -9.410 1.932 -12.992 411 HD1 TYR 57 1HD TYR 57 -6.885 0.116 -10.949 412 HD2 TYR 57 2HD TYR 57 -7.921 3.734 -12.935 413 HE1 TYR 57 1HE TYR 57 -4.929 1.220 -9.946 414 HE2 TYR 57 2HE TYR 57 -5.966 4.846 -11.940 415 HH TYR 57 HH TYR 57 -3.972 4.462 -10.875 416 H ASP 58 H ASP 58 -10.709 -1.113 -13.398 417 HA ASP 58 HA ASP 58 -13.012 0.257 -13.920 418 HB2 ASP 58 1HB ASP 58 -12.064 -2.048 -14.818 419 HB3 ASP 58 2HB ASP 58 -13.225 -2.710 -13.670 420 H LEU 59 H LEU 59 -12.409 -1.950 -11.232 421 HA LEU 59 HA LEU 59 -15.104 -1.651 -10.217 422 HB2 LEU 59 1HB LEU 59 -12.777 -2.928 -8.810 423 HB3 LEU 59 2HB LEU 59 -14.496 -3.207 -8.540 424 HG LEU 59 HG LEU 59 -12.946 -4.043 -10.991 425 HD11 LEU 59 1HD1 LEU 59 -14.149 -6.126 -9.375 426 HD12 LEU 59 2HD1 LEU 59 -12.943 -5.201 -8.481 427 HD13 LEU 59 3HD1 LEU 59 -12.505 -5.985 -9.999 428 HD21 LEU 59 1HD2 LEU 59 -15.796 -3.868 -10.380 429 HD22 LEU 59 2HD2 LEU 59 -15.284 -5.465 -10.926 430 HD23 LEU 59 3HD2 LEU 59 -14.974 -4.048 -11.930 431 H LEU 60 H LEU 60 -11.872 -0.475 -9.490 432 HA LEU 60 HA LEU 60 -12.407 0.699 -6.999 433 HB2 LEU 60 1HB LEU 60 -10.452 1.636 -9.093 434 HB3 LEU 60 2HB LEU 60 -10.411 2.024 -7.375 435 HG LEU 60 HG LEU 60 -10.040 -0.743 -8.521 436 HD11 LEU 60 1HD1 LEU 60 -8.252 1.402 -8.565 437 HD12 LEU 60 2HD1 LEU 60 -7.888 -0.303 -8.829 438 HD13 LEU 60 3HD1 LEU 60 -7.741 0.390 -7.214 439 HD21 LEU 60 1HD2 LEU 60 -9.017 -0.963 -6.123 440 HD22 LEU 60 2HD2 LEU 60 -10.756 -1.117 -6.370 441 HD23 LEU 60 3HD2 LEU 60 -10.082 0.396 -5.765 442 H LYS 61 H LYS 61 -12.466 3.051 -6.544 443 HA LYS 61 HA LYS 61 -14.314 4.374 -8.405 444 HB2 LYS 61 1HB LYS 61 -13.898 4.499 -5.448 445 HB3 LYS 61 2HB LYS 61 -14.555 5.910 -6.266 446 HG2 LYS 61 1HG LYS 61 -16.469 4.808 -5.661 447 HG3 LYS 61 2HG LYS 61 -16.221 4.186 -7.294 448 HD2 LYS 61 1HD LYS 61 -14.866 2.321 -6.058 449 HD3 LYS 61 2HD LYS 61 -15.817 2.831 -4.662 450 HE2 LYS 61 1HE LYS 61 -16.962 1.019 -5.726 451 HE3 LYS 61 2HE LYS 61 -17.874 2.498 -6.026 452 HZ1 LYS 61 1HZ LYS 61 -17.217 2.552 -8.231 453 HZ2 LYS 61 2HZ LYS 61 -17.463 0.899 -7.965 454 HZ3 LYS 61 3HZ LYS 61 -15.892 1.527 -7.985 455 H THR 62 H THR 62 -11.700 5.295 -6.154 456 HA THR 62 HA THR 62 -10.276 7.094 -6.183 457 HB THR 62 HB THR 62 -9.120 5.543 -7.674 458 HG1 THR 62 1HG THR 62 -8.169 7.376 -9.078 459 HG21 THR 62 1HG2 THR 62 -9.330 5.934 -10.161 460 HG22 THR 62 2HG2 THR 62 -10.787 6.864 -9.809 461 HG23 THR 62 3HG2 THR 62 -10.711 5.151 -9.397 462 H GLU 63 H GLU 63 -13.107 7.669 -6.906 463 HA GLU 63 HA GLU 63 -12.609 10.260 -8.192 464 HB2 GLU 63 1HB GLU 63 -14.650 10.076 -9.503 465 HB3 GLU 63 2HB GLU 63 -13.562 8.750 -9.887 466 HG2 GLU 63 1HG GLU 63 -14.925 7.426 -8.147 467 HG3 GLU 63 2HG GLU 63 -16.126 8.699 -8.353 468 H ASN 64 H ASN 64 -13.171 11.805 -6.821 469 HA ASN 64 HA ASN 64 -14.033 12.726 -4.881 470 HB2 ASN 64 1HB ASN 64 -16.674 12.024 -6.143 471 HB3 ASN 64 2HB ASN 64 -16.233 13.480 -5.254 472 HD21 ASN 64 1HD2 ASN 64 -15.973 11.775 -8.278 473 HD22 ASN 64 2HD2 ASN 64 -15.457 13.127 -9.224 474 H LEU 65 H LEU 65 -13.341 10.173 -4.230 475 HA LEU 65 HA LEU 65 -15.320 8.472 -3.283 476 HB2 LEU 65 1HB LEU 65 -12.542 9.005 -2.255 477 HB3 LEU 65 2HB LEU 65 -13.567 7.705 -1.650 478 HG LEU 65 HG LEU 65 -12.999 7.836 -4.573 479 HD11 LEU 65 1HD1 LEU 65 -11.040 7.101 -2.432 480 HD12 LEU 65 2HD1 LEU 65 -10.793 8.068 -3.887 481 HD13 LEU 65 3HD1 LEU 65 -10.993 6.320 -4.014 482 HD21 LEU 65 1HD2 LEU 65 -14.385 6.073 -4.191 483 HD22 LEU 65 2HD2 LEU 65 -13.809 5.831 -2.543 484 HD23 LEU 65 3HD2 LEU 65 -12.840 5.270 -3.906 485 H ASN 66 H ASN 66 -15.722 7.996 -0.910 486 HA ASN 66 HA ASN 66 -15.686 10.293 0.851 487 HB2 ASN 66 1HB ASN 66 -18.003 10.592 1.083 488 HB3 ASN 66 2HB ASN 66 -17.777 10.429 -0.656 489 HD21 ASN 66 1HD2 ASN 66 -18.043 8.197 -1.518 490 HD22 ASN 66 2HD2 ASN 66 -19.306 7.230 -0.842 491 H ASP 67 H ASP 67 -17.050 9.638 2.926 492 HA ASP 67 HA ASP 67 -15.727 7.671 4.269 493 HB2 ASP 67 1HB ASP 67 -18.534 8.708 4.639 494 HB3 ASP 67 2HB ASP 67 -17.812 7.550 5.751 495 H ASP 68 H ASP 68 -18.371 7.291 2.042 496 HA ASP 68 HA ASP 68 -18.857 4.533 2.767 497 HB2 ASP 68 1HB ASP 68 -19.999 6.443 0.767 498 HB3 ASP 68 2HB ASP 68 -20.251 4.715 0.538 499 H GLU 69 H GLU 69 -17.982 6.057 -0.340 500 HA GLU 69 HA GLU 69 -17.074 3.729 -1.572 501 HB2 GLU 69 1HB GLU 69 -16.079 6.536 -2.085 502 HB3 GLU 69 2HB GLU 69 -15.999 5.176 -3.197 503 HG2 GLU 69 1HG GLU 69 -18.655 6.033 -2.172 504 HG3 GLU 69 2HG GLU 69 -17.864 7.000 -3.415 505 H LYS 70 H LYS 70 -15.146 6.290 -0.013 506 HA LYS 70 HA LYS 70 -12.621 5.373 -0.305 507 HB2 LYS 70 1HB LYS 70 -13.875 6.504 2.201 508 HB3 LYS 70 2HB LYS 70 -12.142 6.296 1.986 509 HG2 LYS 70 1HG LYS 70 -12.349 7.758 -0.064 510 HG3 LYS 70 2HG LYS 70 -13.987 8.126 0.480 511 HD2 LYS 70 1HD LYS 70 -13.252 9.281 2.340 512 HD3 LYS 70 2HD LYS 70 -11.701 8.440 2.377 513 HE2 LYS 70 1HE LYS 70 -10.882 9.694 0.534 514 HE3 LYS 70 2HE LYS 70 -12.481 10.349 0.184 515 HZ1 LYS 70 1HZ LYS 70 -12.153 11.191 2.678 516 HZ2 LYS 70 2HZ LYS 70 -11.672 12.093 1.331 517 HZ3 LYS 70 3HZ LYS 70 -10.536 11.173 2.181 518 H LEU 71 H LEU 71 -14.866 4.279 2.233 519 HA LEU 71 HA LEU 71 -13.230 2.468 3.523 520 HB2 LEU 71 1HB LEU 71 -15.375 3.016 4.415 521 HB3 LEU 71 2HB LEU 71 -16.191 2.375 2.990 522 HG LEU 71 HG LEU 71 -15.517 0.108 3.628 523 HD11 LEU 71 1HD1 LEU 71 -13.718 -0.101 4.920 524 HD12 LEU 71 2HD1 LEU 71 -14.767 0.308 6.277 525 HD13 LEU 71 3HD1 LEU 71 -13.826 1.568 5.479 526 HD21 LEU 71 1HD2 LEU 71 -17.224 1.850 5.252 527 HD22 LEU 71 2HD2 LEU 71 -16.725 0.360 6.055 528 HD23 LEU 71 3HD2 LEU 71 -17.571 0.288 4.509 529 H ASN 72 H ASN 72 -15.633 1.601 1.028 530 HA ASN 72 HA ASN 72 -15.048 -1.007 0.622 531 HB2 ASN 72 1HB ASN 72 -15.604 1.059 -1.518 532 HB3 ASN 72 2HB ASN 72 -15.699 -0.682 -1.763 533 HD21 ASN 72 1HD2 ASN 72 -17.085 2.045 -0.065 534 HD22 ASN 72 2HD2 ASN 72 -18.612 1.308 0.263 535 H ASN 73 H ASN 73 -13.232 1.737 -0.680 536 HA ASN 73 HA ASN 73 -11.431 0.239 -2.248 537 HB2 ASN 73 1HB ASN 73 -11.461 3.009 -1.122 538 HB3 ASN 73 2HB ASN 73 -9.956 2.385 -1.791 539 HD21 ASN 73 1HD2 ASN 73 -10.556 4.373 -3.149 540 HD22 ASN 73 2HD2 ASN 73 -11.426 4.043 -4.605 541 H ALA 74 H ALA 74 -11.235 1.444 1.082 542 HA ALA 74 HA ALA 74 -8.616 0.588 1.621 543 HB1 ALA 74 1HB ALA 74 -10.911 0.900 3.552 544 HB2 ALA 74 2HB ALA 74 -9.199 0.832 3.971 545 HB3 ALA 74 3HB ALA 74 -9.824 2.186 3.029 546 H LYS 75 H LYS 75 -11.737 -0.994 2.270 547 HA LYS 75 HA LYS 75 -10.682 -3.326 3.430 548 HB2 LYS 75 1HB LYS 75 -13.273 -2.932 1.922 549 HB3 LYS 75 2HB LYS 75 -12.888 -4.333 2.915 550 HG2 LYS 75 1HG LYS 75 -13.166 -3.201 4.870 551 HG3 LYS 75 2HG LYS 75 -12.698 -1.650 4.170 552 HD2 LYS 75 1HD LYS 75 -15.042 -1.577 4.670 553 HD3 LYS 75 2HD LYS 75 -14.852 -1.641 2.917 554 HE2 LYS 75 1HE LYS 75 -16.556 -3.171 3.338 555 HE3 LYS 75 2HE LYS 75 -15.120 -4.183 3.190 556 HZ1 LYS 75 1HZ LYS 75 -16.746 -3.599 5.536 557 HZ2 LYS 75 2HZ LYS 75 -15.080 -3.738 5.787 558 HZ3 LYS 75 3HZ LYS 75 -15.943 -5.023 5.104 559 H TYR 76 H TYR 76 -11.062 -2.341 0.117 560 HA TYR 76 HA TYR 76 -10.828 -4.918 -1.060 561 HB2 TYR 76 1HB TYR 76 -11.726 -2.809 -2.162 562 HB3 TYR 76 2HB TYR 76 -10.050 -2.303 -2.351 563 HD1 TYR 76 1HD TYR 76 -12.280 -5.204 -3.104 564 HD2 TYR 76 2HD TYR 76 -8.931 -2.866 -4.298 565 HE1 TYR 76 1HE TYR 76 -12.136 -6.489 -5.197 566 HE2 TYR 76 2HE TYR 76 -8.779 -4.144 -6.394 567 HH TYR 76 HH TYR 76 -11.193 -6.038 -7.573 568 H ALA 77 H ALA 77 -8.495 -2.293 -0.508 569 HA ALA 77 HA ALA 77 -6.257 -3.549 -1.621 570 HB1 ALA 77 1HB ALA 77 -5.974 -1.287 -1.225 571 HB2 ALA 77 2HB ALA 77 -6.608 -1.389 0.418 572 HB3 ALA 77 3HB ALA 77 -5.001 -2.019 0.051 573 H ILE 78 H ILE 78 -7.323 -3.434 1.777 574 HA ILE 78 HA ILE 78 -5.279 -5.038 2.823 575 HB ILE 78 HB ILE 78 -8.108 -4.747 3.840 576 HG12 ILE 78 1HG1 ILE 78 -5.584 -3.174 4.370 577 HG13 ILE 78 2HG1 ILE 78 -7.094 -2.578 3.691 578 HG21 ILE 78 1HG2 ILE 78 -6.161 -5.158 5.887 579 HG22 ILE 78 2HG2 ILE 78 -7.569 -6.137 5.482 580 HG23 ILE 78 3HG2 ILE 78 -6.024 -6.446 4.690 581 HD11 ILE 78 1HD1 ILE 78 -7.615 -3.734 6.242 582 HD12 ILE 78 2HD1 ILE 78 -6.280 -2.588 6.379 583 HD13 ILE 78 3HD1 ILE 78 -7.826 -2.066 5.709 584 H SER 79 H SER 79 -8.434 -5.876 1.476 585 HA SER 79 HA SER 79 -8.414 -8.604 2.157 586 HB2 SER 79 1HB SER 79 -10.448 -7.448 1.419 587 HB3 SER 79 2HB SER 79 -9.754 -7.233 -0.187 588 HG SER 79 HG SER 79 -10.613 -9.603 1.073 589 H MET 80 H MET 80 -7.379 -6.930 -0.800 590 HA MET 80 HA MET 80 -6.652 -9.143 -2.310 591 HB2 MET 80 1HB MET 80 -5.457 -6.371 -2.236 592 HB3 MET 80 2HB MET 80 -5.055 -7.572 -3.454 593 HG2 MET 80 1HG MET 80 -7.911 -6.872 -3.008 594 HG3 MET 80 2HG MET 80 -6.879 -5.752 -3.896 595 HE1 MET 80 1HE MET 80 -8.553 -8.888 -3.467 596 HE2 MET 80 2HE MET 80 -9.343 -8.873 -5.044 597 HE3 MET 80 3HE MET 80 -8.014 -9.991 -4.733 598 H ALA 81 H ALA 81 -4.772 -7.339 0.088 599 HA ALA 81 HA ALA 81 -2.274 -8.383 -0.196 600 HB1 ALA 81 1HB ALA 81 -1.901 -7.313 1.714 601 HB2 ALA 81 2HB ALA 81 -3.631 -6.978 1.790 602 HB3 ALA 81 3HB ALA 81 -2.972 -8.398 2.601 603 H ARG 82 H ARG 82 -4.930 -9.877 1.647 604 HA ARG 82 HA ARG 82 -3.473 -12.204 2.345 605 HB2 ARG 82 1HB ARG 82 -5.598 -11.285 3.434 606 HB3 ARG 82 2HB ARG 82 -6.472 -12.045 2.111 607 HG2 ARG 82 1HG ARG 82 -5.729 -14.215 2.771 608 HG3 ARG 82 2HG ARG 82 -4.631 -13.528 3.969 609 HD2 ARG 82 1HD ARG 82 -6.325 -13.019 5.429 610 HD3 ARG 82 2HD ARG 82 -7.527 -12.868 4.148 611 HE ARG 82 HE ARG 82 -6.543 -15.546 4.524 612 HH11 ARG 82 1HH1 ARG 82 -8.896 -13.181 5.518 613 HH12 ARG 82 2HH1 ARG 82 -10.031 -14.359 6.089 614 HH21 ARG 82 1HH2 ARG 82 -8.029 -17.107 5.274 615 HH22 ARG 82 2HH2 ARG 82 -9.536 -16.591 5.952 616 H LYS 83 H LYS 83 -5.656 -11.418 -0.315 617 HA LYS 83 HA LYS 83 -5.980 -13.953 -1.412 618 HB2 LYS 83 1HB LYS 83 -6.122 -11.172 -2.450 619 HB3 LYS 83 2HB LYS 83 -6.010 -12.462 -3.639 620 HG2 LYS 83 1HG LYS 83 -8.282 -12.213 -3.423 621 HG3 LYS 83 2HG LYS 83 -7.957 -13.523 -2.286 622 HD2 LYS 83 1HD LYS 83 -7.914 -11.904 -0.444 623 HD3 LYS 83 2HD LYS 83 -8.253 -10.602 -1.586 624 HE2 LYS 83 1HE LYS 83 -10.294 -11.256 -0.474 625 HE3 LYS 83 2HE LYS 83 -10.375 -11.711 -2.175 626 HZ1 LYS 83 1HZ LYS 83 -10.448 -13.880 -1.674 627 HZ2 LYS 83 2HZ LYS 83 -10.945 -13.358 -0.145 628 HZ3 LYS 83 3HZ LYS 83 -9.324 -13.753 -0.417 629 H ILE 84 H ILE 84 -3.461 -11.533 -2.069 630 HA ILE 84 HA ILE 84 -2.060 -13.236 -3.901 631 HB ILE 84 HB ILE 84 -0.269 -11.520 -3.778 632 HG12 ILE 84 1HG1 ILE 84 -2.129 -9.916 -2.038 633 HG13 ILE 84 2HG1 ILE 84 -0.887 -10.948 -1.339 634 HG21 ILE 84 1HG2 ILE 84 -3.016 -11.120 -4.629 635 HG22 ILE 84 2HG2 ILE 84 -2.176 -9.600 -4.325 636 HG23 ILE 84 3HG2 ILE 84 -1.507 -10.762 -5.471 637 HD11 ILE 84 1HD1 ILE 84 -0.631 -8.309 -2.233 638 HD12 ILE 84 2HD1 ILE 84 0.643 -9.387 -1.662 639 HD13 ILE 84 3HD1 ILE 84 0.260 -9.306 -3.382 640 H GLY 85 H GLY 85 -2.208 -12.983 -0.514 641 HA2 GLY 85 1HA GLY 85 -1.069 -15.013 0.507 642 HA3 GLY 85 2HA GLY 85 0.386 -14.361 -0.230 643 H ALA 86 H ALA 86 1.076 -12.198 0.482 644 HA ALA 86 HA ALA 86 1.632 -11.942 3.086 645 HB1 ALA 86 1HB ALA 86 2.589 -10.079 2.359 646 HB2 ALA 86 2HB ALA 86 1.665 -10.195 0.861 647 HB3 ALA 86 3HB ALA 86 1.012 -9.300 2.232 648 H ARG 87 H ARG 87 0.545 -11.769 4.928 649 HA ARG 87 HA ARG 87 -2.264 -10.920 4.826 650 HB2 ARG 87 1HB ARG 87 -1.834 -13.155 5.754 651 HB3 ARG 87 2HB ARG 87 -0.774 -12.449 6.967 652 HG2 ARG 87 1HG ARG 87 -2.602 -11.323 8.012 653 HG3 ARG 87 2HG ARG 87 -3.694 -11.777 6.702 654 HD2 ARG 87 1HD ARG 87 -2.338 -13.669 8.621 655 HD3 ARG 87 2HD ARG 87 -4.032 -13.185 8.668 656 HE ARG 87 HE ARG 87 -4.466 -14.589 6.881 657 HH11 ARG 87 1HH1 ARG 87 -1.040 -14.387 7.468 658 HH12 ARG 87 2HH1 ARG 87 -0.653 -15.724 6.435 659 HH21 ARG 87 1HH2 ARG 87 -3.969 -16.349 5.519 660 HH22 ARG 87 2HH2 ARG 87 -2.319 -16.838 5.327 661 H VAL 88 H VAL 88 -2.785 -8.973 5.553 662 HA VAL 88 HA VAL 88 -0.878 -7.549 7.276 663 HB VAL 88 HB VAL 88 -2.104 -5.496 6.603 664 HG11 VAL 88 1HG1 VAL 88 -0.744 -5.241 4.837 665 HG12 VAL 88 2HG1 VAL 88 -0.191 -6.868 5.236 666 HG13 VAL 88 3HG1 VAL 88 -1.418 -6.632 3.990 667 HG21 VAL 88 1HG2 VAL 88 -4.063 -5.573 5.557 668 HG22 VAL 88 2HG2 VAL 88 -3.393 -6.577 4.271 669 HG23 VAL 88 3HG2 VAL 88 -4.036 -7.328 5.732 670 H TYR 89 H TYR 89 -1.378 -7.066 9.317 671 HA TYR 89 HA TYR 89 -4.035 -7.785 10.297 672 HB2 TYR 89 1HB TYR 89 -1.652 -8.417 11.321 673 HB3 TYR 89 2HB TYR 89 -1.887 -6.883 12.151 674 HD1 TYR 89 1HD TYR 89 -4.634 -6.767 12.860 675 HD2 TYR 89 2HD TYR 89 -2.091 -10.176 12.742 676 HE1 TYR 89 1HE TYR 89 -6.062 -7.881 14.524 677 HE2 TYR 89 2HE TYR 89 -3.512 -11.300 14.406 678 HH TYR 89 HH TYR 89 -6.394 -10.730 15.051 679 H ALA 90 H ALA 90 -4.220 -5.549 8.822 680 HA ALA 90 HA ALA 90 -4.404 -3.378 10.808 681 HB1 ALA 90 1HB ALA 90 -3.375 -2.017 9.390 682 HB2 ALA 90 2HB ALA 90 -3.102 -3.392 8.319 683 HB3 ALA 90 3HB ALA 90 -4.543 -2.393 8.122 684 H LEU 91 H LEU 91 -6.171 -1.803 10.370 685 HA LEU 91 HA LEU 91 -8.567 -3.219 9.409 686 HB2 LEU 91 1HB LEU 91 -8.493 -2.633 11.824 687 HB3 LEU 91 2HB LEU 91 -8.416 -0.933 11.367 688 HG LEU 91 HG LEU 91 -10.654 -1.387 10.161 689 HD11 LEU 91 1HD1 LEU 91 -11.887 -3.241 10.696 690 HD12 LEU 91 2HD1 LEU 91 -11.014 -3.527 12.201 691 HD13 LEU 91 3HD1 LEU 91 -10.265 -3.934 10.657 692 HD21 LEU 91 1HD2 LEU 91 -10.191 -0.102 12.327 693 HD22 LEU 91 2HD2 LEU 91 -10.769 -1.547 13.157 694 HD23 LEU 91 3HD2 LEU 91 -11.835 -0.678 12.050 695 HA PRO 92 HA PRO 92 -8.760 -0.210 6.166 696 HB2 PRO 92 1HB PRO 92 -11.254 -0.828 5.289 697 HB3 PRO 92 2HB PRO 92 -9.840 -1.831 4.948 698 HG2 PRO 92 1HG PRO 92 -11.953 -2.181 7.041 699 HG3 PRO 92 2HG PRO 92 -11.209 -3.398 5.986 700 HD2 PRO 92 1HD PRO 92 -10.467 -3.059 8.568 701 HD3 PRO 92 2HD PRO 92 -9.330 -3.579 7.307 702 H GLU 93 H GLU 93 -11.612 -0.622 8.267 703 HA GLU 93 HA GLU 93 -12.978 1.682 7.807 704 HB2 GLU 93 1HB GLU 93 -12.558 0.019 10.236 705 HB3 GLU 93 2HB GLU 93 -13.312 1.592 10.455 706 HG2 GLU 93 1HG GLU 93 -14.875 0.824 8.534 707 HG3 GLU 93 2HG GLU 93 -14.307 -0.791 8.960 708 H ASP 94 H ASP 94 -9.854 1.389 9.216 709 HA ASP 94 HA ASP 94 -9.900 4.124 10.242 710 HB2 ASP 94 1HB ASP 94 -8.093 1.772 10.586 711 HB3 ASP 94 2HB ASP 94 -7.418 3.383 10.807 712 H LEU 95 H LEU 95 -8.337 2.151 7.775 713 HA LEU 95 HA LEU 95 -6.405 3.881 6.845 714 HB2 LEU 95 1HB LEU 95 -6.471 1.718 5.935 715 HB3 LEU 95 2HB LEU 95 -8.150 1.892 5.429 716 HG LEU 95 HG LEU 95 -7.522 3.336 3.622 717 HD11 LEU 95 1HD1 LEU 95 -5.402 4.220 3.260 718 HD12 LEU 95 2HD1 LEU 95 -4.628 3.075 4.354 719 HD13 LEU 95 3HD1 LEU 95 -5.621 4.382 5.003 720 HD21 LEU 95 1HD2 LEU 95 -5.743 0.910 3.825 721 HD22 LEU 95 2HD2 LEU 95 -6.010 1.830 2.344 722 HD23 LEU 95 3HD2 LEU 95 -7.357 0.997 3.120 723 H VAL 96 H VAL 96 -9.862 3.859 6.129 724 HA VAL 96 HA VAL 96 -10.068 5.618 4.058 725 HB VAL 96 HB VAL 96 -11.826 5.531 6.513 726 HG11 VAL 96 1HG1 VAL 96 -11.823 7.395 4.408 727 HG12 VAL 96 2HG1 VAL 96 -13.186 6.312 4.117 728 HG13 VAL 96 3HG1 VAL 96 -13.052 7.170 5.653 729 HG21 VAL 96 1HG2 VAL 96 -12.884 3.755 5.626 730 HG22 VAL 96 2HG2 VAL 96 -12.736 4.359 3.976 731 HG23 VAL 96 3HG2 VAL 96 -11.377 3.532 4.738 732 H GLU 97 H GLU 97 -9.359 6.365 7.419 733 HA GLU 97 HA GLU 97 -9.173 9.218 6.738 734 HB2 GLU 97 1HB GLU 97 -9.294 7.866 9.439 735 HB3 GLU 97 2HB GLU 97 -9.167 9.601 9.184 736 HG2 GLU 97 1HG GLU 97 -11.330 9.455 7.905 737 HG3 GLU 97 2HG GLU 97 -11.468 7.799 8.493 738 H VAL 98 H VAL 98 -7.166 7.367 5.894 739 HA VAL 98 HA VAL 98 -4.916 6.904 6.039 740 HB VAL 98 HB VAL 98 -4.768 9.824 6.786 741 HG11 VAL 98 1HG1 VAL 98 -2.742 8.081 6.594 742 HG12 VAL 98 2HG1 VAL 98 -2.871 8.567 4.903 743 HG13 VAL 98 3HG1 VAL 98 -2.597 9.782 6.153 744 HG21 VAL 98 1HG2 VAL 98 -6.299 9.566 4.916 745 HG22 VAL 98 2HG2 VAL 98 -4.785 10.287 4.372 746 HG23 VAL 98 3HG2 VAL 98 -5.113 8.584 4.056 747 H ASN 99 H ASN 99 -5.865 5.895 8.273 748 HA ASN 99 HA ASN 99 -4.707 7.076 10.630 749 HB2 ASN 99 1HB ASN 99 -6.827 5.500 10.340 750 HB3 ASN 99 2HB ASN 99 -5.626 4.239 10.595 751 HD21 ASN 99 1HD2 ASN 99 -7.914 5.616 12.178 752 HD22 ASN 99 2HD2 ASN 99 -7.217 5.822 13.746 753 HA PRO 100 HA PRO 100 -0.725 5.212 9.736 754 HB2 PRO 100 1HB PRO 100 0.570 6.433 11.786 755 HB3 PRO 100 2HB PRO 100 0.198 7.249 10.263 756 HG2 PRO 100 1HG PRO 100 -1.247 7.373 12.882 757 HG3 PRO 100 2HG PRO 100 -0.848 8.688 11.761 758 HD2 PRO 100 1HD PRO 100 -3.310 7.567 11.873 759 HD3 PRO 100 2HD PRO 100 -2.621 8.208 10.368 760 H LYS 101 H LYS 101 -2.861 4.725 12.275 761 HA LYS 101 HA LYS 101 -1.166 3.192 14.006 762 HB2 LYS 101 1HB LYS 101 -4.185 3.255 13.833 763 HB3 LYS 101 2HB LYS 101 -3.239 2.585 15.157 764 HG2 LYS 101 1HG LYS 101 -3.199 5.478 14.324 765 HG3 LYS 101 2HG LYS 101 -4.178 4.820 15.637 766 HD2 LYS 101 1HD LYS 101 -1.176 4.582 15.501 767 HD3 LYS 101 2HD LYS 101 -2.019 5.877 16.354 768 HE2 LYS 101 1HE LYS 101 -3.175 4.165 17.719 769 HE3 LYS 101 2HE LYS 101 -2.223 2.919 16.912 770 HZ1 LYS 101 1HZ LYS 101 -0.354 3.490 18.031 771 HZ2 LYS 101 2HZ LYS 101 -1.480 3.992 19.189 772 HZ3 LYS 101 3HZ LYS 101 -0.769 5.125 18.154 773 H MET 102 H MET 102 -3.470 2.462 11.430 774 HA MET 102 HA MET 102 -2.980 -0.397 11.722 775 HB2 MET 102 1HB MET 102 -4.706 -0.653 9.989 776 HB3 MET 102 2HB MET 102 -5.278 0.319 11.338 777 HG2 MET 102 1HG MET 102 -6.054 1.534 9.570 778 HG3 MET 102 2HG MET 102 -4.500 2.316 9.851 779 HE1 MET 102 1HE MET 102 -5.808 -0.869 8.363 780 HE2 MET 102 2HE MET 102 -6.495 0.045 7.021 781 HE3 MET 102 3HE MET 102 -5.091 -0.989 6.755 782 H VAL 103 H VAL 103 -2.497 2.199 9.363 783 HA VAL 103 HA VAL 103 -1.564 0.913 7.173 784 HB VAL 103 HB VAL 103 -0.249 3.341 8.399 785 HG11 VAL 103 1HG1 VAL 103 -0.388 2.956 5.472 786 HG12 VAL 103 2HG1 VAL 103 0.881 3.677 6.465 787 HG13 VAL 103 3HG1 VAL 103 0.736 1.922 6.352 788 HG21 VAL 103 1HG2 VAL 103 -2.851 3.178 7.801 789 HG22 VAL 103 2HG2 VAL 103 -1.908 4.651 7.576 790 HG23 VAL 103 3HG2 VAL 103 -2.219 3.584 6.206 791 H MET 104 H MET 104 0.071 1.220 10.250 792 HA MET 104 HA MET 104 2.658 0.741 9.865 793 HB2 MET 104 1HB MET 104 2.168 0.591 12.088 794 HB3 MET 104 2HB MET 104 0.720 -0.368 11.815 795 HG2 MET 104 1HG MET 104 2.214 -2.306 11.289 796 HG3 MET 104 2HG MET 104 3.571 -1.317 11.822 797 HE1 MET 104 1HE MET 104 0.388 -3.330 14.412 798 HE2 MET 104 2HE MET 104 -0.046 -2.412 12.970 799 HE3 MET 104 3HE MET 104 0.966 -3.851 12.828 800 H THR 105 H THR 105 0.238 -1.871 9.708 801 HA THR 105 HA THR 105 2.171 -3.735 8.656 802 HB THR 105 HB THR 105 -0.085 -5.079 8.283 803 HG1 THR 105 1HG THR 105 -1.238 -3.029 8.939 804 HG21 THR 105 1HG2 THR 105 1.483 -4.551 10.764 805 HG22 THR 105 2HG2 THR 105 1.349 -6.027 9.809 806 HG23 THR 105 3HG2 THR 105 0.030 -5.543 10.875 807 H VAL 106 H VAL 106 -0.568 -1.879 7.417 808 HA VAL 106 HA VAL 106 -1.056 -2.863 4.970 809 HB VAL 106 HB VAL 106 -0.615 0.041 5.661 810 HG11 VAL 106 1HG1 VAL 106 -1.016 -1.186 3.088 811 HG12 VAL 106 2HG1 VAL 106 -2.375 -0.139 3.497 812 HG13 VAL 106 3HG1 VAL 106 -0.734 0.507 3.490 813 HG21 VAL 106 1HG2 VAL 106 -2.414 -1.194 6.861 814 HG22 VAL 106 2HG2 VAL 106 -3.003 0.146 5.877 815 HG23 VAL 106 3HG2 VAL 106 -3.174 -1.512 5.301 816 H PHE 107 H PHE 107 1.719 -0.766 5.720 817 HA PHE 107 HA PHE 107 2.852 -1.289 3.086 818 HB2 PHE 107 1HB PHE 107 3.457 0.633 5.301 819 HB3 PHE 107 2HB PHE 107 4.702 0.270 4.111 820 HD1 PHE 107 2HD PHE 107 3.196 0.041 1.637 821 HD2 PHE 107 1HD PHE 107 2.732 2.777 4.864 822 HE1 PHE 107 2HE PHE 107 2.201 1.683 0.098 823 HE2 PHE 107 1HE PHE 107 1.736 4.423 3.331 824 HZ PHE 107 HZ PHE 107 1.470 3.877 0.944 825 H ALA 108 H ALA 108 3.934 -1.502 6.478 826 HA ALA 108 HA ALA 108 6.334 -2.677 6.306 827 HB1 ALA 108 1HB ALA 108 4.066 -3.341 8.159 828 HB2 ALA 108 2HB ALA 108 5.662 -4.074 8.329 829 HB3 ALA 108 3HB ALA 108 5.476 -2.325 8.460 830 H CYS 109 H CYS 109 3.280 -4.509 6.118 831 HA CYS 109 HA CYS 109 4.394 -7.023 5.665 832 HB2 CYS 109 1HB CYS 109 1.743 -5.779 5.046 833 HB3 CYS 109 2HB CYS 109 2.115 -7.371 4.397 834 HG CYS 109 HG CYS 109 2.532 -8.542 6.905 835 H LEU 110 H LEU 110 3.661 -4.410 3.429 836 HA LEU 110 HA LEU 110 4.316 -5.990 1.103 837 HB2 LEU 110 1HB LEU 110 3.853 -3.024 1.371 838 HB3 LEU 110 2HB LEU 110 3.959 -3.922 -0.142 839 HG LEU 110 HG LEU 110 1.836 -4.503 1.903 840 HD11 LEU 110 1HD1 LEU 110 1.437 -2.702 -0.462 841 HD12 LEU 110 2HD1 LEU 110 1.882 -2.070 1.123 842 HD13 LEU 110 3HD1 LEU 110 0.375 -2.965 0.923 843 HD21 LEU 110 1HD2 LEU 110 1.137 -4.841 -0.861 844 HD22 LEU 110 2HD2 LEU 110 1.159 -6.030 0.441 845 HD23 LEU 110 3HD2 LEU 110 2.622 -5.718 -0.495 846 H MET 111 H MET 111 5.645 -2.907 2.314 847 HA MET 111 HA MET 111 7.959 -2.836 0.858 848 HB2 MET 111 1HB MET 111 8.868 -1.367 2.530 849 HB3 MET 111 2HB MET 111 7.144 -1.048 2.394 850 HG2 MET 111 1HG MET 111 7.542 -1.030 4.679 851 HG3 MET 111 2HG MET 111 6.878 -2.635 4.376 852 HE1 MET 111 1HE MET 111 10.639 -1.651 3.416 853 HE2 MET 111 2HE MET 111 10.115 -0.555 4.694 854 HE3 MET 111 3HE MET 111 11.358 -1.763 5.023 855 H GLY 112 H GLY 112 7.145 -5.034 3.360 856 HA2 GLY 112 1HA GLY 112 9.462 -5.774 4.564 857 HA3 GLY 112 2HA GLY 112 8.256 -6.941 4.042 858 H LYS 113 H LYS 113 8.564 -6.459 1.227 859 HA LYS 113 HA LYS 113 10.490 -8.339 0.574 860 HB2 LYS 113 1HB LYS 113 9.241 -6.142 -1.072 861 HB3 LYS 113 2HB LYS 113 10.327 -7.342 -1.761 862 HG2 LYS 113 1HG LYS 113 7.997 -8.303 -0.190 863 HG3 LYS 113 2HG LYS 113 7.711 -7.648 -1.805 864 HD2 LYS 113 1HD LYS 113 9.822 -9.724 -1.314 865 HD3 LYS 113 2HD LYS 113 8.135 -10.174 -1.572 866 HE2 LYS 113 1HE LYS 113 9.746 -8.470 -3.465 867 HE3 LYS 113 2HE LYS 113 9.539 -10.213 -3.634 868 HZ1 LYS 113 1HZ LYS 113 7.695 -9.769 -4.755 869 HZ2 LYS 113 2HZ LYS 113 7.775 -8.121 -4.385 870 HZ3 LYS 113 3HZ LYS 113 7.002 -9.188 -3.325 871 H GLY 114 H GLY 114 10.758 -4.821 0.742 872 HA2 GLY 114 1HA GLY 114 13.433 -4.756 -0.294 873 HA3 GLY 114 2HA GLY 114 12.577 -3.424 0.469 874 H MET 115 H MET 115 13.445 -6.644 1.702 875 HA MET 115 HA MET 115 14.713 -5.319 3.994 876 HB2 MET 115 1HB MET 115 13.309 -7.912 3.606 877 HB3 MET 115 2HB MET 115 14.613 -7.870 4.787 878 HG2 MET 115 1HG MET 115 12.520 -5.760 4.886 879 HG3 MET 115 2HG MET 115 12.136 -7.375 5.477 880 HE1 MET 115 1HE MET 115 12.320 -6.181 8.748 881 HE2 MET 115 2HE MET 115 12.523 -4.602 7.989 882 HE3 MET 115 3HE MET 115 11.459 -5.803 7.257 883 H LYS 116 H LYS 116 16.459 -6.974 4.982 884 HA LYS 116 HA LYS 116 18.573 -7.798 4.813 885 HB2 LYS 116 1HB LYS 116 17.652 -8.612 2.050 886 HB3 LYS 116 2HB LYS 116 19.127 -9.170 2.829 887 HG2 LYS 116 1HG LYS 116 17.486 -9.941 4.714 888 HG3 LYS 116 2HG LYS 116 16.291 -9.864 3.417 889 HD2 LYS 116 1HD LYS 116 17.496 -11.447 2.106 890 HD3 LYS 116 2HD LYS 116 18.892 -11.369 3.183 891 HE2 LYS 116 1HE LYS 116 17.845 -13.350 3.806 892 HE3 LYS 116 2HE LYS 116 17.260 -12.191 5.000 893 HZ1 LYS 116 1HZ LYS 116 15.183 -12.512 4.336 894 HZ2 LYS 116 2HZ LYS 116 15.729 -13.800 3.385 895 HZ3 LYS 116 3HZ LYS 116 15.574 -12.255 2.710 896 H ARG 117 H ARG 117 18.339 -5.105 4.418 897 HA ARG 117 HA ARG 117 19.488 -4.120 2.046 898 HB2 ARG 117 1HB ARG 117 19.125 -3.048 4.814 899 HB3 ARG 117 2HB ARG 117 20.160 -2.177 3.691 900 HG2 ARG 117 1HG ARG 117 18.360 -1.840 2.171 901 HG3 ARG 117 2HG ARG 117 17.313 -2.931 3.082 902 HD2 ARG 117 1HD ARG 117 16.773 -0.579 3.511 903 HD3 ARG 117 2HD ARG 117 17.327 -1.401 4.969 904 HE ARG 117 HE ARG 117 19.394 -0.001 3.524 905 HH11 ARG 117 1HH1 ARG 117 16.944 0.204 5.988 906 HH12 ARG 117 2HH1 ARG 117 17.685 1.545 6.797 907 HH21 ARG 117 1HH2 ARG 117 20.379 1.765 4.579 908 HH22 ARG 117 2HH2 ARG 117 19.639 2.432 5.994 909 H VAL 118 H VAL 118 21.632 -2.671 2.426 910 HA VAL 118 HA VAL 118 23.776 -4.450 2.349 911 HB VAL 118 HB VAL 118 23.849 -1.486 2.934 912 HG11 VAL 118 1HG1 VAL 118 25.913 -3.339 3.117 913 HG12 VAL 118 2HG1 VAL 118 26.132 -2.583 1.538 914 HG13 VAL 118 3HG1 VAL 118 26.073 -1.587 2.994 915 HG21 VAL 118 1HG2 VAL 118 23.674 -1.074 0.722 916 HG22 VAL 118 2HG2 VAL 118 24.563 -2.528 0.270 917 HG23 VAL 118 3HG2 VAL 118 22.857 -2.637 0.706 918 H SER 119 H SER 119 22.746 -2.277 4.969 919 HA SER 119 HA SER 119 23.920 -4.088 6.916 920 HB2 SER 119 1HB SER 119 25.239 -2.360 8.022 921 HB3 SER 119 2HB SER 119 25.760 -2.523 6.345 922 HG SER 119 HG SER 119 25.437 -0.319 7.116 923 H GLY 120 H GLY 120 23.410 -3.345 9.188 924 HA2 GLY 120 1HA GLY 120 21.286 -1.449 9.545 925 HA3 GLY 120 2HA GLY 120 20.715 -3.109 9.608 926 HA PRO 121 HA PRO 121 21.813 -2.050 13.923 927 HB2 PRO 121 1HB PRO 121 19.863 -3.592 15.016 928 HB3 PRO 121 2HB PRO 121 19.577 -1.944 14.446 929 HG2 PRO 121 1HG PRO 121 19.001 -4.546 13.083 930 HG3 PRO 121 2HG PRO 121 17.995 -3.088 13.185 931 HD2 PRO 121 1HD PRO 121 19.465 -3.693 10.993 932 HD3 PRO 121 2HD PRO 121 19.148 -2.021 11.499 933 H SER 122 H SER 122 22.031 -4.755 11.985 934 HA SER 122 HA SER 122 22.664 -6.703 13.999 935 HB2 SER 122 1HB SER 122 23.275 -8.146 12.128 936 HB3 SER 122 2HB SER 122 21.741 -7.343 11.789 937 HG SER 122 HG SER 122 24.078 -6.087 10.930 938 H SER 123 H SER 123 24.628 -7.326 14.747 939 HA SER 123 HA SER 123 26.754 -5.503 14.730 940 HB2 SER 123 1HB SER 123 26.210 -7.425 16.393 941 HB3 SER 123 2HB SER 123 27.165 -8.427 15.300 942 HG SER 123 HG SER 123 27.996 -6.132 16.737 943 H GLY 124 H GLY 124 26.458 -8.650 13.080 944 HA2 GLY 124 1HA GLY 124 27.258 -8.326 10.634 945 HA3 GLY 124 2HA GLY 124 28.778 -7.932 11.423 Start of MODEL 12 1 H1 GLY 1 H GLY 1 11.818 10.127 -0.502 2 HA2 GLY 1 1HA GLY 1 14.321 9.839 -1.853 3 HA3 GLY 1 2HA GLY 1 13.618 11.425 -2.132 4 H SER 2 H SER 2 14.770 9.208 0.354 5 HA SER 2 HA SER 2 15.685 11.475 1.920 6 HB2 SER 2 1HB SER 2 14.637 10.628 4.005 7 HB3 SER 2 2HB SER 2 13.442 11.141 2.814 8 HG SER 2 HG SER 2 13.434 8.887 4.001 9 H SER 3 H SER 3 17.438 11.015 3.206 10 HA SER 3 HA SER 3 18.959 8.720 2.528 11 HB2 SER 3 1HB SER 3 20.572 9.564 4.206 12 HB3 SER 3 2HB SER 3 20.041 10.833 3.104 13 HG SER 3 HG SER 3 19.927 10.850 5.726 14 H GLY 4 H GLY 4 19.656 7.000 3.868 15 HA2 GLY 4 1HA GLY 4 19.123 6.393 6.441 16 HA3 GLY 4 2HA GLY 4 17.585 6.058 5.659 17 H SER 5 H SER 5 21.020 5.231 5.647 18 HA SER 5 HA SER 5 20.915 3.100 3.842 19 HB2 SER 5 1HB SER 5 22.733 3.418 6.242 20 HB3 SER 5 2HB SER 5 23.014 2.345 4.870 21 HG SER 5 HG SER 5 23.169 5.138 5.016 22 H SER 6 H SER 6 20.890 2.949 7.407 23 HA SER 6 HA SER 6 19.830 0.228 7.252 24 HB2 SER 6 1HB SER 6 20.959 1.845 9.542 25 HB3 SER 6 2HB SER 6 20.238 0.249 9.749 26 HG SER 6 HG SER 6 22.310 -0.233 9.430 27 H GLY 7 H GLY 7 18.083 2.289 6.459 28 HA2 GLY 7 1HA GLY 7 16.234 2.564 8.730 29 HA3 GLY 7 2HA GLY 7 16.184 3.512 7.251 30 H ASN 8 H ASN 8 15.608 0.294 8.589 31 HA ASN 8 HA ASN 8 14.379 -0.795 6.292 32 HB2 ASN 8 1HB ASN 8 13.755 -1.608 9.129 33 HB3 ASN 8 2HB ASN 8 13.717 -2.607 7.680 34 HD21 ASN 8 1HD2 ASN 8 16.111 -1.952 6.515 35 HD22 ASN 8 2HD2 ASN 8 17.408 -2.491 7.521 36 H ASP 9 H ASP 9 13.144 1.036 9.028 37 HA ASP 9 HA ASP 9 10.396 0.751 8.134 38 HB2 ASP 9 1HB ASP 9 11.728 2.029 10.498 39 HB3 ASP 9 2HB ASP 9 10.066 2.446 10.093 40 H ASP 10 H ASP 10 13.026 2.900 7.708 41 HA ASP 10 HA ASP 10 11.433 5.211 7.056 42 HB2 ASP 10 1HB ASP 10 13.707 5.427 8.005 43 HB3 ASP 10 2HB ASP 10 14.369 4.685 6.551 44 H ILE 11 H ILE 11 13.140 2.677 5.299 45 HA ILE 11 HA ILE 11 12.840 3.770 2.715 46 HB ILE 11 HB ILE 11 14.337 1.812 3.479 47 HG12 ILE 11 1HG1 ILE 11 12.868 1.299 0.904 48 HG13 ILE 11 2HG1 ILE 11 13.882 2.724 1.101 49 HG21 ILE 11 1HG2 ILE 11 11.921 0.628 4.013 50 HG22 ILE 11 2HG2 ILE 11 12.380 -0.100 2.475 51 HG23 ILE 11 3HG2 ILE 11 13.466 -0.210 3.861 52 HD11 ILE 11 1HD1 ILE 11 14.771 0.413 0.112 53 HD12 ILE 11 2HD1 ILE 11 15.795 1.539 1.004 54 HD13 ILE 11 3HD1 ILE 11 15.102 0.139 1.822 55 H ILE 12 H ILE 12 10.558 2.504 4.846 56 HA ILE 12 HA ILE 12 8.766 1.103 3.298 57 HB ILE 12 HB ILE 12 8.109 3.130 5.439 58 HG12 ILE 12 1HG1 ILE 12 8.538 0.137 5.571 59 HG13 ILE 12 2HG1 ILE 12 9.610 1.369 6.227 60 HG21 ILE 12 1HG2 ILE 12 6.253 0.957 5.242 61 HG22 ILE 12 2HG2 ILE 12 5.957 2.690 5.126 62 HG23 ILE 12 3HG2 ILE 12 6.389 1.772 3.684 63 HD11 ILE 12 1HD1 ILE 12 7.459 0.075 7.492 64 HD12 ILE 12 2HD1 ILE 12 8.486 1.361 8.127 65 HD13 ILE 12 3HD1 ILE 12 6.992 1.762 7.279 66 H VAL 13 H VAL 13 9.301 4.575 3.431 67 HA VAL 13 HA VAL 13 7.047 5.178 1.733 68 HB VAL 13 HB VAL 13 9.329 6.931 2.652 69 HG11 VAL 13 1HG1 VAL 13 7.548 8.729 2.035 70 HG12 VAL 13 2HG1 VAL 13 8.567 8.034 0.773 71 HG13 VAL 13 3HG1 VAL 13 6.910 7.466 0.983 72 HG21 VAL 13 1HG2 VAL 13 7.189 7.887 3.932 73 HG22 VAL 13 2HG2 VAL 13 6.700 6.197 3.802 74 HG23 VAL 13 3HG2 VAL 13 8.213 6.619 4.605 75 H ASN 14 H ASN 14 10.583 5.156 1.404 76 HA ASN 14 HA ASN 14 10.743 6.055 -1.230 77 HB2 ASN 14 1HB ASN 14 12.761 5.953 0.000 78 HB3 ASN 14 2HB ASN 14 12.524 4.255 0.403 79 HD21 ASN 14 1HD2 ASN 14 13.596 6.513 -1.978 80 HD22 ASN 14 2HD2 ASN 14 14.293 5.362 -3.061 81 H TRP 15 H TRP 15 10.770 2.687 -0.056 82 HA TRP 15 HA TRP 15 10.857 1.331 -2.420 83 HB2 TRP 15 1HB TRP 15 10.832 0.243 -0.211 84 HB3 TRP 15 2HB TRP 15 9.122 0.629 -0.042 85 HD1 TRP 15 HD TRP 15 11.324 -1.314 -2.597 86 HE1 TRP 15 1HE TRP 15 10.009 -3.399 -3.338 87 HE3 TRP 15 3HE TRP 15 7.023 -0.547 0.059 88 HZ2 TRP 15 2HZ TRP 15 7.483 -4.564 -2.859 89 HZ3 TRP 15 3HZ TRP 15 5.205 -2.193 -0.139 90 HH2 TRP 15 HH TRP 15 5.433 -4.159 -1.569 91 H VAL 16 H VAL 16 7.789 2.108 -0.766 92 HA VAL 16 HA VAL 16 6.006 1.373 -2.688 93 HB VAL 16 HB VAL 16 5.883 3.776 -0.869 94 HG11 VAL 16 1HG1 VAL 16 4.263 4.443 -2.308 95 HG12 VAL 16 2HG1 VAL 16 3.991 2.814 -2.931 96 HG13 VAL 16 3HG1 VAL 16 3.307 3.291 -1.376 97 HG21 VAL 16 1HG2 VAL 16 4.016 1.940 -0.049 98 HG22 VAL 16 2HG2 VAL 16 5.350 0.920 -0.588 99 HG23 VAL 16 3HG2 VAL 16 5.623 2.149 0.647 100 H ASN 17 H ASN 17 7.602 4.547 -2.462 101 HA ASN 17 HA ASN 17 6.432 5.755 -4.668 102 HB2 ASN 17 1HB ASN 17 8.984 6.124 -3.183 103 HB3 ASN 17 2HB ASN 17 8.844 6.905 -4.755 104 HD21 ASN 17 1HD2 ASN 17 7.286 6.574 -1.614 105 HD22 ASN 17 2HD2 ASN 17 6.547 8.135 -1.614 106 H GLU 18 H GLU 18 9.607 4.125 -4.578 107 HA GLU 18 HA GLU 18 10.158 4.222 -7.291 108 HB2 GLU 18 1HB GLU 18 11.008 2.452 -5.053 109 HB3 GLU 18 2HB GLU 18 11.382 1.936 -6.690 110 HG2 GLU 18 1HG GLU 18 12.106 4.658 -5.659 111 HG3 GLU 18 2HG GLU 18 13.159 3.257 -5.468 112 H THR 19 H THR 19 8.759 1.461 -5.514 113 HA THR 19 HA THR 19 8.265 -0.293 -7.512 114 HB THR 19 HB THR 19 6.391 0.412 -5.247 115 HG1 THR 19 1HG THR 19 7.955 -1.914 -5.344 116 HG21 THR 19 1HG2 THR 19 6.254 -1.681 -7.359 117 HG22 THR 19 2HG2 THR 19 4.954 -0.801 -6.554 118 HG23 THR 19 3HG2 THR 19 5.774 -2.121 -5.721 119 H LEU 20 H LEU 20 6.419 2.630 -6.824 120 HA LEU 20 HA LEU 20 4.418 2.090 -8.810 121 HB2 LEU 20 1HB LEU 20 5.110 4.616 -7.318 122 HB3 LEU 20 2HB LEU 20 3.706 4.418 -8.366 123 HG LEU 20 HG LEU 20 4.054 2.559 -6.060 124 HD11 LEU 20 1HD1 LEU 20 2.429 4.725 -5.239 125 HD12 LEU 20 2HD1 LEU 20 3.977 5.384 -5.768 126 HD13 LEU 20 3HD1 LEU 20 3.929 4.142 -4.517 127 HD21 LEU 20 1HD2 LEU 20 2.253 2.116 -7.579 128 HD22 LEU 20 2HD2 LEU 20 1.706 3.791 -7.495 129 HD23 LEU 20 3HD2 LEU 20 1.573 2.747 -6.078 130 H ARG 21 H ARG 21 7.259 4.199 -8.585 131 HA ARG 21 HA ARG 21 6.963 5.479 -11.061 132 HB2 ARG 21 1HB ARG 21 9.241 4.995 -9.195 133 HB3 ARG 21 2HB ARG 21 9.599 5.583 -10.813 134 HG2 ARG 21 1HG ARG 21 7.504 6.993 -9.254 135 HG3 ARG 21 2HG ARG 21 9.192 7.224 -8.790 136 HD2 ARG 21 1HD ARG 21 8.996 8.899 -10.324 137 HD3 ARG 21 2HD ARG 21 9.476 7.584 -11.396 138 HE ARG 21 HE ARG 21 7.379 7.618 -12.337 139 HH11 ARG 21 1HH1 ARG 21 7.393 9.538 -9.433 140 HH12 ARG 21 2HH1 ARG 21 5.825 10.218 -9.719 141 HH21 ARG 21 1HH2 ARG 21 5.315 8.508 -12.726 142 HH22 ARG 21 2HH2 ARG 21 4.644 9.630 -11.592 143 H GLU 22 H GLU 22 9.079 2.729 -10.217 144 HA GLU 22 HA GLU 22 10.056 2.162 -12.730 145 HB2 GLU 22 1HB GLU 22 10.614 -0.002 -11.923 146 HB3 GLU 22 2HB GLU 22 10.718 1.084 -10.545 147 HG2 GLU 22 1HG GLU 22 8.774 0.248 -9.580 148 HG3 GLU 22 2HG GLU 22 8.225 -0.477 -11.090 149 H ALA 23 H ALA 23 6.884 1.604 -11.458 150 HA ALA 23 HA ALA 23 6.155 -0.137 -13.688 151 HB1 ALA 23 1HB ALA 23 4.687 0.709 -11.202 152 HB2 ALA 23 2HB ALA 23 3.937 -0.228 -12.494 153 HB3 ALA 23 3HB ALA 23 5.310 -0.891 -11.610 154 H GLU 24 H GLU 24 6.076 3.151 -12.813 155 HA GLU 24 HA GLU 24 5.376 4.987 -13.980 156 HB2 GLU 24 1HB GLU 24 4.053 3.175 -15.989 157 HB3 GLU 24 2HB GLU 24 4.647 4.813 -16.223 158 HG2 GLU 24 1HG GLU 24 6.857 4.138 -16.334 159 HG3 GLU 24 2HG GLU 24 6.537 2.613 -15.510 160 H LYS 25 H LYS 25 3.900 3.971 -11.852 161 HA LYS 25 HA LYS 25 1.097 4.023 -12.597 162 HB2 LYS 25 1HB LYS 25 2.652 3.374 -10.162 163 HB3 LYS 25 2HB LYS 25 1.045 4.041 -9.899 164 HG2 LYS 25 1HG LYS 25 1.125 1.562 -9.941 165 HG3 LYS 25 2HG LYS 25 0.030 2.266 -11.133 166 HD2 LYS 25 1HD LYS 25 1.867 2.041 -12.822 167 HD3 LYS 25 2HD LYS 25 2.788 1.144 -11.612 168 HE2 LYS 25 1HE LYS 25 1.779 -0.575 -12.752 169 HE3 LYS 25 2HE LYS 25 0.606 -0.297 -11.465 170 HZ1 LYS 25 1HZ LYS 25 -0.538 -0.485 -13.540 171 HZ2 LYS 25 2HZ LYS 25 0.441 0.691 -14.259 172 HZ3 LYS 25 3HZ LYS 25 -0.637 1.125 -13.031 173 H SER 26 H SER 26 -0.419 5.492 -11.523 174 HA SER 26 HA SER 26 0.697 8.194 -11.411 175 HB2 SER 26 1HB SER 26 -2.030 7.069 -11.940 176 HB3 SER 26 2HB SER 26 -1.879 8.731 -11.371 177 HG SER 26 HG SER 26 -0.230 7.943 -13.473 178 H SER 27 H SER 27 0.526 5.964 -9.235 179 HA SER 27 HA SER 27 -0.697 7.639 -7.144 180 HB2 SER 27 1HB SER 27 -0.203 4.652 -7.178 181 HB3 SER 27 2HB SER 27 -0.863 5.548 -5.810 182 HG SER 27 HG SER 27 -2.019 5.355 -8.397 183 H SER 28 H SER 28 0.409 7.973 -5.200 184 HA SER 28 HA SER 28 2.930 6.875 -4.580 185 HB2 SER 28 1HB SER 28 4.457 8.557 -5.186 186 HB3 SER 28 2HB SER 28 3.431 8.393 -6.612 187 HG SER 28 HG SER 28 3.923 10.598 -5.512 188 H ILE 29 H ILE 29 3.889 7.841 -2.670 189 HA ILE 29 HA ILE 29 2.031 9.587 -1.196 190 HB ILE 29 HB ILE 29 2.736 8.353 0.882 191 HG12 ILE 29 1HG1 ILE 29 3.474 6.047 -0.871 192 HG13 ILE 29 2HG1 ILE 29 4.694 7.267 -0.521 193 HG21 ILE 29 1HG2 ILE 29 0.943 7.425 -1.237 194 HG22 ILE 29 2HG2 ILE 29 1.379 6.186 -0.060 195 HG23 ILE 29 3HG2 ILE 29 0.633 7.690 0.479 196 HD11 ILE 29 1HD1 ILE 29 4.479 6.858 1.841 197 HD12 ILE 29 2HD1 ILE 29 3.159 5.722 1.554 198 HD13 ILE 29 3HD1 ILE 29 4.790 5.341 0.997 199 H SER 30 H SER 30 3.002 10.854 0.510 200 HA SER 30 HA SER 30 5.788 11.546 -0.116 201 HB2 SER 30 1HB SER 30 3.448 13.103 0.913 202 HB3 SER 30 2HB SER 30 5.075 13.637 1.332 203 HG SER 30 HG SER 30 5.512 14.006 -0.769 204 H SER 31 H SER 31 3.645 10.548 2.453 205 HA SER 31 HA SER 31 5.816 9.647 4.062 206 HB2 SER 31 1HB SER 31 5.647 12.212 4.462 207 HB3 SER 31 2HB SER 31 4.201 11.809 5.388 208 HG SER 31 HG SER 31 6.757 10.659 5.829 209 H PHE 32 H PHE 32 5.057 8.653 6.099 210 HA PHE 32 HA PHE 32 3.045 6.861 5.784 211 HB2 PHE 32 1HB PHE 32 4.093 8.144 8.302 212 HB3 PHE 32 2HB PHE 32 2.896 6.852 8.343 213 HD1 PHE 32 2HD PHE 32 3.506 4.664 7.136 214 HD2 PHE 32 1HD PHE 32 6.349 7.641 8.219 215 HE1 PHE 32 2HE PHE 32 5.305 2.993 6.993 216 HE2 PHE 32 1HE PHE 32 8.153 5.974 8.076 217 HZ PHE 32 HZ PHE 32 7.633 3.646 7.463 218 H LYS 33 H LYS 33 2.733 10.204 6.709 219 HA LYS 33 HA LYS 33 -0.138 9.863 7.199 220 HB2 LYS 33 1HB LYS 33 1.791 12.103 7.782 221 HB3 LYS 33 2HB LYS 33 0.050 12.321 7.893 222 HG2 LYS 33 1HG LYS 33 1.262 10.038 9.352 223 HG3 LYS 33 2HG LYS 33 1.511 11.665 9.988 224 HD2 LYS 33 1HD LYS 33 -1.073 11.876 9.636 225 HD3 LYS 33 2HD LYS 33 -1.022 10.113 9.673 226 HE2 LYS 33 1HE LYS 33 -1.414 10.722 11.894 227 HE3 LYS 33 2HE LYS 33 0.316 10.387 11.839 228 HZ1 LYS 33 1HZ LYS 33 0.832 12.637 11.927 229 HZ2 LYS 33 2HZ LYS 33 -0.453 12.494 13.017 230 HZ3 LYS 33 3HZ LYS 33 -0.723 13.127 11.473 231 H ASP 34 H ASP 34 0.627 9.503 4.572 232 HA ASP 34 HA ASP 34 0.336 11.945 3.085 233 HB2 ASP 34 1HB ASP 34 1.630 10.336 1.975 234 HB3 ASP 34 2HB ASP 34 0.503 9.036 2.351 235 HA PRO 35 HA PRO 35 -4.070 12.121 3.073 236 HB2 PRO 35 1HB PRO 35 -4.385 13.769 0.937 237 HB3 PRO 35 2HB PRO 35 -3.821 14.336 2.514 238 HG2 PRO 35 1HG PRO 35 -2.239 13.674 0.060 239 HG3 PRO 35 2HG PRO 35 -2.057 15.043 1.172 240 HD2 PRO 35 1HD PRO 35 -0.460 12.859 1.278 241 HD3 PRO 35 2HD PRO 35 -0.899 13.792 2.723 242 H LYS 36 H LYS 36 -2.458 11.648 -0.069 243 HA LYS 36 HA LYS 36 -4.553 10.701 -1.568 244 HB2 LYS 36 1HB LYS 36 -1.617 10.172 -1.575 245 HB3 LYS 36 2HB LYS 36 -2.644 9.163 -2.584 246 HG2 LYS 36 1HG LYS 36 -1.829 10.960 -3.915 247 HG3 LYS 36 2HG LYS 36 -3.548 11.235 -3.625 248 HD2 LYS 36 1HD LYS 36 -1.605 12.443 -1.727 249 HD3 LYS 36 2HD LYS 36 -1.743 13.160 -3.334 250 HE2 LYS 36 1HE LYS 36 -4.085 12.644 -1.508 251 HE3 LYS 36 2HE LYS 36 -3.228 14.183 -1.599 252 HZ1 LYS 36 1HZ LYS 36 -4.661 12.851 -3.834 253 HZ2 LYS 36 2HZ LYS 36 -3.808 14.306 -3.953 254 HZ3 LYS 36 3HZ LYS 36 -5.192 14.214 -2.985 255 H ILE 37 H ILE 37 -2.798 9.071 0.967 256 HA ILE 37 HA ILE 37 -3.440 6.420 0.470 257 HB ILE 37 HB ILE 37 -3.159 7.855 3.109 258 HG12 ILE 37 1HG1 ILE 37 -1.266 6.056 1.579 259 HG13 ILE 37 2HG1 ILE 37 -1.156 7.812 1.664 260 HG21 ILE 37 1HG2 ILE 37 -4.067 5.170 2.543 261 HG22 ILE 37 2HG2 ILE 37 -2.588 5.165 3.503 262 HG23 ILE 37 3HG2 ILE 37 -4.009 6.039 4.076 263 HD11 ILE 37 1HD1 ILE 37 -0.245 7.783 3.716 264 HD12 ILE 37 2HD1 ILE 37 -1.219 6.411 4.248 265 HD13 ILE 37 3HD1 ILE 37 0.213 6.143 3.255 266 H SER 38 H SER 38 -5.415 8.996 1.774 267 HA SER 38 HA SER 38 -7.475 7.560 2.944 268 HB2 SER 38 1HB SER 38 -8.867 9.518 2.588 269 HB3 SER 38 2HB SER 38 -7.237 10.039 3.011 270 HG SER 38 HG SER 38 -7.429 9.760 0.353 271 H THR 39 H THR 39 -6.654 7.909 -0.391 272 HA THR 39 HA THR 39 -9.225 6.790 -1.246 273 HB THR 39 HB THR 39 -8.361 7.219 -3.565 274 HG1 THR 39 1HG THR 39 -6.346 8.742 -2.257 275 HG21 THR 39 1HG2 THR 39 -8.224 9.784 -2.033 276 HG22 THR 39 2HG2 THR 39 -9.719 8.849 -2.038 277 HG23 THR 39 3HG2 THR 39 -9.038 9.430 -3.557 278 H SER 40 H SER 40 -6.164 5.772 -0.379 279 HA SER 40 HA SER 40 -5.138 3.739 -0.451 280 HB2 SER 40 1HB SER 40 -7.574 2.730 -1.933 281 HB3 SER 40 2HB SER 40 -6.400 1.774 -1.029 282 HG SER 40 HG SER 40 -8.621 2.870 -0.129 283 H LEU 41 H LEU 41 -4.968 5.749 -2.617 284 HA LEU 41 HA LEU 41 -4.757 4.425 -5.115 285 HB2 LEU 41 1HB LEU 41 -3.835 7.041 -4.016 286 HB3 LEU 41 2HB LEU 41 -3.207 6.489 -5.567 287 HG LEU 41 HG LEU 41 -6.122 6.931 -4.921 288 HD11 LEU 41 1HD1 LEU 41 -4.850 9.020 -5.001 289 HD12 LEU 41 2HD1 LEU 41 -5.948 8.873 -6.373 290 HD13 LEU 41 3HD1 LEU 41 -4.223 8.577 -6.589 291 HD21 LEU 41 1HD2 LEU 41 -5.859 5.207 -6.579 292 HD22 LEU 41 2HD2 LEU 41 -4.708 6.192 -7.480 293 HD23 LEU 41 3HD2 LEU 41 -6.398 6.688 -7.372 294 HA PRO 42 HA PRO 42 -0.016 4.333 -4.110 295 HB2 PRO 42 1HB PRO 42 0.680 4.709 -1.513 296 HB3 PRO 42 2HB PRO 42 0.548 6.036 -2.674 297 HG2 PRO 42 1HG PRO 42 -1.418 5.122 -0.610 298 HG3 PRO 42 2HG PRO 42 -0.939 6.773 -1.044 299 HD2 PRO 42 1HD PRO 42 -3.233 5.641 -1.932 300 HD3 PRO 42 2HD PRO 42 -2.318 6.821 -2.891 301 H VAL 43 H VAL 43 -2.276 3.188 -1.658 302 HA VAL 43 HA VAL 43 -0.720 0.910 -0.908 303 HB VAL 43 HB VAL 43 -3.688 1.306 -0.517 304 HG11 VAL 43 1HG1 VAL 43 -1.659 -0.380 0.946 305 HG12 VAL 43 2HG1 VAL 43 -3.348 -0.182 1.415 306 HG13 VAL 43 3HG1 VAL 43 -2.942 -0.965 -0.112 307 HG21 VAL 43 1HG2 VAL 43 -2.889 2.080 1.803 308 HG22 VAL 43 2HG2 VAL 43 -1.336 2.362 1.016 309 HG23 VAL 43 3HG2 VAL 43 -2.774 3.218 0.460 310 H LEU 44 H LEU 44 -3.472 1.451 -3.070 311 HA LEU 44 HA LEU 44 -3.748 -1.302 -3.782 312 HB2 LEU 44 1HB LEU 44 -4.792 1.240 -5.009 313 HB3 LEU 44 2HB LEU 44 -5.168 -0.363 -5.642 314 HG LEU 44 HG LEU 44 -5.816 0.452 -2.818 315 HD11 LEU 44 1HD1 LEU 44 -7.883 0.432 -4.958 316 HD12 LEU 44 2HD1 LEU 44 -6.854 1.853 -4.785 317 HD13 LEU 44 3HD1 LEU 44 -7.844 1.311 -3.429 318 HD21 LEU 44 1HD2 LEU 44 -7.319 -1.409 -2.880 319 HD22 LEU 44 2HD2 LEU 44 -5.735 -1.966 -3.418 320 HD23 LEU 44 3HD2 LEU 44 -7.013 -1.666 -4.597 321 H ASP 45 H ASP 45 -2.607 1.535 -5.621 322 HA ASP 45 HA ASP 45 -1.709 0.200 -7.875 323 HB2 ASP 45 1HB ASP 45 -0.819 2.751 -6.552 324 HB3 ASP 45 2HB ASP 45 -0.042 2.170 -8.022 325 H LEU 46 H LEU 46 -0.102 0.703 -4.785 326 HA LEU 46 HA LEU 46 2.468 -0.152 -5.509 327 HB2 LEU 46 1HB LEU 46 2.262 0.943 -3.451 328 HB3 LEU 46 2HB LEU 46 0.961 -0.118 -2.918 329 HG LEU 46 HG LEU 46 2.547 -1.939 -2.613 330 HD11 LEU 46 1HD1 LEU 46 4.545 -1.978 -3.571 331 HD12 LEU 46 2HD1 LEU 46 4.997 -0.457 -2.801 332 HD13 LEU 46 3HD1 LEU 46 4.155 -0.445 -4.351 333 HD21 LEU 46 1HD2 LEU 46 3.051 0.684 -1.272 334 HD22 LEU 46 2HD2 LEU 46 4.040 -0.719 -0.868 335 HD23 LEU 46 3HD2 LEU 46 2.292 -0.774 -0.634 336 H ILE 47 H ILE 47 -0.331 -1.957 -4.307 337 HA ILE 47 HA ILE 47 0.963 -4.462 -4.125 338 HB ILE 47 HB ILE 47 -1.955 -3.770 -4.459 339 HG12 ILE 47 1HG1 ILE 47 -0.502 -4.818 -2.029 340 HG13 ILE 47 2HG1 ILE 47 -0.706 -3.100 -2.349 341 HG21 ILE 47 1HG2 ILE 47 -2.113 -6.211 -3.472 342 HG22 ILE 47 2HG2 ILE 47 -2.012 -5.927 -5.209 343 HG23 ILE 47 3HG2 ILE 47 -0.572 -6.397 -4.308 344 HD11 ILE 47 1HD1 ILE 47 -3.091 -4.887 -2.305 345 HD12 ILE 47 2HD1 ILE 47 -2.365 -4.340 -0.793 346 HD13 ILE 47 3HD1 ILE 47 -2.970 -3.162 -1.958 347 H ASP 48 H ASP 48 -1.105 -3.054 -6.656 348 HA ASP 48 HA ASP 48 -1.058 -5.208 -8.426 349 HB2 ASP 48 1HB ASP 48 -2.596 -3.355 -8.726 350 HB3 ASP 48 2HB ASP 48 -1.256 -2.247 -9.008 351 H ALA 49 H ALA 49 1.078 -2.367 -8.286 352 HA ALA 49 HA ALA 49 2.688 -2.652 -10.414 353 HB1 ALA 49 1HB ALA 49 3.061 -0.928 -8.767 354 HB2 ALA 49 2HB ALA 49 3.607 -2.124 -7.591 355 HB3 ALA 49 3HB ALA 49 4.561 -1.814 -9.041 356 H ILE 50 H ILE 50 2.909 -4.608 -7.464 357 HA ILE 50 HA ILE 50 5.111 -6.167 -8.452 358 HB ILE 50 HB ILE 50 3.291 -6.814 -6.133 359 HG12 ILE 50 1HG1 ILE 50 5.926 -5.339 -6.033 360 HG13 ILE 50 2HG1 ILE 50 4.364 -4.526 -6.028 361 HG21 ILE 50 1HG2 ILE 50 4.533 -8.636 -5.909 362 HG22 ILE 50 2HG2 ILE 50 5.463 -8.189 -7.338 363 HG23 ILE 50 3HG2 ILE 50 5.976 -7.635 -5.744 364 HD11 ILE 50 1HD1 ILE 50 4.766 -6.641 -4.009 365 HD12 ILE 50 2HD1 ILE 50 5.683 -5.148 -3.806 366 HD13 ILE 50 3HD1 ILE 50 3.923 -5.097 -3.891 367 H GLN 51 H GLN 51 1.696 -6.913 -7.735 368 HA GLN 51 HA GLN 51 1.903 -9.209 -9.563 369 HB2 GLN 51 1HB GLN 51 0.375 -8.718 -7.064 370 HB3 GLN 51 2HB GLN 51 -0.413 -9.685 -8.304 371 HG2 GLN 51 1HG GLN 51 2.373 -10.385 -7.575 372 HG3 GLN 51 2HG GLN 51 1.097 -10.758 -6.418 373 HE21 GLN 51 1HE2 GLN 51 -0.526 -12.228 -7.000 374 HE22 GLN 51 2HE2 GLN 51 -0.309 -13.349 -8.295 375 HA PRO 52 HA PRO 52 -0.594 -6.432 -12.119 376 HB2 PRO 52 1HB PRO 52 -0.151 -7.809 -14.416 377 HB3 PRO 52 2HB PRO 52 1.006 -6.650 -13.753 378 HG2 PRO 52 1HG PRO 52 0.992 -9.636 -13.554 379 HG3 PRO 52 2HG PRO 52 2.352 -8.542 -13.871 380 HD2 PRO 52 1HD PRO 52 1.888 -9.621 -11.430 381 HD3 PRO 52 2HD PRO 52 2.607 -8.012 -11.643 382 H GLY 53 H GLY 53 -2.731 -6.679 -11.908 383 HA2 GLY 53 1HA GLY 53 -4.644 -7.798 -13.044 384 HA3 GLY 53 2HA GLY 53 -3.890 -9.316 -12.577 385 H SER 54 H SER 54 -3.124 -8.329 -9.932 386 HA SER 54 HA SER 54 -5.228 -9.240 -8.413 387 HB2 SER 54 1HB SER 54 -4.146 -8.031 -6.498 388 HB3 SER 54 2HB SER 54 -3.029 -9.011 -7.447 389 HG SER 54 HG SER 54 -2.535 -7.007 -8.594 390 H ILE 55 H ILE 55 -4.349 -5.809 -8.856 391 HA ILE 55 HA ILE 55 -6.924 -4.975 -7.819 392 HB ILE 55 HB ILE 55 -4.676 -3.297 -8.941 393 HG12 ILE 55 1HG1 ILE 55 -4.012 -4.583 -6.941 394 HG13 ILE 55 2HG1 ILE 55 -4.085 -2.855 -6.612 395 HG21 ILE 55 1HG2 ILE 55 -6.260 -1.716 -8.956 396 HG22 ILE 55 2HG2 ILE 55 -7.360 -2.678 -7.969 397 HG23 ILE 55 3HG2 ILE 55 -6.087 -1.731 -7.201 398 HD11 ILE 55 1HD1 ILE 55 -6.442 -3.324 -5.731 399 HD12 ILE 55 2HD1 ILE 55 -5.946 -5.018 -5.718 400 HD13 ILE 55 3HD1 ILE 55 -5.067 -3.835 -4.751 401 H ASN 56 H ASN 56 -8.557 -4.011 -8.963 402 HA ASN 56 HA ASN 56 -8.248 -3.904 -11.889 403 HB2 ASN 56 1HB ASN 56 -9.603 -5.885 -11.004 404 HB3 ASN 56 2HB ASN 56 -10.815 -4.702 -10.522 405 HD21 ASN 56 1HD2 ASN 56 -12.258 -5.769 -11.957 406 HD22 ASN 56 2HD2 ASN 56 -12.195 -5.459 -13.656 407 H TYR 57 H TYR 57 -8.071 -1.730 -12.130 408 HA TYR 57 HA TYR 57 -9.211 0.296 -10.693 409 HB2 TYR 57 1HB TYR 57 -8.313 0.035 -13.518 410 HB3 TYR 57 2HB TYR 57 -9.264 1.456 -13.102 411 HD1 TYR 57 1HD TYR 57 -6.805 -0.308 -10.948 412 HD2 TYR 57 2HD TYR 57 -7.660 3.168 -13.249 413 HE1 TYR 57 1HE TYR 57 -4.787 0.776 -10.052 414 HE2 TYR 57 2HE TYR 57 -5.644 4.259 -12.361 415 HH TYR 57 HH TYR 57 -3.275 2.535 -10.530 416 H ASP 58 H ASP 58 -10.658 -1.490 -13.383 417 HA ASP 58 HA ASP 58 -12.918 -0.110 -13.934 418 HB2 ASP 58 1HB ASP 58 -12.097 -2.517 -14.660 419 HB3 ASP 58 2HB ASP 58 -13.248 -3.038 -13.432 420 H LEU 59 H LEU 59 -12.485 -2.287 -11.162 421 HA LEU 59 HA LEU 59 -15.100 -1.680 -10.111 422 HB2 LEU 59 1HB LEU 59 -12.850 -3.063 -8.676 423 HB3 LEU 59 2HB LEU 59 -14.578 -3.181 -8.349 424 HG LEU 59 HG LEU 59 -13.194 -4.266 -10.801 425 HD11 LEU 59 1HD1 LEU 59 -13.704 -5.379 -8.132 426 HD12 LEU 59 2HD1 LEU 59 -12.523 -5.847 -9.354 427 HD13 LEU 59 3HD1 LEU 59 -14.191 -6.406 -9.480 428 HD21 LEU 59 1HD2 LEU 59 -16.009 -3.943 -10.007 429 HD22 LEU 59 2HD2 LEU 59 -15.573 -5.532 -10.634 430 HD23 LEU 59 3HD2 LEU 59 -15.288 -4.090 -11.610 431 H LEU 60 H LEU 60 -11.804 -0.636 -9.583 432 HA LEU 60 HA LEU 60 -12.165 0.667 -7.115 433 HB2 LEU 60 1HB LEU 60 -10.255 1.400 -9.328 434 HB3 LEU 60 2HB LEU 60 -10.119 1.855 -7.630 435 HG LEU 60 HG LEU 60 -9.878 -0.940 -8.740 436 HD11 LEU 60 1HD1 LEU 60 -7.800 -0.283 -9.212 437 HD12 LEU 60 2HD1 LEU 60 -7.535 -0.285 -7.469 438 HD13 LEU 60 3HD1 LEU 60 -7.969 1.213 -8.293 439 HD21 LEU 60 1HD2 LEU 60 -10.128 0.144 -6.000 440 HD22 LEU 60 2HD2 LEU 60 -8.906 -1.103 -6.252 441 HD23 LEU 60 3HD2 LEU 60 -10.595 -1.429 -6.648 442 H LYS 61 H LYS 61 -12.475 2.864 -6.622 443 HA LYS 61 HA LYS 61 -14.258 4.224 -8.457 444 HB2 LYS 61 1HB LYS 61 -13.344 4.912 -5.659 445 HB3 LYS 61 2HB LYS 61 -14.518 5.846 -6.578 446 HG2 LYS 61 1HG LYS 61 -14.826 2.973 -5.730 447 HG3 LYS 61 2HG LYS 61 -15.606 4.368 -4.981 448 HD2 LYS 61 1HD LYS 61 -16.685 4.855 -7.176 449 HD3 LYS 61 2HD LYS 61 -16.010 3.344 -7.790 450 HE2 LYS 61 1HE LYS 61 -17.206 2.135 -5.986 451 HE3 LYS 61 2HE LYS 61 -17.945 3.658 -5.497 452 HZ1 LYS 61 1HZ LYS 61 -18.208 2.639 -8.258 453 HZ2 LYS 61 2HZ LYS 61 -19.171 3.777 -7.456 454 HZ3 LYS 61 3HZ LYS 61 -19.265 2.141 -7.033 455 H THR 62 H THR 62 -11.492 5.374 -6.518 456 HA THR 62 HA THR 62 -9.949 7.008 -6.908 457 HB THR 62 HB THR 62 -8.755 6.910 -8.994 458 HG1 THR 62 1HG THR 62 -10.624 5.149 -10.139 459 HG21 THR 62 1HG2 THR 62 -9.774 4.177 -8.207 460 HG22 THR 62 2HG2 THR 62 -8.390 5.022 -7.513 461 HG23 THR 62 3HG2 THR 62 -8.343 4.481 -9.190 462 H GLU 63 H GLU 63 -12.643 7.888 -6.973 463 HA GLU 63 HA GLU 63 -12.297 10.304 -8.559 464 HB2 GLU 63 1HB GLU 63 -14.737 10.100 -9.307 465 HB3 GLU 63 2HB GLU 63 -13.550 9.106 -10.141 466 HG2 GLU 63 1HG GLU 63 -14.187 7.220 -8.640 467 HG3 GLU 63 2HG GLU 63 -15.488 8.232 -8.015 468 H ASN 64 H ASN 64 -12.344 11.765 -6.970 469 HA ASN 64 HA ASN 64 -12.901 12.761 -4.967 470 HB2 ASN 64 1HB ASN 64 -15.359 13.442 -4.987 471 HB3 ASN 64 2HB ASN 64 -14.405 13.908 -6.393 472 HD21 ASN 64 1HD2 ASN 64 -14.733 12.845 -8.354 473 HD22 ASN 64 2HD2 ASN 64 -16.163 11.927 -8.663 474 H LEU 65 H LEU 65 -12.531 10.116 -4.434 475 HA LEU 65 HA LEU 65 -14.603 8.650 -3.349 476 HB2 LEU 65 1HB LEU 65 -11.704 8.862 -2.606 477 HB3 LEU 65 2HB LEU 65 -12.794 7.760 -1.768 478 HG LEU 65 HG LEU 65 -12.622 7.597 -4.737 479 HD11 LEU 65 1HD1 LEU 65 -10.358 7.498 -4.512 480 HD12 LEU 65 2HD1 LEU 65 -10.755 5.819 -4.147 481 HD13 LEU 65 3HD1 LEU 65 -10.433 6.955 -2.835 482 HD21 LEU 65 1HD2 LEU 65 -12.615 5.082 -3.747 483 HD22 LEU 65 2HD2 LEU 65 -14.076 5.998 -4.113 484 HD23 LEU 65 3HD2 LEU 65 -13.463 5.937 -2.460 485 H ASN 66 H ASN 66 -15.249 8.302 -1.132 486 HA ASN 66 HA ASN 66 -14.749 10.511 0.714 487 HB2 ASN 66 1HB ASN 66 -17.324 10.409 1.192 488 HB3 ASN 66 2HB ASN 66 -16.719 11.378 -0.148 489 HD21 ASN 66 1HD2 ASN 66 -18.608 8.686 0.796 490 HD22 ASN 66 2HD2 ASN 66 -19.155 8.234 -0.779 491 H ASP 67 H ASP 67 -15.811 10.031 2.892 492 HA ASP 67 HA ASP 67 -14.764 7.865 4.104 493 HB2 ASP 67 1HB ASP 67 -16.047 9.782 5.175 494 HB3 ASP 67 2HB ASP 67 -17.514 8.864 4.846 495 H ASP 68 H ASP 68 -17.598 7.900 2.092 496 HA ASP 68 HA ASP 68 -18.506 5.283 2.868 497 HB2 ASP 68 1HB ASP 68 -19.820 7.312 1.785 498 HB3 ASP 68 2HB ASP 68 -19.326 6.534 0.284 499 H GLU 69 H GLU 69 -17.303 6.550 -0.247 500 HA GLU 69 HA GLU 69 -16.848 4.028 -1.394 501 HB2 GLU 69 1HB GLU 69 -15.403 6.597 -2.061 502 HB3 GLU 69 2HB GLU 69 -15.607 5.198 -3.107 503 HG2 GLU 69 1HG GLU 69 -17.976 6.694 -2.054 504 HG3 GLU 69 2HG GLU 69 -17.102 7.250 -3.480 505 H LYS 70 H LYS 70 -14.494 6.331 -0.025 506 HA LYS 70 HA LYS 70 -12.153 5.051 -0.268 507 HB2 LYS 70 1HB LYS 70 -13.190 6.347 2.259 508 HB3 LYS 70 2HB LYS 70 -11.502 5.947 1.969 509 HG2 LYS 70 1HG LYS 70 -11.607 7.429 -0.058 510 HG3 LYS 70 2HG LYS 70 -13.195 7.955 0.507 511 HD2 LYS 70 1HD LYS 70 -12.298 8.932 2.449 512 HD3 LYS 70 2HD LYS 70 -10.758 8.089 2.262 513 HE2 LYS 70 1HE LYS 70 -10.116 9.457 0.455 514 HE3 LYS 70 2HE LYS 70 -11.751 10.077 0.238 515 HZ1 LYS 70 1HZ LYS 70 -11.397 11.671 1.726 516 HZ2 LYS 70 2HZ LYS 70 -9.753 11.281 1.646 517 HZ3 LYS 70 3HZ LYS 70 -10.725 10.605 2.854 518 H LEU 71 H LEU 71 -14.688 4.175 2.029 519 HA LEU 71 HA LEU 71 -13.280 2.215 3.451 520 HB2 LEU 71 1HB LEU 71 -15.299 2.932 4.385 521 HB3 LEU 71 2HB LEU 71 -16.188 2.666 2.886 522 HG LEU 71 HG LEU 71 -15.757 0.175 3.283 523 HD11 LEU 71 1HD1 LEU 71 -14.045 0.299 4.948 524 HD12 LEU 71 2HD1 LEU 71 -15.481 -0.407 5.688 525 HD13 LEU 71 3HD1 LEU 71 -15.068 1.279 6.001 526 HD21 LEU 71 1HD2 LEU 71 -17.786 -0.026 4.354 527 HD22 LEU 71 2HD2 LEU 71 -17.882 1.620 3.729 528 HD23 LEU 71 3HD2 LEU 71 -17.480 1.342 5.424 529 H ASN 72 H ASN 72 -15.595 1.772 0.771 530 HA ASN 72 HA ASN 72 -15.354 -0.939 0.417 531 HB2 ASN 72 1HB ASN 72 -15.663 1.164 -1.737 532 HB3 ASN 72 2HB ASN 72 -16.001 -0.552 -1.941 533 HD21 ASN 72 1HD2 ASN 72 -16.962 2.365 -0.251 534 HD22 ASN 72 2HD2 ASN 72 -18.581 1.861 0.086 535 H ASN 73 H ASN 73 -13.171 1.599 -0.646 536 HA ASN 73 HA ASN 73 -11.534 -0.161 -2.221 537 HB2 ASN 73 1HB ASN 73 -11.325 2.703 -1.341 538 HB3 ASN 73 2HB ASN 73 -9.939 1.895 -2.069 539 HD21 ASN 73 1HD2 ASN 73 -10.424 3.782 -3.565 540 HD22 ASN 73 2HD2 ASN 73 -11.455 3.440 -4.909 541 H ALA 74 H ALA 74 -11.556 1.032 1.063 542 HA ALA 74 HA ALA 74 -8.895 0.247 1.714 543 HB1 ALA 74 1HB ALA 74 -10.224 1.961 2.950 544 HB2 ALA 74 2HB ALA 74 -11.192 0.648 3.621 545 HB3 ALA 74 3HB ALA 74 -9.467 0.744 3.978 546 H LYS 75 H LYS 75 -12.066 -1.277 2.016 547 HA LYS 75 HA LYS 75 -11.198 -3.528 3.499 548 HB2 LYS 75 1HB LYS 75 -13.593 -3.192 1.684 549 HB3 LYS 75 2HB LYS 75 -13.347 -4.542 2.783 550 HG2 LYS 75 1HG LYS 75 -13.829 -3.307 4.633 551 HG3 LYS 75 2HG LYS 75 -13.252 -1.801 3.915 552 HD2 LYS 75 1HD LYS 75 -15.625 -1.641 4.116 553 HD3 LYS 75 2HD LYS 75 -15.252 -1.861 2.405 554 HE2 LYS 75 1HE LYS 75 -17.130 -3.252 3.006 555 HE3 LYS 75 2HE LYS 75 -15.737 -4.270 2.644 556 HZ1 LYS 75 1HZ LYS 75 -16.095 -5.220 4.602 557 HZ2 LYS 75 2HZ LYS 75 -17.224 -4.047 5.063 558 HZ3 LYS 75 3HZ LYS 75 -15.575 -3.787 5.336 559 H TYR 76 H TYR 76 -11.421 -2.840 0.059 560 HA TYR 76 HA TYR 76 -10.868 -5.515 -0.782 561 HB2 TYR 76 1HB TYR 76 -12.053 -3.790 -2.170 562 HB3 TYR 76 2HB TYR 76 -10.509 -2.968 -2.371 563 HD1 TYR 76 1HD TYR 76 -11.727 -6.500 -2.642 564 HD2 TYR 76 2HD TYR 76 -9.541 -3.315 -4.425 565 HE1 TYR 76 1HE TYR 76 -11.220 -7.937 -4.573 566 HE2 TYR 76 2HE TYR 76 -9.029 -4.743 -6.361 567 HH TYR 76 HH TYR 76 -10.186 -6.841 -7.458 568 H ALA 77 H ALA 77 -8.931 -2.529 -0.671 569 HA ALA 77 HA ALA 77 -6.538 -3.495 -1.638 570 HB1 ALA 77 1HB ALA 77 -5.913 -1.740 0.494 571 HB2 ALA 77 2HB ALA 77 -5.976 -1.389 -1.234 572 HB3 ALA 77 3HB ALA 77 -7.417 -1.181 -0.240 573 H ILE 78 H ILE 78 -7.417 -3.255 1.815 574 HA ILE 78 HA ILE 78 -5.224 -4.568 2.869 575 HB ILE 78 HB ILE 78 -8.067 -4.583 3.884 576 HG12 ILE 78 1HG1 ILE 78 -5.742 -2.934 4.866 577 HG13 ILE 78 2HG1 ILE 78 -6.815 -2.371 3.589 578 HG21 ILE 78 1HG2 ILE 78 -7.248 -5.318 5.990 579 HG22 ILE 78 2HG2 ILE 78 -6.612 -6.426 4.775 580 HG23 ILE 78 3HG2 ILE 78 -5.573 -5.177 5.459 581 HD11 ILE 78 1HD1 ILE 78 -7.283 -2.636 6.488 582 HD12 ILE 78 2HD1 ILE 78 -7.875 -1.433 5.341 583 HD13 ILE 78 3HD1 ILE 78 -8.638 -3.020 5.427 584 H SER 79 H SER 79 -8.212 -5.920 1.566 585 HA SER 79 HA SER 79 -7.701 -8.601 2.338 586 HB2 SER 79 1HB SER 79 -9.598 -7.232 0.493 587 HB3 SER 79 2HB SER 79 -9.351 -8.964 0.270 588 HG SER 79 HG SER 79 -9.720 -8.184 2.885 589 H MET 80 H MET 80 -7.020 -6.743 -0.589 590 HA MET 80 HA MET 80 -6.188 -8.745 -2.292 591 HB2 MET 80 1HB MET 80 -5.306 -5.895 -1.950 592 HB3 MET 80 2HB MET 80 -4.555 -6.927 -3.159 593 HG2 MET 80 1HG MET 80 -7.525 -6.639 -3.048 594 HG3 MET 80 2HG MET 80 -6.531 -5.414 -3.830 595 HE1 MET 80 1HE MET 80 -8.014 -9.251 -5.524 596 HE2 MET 80 2HE MET 80 -7.187 -9.489 -3.984 597 HE3 MET 80 3HE MET 80 -8.521 -8.341 -4.099 598 H ALA 81 H ALA 81 -4.092 -6.854 -0.109 599 HA ALA 81 HA ALA 81 -1.677 -7.989 -0.502 600 HB1 ALA 81 1HB ALA 81 -1.425 -7.784 2.092 601 HB2 ALA 81 2HB ALA 81 -1.653 -6.342 1.103 602 HB3 ALA 81 3HB ALA 81 -3.016 -7.030 1.986 603 H ARG 82 H ARG 82 -4.038 -9.283 1.845 604 HA ARG 82 HA ARG 82 -2.598 -11.624 2.425 605 HB2 ARG 82 1HB ARG 82 -4.394 -10.773 3.862 606 HB3 ARG 82 2HB ARG 82 -5.574 -11.122 2.605 607 HG2 ARG 82 1HG ARG 82 -3.871 -13.352 3.570 608 HG3 ARG 82 2HG ARG 82 -5.156 -12.764 4.627 609 HD2 ARG 82 1HD ARG 82 -5.597 -13.544 1.752 610 HD3 ARG 82 2HD ARG 82 -5.783 -14.665 3.099 611 HE ARG 82 HE ARG 82 -7.584 -12.555 2.334 612 HH11 ARG 82 1HH1 ARG 82 -6.514 -14.621 4.923 613 HH12 ARG 82 2HH1 ARG 82 -7.995 -14.495 5.812 614 HH21 ARG 82 1HH2 ARG 82 -9.541 -12.381 3.494 615 HH22 ARG 82 2HH2 ARG 82 -9.717 -13.221 4.998 616 H LYS 83 H LYS 83 -5.200 -10.994 0.102 617 HA LYS 83 HA LYS 83 -5.668 -13.549 -0.823 618 HB2 LYS 83 1HB LYS 83 -6.644 -11.162 -1.491 619 HB3 LYS 83 2HB LYS 83 -5.529 -11.356 -2.838 620 HG2 LYS 83 1HG LYS 83 -7.322 -12.333 -3.786 621 HG3 LYS 83 2HG LYS 83 -6.725 -13.748 -2.918 622 HD2 LYS 83 1HD LYS 83 -8.684 -11.848 -1.666 623 HD3 LYS 83 2HD LYS 83 -9.216 -13.171 -2.706 624 HE2 LYS 83 1HE LYS 83 -7.549 -13.453 -0.207 625 HE3 LYS 83 2HE LYS 83 -9.274 -13.790 -0.334 626 HZ1 LYS 83 1HZ LYS 83 -8.759 -15.510 -1.975 627 HZ2 LYS 83 2HZ LYS 83 -8.010 -15.820 -0.490 628 HZ3 LYS 83 3HZ LYS 83 -7.104 -15.209 -1.782 629 H ILE 84 H ILE 84 -3.273 -11.223 -2.065 630 HA ILE 84 HA ILE 84 -2.138 -13.091 -3.904 631 HB ILE 84 HB ILE 84 -0.389 -11.426 -4.255 632 HG12 ILE 84 1HG1 ILE 84 -1.708 -9.746 -2.125 633 HG13 ILE 84 2HG1 ILE 84 -0.313 -10.767 -1.794 634 HG21 ILE 84 1HG2 ILE 84 -3.144 -10.217 -4.057 635 HG22 ILE 84 2HG2 ILE 84 -1.808 -9.568 -5.005 636 HG23 ILE 84 3HG2 ILE 84 -2.501 -11.136 -5.417 637 HD11 ILE 84 1HD1 ILE 84 -0.197 -8.167 -2.541 638 HD12 ILE 84 2HD1 ILE 84 1.106 -9.336 -2.759 639 HD13 ILE 84 3HD1 ILE 84 0.006 -8.983 -4.091 640 H GLY 85 H GLY 85 -1.474 -12.141 -0.600 641 HA2 GLY 85 1HA GLY 85 -0.395 -14.128 0.599 642 HA3 GLY 85 2HA GLY 85 0.888 -13.906 -0.582 643 H ALA 86 H ALA 86 -0.482 -12.828 2.378 644 HA ALA 86 HA ALA 86 1.882 -11.505 3.173 645 HB1 ALA 86 1HB ALA 86 0.874 -9.842 1.535 646 HB2 ALA 86 2HB ALA 86 -0.391 -9.589 2.738 647 HB3 ALA 86 3HB ALA 86 1.290 -9.231 3.137 648 H ARG 87 H ARG 87 1.539 -10.298 5.289 649 HA ARG 87 HA ARG 87 -0.688 -11.511 6.789 650 HB2 ARG 87 1HB ARG 87 0.947 -11.464 8.760 651 HB3 ARG 87 2HB ARG 87 1.199 -12.696 7.531 652 HG2 ARG 87 1HG ARG 87 2.646 -10.112 7.267 653 HG3 ARG 87 2HG ARG 87 3.193 -11.273 8.478 654 HD2 ARG 87 1HD ARG 87 3.526 -12.955 6.811 655 HD3 ARG 87 2HD ARG 87 2.756 -11.957 5.577 656 HE ARG 87 HE ARG 87 4.871 -10.468 6.473 657 HH11 ARG 87 1HH1 ARG 87 4.470 -13.637 5.090 658 HH12 ARG 87 2HH1 ARG 87 6.028 -13.646 4.332 659 HH21 ARG 87 1HH2 ARG 87 6.925 -10.468 5.481 660 HH22 ARG 87 2HH2 ARG 87 7.424 -11.843 4.556 661 H VAL 88 H VAL 88 -1.933 -9.622 6.587 662 HA VAL 88 HA VAL 88 -0.896 -7.288 8.060 663 HB VAL 88 HB VAL 88 -1.324 -6.646 5.794 664 HG11 VAL 88 1HG1 VAL 88 -2.758 -8.475 5.116 665 HG12 VAL 88 2HG1 VAL 88 -4.058 -7.872 6.147 666 HG13 VAL 88 3HG1 VAL 88 -3.536 -6.936 4.746 667 HG21 VAL 88 1HG2 VAL 88 -2.192 -4.730 6.507 668 HG22 VAL 88 2HG2 VAL 88 -3.789 -5.466 6.634 669 HG23 VAL 88 3HG2 VAL 88 -2.678 -5.530 8.002 670 H TYR 89 H TYR 89 -2.039 -6.500 9.751 671 HA TYR 89 HA TYR 89 -4.685 -7.660 10.295 672 HB2 TYR 89 1HB TYR 89 -2.475 -7.303 12.329 673 HB3 TYR 89 2HB TYR 89 -4.104 -7.874 12.671 674 HD1 TYR 89 2HD TYR 89 -0.922 -8.717 10.999 675 HD2 TYR 89 1HD TYR 89 -4.724 -10.142 12.274 676 HE1 TYR 89 2HE TYR 89 -0.196 -11.027 10.568 677 HE2 TYR 89 1HE TYR 89 -4.007 -12.455 11.848 678 HH TYR 89 HH TYR 89 -2.097 -13.508 10.159 679 H ALA 90 H ALA 90 -5.577 -5.692 9.535 680 HA ALA 90 HA ALA 90 -5.600 -3.606 11.572 681 HB1 ALA 90 1HB ALA 90 -4.841 -3.124 8.700 682 HB2 ALA 90 2HB ALA 90 -5.397 -1.844 9.781 683 HB3 ALA 90 3HB ALA 90 -3.919 -2.731 10.152 684 H LEU 91 H LEU 91 -7.189 -1.762 10.549 685 HA LEU 91 HA LEU 91 -9.572 -3.219 9.609 686 HB2 LEU 91 1HB LEU 91 -9.512 -2.361 12.035 687 HB3 LEU 91 2HB LEU 91 -9.697 -0.760 11.321 688 HG LEU 91 HG LEU 91 -11.804 -1.646 10.223 689 HD11 LEU 91 1HD1 LEU 91 -11.376 -4.017 10.461 690 HD12 LEU 91 2HD1 LEU 91 -12.852 -3.579 11.322 691 HD13 LEU 91 3HD1 LEU 91 -11.360 -3.863 12.218 692 HD21 LEU 91 1HD2 LEU 91 -11.951 -1.704 13.220 693 HD22 LEU 91 2HD2 LEU 91 -13.123 -1.068 12.065 694 HD23 LEU 91 3HD2 LEU 91 -11.602 -0.217 12.338 695 HA PRO 92 HA PRO 92 -9.503 -0.391 6.214 696 HB2 PRO 92 1HB PRO 92 -12.008 -0.881 5.287 697 HB3 PRO 92 2HB PRO 92 -10.662 -2.003 5.059 698 HG2 PRO 92 1HG PRO 92 -12.859 -2.067 7.091 699 HG3 PRO 92 2HG PRO 92 -12.177 -3.399 6.140 700 HD2 PRO 92 1HD PRO 92 -11.491 -2.953 8.721 701 HD3 PRO 92 2HD PRO 92 -10.358 -3.631 7.536 702 H GLU 93 H GLU 93 -11.741 -0.249 8.842 703 HA GLU 93 HA GLU 93 -13.131 2.103 8.001 704 HB2 GLU 93 1HB GLU 93 -12.917 0.599 10.592 705 HB3 GLU 93 2HB GLU 93 -13.721 2.162 10.528 706 HG2 GLU 93 1HG GLU 93 -14.517 0.053 8.587 707 HG3 GLU 93 2HG GLU 93 -15.067 -0.065 10.257 708 H ASP 94 H ASP 94 -10.092 1.491 9.458 709 HA ASP 94 HA ASP 94 -9.854 4.210 10.498 710 HB2 ASP 94 1HB ASP 94 -8.211 1.712 10.759 711 HB3 ASP 94 2HB ASP 94 -7.497 3.280 11.124 712 H LEU 95 H LEU 95 -8.587 2.134 7.962 713 HA LEU 95 HA LEU 95 -6.490 3.748 7.064 714 HB2 LEU 95 1HB LEU 95 -6.617 1.541 6.251 715 HB3 LEU 95 2HB LEU 95 -8.267 1.767 5.672 716 HG LEU 95 HG LEU 95 -7.373 3.322 3.940 717 HD11 LEU 95 1HD1 LEU 95 -5.243 3.745 5.296 718 HD12 LEU 95 2HD1 LEU 95 -5.087 3.577 3.548 719 HD13 LEU 95 3HD1 LEU 95 -4.660 2.231 4.604 720 HD21 LEU 95 1HD2 LEU 95 -5.859 1.092 3.106 721 HD22 LEU 95 2HD2 LEU 95 -7.520 1.504 2.678 722 HD23 LEU 95 3HD2 LEU 95 -7.197 0.476 4.075 723 H VAL 96 H VAL 96 -9.939 3.841 6.367 724 HA VAL 96 HA VAL 96 -9.957 5.589 4.207 725 HB VAL 96 HB VAL 96 -11.939 5.175 6.434 726 HG11 VAL 96 1HG1 VAL 96 -12.687 7.244 5.922 727 HG12 VAL 96 2HG1 VAL 96 -11.887 7.262 4.349 728 HG13 VAL 96 3HG1 VAL 96 -13.415 6.405 4.553 729 HG21 VAL 96 1HG2 VAL 96 -11.396 3.974 3.846 730 HG22 VAL 96 2HG2 VAL 96 -12.388 3.384 5.179 731 HG23 VAL 96 3HG2 VAL 96 -13.070 4.506 4.002 732 H GLU 97 H GLU 97 -9.440 6.211 7.599 733 HA GLU 97 HA GLU 97 -9.493 9.104 7.128 734 HB2 GLU 97 1HB GLU 97 -9.456 7.473 9.668 735 HB3 GLU 97 2HB GLU 97 -9.287 9.223 9.643 736 HG2 GLU 97 1HG GLU 97 -11.507 9.178 8.319 737 HG3 GLU 97 2HG GLU 97 -11.665 7.548 8.970 738 H VAL 98 H VAL 98 -7.355 7.259 6.213 739 HA VAL 98 HA VAL 98 -5.075 7.032 6.233 740 HB VAL 98 HB VAL 98 -5.203 9.969 6.924 741 HG11 VAL 98 1HG1 VAL 98 -3.000 8.388 6.765 742 HG12 VAL 98 2HG1 VAL 98 -3.134 8.964 5.103 743 HG13 VAL 98 3HG1 VAL 98 -3.017 10.118 6.432 744 HG21 VAL 98 1HG2 VAL 98 -4.850 9.285 4.123 745 HG22 VAL 98 2HG2 VAL 98 -6.395 8.727 4.766 746 HG23 VAL 98 3HG2 VAL 98 -5.959 10.432 4.874 747 H ASN 99 H ASN 99 -5.859 5.975 8.514 748 HA ASN 99 HA ASN 99 -4.574 7.271 10.769 749 HB2 ASN 99 1HB ASN 99 -6.337 4.900 10.389 750 HB3 ASN 99 2HB ASN 99 -5.284 4.917 11.799 751 HD21 ASN 99 1HD2 ASN 99 -8.201 5.943 10.502 752 HD22 ASN 99 2HD2 ASN 99 -8.656 7.056 11.742 753 HA PRO 100 HA PRO 100 -0.718 5.229 9.803 754 HB2 PRO 100 1HB PRO 100 0.674 6.327 11.858 755 HB3 PRO 100 2HB PRO 100 0.302 7.208 10.371 756 HG2 PRO 100 1HG PRO 100 -1.077 7.307 13.027 757 HG3 PRO 100 2HG PRO 100 -0.647 8.640 11.938 758 HD2 PRO 100 1HD PRO 100 -3.151 7.620 12.074 759 HD3 PRO 100 2HD PRO 100 -2.470 8.280 10.574 760 H LYS 101 H LYS 101 -2.834 4.713 12.333 761 HA LYS 101 HA LYS 101 -1.126 2.998 13.915 762 HB2 LYS 101 1HB LYS 101 -4.129 3.279 14.074 763 HB3 LYS 101 2HB LYS 101 -3.050 2.647 15.312 764 HG2 LYS 101 1HG LYS 101 -2.977 5.487 14.320 765 HG3 LYS 101 2HG LYS 101 -3.888 4.954 15.735 766 HD2 LYS 101 1HD LYS 101 -0.935 4.464 15.433 767 HD3 LYS 101 2HD LYS 101 -1.582 5.935 16.162 768 HE2 LYS 101 1HE LYS 101 -2.719 4.626 17.857 769 HE3 LYS 101 2HE LYS 101 -2.173 3.131 17.101 770 HZ1 LYS 101 1HZ LYS 101 0.026 4.832 17.643 771 HZ2 LYS 101 2HZ LYS 101 -0.264 3.258 18.191 772 HZ3 LYS 101 3HZ LYS 101 -0.872 4.580 19.054 773 H MET 102 H MET 102 -3.344 2.695 11.272 774 HA MET 102 HA MET 102 -3.365 -0.226 11.536 775 HB2 MET 102 1HB MET 102 -5.118 1.758 10.172 776 HB3 MET 102 2HB MET 102 -4.986 0.155 9.458 777 HG2 MET 102 1HG MET 102 -6.863 0.085 10.861 778 HG3 MET 102 2HG MET 102 -5.586 -0.770 11.723 779 HE1 MET 102 1HE MET 102 -6.940 -0.762 13.680 780 HE2 MET 102 2HE MET 102 -5.489 -0.205 14.515 781 HE3 MET 102 3HE MET 102 -7.047 0.552 14.853 782 H VAL 103 H VAL 103 -2.730 2.318 9.133 783 HA VAL 103 HA VAL 103 -1.877 0.776 7.016 784 HB VAL 103 HB VAL 103 -0.830 3.461 7.917 785 HG11 VAL 103 1HG1 VAL 103 -0.370 3.446 5.272 786 HG12 VAL 103 2HG1 VAL 103 0.839 2.979 6.470 787 HG13 VAL 103 3HG1 VAL 103 -0.097 1.741 5.632 788 HG21 VAL 103 1HG2 VAL 103 -2.526 3.208 5.527 789 HG22 VAL 103 2HG2 VAL 103 -3.322 2.839 7.058 790 HG23 VAL 103 3HG2 VAL 103 -2.555 4.408 6.818 791 H MET 104 H MET 104 -0.406 1.137 10.070 792 HA MET 104 HA MET 104 2.299 0.845 9.528 793 HB2 MET 104 1HB MET 104 2.481 -0.147 11.773 794 HB3 MET 104 2HB MET 104 1.457 1.283 11.772 795 HG2 MET 104 1HG MET 104 0.168 -0.081 13.035 796 HG3 MET 104 2HG MET 104 -0.442 -0.522 11.441 797 HE1 MET 104 1HE MET 104 -1.413 -2.508 12.979 798 HE2 MET 104 2HE MET 104 -0.442 -3.867 13.545 799 HE3 MET 104 3HE MET 104 -0.391 -2.328 14.405 800 H THR 105 H THR 105 -0.280 -1.468 9.303 801 HA THR 105 HA THR 105 1.598 -3.686 8.972 802 HB THR 105 HB THR 105 -0.642 -4.985 8.682 803 HG1 THR 105 1HG THR 105 -2.432 -3.938 9.234 804 HG21 THR 105 1HG2 THR 105 -0.207 -5.679 10.761 805 HG22 THR 105 2HG2 THR 105 -0.670 -4.120 11.443 806 HG23 THR 105 3HG2 THR 105 0.977 -4.378 10.867 807 H VAL 106 H VAL 106 -1.112 -2.171 7.225 808 HA VAL 106 HA VAL 106 -1.227 -3.555 4.920 809 HB VAL 106 HB VAL 106 -1.287 -0.568 5.288 810 HG11 VAL 106 1HG1 VAL 106 -1.951 -2.099 2.776 811 HG12 VAL 106 2HG1 VAL 106 -2.193 -0.371 3.035 812 HG13 VAL 106 3HG1 VAL 106 -0.560 -1.038 2.998 813 HG21 VAL 106 1HG2 VAL 106 -3.071 -2.411 6.068 814 HG22 VAL 106 2HG2 VAL 106 -3.524 -0.785 5.560 815 HG23 VAL 106 3HG2 VAL 106 -3.641 -2.129 4.423 816 H PHE 107 H PHE 107 1.275 -1.195 5.746 817 HA PHE 107 HA PHE 107 2.655 -1.645 3.230 818 HB2 PHE 107 1HB PHE 107 3.047 0.205 5.556 819 HB3 PHE 107 2HB PHE 107 4.368 -0.069 4.424 820 HD1 PHE 107 2HD PHE 107 3.046 -0.218 1.857 821 HD2 PHE 107 1HD PHE 107 2.241 2.326 5.173 822 HE1 PHE 107 2HE PHE 107 2.086 1.458 0.333 823 HE2 PHE 107 1HE PHE 107 1.279 4.006 3.654 824 HZ PHE 107 HZ PHE 107 1.201 3.574 1.231 825 H ALA 108 H ALA 108 3.434 -1.973 6.693 826 HA ALA 108 HA ALA 108 5.888 -3.087 6.650 827 HB1 ALA 108 1HB ALA 108 4.980 -4.601 8.576 828 HB2 ALA 108 2HB ALA 108 5.036 -2.848 8.773 829 HB3 ALA 108 3HB ALA 108 3.514 -3.641 8.369 830 H CYS 109 H CYS 109 2.897 -5.015 6.373 831 HA CYS 109 HA CYS 109 4.095 -7.477 5.902 832 HB2 CYS 109 1HB CYS 109 1.950 -8.169 4.946 833 HB3 CYS 109 2HB CYS 109 1.702 -7.204 6.396 834 HG CYS 109 HG CYS 109 1.258 -4.833 4.759 835 H LEU 110 H LEU 110 3.531 -4.796 3.744 836 HA LEU 110 HA LEU 110 4.102 -6.300 1.353 837 HB2 LEU 110 1HB LEU 110 3.825 -3.345 1.869 838 HB3 LEU 110 2HB LEU 110 4.102 -4.047 0.276 839 HG LEU 110 HG LEU 110 1.685 -4.606 1.993 840 HD11 LEU 110 1HD1 LEU 110 1.697 -2.279 1.327 841 HD12 LEU 110 2HD1 LEU 110 0.483 -3.166 0.408 842 HD13 LEU 110 3HD1 LEU 110 2.018 -2.734 -0.346 843 HD21 LEU 110 1HD2 LEU 110 2.246 -6.396 0.428 844 HD22 LEU 110 2HD2 LEU 110 2.286 -5.232 -0.897 845 HD23 LEU 110 3HD2 LEU 110 0.769 -5.562 -0.057 846 H MET 111 H MET 111 5.854 -4.236 3.578 847 HA MET 111 HA MET 111 8.117 -3.653 2.089 848 HB2 MET 111 1HB MET 111 7.534 -3.944 4.990 849 HB3 MET 111 2HB MET 111 9.225 -3.922 4.508 850 HG2 MET 111 1HG MET 111 7.439 -1.812 3.432 851 HG3 MET 111 2HG MET 111 7.917 -1.719 5.126 852 HE1 MET 111 1HE MET 111 9.730 0.134 1.840 853 HE2 MET 111 2HE MET 111 9.934 -1.530 1.296 854 HE3 MET 111 3HE MET 111 8.346 -0.957 1.809 855 H GLY 112 H GLY 112 7.161 -6.638 3.630 856 HA2 GLY 112 1HA GLY 112 9.429 -8.077 3.938 857 HA3 GLY 112 2HA GLY 112 7.968 -8.774 3.255 858 H LYS 113 H LYS 113 8.215 -6.873 0.927 859 HA LYS 113 HA LYS 113 9.746 -8.630 -0.741 860 HB2 LYS 113 1HB LYS 113 7.682 -7.565 -1.543 861 HB3 LYS 113 2HB LYS 113 8.431 -5.982 -1.379 862 HG2 LYS 113 1HG LYS 113 8.780 -6.297 -3.590 863 HG3 LYS 113 2HG LYS 113 10.230 -7.102 -2.983 864 HD2 LYS 113 1HD LYS 113 7.756 -8.724 -3.268 865 HD3 LYS 113 2HD LYS 113 8.607 -8.254 -4.741 866 HE2 LYS 113 1HE LYS 113 9.710 -10.195 -4.308 867 HE3 LYS 113 2HE LYS 113 10.698 -9.104 -3.339 868 HZ1 LYS 113 1HZ LYS 113 8.627 -9.880 -1.701 869 HZ2 LYS 113 2HZ LYS 113 10.234 -10.398 -1.617 870 HZ3 LYS 113 3HZ LYS 113 9.102 -11.295 -2.497 871 H GLY 114 H GLY 114 10.102 -5.278 0.373 872 HA2 GLY 114 1HA GLY 114 12.474 -4.714 -1.049 873 HA3 GLY 114 2HA GLY 114 11.914 -3.867 0.386 874 H MET 115 H MET 115 11.933 -6.062 2.177 875 HA MET 115 HA MET 115 14.419 -5.945 3.284 876 HB2 MET 115 1HB MET 115 12.212 -7.935 3.423 877 HB3 MET 115 2HB MET 115 13.766 -8.403 4.099 878 HG2 MET 115 1HG MET 115 12.827 -7.494 5.946 879 HG3 MET 115 2HG MET 115 13.567 -6.046 5.269 880 HE1 MET 115 1HE MET 115 9.769 -7.291 6.466 881 HE2 MET 115 2HE MET 115 11.297 -6.906 7.258 882 HE3 MET 115 3HE MET 115 10.044 -5.672 7.114 883 H LYS 116 H LYS 116 16.217 -7.397 3.382 884 HA LYS 116 HA LYS 116 16.584 -8.970 0.916 885 HB2 LYS 116 1HB LYS 116 18.496 -7.181 2.396 886 HB3 LYS 116 2HB LYS 116 19.074 -8.441 1.313 887 HG2 LYS 116 1HG LYS 116 19.040 -6.615 -0.074 888 HG3 LYS 116 2HG LYS 116 17.460 -7.332 -0.400 889 HD2 LYS 116 1HD LYS 116 16.973 -5.073 -0.118 890 HD3 LYS 116 2HD LYS 116 16.613 -5.764 1.466 891 HE2 LYS 116 1HE LYS 116 19.359 -4.737 0.955 892 HE3 LYS 116 2HE LYS 116 18.061 -3.570 1.206 893 HZ1 LYS 116 1HZ LYS 116 19.453 -5.078 3.124 894 HZ2 LYS 116 2HZ LYS 116 17.824 -5.529 3.172 895 HZ3 LYS 116 3HZ LYS 116 18.258 -3.906 3.370 896 H ARG 117 H ARG 117 17.928 -10.846 1.070 897 HA ARG 117 HA ARG 117 18.284 -11.868 3.807 898 HB2 ARG 117 1HB ARG 117 17.200 -13.396 1.434 899 HB3 ARG 117 2HB ARG 117 17.603 -14.107 2.991 900 HG2 ARG 117 1HG ARG 117 15.927 -12.467 3.987 901 HG3 ARG 117 2HG ARG 117 15.391 -12.196 2.328 902 HD2 ARG 117 1HD ARG 117 14.623 -14.377 2.087 903 HD3 ARG 117 2HD ARG 117 15.614 -14.974 3.418 904 HE ARG 117 HE ARG 117 13.938 -14.409 4.872 905 HH11 ARG 117 1HH1 ARG 117 13.389 -12.819 1.824 906 HH12 ARG 117 2HH1 ARG 117 11.818 -12.234 2.263 907 HH21 ARG 117 1HH2 ARG 117 11.872 -13.645 5.462 908 HH22 ARG 117 2HH2 ARG 117 10.957 -12.704 4.334 909 H VAL 118 H VAL 118 19.771 -13.799 3.855 910 HA VAL 118 HA VAL 118 21.808 -13.689 1.741 911 HB VAL 118 HB VAL 118 22.397 -13.588 4.703 912 HG11 VAL 118 1HG1 VAL 118 24.765 -13.143 3.511 913 HG12 VAL 118 2HG1 VAL 118 24.220 -14.740 4.027 914 HG13 VAL 118 3HG1 VAL 118 24.041 -14.247 2.343 915 HG21 VAL 118 1HG2 VAL 118 22.090 -11.390 4.369 916 HG22 VAL 118 2HG2 VAL 118 23.659 -11.459 3.565 917 HG23 VAL 118 3HG2 VAL 118 22.176 -11.543 2.614 918 H SER 119 H SER 119 21.709 -15.679 0.906 919 HA SER 119 HA SER 119 21.579 -17.952 0.733 920 HB2 SER 119 1HB SER 119 23.263 -17.863 3.247 921 HB3 SER 119 2HB SER 119 23.189 -19.177 2.073 922 HG SER 119 HG SER 119 23.963 -17.570 0.517 923 H GLY 120 H GLY 120 19.329 -16.892 1.950 924 HA2 GLY 120 1HA GLY 120 18.550 -17.873 4.406 925 HA3 GLY 120 2HA GLY 120 17.455 -17.635 3.053 926 HA PRO 121 HA PRO 121 18.336 -22.248 4.110 927 HB2 PRO 121 1HB PRO 121 16.397 -22.741 5.944 928 HB3 PRO 121 2HB PRO 121 18.036 -22.248 6.387 929 HG2 PRO 121 1HG PRO 121 15.547 -20.594 6.189 930 HG3 PRO 121 2HG PRO 121 16.810 -20.571 7.435 931 HD2 PRO 121 1HD PRO 121 16.692 -18.739 5.443 932 HD3 PRO 121 2HD PRO 121 18.227 -19.284 6.151 933 H SER 122 H SER 122 15.548 -20.259 3.543 934 HA SER 122 HA SER 122 13.949 -22.467 2.539 935 HB2 SER 122 1HB SER 122 12.187 -20.850 2.254 936 HB3 SER 122 2HB SER 122 12.938 -20.559 3.822 937 HG SER 122 HG SER 122 12.554 -18.657 2.464 938 H SER 123 H SER 123 14.202 -23.202 0.547 939 HA SER 123 HA SER 123 15.595 -21.641 -1.447 940 HB2 SER 123 1HB SER 123 15.872 -24.155 -1.068 941 HB3 SER 123 2HB SER 123 14.312 -24.340 -1.869 942 HG SER 123 HG SER 123 16.781 -23.628 -2.918 943 H GLY 124 H GLY 124 14.619 -20.280 -2.782 944 HA2 GLY 124 1HA GLY 124 11.750 -20.228 -3.021 945 HA3 GLY 124 2HA GLY 124 12.884 -19.133 -3.798 Start of MODEL 13 1 H1 GLY 1 H GLY 1 14.147 15.946 0.120 2 HA2 GLY 1 1HA GLY 1 16.001 14.619 1.342 3 HA3 GLY 1 2HA GLY 1 14.846 15.485 2.343 4 H SER 2 H SER 2 16.433 12.806 2.441 5 HA SER 2 HA SER 2 14.169 11.040 3.060 6 HB2 SER 2 1HB SER 2 15.992 10.254 1.487 7 HB3 SER 2 2HB SER 2 17.085 10.265 2.872 8 HG SER 2 HG SER 2 15.139 8.928 3.777 9 H SER 3 H SER 3 13.602 11.843 5.077 10 HA SER 3 HA SER 3 15.534 12.205 7.163 11 HB2 SER 3 1HB SER 3 12.509 12.105 7.243 12 HB3 SER 3 2HB SER 3 13.532 12.542 8.611 13 HG SER 3 HG SER 3 14.407 14.127 6.891 14 H GLY 4 H GLY 4 16.599 10.225 7.380 15 HA2 GLY 4 1HA GLY 4 16.053 8.516 9.330 16 HA3 GLY 4 2HA GLY 4 15.021 7.867 8.065 17 H SER 5 H SER 5 18.217 8.109 9.289 18 HA SER 5 HA SER 5 19.240 6.583 6.986 19 HB2 SER 5 1HB SER 5 21.500 7.337 7.727 20 HB3 SER 5 2HB SER 5 20.441 8.671 7.267 21 HG SER 5 HG SER 5 21.539 8.055 9.707 22 H SER 6 H SER 6 17.760 5.248 8.909 23 HA SER 6 HA SER 6 19.641 3.263 9.749 24 HB2 SER 6 1HB SER 6 19.205 3.381 12.150 25 HB3 SER 6 2HB SER 6 19.889 4.906 11.586 26 HG SER 6 HG SER 6 18.121 5.881 12.158 27 H GLY 7 H GLY 7 18.664 1.300 10.253 28 HA2 GLY 7 1HA GLY 7 17.020 -0.301 10.193 29 HA3 GLY 7 2HA GLY 7 15.953 0.924 10.861 30 H ASN 8 H ASN 8 14.730 -0.758 9.273 31 HA ASN 8 HA ASN 8 14.612 0.508 6.620 32 HB2 ASN 8 1HB ASN 8 13.626 -1.544 5.797 33 HB3 ASN 8 2HB ASN 8 15.109 -1.931 6.665 34 HD21 ASN 8 1HD2 ASN 8 12.454 -3.332 6.062 35 HD22 ASN 8 2HD2 ASN 8 12.000 -4.000 7.590 36 H ASP 9 H ASP 9 13.395 1.741 8.856 37 HA ASP 9 HA ASP 9 10.540 1.180 8.574 38 HB2 ASP 9 1HB ASP 9 12.090 2.950 10.471 39 HB3 ASP 9 2HB ASP 9 10.331 2.890 10.423 40 H ASP 10 H ASP 10 12.943 3.558 7.742 41 HA ASP 10 HA ASP 10 11.006 5.548 6.947 42 HB2 ASP 10 1HB ASP 10 13.451 5.897 7.826 43 HB3 ASP 10 2HB ASP 10 13.891 5.637 6.140 44 H ILE 11 H ILE 11 12.844 2.989 5.463 45 HA ILE 11 HA ILE 11 12.650 3.802 2.777 46 HB ILE 11 HB ILE 11 14.098 1.936 3.722 47 HG12 ILE 11 1HG1 ILE 11 12.569 0.992 1.319 48 HG13 ILE 11 2HG1 ILE 11 13.505 2.481 1.237 49 HG21 ILE 11 1HG2 ILE 11 11.600 0.865 4.385 50 HG22 ILE 11 2HG2 ILE 11 12.228 -0.154 3.091 51 HG23 ILE 11 3HG2 ILE 11 13.177 0.095 4.558 52 HD11 ILE 11 1HD1 ILE 11 14.425 -0.331 1.506 53 HD12 ILE 11 2HD1 ILE 11 15.032 0.968 0.476 54 HD13 ILE 11 3HD1 ILE 11 15.407 0.959 2.199 55 H ILE 12 H ILE 12 10.326 2.497 4.949 56 HA ILE 12 HA ILE 12 8.549 1.111 3.430 57 HB ILE 12 HB ILE 12 7.855 3.249 5.446 58 HG12 ILE 12 1HG1 ILE 12 8.190 0.256 5.747 59 HG13 ILE 12 2HG1 ILE 12 9.319 1.477 6.325 60 HG21 ILE 12 1HG2 ILE 12 6.211 1.276 3.957 61 HG22 ILE 12 2HG2 ILE 12 5.815 1.574 5.649 62 HG23 ILE 12 3HG2 ILE 12 5.812 2.907 4.494 63 HD11 ILE 12 1HD1 ILE 12 6.978 2.263 7.486 64 HD12 ILE 12 2HD1 ILE 12 6.840 0.505 7.503 65 HD13 ILE 12 3HD1 ILE 12 8.229 1.288 8.256 66 H VAL 13 H VAL 13 9.096 4.584 3.387 67 HA VAL 13 HA VAL 13 6.884 5.112 1.615 68 HB VAL 13 HB VAL 13 9.189 6.894 2.418 69 HG11 VAL 13 1HG1 VAL 13 6.868 8.349 1.691 70 HG12 VAL 13 2HG1 VAL 13 8.451 8.347 0.912 71 HG13 VAL 13 3HG1 VAL 13 7.213 7.200 0.398 72 HG21 VAL 13 1HG2 VAL 13 7.683 7.876 4.013 73 HG22 VAL 13 2HG2 VAL 13 6.357 6.858 3.455 74 HG23 VAL 13 3HG2 VAL 13 7.733 6.135 4.287 75 H ASN 14 H ASN 14 10.419 4.972 1.335 76 HA ASN 14 HA ASN 14 10.612 5.707 -1.360 77 HB2 ASN 14 1HB ASN 14 12.354 4.282 0.582 78 HB3 ASN 14 2HB ASN 14 12.745 4.097 -1.125 79 HD21 ASN 14 1HD2 ASN 14 13.139 6.021 -2.363 80 HD22 ASN 14 2HD2 ASN 14 13.770 7.428 -1.583 81 H TRP 15 H TRP 15 10.677 2.429 0.047 82 HA TRP 15 HA TRP 15 10.761 0.916 -2.219 83 HB2 TRP 15 1HB TRP 15 10.721 0.062 0.140 84 HB3 TRP 15 2HB TRP 15 8.976 0.295 0.141 85 HD1 TRP 15 HD TRP 15 11.686 -1.862 -1.546 86 HE1 TRP 15 1HE TRP 15 10.579 -4.018 -2.410 87 HE3 TRP 15 3HE TRP 15 6.803 -0.726 -0.539 88 HZ2 TRP 15 2HZ TRP 15 7.979 -5.095 -2.636 89 HZ3 TRP 15 3HZ TRP 15 5.068 -2.373 -1.111 90 HH2 TRP 15 HH TRP 15 5.645 -4.512 -2.138 91 H VAL 16 H VAL 16 7.822 2.237 -0.710 92 HA VAL 16 HA VAL 16 5.968 1.201 -2.523 93 HB VAL 16 HB VAL 16 5.812 3.816 -1.017 94 HG11 VAL 16 1HG1 VAL 16 4.002 4.097 -2.320 95 HG12 VAL 16 2HG1 VAL 16 3.942 2.395 -2.781 96 HG13 VAL 16 3HG1 VAL 16 3.264 2.915 -1.238 97 HG21 VAL 16 1HG2 VAL 16 5.020 2.688 0.812 98 HG22 VAL 16 2HG2 VAL 16 4.435 1.325 -0.143 99 HG23 VAL 16 3HG2 VAL 16 6.160 1.497 0.185 100 H ASN 17 H ASN 17 7.484 4.429 -2.499 101 HA ASN 17 HA ASN 17 6.361 5.453 -4.800 102 HB2 ASN 17 1HB ASN 17 8.989 5.902 -3.432 103 HB3 ASN 17 2HB ASN 17 8.677 6.675 -4.983 104 HD21 ASN 17 1HD2 ASN 17 7.033 6.123 -1.886 105 HD22 ASN 17 2HD2 ASN 17 6.391 7.721 -1.749 106 H GLU 18 H GLU 18 9.427 3.655 -4.533 107 HA GLU 18 HA GLU 18 10.061 3.619 -7.248 108 HB2 GLU 18 1HB GLU 18 10.798 1.945 -4.896 109 HB3 GLU 18 2HB GLU 18 11.190 1.332 -6.495 110 HG2 GLU 18 1HG GLU 18 11.982 4.086 -5.617 111 HG3 GLU 18 2HG GLU 18 12.974 2.669 -5.278 112 H THR 19 H THR 19 8.575 0.982 -5.357 113 HA THR 19 HA THR 19 8.038 -0.848 -7.261 114 HB THR 19 HB THR 19 6.121 0.033 -5.095 115 HG1 THR 19 1HG THR 19 8.135 -0.710 -4.315 116 HG21 THR 19 1HG2 THR 19 4.725 -1.270 -6.359 117 HG22 THR 19 2HG2 THR 19 5.510 -2.528 -5.404 118 HG23 THR 19 3HG2 THR 19 6.047 -2.207 -7.052 119 H LEU 20 H LEU 20 6.140 2.086 -6.671 120 HA LEU 20 HA LEU 20 4.218 1.520 -8.708 121 HB2 LEU 20 1HB LEU 20 4.903 4.092 -7.293 122 HB3 LEU 20 2HB LEU 20 3.520 3.869 -8.361 123 HG LEU 20 HG LEU 20 3.792 2.078 -5.995 124 HD11 LEU 20 1HD1 LEU 20 2.356 4.632 -5.589 125 HD12 LEU 20 2HD1 LEU 20 4.117 4.677 -5.501 126 HD13 LEU 20 3HD1 LEU 20 3.208 3.608 -4.432 127 HD21 LEU 20 1HD2 LEU 20 1.941 2.364 -7.985 128 HD22 LEU 20 2HD2 LEU 20 1.233 3.316 -6.680 129 HD23 LEU 20 3HD2 LEU 20 1.641 1.620 -6.414 130 H ARG 21 H ARG 21 7.054 3.643 -8.489 131 HA ARG 21 HA ARG 21 6.866 4.894 -10.955 132 HB2 ARG 21 1HB ARG 21 8.547 5.257 -9.024 133 HB3 ARG 21 2HB ARG 21 9.508 4.018 -9.820 134 HG2 ARG 21 1HG ARG 21 10.358 6.053 -10.600 135 HG3 ARG 21 2HG ARG 21 9.346 5.448 -11.912 136 HD2 ARG 21 1HD ARG 21 7.504 6.888 -11.093 137 HD3 ARG 21 2HD ARG 21 8.599 7.546 -9.878 138 HE ARG 21 HE ARG 21 9.824 7.874 -12.348 139 HH11 ARG 21 1HH1 ARG 21 6.956 8.973 -10.707 140 HH12 ARG 21 2HH1 ARG 21 6.893 10.484 -11.554 141 HH21 ARG 21 1HH2 ARG 21 9.751 9.860 -13.469 142 HH22 ARG 21 2HH2 ARG 21 8.483 10.987 -13.125 143 H GLU 22 H GLU 22 8.567 1.870 -10.154 144 HA GLU 22 HA GLU 22 9.553 1.277 -12.679 145 HB2 GLU 22 1HB GLU 22 8.550 -0.724 -10.647 146 HB3 GLU 22 2HB GLU 22 9.710 -1.028 -11.933 147 HG2 GLU 22 1HG GLU 22 11.045 0.893 -10.740 148 HG3 GLU 22 2HG GLU 22 10.065 0.411 -9.357 149 H ALA 23 H ALA 23 6.372 0.648 -11.295 150 HA ALA 23 HA ALA 23 5.469 -0.795 -13.631 151 HB1 ALA 23 1HB ALA 23 4.103 0.091 -11.103 152 HB2 ALA 23 2HB ALA 23 3.245 -0.703 -12.426 153 HB3 ALA 23 3HB ALA 23 4.550 -1.545 -11.591 154 H GLU 24 H GLU 24 5.785 2.447 -12.759 155 HA GLU 24 HA GLU 24 5.235 4.367 -13.861 156 HB2 GLU 24 1HB GLU 24 3.706 2.708 -15.858 157 HB3 GLU 24 2HB GLU 24 4.407 4.303 -16.087 158 HG2 GLU 24 1HG GLU 24 6.210 2.039 -15.413 159 HG3 GLU 24 2HG GLU 24 5.557 2.150 -17.047 160 H LYS 25 H LYS 25 3.737 3.592 -11.700 161 HA LYS 25 HA LYS 25 0.929 3.949 -12.396 162 HB2 LYS 25 1HB LYS 25 2.426 3.059 -9.985 163 HB3 LYS 25 2HB LYS 25 0.872 3.840 -9.722 164 HG2 LYS 25 1HG LYS 25 0.834 1.332 -9.874 165 HG3 LYS 25 2HG LYS 25 -0.280 2.183 -10.946 166 HD2 LYS 25 1HD LYS 25 1.431 1.967 -12.759 167 HD3 LYS 25 2HD LYS 25 2.372 0.944 -11.672 168 HE2 LYS 25 1HE LYS 25 1.188 -0.617 -12.892 169 HE3 LYS 25 2HE LYS 25 0.164 -0.415 -11.472 170 HZ1 LYS 25 1HZ LYS 25 -0.474 0.032 -14.176 171 HZ2 LYS 25 2HZ LYS 25 -0.625 1.492 -13.335 172 HZ3 LYS 25 3HZ LYS 25 -1.484 0.128 -12.822 173 H SER 26 H SER 26 -0.325 5.681 -11.734 174 HA SER 26 HA SER 26 1.130 8.152 -11.322 175 HB2 SER 26 1HB SER 26 -0.869 7.831 -12.907 176 HB3 SER 26 2HB SER 26 -1.870 7.875 -11.456 177 HG SER 26 HG SER 26 0.009 9.901 -12.059 178 H SER 27 H SER 27 0.402 5.869 -9.252 179 HA SER 27 HA SER 27 -0.693 7.623 -7.167 180 HB2 SER 27 1HB SER 27 -0.325 4.622 -7.069 181 HB3 SER 27 2HB SER 27 -1.236 5.618 -5.933 182 HG SER 27 HG SER 27 -2.876 5.402 -7.208 183 H SER 28 H SER 28 0.318 7.785 -5.134 184 HA SER 28 HA SER 28 2.740 6.521 -4.448 185 HB2 SER 28 1HB SER 28 4.265 8.486 -4.673 186 HB3 SER 28 2HB SER 28 3.737 7.832 -6.224 187 HG SER 28 HG SER 28 3.149 10.264 -5.020 188 H ILE 29 H ILE 29 3.912 7.950 -2.669 189 HA ILE 29 HA ILE 29 1.967 9.496 -1.132 190 HB ILE 29 HB ILE 29 2.636 8.232 0.951 191 HG12 ILE 29 1HG1 ILE 29 3.296 5.909 -0.805 192 HG13 ILE 29 2HG1 ILE 29 4.555 7.097 -0.488 193 HG21 ILE 29 1HG2 ILE 29 0.930 7.138 -1.235 194 HG22 ILE 29 2HG2 ILE 29 1.157 6.189 0.234 195 HG23 ILE 29 3HG2 ILE 29 0.467 7.809 0.330 196 HD11 ILE 29 1HD1 ILE 29 4.353 6.722 1.889 197 HD12 ILE 29 2HD1 ILE 29 3.020 5.599 1.620 198 HD13 ILE 29 3HD1 ILE 29 4.640 5.196 1.051 199 H SER 30 H SER 30 2.860 11.015 0.224 200 HA SER 30 HA SER 30 5.663 11.608 -0.250 201 HB2 SER 30 1HB SER 30 3.383 13.129 0.996 202 HB3 SER 30 2HB SER 30 5.046 13.694 1.146 203 HG SER 30 HG SER 30 5.166 13.865 -1.075 204 H SER 31 H SER 31 3.549 10.666 2.391 205 HA SER 31 HA SER 31 5.723 9.636 3.914 206 HB2 SER 31 1HB SER 31 5.550 11.112 5.858 207 HB3 SER 31 2HB SER 31 6.003 12.038 4.427 208 HG SER 31 HG SER 31 3.924 12.410 6.029 209 H PHE 32 H PHE 32 4.976 8.744 6.023 210 HA PHE 32 HA PHE 32 2.885 7.041 5.817 211 HB2 PHE 32 1HB PHE 32 3.909 8.401 8.313 212 HB3 PHE 32 2HB PHE 32 2.795 7.039 8.334 213 HD1 PHE 32 2HD PHE 32 3.701 5.096 6.584 214 HD2 PHE 32 1HD PHE 32 6.056 7.832 8.840 215 HE1 PHE 32 2HE PHE 32 5.602 3.539 6.481 216 HE2 PHE 32 1HE PHE 32 7.961 6.279 8.740 217 HZ PHE 32 HZ PHE 32 7.735 4.129 7.560 218 H LYS 33 H LYS 33 2.729 10.418 6.723 219 HA LYS 33 HA LYS 33 -0.147 10.220 7.221 220 HB2 LYS 33 1HB LYS 33 1.937 12.299 7.776 221 HB3 LYS 33 2HB LYS 33 0.242 12.762 7.717 222 HG2 LYS 33 1HG LYS 33 -0.303 11.368 9.542 223 HG3 LYS 33 2HG LYS 33 1.256 10.541 9.467 224 HD2 LYS 33 1HD LYS 33 2.367 12.252 10.496 225 HD3 LYS 33 2HD LYS 33 1.260 13.484 9.885 226 HE2 LYS 33 1HE LYS 33 -0.440 12.188 11.458 227 HE3 LYS 33 2HE LYS 33 1.051 11.755 12.292 228 HZ1 LYS 33 1HZ LYS 33 1.445 14.343 12.013 229 HZ2 LYS 33 2HZ LYS 33 0.616 13.695 13.337 230 HZ3 LYS 33 3HZ LYS 33 -0.247 14.352 12.038 231 H ASP 34 H ASP 34 0.656 9.755 4.582 232 HA ASP 34 HA ASP 34 0.344 12.163 3.037 233 HB2 ASP 34 1HB ASP 34 1.674 10.580 1.953 234 HB3 ASP 34 2HB ASP 34 0.608 9.246 2.384 235 HA PRO 35 HA PRO 35 -4.061 12.254 2.949 236 HB2 PRO 35 1HB PRO 35 -4.382 13.799 0.740 237 HB3 PRO 35 2HB PRO 35 -3.845 14.446 2.294 238 HG2 PRO 35 1HG PRO 35 -2.225 13.705 -0.111 239 HG3 PRO 35 2HG PRO 35 -2.080 15.125 0.940 240 HD2 PRO 35 1HD PRO 35 -0.446 12.977 1.160 241 HD3 PRO 35 2HD PRO 35 -0.917 13.965 2.558 242 H LYS 36 H LYS 36 -2.343 11.573 -0.086 243 HA LYS 36 HA LYS 36 -4.448 10.532 -1.564 244 HB2 LYS 36 1HB LYS 36 -1.490 10.095 -1.578 245 HB3 LYS 36 2HB LYS 36 -2.507 9.064 -2.575 246 HG2 LYS 36 1HG LYS 36 -2.015 10.712 -4.068 247 HG3 LYS 36 2HG LYS 36 -3.499 11.365 -3.370 248 HD2 LYS 36 1HD LYS 36 -2.395 13.005 -2.213 249 HD3 LYS 36 2HD LYS 36 -0.910 12.060 -2.077 250 HE2 LYS 36 1HE LYS 36 -0.270 12.554 -4.286 251 HE3 LYS 36 2HE LYS 36 -1.882 13.127 -4.712 252 HZ1 LYS 36 1HZ LYS 36 -1.566 15.107 -3.592 253 HZ2 LYS 36 2HZ LYS 36 -0.037 14.836 -4.262 254 HZ3 LYS 36 3HZ LYS 36 -0.315 14.502 -2.627 255 H ILE 37 H ILE 37 -2.754 9.176 1.122 256 HA ILE 37 HA ILE 37 -3.308 6.443 0.674 257 HB ILE 37 HB ILE 37 -2.842 7.929 3.261 258 HG12 ILE 37 1HG1 ILE 37 -1.022 6.285 1.491 259 HG13 ILE 37 2HG1 ILE 37 -0.937 8.022 1.756 260 HG21 ILE 37 1HG2 ILE 37 -2.739 4.955 2.786 261 HG22 ILE 37 2HG2 ILE 37 -2.485 5.800 4.312 262 HG23 ILE 37 3HG2 ILE 37 -4.080 5.796 3.561 263 HD11 ILE 37 1HD1 ILE 37 0.663 7.416 3.214 264 HD12 ILE 37 2HD1 ILE 37 -0.716 7.168 4.285 265 HD13 ILE 37 3HD1 ILE 37 0.000 5.798 3.436 266 H SER 38 H SER 38 -5.216 9.069 1.903 267 HA SER 38 HA SER 38 -7.158 7.639 3.330 268 HB2 SER 38 1HB SER 38 -8.530 9.605 3.154 269 HB3 SER 38 2HB SER 38 -6.858 10.140 3.318 270 HG SER 38 HG SER 38 -7.251 9.875 0.755 271 H THR 39 H THR 39 -6.689 8.132 -0.084 272 HA THR 39 HA THR 39 -9.305 7.019 -0.734 273 HB THR 39 HB THR 39 -8.508 7.358 -3.126 274 HG1 THR 39 1HG THR 39 -6.229 7.493 -2.445 275 HG21 THR 39 1HG2 THR 39 -8.529 9.856 -1.434 276 HG22 THR 39 2HG2 THR 39 -9.978 8.937 -1.838 277 HG23 THR 39 3HG2 THR 39 -9.028 9.691 -3.117 278 H SER 40 H SER 40 -6.235 5.887 -0.064 279 HA SER 40 HA SER 40 -5.310 3.806 -0.169 280 HB2 SER 40 1HB SER 40 -7.911 3.227 -0.015 281 HB3 SER 40 2HB SER 40 -7.616 2.634 -1.649 282 HG SER 40 HG SER 40 -6.438 1.795 0.777 283 H LEU 41 H LEU 41 -5.177 5.803 -2.353 284 HA LEU 41 HA LEU 41 -5.141 4.450 -4.848 285 HB2 LEU 41 1HB LEU 41 -4.137 7.058 -3.822 286 HB3 LEU 41 2HB LEU 41 -3.536 6.475 -5.373 287 HG LEU 41 HG LEU 41 -6.429 6.993 -4.684 288 HD11 LEU 41 1HD1 LEU 41 -5.970 8.723 -6.605 289 HD12 LEU 41 2HD1 LEU 41 -4.310 8.602 -6.021 290 HD13 LEU 41 3HD1 LEU 41 -5.595 9.110 -4.925 291 HD21 LEU 41 1HD2 LEU 41 -5.878 6.802 -7.478 292 HD22 LEU 41 2HD2 LEU 41 -6.971 5.829 -6.493 293 HD23 LEU 41 3HD2 LEU 41 -5.282 5.350 -6.673 294 HA PRO 42 HA PRO 42 -0.357 4.245 -4.107 295 HB2 PRO 42 1HB PRO 42 0.501 4.666 -1.567 296 HB3 PRO 42 2HB PRO 42 0.334 5.966 -2.752 297 HG2 PRO 42 1HG PRO 42 -1.529 5.158 -0.553 298 HG3 PRO 42 2HG PRO 42 -1.034 6.784 -1.059 299 HD2 PRO 42 1HD PRO 42 -3.404 5.693 -1.781 300 HD3 PRO 42 2HD PRO 42 -2.518 6.825 -2.823 301 H VAL 43 H VAL 43 -2.649 3.129 -1.730 302 HA VAL 43 HA VAL 43 -1.069 0.866 -0.899 303 HB VAL 43 HB VAL 43 -4.030 1.214 -0.462 304 HG11 VAL 43 1HG1 VAL 43 -3.144 0.078 1.766 305 HG12 VAL 43 2HG1 VAL 43 -3.560 -0.869 0.335 306 HG13 VAL 43 3HG1 VAL 43 -1.874 -0.479 0.676 307 HG21 VAL 43 1HG2 VAL 43 -3.711 2.924 0.921 308 HG22 VAL 43 2HG2 VAL 43 -2.428 2.065 1.772 309 HG23 VAL 43 3HG2 VAL 43 -2.049 3.021 0.339 310 H LEU 44 H LEU 44 -3.470 1.546 -3.320 311 HA LEU 44 HA LEU 44 -3.949 -1.259 -3.889 312 HB2 LEU 44 1HB LEU 44 -4.951 1.307 -5.088 313 HB3 LEU 44 2HB LEU 44 -5.299 -0.264 -5.806 314 HG LEU 44 HG LEU 44 -6.020 0.334 -2.956 315 HD11 LEU 44 1HD1 LEU 44 -8.363 0.643 -4.238 316 HD12 LEU 44 2HD1 LEU 44 -7.268 1.368 -5.415 317 HD13 LEU 44 3HD1 LEU 44 -7.321 1.985 -3.763 318 HD21 LEU 44 1HD2 LEU 44 -6.011 -2.006 -3.994 319 HD22 LEU 44 2HD2 LEU 44 -7.409 -1.459 -4.921 320 HD23 LEU 44 3HD2 LEU 44 -7.473 -1.486 -3.158 321 H ASP 45 H ASP 45 -2.629 1.544 -5.651 322 HA ASP 45 HA ASP 45 -1.760 0.149 -7.912 323 HB2 ASP 45 1HB ASP 45 -0.820 2.712 -6.632 324 HB3 ASP 45 2HB ASP 45 -0.115 2.100 -8.126 325 H LEU 46 H LEU 46 -0.228 0.673 -4.795 326 HA LEU 46 HA LEU 46 2.371 -0.120 -5.397 327 HB2 LEU 46 1HB LEU 46 2.027 0.836 -3.294 328 HB3 LEU 46 2HB LEU 46 0.710 -0.271 -2.907 329 HG LEU 46 HG LEU 46 2.239 -2.061 -2.500 330 HD11 LEU 46 1HD1 LEU 46 4.420 -2.148 -3.130 331 HD12 LEU 46 2HD1 LEU 46 4.653 -0.407 -2.974 332 HD13 LEU 46 3HD1 LEU 46 3.819 -1.061 -4.383 333 HD21 LEU 46 1HD2 LEU 46 3.923 -0.423 -0.990 334 HD22 LEU 46 2HD2 LEU 46 2.425 -1.192 -0.464 335 HD23 LEU 46 3HD2 LEU 46 2.396 0.452 -1.105 336 H ILE 47 H ILE 47 -0.400 -2.085 -4.362 337 HA ILE 47 HA ILE 47 0.983 -4.551 -4.347 338 HB ILE 47 HB ILE 47 -1.973 -4.045 -4.714 339 HG12 ILE 47 1HG1 ILE 47 -0.673 -4.929 -2.161 340 HG13 ILE 47 2HG1 ILE 47 -0.677 -3.222 -2.589 341 HG21 ILE 47 1HG2 ILE 47 -0.504 -6.425 -4.980 342 HG22 ILE 47 2HG2 ILE 47 -1.325 -6.519 -3.422 343 HG23 ILE 47 3HG2 ILE 47 -2.256 -6.239 -4.894 344 HD11 ILE 47 1HD1 ILE 47 -2.833 -4.919 -1.607 345 HD12 ILE 47 2HD1 ILE 47 -2.627 -3.170 -1.515 346 HD13 ILE 47 3HD1 ILE 47 -3.284 -3.905 -2.977 347 H ASP 48 H ASP 48 -1.263 -3.154 -6.738 348 HA ASP 48 HA ASP 48 -1.200 -5.124 -8.649 349 HB2 ASP 48 1HB ASP 48 -2.620 -3.095 -8.755 350 HB3 ASP 48 2HB ASP 48 -1.200 -2.146 -9.184 351 H ALA 49 H ALA 49 1.037 -2.369 -8.372 352 HA ALA 49 HA ALA 49 2.643 -2.670 -10.520 353 HB1 ALA 49 1HB ALA 49 4.547 -1.929 -9.057 354 HB2 ALA 49 2HB ALA 49 3.096 -0.931 -8.967 355 HB3 ALA 49 3HB ALA 49 3.455 -2.083 -7.681 356 H ILE 50 H ILE 50 2.831 -4.605 -7.551 357 HA ILE 50 HA ILE 50 5.031 -6.184 -8.458 358 HB ILE 50 HB ILE 50 3.054 -6.830 -6.269 359 HG12 ILE 50 1HG1 ILE 50 5.732 -5.437 -6.061 360 HG13 ILE 50 2HG1 ILE 50 4.173 -4.621 -5.983 361 HG21 ILE 50 1HG2 ILE 50 5.811 -7.748 -6.009 362 HG22 ILE 50 2HG2 ILE 50 4.298 -8.618 -5.765 363 HG23 ILE 50 3HG2 ILE 50 4.963 -8.445 -7.389 364 HD11 ILE 50 1HD1 ILE 50 3.877 -5.171 -3.847 365 HD12 ILE 50 2HD1 ILE 50 4.415 -6.831 -4.103 366 HD13 ILE 50 3HD1 ILE 50 5.600 -5.549 -3.850 367 H GLN 51 H GLN 51 1.623 -7.057 -7.847 368 HA GLN 51 HA GLN 51 1.905 -9.176 -9.871 369 HB2 GLN 51 1HB GLN 51 1.394 -9.938 -7.560 370 HB3 GLN 51 2HB GLN 51 -0.099 -9.008 -7.615 371 HG2 GLN 51 1HG GLN 51 -0.804 -11.144 -8.120 372 HG3 GLN 51 2HG GLN 51 -0.632 -10.405 -9.711 373 HE21 GLN 51 1HE2 GLN 51 1.272 -12.230 -7.338 374 HE22 GLN 51 2HE2 GLN 51 2.087 -13.219 -8.497 375 HA PRO 52 HA PRO 52 -0.850 -6.269 -12.011 376 HB2 PRO 52 1HB PRO 52 -0.294 -7.242 -14.484 377 HB3 PRO 52 2HB PRO 52 0.745 -6.078 -13.653 378 HG2 PRO 52 1HG PRO 52 1.041 -9.048 -13.892 379 HG3 PRO 52 2HG PRO 52 2.277 -7.784 -14.041 380 HD2 PRO 52 1HD PRO 52 1.953 -9.249 -11.786 381 HD3 PRO 52 2HD PRO 52 2.502 -7.561 -11.757 382 H GLY 53 H GLY 53 -2.958 -6.586 -12.412 383 HA2 GLY 53 1HA GLY 53 -4.636 -7.882 -13.666 384 HA3 GLY 53 2HA GLY 53 -3.835 -9.330 -13.073 385 H SER 54 H SER 54 -3.483 -8.050 -10.391 386 HA SER 54 HA SER 54 -5.852 -9.060 -9.206 387 HB2 SER 54 1HB SER 54 -3.711 -7.321 -7.956 388 HB3 SER 54 2HB SER 54 -4.892 -8.302 -7.090 389 HG SER 54 HG SER 54 -2.780 -9.282 -7.355 390 H ILE 55 H ILE 55 -4.528 -5.750 -9.039 391 HA ILE 55 HA ILE 55 -7.022 -4.639 -8.215 392 HB ILE 55 HB ILE 55 -4.644 -3.157 -9.337 393 HG12 ILE 55 1HG1 ILE 55 -3.991 -4.624 -7.459 394 HG13 ILE 55 2HG1 ILE 55 -3.875 -2.920 -7.033 395 HG21 ILE 55 1HG2 ILE 55 -7.213 -2.344 -8.334 396 HG22 ILE 55 2HG2 ILE 55 -5.920 -1.680 -7.337 397 HG23 ILE 55 3HG2 ILE 55 -5.940 -1.372 -9.073 398 HD11 ILE 55 1HD1 ILE 55 -6.163 -4.731 -6.299 399 HD12 ILE 55 2HD1 ILE 55 -4.825 -4.292 -5.237 400 HD13 ILE 55 3HD1 ILE 55 -5.943 -3.053 -5.802 401 H ASN 56 H ASN 56 -8.557 -3.558 -9.363 402 HA ASN 56 HA ASN 56 -8.159 -3.251 -12.255 403 HB2 ASN 56 1HB ASN 56 -9.550 -5.344 -11.449 404 HB3 ASN 56 2HB ASN 56 -10.830 -4.150 -11.253 405 HD21 ASN 56 1HD2 ASN 56 -12.097 -4.955 -12.880 406 HD22 ASN 56 2HD2 ASN 56 -11.670 -4.842 -14.551 407 H TYR 57 H TYR 57 -8.159 -1.089 -12.428 408 HA TYR 57 HA TYR 57 -9.378 0.769 -10.806 409 HB2 TYR 57 1HB TYR 57 -8.428 0.780 -13.625 410 HB3 TYR 57 2HB TYR 57 -9.450 2.119 -13.115 411 HD1 TYR 57 1HD TYR 57 -6.970 0.312 -11.030 412 HD2 TYR 57 2HD TYR 57 -7.902 3.895 -13.128 413 HE1 TYR 57 1HE TYR 57 -5.018 1.408 -10.012 414 HE2 TYR 57 2HE TYR 57 -5.951 5.000 -12.118 415 HH TYR 57 HH TYR 57 -3.718 3.228 -10.016 416 H ASP 58 H ASP 58 -10.732 -0.959 -13.561 417 HA ASP 58 HA ASP 58 -13.048 0.408 -14.048 418 HB2 ASP 58 1HB ASP 58 -12.091 -1.875 -14.991 419 HB3 ASP 58 2HB ASP 58 -13.237 -2.564 -13.844 420 H LEU 59 H LEU 59 -12.345 -1.725 -11.345 421 HA LEU 59 HA LEU 59 -15.054 -1.507 -10.319 422 HB2 LEU 59 1HB LEU 59 -12.707 -2.757 -8.925 423 HB3 LEU 59 2HB LEU 59 -14.422 -3.078 -8.676 424 HG LEU 59 HG LEU 59 -12.810 -3.860 -11.106 425 HD11 LEU 59 1HD1 LEU 59 -14.084 -5.813 -9.265 426 HD12 LEU 59 2HD1 LEU 59 -12.575 -5.051 -8.762 427 HD13 LEU 59 3HD1 LEU 59 -12.639 -5.972 -10.264 428 HD21 LEU 59 1HD2 LEU 59 -14.789 -3.932 -12.125 429 HD22 LEU 59 2HD2 LEU 59 -15.664 -3.659 -10.618 430 HD23 LEU 59 3HD2 LEU 59 -15.172 -5.292 -11.069 431 H LEU 60 H LEU 60 -11.833 -0.284 -9.633 432 HA LEU 60 HA LEU 60 -12.351 0.864 -7.123 433 HB2 LEU 60 1HB LEU 60 -10.456 1.965 -9.182 434 HB3 LEU 60 2HB LEU 60 -10.352 2.111 -7.429 435 HG LEU 60 HG LEU 60 -9.962 -0.427 -9.015 436 HD11 LEU 60 1HD1 LEU 60 -7.900 1.086 -7.441 437 HD12 LEU 60 2HD1 LEU 60 -8.179 1.379 -9.157 438 HD13 LEU 60 3HD1 LEU 60 -7.661 -0.214 -8.609 439 HD21 LEU 60 1HD2 LEU 60 -10.227 -1.535 -7.113 440 HD22 LEU 60 2HD2 LEU 60 -10.654 -0.031 -6.296 441 HD23 LEU 60 3HD2 LEU 60 -8.971 -0.557 -6.354 442 H LYS 61 H LYS 61 -12.451 3.204 -6.648 443 HA LYS 61 HA LYS 61 -14.313 4.525 -8.498 444 HB2 LYS 61 1HB LYS 61 -13.942 4.587 -5.535 445 HB3 LYS 61 2HB LYS 61 -14.603 6.011 -6.327 446 HG2 LYS 61 1HG LYS 61 -16.486 4.816 -5.704 447 HG3 LYS 61 2HG LYS 61 -16.274 4.382 -7.402 448 HD2 LYS 61 1HD LYS 61 -15.129 2.316 -6.711 449 HD3 LYS 61 2HD LYS 61 -15.394 2.750 -5.020 450 HE2 LYS 61 1HE LYS 61 -17.187 1.377 -5.352 451 HE3 LYS 61 2HE LYS 61 -17.903 2.917 -5.823 452 HZ1 LYS 61 1HZ LYS 61 -16.616 1.681 -8.029 453 HZ2 LYS 61 2HZ LYS 61 -18.228 2.164 -7.868 454 HZ3 LYS 61 3HZ LYS 61 -17.750 0.629 -7.345 455 H THR 62 H THR 62 -11.773 5.473 -6.175 456 HA THR 62 HA THR 62 -10.384 7.297 -6.153 457 HB THR 62 HB THR 62 -9.185 5.768 -7.657 458 HG1 THR 62 1HG THR 62 -7.825 7.377 -7.747 459 HG21 THR 62 1HG2 THR 62 -9.312 6.268 -10.133 460 HG22 THR 62 2HG2 THR 62 -10.785 7.174 -9.788 461 HG23 THR 62 3HG2 THR 62 -10.713 5.446 -9.447 462 H GLU 63 H GLU 63 -13.198 7.846 -6.891 463 HA GLU 63 HA GLU 63 -12.732 10.466 -8.116 464 HB2 GLU 63 1HB GLU 63 -14.674 10.269 -9.545 465 HB3 GLU 63 2HB GLU 63 -13.564 8.949 -9.885 466 HG2 GLU 63 1HG GLU 63 -15.064 7.679 -8.139 467 HG3 GLU 63 2HG GLU 63 -16.249 8.894 -8.617 468 H ASN 64 H ASN 64 -13.352 11.917 -6.667 469 HA ASN 64 HA ASN 64 -14.349 12.772 -4.774 470 HB2 ASN 64 1HB ASN 64 -16.921 12.002 -6.132 471 HB3 ASN 64 2HB ASN 64 -16.551 13.462 -5.220 472 HD21 ASN 64 1HD2 ASN 64 -16.190 11.806 -8.253 473 HD22 ASN 64 2HD2 ASN 64 -15.678 13.177 -9.171 474 H LEU 65 H LEU 65 -13.572 10.254 -4.135 475 HA LEU 65 HA LEU 65 -15.582 8.497 -3.275 476 HB2 LEU 65 1HB LEU 65 -12.744 8.934 -2.400 477 HB3 LEU 65 2HB LEU 65 -13.766 7.703 -1.661 478 HG LEU 65 HG LEU 65 -13.454 7.689 -4.623 479 HD11 LEU 65 1HD1 LEU 65 -11.428 6.231 -4.304 480 HD12 LEU 65 2HD1 LEU 65 -11.338 6.852 -2.655 481 HD13 LEU 65 3HD1 LEU 65 -11.179 7.954 -4.022 482 HD21 LEU 65 1HD2 LEU 65 -14.772 5.935 -4.127 483 HD22 LEU 65 2HD2 LEU 65 -14.225 5.859 -2.452 484 HD23 LEU 65 3HD2 LEU 65 -13.245 5.143 -3.734 485 H ASN 66 H ASN 66 -16.377 8.066 -1.158 486 HA ASN 66 HA ASN 66 -16.246 10.359 0.684 487 HB2 ASN 66 1HB ASN 66 -18.700 9.500 1.242 488 HB3 ASN 66 2HB ASN 66 -18.400 10.661 -0.048 489 HD21 ASN 66 1HD2 ASN 66 -19.559 7.571 0.763 490 HD22 ASN 66 2HD2 ASN 66 -19.936 7.034 -0.835 491 H ASP 67 H ASP 67 -16.963 9.769 2.926 492 HA ASP 67 HA ASP 67 -15.391 8.030 4.195 493 HB2 ASP 67 1HB ASP 67 -17.085 9.537 5.271 494 HB3 ASP 67 2HB ASP 67 -18.309 8.316 4.933 495 H ASP 68 H ASP 68 -18.381 7.150 2.548 496 HA ASP 68 HA ASP 68 -18.331 4.415 3.363 497 HB2 ASP 68 1HB ASP 68 -20.333 5.820 2.505 498 HB3 ASP 68 2HB ASP 68 -19.736 5.412 0.899 499 H GLU 69 H GLU 69 -18.061 5.703 0.051 500 HA GLU 69 HA GLU 69 -17.012 3.500 -1.174 501 HB2 GLU 69 1HB GLU 69 -16.095 6.307 -1.797 502 HB3 GLU 69 2HB GLU 69 -16.187 4.941 -2.900 503 HG2 GLU 69 1HG GLU 69 -18.741 5.036 -2.210 504 HG3 GLU 69 2HG GLU 69 -18.330 6.720 -1.895 505 H LYS 70 H LYS 70 -15.101 6.157 0.240 506 HA LYS 70 HA LYS 70 -12.564 5.413 -0.195 507 HB2 LYS 70 1HB LYS 70 -13.739 6.335 2.430 508 HB3 LYS 70 2HB LYS 70 -12.010 6.245 2.118 509 HG2 LYS 70 1HG LYS 70 -12.698 7.724 0.026 510 HG3 LYS 70 2HG LYS 70 -14.030 8.157 1.099 511 HD2 LYS 70 1HD LYS 70 -12.581 9.038 2.722 512 HD3 LYS 70 2HD LYS 70 -11.172 8.238 2.020 513 HE2 LYS 70 1HE LYS 70 -11.126 9.723 0.183 514 HE3 LYS 70 2HE LYS 70 -12.736 10.343 0.549 515 HZ1 LYS 70 1HZ LYS 70 -10.524 10.664 2.474 516 HZ2 LYS 70 2HZ LYS 70 -11.947 11.567 2.332 517 HZ3 LYS 70 3HZ LYS 70 -10.713 11.749 1.190 518 H LEU 71 H LEU 71 -14.521 4.085 2.471 519 HA LEU 71 HA LEU 71 -12.674 2.293 3.489 520 HB2 LEU 71 1HB LEU 71 -14.645 2.641 4.715 521 HB3 LEU 71 2HB LEU 71 -15.669 2.231 3.342 522 HG LEU 71 HG LEU 71 -14.936 -0.130 3.560 523 HD11 LEU 71 1HD1 LEU 71 -12.819 0.718 4.888 524 HD12 LEU 71 2HD1 LEU 71 -13.510 -0.880 5.172 525 HD13 LEU 71 3HD1 LEU 71 -13.874 0.448 6.274 526 HD21 LEU 71 1HD2 LEU 71 -15.990 -0.216 6.063 527 HD22 LEU 71 2HD2 LEU 71 -16.934 -0.059 4.582 528 HD23 LEU 71 3HD2 LEU 71 -16.518 1.376 5.520 529 H ASN 72 H ASN 72 -15.207 1.615 1.071 530 HA ASN 72 HA ASN 72 -14.674 -1.010 0.525 531 HB2 ASN 72 1HB ASN 72 -15.425 1.171 -1.433 532 HB3 ASN 72 2HB ASN 72 -15.509 -0.553 -1.785 533 HD21 ASN 72 1HD2 ASN 72 -16.851 2.060 0.087 534 HD22 ASN 72 2HD2 ASN 72 -18.317 1.256 0.523 535 H ASN 73 H ASN 73 -13.010 1.823 -0.801 536 HA ASN 73 HA ASN 73 -11.335 0.463 -2.593 537 HB2 ASN 73 1HB ASN 73 -11.219 3.122 -1.221 538 HB3 ASN 73 2HB ASN 73 -9.813 2.553 -2.115 539 HD21 ASN 73 1HD2 ASN 73 -10.265 4.486 -3.397 540 HD22 ASN 73 2HD2 ASN 73 -11.403 4.371 -4.693 541 H ALA 74 H ALA 74 -10.789 1.460 0.774 542 HA ALA 74 HA ALA 74 -8.165 0.549 1.031 543 HB1 ALA 74 1HB ALA 74 -8.961 1.936 2.742 544 HB2 ALA 74 2HB ALA 74 -10.377 0.923 3.025 545 HB3 ALA 74 3HB ALA 74 -8.778 0.354 3.504 546 H LYS 75 H LYS 75 -11.223 -1.133 1.709 547 HA LYS 75 HA LYS 75 -10.174 -3.523 2.668 548 HB2 LYS 75 1HB LYS 75 -12.704 -2.947 1.130 549 HB3 LYS 75 2HB LYS 75 -12.333 -4.535 1.790 550 HG2 LYS 75 1HG LYS 75 -12.685 -3.880 3.940 551 HG3 LYS 75 2HG LYS 75 -12.202 -2.210 3.628 552 HD2 LYS 75 1HD LYS 75 -14.487 -2.010 3.941 553 HD3 LYS 75 2HD LYS 75 -14.361 -2.130 2.184 554 HE2 LYS 75 1HE LYS 75 -16.160 -3.542 3.084 555 HE3 LYS 75 2HE LYS 75 -14.911 -4.490 2.278 556 HZ1 LYS 75 1HZ LYS 75 -14.662 -5.652 4.128 557 HZ2 LYS 75 2HZ LYS 75 -15.843 -4.728 4.908 558 HZ3 LYS 75 3HZ LYS 75 -14.220 -4.257 4.977 559 H TYR 76 H TYR 76 -10.929 -2.578 -0.670 560 HA TYR 76 HA TYR 76 -10.274 -5.015 -1.888 561 HB2 TYR 76 1HB TYR 76 -11.438 -2.905 -2.864 562 HB3 TYR 76 2HB TYR 76 -9.801 -2.374 -3.240 563 HD1 TYR 76 1HD TYR 76 -11.704 -5.589 -3.525 564 HD2 TYR 76 2HD TYR 76 -9.216 -2.714 -5.436 565 HE1 TYR 76 1HE TYR 76 -11.750 -6.928 -5.587 566 HE2 TYR 76 2HE TYR 76 -9.258 -4.044 -7.505 567 HH TYR 76 HH TYR 76 -9.632 -6.477 -8.120 568 H ALA 77 H ALA 77 -8.293 -2.269 -0.947 569 HA ALA 77 HA ALA 77 -5.933 -3.057 -2.297 570 HB1 ALA 77 1HB ALA 77 -5.654 -1.539 0.218 571 HB2 ALA 77 2HB ALA 77 -4.992 -1.217 -1.384 572 HB3 ALA 77 3HB ALA 77 -6.670 -0.813 -1.027 573 H ILE 78 H ILE 78 -6.788 -3.289 1.162 574 HA ILE 78 HA ILE 78 -4.569 -4.833 1.910 575 HB ILE 78 HB ILE 78 -7.304 -4.701 3.188 576 HG12 ILE 78 1HG1 ILE 78 -4.767 -3.295 4.025 577 HG13 ILE 78 2HG1 ILE 78 -5.951 -2.559 2.950 578 HG21 ILE 78 1HG2 ILE 78 -5.164 -5.285 5.004 579 HG22 ILE 78 2HG2 ILE 78 -6.637 -6.199 4.683 580 HG23 ILE 78 3HG2 ILE 78 -5.195 -6.479 3.707 581 HD11 ILE 78 1HD1 ILE 78 -7.365 -3.517 5.185 582 HD12 ILE 78 2HD1 ILE 78 -5.937 -2.679 5.791 583 HD13 ILE 78 3HD1 ILE 78 -7.059 -1.844 4.718 584 H SER 79 H SER 79 -7.802 -5.763 0.825 585 HA SER 79 HA SER 79 -7.801 -8.458 1.356 586 HB2 SER 79 1HB SER 79 -9.660 -7.101 0.301 587 HB3 SER 79 2HB SER 79 -8.817 -7.283 -1.237 588 HG SER 79 HG SER 79 -10.529 -8.937 -0.251 589 H MET 80 H MET 80 -6.841 -7.072 -1.791 590 HA MET 80 HA MET 80 -5.826 -9.302 -2.989 591 HB2 MET 80 1HB MET 80 -5.176 -6.406 -3.171 592 HB3 MET 80 2HB MET 80 -4.061 -7.533 -3.933 593 HG2 MET 80 1HG MET 80 -5.767 -6.660 -5.476 594 HG3 MET 80 2HG MET 80 -5.808 -8.414 -5.317 595 HE1 MET 80 1HE MET 80 -7.786 -8.787 -6.298 596 HE2 MET 80 2HE MET 80 -8.474 -9.597 -4.891 597 HE3 MET 80 3HE MET 80 -9.411 -8.375 -5.751 598 H ALA 81 H ALA 81 -4.158 -7.187 -0.692 599 HA ALA 81 HA ALA 81 -1.599 -8.121 -0.775 600 HB1 ALA 81 1HB ALA 81 -1.281 -7.171 1.283 601 HB2 ALA 81 2HB ALA 81 -2.794 -6.397 0.811 602 HB3 ALA 81 3HB ALA 81 -2.813 -7.769 1.920 603 H ARG 82 H ARG 82 -4.262 -9.557 1.103 604 HA ARG 82 HA ARG 82 -2.704 -11.746 2.042 605 HB2 ARG 82 1HB ARG 82 -4.887 -10.761 3.020 606 HB3 ARG 82 2HB ARG 82 -5.702 -11.774 1.836 607 HG2 ARG 82 1HG ARG 82 -4.465 -13.730 2.812 608 HG3 ARG 82 2HG ARG 82 -3.935 -12.651 4.103 609 HD2 ARG 82 1HD ARG 82 -5.902 -13.915 4.783 610 HD3 ARG 82 2HD ARG 82 -6.268 -12.192 4.677 611 HE ARG 82 HE ARG 82 -6.998 -13.127 2.247 612 HH11 ARG 82 1HH1 ARG 82 -7.742 -14.101 5.506 613 HH12 ARG 82 2HH1 ARG 82 -9.317 -14.703 5.104 614 HH21 ARG 82 1HH2 ARG 82 -9.069 -13.916 1.707 615 HH22 ARG 82 2HH2 ARG 82 -10.069 -14.598 2.943 616 H LYS 83 H LYS 83 -5.027 -11.334 -0.597 617 HA LYS 83 HA LYS 83 -5.371 -13.889 -1.481 618 HB2 LYS 83 1HB LYS 83 -5.220 -11.253 -2.851 619 HB3 LYS 83 2HB LYS 83 -5.181 -12.690 -3.863 620 HG2 LYS 83 1HG LYS 83 -7.436 -12.019 -3.733 621 HG3 LYS 83 2HG LYS 83 -7.279 -13.438 -2.695 622 HD2 LYS 83 1HD LYS 83 -6.956 -11.808 -0.772 623 HD3 LYS 83 2HD LYS 83 -7.495 -10.548 -1.885 624 HE2 LYS 83 1HE LYS 83 -9.397 -11.254 -0.644 625 HE3 LYS 83 2HE LYS 83 -9.565 -11.907 -2.273 626 HZ1 LYS 83 1HZ LYS 83 -9.631 -13.951 -1.459 627 HZ2 LYS 83 2HZ LYS 83 -9.653 -13.307 0.104 628 HZ3 LYS 83 3HZ LYS 83 -8.182 -13.736 -0.612 629 H ILE 84 H ILE 84 -2.709 -11.735 -2.477 630 HA ILE 84 HA ILE 84 -1.339 -13.830 -3.870 631 HB ILE 84 HB ILE 84 0.544 -12.165 -3.980 632 HG12 ILE 84 1HG1 ILE 84 -1.469 -10.273 -2.754 633 HG13 ILE 84 2HG1 ILE 84 -0.143 -10.995 -1.849 634 HG21 ILE 84 1HG2 ILE 84 -0.454 -11.697 -5.906 635 HG22 ILE 84 2HG2 ILE 84 -2.026 -12.115 -5.226 636 HG23 ILE 84 3HG2 ILE 84 -1.415 -10.467 -5.084 637 HD11 ILE 84 1HD1 ILE 84 -0.098 -8.618 -3.269 638 HD12 ILE 84 2HD1 ILE 84 1.288 -9.484 -2.605 639 HD13 ILE 84 3HD1 ILE 84 0.797 -9.756 -4.276 640 H GLY 85 H GLY 85 -1.437 -12.718 -0.618 641 HA2 GLY 85 1HA GLY 85 -0.515 -14.431 0.959 642 HA3 GLY 85 2HA GLY 85 0.958 -14.332 0.005 643 H ALA 86 H ALA 86 -1.045 -12.749 2.374 644 HA ALA 86 HA ALA 86 1.145 -11.447 3.586 645 HB1 ALA 86 1HB ALA 86 -0.699 -9.461 2.311 646 HB2 ALA 86 2HB ALA 86 0.914 -9.215 2.982 647 HB3 ALA 86 3HB ALA 86 0.717 -10.065 1.449 648 H ARG 87 H ARG 87 0.501 -11.823 5.608 649 HA ARG 87 HA ARG 87 -2.304 -11.507 6.337 650 HB2 ARG 87 1HB ARG 87 -1.780 -12.672 8.344 651 HB3 ARG 87 2HB ARG 87 -0.942 -13.508 7.044 652 HG2 ARG 87 1HG ARG 87 1.129 -12.309 7.660 653 HG3 ARG 87 2HG ARG 87 0.269 -11.586 9.019 654 HD2 ARG 87 1HD ARG 87 -0.263 -13.956 9.755 655 HD3 ARG 87 2HD ARG 87 0.919 -14.485 8.558 656 HE ARG 87 HE ARG 87 2.289 -12.664 10.014 657 HH11 ARG 87 1HH1 ARG 87 0.407 -15.472 10.851 658 HH12 ARG 87 2HH1 ARG 87 1.332 -15.831 12.271 659 HH21 ARG 87 1HH2 ARG 87 3.516 -13.127 11.882 660 HH22 ARG 87 2HH2 ARG 87 3.100 -14.496 12.857 661 H VAL 88 H VAL 88 -3.081 -9.779 7.355 662 HA VAL 88 HA VAL 88 -1.222 -8.029 8.813 663 HB VAL 88 HB VAL 88 -1.622 -6.993 6.637 664 HG11 VAL 88 1HG1 VAL 88 -4.536 -6.795 7.341 665 HG12 VAL 88 2HG1 VAL 88 -3.749 -6.453 5.798 666 HG13 VAL 88 3HG1 VAL 88 -3.892 -8.117 6.367 667 HG21 VAL 88 1HG2 VAL 88 -1.957 -4.872 7.443 668 HG22 VAL 88 2HG2 VAL 88 -3.284 -5.362 8.497 669 HG23 VAL 88 3HG2 VAL 88 -1.618 -5.732 8.945 670 H TYR 89 H TYR 89 -2.201 -6.725 10.454 671 HA TYR 89 HA TYR 89 -4.810 -7.755 11.361 672 HB2 TYR 89 1HB TYR 89 -2.567 -8.276 12.670 673 HB3 TYR 89 2HB TYR 89 -2.834 -6.661 13.315 674 HD1 TYR 89 1HD TYR 89 -4.780 -6.191 14.725 675 HD2 TYR 89 2HD TYR 89 -4.012 -10.114 13.269 676 HE1 TYR 89 1HE TYR 89 -6.363 -7.106 16.371 677 HE2 TYR 89 2HE TYR 89 -5.593 -11.039 14.909 678 HH TYR 89 HH TYR 89 -6.476 -9.961 17.424 679 H ALA 90 H ALA 90 -4.983 -5.680 9.723 680 HA ALA 90 HA ALA 90 -5.685 -3.470 11.518 681 HB1 ALA 90 1HB ALA 90 -3.575 -2.803 10.586 682 HB2 ALA 90 2HB ALA 90 -4.126 -3.185 8.954 683 HB3 ALA 90 3HB ALA 90 -4.851 -1.842 9.838 684 H LEU 91 H LEU 91 -7.394 -2.141 10.777 685 HA LEU 91 HA LEU 91 -9.160 -3.504 8.894 686 HB2 LEU 91 1HB LEU 91 -9.833 -2.704 11.239 687 HB3 LEU 91 2HB LEU 91 -9.858 -1.090 10.532 688 HG LEU 91 HG LEU 91 -11.552 -1.936 8.887 689 HD11 LEU 91 1HD1 LEU 91 -12.672 -3.997 9.270 690 HD12 LEU 91 2HD1 LEU 91 -11.776 -4.280 10.762 691 HD13 LEU 91 3HD1 LEU 91 -10.943 -4.346 9.208 692 HD21 LEU 91 1HD2 LEU 91 -11.907 -0.851 11.297 693 HD22 LEU 91 2HD2 LEU 91 -12.722 -2.392 11.569 694 HD23 LEU 91 3HD2 LEU 91 -13.252 -1.331 10.262 695 HA PRO 92 HA PRO 92 -8.318 -0.620 5.662 696 HB2 PRO 92 1HB PRO 92 -10.508 -1.108 4.135 697 HB3 PRO 92 2HB PRO 92 -9.139 -2.222 4.236 698 HG2 PRO 92 1HG PRO 92 -11.773 -2.324 5.656 699 HG3 PRO 92 2HG PRO 92 -10.864 -3.639 4.888 700 HD2 PRO 92 1HD PRO 92 -10.848 -3.225 7.565 701 HD3 PRO 92 2HD PRO 92 -9.448 -3.880 6.691 702 H GLU 93 H GLU 93 -11.153 -0.529 7.639 703 HA GLU 93 HA GLU 93 -12.375 1.772 6.519 704 HB2 GLU 93 1HB GLU 93 -13.895 1.627 8.238 705 HB3 GLU 93 2HB GLU 93 -13.281 -0.020 8.219 706 HG2 GLU 93 1HG GLU 93 -13.372 0.643 10.478 707 HG3 GLU 93 2HG GLU 93 -11.671 0.664 10.017 708 H ASP 94 H ASP 94 -9.888 1.278 8.939 709 HA ASP 94 HA ASP 94 -9.857 4.005 9.826 710 HB2 ASP 94 1HB ASP 94 -8.249 3.349 11.336 711 HB3 ASP 94 2HB ASP 94 -9.014 1.796 11.011 712 H LEU 95 H LEU 95 -8.003 2.063 7.539 713 HA LEU 95 HA LEU 95 -5.916 3.792 6.985 714 HB2 LEU 95 1HB LEU 95 -5.843 1.638 6.049 715 HB3 LEU 95 2HB LEU 95 -7.410 1.837 5.267 716 HG LEU 95 HG LEU 95 -6.332 3.543 3.768 717 HD11 LEU 95 1HD1 LEU 95 -3.915 3.556 3.595 718 HD12 LEU 95 2HD1 LEU 95 -3.790 2.420 4.938 719 HD13 LEU 95 3HD1 LEU 95 -4.413 4.046 5.214 720 HD21 LEU 95 1HD2 LEU 95 -6.750 1.401 2.863 721 HD22 LEU 95 2HD2 LEU 95 -5.421 0.676 3.768 722 HD23 LEU 95 3HD2 LEU 95 -5.082 1.789 2.443 723 H VAL 96 H VAL 96 -9.262 4.020 6.097 724 HA VAL 96 HA VAL 96 -9.124 5.744 3.910 725 HB VAL 96 HB VAL 96 -11.211 5.508 6.075 726 HG11 VAL 96 1HG1 VAL 96 -11.871 7.540 5.353 727 HG12 VAL 96 2HG1 VAL 96 -10.977 7.411 3.838 728 HG13 VAL 96 3HG1 VAL 96 -12.542 6.617 4.009 729 HG21 VAL 96 1HG2 VAL 96 -11.809 3.687 4.952 730 HG22 VAL 96 2HG2 VAL 96 -12.156 4.699 3.549 731 HG23 VAL 96 3HG2 VAL 96 -10.558 3.979 3.744 732 H GLU 97 H GLU 97 -8.944 6.403 7.364 733 HA GLU 97 HA GLU 97 -8.767 9.276 6.862 734 HB2 GLU 97 1HB GLU 97 -8.829 7.726 9.457 735 HB3 GLU 97 2HB GLU 97 -8.801 9.478 9.328 736 HG2 GLU 97 1HG GLU 97 -10.944 9.325 8.043 737 HG3 GLU 97 2HG GLU 97 -10.986 7.611 8.452 738 H VAL 98 H VAL 98 -6.657 7.315 6.098 739 HA VAL 98 HA VAL 98 -4.394 6.965 6.302 740 HB VAL 98 HB VAL 98 -4.375 9.941 6.802 741 HG11 VAL 98 1HG1 VAL 98 -2.295 8.157 6.679 742 HG12 VAL 98 2HG1 VAL 98 -2.376 8.773 5.028 743 HG13 VAL 98 3HG1 VAL 98 -2.180 9.890 6.378 744 HG21 VAL 98 1HG2 VAL 98 -4.773 8.395 4.251 745 HG22 VAL 98 2HG2 VAL 98 -5.810 9.643 4.942 746 HG23 VAL 98 3HG2 VAL 98 -4.233 10.075 4.280 747 H ASN 99 H ASN 99 -5.328 6.099 8.594 748 HA ASN 99 HA ASN 99 -4.111 7.518 10.819 749 HB2 ASN 99 1HB ASN 99 -5.763 4.994 10.658 750 HB3 ASN 99 2HB ASN 99 -5.072 5.599 12.160 751 HD21 ASN 99 1HD2 ASN 99 -7.670 5.315 12.200 752 HD22 ASN 99 2HD2 ASN 99 -8.497 6.825 12.060 753 HA PRO 100 HA PRO 100 -0.349 5.172 10.183 754 HB2 PRO 100 1HB PRO 100 1.058 6.437 12.129 755 HB3 PRO 100 2HB PRO 100 0.775 7.145 10.535 756 HG2 PRO 100 1HG PRO 100 -0.658 7.653 13.114 757 HG3 PRO 100 2HG PRO 100 -0.123 8.813 11.883 758 HD2 PRO 100 1HD PRO 100 -2.687 7.962 12.066 759 HD3 PRO 100 2HD PRO 100 -1.931 8.390 10.518 760 H LYS 101 H LYS 101 -2.531 5.138 12.728 761 HA LYS 101 HA LYS 101 -1.020 3.631 14.631 762 HB2 LYS 101 1HB LYS 101 -3.996 4.055 14.315 763 HB3 LYS 101 2HB LYS 101 -3.260 3.210 15.670 764 HG2 LYS 101 1HG LYS 101 -2.448 5.121 16.605 765 HG3 LYS 101 2HG LYS 101 -2.293 5.946 15.051 766 HD2 LYS 101 1HD LYS 101 -4.739 6.166 14.943 767 HD3 LYS 101 2HD LYS 101 -4.871 5.374 16.514 768 HE2 LYS 101 1HE LYS 101 -3.668 7.173 17.573 769 HE3 LYS 101 2HE LYS 101 -3.350 7.929 16.012 770 HZ1 LYS 101 1HZ LYS 101 -6.095 7.476 17.029 771 HZ2 LYS 101 2HZ LYS 101 -5.607 8.480 15.759 772 HZ3 LYS 101 3HZ LYS 101 -5.229 8.892 17.356 773 H MET 102 H MET 102 -3.463 2.810 12.189 774 HA MET 102 HA MET 102 -3.038 -0.034 12.683 775 HB2 MET 102 1HB MET 102 -4.914 1.277 10.710 776 HB3 MET 102 2HB MET 102 -4.930 -0.404 11.225 777 HG2 MET 102 1HG MET 102 -5.681 2.032 12.802 778 HG3 MET 102 2HG MET 102 -6.684 0.649 12.375 779 HE1 MET 102 1HE MET 102 -4.632 -2.124 14.103 780 HE2 MET 102 2HE MET 102 -6.373 -1.933 14.313 781 HE3 MET 102 3HE MET 102 -5.638 -1.650 12.734 782 H VAL 103 H VAL 103 -2.378 2.431 10.291 783 HA VAL 103 HA VAL 103 -1.678 0.796 8.125 784 HB VAL 103 HB VAL 103 -0.517 3.491 8.844 785 HG11 VAL 103 1HG1 VAL 103 -0.037 1.666 6.657 786 HG12 VAL 103 2HG1 VAL 103 -0.654 3.215 6.079 787 HG13 VAL 103 3HG1 VAL 103 0.798 3.160 7.079 788 HG21 VAL 103 1HG2 VAL 103 -2.365 4.496 8.049 789 HG22 VAL 103 2HG2 VAL 103 -2.591 3.301 6.772 790 HG23 VAL 103 3HG2 VAL 103 -3.143 2.955 8.411 791 H MET 104 H MET 104 -0.229 1.033 11.129 792 HA MET 104 HA MET 104 2.491 0.964 10.680 793 HB2 MET 104 1HB MET 104 2.715 -0.084 12.802 794 HB3 MET 104 2HB MET 104 1.299 0.953 12.908 795 HG2 MET 104 1HG MET 104 -0.013 -1.187 12.290 796 HG3 MET 104 2HG MET 104 1.453 -2.025 12.791 797 HE1 MET 104 1HE MET 104 -0.641 -3.152 14.722 798 HE2 MET 104 2HE MET 104 -1.635 -1.940 15.531 799 HE3 MET 104 3HE MET 104 -1.607 -2.025 13.768 800 H THR 105 H THR 105 0.155 -1.685 10.467 801 HA THR 105 HA THR 105 2.264 -3.497 9.554 802 HB THR 105 HB THR 105 0.196 -5.126 9.526 803 HG1 THR 105 1HG THR 105 -1.137 -3.111 10.099 804 HG21 THR 105 1HG2 THR 105 1.670 -4.100 11.938 805 HG22 THR 105 2HG2 THR 105 1.964 -5.572 11.010 806 HG23 THR 105 3HG2 THR 105 0.539 -5.449 12.043 807 H VAL 106 H VAL 106 -0.635 -1.867 8.446 808 HA VAL 106 HA VAL 106 -1.384 -3.090 6.179 809 HB VAL 106 HB VAL 106 -0.893 -0.137 6.546 810 HG11 VAL 106 1HG1 VAL 106 -1.094 0.036 4.324 811 HG12 VAL 106 2HG1 VAL 106 -1.655 -1.629 4.155 812 HG13 VAL 106 3HG1 VAL 106 -2.794 -0.353 4.585 813 HG21 VAL 106 1HG2 VAL 106 -2.567 -1.168 8.018 814 HG22 VAL 106 2HG2 VAL 106 -3.300 -0.036 6.882 815 HG23 VAL 106 3HG2 VAL 106 -3.429 -1.772 6.603 816 H PHE 107 H PHE 107 1.244 -0.673 6.164 817 HA PHE 107 HA PHE 107 2.125 -1.465 3.558 818 HB2 PHE 107 1HB PHE 107 3.025 0.500 5.615 819 HB3 PHE 107 2HB PHE 107 4.169 0.024 4.364 820 HD1 PHE 107 2HD PHE 107 2.526 -0.237 2.000 821 HD2 PHE 107 1HD PHE 107 2.328 2.639 5.130 822 HE1 PHE 107 2HE PHE 107 1.502 1.374 0.449 823 HE2 PHE 107 1HE PHE 107 1.303 4.256 3.585 824 HZ PHE 107 HZ PHE 107 0.890 3.625 1.240 825 H ALA 108 H ALA 108 3.433 -1.834 6.840 826 HA ALA 108 HA ALA 108 5.819 -3.010 6.476 827 HB1 ALA 108 1HB ALA 108 5.646 -3.498 8.638 828 HB2 ALA 108 2HB ALA 108 3.984 -2.911 8.561 829 HB3 ALA 108 3HB ALA 108 4.323 -4.628 8.345 830 H CYS 109 H CYS 109 2.890 -5.036 6.739 831 HA CYS 109 HA CYS 109 3.888 -7.440 5.986 832 HB2 CYS 109 1HB CYS 109 1.444 -6.697 6.541 833 HB3 CYS 109 2HB CYS 109 1.278 -6.564 4.795 834 HG CYS 109 HG CYS 109 0.324 -8.983 4.876 835 H LEU 110 H LEU 110 3.157 -4.732 3.876 836 HA LEU 110 HA LEU 110 3.679 -6.245 1.470 837 HB2 LEU 110 1HB LEU 110 3.226 -3.301 1.925 838 HB3 LEU 110 2HB LEU 110 3.403 -4.055 0.342 839 HG LEU 110 HG LEU 110 1.249 -5.016 2.170 840 HD11 LEU 110 1HD1 LEU 110 -0.193 -3.259 0.916 841 HD12 LEU 110 2HD1 LEU 110 1.331 -2.385 0.756 842 HD13 LEU 110 3HD1 LEU 110 0.706 -2.781 2.357 843 HD21 LEU 110 1HD2 LEU 110 0.374 -4.738 -0.462 844 HD22 LEU 110 2HD2 LEU 110 0.852 -6.228 0.352 845 HD23 LEU 110 3HD2 LEU 110 2.035 -5.317 -0.587 846 H MET 111 H MET 111 5.099 -3.179 2.600 847 HA MET 111 HA MET 111 7.354 -3.099 1.118 848 HB2 MET 111 1HB MET 111 8.320 -1.681 2.737 849 HB3 MET 111 2HB MET 111 6.584 -1.462 2.914 850 HG2 MET 111 1HG MET 111 7.285 -1.619 5.097 851 HG3 MET 111 2HG MET 111 6.783 -3.272 4.745 852 HE1 MET 111 1HE MET 111 11.148 -1.811 4.945 853 HE2 MET 111 2HE MET 111 10.202 -1.583 3.474 854 HE3 MET 111 3HE MET 111 9.712 -0.786 4.969 855 H GLY 112 H GLY 112 6.708 -5.279 3.758 856 HA2 GLY 112 1HA GLY 112 9.099 -6.167 4.633 857 HA3 GLY 112 2HA GLY 112 7.781 -7.269 4.265 858 H LYS 113 H LYS 113 7.901 -6.513 1.383 859 HA LYS 113 HA LYS 113 9.501 -8.596 0.458 860 HB2 LYS 113 1HB LYS 113 7.670 -7.623 -0.849 861 HB3 LYS 113 2HB LYS 113 8.580 -6.130 -1.031 862 HG2 LYS 113 1HG LYS 113 8.913 -7.216 -3.049 863 HG3 LYS 113 2HG LYS 113 10.374 -7.601 -2.136 864 HD2 LYS 113 1HD LYS 113 9.016 -9.705 -1.399 865 HD3 LYS 113 2HD LYS 113 8.054 -9.353 -2.836 866 HE2 LYS 113 1HE LYS 113 9.881 -9.661 -4.270 867 HE3 LYS 113 2HE LYS 113 11.047 -9.524 -2.956 868 HZ1 LYS 113 1HZ LYS 113 10.267 -11.843 -3.987 869 HZ2 LYS 113 2HZ LYS 113 9.135 -11.700 -2.738 870 HZ3 LYS 113 3HZ LYS 113 10.789 -11.673 -2.386 871 H GLY 114 H GLY 114 10.188 -5.116 0.631 872 HA2 GLY 114 1HA GLY 114 12.491 -4.758 -0.667 873 HA3 GLY 114 2HA GLY 114 12.265 -4.111 0.951 874 H MET 115 H MET 115 14.519 -5.498 -0.731 875 HA MET 115 HA MET 115 15.236 -7.742 0.917 876 HB2 MET 115 1HB MET 115 16.718 -6.242 -1.244 877 HB3 MET 115 2HB MET 115 17.386 -7.632 -0.400 878 HG2 MET 115 1HG MET 115 15.785 -9.089 -1.307 879 HG3 MET 115 2HG MET 115 14.764 -7.759 -1.846 880 HE1 MET 115 1HE MET 115 14.314 -8.530 -3.861 881 HE2 MET 115 2HE MET 115 15.261 -8.129 -5.294 882 HE3 MET 115 3HE MET 115 15.380 -9.738 -4.578 883 H LYS 116 H LYS 116 14.876 -5.875 2.722 884 HA LYS 116 HA LYS 116 15.809 -4.472 4.289 885 HB2 LYS 116 1HB LYS 116 17.948 -6.598 4.064 886 HB3 LYS 116 2HB LYS 116 17.731 -5.509 5.429 887 HG2 LYS 116 1HG LYS 116 15.532 -6.487 5.859 888 HG3 LYS 116 2HG LYS 116 15.754 -7.581 4.493 889 HD2 LYS 116 1HD LYS 116 16.418 -8.930 6.228 890 HD3 LYS 116 2HD LYS 116 17.963 -8.212 5.767 891 HE2 LYS 116 1HE LYS 116 16.279 -6.858 7.824 892 HE3 LYS 116 2HE LYS 116 17.209 -8.284 8.279 893 HZ1 LYS 116 1HZ LYS 116 18.117 -5.611 7.641 894 HZ2 LYS 116 2HZ LYS 116 19.044 -6.854 6.965 895 HZ3 LYS 116 3HZ LYS 116 18.817 -6.784 8.640 896 H ARG 117 H ARG 117 16.313 -3.490 1.717 897 HA ARG 117 HA ARG 117 19.095 -2.813 1.462 898 HB2 ARG 117 1HB ARG 117 16.613 -1.870 0.026 899 HB3 ARG 117 2HB ARG 117 18.223 -1.268 -0.346 900 HG2 ARG 117 1HG ARG 117 17.568 -4.194 -0.417 901 HG3 ARG 117 2HG ARG 117 17.304 -3.135 -1.804 902 HD2 ARG 117 1HD ARG 117 19.751 -2.444 -1.500 903 HD3 ARG 117 2HD ARG 117 19.888 -3.860 -0.458 904 HE ARG 117 HE ARG 117 18.800 -4.873 -2.710 905 HH11 ARG 117 1HH1 ARG 117 21.580 -2.866 -2.108 906 HH12 ARG 117 2HH1 ARG 117 22.473 -3.469 -3.466 907 HH21 ARG 117 1HH2 ARG 117 19.965 -5.676 -4.499 908 HH22 ARG 117 2HH2 ARG 117 21.552 -5.067 -4.826 909 H VAL 118 H VAL 118 20.016 -0.740 1.678 910 HA VAL 118 HA VAL 118 18.461 1.350 2.970 911 HB VAL 118 HB VAL 118 19.258 -0.039 4.850 912 HG11 VAL 118 1HG1 VAL 118 21.992 0.655 3.786 913 HG12 VAL 118 2HG1 VAL 118 21.678 -0.077 5.361 914 HG13 VAL 118 3HG1 VAL 118 21.273 -0.951 3.884 915 HG21 VAL 118 1HG2 VAL 118 19.800 1.750 6.185 916 HG22 VAL 118 2HG2 VAL 118 20.873 2.463 4.981 917 HG23 VAL 118 3HG2 VAL 118 19.125 2.581 4.783 918 H SER 119 H SER 119 19.513 3.401 2.982 919 HA SER 119 HA SER 119 22.002 3.585 1.444 920 HB2 SER 119 1HB SER 119 19.497 5.166 0.815 921 HB3 SER 119 2HB SER 119 21.067 5.376 0.039 922 HG SER 119 HG SER 119 20.868 3.136 -0.617 923 H GLY 120 H GLY 120 23.364 5.152 2.125 924 HA2 GLY 120 1HA GLY 120 22.885 7.599 3.197 925 HA3 GLY 120 2HA GLY 120 22.701 6.522 4.575 926 HA PRO 121 HA PRO 121 27.202 7.756 3.960 927 HB2 PRO 121 1HB PRO 121 27.500 9.019 6.344 928 HB3 PRO 121 2HB PRO 121 26.962 9.848 4.878 929 HG2 PRO 121 1HG PRO 121 25.339 8.803 7.165 930 HG3 PRO 121 2HG PRO 121 25.186 10.340 6.296 931 HD2 PRO 121 1HD PRO 121 23.572 8.223 5.806 932 HD3 PRO 121 2HD PRO 121 24.040 9.380 4.543 933 H SER 122 H SER 122 28.933 7.467 5.869 934 HA SER 122 HA SER 122 28.800 4.719 6.584 935 HB2 SER 122 1HB SER 122 30.742 6.893 7.394 936 HB3 SER 122 2HB SER 122 30.954 5.182 7.769 937 HG SER 122 HG SER 122 30.581 5.064 5.292 938 H SER 123 H SER 123 28.887 3.815 8.713 939 HA SER 123 HA SER 123 27.271 5.344 10.620 940 HB2 SER 123 1HB SER 123 26.601 3.006 9.804 941 HB3 SER 123 2HB SER 123 27.921 2.405 10.807 942 HG SER 123 HG SER 123 25.943 4.123 11.856 943 H GLY 124 H GLY 124 28.378 6.412 12.117 944 HA2 GLY 124 1HA GLY 124 29.702 6.594 14.031 945 HA3 GLY 124 2HA GLY 124 30.366 5.002 13.695 Start of MODEL 14 1 H1 GLY 1 H GLY 1 19.442 11.023 -8.298 2 HA2 GLY 1 1HA GLY 1 17.191 9.400 -7.574 3 HA3 GLY 1 2HA GLY 1 18.718 8.579 -7.288 4 H SER 2 H SER 2 16.657 11.232 -6.347 5 HA SER 2 HA SER 2 18.230 12.619 -4.573 6 HB2 SER 2 1HB SER 2 15.310 11.891 -4.241 7 HB3 SER 2 2HB SER 2 16.145 13.172 -3.363 8 HG SER 2 HG SER 2 15.347 14.262 -5.025 9 H SER 3 H SER 3 18.241 12.563 -2.188 10 HA SER 3 HA SER 3 17.699 10.074 -0.860 11 HB2 SER 3 1HB SER 3 20.569 10.920 -1.316 12 HB3 SER 3 2HB SER 3 20.064 9.668 -0.180 13 HG SER 3 HG SER 3 20.158 8.377 -1.825 14 H GLY 4 H GLY 4 17.410 10.373 1.285 15 HA2 GLY 4 1HA GLY 4 18.621 12.655 2.625 16 HA3 GLY 4 2HA GLY 4 16.869 12.695 2.483 17 H SER 5 H SER 5 15.620 11.131 3.590 18 HA SER 5 HA SER 5 16.634 10.451 6.143 19 HB2 SER 5 1HB SER 5 14.206 10.925 5.516 20 HB3 SER 5 2HB SER 5 14.152 9.277 4.890 21 HG SER 5 HG SER 5 14.566 10.142 7.548 22 H SER 6 H SER 6 17.167 8.471 7.037 23 HA SER 6 HA SER 6 17.470 6.221 5.166 24 HB2 SER 6 1HB SER 6 19.651 5.695 6.229 25 HB3 SER 6 2HB SER 6 19.662 7.256 5.411 26 HG SER 6 HG SER 6 19.200 8.172 7.535 27 H GLY 7 H GLY 7 17.765 4.117 6.280 28 HA2 GLY 7 1HA GLY 7 17.623 3.076 8.582 29 HA3 GLY 7 2HA GLY 7 16.193 4.079 8.780 30 H ASN 8 H ASN 8 16.128 1.315 9.096 31 HA ASN 8 HA ASN 8 15.288 -0.029 6.740 32 HB2 ASN 8 1HB ASN 8 16.130 -1.250 8.689 33 HB3 ASN 8 2HB ASN 8 14.763 -0.688 9.647 34 HD21 ASN 8 1HD2 ASN 8 13.141 -2.044 9.826 35 HD22 ASN 8 2HD2 ASN 8 12.751 -3.319 8.726 36 H ASP 9 H ASP 9 13.575 1.636 9.342 37 HA ASP 9 HA ASP 9 10.985 1.027 8.205 38 HB2 ASP 9 1HB ASP 9 10.266 2.708 10.059 39 HB3 ASP 9 2HB ASP 9 10.872 1.122 10.527 40 H ASP 10 H ASP 10 13.370 3.448 7.875 41 HA ASP 10 HA ASP 10 11.616 5.572 7.071 42 HB2 ASP 10 1HB ASP 10 14.594 5.161 6.985 43 HB3 ASP 10 2HB ASP 10 13.845 6.545 6.192 44 H ILE 11 H ILE 11 13.261 2.939 5.503 45 HA ILE 11 HA ILE 11 13.015 3.964 2.842 46 HB ILE 11 HB ILE 11 14.627 2.128 3.744 47 HG12 ILE 11 1HG1 ILE 11 13.340 1.471 1.110 48 HG13 ILE 11 2HG1 ILE 11 14.195 2.994 1.329 49 HG21 ILE 11 1HG2 ILE 11 12.392 0.787 4.322 50 HG22 ILE 11 2HG2 ILE 11 12.669 0.178 2.691 51 HG23 ILE 11 3HG2 ILE 11 13.912 -0.015 3.928 52 HD11 ILE 11 1HD1 ILE 11 16.189 1.659 2.039 53 HD12 ILE 11 2HD1 ILE 11 15.311 0.215 1.536 54 HD13 ILE 11 3HD1 ILE 11 15.710 1.462 0.353 55 H ILE 12 H ILE 12 10.885 2.432 5.026 56 HA ILE 12 HA ILE 12 9.197 0.887 3.576 57 HB ILE 12 HB ILE 12 8.324 3.022 5.525 58 HG12 ILE 12 1HG1 ILE 12 8.987 0.105 5.980 59 HG13 ILE 12 2HG1 ILE 12 10.016 1.460 6.430 60 HG21 ILE 12 1HG2 ILE 12 6.240 2.143 5.543 61 HG22 ILE 12 2HG2 ILE 12 6.678 1.672 3.902 62 HG23 ILE 12 3HG2 ILE 12 6.810 0.506 5.217 63 HD11 ILE 12 1HD1 ILE 12 7.388 0.635 7.597 64 HD12 ILE 12 2HD1 ILE 12 8.941 0.855 8.402 65 HD13 ILE 12 3HD1 ILE 12 8.037 2.257 7.831 66 H VAL 13 H VAL 13 9.380 4.408 3.499 67 HA VAL 13 HA VAL 13 7.136 4.689 1.722 68 HB VAL 13 HB VAL 13 9.252 6.651 2.610 69 HG11 VAL 13 1HG1 VAL 13 7.595 8.344 1.649 70 HG12 VAL 13 2HG1 VAL 13 8.613 7.462 0.508 71 HG13 VAL 13 3HG1 VAL 13 6.930 6.988 0.739 72 HG21 VAL 13 1HG2 VAL 13 6.931 7.601 3.561 73 HG22 VAL 13 2HG2 VAL 13 6.562 5.876 3.561 74 HG23 VAL 13 3HG2 VAL 13 7.955 6.479 4.459 75 H ASN 14 H ASN 14 10.667 4.951 1.405 76 HA ASN 14 HA ASN 14 10.822 5.669 -1.265 77 HB2 ASN 14 1HB ASN 14 12.894 5.725 -0.289 78 HB3 ASN 14 2HB ASN 14 12.620 4.248 0.631 79 HD21 ASN 14 1HD2 ASN 14 12.984 5.351 -2.719 80 HD22 ASN 14 2HD2 ASN 14 13.923 3.998 -3.242 81 H TRP 15 H TRP 15 10.833 2.380 0.107 82 HA TRP 15 HA TRP 15 11.034 0.900 -2.193 83 HB2 TRP 15 1HB TRP 15 10.943 0.019 0.162 84 HB3 TRP 15 2HB TRP 15 9.193 0.209 0.103 85 HD1 TRP 15 HD TRP 15 12.019 -1.957 -1.291 86 HE1 TRP 15 1HE TRP 15 10.998 -4.088 -2.311 87 HE3 TRP 15 3HE TRP 15 7.070 -0.715 -0.977 88 HZ2 TRP 15 2HZ TRP 15 8.433 -5.108 -2.904 89 HZ3 TRP 15 3HZ TRP 15 5.396 -2.323 -1.792 90 HH2 TRP 15 HH TRP 15 6.065 -4.473 -2.736 91 H VAL 16 H VAL 16 8.044 2.158 -0.731 92 HA VAL 16 HA VAL 16 6.274 1.136 -2.656 93 HB VAL 16 HB VAL 16 6.008 3.585 -0.908 94 HG11 VAL 16 1HG1 VAL 16 4.496 3.807 -2.764 95 HG12 VAL 16 2HG1 VAL 16 3.945 2.141 -2.568 96 HG13 VAL 16 3HG1 VAL 16 3.573 3.346 -1.333 97 HG21 VAL 16 1HG2 VAL 16 5.456 0.687 -0.550 98 HG22 VAL 16 2HG2 VAL 16 6.055 1.876 0.606 99 HG23 VAL 16 3HG2 VAL 16 4.343 1.841 0.187 100 H ASN 17 H ASN 17 7.624 4.424 -2.350 101 HA ASN 17 HA ASN 17 6.541 5.553 -4.617 102 HB2 ASN 17 1HB ASN 17 9.109 6.020 -3.140 103 HB3 ASN 17 2HB ASN 17 8.785 6.899 -4.631 104 HD21 ASN 17 1HD2 ASN 17 7.507 6.193 -1.427 105 HD22 ASN 17 2HD2 ASN 17 6.628 7.670 -1.254 106 H GLU 18 H GLU 18 9.647 3.833 -4.354 107 HA GLU 18 HA GLU 18 10.389 4.033 -7.042 108 HB2 GLU 18 1HB GLU 18 11.117 2.242 -4.779 109 HB3 GLU 18 2HB GLU 18 11.574 1.732 -6.398 110 HG2 GLU 18 1HG GLU 18 12.234 4.475 -5.405 111 HG3 GLU 18 2HG GLU 18 13.250 3.090 -5.008 112 H THR 19 H THR 19 9.084 1.126 -5.437 113 HA THR 19 HA THR 19 8.650 -0.531 -7.499 114 HB THR 19 HB THR 19 6.723 0.042 -5.244 115 HG1 THR 19 1HG THR 19 9.028 -0.958 -5.095 116 HG21 THR 19 1HG2 THR 19 6.074 -2.442 -5.864 117 HG22 THR 19 2HG2 THR 19 6.603 -1.937 -7.470 118 HG23 THR 19 3HG2 THR 19 5.298 -1.073 -6.658 119 H LEU 20 H LEU 20 6.639 2.270 -6.724 120 HA LEU 20 HA LEU 20 4.749 1.767 -8.815 121 HB2 LEU 20 1HB LEU 20 5.299 4.225 -7.163 122 HB3 LEU 20 2HB LEU 20 3.963 4.070 -8.299 123 HG LEU 20 HG LEU 20 4.223 2.085 -6.085 124 HD11 LEU 20 1HD1 LEU 20 4.447 4.535 -5.259 125 HD12 LEU 20 2HD1 LEU 20 3.299 3.454 -4.471 126 HD13 LEU 20 3HD1 LEU 20 2.730 4.637 -5.649 127 HD21 LEU 20 1HD2 LEU 20 2.279 2.870 -8.074 128 HD22 LEU 20 2HD2 LEU 20 1.593 2.910 -6.450 129 HD23 LEU 20 3HD2 LEU 20 2.334 1.429 -7.059 130 H ARG 21 H ARG 21 7.551 3.888 -8.411 131 HA ARG 21 HA ARG 21 7.293 5.322 -10.807 132 HB2 ARG 21 1HB ARG 21 8.888 5.665 -8.768 133 HB3 ARG 21 2HB ARG 21 9.976 4.620 -9.670 134 HG2 ARG 21 1HG ARG 21 10.328 6.170 -11.316 135 HG3 ARG 21 2HG ARG 21 8.774 6.963 -11.054 136 HD2 ARG 21 1HD ARG 21 10.836 7.042 -8.900 137 HD3 ARG 21 2HD ARG 21 11.010 8.105 -10.296 138 HE ARG 21 HE ARG 21 9.098 8.341 -8.167 139 HH11 ARG 21 1HH1 ARG 21 9.780 9.107 -11.493 140 HH12 ARG 21 2HH1 ARG 21 8.719 10.476 -11.530 141 HH21 ARG 21 1HH2 ARG 21 7.699 10.142 -8.203 142 HH22 ARG 21 2HH2 ARG 21 7.537 11.064 -9.659 143 H GLU 22 H GLU 22 9.219 2.414 -10.080 144 HA GLU 22 HA GLU 22 10.260 2.051 -12.655 145 HB2 GLU 22 1HB GLU 22 10.865 -0.152 -11.955 146 HB3 GLU 22 2HB GLU 22 11.039 0.905 -10.563 147 HG2 GLU 22 1HG GLU 22 8.876 0.132 -9.714 148 HG3 GLU 22 2HG GLU 22 8.729 -0.947 -11.099 149 H ALA 23 H ALA 23 7.120 1.456 -11.379 150 HA ALA 23 HA ALA 23 6.384 -0.270 -13.623 151 HB1 ALA 23 1HB ALA 23 4.972 0.492 -11.082 152 HB2 ALA 23 2HB ALA 23 4.169 -0.375 -12.392 153 HB3 ALA 23 3HB ALA 23 5.558 -1.095 -11.577 154 H GLU 24 H GLU 24 6.451 2.989 -12.854 155 HA GLU 24 HA GLU 24 5.660 4.844 -13.912 156 HB2 GLU 24 1HB GLU 24 4.331 3.069 -15.947 157 HB3 GLU 24 2HB GLU 24 4.943 4.704 -16.156 158 HG2 GLU 24 1HG GLU 24 7.164 3.994 -16.216 159 HG3 GLU 24 2HG GLU 24 6.775 2.424 -15.514 160 H LYS 25 H LYS 25 4.250 4.127 -11.776 161 HA LYS 25 HA LYS 25 1.421 4.044 -12.506 162 HB2 LYS 25 1HB LYS 25 2.980 3.500 -10.026 163 HB3 LYS 25 2HB LYS 25 1.318 4.045 -9.845 164 HG2 LYS 25 1HG LYS 25 1.715 1.543 -9.872 165 HG3 LYS 25 2HG LYS 25 0.460 2.165 -10.948 166 HD2 LYS 25 1HD LYS 25 2.120 2.145 -12.798 167 HD3 LYS 25 2HD LYS 25 3.274 1.379 -11.703 168 HE2 LYS 25 1HE LYS 25 2.143 -0.612 -11.686 169 HE3 LYS 25 2HE LYS 25 0.585 0.145 -12.016 170 HZ1 LYS 25 1HZ LYS 25 1.288 0.518 -14.296 171 HZ2 LYS 25 2HZ LYS 25 1.370 -1.127 -13.912 172 HZ3 LYS 25 3HZ LYS 25 2.786 -0.203 -13.980 173 H SER 26 H SER 26 -0.086 5.572 -11.669 174 HA SER 26 HA SER 26 1.063 8.248 -11.441 175 HB2 SER 26 1HB SER 26 -0.721 7.865 -13.110 176 HB3 SER 26 2HB SER 26 -1.822 7.402 -11.812 177 HG SER 26 HG SER 26 -1.197 9.857 -12.696 178 H SER 27 H SER 27 0.573 5.967 -9.309 179 HA SER 27 HA SER 27 -0.618 7.751 -7.287 180 HB2 SER 27 1HB SER 27 -0.541 4.723 -7.280 181 HB3 SER 27 2HB SER 27 -1.298 5.746 -6.057 182 HG SER 27 HG SER 27 -2.422 6.583 -8.151 183 H SER 28 H SER 28 0.311 7.764 -5.191 184 HA SER 28 HA SER 28 2.611 6.316 -4.460 185 HB2 SER 28 1HB SER 28 4.355 7.958 -4.699 186 HB3 SER 28 2HB SER 28 3.597 7.747 -6.277 187 HG SER 28 HG SER 28 3.092 9.776 -6.236 188 H ILE 29 H ILE 29 3.866 7.788 -2.674 189 HA ILE 29 HA ILE 29 1.852 9.217 -1.092 190 HB ILE 29 HB ILE 29 2.880 8.039 0.958 191 HG12 ILE 29 1HG1 ILE 29 3.336 5.750 -0.912 192 HG13 ILE 29 2HG1 ILE 29 4.613 6.945 -0.708 193 HG21 ILE 29 1HG2 ILE 29 0.850 7.053 -0.951 194 HG22 ILE 29 2HG2 ILE 29 1.363 5.932 0.309 195 HG23 ILE 29 3HG2 ILE 29 0.691 7.502 0.747 196 HD11 ILE 29 1HD1 ILE 29 4.639 6.513 1.688 197 HD12 ILE 29 2HD1 ILE 29 3.350 5.324 1.489 198 HD13 ILE 29 3HD1 ILE 29 4.932 5.041 0.762 199 H SER 30 H SER 30 2.695 10.691 0.437 200 HA SER 30 HA SER 30 5.388 11.614 -0.235 201 HB2 SER 30 1HB SER 30 3.210 13.083 -0.172 202 HB3 SER 30 2HB SER 30 3.527 13.129 1.561 203 HG SER 30 HG SER 30 4.855 14.360 -0.507 204 H SER 31 H SER 31 3.463 10.477 2.466 205 HA SER 31 HA SER 31 5.786 9.716 3.934 206 HB2 SER 31 1HB SER 31 5.701 12.174 4.409 207 HB3 SER 31 2HB SER 31 4.118 11.930 5.149 208 HG SER 31 HG SER 31 6.359 10.440 5.989 209 H PHE 32 H PHE 32 5.111 8.944 6.209 210 HA PHE 32 HA PHE 32 3.261 6.921 5.998 211 HB2 PHE 32 1HB PHE 32 4.270 8.395 8.430 212 HB3 PHE 32 2HB PHE 32 3.221 6.985 8.545 213 HD1 PHE 32 1HD PHE 32 6.507 8.157 7.318 214 HD2 PHE 32 2HD PHE 32 4.087 4.814 8.358 215 HE1 PHE 32 1HE PHE 32 8.476 6.689 7.167 216 HE2 PHE 32 2HE PHE 32 6.051 3.340 8.210 217 HZ PHE 32 HZ PHE 32 8.250 4.278 7.614 218 H LYS 33 H LYS 33 2.729 10.275 6.697 219 HA LYS 33 HA LYS 33 -0.107 9.737 7.267 220 HB2 LYS 33 1HB LYS 33 1.664 12.091 7.903 221 HB3 LYS 33 2HB LYS 33 -0.088 12.174 8.029 222 HG2 LYS 33 1HG LYS 33 -0.113 10.480 9.717 223 HG3 LYS 33 2HG LYS 33 1.612 10.172 9.499 224 HD2 LYS 33 1HD LYS 33 2.111 12.444 10.270 225 HD3 LYS 33 2HD LYS 33 0.386 12.748 10.489 226 HE2 LYS 33 1HE LYS 33 0.557 10.568 11.972 227 HE3 LYS 33 2HE LYS 33 2.244 11.063 12.089 228 HZ1 LYS 33 1HZ LYS 33 0.948 11.976 13.899 229 HZ2 LYS 33 2HZ LYS 33 -0.109 12.726 12.811 230 HZ3 LYS 33 3HZ LYS 33 1.506 13.223 12.902 231 H ASP 34 H ASP 34 0.602 9.450 4.652 232 HA ASP 34 HA ASP 34 0.207 11.911 3.205 233 HB2 ASP 34 1HB ASP 34 1.576 10.409 2.051 234 HB3 ASP 34 2HB ASP 34 0.547 9.031 2.429 235 HA PRO 35 HA PRO 35 -4.199 11.863 3.169 236 HB2 PRO 35 1HB PRO 35 -4.599 13.464 1.014 237 HB3 PRO 35 2HB PRO 35 -4.061 14.079 2.581 238 HG2 PRO 35 1HG PRO 35 -2.451 13.466 0.132 239 HG3 PRO 35 2HG PRO 35 -2.338 14.857 1.227 240 HD2 PRO 35 1HD PRO 35 -0.633 12.757 1.357 241 HD3 PRO 35 2HD PRO 35 -1.116 13.685 2.791 242 H LYS 36 H LYS 36 -2.532 11.377 0.063 243 HA LYS 36 HA LYS 36 -4.588 10.327 -1.438 244 HB2 LYS 36 1HB LYS 36 -1.710 9.396 -1.460 245 HB3 LYS 36 2HB LYS 36 -2.876 9.186 -2.760 246 HG2 LYS 36 1HG LYS 36 -1.974 11.866 -1.733 247 HG3 LYS 36 2HG LYS 36 -1.249 11.035 -3.112 248 HD2 LYS 36 1HD LYS 36 -4.201 11.506 -3.028 249 HD3 LYS 36 2HD LYS 36 -3.113 12.810 -3.507 250 HE2 LYS 36 1HE LYS 36 -2.185 11.390 -5.266 251 HE3 LYS 36 2HE LYS 36 -3.256 10.076 -4.778 252 HZ1 LYS 36 1HZ LYS 36 -4.459 10.984 -6.465 253 HZ2 LYS 36 2HZ LYS 36 -3.885 12.554 -6.207 254 HZ3 LYS 36 3HZ LYS 36 -5.067 11.907 -5.185 255 H ILE 37 H ILE 37 -2.790 8.834 1.147 256 HA ILE 37 HA ILE 37 -3.348 6.143 0.671 257 HB ILE 37 HB ILE 37 -3.115 7.522 3.348 258 HG12 ILE 37 1HG1 ILE 37 -1.073 6.344 1.468 259 HG13 ILE 37 2HG1 ILE 37 -1.123 7.973 2.135 260 HG21 ILE 37 1HG2 ILE 37 -3.445 5.543 4.294 261 HG22 ILE 37 2HG2 ILE 37 -3.797 4.861 2.706 262 HG23 ILE 37 3HG2 ILE 37 -2.147 4.839 3.329 263 HD11 ILE 37 1HD1 ILE 37 0.125 5.604 3.174 264 HD12 ILE 37 2HD1 ILE 37 0.289 7.284 3.689 265 HD13 ILE 37 3HD1 ILE 37 -1.006 6.284 4.345 266 H SER 38 H SER 38 -5.350 8.692 1.954 267 HA SER 38 HA SER 38 -7.328 7.190 3.225 268 HB2 SER 38 1HB SER 38 -8.764 9.130 2.964 269 HB3 SER 38 2HB SER 38 -7.126 9.674 3.329 270 HG SER 38 HG SER 38 -7.271 10.787 1.564 271 H THR 39 H THR 39 -6.821 7.913 -0.169 272 HA THR 39 HA THR 39 -9.343 6.687 -0.937 273 HB THR 39 HB THR 39 -8.532 7.163 -3.282 274 HG1 THR 39 1HG THR 39 -6.254 7.269 -2.578 275 HG21 THR 39 1HG2 THR 39 -9.757 8.790 -1.481 276 HG22 THR 39 2HG2 THR 39 -9.491 9.202 -3.176 277 HG23 THR 39 3HG2 THR 39 -8.369 9.775 -1.941 278 H SER 40 H SER 40 -6.252 5.641 -0.216 279 HA SER 40 HA SER 40 -5.229 3.614 -0.388 280 HB2 SER 40 1HB SER 40 -7.729 2.637 -1.780 281 HB3 SER 40 2HB SER 40 -6.517 1.663 -0.948 282 HG SER 40 HG SER 40 -8.344 3.505 0.195 283 H LEU 41 H LEU 41 -5.204 5.679 -2.533 284 HA LEU 41 HA LEU 41 -5.077 4.382 -5.053 285 HB2 LEU 41 1HB LEU 41 -4.200 7.019 -3.973 286 HB3 LEU 41 2HB LEU 41 -3.604 6.499 -5.547 287 HG LEU 41 HG LEU 41 -6.504 6.860 -4.793 288 HD11 LEU 41 1HD1 LEU 41 -5.431 8.995 -4.951 289 HD12 LEU 41 2HD1 LEU 41 -6.378 8.740 -6.415 290 HD13 LEU 41 3HD1 LEU 41 -4.628 8.535 -6.452 291 HD21 LEU 41 1HD2 LEU 41 -6.834 6.607 -7.264 292 HD22 LEU 41 2HD2 LEU 41 -6.348 5.134 -6.424 293 HD23 LEU 41 3HD2 LEU 41 -5.165 6.045 -7.364 294 HA PRO 42 HA PRO 42 -0.293 4.432 -4.287 295 HB2 PRO 42 1HB PRO 42 0.527 4.843 -1.732 296 HB3 PRO 42 2HB PRO 42 0.293 6.158 -2.889 297 HG2 PRO 42 1HG PRO 42 -1.533 5.196 -0.721 298 HG3 PRO 42 2HG PRO 42 -1.128 6.858 -1.188 299 HD2 PRO 42 1HD PRO 42 -3.429 5.652 -1.948 300 HD3 PRO 42 2HD PRO 42 -2.603 6.855 -2.959 301 H VAL 43 H VAL 43 -2.522 3.140 -1.936 302 HA VAL 43 HA VAL 43 -0.809 0.922 -1.217 303 HB VAL 43 HB VAL 43 -3.747 1.161 -0.595 304 HG11 VAL 43 1HG1 VAL 43 -2.909 -0.053 1.495 305 HG12 VAL 43 2HG1 VAL 43 -2.965 -0.969 -0.013 306 HG13 VAL 43 3HG1 VAL 43 -1.427 -0.339 0.582 307 HG21 VAL 43 1HG2 VAL 43 -2.074 2.030 1.566 308 HG22 VAL 43 2HG2 VAL 43 -1.765 3.014 0.135 309 HG23 VAL 43 3HG2 VAL 43 -3.402 2.878 0.774 310 H LEU 44 H LEU 44 -3.548 1.535 -3.326 311 HA LEU 44 HA LEU 44 -3.958 -1.236 -3.972 312 HB2 LEU 44 1HB LEU 44 -5.007 1.332 -5.131 313 HB3 LEU 44 2HB LEU 44 -5.414 -0.248 -5.797 314 HG LEU 44 HG LEU 44 -5.948 0.374 -2.914 315 HD11 LEU 44 1HD1 LEU 44 -7.956 1.416 -3.349 316 HD12 LEU 44 2HD1 LEU 44 -8.034 0.814 -5.005 317 HD13 LEU 44 3HD1 LEU 44 -6.914 2.112 -4.590 318 HD21 LEU 44 1HD2 LEU 44 -6.711 -1.679 -4.901 319 HD22 LEU 44 2HD2 LEU 44 -7.955 -1.182 -3.755 320 HD23 LEU 44 3HD2 LEU 44 -6.421 -1.827 -3.168 321 H ASP 45 H ASP 45 -2.418 1.545 -5.521 322 HA ASP 45 HA ASP 45 -1.756 0.196 -7.932 323 HB2 ASP 45 1HB ASP 45 -0.867 2.748 -6.631 324 HB3 ASP 45 2HB ASP 45 -0.010 2.138 -8.043 325 H LEU 46 H LEU 46 -0.070 0.708 -4.880 326 HA LEU 46 HA LEU 46 2.466 -0.188 -5.612 327 HB2 LEU 46 1HB LEU 46 2.304 0.841 -3.528 328 HB3 LEU 46 2HB LEU 46 0.952 -0.174 -3.029 329 HG LEU 46 HG LEU 46 2.416 -2.044 -2.667 330 HD11 LEU 46 1HD1 LEU 46 4.961 -0.728 -3.050 331 HD12 LEU 46 2HD1 LEU 46 4.045 -0.827 -4.553 332 HD13 LEU 46 3HD1 LEU 46 4.398 -2.293 -3.637 333 HD21 LEU 46 1HD2 LEU 46 2.328 -0.759 -0.737 334 HD22 LEU 46 2HD2 LEU 46 3.239 0.569 -1.458 335 HD23 LEU 46 3HD2 LEU 46 4.062 -0.928 -1.017 336 H ILE 47 H ILE 47 -0.391 -1.987 -4.586 337 HA ILE 47 HA ILE 47 0.871 -4.515 -4.392 338 HB ILE 47 HB ILE 47 -2.030 -3.843 -4.898 339 HG12 ILE 47 1HG1 ILE 47 -0.841 -4.801 -2.309 340 HG13 ILE 47 2HG1 ILE 47 -0.809 -3.092 -2.730 341 HG21 ILE 47 1HG2 ILE 47 -1.285 -6.158 -5.578 342 HG22 ILE 47 2HG2 ILE 47 -0.924 -6.446 -3.877 343 HG23 ILE 47 3HG2 ILE 47 -2.576 -6.087 -4.379 344 HD11 ILE 47 1HD1 ILE 47 -2.767 -4.171 -1.318 345 HD12 ILE 47 2HD1 ILE 47 -3.042 -2.841 -2.443 346 HD13 ILE 47 3HD1 ILE 47 -3.406 -4.496 -2.928 347 H ASP 48 H ASP 48 -1.313 -3.238 -6.912 348 HA ASP 48 HA ASP 48 -1.243 -5.223 -8.748 349 HB2 ASP 48 1HB ASP 48 -2.517 -3.190 -9.119 350 HB3 ASP 48 2HB ASP 48 -1.034 -2.255 -9.296 351 H ALA 49 H ALA 49 1.239 -2.706 -8.383 352 HA ALA 49 HA ALA 49 2.906 -3.377 -10.475 353 HB1 ALA 49 1HB ALA 49 3.507 -1.436 -9.382 354 HB2 ALA 49 2HB ALA 49 3.404 -2.178 -7.785 355 HB3 ALA 49 3HB ALA 49 4.760 -2.556 -8.848 356 H ILE 50 H ILE 50 2.656 -4.863 -7.289 357 HA ILE 50 HA ILE 50 4.929 -6.533 -7.518 358 HB ILE 50 HB ILE 50 2.463 -7.101 -5.877 359 HG12 ILE 50 1HG1 ILE 50 3.198 -4.832 -5.404 360 HG13 ILE 50 2HG1 ILE 50 3.617 -5.880 -4.055 361 HG21 ILE 50 1HG2 ILE 50 3.632 -8.721 -4.864 362 HG22 ILE 50 2HG2 ILE 50 4.670 -8.647 -6.286 363 HG23 ILE 50 3HG2 ILE 50 5.111 -7.762 -4.826 364 HD11 ILE 50 1HD1 ILE 50 5.549 -5.110 -6.223 365 HD12 ILE 50 2HD1 ILE 50 5.373 -4.236 -4.700 366 HD13 ILE 50 3HD1 ILE 50 5.904 -5.917 -4.697 367 H GLN 51 H GLN 51 1.462 -7.347 -7.791 368 HA GLN 51 HA GLN 51 2.234 -9.577 -9.555 369 HB2 GLN 51 1HB GLN 51 1.173 -10.044 -7.220 370 HB3 GLN 51 2HB GLN 51 -0.327 -9.552 -7.995 371 HG2 GLN 51 1HG GLN 51 1.456 -11.739 -9.033 372 HG3 GLN 51 2HG GLN 51 0.081 -12.007 -7.963 373 HE21 GLN 51 1HE2 GLN 51 1.074 -11.917 -11.115 374 HE22 GLN 51 2HE2 GLN 51 -0.462 -11.755 -11.889 375 HA PRO 52 HA PRO 52 -0.099 -7.037 -12.442 376 HB2 PRO 52 1HB PRO 52 0.647 -8.451 -14.636 377 HB3 PRO 52 2HB PRO 52 1.686 -7.242 -13.875 378 HG2 PRO 52 1HG PRO 52 1.732 -10.222 -13.601 379 HG3 PRO 52 2HG PRO 52 3.088 -9.096 -13.787 380 HD2 PRO 52 1HD PRO 52 2.374 -10.131 -11.390 381 HD3 PRO 52 2HD PRO 52 3.069 -8.507 -11.560 382 H GLY 53 H GLY 53 -2.239 -7.349 -12.457 383 HA2 GLY 53 1HA GLY 53 -4.073 -8.429 -13.626 384 HA3 GLY 53 2HA GLY 53 -3.241 -9.959 -13.400 385 H SER 54 H SER 54 -3.695 -7.456 -10.959 386 HA SER 54 HA SER 54 -5.472 -9.303 -9.503 387 HB2 SER 54 1HB SER 54 -4.456 -8.361 -7.400 388 HB3 SER 54 2HB SER 54 -3.349 -9.325 -8.376 389 HG SER 54 HG SER 54 -2.172 -7.611 -8.729 390 H ILE 55 H ILE 55 -4.390 -5.902 -9.428 391 HA ILE 55 HA ILE 55 -6.881 -4.995 -8.348 392 HB ILE 55 HB ILE 55 -4.637 -3.389 -9.579 393 HG12 ILE 55 1HG1 ILE 55 -3.861 -4.687 -7.666 394 HG13 ILE 55 2HG1 ILE 55 -3.959 -2.983 -7.236 395 HG21 ILE 55 1HG2 ILE 55 -6.450 -1.945 -9.566 396 HG22 ILE 55 2HG2 ILE 55 -7.120 -2.637 -8.091 397 HG23 ILE 55 3HG2 ILE 55 -5.684 -1.616 -8.011 398 HD11 ILE 55 1HD1 ILE 55 -6.154 -3.449 -6.171 399 HD12 ILE 55 2HD1 ILE 55 -5.883 -5.164 -6.481 400 HD13 ILE 55 3HD1 ILE 55 -4.791 -4.278 -5.418 401 H ASN 56 H ASN 56 -8.334 -3.493 -9.373 402 HA ASN 56 HA ASN 56 -8.258 -3.284 -12.265 403 HB2 ASN 56 1HB ASN 56 -9.481 -5.480 -11.421 404 HB3 ASN 56 2HB ASN 56 -10.811 -4.358 -11.146 405 HD21 ASN 56 1HD2 ASN 56 -12.186 -4.870 -12.725 406 HD22 ASN 56 2HD2 ASN 56 -11.814 -4.839 -14.412 407 H TYR 57 H TYR 57 -8.422 -1.131 -12.391 408 HA TYR 57 HA TYR 57 -9.711 0.554 -10.584 409 HB2 TYR 57 1HB TYR 57 -9.223 1.055 -13.527 410 HB3 TYR 57 2HB TYR 57 -9.522 2.283 -12.301 411 HD1 TYR 57 2HD TYR 57 -7.834 2.037 -10.193 412 HD2 TYR 57 1HD TYR 57 -7.034 0.784 -14.180 413 HE1 TYR 57 2HE TYR 57 -5.420 2.188 -9.750 414 HE2 TYR 57 1HE TYR 57 -4.618 0.930 -13.748 415 HH TYR 57 HH TYR 57 -3.352 2.357 -10.849 416 H ASP 58 H ASP 58 -10.941 -1.204 -13.337 417 HA ASP 58 HA ASP 58 -13.289 0.106 -13.906 418 HB2 ASP 58 1HB ASP 58 -12.229 -2.137 -14.830 419 HB3 ASP 58 2HB ASP 58 -13.369 -2.873 -13.705 420 H LEU 59 H LEU 59 -12.599 -2.062 -11.216 421 HA LEU 59 HA LEU 59 -15.331 -1.893 -10.241 422 HB2 LEU 59 1HB LEU 59 -13.042 -3.120 -8.749 423 HB3 LEU 59 2HB LEU 59 -14.756 -3.528 -8.680 424 HG LEU 59 HG LEU 59 -12.883 -4.137 -10.967 425 HD11 LEU 59 1HD1 LEU 59 -13.244 -6.481 -10.271 426 HD12 LEU 59 2HD1 LEU 59 -14.103 -5.897 -8.847 427 HD13 LEU 59 3HD1 LEU 59 -12.393 -5.522 -9.059 428 HD21 LEU 59 1HD2 LEU 59 -15.219 -5.661 -11.138 429 HD22 LEU 59 2HD2 LEU 59 -14.719 -4.343 -12.199 430 HD23 LEU 59 3HD2 LEU 59 -15.753 -4.013 -10.807 431 H LEU 60 H LEU 60 -12.160 -0.590 -9.518 432 HA LEU 60 HA LEU 60 -12.793 0.510 -6.987 433 HB2 LEU 60 1HB LEU 60 -10.730 1.478 -8.958 434 HB3 LEU 60 2HB LEU 60 -10.765 1.793 -7.224 435 HG LEU 60 HG LEU 60 -10.315 -0.898 -8.515 436 HD11 LEU 60 1HD1 LEU 60 -8.470 0.784 -8.761 437 HD12 LEU 60 2HD1 LEU 60 -8.036 -0.683 -7.883 438 HD13 LEU 60 3HD1 LEU 60 -8.354 0.811 -7.001 439 HD21 LEU 60 1HD2 LEU 60 -11.475 -0.792 -6.239 440 HD22 LEU 60 2HD2 LEU 60 -9.937 -0.189 -5.623 441 HD23 LEU 60 3HD2 LEU 60 -10.023 -1.786 -6.369 442 H LYS 61 H LYS 61 -12.666 2.945 -6.609 443 HA LYS 61 HA LYS 61 -14.494 4.261 -8.501 444 HB2 LYS 61 1HB LYS 61 -14.131 4.436 -5.539 445 HB3 LYS 61 2HB LYS 61 -14.764 5.831 -6.402 446 HG2 LYS 61 1HG LYS 61 -16.636 4.629 -5.644 447 HG3 LYS 61 2HG LYS 61 -16.509 4.284 -7.370 448 HD2 LYS 61 1HD LYS 61 -15.800 2.113 -7.018 449 HD3 LYS 61 2HD LYS 61 -15.190 2.465 -5.400 450 HE2 LYS 61 1HE LYS 61 -18.118 2.599 -6.047 451 HE3 LYS 61 2HE LYS 61 -17.340 1.081 -5.604 452 HZ1 LYS 61 1HZ LYS 61 -16.876 1.843 -3.482 453 HZ2 LYS 61 2HZ LYS 61 -18.417 2.478 -3.770 454 HZ3 LYS 61 3HZ LYS 61 -17.055 3.472 -3.901 455 H THR 62 H THR 62 -11.928 5.173 -6.193 456 HA THR 62 HA THR 62 -10.455 6.929 -6.220 457 HB THR 62 HB THR 62 -9.234 5.400 -7.620 458 HG1 THR 62 1HG THR 62 -9.086 7.788 -9.107 459 HG21 THR 62 1HG2 THR 62 -9.483 5.428 -10.081 460 HG22 THR 62 2HG2 THR 62 -10.863 6.512 -9.908 461 HG23 THR 62 3HG2 THR 62 -10.941 4.873 -9.261 462 H GLU 63 H GLU 63 -13.207 7.649 -6.862 463 HA GLU 63 HA GLU 63 -12.639 10.171 -8.237 464 HB2 GLU 63 1HB GLU 63 -14.817 10.006 -9.440 465 HB3 GLU 63 2HB GLU 63 -13.629 8.820 -9.962 466 HG2 GLU 63 1HG GLU 63 -14.737 7.160 -8.469 467 HG3 GLU 63 2HG GLU 63 -15.998 8.356 -8.172 468 H ASN 64 H ASN 64 -13.175 11.776 -6.930 469 HA ASN 64 HA ASN 64 -13.998 12.776 -5.012 470 HB2 ASN 64 1HB ASN 64 -16.364 13.341 -5.286 471 HB3 ASN 64 2HB ASN 64 -15.519 13.447 -6.827 472 HD21 ASN 64 1HD2 ASN 64 -16.102 12.134 -8.479 473 HD22 ASN 64 2HD2 ASN 64 -17.429 11.029 -8.408 474 H LEU 65 H LEU 65 -13.366 10.156 -4.375 475 HA LEU 65 HA LEU 65 -15.351 8.556 -3.307 476 HB2 LEU 65 1HB LEU 65 -12.521 9.038 -2.415 477 HB3 LEU 65 2HB LEU 65 -13.557 7.821 -1.673 478 HG LEU 65 HG LEU 65 -13.120 7.754 -4.625 479 HD11 LEU 65 1HD1 LEU 65 -10.907 7.641 -4.329 480 HD12 LEU 65 2HD1 LEU 65 -11.226 6.035 -3.676 481 HD13 LEU 65 3HD1 LEU 65 -11.053 7.410 -2.587 482 HD21 LEU 65 1HD2 LEU 65 -13.159 5.253 -3.988 483 HD22 LEU 65 2HD2 LEU 65 -14.668 6.164 -3.938 484 HD23 LEU 65 3HD2 LEU 65 -13.797 5.817 -2.443 485 H ASN 66 H ASN 66 -16.013 8.222 -1.082 486 HA ASN 66 HA ASN 66 -15.760 10.519 0.698 487 HB2 ASN 66 1HB ASN 66 -18.048 10.952 0.906 488 HB3 ASN 66 2HB ASN 66 -17.850 10.698 -0.826 489 HD21 ASN 66 1HD2 ASN 66 -18.306 8.507 -1.624 490 HD22 ASN 66 2HD2 ASN 66 -19.583 7.614 -0.877 491 H ASP 67 H ASP 67 -16.892 10.026 2.845 492 HA ASP 67 HA ASP 67 -15.743 8.012 4.194 493 HB2 ASP 67 1HB ASP 67 -17.207 9.767 5.193 494 HB3 ASP 67 2HB ASP 67 -18.613 8.848 4.661 495 H ASP 68 H ASP 68 -18.541 7.707 2.110 496 HA ASP 68 HA ASP 68 -19.111 4.997 2.874 497 HB2 ASP 68 1HB ASP 68 -20.144 6.888 0.795 498 HB3 ASP 68 2HB ASP 68 -20.494 5.167 0.643 499 H GLU 69 H GLU 69 -18.217 6.322 -0.314 500 HA GLU 69 HA GLU 69 -17.404 3.912 -1.432 501 HB2 GLU 69 1HB GLU 69 -16.266 6.631 -2.095 502 HB3 GLU 69 2HB GLU 69 -16.312 5.222 -3.144 503 HG2 GLU 69 1HG GLU 69 -18.883 6.267 -2.094 504 HG3 GLU 69 2HG GLU 69 -18.062 7.178 -3.360 505 H LYS 70 H LYS 70 -15.328 6.473 -0.070 506 HA LYS 70 HA LYS 70 -12.854 5.491 -0.313 507 HB2 LYS 70 1HB LYS 70 -14.045 6.603 2.234 508 HB3 LYS 70 2HB LYS 70 -12.320 6.418 1.943 509 HG2 LYS 70 1HG LYS 70 -12.450 7.975 0.080 510 HG3 LYS 70 2HG LYS 70 -14.190 8.138 0.325 511 HD2 LYS 70 1HD LYS 70 -13.470 9.970 1.485 512 HD3 LYS 70 2HD LYS 70 -13.420 8.769 2.778 513 HE2 LYS 70 1HE LYS 70 -11.007 8.387 2.177 514 HE3 LYS 70 2HE LYS 70 -11.125 9.788 1.114 515 HZ1 LYS 70 1HZ LYS 70 -11.608 11.182 2.969 516 HZ2 LYS 70 2HZ LYS 70 -10.221 10.290 3.347 517 HZ3 LYS 70 3HZ LYS 70 -11.712 9.862 4.021 518 H LEU 71 H LEU 71 -15.198 4.341 2.088 519 HA LEU 71 HA LEU 71 -13.556 2.508 3.404 520 HB2 LEU 71 1HB LEU 71 -15.631 3.046 4.382 521 HB3 LEU 71 2HB LEU 71 -16.520 2.594 2.929 522 HG LEU 71 HG LEU 71 -15.976 0.231 3.357 523 HD11 LEU 71 1HD1 LEU 71 -14.826 -0.510 5.241 524 HD12 LEU 71 2HD1 LEU 71 -14.967 1.047 6.058 525 HD13 LEU 71 3HD1 LEU 71 -13.873 0.867 4.686 526 HD21 LEU 71 1HD2 LEU 71 -17.844 1.818 4.630 527 HD22 LEU 71 2HD2 LEU 71 -17.121 0.890 5.943 528 HD23 LEU 71 3HD2 LEU 71 -17.841 0.055 4.566 529 H ASN 72 H ASN 72 -15.943 1.820 0.840 530 HA ASN 72 HA ASN 72 -15.519 -0.816 0.403 531 HB2 ASN 72 1HB ASN 72 -15.858 1.323 -1.711 532 HB3 ASN 72 2HB ASN 72 -16.057 -0.404 -1.997 533 HD21 ASN 72 1HD2 ASN 72 -17.313 2.362 -0.247 534 HD22 ASN 72 2HD2 ASN 72 -18.901 1.726 -0.008 535 H ASN 73 H ASN 73 -13.536 1.818 -0.922 536 HA ASN 73 HA ASN 73 -11.757 0.183 -2.368 537 HB2 ASN 73 1HB ASN 73 -11.705 2.995 -1.358 538 HB3 ASN 73 2HB ASN 73 -10.202 2.284 -1.940 539 HD21 ASN 73 1HD2 ASN 73 -10.653 4.223 -3.411 540 HD22 ASN 73 2HD2 ASN 73 -11.485 3.869 -4.882 541 H ALA 74 H ALA 74 -11.835 1.212 0.981 542 HA ALA 74 HA ALA 74 -9.186 0.363 1.618 543 HB1 ALA 74 1HB ALA 74 -11.275 0.509 3.725 544 HB2 ALA 74 2HB ALA 74 -9.611 1.095 3.736 545 HB3 ALA 74 3HB ALA 74 -10.855 1.991 2.865 546 H LYS 75 H LYS 75 -12.396 -1.096 1.900 547 HA LYS 75 HA LYS 75 -11.580 -3.416 3.292 548 HB2 LYS 75 1HB LYS 75 -13.963 -2.911 1.505 549 HB3 LYS 75 2HB LYS 75 -13.749 -4.367 2.468 550 HG2 LYS 75 1HG LYS 75 -14.140 -3.284 4.448 551 HG3 LYS 75 2HG LYS 75 -13.620 -1.718 3.820 552 HD2 LYS 75 1HD LYS 75 -15.980 -1.610 4.100 553 HD3 LYS 75 2HD LYS 75 -15.671 -1.735 2.367 554 HE2 LYS 75 1HE LYS 75 -17.478 -3.202 2.885 555 HE3 LYS 75 2HE LYS 75 -16.060 -4.198 2.561 556 HZ1 LYS 75 1HZ LYS 75 -16.207 -5.078 4.573 557 HZ2 LYS 75 2HZ LYS 75 -17.660 -4.247 4.813 558 HZ3 LYS 75 3HZ LYS 75 -16.199 -3.555 5.313 559 H TYR 76 H TYR 76 -11.661 -2.567 -0.102 560 HA TYR 76 HA TYR 76 -11.222 -5.231 -1.058 561 HB2 TYR 76 1HB TYR 76 -12.267 -3.293 -2.353 562 HB3 TYR 76 2HB TYR 76 -10.629 -2.686 -2.564 563 HD1 TYR 76 1HD TYR 76 -12.307 -6.020 -2.866 564 HD2 TYR 76 2HD TYR 76 -9.755 -3.119 -4.646 565 HE1 TYR 76 1HE TYR 76 -12.025 -7.479 -4.826 566 HE2 TYR 76 2HE TYR 76 -9.467 -4.568 -6.611 567 HH TYR 76 HH TYR 76 -11.340 -6.851 -7.504 568 H ALA 77 H ALA 77 -9.158 -2.342 -0.774 569 HA ALA 77 HA ALA 77 -6.786 -3.292 -1.734 570 HB1 ALA 77 1HB ALA 77 -7.580 -1.064 -0.312 571 HB2 ALA 77 2HB ALA 77 -6.366 -1.810 0.728 572 HB3 ALA 77 3HB ALA 77 -5.960 -1.383 -0.934 573 H ILE 78 H ILE 78 -7.784 -3.484 1.689 574 HA ILE 78 HA ILE 78 -5.655 -5.002 2.614 575 HB ILE 78 HB ILE 78 -8.519 -5.036 3.573 576 HG12 ILE 78 1HG1 ILE 78 -6.112 -3.504 4.582 577 HG13 ILE 78 2HG1 ILE 78 -7.411 -2.819 3.612 578 HG21 ILE 78 1HG2 ILE 78 -6.501 -5.610 5.563 579 HG22 ILE 78 2HG2 ILE 78 -7.967 -6.500 5.154 580 HG23 ILE 78 3HG2 ILE 78 -6.479 -6.792 4.253 581 HD11 ILE 78 1HD1 ILE 78 -8.372 -2.276 5.533 582 HD12 ILE 78 2HD1 ILE 78 -8.728 -3.992 5.731 583 HD13 ILE 78 3HD1 ILE 78 -7.278 -3.301 6.459 584 H SER 79 H SER 79 -8.683 -6.047 1.127 585 HA SER 79 HA SER 79 -8.395 -8.805 1.572 586 HB2 SER 79 1HB SER 79 -10.476 -7.585 0.775 587 HB3 SER 79 2HB SER 79 -9.746 -7.568 -0.830 588 HG SER 79 HG SER 79 -10.819 -9.416 -0.898 589 H MET 80 H MET 80 -7.391 -6.762 -1.147 590 HA MET 80 HA MET 80 -6.374 -8.822 -2.767 591 HB2 MET 80 1HB MET 80 -5.945 -5.865 -2.613 592 HB3 MET 80 2HB MET 80 -4.899 -6.831 -3.645 593 HG2 MET 80 1HG MET 80 -7.866 -7.083 -3.855 594 HG3 MET 80 2HG MET 80 -7.026 -5.741 -4.631 595 HE1 MET 80 1HE MET 80 -8.826 -8.222 -5.299 596 HE2 MET 80 2HE MET 80 -8.348 -8.610 -6.953 597 HE3 MET 80 3HE MET 80 -7.951 -9.716 -5.636 598 H ALA 81 H ALA 81 -4.559 -6.497 -0.755 599 HA ALA 81 HA ALA 81 -2.036 -7.453 -0.977 600 HB1 ALA 81 1HB ALA 81 -3.511 -6.217 1.290 601 HB2 ALA 81 2HB ALA 81 -1.898 -6.864 1.588 602 HB3 ALA 81 3HB ALA 81 -2.133 -5.611 0.370 603 H ARG 82 H ARG 82 -4.557 -8.770 1.142 604 HA ARG 82 HA ARG 82 -2.878 -10.802 2.243 605 HB2 ARG 82 1HB ARG 82 -4.860 -9.919 3.425 606 HB3 ARG 82 2HB ARG 82 -5.895 -10.620 2.188 607 HG2 ARG 82 1HG ARG 82 -5.446 -12.803 2.878 608 HG3 ARG 82 2HG ARG 82 -4.011 -12.317 3.781 609 HD2 ARG 82 1HD ARG 82 -5.463 -11.083 5.354 610 HD3 ARG 82 2HD ARG 82 -6.873 -11.673 4.475 611 HE ARG 82 HE ARG 82 -5.339 -13.104 6.401 612 HH11 ARG 82 1HH1 ARG 82 -7.224 -13.471 3.498 613 HH12 ARG 82 2HH1 ARG 82 -7.659 -15.113 3.832 614 HH21 ARG 82 1HH2 ARG 82 -5.905 -15.267 6.852 615 HH22 ARG 82 2HH2 ARG 82 -6.909 -16.135 5.740 616 H LYS 83 H LYS 83 -5.353 -10.723 -0.291 617 HA LYS 83 HA LYS 83 -5.566 -13.400 -0.889 618 HB2 LYS 83 1HB LYS 83 -6.672 -11.249 -1.948 619 HB3 LYS 83 2HB LYS 83 -5.398 -11.446 -3.144 620 HG2 LYS 83 1HG LYS 83 -7.051 -12.655 -4.130 621 HG3 LYS 83 2HG LYS 83 -6.280 -13.927 -3.179 622 HD2 LYS 83 1HD LYS 83 -8.482 -14.265 -2.625 623 HD3 LYS 83 2HD LYS 83 -7.997 -13.148 -1.346 624 HE2 LYS 83 1HE LYS 83 -9.132 -11.372 -2.287 625 HE3 LYS 83 2HE LYS 83 -9.094 -12.070 -3.905 626 HZ1 LYS 83 1HZ LYS 83 -10.671 -13.265 -1.704 627 HZ2 LYS 83 2HZ LYS 83 -10.801 -13.565 -3.363 628 HZ3 LYS 83 3HZ LYS 83 -11.306 -12.079 -2.730 629 H ILE 84 H ILE 84 -3.148 -11.100 -2.102 630 HA ILE 84 HA ILE 84 -1.782 -13.036 -3.691 631 HB ILE 84 HB ILE 84 -0.028 -11.350 -3.931 632 HG12 ILE 84 1HG1 ILE 84 -1.627 -9.566 -2.099 633 HG13 ILE 84 2HG1 ILE 84 -0.291 -10.551 -1.512 634 HG21 ILE 84 1HG2 ILE 84 -2.838 -10.282 -4.154 635 HG22 ILE 84 2HG2 ILE 84 -1.425 -9.541 -4.904 636 HG23 ILE 84 3HG2 ILE 84 -1.931 -11.160 -5.385 637 HD11 ILE 84 1HD1 ILE 84 1.197 -9.077 -2.227 638 HD12 ILE 84 2HD1 ILE 84 0.476 -9.030 -3.836 639 HD13 ILE 84 3HD1 ILE 84 -0.151 -7.990 -2.559 640 H GLY 85 H GLY 85 -1.538 -11.940 -0.383 641 HA2 GLY 85 1HA GLY 85 -0.578 -13.729 1.097 642 HA3 GLY 85 2HA GLY 85 0.787 -13.725 -0.009 643 H ALA 86 H ALA 86 -0.788 -12.098 2.614 644 HA ALA 86 HA ALA 86 1.595 -10.903 3.523 645 HB1 ALA 86 1HB ALA 86 1.681 -8.949 2.481 646 HB2 ALA 86 2HB ALA 86 0.293 -9.422 1.500 647 HB3 ALA 86 3HB ALA 86 0.047 -8.564 3.021 648 H ARG 87 H ARG 87 1.387 -10.091 5.592 649 HA ARG 87 HA ARG 87 -1.128 -10.700 6.906 650 HB2 ARG 87 1HB ARG 87 1.624 -9.980 7.892 651 HB3 ARG 87 2HB ARG 87 0.245 -10.048 8.981 652 HG2 ARG 87 1HG ARG 87 1.283 -12.320 7.298 653 HG3 ARG 87 2HG ARG 87 1.512 -12.119 9.036 654 HD2 ARG 87 1HD ARG 87 -1.034 -12.076 9.192 655 HD3 ARG 87 2HD ARG 87 -1.030 -12.675 7.534 656 HE ARG 87 HE ARG 87 0.634 -14.282 9.156 657 HH11 ARG 87 1HH1 ARG 87 -2.719 -13.588 8.524 658 HH12 ARG 87 2HH1 ARG 87 -3.270 -15.160 9.003 659 HH21 ARG 87 1HH2 ARG 87 -0.079 -16.355 9.789 660 HH22 ARG 87 2HH2 ARG 87 -1.767 -16.733 9.723 661 H VAL 88 H VAL 88 -2.502 -9.051 6.225 662 HA VAL 88 HA VAL 88 -1.864 -6.298 6.328 663 HB VAL 88 HB VAL 88 -4.331 -5.939 6.203 664 HG11 VAL 88 1HG1 VAL 88 -2.615 -6.784 4.279 665 HG12 VAL 88 2HG1 VAL 88 -3.891 -7.997 4.155 666 HG13 VAL 88 3HG1 VAL 88 -4.280 -6.286 3.982 667 HG21 VAL 88 1HG2 VAL 88 -5.756 -7.940 5.862 668 HG22 VAL 88 2HG2 VAL 88 -4.394 -8.951 6.346 669 HG23 VAL 88 3HG2 VAL 88 -5.104 -7.819 7.497 670 H TYR 89 H TYR 89 -3.620 -8.420 8.570 671 HA TYR 89 HA TYR 89 -4.476 -7.980 10.667 672 HB2 TYR 89 1HB TYR 89 -1.894 -8.481 10.766 673 HB3 TYR 89 2HB TYR 89 -1.797 -6.806 11.298 674 HD1 TYR 89 2HD TYR 89 -3.263 -10.110 12.101 675 HD2 TYR 89 1HD TYR 89 -2.373 -6.195 13.510 676 HE1 TYR 89 2HE TYR 89 -3.821 -10.814 14.390 677 HE2 TYR 89 1HE TYR 89 -2.928 -6.888 15.804 678 HH TYR 89 HH TYR 89 -3.127 -9.988 16.789 679 H ALA 90 H ALA 90 -5.175 -5.888 8.959 680 HA ALA 90 HA ALA 90 -5.138 -3.629 10.840 681 HB1 ALA 90 1HB ALA 90 -5.166 -2.151 8.737 682 HB2 ALA 90 2HB ALA 90 -3.632 -2.865 9.236 683 HB3 ALA 90 3HB ALA 90 -4.543 -3.575 7.903 684 H LEU 91 H LEU 91 -6.826 -1.909 9.888 685 HA LEU 91 HA LEU 91 -9.266 -3.394 9.168 686 HB2 LEU 91 1HB LEU 91 -9.051 -2.611 11.599 687 HB3 LEU 91 2HB LEU 91 -9.266 -0.984 10.956 688 HG LEU 91 HG LEU 91 -11.451 -1.835 9.964 689 HD11 LEU 91 1HD1 LEU 91 -10.505 -4.279 10.809 690 HD12 LEU 91 2HD1 LEU 91 -12.160 -3.916 10.324 691 HD13 LEU 91 3HD1 LEU 91 -11.710 -3.863 12.028 692 HD21 LEU 91 1HD2 LEU 91 -11.525 -1.981 12.943 693 HD22 LEU 91 2HD2 LEU 91 -12.608 -1.147 11.828 694 HD23 LEU 91 3HD2 LEU 91 -11.006 -0.488 12.159 695 HA PRO 92 HA PRO 92 -9.511 -0.493 5.845 696 HB2 PRO 92 1HB PRO 92 -12.082 -0.984 5.122 697 HB3 PRO 92 2HB PRO 92 -10.753 -2.091 4.756 698 HG2 PRO 92 1HG PRO 92 -12.770 -2.216 6.966 699 HG3 PRO 92 2HG PRO 92 -12.161 -3.522 5.930 700 HD2 PRO 92 1HD PRO 92 -11.263 -3.124 8.454 701 HD3 PRO 92 2HD PRO 92 -10.228 -3.767 7.163 702 H GLU 93 H GLU 93 -11.340 -0.351 8.725 703 HA GLU 93 HA GLU 93 -12.881 1.980 8.040 704 HB2 GLU 93 1HB GLU 93 -12.350 0.597 10.671 705 HB3 GLU 93 2HB GLU 93 -13.392 2.004 10.505 706 HG2 GLU 93 1HG GLU 93 -14.584 0.527 8.703 707 HG3 GLU 93 2HG GLU 93 -13.820 -0.793 9.587 708 H ASP 94 H ASP 94 -9.746 1.330 9.334 709 HA ASP 94 HA ASP 94 -9.414 4.076 10.273 710 HB2 ASP 94 1HB ASP 94 -7.393 1.829 10.335 711 HB3 ASP 94 2HB ASP 94 -7.333 3.343 11.235 712 H LEU 95 H LEU 95 -8.376 1.926 7.713 713 HA LEU 95 HA LEU 95 -6.237 3.380 6.681 714 HB2 LEU 95 1HB LEU 95 -6.681 1.167 5.903 715 HB3 LEU 95 2HB LEU 95 -8.277 1.635 5.319 716 HG LEU 95 HG LEU 95 -7.246 2.984 3.564 717 HD11 LEU 95 1HD1 LEU 95 -5.139 3.363 5.012 718 HD12 LEU 95 2HD1 LEU 95 -4.964 3.235 3.262 719 HD13 LEU 95 3HD1 LEU 95 -4.571 1.857 4.290 720 HD21 LEU 95 1HD2 LEU 95 -6.284 1.141 2.244 721 HD22 LEU 95 2HD2 LEU 95 -7.775 0.674 3.064 722 HD23 LEU 95 3HD2 LEU 95 -6.216 0.152 3.704 723 H VAL 96 H VAL 96 -9.694 3.826 6.300 724 HA VAL 96 HA VAL 96 -9.652 5.628 4.142 725 HB VAL 96 HB VAL 96 -11.622 5.238 6.387 726 HG11 VAL 96 1HG1 VAL 96 -11.944 7.499 5.831 727 HG12 VAL 96 2HG1 VAL 96 -11.696 7.198 4.110 728 HG13 VAL 96 3HG1 VAL 96 -13.162 6.622 4.906 729 HG21 VAL 96 1HG2 VAL 96 -12.783 3.892 4.962 730 HG22 VAL 96 2HG2 VAL 96 -12.241 4.757 3.525 731 HG23 VAL 96 3HG2 VAL 96 -11.158 3.623 4.331 732 H GLU 97 H GLU 97 -8.957 6.031 7.519 733 HA GLU 97 HA GLU 97 -8.852 8.949 7.185 734 HB2 GLU 97 1HB GLU 97 -8.981 7.217 9.653 735 HB3 GLU 97 2HB GLU 97 -8.657 8.944 9.710 736 HG2 GLU 97 1HG GLU 97 -10.878 9.032 8.273 737 HG3 GLU 97 2HG GLU 97 -11.170 7.502 9.096 738 H VAL 98 H VAL 98 -6.850 6.962 6.229 739 HA VAL 98 HA VAL 98 -4.596 6.510 6.336 740 HB VAL 98 HB VAL 98 -4.492 9.481 6.866 741 HG11 VAL 98 1HG1 VAL 98 -2.298 9.379 6.482 742 HG12 VAL 98 2HG1 VAL 98 -2.444 7.631 6.680 743 HG13 VAL 98 3HG1 VAL 98 -2.516 8.346 5.069 744 HG21 VAL 98 1HG2 VAL 98 -5.959 9.150 5.015 745 HG22 VAL 98 2HG2 VAL 98 -4.398 9.653 4.365 746 HG23 VAL 98 3HG2 VAL 98 -4.877 7.957 4.294 747 H ASN 99 H ASN 99 -5.526 5.690 8.687 748 HA ASN 99 HA ASN 99 -4.400 6.991 10.951 749 HB2 ASN 99 1HB ASN 99 -5.737 4.382 10.424 750 HB3 ASN 99 2HB ASN 99 -4.769 4.520 11.890 751 HD21 ASN 99 1HD2 ASN 99 -7.735 5.162 10.429 752 HD22 ASN 99 2HD2 ASN 99 -8.425 6.130 11.682 753 HA PRO 100 HA PRO 100 -0.214 5.631 10.189 754 HB2 PRO 100 1HB PRO 100 0.855 6.861 12.361 755 HB3 PRO 100 2HB PRO 100 0.433 7.724 10.877 756 HG2 PRO 100 1HG PRO 100 -1.098 7.500 13.440 757 HG3 PRO 100 2HG PRO 100 -0.828 8.924 12.420 758 HD2 PRO 100 1HD PRO 100 -3.136 7.509 12.364 759 HD3 PRO 100 2HD PRO 100 -2.483 8.327 10.930 760 H LYS 101 H LYS 101 -2.214 5.012 12.930 761 HA LYS 101 HA LYS 101 -0.309 3.278 14.248 762 HB2 LYS 101 1HB LYS 101 -2.140 2.840 15.830 763 HB3 LYS 101 2HB LYS 101 -1.878 4.563 15.601 764 HG2 LYS 101 1HG LYS 101 -4.174 4.400 15.556 765 HG3 LYS 101 2HG LYS 101 -3.765 4.367 13.839 766 HD2 LYS 101 1HD LYS 101 -4.280 2.140 13.619 767 HD3 LYS 101 2HD LYS 101 -3.944 1.785 15.316 768 HE2 LYS 101 1HE LYS 101 -6.300 1.615 14.997 769 HE3 LYS 101 2HE LYS 101 -5.993 3.093 15.906 770 HZ1 LYS 101 1HZ LYS 101 -6.871 2.779 13.119 771 HZ2 LYS 101 2HZ LYS 101 -6.001 4.161 13.558 772 HZ3 LYS 101 3HZ LYS 101 -7.469 3.807 14.322 773 H MET 102 H MET 102 -2.471 3.004 11.681 774 HA MET 102 HA MET 102 -2.789 0.110 12.068 775 HB2 MET 102 1HB MET 102 -4.882 1.187 11.648 776 HB3 MET 102 2HB MET 102 -4.222 2.075 10.281 777 HG2 MET 102 1HG MET 102 -3.778 -0.387 9.395 778 HG3 MET 102 2HG MET 102 -5.137 -0.732 10.462 779 HE1 MET 102 1HE MET 102 -4.958 1.781 6.708 780 HE2 MET 102 2HE MET 102 -4.992 2.815 8.136 781 HE3 MET 102 3HE MET 102 -3.722 1.604 7.954 782 H VAL 103 H VAL 103 -2.008 2.447 9.488 783 HA VAL 103 HA VAL 103 -1.208 0.825 7.474 784 HB VAL 103 HB VAL 103 0.177 3.343 8.401 785 HG11 VAL 103 1HG1 VAL 103 0.756 3.329 5.828 786 HG12 VAL 103 2HG1 VAL 103 1.786 2.509 7.004 787 HG13 VAL 103 3HG1 VAL 103 0.630 1.584 6.044 788 HG21 VAL 103 1HG2 VAL 103 -1.176 3.970 6.137 789 HG22 VAL 103 2HG2 VAL 103 -2.245 2.757 6.842 790 HG23 VAL 103 3HG2 VAL 103 -1.809 4.193 7.768 791 H MET 104 H MET 104 0.346 1.197 10.538 792 HA MET 104 HA MET 104 2.940 0.566 10.216 793 HB2 MET 104 1HB MET 104 2.824 -0.729 12.320 794 HB3 MET 104 2HB MET 104 1.949 0.793 12.416 795 HG2 MET 104 1HG MET 104 -0.125 -0.249 12.389 796 HG3 MET 104 2HG MET 104 0.530 -1.743 11.720 797 HE1 MET 104 1HE MET 104 0.114 -3.862 13.958 798 HE2 MET 104 2HE MET 104 -0.967 -2.863 14.929 799 HE3 MET 104 3HE MET 104 -1.011 -2.759 13.169 800 H THR 105 H THR 105 0.241 -1.671 9.833 801 HA THR 105 HA THR 105 2.084 -3.823 9.099 802 HB THR 105 HB THR 105 -0.155 -5.128 8.914 803 HG1 THR 105 1HG THR 105 -1.259 -2.914 9.210 804 HG21 THR 105 1HG2 THR 105 -0.148 -5.556 11.337 805 HG22 THR 105 2HG2 THR 105 0.857 -4.126 11.579 806 HG23 THR 105 3HG2 THR 105 1.486 -5.505 10.678 807 H VAL 106 H VAL 106 -0.556 -1.886 7.771 808 HA VAL 106 HA VAL 106 -1.114 -3.049 5.398 809 HB VAL 106 HB VAL 106 -0.592 -0.101 5.802 810 HG11 VAL 106 1HG1 VAL 106 -1.364 -1.629 3.462 811 HG12 VAL 106 2HG1 VAL 106 -2.566 -0.408 3.886 812 HG13 VAL 106 3HG1 VAL 106 -0.891 0.065 3.600 813 HG21 VAL 106 1HG2 VAL 106 -2.258 -1.088 7.336 814 HG22 VAL 106 2HG2 VAL 106 -2.966 0.079 6.220 815 HG23 VAL 106 3HG2 VAL 106 -3.178 -1.648 5.940 816 H PHE 107 H PHE 107 1.509 -0.650 5.744 817 HA PHE 107 HA PHE 107 2.647 -1.382 3.211 818 HB2 PHE 107 1HB PHE 107 3.337 0.562 5.378 819 HB3 PHE 107 2HB PHE 107 4.562 0.146 4.185 820 HD1 PHE 107 2HD PHE 107 3.034 -0.098 1.727 821 HD2 PHE 107 1HD PHE 107 2.653 2.712 4.901 822 HE1 PHE 107 2HE PHE 107 2.065 1.534 0.162 823 HE2 PHE 107 1HE PHE 107 1.683 4.347 3.341 824 HZ PHE 107 HZ PHE 107 1.388 3.761 0.968 825 H ALA 108 H ALA 108 3.758 -1.633 6.588 826 HA ALA 108 HA ALA 108 6.148 -2.826 6.396 827 HB1 ALA 108 1HB ALA 108 5.234 -2.473 8.549 828 HB2 ALA 108 2HB ALA 108 3.883 -3.563 8.234 829 HB3 ALA 108 3HB ALA 108 5.515 -4.208 8.410 830 H CYS 109 H CYS 109 3.175 -4.802 6.505 831 HA CYS 109 HA CYS 109 4.234 -7.249 5.920 832 HB2 CYS 109 1HB CYS 109 2.059 -7.908 5.111 833 HB3 CYS 109 2HB CYS 109 1.840 -6.785 6.448 834 HG CYS 109 HG CYS 109 1.822 -5.495 3.322 835 H LEU 110 H LEU 110 3.534 -4.634 3.676 836 HA LEU 110 HA LEU 110 4.122 -6.201 1.338 837 HB2 LEU 110 1HB LEU 110 3.493 -3.337 1.887 838 HB3 LEU 110 2HB LEU 110 4.206 -3.778 0.337 839 HG LEU 110 HG LEU 110 1.646 -4.963 1.402 840 HD11 LEU 110 1HD1 LEU 110 1.852 -2.849 -0.720 841 HD12 LEU 110 2HD1 LEU 110 1.618 -2.450 0.981 842 HD13 LEU 110 3HD1 LEU 110 0.419 -3.424 0.131 843 HD21 LEU 110 1HD2 LEU 110 3.131 -5.112 -1.201 844 HD22 LEU 110 2HD2 LEU 110 1.396 -5.416 -1.112 845 HD23 LEU 110 3HD2 LEU 110 2.515 -6.425 -0.195 846 H MET 111 H MET 111 5.672 -3.230 2.564 847 HA MET 111 HA MET 111 7.984 -3.308 1.119 848 HB2 MET 111 1HB MET 111 8.849 -1.758 2.590 849 HB3 MET 111 2HB MET 111 7.131 -1.629 2.941 850 HG2 MET 111 1HG MET 111 8.005 -1.723 5.050 851 HG3 MET 111 2HG MET 111 7.655 -3.424 4.754 852 HE1 MET 111 1HE MET 111 11.783 -1.422 4.695 853 HE2 MET 111 2HE MET 111 10.890 -1.467 3.175 854 HE3 MET 111 3HE MET 111 10.211 -0.632 4.573 855 H GLY 112 H GLY 112 7.025 -5.473 3.609 856 HA2 GLY 112 1HA GLY 112 9.277 -6.413 4.780 857 HA3 GLY 112 2HA GLY 112 7.991 -7.478 4.233 858 H LYS 113 H LYS 113 8.561 -6.565 1.402 859 HA LYS 113 HA LYS 113 10.241 -8.705 0.671 860 HB2 LYS 113 1HB LYS 113 8.455 -7.320 -0.691 861 HB3 LYS 113 2HB LYS 113 9.859 -6.365 -1.149 862 HG2 LYS 113 1HG LYS 113 10.905 -8.646 -1.779 863 HG3 LYS 113 2HG LYS 113 9.237 -9.223 -1.763 864 HD2 LYS 113 1HD LYS 113 9.575 -8.603 -3.983 865 HD3 LYS 113 2HD LYS 113 8.750 -7.205 -3.289 866 HE2 LYS 113 1HE LYS 113 10.460 -6.166 -4.407 867 HE3 LYS 113 2HE LYS 113 11.204 -6.393 -2.825 868 HZ1 LYS 113 1HZ LYS 113 11.534 -8.520 -4.805 869 HZ2 LYS 113 2HZ LYS 113 12.599 -7.989 -3.605 870 HZ3 LYS 113 3HZ LYS 113 12.419 -7.095 -5.030 871 H GLY 114 H GLY 114 10.836 -5.222 0.957 872 HA2 GLY 114 1HA GLY 114 13.555 -5.409 0.065 873 HA3 GLY 114 2HA GLY 114 12.796 -4.009 0.809 874 H MET 115 H MET 115 13.327 -7.322 1.996 875 HA MET 115 HA MET 115 15.433 -6.663 3.746 876 HB2 MET 115 1HB MET 115 13.693 -5.372 4.904 877 HB3 MET 115 2HB MET 115 12.703 -6.820 5.037 878 HG2 MET 115 1HG MET 115 14.786 -7.790 6.264 879 HG3 MET 115 2HG MET 115 15.201 -6.092 6.487 880 HE1 MET 115 1HE MET 115 13.478 -5.245 9.600 881 HE2 MET 115 2HE MET 115 15.019 -5.985 9.163 882 HE3 MET 115 3HE MET 115 14.376 -4.649 8.205 883 H LYS 116 H LYS 116 16.471 -8.527 3.915 884 HA LYS 116 HA LYS 116 14.901 -11.020 3.947 885 HB2 LYS 116 1HB LYS 116 17.556 -10.300 2.781 886 HB3 LYS 116 2HB LYS 116 17.290 -11.956 3.311 887 HG2 LYS 116 1HG LYS 116 15.242 -10.712 1.562 888 HG3 LYS 116 2HG LYS 116 16.782 -11.182 0.841 889 HD2 LYS 116 1HD LYS 116 15.641 -13.139 0.576 890 HD3 LYS 116 2HD LYS 116 16.304 -13.416 2.188 891 HE2 LYS 116 1HE LYS 116 13.878 -13.960 1.963 892 HE3 LYS 116 2HE LYS 116 14.244 -12.780 3.220 893 HZ1 LYS 116 1HZ LYS 116 12.425 -12.493 1.193 894 HZ2 LYS 116 2HZ LYS 116 13.726 -11.526 0.714 895 HZ3 LYS 116 3HZ LYS 116 12.989 -11.269 2.215 896 H ARG 117 H ARG 117 14.579 -11.223 6.144 897 HA ARG 117 HA ARG 117 17.003 -11.788 7.709 898 HB2 ARG 117 1HB ARG 117 14.790 -9.912 8.321 899 HB3 ARG 117 2HB ARG 117 15.361 -10.910 9.653 900 HG2 ARG 117 1HG ARG 117 17.685 -10.101 9.107 901 HG3 ARG 117 2HG ARG 117 16.926 -8.932 8.024 902 HD2 ARG 117 1HD ARG 117 15.806 -7.864 9.806 903 HD3 ARG 117 2HD ARG 117 16.160 -9.185 10.919 904 HE ARG 117 HE ARG 117 18.167 -8.199 11.364 905 HH11 ARG 117 1HH1 ARG 117 16.965 -6.961 8.340 906 HH12 ARG 117 2HH1 ARG 117 18.231 -5.792 8.165 907 HH21 ARG 117 1HH2 ARG 117 19.840 -6.664 11.144 908 HH22 ARG 117 2HH2 ARG 117 19.867 -5.625 9.760 909 H VAL 118 H VAL 118 14.389 -13.089 6.363 910 HA VAL 118 HA VAL 118 12.848 -14.451 8.101 911 HB VAL 118 HB VAL 118 12.734 -14.761 5.663 912 HG11 VAL 118 1HG1 VAL 118 14.252 -16.036 4.433 913 HG12 VAL 118 2HG1 VAL 118 15.280 -15.072 5.496 914 HG13 VAL 118 3HG1 VAL 118 14.957 -16.764 5.876 915 HG21 VAL 118 1HG2 VAL 118 12.393 -17.296 5.730 916 HG22 VAL 118 2HG2 VAL 118 12.890 -17.193 7.419 917 HG23 VAL 118 3HG2 VAL 118 11.462 -16.319 6.865 918 H SER 119 H SER 119 13.098 -15.833 9.732 919 HA SER 119 HA SER 119 15.769 -16.928 10.226 920 HB2 SER 119 1HB SER 119 15.175 -17.094 12.509 921 HB3 SER 119 2HB SER 119 14.475 -15.566 11.976 922 HG SER 119 HG SER 119 13.060 -16.982 13.228 923 H GLY 120 H GLY 120 14.492 -18.216 8.191 924 HA2 GLY 120 1HA GLY 120 14.293 -20.454 7.582 925 HA3 GLY 120 2HA GLY 120 14.268 -20.888 9.284 926 HA PRO 121 HA PRO 121 10.015 -21.709 7.889 927 HB2 PRO 121 1HB PRO 121 9.560 -23.639 9.743 928 HB3 PRO 121 2HB PRO 121 10.395 -23.950 8.216 929 HG2 PRO 121 1HG PRO 121 11.542 -23.491 10.943 930 HG3 PRO 121 2HG PRO 121 12.010 -24.686 9.719 931 HD2 PRO 121 1HD PRO 121 13.388 -22.389 10.115 932 HD3 PRO 121 2HD PRO 121 13.251 -23.157 8.521 933 H SER 122 H SER 122 7.957 -21.883 9.256 934 HA SER 122 HA SER 122 8.152 -20.180 11.648 935 HB2 SER 122 1HB SER 122 7.391 -18.821 9.732 936 HB3 SER 122 2HB SER 122 6.057 -19.944 9.473 937 HG SER 122 HG SER 122 5.640 -19.390 11.849 938 H SER 123 H SER 123 7.461 -21.307 13.331 939 HA SER 123 HA SER 123 4.915 -22.685 13.215 940 HB2 SER 123 1HB SER 123 7.459 -24.174 13.907 941 HB3 SER 123 2HB SER 123 5.825 -24.810 14.095 942 HG SER 123 HG SER 123 5.799 -24.101 11.675 943 H GLY 124 H GLY 124 4.366 -23.613 15.434 944 HA2 GLY 124 1HA GLY 124 4.156 -23.360 17.713 945 HA3 GLY 124 2HA GLY 124 5.756 -22.632 17.721 Start of MODEL 15 1 H1 GLY 1 H GLY 1 23.836 -10.751 12.194 2 HA2 GLY 1 1HA GLY 1 22.492 -9.437 14.213 3 HA3 GLY 1 2HA GLY 1 24.129 -8.797 14.252 4 H SER 2 H SER 2 24.458 -7.033 13.089 5 HA SER 2 HA SER 2 23.343 -6.720 10.457 6 HB2 SER 2 1HB SER 2 21.399 -5.959 11.602 7 HB3 SER 2 2HB SER 2 22.353 -5.022 12.749 8 HG SER 2 HG SER 2 22.790 -3.542 11.188 9 H SER 3 H SER 3 24.752 -5.634 9.247 10 HA SER 3 HA SER 3 26.808 -4.036 10.618 11 HB2 SER 3 1HB SER 3 26.975 -5.293 7.870 12 HB3 SER 3 2HB SER 3 28.286 -4.529 8.768 13 HG SER 3 HG SER 3 28.511 -6.683 9.115 14 H GLY 4 H GLY 4 25.761 -2.057 10.653 15 HA2 GLY 4 1HA GLY 4 25.242 0.024 9.828 16 HA3 GLY 4 2HA GLY 4 26.001 -0.465 8.321 17 H SER 5 H SER 5 23.568 1.106 8.767 18 HA SER 5 HA SER 5 21.883 -0.292 6.892 19 HB2 SER 5 1HB SER 5 19.887 -0.359 8.233 20 HB3 SER 5 2HB SER 5 21.165 -1.168 9.141 21 HG SER 5 HG SER 5 20.084 0.243 10.505 22 H SER 6 H SER 6 20.633 1.080 5.696 23 HA SER 6 HA SER 6 21.205 3.901 5.979 24 HB2 SER 6 1HB SER 6 19.868 2.207 3.893 25 HB3 SER 6 2HB SER 6 19.661 3.958 3.868 26 HG SER 6 HG SER 6 21.788 2.472 3.108 27 H GLY 7 H GLY 7 18.391 1.769 6.189 28 HA2 GLY 7 1HA GLY 7 17.013 3.051 8.144 29 HA3 GLY 7 2HA GLY 7 16.571 3.948 6.698 30 H ASN 8 H ASN 8 16.198 1.003 8.470 31 HA ASN 8 HA ASN 8 14.848 -0.488 6.466 32 HB2 ASN 8 1HB ASN 8 14.406 -0.859 9.419 33 HB3 ASN 8 2HB ASN 8 14.404 -2.075 8.144 34 HD21 ASN 8 1HD2 ASN 8 16.320 -0.199 10.310 35 HD22 ASN 8 2HD2 ASN 8 17.826 -0.985 9.999 36 H ASP 9 H ASP 9 13.844 1.888 8.816 37 HA ASP 9 HA ASP 9 11.023 1.413 8.218 38 HB2 ASP 9 1HB ASP 9 10.645 3.153 9.996 39 HB3 ASP 9 2HB ASP 9 11.480 1.705 10.552 40 H ASP 10 H ASP 10 13.583 3.323 7.156 41 HA ASP 10 HA ASP 10 11.951 5.593 6.372 42 HB2 ASP 10 1HB ASP 10 14.086 6.299 6.977 43 HB3 ASP 10 2HB ASP 10 14.869 4.925 6.200 44 H ILE 11 H ILE 11 13.423 2.755 4.936 45 HA ILE 11 HA ILE 11 13.008 3.490 2.227 46 HB ILE 11 HB ILE 11 14.551 1.655 3.135 47 HG12 ILE 11 1HG1 ILE 11 12.821 0.778 0.829 48 HG13 ILE 11 2HG1 ILE 11 13.910 2.156 0.700 49 HG21 ILE 11 1HG2 ILE 11 12.298 0.613 4.184 50 HG22 ILE 11 2HG2 ILE 11 12.402 -0.305 2.682 51 HG23 ILE 11 3HG2 ILE 11 13.743 -0.333 3.827 52 HD11 ILE 11 1HD1 ILE 11 15.317 -0.085 1.784 53 HD12 ILE 11 2HD1 ILE 11 14.498 -0.550 0.293 54 HD13 ILE 11 3HD1 ILE 11 15.617 0.813 0.296 55 H ILE 12 H ILE 12 10.879 2.517 4.673 56 HA ILE 12 HA ILE 12 8.975 0.977 3.402 57 HB ILE 12 HB ILE 12 8.449 3.194 5.385 58 HG12 ILE 12 1HG1 ILE 12 9.132 0.273 5.740 59 HG13 ILE 12 2HG1 ILE 12 10.040 1.664 6.323 60 HG21 ILE 12 1HG2 ILE 12 6.687 1.434 3.977 61 HG22 ILE 12 2HG2 ILE 12 6.642 1.065 5.700 62 HG23 ILE 12 3HG2 ILE 12 6.300 2.702 5.140 63 HD11 ILE 12 1HD1 ILE 12 7.524 1.956 7.449 64 HD12 ILE 12 2HD1 ILE 12 7.871 0.230 7.559 65 HD13 ILE 12 3HD1 ILE 12 8.992 1.401 8.253 66 H VAL 13 H VAL 13 9.576 4.418 3.128 67 HA VAL 13 HA VAL 13 7.191 4.831 1.512 68 HB VAL 13 HB VAL 13 9.366 6.742 2.372 69 HG11 VAL 13 1HG1 VAL 13 7.685 8.475 1.558 70 HG12 VAL 13 2HG1 VAL 13 8.594 7.600 0.325 71 HG13 VAL 13 3HG1 VAL 13 6.924 7.154 0.672 72 HG21 VAL 13 1HG2 VAL 13 8.039 7.367 4.100 73 HG22 VAL 13 2HG2 VAL 13 6.547 7.057 3.213 74 HG23 VAL 13 3HG2 VAL 13 7.442 5.717 3.927 75 H ASN 14 H ASN 14 10.717 5.169 1.134 76 HA ASN 14 HA ASN 14 10.888 5.937 -1.481 77 HB2 ASN 14 1HB ASN 14 12.735 5.320 0.296 78 HB3 ASN 14 2HB ASN 14 12.727 3.772 -0.543 79 HD21 ASN 14 1HD2 ASN 14 13.043 3.845 -2.892 80 HD22 ASN 14 2HD2 ASN 14 14.102 5.046 -3.541 81 H TRP 15 H TRP 15 10.859 2.546 -0.371 82 HA TRP 15 HA TRP 15 10.872 1.241 -2.767 83 HB2 TRP 15 1HB TRP 15 10.882 0.093 -0.595 84 HB3 TRP 15 2HB TRP 15 9.192 0.522 -0.355 85 HD1 TRP 15 HD TRP 15 11.227 -1.392 -3.066 86 HE1 TRP 15 1HE TRP 15 9.835 -3.431 -3.795 87 HE3 TRP 15 3HE TRP 15 7.090 -0.632 -0.160 88 HZ2 TRP 15 2HZ TRP 15 7.317 -4.566 -3.215 89 HZ3 TRP 15 3HZ TRP 15 5.233 -2.240 -0.307 90 HH2 TRP 15 HH TRP 15 5.346 -4.166 -1.804 91 H VAL 16 H VAL 16 7.807 1.789 -1.031 92 HA VAL 16 HA VAL 16 5.976 1.195 -2.883 93 HB VAL 16 HB VAL 16 5.920 3.697 -1.189 94 HG11 VAL 16 1HG1 VAL 16 4.170 4.160 -2.556 95 HG12 VAL 16 2HG1 VAL 16 3.935 2.472 -3.012 96 HG13 VAL 16 3HG1 VAL 16 3.341 3.058 -1.457 97 HG21 VAL 16 1HG2 VAL 16 4.199 1.772 -0.149 98 HG22 VAL 16 2HG2 VAL 16 5.657 0.882 -0.589 99 HG23 VAL 16 3HG2 VAL 16 5.761 2.261 0.506 100 H ASN 17 H ASN 17 7.689 4.311 -2.786 101 HA ASN 17 HA ASN 17 6.458 5.436 -5.045 102 HB2 ASN 17 1HB ASN 17 9.055 5.952 -3.625 103 HB3 ASN 17 2HB ASN 17 8.665 6.810 -5.112 104 HD21 ASN 17 1HD2 ASN 17 7.495 6.109 -1.865 105 HD22 ASN 17 2HD2 ASN 17 6.606 7.578 -1.673 106 H GLU 18 H GLU 18 9.385 3.480 -4.701 107 HA GLU 18 HA GLU 18 10.251 3.676 -7.374 108 HB2 GLU 18 1HB GLU 18 10.798 1.832 -5.096 109 HB3 GLU 18 2HB GLU 18 11.286 1.320 -6.705 110 HG2 GLU 18 1HG GLU 18 12.461 3.571 -6.885 111 HG3 GLU 18 2HG GLU 18 12.213 3.705 -5.144 112 H THR 19 H THR 19 8.802 0.810 -5.822 113 HA THR 19 HA THR 19 8.284 -0.729 -7.987 114 HB THR 19 HB THR 19 7.637 -1.039 -5.448 115 HG1 THR 19 1HG THR 19 6.634 -2.219 -7.780 116 HG21 THR 19 1HG2 THR 19 5.870 0.636 -5.410 117 HG22 THR 19 2HG2 THR 19 5.195 -0.968 -5.126 118 HG23 THR 19 3HG2 THR 19 5.021 -0.206 -6.706 119 H LEU 20 H LEU 20 6.388 2.049 -6.920 120 HA LEU 20 HA LEU 20 4.340 1.696 -8.891 121 HB2 LEU 20 1HB LEU 20 5.065 4.073 -7.186 122 HB3 LEU 20 2HB LEU 20 3.625 3.962 -8.196 123 HG LEU 20 HG LEU 20 4.142 1.976 -6.007 124 HD11 LEU 20 1HD1 LEU 20 2.690 4.602 -5.714 125 HD12 LEU 20 2HD1 LEU 20 4.272 4.231 -5.027 126 HD13 LEU 20 3HD1 LEU 20 2.847 3.341 -4.490 127 HD21 LEU 20 1HD2 LEU 20 1.683 1.817 -6.065 128 HD22 LEU 20 2HD2 LEU 20 2.424 1.406 -7.611 129 HD23 LEU 20 3HD2 LEU 20 1.658 2.979 -7.393 130 H ARG 21 H ARG 21 7.205 3.751 -8.579 131 HA ARG 21 HA ARG 21 6.806 5.295 -10.888 132 HB2 ARG 21 1HB ARG 21 9.129 4.631 -9.152 133 HB3 ARG 21 2HB ARG 21 9.473 5.308 -10.738 134 HG2 ARG 21 1HG ARG 21 7.666 7.079 -9.992 135 HG3 ARG 21 2HG ARG 21 8.166 6.555 -8.383 136 HD2 ARG 21 1HD ARG 21 10.532 6.993 -9.070 137 HD3 ARG 21 2HD ARG 21 9.908 7.696 -10.561 138 HE ARG 21 HE ARG 21 8.747 8.876 -8.232 139 HH11 ARG 21 1HH1 ARG 21 11.545 8.895 -10.303 140 HH12 ARG 21 2HH1 ARG 21 11.973 10.531 -9.927 141 HH21 ARG 21 1HH2 ARG 21 9.302 11.030 -7.728 142 HH22 ARG 21 2HH2 ARG 21 10.698 11.745 -8.461 143 H GLU 22 H GLU 22 8.907 2.446 -10.432 144 HA GLU 22 HA GLU 22 9.674 2.174 -13.104 145 HB2 GLU 22 1HB GLU 22 9.327 -0.089 -11.134 146 HB3 GLU 22 2HB GLU 22 10.394 -0.051 -12.531 147 HG2 GLU 22 1HG GLU 22 10.757 2.031 -10.450 148 HG3 GLU 22 2HG GLU 22 11.270 0.386 -10.080 149 H ALA 23 H ALA 23 6.752 1.254 -11.468 150 HA ALA 23 HA ALA 23 5.852 -0.420 -13.669 151 HB1 ALA 23 1HB ALA 23 4.658 0.307 -11.009 152 HB2 ALA 23 2HB ALA 23 3.761 -0.587 -12.238 153 HB3 ALA 23 3HB ALA 23 5.241 -1.264 -11.559 154 H GLU 24 H GLU 24 5.927 2.837 -13.000 155 HA GLU 24 HA GLU 24 4.955 4.657 -13.958 156 HB2 GLU 24 1HB GLU 24 3.412 2.984 -15.886 157 HB3 GLU 24 2HB GLU 24 4.262 4.501 -16.148 158 HG2 GLU 24 1HG GLU 24 5.691 3.146 -17.239 159 HG3 GLU 24 2HG GLU 24 6.359 2.949 -15.619 160 H LYS 25 H LYS 25 3.757 3.942 -11.712 161 HA LYS 25 HA LYS 25 0.885 3.706 -12.191 162 HB2 LYS 25 1HB LYS 25 2.688 3.264 -9.880 163 HB3 LYS 25 2HB LYS 25 1.072 3.847 -9.508 164 HG2 LYS 25 1HG LYS 25 1.331 1.369 -9.456 165 HG3 LYS 25 2HG LYS 25 0.066 1.954 -10.537 166 HD2 LYS 25 1HD LYS 25 1.956 1.864 -12.335 167 HD3 LYS 25 2HD LYS 25 2.725 0.757 -11.195 168 HE2 LYS 25 1HE LYS 25 1.502 -0.634 -12.624 169 HE3 LYS 25 2HE LYS 25 0.495 -0.492 -11.184 170 HZ1 LYS 25 1HZ LYS 25 -0.968 0.948 -12.261 171 HZ2 LYS 25 2HZ LYS 25 -0.633 -0.231 -13.427 172 HZ3 LYS 25 3HZ LYS 25 0.116 1.283 -13.517 173 H SER 26 H SER 26 -0.611 5.246 -11.556 174 HA SER 26 HA SER 26 0.424 7.956 -11.409 175 HB2 SER 26 1HB SER 26 -2.334 6.800 -11.795 176 HB3 SER 26 2HB SER 26 -2.075 8.524 -11.530 177 HG SER 26 HG SER 26 -0.539 8.319 -13.366 178 H SER 27 H SER 27 0.342 5.847 -9.144 179 HA SER 27 HA SER 27 -0.830 7.649 -7.127 180 HB2 SER 27 1HB SER 27 -0.742 4.623 -7.050 181 HB3 SER 27 2HB SER 27 -1.359 5.662 -5.766 182 HG SER 27 HG SER 27 -2.699 6.486 -7.730 183 H SER 28 H SER 28 0.210 7.653 -5.049 184 HA SER 28 HA SER 28 2.612 6.292 -4.495 185 HB2 SER 28 1HB SER 28 3.388 7.817 -6.357 186 HB3 SER 28 2HB SER 28 3.044 9.178 -5.289 187 HG SER 28 HG SER 28 5.131 8.741 -4.897 188 H ILE 29 H ILE 29 3.911 7.742 -2.751 189 HA ILE 29 HA ILE 29 2.009 9.176 -1.056 190 HB ILE 29 HB ILE 29 2.931 7.882 0.942 191 HG12 ILE 29 1HG1 ILE 29 3.393 5.638 -0.984 192 HG13 ILE 29 2HG1 ILE 29 4.688 6.796 -0.701 193 HG21 ILE 29 1HG2 ILE 29 1.400 5.804 0.079 194 HG22 ILE 29 2HG2 ILE 29 0.771 7.313 0.740 195 HG23 ILE 29 3HG2 ILE 29 0.889 7.097 -1.006 196 HD11 ILE 29 1HD1 ILE 29 4.267 6.291 1.796 197 HD12 ILE 29 2HD1 ILE 29 3.450 4.850 1.190 198 HD13 ILE 29 3HD1 ILE 29 5.150 5.124 0.814 199 H SER 30 H SER 30 2.972 10.555 0.483 200 HA SER 30 HA SER 30 5.754 11.237 -0.156 201 HB2 SER 30 1HB SER 30 4.312 13.106 -0.481 202 HB3 SER 30 2HB SER 30 3.496 12.834 1.058 203 HG SER 30 HG SER 30 6.095 13.829 0.585 204 H SER 31 H SER 31 3.610 10.405 2.490 205 HA SER 31 HA SER 31 5.785 9.504 4.101 206 HB2 SER 31 1HB SER 31 4.506 12.145 4.704 207 HB3 SER 31 2HB SER 31 5.031 11.117 6.038 208 HG SER 31 HG SER 31 6.993 11.159 4.277 209 H PHE 32 H PHE 32 4.953 8.848 6.343 210 HA PHE 32 HA PHE 32 2.891 7.028 6.086 211 HB2 PHE 32 1HB PHE 32 4.008 8.372 8.548 212 HB3 PHE 32 2HB PHE 32 2.838 7.058 8.620 213 HD1 PHE 32 2HD PHE 32 3.501 4.904 7.286 214 HD2 PHE 32 1HD PHE 32 6.251 7.875 8.600 215 HE1 PHE 32 2HE PHE 32 5.332 3.266 7.146 216 HE2 PHE 32 1HE PHE 32 8.087 6.242 8.462 217 HZ PHE 32 HZ PHE 32 7.629 3.934 7.736 218 H LYS 33 H LYS 33 2.727 10.420 6.627 219 HA LYS 33 HA LYS 33 -0.132 10.232 7.298 220 HB2 LYS 33 1HB LYS 33 1.848 12.483 7.669 221 HB3 LYS 33 2HB LYS 33 0.120 12.648 7.953 222 HG2 LYS 33 1HG LYS 33 0.422 10.654 9.561 223 HG3 LYS 33 2HG LYS 33 2.139 11.057 9.482 224 HD2 LYS 33 1HD LYS 33 1.503 12.326 11.282 225 HD3 LYS 33 2HD LYS 33 1.249 13.487 9.977 226 HE2 LYS 33 1HE LYS 33 -1.128 12.844 9.906 227 HE3 LYS 33 2HE LYS 33 -0.855 11.738 11.250 228 HZ1 LYS 33 1HZ LYS 33 -0.074 13.731 12.528 229 HZ2 LYS 33 2HZ LYS 33 -1.725 13.712 12.162 230 HZ3 LYS 33 3HZ LYS 33 -0.674 14.695 11.273 231 H ASP 34 H ASP 34 0.544 9.713 4.679 232 HA ASP 34 HA ASP 34 0.279 12.120 3.107 233 HB2 ASP 34 1HB ASP 34 1.599 10.485 2.060 234 HB3 ASP 34 2HB ASP 34 0.471 9.192 2.455 235 HA PRO 35 HA PRO 35 -4.128 12.239 3.080 236 HB2 PRO 35 1HB PRO 35 -4.464 13.798 0.884 237 HB3 PRO 35 2HB PRO 35 -3.907 14.432 2.436 238 HG2 PRO 35 1HG PRO 35 -2.315 13.697 0.010 239 HG3 PRO 35 2HG PRO 35 -2.152 15.110 1.069 240 HD2 PRO 35 1HD PRO 35 -0.526 12.953 1.258 241 HD3 PRO 35 2HD PRO 35 -0.978 13.934 2.666 242 H LYS 36 H LYS 36 -2.508 11.664 -0.039 243 HA LYS 36 HA LYS 36 -4.596 10.629 -1.496 244 HB2 LYS 36 1HB LYS 36 -1.734 9.651 -1.518 245 HB3 LYS 36 2HB LYS 36 -2.917 9.397 -2.796 246 HG2 LYS 36 1HG LYS 36 -1.976 12.107 -1.887 247 HG3 LYS 36 2HG LYS 36 -1.284 11.217 -3.245 248 HD2 LYS 36 1HD LYS 36 -3.774 11.101 -4.047 249 HD3 LYS 36 2HD LYS 36 -3.972 12.491 -2.976 250 HE2 LYS 36 1HE LYS 36 -3.490 13.434 -5.059 251 HE3 LYS 36 2HE LYS 36 -1.953 13.481 -4.197 252 HZ1 LYS 36 1HZ LYS 36 -1.173 12.522 -6.047 253 HZ2 LYS 36 2HZ LYS 36 -2.696 11.996 -6.560 254 HZ3 LYS 36 3HZ LYS 36 -1.830 11.095 -5.420 255 H ILE 37 H ILE 37 -2.799 9.129 1.089 256 HA ILE 37 HA ILE 37 -3.402 6.449 0.685 257 HB ILE 37 HB ILE 37 -3.121 7.960 3.283 258 HG12 ILE 37 1HG1 ILE 37 -1.205 6.321 1.617 259 HG13 ILE 37 2HG1 ILE 37 -1.104 8.041 1.972 260 HG21 ILE 37 1HG2 ILE 37 -2.438 5.284 3.683 261 HG22 ILE 37 2HG2 ILE 37 -3.851 6.131 4.313 262 HG23 ILE 37 3HG2 ILE 37 -3.958 5.248 2.790 263 HD11 ILE 37 1HD1 ILE 37 0.140 7.593 3.738 264 HD12 ILE 37 2HD1 ILE 37 -1.178 6.652 4.435 265 HD13 ILE 37 3HD1 ILE 37 0.012 5.867 3.397 266 H SER 38 H SER 38 -5.395 9.041 1.918 267 HA SER 38 HA SER 38 -7.417 7.589 3.159 268 HB2 SER 38 1HB SER 38 -7.142 10.101 3.147 269 HB3 SER 38 2HB SER 38 -7.847 10.099 1.529 270 HG SER 38 HG SER 38 -9.045 9.699 3.991 271 H THR 39 H THR 39 -6.865 8.272 -0.242 272 HA THR 39 HA THR 39 -9.378 7.070 -1.043 273 HB THR 39 HB THR 39 -8.462 7.430 -3.379 274 HG1 THR 39 1HG THR 39 -6.204 7.613 -2.308 275 HG21 THR 39 1HG2 THR 39 -9.407 9.330 -1.449 276 HG22 THR 39 2HG2 THR 39 -9.711 9.265 -3.184 277 HG23 THR 39 3HG2 THR 39 -8.298 10.121 -2.568 278 H SER 40 H SER 40 -6.348 5.946 -0.194 279 HA SER 40 HA SER 40 -5.396 3.878 -0.263 280 HB2 SER 40 1HB SER 40 -7.835 2.892 -1.744 281 HB3 SER 40 2HB SER 40 -6.732 1.964 -0.729 282 HG SER 40 HG SER 40 -7.606 2.846 1.057 283 H LEU 41 H LEU 41 -5.197 5.865 -2.456 284 HA LEU 41 HA LEU 41 -5.052 4.503 -4.939 285 HB2 LEU 41 1HB LEU 41 -4.066 7.111 -3.886 286 HB3 LEU 41 2HB LEU 41 -3.447 6.523 -5.427 287 HG LEU 41 HG LEU 41 -6.351 7.043 -4.790 288 HD11 LEU 41 1HD1 LEU 41 -6.119 8.936 -6.317 289 HD12 LEU 41 2HD1 LEU 41 -4.394 8.605 -6.471 290 HD13 LEU 41 3HD1 LEU 41 -5.061 9.104 -4.916 291 HD21 LEU 41 1HD2 LEU 41 -6.611 6.772 -7.255 292 HD22 LEU 41 2HD2 LEU 41 -6.178 5.288 -6.405 293 HD23 LEU 41 3HD2 LEU 41 -4.952 6.175 -7.314 294 HA PRO 42 HA PRO 42 -0.302 4.306 -3.996 295 HB2 PRO 42 1HB PRO 42 0.442 4.713 -1.418 296 HB3 PRO 42 2HB PRO 42 0.326 6.020 -2.602 297 HG2 PRO 42 1HG PRO 42 -1.631 5.197 -0.492 298 HG3 PRO 42 2HG PRO 42 -1.117 6.826 -0.966 299 HD2 PRO 42 1HD PRO 42 -3.452 5.735 -1.798 300 HD3 PRO 42 2HD PRO 42 -2.521 6.874 -2.793 301 H VAL 43 H VAL 43 -2.555 3.264 -1.494 302 HA VAL 43 HA VAL 43 -1.043 0.957 -0.730 303 HB VAL 43 HB VAL 43 -3.996 1.350 -0.283 304 HG11 VAL 43 1HG1 VAL 43 -1.841 -0.301 0.973 305 HG12 VAL 43 2HG1 VAL 43 -3.274 0.152 1.897 306 HG13 VAL 43 3HG1 VAL 43 -3.441 -0.788 0.415 307 HG21 VAL 43 1HG2 VAL 43 -2.532 2.166 1.993 308 HG22 VAL 43 2HG2 VAL 43 -1.869 3.030 0.605 309 HG23 VAL 43 3HG2 VAL 43 -3.591 3.139 0.971 310 H LEU 44 H LEU 44 -3.666 1.607 -2.981 311 HA LEU 44 HA LEU 44 -4.133 -1.162 -3.584 312 HB2 LEU 44 1HB LEU 44 -5.044 1.421 -4.818 313 HB3 LEU 44 2HB LEU 44 -5.438 -0.145 -5.526 314 HG LEU 44 HG LEU 44 -6.174 0.586 -2.701 315 HD11 LEU 44 1HD1 LEU 44 -8.048 0.751 -5.035 316 HD12 LEU 44 2HD1 LEU 44 -7.113 2.146 -4.500 317 HD13 LEU 44 3HD1 LEU 44 -8.255 1.377 -3.399 318 HD21 LEU 44 1HD2 LEU 44 -7.874 -1.241 -4.179 319 HD22 LEU 44 2HD2 LEU 44 -7.106 -1.434 -2.603 320 HD23 LEU 44 3HD2 LEU 44 -6.210 -1.816 -4.075 321 H ASP 45 H ASP 45 -2.699 1.560 -5.381 322 HA ASP 45 HA ASP 45 -1.871 0.070 -7.609 323 HB2 ASP 45 1HB ASP 45 -0.972 2.684 -6.426 324 HB3 ASP 45 2HB ASP 45 -0.157 2.000 -7.830 325 H LEU 46 H LEU 46 -0.189 0.889 -4.602 326 HA LEU 46 HA LEU 46 2.347 0.023 -5.108 327 HB2 LEU 46 1HB LEU 46 1.942 0.961 -3.006 328 HB3 LEU 46 2HB LEU 46 0.645 -0.178 -2.651 329 HG LEU 46 HG LEU 46 2.267 -1.959 -2.328 330 HD11 LEU 46 1HD1 LEU 46 4.042 -0.043 -3.609 331 HD12 LEU 46 2HD1 LEU 46 4.184 -1.793 -3.454 332 HD13 LEU 46 3HD1 LEU 46 4.727 -0.745 -2.143 333 HD21 LEU 46 1HD2 LEU 46 3.545 -0.869 -0.383 334 HD22 LEU 46 2HD2 LEU 46 1.782 -0.872 -0.326 335 HD23 LEU 46 3HD2 LEU 46 2.649 0.591 -0.799 336 H ILE 47 H ILE 47 -0.421 -1.992 -4.177 337 HA ILE 47 HA ILE 47 0.961 -4.439 -4.068 338 HB ILE 47 HB ILE 47 -1.945 -4.000 -4.770 339 HG12 ILE 47 1HG1 ILE 47 -0.953 -4.733 -2.040 340 HG13 ILE 47 2HG1 ILE 47 -0.918 -3.047 -2.547 341 HG21 ILE 47 1HG2 ILE 47 -1.009 -6.256 -5.273 342 HG22 ILE 47 2HG2 ILE 47 -0.624 -6.422 -3.560 343 HG23 ILE 47 3HG2 ILE 47 -2.303 -6.262 -4.076 344 HD11 ILE 47 1HD1 ILE 47 -3.445 -3.718 -3.215 345 HD12 ILE 47 2HD1 ILE 47 -3.182 -4.755 -1.812 346 HD13 ILE 47 3HD1 ILE 47 -2.975 -3.009 -1.671 347 H ASP 48 H ASP 48 -1.228 -3.276 -6.639 348 HA ASP 48 HA ASP 48 -0.793 -5.214 -8.517 349 HB2 ASP 48 1HB ASP 48 -2.350 -3.179 -8.626 350 HB3 ASP 48 2HB ASP 48 -0.969 -2.305 -9.284 351 H ALA 49 H ALA 49 1.144 -2.278 -8.026 352 HA ALA 49 HA ALA 49 2.910 -2.339 -10.065 353 HB1 ALA 49 1HB ALA 49 4.633 -1.488 -8.465 354 HB2 ALA 49 2HB ALA 49 3.083 -0.649 -8.391 355 HB3 ALA 49 3HB ALA 49 3.504 -1.836 -7.156 356 H ILE 50 H ILE 50 3.078 -4.385 -7.171 357 HA ILE 50 HA ILE 50 5.457 -5.732 -8.008 358 HB ILE 50 HB ILE 50 3.455 -6.696 -5.967 359 HG12 ILE 50 1HG1 ILE 50 5.904 -5.060 -5.343 360 HG13 ILE 50 2HG1 ILE 50 4.359 -4.290 -5.688 361 HG21 ILE 50 1HG2 ILE 50 5.597 -7.999 -6.982 362 HG22 ILE 50 2HG2 ILE 50 6.336 -7.162 -5.618 363 HG23 ILE 50 3HG2 ILE 50 4.969 -8.243 -5.354 364 HD11 ILE 50 1HD1 ILE 50 4.205 -4.417 -3.436 365 HD12 ILE 50 2HD1 ILE 50 3.537 -6.000 -3.835 366 HD13 ILE 50 3HD1 ILE 50 5.220 -5.855 -3.333 367 H GLN 51 H GLN 51 2.027 -6.677 -7.849 368 HA GLN 51 HA GLN 51 2.603 -8.730 -9.881 369 HB2 GLN 51 1HB GLN 51 2.122 -9.661 -7.598 370 HB3 GLN 51 2HB GLN 51 0.515 -8.955 -7.711 371 HG2 GLN 51 1HG GLN 51 -0.190 -10.457 -9.284 372 HG3 GLN 51 2HG GLN 51 1.440 -10.754 -9.889 373 HE21 GLN 51 1HE2 GLN 51 -0.995 -11.697 -7.672 374 HE22 GLN 51 2HE2 GLN 51 -0.159 -13.040 -6.977 375 HA PRO 52 HA PRO 52 -0.428 -5.916 -11.800 376 HB2 PRO 52 1HB PRO 52 0.354 -6.478 -14.339 377 HB3 PRO 52 2HB PRO 52 1.183 -5.298 -13.317 378 HG2 PRO 52 1HG PRO 52 1.912 -8.143 -13.899 379 HG3 PRO 52 2HG PRO 52 2.958 -6.712 -13.826 380 HD2 PRO 52 1HD PRO 52 2.765 -8.485 -11.787 381 HD3 PRO 52 2HD PRO 52 3.064 -6.754 -11.523 382 H GLY 53 H GLY 53 -2.445 -6.682 -11.867 383 HA2 GLY 53 1HA GLY 53 -3.820 -8.020 -13.596 384 HA3 GLY 53 2HA GLY 53 -2.902 -9.377 -12.959 385 H SER 54 H SER 54 -3.055 -7.840 -10.270 386 HA SER 54 HA SER 54 -5.431 -9.221 -9.368 387 HB2 SER 54 1HB SER 54 -3.107 -7.884 -8.063 388 HB3 SER 54 2HB SER 54 -4.596 -8.032 -7.133 389 HG SER 54 HG SER 54 -3.718 -10.300 -8.483 390 H ILE 55 H ILE 55 -4.236 -5.891 -8.889 391 HA ILE 55 HA ILE 55 -6.744 -4.867 -8.097 392 HB ILE 55 HB ILE 55 -4.381 -3.371 -9.237 393 HG12 ILE 55 1HG1 ILE 55 -3.985 -4.779 -7.162 394 HG13 ILE 55 2HG1 ILE 55 -3.629 -3.062 -7.001 395 HG21 ILE 55 1HG2 ILE 55 -5.936 -1.733 -9.320 396 HG22 ILE 55 2HG2 ILE 55 -6.987 -2.521 -8.144 397 HG23 ILE 55 3HG2 ILE 55 -5.576 -1.616 -7.598 398 HD11 ILE 55 1HD1 ILE 55 -5.319 -4.660 -5.413 399 HD12 ILE 55 2HD1 ILE 55 -5.002 -2.929 -5.278 400 HD13 ILE 55 3HD1 ILE 55 -6.342 -3.505 -6.269 401 H ASN 56 H ASN 56 -8.389 -3.960 -9.209 402 HA ASN 56 HA ASN 56 -8.085 -3.684 -12.125 403 HB2 ASN 56 1HB ASN 56 -9.472 -5.712 -11.156 404 HB3 ASN 56 2HB ASN 56 -10.722 -4.486 -10.963 405 HD21 ASN 56 1HD2 ASN 56 -12.109 -5.160 -12.502 406 HD22 ASN 56 2HD2 ASN 56 -11.741 -5.206 -14.190 407 H TYR 57 H TYR 57 -8.023 -1.522 -12.347 408 HA TYR 57 HA TYR 57 -9.238 0.386 -10.744 409 HB2 TYR 57 1HB TYR 57 -8.168 0.361 -13.523 410 HB3 TYR 57 2HB TYR 57 -9.164 1.733 -13.047 411 HD1 TYR 57 1HD TYR 57 -6.841 -0.153 -10.859 412 HD2 TYR 57 2HD TYR 57 -7.544 3.449 -13.012 413 HE1 TYR 57 1HE TYR 57 -4.893 0.875 -9.765 414 HE2 TYR 57 2HE TYR 57 -5.598 4.486 -11.924 415 HH TYR 57 HH TYR 57 -3.373 3.527 -10.827 416 H ASP 58 H ASP 58 -10.547 -1.480 -13.390 417 HA ASP 58 HA ASP 58 -12.776 -0.050 -14.114 418 HB2 ASP 58 1HB ASP 58 -11.883 -2.423 -14.849 419 HB3 ASP 58 2HB ASP 58 -13.069 -2.994 -13.677 420 H LEU 59 H LEU 59 -12.344 -2.104 -11.273 421 HA LEU 59 HA LEU 59 -15.058 -1.607 -10.374 422 HB2 LEU 59 1HB LEU 59 -12.962 -2.918 -8.700 423 HB3 LEU 59 2HB LEU 59 -14.699 -3.213 -8.749 424 HG LEU 59 HG LEU 59 -12.747 -4.033 -10.899 425 HD11 LEU 59 1HD1 LEU 59 -13.168 -6.321 -10.059 426 HD12 LEU 59 2HD1 LEU 59 -14.035 -5.628 -8.690 427 HD13 LEU 59 3HD1 LEU 59 -12.315 -5.300 -8.900 428 HD21 LEU 59 1HD2 LEU 59 -15.625 -3.869 -10.786 429 HD22 LEU 59 2HD2 LEU 59 -15.094 -5.532 -11.035 430 HD23 LEU 59 3HD2 LEU 59 -14.574 -4.264 -12.146 431 H LEU 60 H LEU 60 -11.787 -0.578 -9.636 432 HA LEU 60 HA LEU 60 -12.282 0.704 -7.189 433 HB2 LEU 60 1HB LEU 60 -10.269 1.420 -9.316 434 HB3 LEU 60 2HB LEU 60 -10.231 1.961 -7.639 435 HG LEU 60 HG LEU 60 -9.939 -0.900 -8.554 436 HD11 LEU 60 1HD1 LEU 60 -7.645 0.151 -7.232 437 HD12 LEU 60 2HD1 LEU 60 -8.069 1.216 -8.571 438 HD13 LEU 60 3HD1 LEU 60 -7.783 -0.498 -8.866 439 HD21 LEU 60 1HD2 LEU 60 -9.132 -1.157 -6.164 440 HD22 LEU 60 2HD2 LEU 60 -10.866 -0.928 -6.388 441 HD23 LEU 60 3HD2 LEU 60 -9.860 0.419 -5.853 442 H LYS 61 H LYS 61 -12.603 2.906 -6.688 443 HA LYS 61 HA LYS 61 -14.246 4.299 -8.652 444 HB2 LYS 61 1HB LYS 61 -13.874 4.466 -5.694 445 HB3 LYS 61 2HB LYS 61 -14.465 5.888 -6.544 446 HG2 LYS 61 1HG LYS 61 -16.413 4.832 -5.908 447 HG3 LYS 61 2HG LYS 61 -16.199 4.268 -7.567 448 HD2 LYS 61 1HD LYS 61 -15.036 2.244 -6.593 449 HD3 LYS 61 2HD LYS 61 -15.607 2.786 -5.013 450 HE2 LYS 61 1HE LYS 61 -17.143 1.151 -5.876 451 HE3 LYS 61 2HE LYS 61 -17.926 2.731 -5.889 452 HZ1 LYS 61 1HZ LYS 61 -17.897 2.832 -8.153 453 HZ2 LYS 61 2HZ LYS 61 -18.035 1.158 -7.957 454 HZ3 LYS 61 3HZ LYS 61 -16.531 1.846 -8.310 455 H THR 62 H THR 62 -11.703 5.275 -6.344 456 HA THR 62 HA THR 62 -10.196 6.994 -6.409 457 HB THR 62 HB THR 62 -8.620 6.835 -8.093 458 HG1 THR 62 1HG THR 62 -10.856 6.575 -9.761 459 HG21 THR 62 1HG2 THR 62 -8.646 4.457 -8.944 460 HG22 THR 62 2HG2 THR 62 -10.224 4.284 -8.177 461 HG23 THR 62 3HG2 THR 62 -8.801 4.639 -7.198 462 H GLU 63 H GLU 63 -12.979 7.699 -7.013 463 HA GLU 63 HA GLU 63 -12.437 10.231 -8.395 464 HB2 GLU 63 1HB GLU 63 -14.587 10.107 -9.559 465 HB3 GLU 63 2HB GLU 63 -13.544 8.767 -10.012 466 HG2 GLU 63 1HG GLU 63 -14.796 7.429 -8.231 467 HG3 GLU 63 2HG GLU 63 -15.978 8.737 -8.269 468 H ASN 64 H ASN 64 -12.671 11.697 -6.834 469 HA ASN 64 HA ASN 64 -13.421 12.708 -4.912 470 HB2 ASN 64 1HB ASN 64 -15.934 13.195 -5.081 471 HB3 ASN 64 2HB ASN 64 -14.917 13.749 -6.408 472 HD21 ASN 64 1HD2 ASN 64 -14.925 12.555 -8.369 473 HD22 ASN 64 2HD2 ASN 64 -16.287 11.584 -8.799 474 H LEU 65 H LEU 65 -12.908 10.109 -4.299 475 HA LEU 65 HA LEU 65 -14.975 8.561 -3.278 476 HB2 LEU 65 1HB LEU 65 -12.102 8.861 -2.456 477 HB3 LEU 65 2HB LEU 65 -13.183 7.711 -1.673 478 HG LEU 65 HG LEU 65 -12.867 7.614 -4.639 479 HD11 LEU 65 1HD1 LEU 65 -11.013 5.879 -4.079 480 HD12 LEU 65 2HD1 LEU 65 -10.819 6.834 -2.610 481 HD13 LEU 65 3HD1 LEU 65 -10.607 7.592 -4.188 482 HD21 LEU 65 1HD2 LEU 65 -12.945 5.089 -3.826 483 HD22 LEU 65 2HD2 LEU 65 -14.408 6.049 -4.044 484 HD23 LEU 65 3HD2 LEU 65 -13.728 5.831 -2.430 485 H ASN 66 H ASN 66 -15.707 8.233 -1.104 486 HA ASN 66 HA ASN 66 -15.326 10.501 0.714 487 HB2 ASN 66 1HB ASN 66 -17.664 10.775 1.099 488 HB3 ASN 66 2HB ASN 66 -17.443 10.770 -0.649 489 HD21 ASN 66 1HD2 ASN 66 -17.790 8.679 -1.739 490 HD22 ASN 66 2HD2 ASN 66 -19.044 7.650 -1.142 491 H ASP 67 H ASP 67 -16.601 9.935 2.863 492 HA ASP 67 HA ASP 67 -15.281 7.913 4.154 493 HB2 ASP 67 1HB ASP 67 -16.855 9.800 5.058 494 HB3 ASP 67 2HB ASP 67 -18.098 8.555 4.959 495 H ASP 68 H ASP 68 -18.041 7.669 2.081 496 HA ASP 68 HA ASP 68 -18.759 5.007 2.941 497 HB2 ASP 68 1HB ASP 68 -20.254 6.898 1.852 498 HB3 ASP 68 2HB ASP 68 -19.705 6.158 0.350 499 H GLU 69 H GLU 69 -17.833 6.254 -0.271 500 HA GLU 69 HA GLU 69 -17.144 3.788 -1.362 501 HB2 GLU 69 1HB GLU 69 -16.090 6.537 -2.045 502 HB3 GLU 69 2HB GLU 69 -15.856 5.105 -3.037 503 HG2 GLU 69 1HG GLU 69 -18.617 5.938 -2.284 504 HG3 GLU 69 2HG GLU 69 -17.768 6.781 -3.578 505 H LYS 70 H LYS 70 -14.988 6.271 0.011 506 HA LYS 70 HA LYS 70 -12.541 5.208 -0.273 507 HB2 LYS 70 1HB LYS 70 -13.738 6.466 2.192 508 HB3 LYS 70 2HB LYS 70 -12.030 6.061 2.076 509 HG2 LYS 70 1HG LYS 70 -11.878 7.515 0.070 510 HG3 LYS 70 2HG LYS 70 -13.553 7.998 0.346 511 HD2 LYS 70 1HD LYS 70 -12.935 8.858 2.556 512 HD3 LYS 70 2HD LYS 70 -11.260 8.379 2.273 513 HE2 LYS 70 1HE LYS 70 -10.986 9.975 0.561 514 HE3 LYS 70 2HE LYS 70 -12.724 10.245 0.426 515 HZ1 LYS 70 1HZ LYS 70 -11.965 10.815 3.053 516 HZ2 LYS 70 2HZ LYS 70 -12.533 11.888 1.874 517 HZ3 LYS 70 3HZ LYS 70 -10.873 11.606 2.031 518 H LEU 71 H LEU 71 -14.938 4.115 2.091 519 HA LEU 71 HA LEU 71 -13.362 2.262 3.456 520 HB2 LEU 71 1HB LEU 71 -15.486 2.872 4.331 521 HB3 LEU 71 2HB LEU 71 -16.314 2.326 2.874 522 HG LEU 71 HG LEU 71 -15.704 -0.005 3.455 523 HD11 LEU 71 1HD1 LEU 71 -15.032 -0.325 5.898 524 HD12 LEU 71 2HD1 LEU 71 -14.507 1.357 5.845 525 HD13 LEU 71 3HD1 LEU 71 -13.776 0.171 4.764 526 HD21 LEU 71 1HD2 LEU 71 -17.670 -0.143 4.482 527 HD22 LEU 71 2HD2 LEU 71 -17.688 1.619 4.546 528 HD23 LEU 71 3HD2 LEU 71 -17.053 0.692 5.907 529 H ASN 72 H ASN 72 -15.785 1.485 0.951 530 HA ASN 72 HA ASN 72 -15.253 -1.133 0.521 531 HB2 ASN 72 1HB ASN 72 -15.752 0.922 -1.645 532 HB3 ASN 72 2HB ASN 72 -15.977 -0.816 -1.814 533 HD21 ASN 72 1HD2 ASN 72 -17.125 2.073 -0.211 534 HD22 ASN 72 2HD2 ASN 72 -18.694 1.462 0.181 535 H ASN 73 H ASN 73 -13.388 1.590 -0.744 536 HA ASN 73 HA ASN 73 -11.631 0.057 -2.346 537 HB2 ASN 73 1HB ASN 73 -11.513 2.825 -1.177 538 HB3 ASN 73 2HB ASN 73 -10.129 2.152 -2.034 539 HD21 ASN 73 1HD2 ASN 73 -10.499 3.965 -3.477 540 HD22 ASN 73 2HD2 ASN 73 -11.661 3.805 -4.746 541 H ALA 74 H ALA 74 -11.381 1.294 0.969 542 HA ALA 74 HA ALA 74 -8.768 0.386 1.482 543 HB1 ALA 74 1HB ALA 74 -10.911 0.624 3.574 544 HB2 ALA 74 2HB ALA 74 -9.174 0.883 3.744 545 HB3 ALA 74 3HB ALA 74 -10.153 2.035 2.835 546 H LYS 75 H LYS 75 -11.912 -1.171 1.807 547 HA LYS 75 HA LYS 75 -11.026 -3.459 3.208 548 HB2 LYS 75 1HB LYS 75 -13.424 -2.968 1.444 549 HB3 LYS 75 2HB LYS 75 -13.159 -4.486 2.292 550 HG2 LYS 75 1HG LYS 75 -13.619 -3.588 4.334 551 HG3 LYS 75 2HG LYS 75 -13.073 -1.974 3.873 552 HD2 LYS 75 1HD LYS 75 -15.445 -1.888 4.131 553 HD3 LYS 75 2HD LYS 75 -15.095 -1.807 2.404 554 HE2 LYS 75 1HE LYS 75 -15.566 -4.480 3.615 555 HE3 LYS 75 2HE LYS 75 -16.955 -3.419 3.385 556 HZ1 LYS 75 1HZ LYS 75 -16.726 -3.461 1.114 557 HZ2 LYS 75 2HZ LYS 75 -16.252 -5.034 1.512 558 HZ3 LYS 75 3HZ LYS 75 -15.083 -3.864 1.160 559 H TYR 76 H TYR 76 -11.290 -2.699 -0.223 560 HA TYR 76 HA TYR 76 -10.669 -5.329 -1.132 561 HB2 TYR 76 1HB TYR 76 -11.859 -3.515 -2.452 562 HB3 TYR 76 2HB TYR 76 -10.283 -2.764 -2.678 563 HD1 TYR 76 1HD TYR 76 -11.943 -6.086 -3.116 564 HD2 TYR 76 2HD TYR 76 -9.097 -3.287 -4.588 565 HE1 TYR 76 1HE TYR 76 -11.542 -7.529 -5.067 566 HE2 TYR 76 2HE TYR 76 -8.690 -4.721 -6.544 567 HH TYR 76 HH TYR 76 -8.940 -6.962 -7.268 568 H ALA 77 H ALA 77 -8.783 -2.368 -0.664 569 HA ALA 77 HA ALA 77 -6.363 -3.176 -1.745 570 HB1 ALA 77 1HB ALA 77 -5.828 -1.125 -1.096 571 HB2 ALA 77 2HB ALA 77 -7.292 -1.043 -0.116 572 HB3 ALA 77 3HB ALA 77 -5.797 -1.662 0.584 573 H ILE 78 H ILE 78 -7.503 -3.556 1.607 574 HA ILE 78 HA ILE 78 -5.211 -4.929 2.525 575 HB ILE 78 HB ILE 78 -8.032 -4.946 3.602 576 HG12 ILE 78 1HG1 ILE 78 -5.574 -3.382 4.420 577 HG13 ILE 78 2HG1 ILE 78 -6.981 -2.731 3.587 578 HG21 ILE 78 1HG2 ILE 78 -6.585 -6.907 4.265 579 HG22 ILE 78 2HG2 ILE 78 -5.535 -5.745 5.074 580 HG23 ILE 78 3HG2 ILE 78 -7.211 -5.929 5.591 581 HD11 ILE 78 1HD1 ILE 78 -7.942 -2.320 5.529 582 HD12 ILE 78 2HD1 ILE 78 -7.868 -4.034 5.945 583 HD13 ILE 78 3HD1 ILE 78 -6.527 -2.966 6.362 584 H SER 79 H SER 79 -8.394 -6.092 1.447 585 HA SER 79 HA SER 79 -8.030 -8.806 1.867 586 HB2 SER 79 1HB SER 79 -9.905 -9.144 0.530 587 HB3 SER 79 2HB SER 79 -10.108 -7.461 1.016 588 HG SER 79 HG SER 79 -9.232 -8.498 -1.458 589 H MET 80 H MET 80 -7.321 -6.934 -1.078 590 HA MET 80 HA MET 80 -6.432 -8.867 -2.767 591 HB2 MET 80 1HB MET 80 -6.450 -6.237 -2.951 592 HB3 MET 80 2HB MET 80 -4.757 -6.405 -2.508 593 HG2 MET 80 1HG MET 80 -4.567 -6.464 -4.767 594 HG3 MET 80 2HG MET 80 -4.777 -8.183 -4.446 595 HE1 MET 80 1HE MET 80 -6.207 -9.550 -5.231 596 HE2 MET 80 2HE MET 80 -7.870 -9.184 -4.773 597 HE3 MET 80 3HE MET 80 -7.425 -9.272 -6.477 598 H ALA 81 H ALA 81 -4.568 -7.371 -0.148 599 HA ALA 81 HA ALA 81 -2.072 -8.346 -0.497 600 HB1 ALA 81 1HB ALA 81 -2.986 -8.800 2.241 601 HB2 ALA 81 2HB ALA 81 -1.725 -7.731 1.626 602 HB3 ALA 81 3HB ALA 81 -3.410 -7.213 1.601 603 H ARG 82 H ARG 82 -4.759 -10.169 0.961 604 HA ARG 82 HA ARG 82 -3.266 -12.556 1.321 605 HB2 ARG 82 1HB ARG 82 -5.319 -12.032 2.592 606 HB3 ARG 82 2HB ARG 82 -6.261 -12.193 1.116 607 HG2 ARG 82 1HG ARG 82 -5.667 -14.538 0.961 608 HG3 ARG 82 2HG ARG 82 -4.649 -14.391 2.395 609 HD2 ARG 82 1HD ARG 82 -6.466 -14.153 3.816 610 HD3 ARG 82 2HD ARG 82 -7.539 -13.632 2.518 611 HE ARG 82 HE ARG 82 -6.612 -16.335 2.227 612 HH11 ARG 82 1HH1 ARG 82 -9.012 -14.275 3.682 613 HH12 ARG 82 2HH1 ARG 82 -10.192 -15.535 3.830 614 HH21 ARG 82 1HH2 ARG 82 -8.157 -18.002 2.417 615 HH22 ARG 82 2HH2 ARG 82 -9.704 -17.655 3.111 616 H LYS 83 H LYS 83 -5.135 -11.239 -1.316 617 HA LYS 83 HA LYS 83 -5.593 -13.525 -2.833 618 HB2 LYS 83 1HB LYS 83 -6.281 -11.012 -3.192 619 HB3 LYS 83 2HB LYS 83 -4.823 -10.962 -4.174 620 HG2 LYS 83 1HG LYS 83 -6.334 -11.502 -5.777 621 HG3 LYS 83 2HG LYS 83 -5.896 -13.126 -5.243 622 HD2 LYS 83 1HD LYS 83 -7.856 -12.879 -3.590 623 HD3 LYS 83 2HD LYS 83 -8.363 -11.536 -4.617 624 HE2 LYS 83 1HE LYS 83 -8.453 -13.021 -6.541 625 HE3 LYS 83 2HE LYS 83 -7.877 -14.363 -5.555 626 HZ1 LYS 83 1HZ LYS 83 -10.185 -14.619 -5.675 627 HZ2 LYS 83 2HZ LYS 83 -10.485 -12.977 -5.405 628 HZ3 LYS 83 3HZ LYS 83 -9.917 -13.950 -4.145 629 H ILE 84 H ILE 84 -2.795 -11.327 -2.904 630 HA ILE 84 HA ILE 84 -1.376 -12.966 -4.792 631 HB ILE 84 HB ILE 84 0.530 -11.435 -4.341 632 HG12 ILE 84 1HG1 ILE 84 -1.394 -9.902 -2.593 633 HG13 ILE 84 2HG1 ILE 84 -0.194 -11.009 -1.938 634 HG21 ILE 84 1HG2 ILE 84 -2.106 -10.666 -5.346 635 HG22 ILE 84 2HG2 ILE 84 -1.074 -9.304 -4.917 636 HG23 ILE 84 3HG2 ILE 84 -0.515 -10.498 -6.087 637 HD11 ILE 84 1HD1 ILE 84 1.351 -9.434 -2.029 638 HD12 ILE 84 2HD1 ILE 84 1.070 -9.207 -3.756 639 HD13 ILE 84 3HD1 ILE 84 0.119 -8.299 -2.581 640 H GLY 85 H GLY 85 -1.697 -12.836 -1.367 641 HA2 GLY 85 1HA GLY 85 -0.997 -14.895 -0.205 642 HA3 GLY 85 2HA GLY 85 0.501 -14.796 -1.119 643 H ALA 86 H ALA 86 -1.426 -13.163 1.356 644 HA ALA 86 HA ALA 86 0.818 -12.699 3.013 645 HB1 ALA 86 1HB ALA 86 -0.247 -10.240 1.629 646 HB2 ALA 86 2HB ALA 86 0.999 -10.291 2.877 647 HB3 ALA 86 3HB ALA 86 1.306 -11.004 1.292 648 H ARG 87 H ARG 87 0.175 -10.965 4.771 649 HA ARG 87 HA ARG 87 -2.695 -11.248 5.356 650 HB2 ARG 87 1HB ARG 87 -0.344 -11.820 7.141 651 HB3 ARG 87 2HB ARG 87 -1.916 -11.409 7.811 652 HG2 ARG 87 1HG ARG 87 -2.707 -13.336 6.180 653 HG3 ARG 87 2HG ARG 87 -1.035 -13.859 6.395 654 HD2 ARG 87 1HD ARG 87 -1.390 -13.718 8.862 655 HD3 ARG 87 2HD ARG 87 -3.095 -13.394 8.547 656 HE ARG 87 HE ARG 87 -2.373 -15.746 7.210 657 HH11 ARG 87 1HH1 ARG 87 -2.781 -14.548 10.453 658 HH12 ARG 87 2HH1 ARG 87 -3.204 -16.094 11.110 659 HH21 ARG 87 1HH2 ARG 87 -2.929 -17.787 8.063 660 HH22 ARG 87 2HH2 ARG 87 -3.287 -17.935 9.750 661 H VAL 88 H VAL 88 -3.406 -9.718 7.116 662 HA VAL 88 HA VAL 88 -1.817 -7.303 7.388 663 HB VAL 88 HB VAL 88 -4.587 -7.095 6.216 664 HG11 VAL 88 1HG1 VAL 88 -3.934 -4.774 5.791 665 HG12 VAL 88 2HG1 VAL 88 -3.843 -5.166 7.509 666 HG13 VAL 88 3HG1 VAL 88 -2.369 -5.078 6.544 667 HG21 VAL 88 1HG2 VAL 88 -1.942 -6.864 4.785 668 HG22 VAL 88 2HG2 VAL 88 -3.100 -8.181 4.600 669 HG23 VAL 88 3HG2 VAL 88 -3.529 -6.550 4.085 670 H TYR 89 H TYR 89 -1.880 -7.016 9.518 671 HA TYR 89 HA TYR 89 -4.275 -7.714 11.024 672 HB2 TYR 89 1HB TYR 89 -1.726 -6.616 12.189 673 HB3 TYR 89 2HB TYR 89 -2.939 -7.628 12.965 674 HD1 TYR 89 2HD TYR 89 -0.170 -7.607 10.524 675 HD2 TYR 89 1HD TYR 89 -2.852 -10.004 12.796 676 HE1 TYR 89 2HE TYR 89 1.150 -9.605 9.965 677 HE2 TYR 89 1HE TYR 89 -1.539 -12.009 12.244 678 HH TYR 89 HH TYR 89 0.581 -12.205 9.814 679 H ALA 90 H ALA 90 -4.827 -5.616 9.412 680 HA ALA 90 HA ALA 90 -5.018 -3.382 11.318 681 HB1 ALA 90 1HB ALA 90 -3.734 -2.163 9.970 682 HB2 ALA 90 2HB ALA 90 -3.782 -3.386 8.699 683 HB3 ALA 90 3HB ALA 90 -5.071 -2.188 8.819 684 H LEU 91 H LEU 91 -6.685 -1.706 10.250 685 HA LEU 91 HA LEU 91 -9.028 -3.267 9.379 686 HB2 LEU 91 1HB LEU 91 -8.999 -2.436 11.802 687 HB3 LEU 91 2HB LEU 91 -9.208 -0.826 11.117 688 HG LEU 91 HG LEU 91 -11.310 -1.680 10.025 689 HD11 LEU 91 1HD1 LEU 91 -11.426 -3.871 12.006 690 HD12 LEU 91 2HD1 LEU 91 -10.421 -4.138 10.582 691 HD13 LEU 91 3HD1 LEU 91 -12.132 -3.755 10.393 692 HD21 LEU 91 1HD2 LEU 91 -11.425 -1.927 13.014 693 HD22 LEU 91 2HD2 LEU 91 -12.624 -1.249 11.913 694 HD23 LEU 91 3HD2 LEU 91 -11.119 -0.382 12.219 695 HA PRO 92 HA PRO 92 -9.154 -0.437 5.993 696 HB2 PRO 92 1HB PRO 92 -11.683 -0.962 5.158 697 HB3 PRO 92 2HB PRO 92 -10.332 -2.068 4.883 698 HG2 PRO 92 1HG PRO 92 -12.453 -2.157 6.994 699 HG3 PRO 92 2HG PRO 92 -11.787 -3.481 6.020 700 HD2 PRO 92 1HD PRO 92 -11.015 -3.020 8.575 701 HD3 PRO 92 2HD PRO 92 -9.915 -3.685 7.350 702 H GLU 93 H GLU 93 -11.442 -0.378 8.619 703 HA GLU 93 HA GLU 93 -12.853 1.958 7.852 704 HB2 GLU 93 1HB GLU 93 -12.430 0.736 10.585 705 HB3 GLU 93 2HB GLU 93 -13.571 2.026 10.230 706 HG2 GLU 93 1HG GLU 93 -14.453 0.304 8.449 707 HG3 GLU 93 2HG GLU 93 -13.689 -0.857 9.532 708 H ASP 94 H ASP 94 -9.779 1.416 9.325 709 HA ASP 94 HA ASP 94 -9.558 4.171 10.251 710 HB2 ASP 94 1HB ASP 94 -7.771 1.756 10.493 711 HB3 ASP 94 2HB ASP 94 -7.234 3.368 10.959 712 H LEU 95 H LEU 95 -8.173 2.013 7.825 713 HA LEU 95 HA LEU 95 -6.155 3.633 6.833 714 HB2 LEU 95 1HB LEU 95 -6.323 1.380 6.098 715 HB3 LEU 95 2HB LEU 95 -7.945 1.641 5.462 716 HG LEU 95 HG LEU 95 -7.043 3.019 3.671 717 HD11 LEU 95 1HD1 LEU 95 -4.563 3.093 3.360 718 HD12 LEU 95 2HD1 LEU 95 -4.397 2.479 5.004 719 HD13 LEU 95 3HD1 LEU 95 -5.165 4.042 4.720 720 HD21 LEU 95 1HD2 LEU 95 -5.747 0.322 4.021 721 HD22 LEU 95 2HD2 LEU 95 -5.691 1.245 2.519 722 HD23 LEU 95 3HD2 LEU 95 -7.241 0.702 3.165 723 H VAL 96 H VAL 96 -9.605 3.833 6.379 724 HA VAL 96 HA VAL 96 -9.676 5.481 4.105 725 HB VAL 96 HB VAL 96 -11.599 5.123 6.392 726 HG11 VAL 96 1HG1 VAL 96 -11.572 7.191 4.302 727 HG12 VAL 96 2HG1 VAL 96 -13.100 6.326 4.487 728 HG13 VAL 96 3HG1 VAL 96 -12.388 7.165 5.865 729 HG21 VAL 96 1HG2 VAL 96 -12.644 3.604 5.087 730 HG22 VAL 96 2HG2 VAL 96 -12.320 4.498 3.601 731 HG23 VAL 96 3HG2 VAL 96 -11.061 3.492 4.318 732 H GLU 97 H GLU 97 -9.230 6.200 7.513 733 HA GLU 97 HA GLU 97 -9.146 9.071 6.916 734 HB2 GLU 97 1HB GLU 97 -9.227 7.613 9.563 735 HB3 GLU 97 2HB GLU 97 -9.168 9.361 9.381 736 HG2 GLU 97 1HG GLU 97 -11.308 9.139 8.033 737 HG3 GLU 97 2HG GLU 97 -11.389 7.486 8.643 738 H VAL 98 H VAL 98 -7.030 7.407 6.007 739 HA VAL 98 HA VAL 98 -4.760 7.006 6.232 740 HB VAL 98 HB VAL 98 -4.814 9.964 6.831 741 HG11 VAL 98 1HG1 VAL 98 -2.621 10.039 6.283 742 HG12 VAL 98 2HG1 VAL 98 -2.665 8.354 6.807 743 HG13 VAL 98 3HG1 VAL 98 -2.763 8.749 5.090 744 HG21 VAL 98 1HG2 VAL 98 -5.658 8.480 4.474 745 HG22 VAL 98 2HG2 VAL 98 -5.916 10.173 4.898 746 HG23 VAL 98 3HG2 VAL 98 -4.412 9.677 4.122 747 H ASN 99 H ASN 99 -5.697 6.064 8.515 748 HA ASN 99 HA ASN 99 -4.508 7.410 10.786 749 HB2 ASN 99 1HB ASN 99 -6.277 5.050 10.380 750 HB3 ASN 99 2HB ASN 99 -5.284 5.075 11.834 751 HD21 ASN 99 1HD2 ASN 99 -8.016 5.104 11.982 752 HD22 ASN 99 2HD2 ASN 99 -8.549 6.639 12.569 753 HA PRO 100 HA PRO 100 -0.628 5.301 10.028 754 HB2 PRO 100 1HB PRO 100 0.722 6.557 12.021 755 HB3 PRO 100 2HB PRO 100 0.391 7.315 10.459 756 HG2 PRO 100 1HG PRO 100 -1.050 7.636 13.063 757 HG3 PRO 100 2HG PRO 100 -0.586 8.874 11.881 758 HD2 PRO 100 1HD PRO 100 -3.100 7.880 12.039 759 HD3 PRO 100 2HD PRO 100 -2.378 8.412 10.507 760 H LYS 101 H LYS 101 -2.786 5.046 12.584 761 HA LYS 101 HA LYS 101 -1.169 3.518 14.391 762 HB2 LYS 101 1HB LYS 101 -4.168 3.840 14.185 763 HB3 LYS 101 2HB LYS 101 -3.343 3.005 15.495 764 HG2 LYS 101 1HG LYS 101 -2.544 4.942 16.414 765 HG3 LYS 101 2HG LYS 101 -2.569 5.811 14.878 766 HD2 LYS 101 1HD LYS 101 -5.003 5.912 14.962 767 HD3 LYS 101 2HD LYS 101 -5.001 5.002 16.476 768 HE2 LYS 101 1HE LYS 101 -5.260 7.296 17.041 769 HE3 LYS 101 2HE LYS 101 -3.610 6.845 17.463 770 HZ1 LYS 101 1HZ LYS 101 -3.102 8.691 16.325 771 HZ2 LYS 101 2HZ LYS 101 -4.562 8.716 15.472 772 HZ3 LYS 101 3HZ LYS 101 -3.297 7.718 14.955 773 H MET 102 H MET 102 -3.224 2.822 11.660 774 HA MET 102 HA MET 102 -2.946 -0.060 12.145 775 HB2 MET 102 1HB MET 102 -4.898 1.618 10.652 776 HB3 MET 102 2HB MET 102 -4.575 0.005 10.032 777 HG2 MET 102 1HG MET 102 -6.506 0.002 11.491 778 HG3 MET 102 2HG MET 102 -5.197 -0.957 12.180 779 HE1 MET 102 1HE MET 102 -4.515 0.287 15.430 780 HE2 MET 102 2HE MET 102 -5.966 -0.657 15.098 781 HE3 MET 102 3HE MET 102 -4.492 -0.954 14.177 782 H VAL 103 H VAL 103 -2.426 2.427 9.676 783 HA VAL 103 HA VAL 103 -1.499 0.932 7.575 784 HB VAL 103 HB VAL 103 -0.280 3.543 8.482 785 HG11 VAL 103 1HG1 VAL 103 0.555 1.916 6.468 786 HG12 VAL 103 2HG1 VAL 103 -0.582 2.967 5.622 787 HG13 VAL 103 3HG1 VAL 103 0.777 3.665 6.504 788 HG21 VAL 103 1HG2 VAL 103 -2.947 2.986 7.754 789 HG22 VAL 103 2HG2 VAL 103 -2.195 4.562 8.004 790 HG23 VAL 103 3HG2 VAL 103 -2.210 3.838 6.396 791 H MET 104 H MET 104 0.251 1.884 10.489 792 HA MET 104 HA MET 104 2.832 1.365 9.986 793 HB2 MET 104 1HB MET 104 2.953 0.299 12.293 794 HB3 MET 104 2HB MET 104 2.244 1.906 12.209 795 HG2 MET 104 1HG MET 104 0.726 0.902 13.557 796 HG3 MET 104 2HG MET 104 0.009 0.524 11.993 797 HE1 MET 104 1HE MET 104 -0.831 -1.827 14.536 798 HE2 MET 104 2HE MET 104 -1.379 -0.944 13.111 799 HE3 MET 104 3HE MET 104 -1.058 -2.675 13.006 800 H THR 105 H THR 105 0.284 -1.036 10.132 801 HA THR 105 HA THR 105 2.212 -3.197 9.703 802 HB THR 105 HB THR 105 -0.603 -3.077 10.640 803 HG1 THR 105 1HG THR 105 0.382 -3.942 12.295 804 HG21 THR 105 1HG2 THR 105 -0.926 -5.484 10.137 805 HG22 THR 105 2HG2 THR 105 0.532 -5.442 9.145 806 HG23 THR 105 3HG2 THR 105 -0.873 -4.480 8.688 807 H VAL 106 H VAL 106 -0.603 -1.683 8.178 808 HA VAL 106 HA VAL 106 -1.088 -3.257 6.028 809 HB VAL 106 HB VAL 106 -0.893 -0.242 6.001 810 HG11 VAL 106 1HG1 VAL 106 -2.810 -1.356 4.169 811 HG12 VAL 106 2HG1 VAL 106 -1.478 -0.241 3.857 812 HG13 VAL 106 3HG1 VAL 106 -1.196 -1.981 3.830 813 HG21 VAL 106 1HG2 VAL 106 -3.073 -0.160 6.723 814 HG22 VAL 106 2HG2 VAL 106 -3.447 -1.778 6.130 815 HG23 VAL 106 3HG2 VAL 106 -2.491 -1.577 7.598 816 H PHE 107 H PHE 107 1.342 -0.643 6.024 817 HA PHE 107 HA PHE 107 2.456 -1.496 3.527 818 HB2 PHE 107 1HB PHE 107 3.209 0.569 5.576 819 HB3 PHE 107 2HB PHE 107 4.307 0.177 4.256 820 HD1 PHE 107 2HD PHE 107 2.521 -0.201 2.000 821 HD2 PHE 107 1HD PHE 107 2.367 2.669 5.140 822 HE1 PHE 107 2HE PHE 107 1.299 1.342 0.525 823 HE2 PHE 107 1HE PHE 107 1.143 4.216 3.670 824 HZ PHE 107 HZ PHE 107 0.608 3.554 1.359 825 H ALA 108 H ALA 108 3.688 -1.479 6.873 826 HA ALA 108 HA ALA 108 6.116 -2.597 6.663 827 HB1 ALA 108 1HB ALA 108 3.938 -3.110 8.649 828 HB2 ALA 108 2HB ALA 108 5.485 -3.945 8.781 829 HB3 ALA 108 3HB ALA 108 5.428 -2.183 8.835 830 H CYS 109 H CYS 109 3.179 -4.613 6.939 831 HA CYS 109 HA CYS 109 4.338 -7.075 6.501 832 HB2 CYS 109 1HB CYS 109 1.885 -6.443 7.071 833 HB3 CYS 109 2HB CYS 109 1.652 -6.411 5.328 834 HG CYS 109 HG CYS 109 1.022 -8.894 5.271 835 H LEU 110 H LEU 110 3.344 -4.658 4.144 836 HA LEU 110 HA LEU 110 3.850 -6.341 1.875 837 HB2 LEU 110 1HB LEU 110 3.501 -3.351 2.053 838 HB3 LEU 110 2HB LEU 110 3.516 -4.294 0.564 839 HG LEU 110 HG LEU 110 1.461 -4.640 2.741 840 HD11 LEU 110 1HD1 LEU 110 0.796 -3.310 0.179 841 HD12 LEU 110 2HD1 LEU 110 1.659 -2.362 1.389 842 HD13 LEU 110 3HD1 LEU 110 0.104 -3.092 1.787 843 HD21 LEU 110 1HD2 LEU 110 0.631 -5.361 0.102 844 HD22 LEU 110 2HD2 LEU 110 0.748 -6.368 1.546 845 HD23 LEU 110 3HD2 LEU 110 2.145 -6.182 0.485 846 H MET 111 H MET 111 5.696 -4.148 3.828 847 HA MET 111 HA MET 111 7.839 -3.880 1.909 848 HB2 MET 111 1HB MET 111 7.284 -2.867 4.655 849 HB3 MET 111 2HB MET 111 8.961 -2.941 4.132 850 HG2 MET 111 1HG MET 111 6.737 -1.472 2.734 851 HG3 MET 111 2HG MET 111 7.998 -0.748 3.729 852 HE1 MET 111 1HE MET 111 10.454 -2.836 2.636 853 HE2 MET 111 2HE MET 111 11.204 -1.623 1.599 854 HE3 MET 111 3HE MET 111 10.590 -1.166 3.189 855 H GLY 112 H GLY 112 6.898 -6.150 4.259 856 HA2 GLY 112 1HA GLY 112 9.230 -7.108 5.353 857 HA3 GLY 112 2HA GLY 112 7.870 -8.129 4.912 858 H LYS 113 H LYS 113 8.357 -7.108 2.040 859 HA LYS 113 HA LYS 113 9.947 -9.342 1.233 860 HB2 LYS 113 1HB LYS 113 8.784 -7.025 -0.317 861 HB3 LYS 113 2HB LYS 113 9.641 -8.366 -1.064 862 HG2 LYS 113 1HG LYS 113 7.971 -9.912 -0.431 863 HG3 LYS 113 2HG LYS 113 7.210 -8.752 0.659 864 HD2 LYS 113 1HD LYS 113 6.376 -7.464 -1.128 865 HD3 LYS 113 2HD LYS 113 7.436 -8.255 -2.297 866 HE2 LYS 113 1HE LYS 113 6.115 -10.121 -2.435 867 HE3 LYS 113 2HE LYS 113 5.489 -9.930 -0.798 868 HZ1 LYS 113 1HZ LYS 113 4.738 -8.279 -3.150 869 HZ2 LYS 113 2HZ LYS 113 4.154 -8.062 -1.577 870 HZ3 LYS 113 3HZ LYS 113 3.781 -9.475 -2.430 871 H GLY 114 H GLY 114 10.490 -5.897 1.615 872 HA2 GLY 114 1HA GLY 114 13.067 -5.963 0.310 873 HA3 GLY 114 2HA GLY 114 12.357 -4.596 1.156 874 H MET 115 H MET 115 12.894 -7.848 2.429 875 HA MET 115 HA MET 115 15.294 -7.284 3.791 876 HB2 MET 115 1HB MET 115 13.407 -5.862 4.978 877 HB3 MET 115 2HB MET 115 13.041 -7.400 5.748 878 HG2 MET 115 1HG MET 115 14.519 -6.066 7.127 879 HG3 MET 115 2HG MET 115 15.321 -7.537 6.586 880 HE1 MET 115 1HE MET 115 17.646 -7.286 4.629 881 HE2 MET 115 2HE MET 115 18.543 -6.295 5.780 882 HE3 MET 115 3HE MET 115 17.428 -7.532 6.362 883 H LYS 116 H LYS 116 15.872 -8.999 5.346 884 HA LYS 116 HA LYS 116 14.473 -11.506 4.687 885 HB2 LYS 116 1HB LYS 116 16.630 -12.629 5.173 886 HB3 LYS 116 2HB LYS 116 16.735 -11.492 3.837 887 HG2 LYS 116 1HG LYS 116 17.830 -9.872 5.216 888 HG3 LYS 116 2HG LYS 116 17.574 -10.859 6.656 889 HD2 LYS 116 1HD LYS 116 19.119 -11.892 4.297 890 HD3 LYS 116 2HD LYS 116 19.891 -10.920 5.552 891 HE2 LYS 116 1HE LYS 116 18.400 -13.507 5.987 892 HE3 LYS 116 2HE LYS 116 20.153 -13.320 5.971 893 HZ1 LYS 116 1HZ LYS 116 19.886 -11.751 7.860 894 HZ2 LYS 116 2HZ LYS 116 19.434 -13.340 8.221 895 HZ3 LYS 116 3HZ LYS 116 18.248 -12.169 7.932 896 H ARG 117 H ARG 117 13.326 -10.107 6.682 897 HA ARG 117 HA ARG 117 14.087 -11.647 9.071 898 HB2 ARG 117 1HB ARG 117 13.524 -9.728 10.482 899 HB3 ARG 117 2HB ARG 117 14.827 -9.333 9.369 900 HG2 ARG 117 1HG ARG 117 13.400 -8.034 8.007 901 HG3 ARG 117 2HG ARG 117 11.956 -8.650 8.813 902 HD2 ARG 117 1HD ARG 117 14.085 -6.929 10.081 903 HD3 ARG 117 2HD ARG 117 12.505 -6.371 9.532 904 HE ARG 117 HE ARG 117 12.080 -8.457 11.324 905 HH11 ARG 117 1HH1 ARG 117 13.396 -5.234 11.329 906 HH12 ARG 117 2HH1 ARG 117 12.975 -4.924 12.980 907 HH21 ARG 117 1HH2 ARG 117 11.520 -8.060 13.500 908 HH22 ARG 117 2HH2 ARG 117 11.909 -6.531 14.214 909 H VAL 118 H VAL 118 12.276 -11.750 10.688 910 HA VAL 118 HA VAL 118 9.714 -12.048 9.265 911 HB VAL 118 HB VAL 118 10.704 -14.148 10.154 912 HG11 VAL 118 1HG1 VAL 118 9.990 -13.551 12.928 913 HG12 VAL 118 2HG1 VAL 118 11.385 -14.412 12.273 914 HG13 VAL 118 3HG1 VAL 118 11.383 -12.649 12.332 915 HG21 VAL 118 1HG2 VAL 118 8.351 -14.119 9.829 916 HG22 VAL 118 2HG2 VAL 118 8.638 -14.870 11.399 917 HG23 VAL 118 3HG2 VAL 118 8.092 -13.195 11.309 918 H SER 119 H SER 119 7.999 -10.914 9.922 919 HA SER 119 HA SER 119 8.322 -9.120 12.197 920 HB2 SER 119 1HB SER 119 7.522 -7.987 10.282 921 HB3 SER 119 2HB SER 119 6.353 -9.256 9.918 922 HG SER 119 HG SER 119 6.074 -7.076 11.485 923 H GLY 120 H GLY 120 5.774 -11.299 10.964 924 HA2 GLY 120 1HA GLY 120 4.291 -12.653 12.082 925 HA3 GLY 120 2HA GLY 120 5.344 -12.528 13.483 926 HA PRO 121 HA PRO 121 1.323 -10.401 14.438 927 HB2 PRO 121 1HB PRO 121 0.962 -11.630 16.832 928 HB3 PRO 121 2HB PRO 121 0.406 -12.322 15.304 929 HG2 PRO 121 1HG PRO 121 2.873 -12.947 16.879 930 HG3 PRO 121 2HG PRO 121 1.753 -14.056 16.067 931 HD2 PRO 121 1HD PRO 121 4.129 -13.338 14.987 932 HD3 PRO 121 2HD PRO 121 2.701 -13.700 13.997 933 H SER 122 H SER 122 0.816 -9.538 16.865 934 HA SER 122 HA SER 122 3.297 -8.339 17.898 935 HB2 SER 122 1HB SER 122 1.868 -6.802 16.403 936 HB3 SER 122 2HB SER 122 0.715 -6.794 17.737 937 HG SER 122 HG SER 122 2.541 -6.097 19.065 938 H SER 123 H SER 123 3.538 -8.497 20.033 939 HA SER 123 HA SER 123 1.766 -9.968 21.630 940 HB2 SER 123 1HB SER 123 4.310 -9.417 21.942 941 HB3 SER 123 2HB SER 123 3.706 -8.031 22.848 942 HG SER 123 HG SER 123 2.334 -9.921 23.828 943 H GLY 124 H GLY 124 0.473 -9.329 23.419 944 HA2 GLY 124 1HA GLY 124 -0.308 -6.490 23.457 945 HA3 GLY 124 2HA GLY 124 -1.540 -7.730 23.272 Start of MODEL 16 1 H1 GLY 1 H GLY 1 10.872 20.088 -6.372 2 HA2 GLY 1 1HA GLY 1 11.721 17.305 -6.223 3 HA3 GLY 1 2HA GLY 1 12.760 18.718 -6.120 4 H SER 2 H SER 2 12.592 16.310 -4.413 5 HA SER 2 HA SER 2 12.045 17.660 -1.851 6 HB2 SER 2 1HB SER 2 10.416 15.950 -2.011 7 HB3 SER 2 2HB SER 2 11.577 14.794 -2.666 8 HG SER 2 HG SER 2 11.917 15.895 -0.094 9 H SER 3 H SER 3 13.498 17.341 -0.166 10 HA SER 3 HA SER 3 16.184 17.222 -0.760 11 HB2 SER 3 1HB SER 3 15.372 18.105 1.359 12 HB3 SER 3 2HB SER 3 14.820 16.503 1.846 13 HG SER 3 HG SER 3 17.172 15.943 1.471 14 H GLY 4 H GLY 4 14.224 14.594 0.653 15 HA2 GLY 4 1HA GLY 4 14.616 12.400 -0.568 16 HA3 GLY 4 2HA GLY 4 16.314 12.705 -0.228 17 H SER 5 H SER 5 13.724 10.974 0.751 18 HA SER 5 HA SER 5 13.592 11.150 3.503 19 HB2 SER 5 1HB SER 5 13.208 8.881 1.580 20 HB3 SER 5 2HB SER 5 13.139 8.576 3.315 21 HG SER 5 HG SER 5 11.135 9.182 3.063 22 H SER 6 H SER 6 14.441 9.547 5.106 23 HA SER 6 HA SER 6 16.949 8.269 4.561 24 HB2 SER 6 1HB SER 6 18.275 9.630 6.164 25 HB3 SER 6 2HB SER 6 17.766 10.554 4.751 26 HG SER 6 HG SER 6 16.124 11.470 5.999 27 H GLY 7 H GLY 7 17.153 6.569 5.875 28 HA2 GLY 7 1HA GLY 7 17.068 6.128 8.443 29 HA3 GLY 7 2HA GLY 7 15.352 6.411 8.188 30 H ASN 8 H ASN 8 16.552 4.009 9.184 31 HA ASN 8 HA ASN 8 16.719 2.037 7.152 32 HB2 ASN 8 1HB ASN 8 16.162 1.734 10.111 33 HB3 ASN 8 2HB ASN 8 16.579 0.418 9.018 34 HD21 ASN 8 1HD2 ASN 8 17.733 3.273 10.642 35 HD22 ASN 8 2HD2 ASN 8 19.417 2.955 10.428 36 H ASP 9 H ASP 9 14.130 2.980 9.391 37 HA ASP 9 HA ASP 9 12.270 1.147 8.123 38 HB2 ASP 9 1HB ASP 9 11.972 3.098 10.412 39 HB3 ASP 9 2HB ASP 9 10.650 2.106 9.801 40 H ASP 10 H ASP 10 13.346 4.293 7.633 41 HA ASP 10 HA ASP 10 10.903 5.472 6.725 42 HB2 ASP 10 1HB ASP 10 13.133 6.605 7.516 43 HB3 ASP 10 2HB ASP 10 13.595 6.429 5.825 44 H ILE 11 H ILE 11 12.873 3.106 5.447 45 HA ILE 11 HA ILE 11 12.790 3.795 2.684 46 HB ILE 11 HB ILE 11 14.399 2.161 3.743 47 HG12 ILE 11 1HG1 ILE 11 12.924 0.924 1.428 48 HG13 ILE 11 2HG1 ILE 11 13.836 2.416 1.242 49 HG21 ILE 11 1HG2 ILE 11 11.965 0.862 4.421 50 HG22 ILE 11 2HG2 ILE 11 12.882 -0.199 3.353 51 HG23 ILE 11 3HG2 ILE 11 13.614 0.401 4.841 52 HD11 ILE 11 1HD1 ILE 11 15.807 1.120 2.211 53 HD12 ILE 11 2HD1 ILE 11 14.843 -0.323 1.898 54 HD13 ILE 11 3HD1 ILE 11 15.299 0.738 0.566 55 H ILE 12 H ILE 12 10.443 2.677 4.840 56 HA ILE 12 HA ILE 12 8.889 0.976 3.258 57 HB ILE 12 HB ILE 12 7.979 2.922 5.380 58 HG12 ILE 12 1HG1 ILE 12 8.620 -0.033 5.527 59 HG13 ILE 12 2HG1 ILE 12 9.624 1.265 6.166 60 HG21 ILE 12 1HG2 ILE 12 5.942 1.681 5.511 61 HG22 ILE 12 2HG2 ILE 12 6.183 2.149 3.829 62 HG23 ILE 12 3HG2 ILE 12 6.525 0.497 4.342 63 HD11 ILE 12 1HD1 ILE 12 8.564 0.953 8.087 64 HD12 ILE 12 2HD1 ILE 12 7.160 1.706 7.328 65 HD13 ILE 12 3HD1 ILE 12 7.328 -0.051 7.328 66 H VAL 13 H VAL 13 9.212 4.448 3.260 67 HA VAL 13 HA VAL 13 6.898 4.854 1.565 68 HB VAL 13 HB VAL 13 9.040 6.830 2.361 69 HG11 VAL 13 1HG1 VAL 13 7.997 8.331 1.097 70 HG12 VAL 13 2HG1 VAL 13 7.035 7.013 0.425 71 HG13 VAL 13 3HG1 VAL 13 6.435 7.926 1.810 72 HG21 VAL 13 1HG2 VAL 13 7.327 5.602 4.071 73 HG22 VAL 13 2HG2 VAL 13 7.975 7.226 4.303 74 HG23 VAL 13 3HG2 VAL 13 6.377 7.008 3.589 75 H ASN 14 H ASN 14 10.426 5.211 1.258 76 HA ASN 14 HA ASN 14 10.534 6.011 -1.394 77 HB2 ASN 14 1HB ASN 14 12.573 6.142 -0.282 78 HB3 ASN 14 2HB ASN 14 12.428 4.519 0.387 79 HD21 ASN 14 1HD2 ASN 14 13.262 6.407 -2.410 80 HD22 ASN 14 2HD2 ASN 14 14.079 5.148 -3.266 81 H TRP 15 H TRP 15 10.618 2.710 -0.078 82 HA TRP 15 HA TRP 15 10.895 1.310 -2.454 83 HB2 TRP 15 1HB TRP 15 10.931 0.394 -0.080 84 HB3 TRP 15 2HB TRP 15 9.171 0.382 -0.156 85 HD1 TRP 15 HD TRP 15 12.230 -1.294 -1.793 86 HE1 TRP 15 1HE TRP 15 11.475 -3.540 -2.799 87 HE3 TRP 15 3HE TRP 15 7.197 -0.898 -0.984 88 HZ2 TRP 15 2HZ TRP 15 9.066 -4.956 -3.197 89 HZ3 TRP 15 3HZ TRP 15 5.737 -2.742 -1.708 90 HH2 TRP 15 HH TRP 15 6.655 -4.728 -2.791 91 H VAL 16 H VAL 16 7.956 2.529 -0.905 92 HA VAL 16 HA VAL 16 6.096 1.364 -2.656 93 HB VAL 16 HB VAL 16 5.860 3.963 -1.133 94 HG11 VAL 16 1HG1 VAL 16 3.646 2.202 -2.169 95 HG12 VAL 16 2HG1 VAL 16 3.499 3.789 -1.412 96 HG13 VAL 16 3HG1 VAL 16 4.231 3.637 -3.010 97 HG21 VAL 16 1HG2 VAL 16 4.442 1.616 -0.135 98 HG22 VAL 16 2HG2 VAL 16 6.196 1.442 -0.107 99 HG23 VAL 16 3HG2 VAL 16 5.431 2.793 0.727 100 H ASN 17 H ASN 17 7.448 4.665 -2.659 101 HA ASN 17 HA ASN 17 6.226 5.623 -4.940 102 HB2 ASN 17 1HB ASN 17 8.770 6.244 -3.523 103 HB3 ASN 17 2HB ASN 17 8.560 6.906 -5.141 104 HD21 ASN 17 1HD2 ASN 17 7.943 7.335 -1.889 105 HD22 ASN 17 2HD2 ASN 17 6.770 8.598 -2.007 106 H GLU 18 H GLU 18 9.470 4.144 -4.762 107 HA GLU 18 HA GLU 18 10.027 4.101 -7.473 108 HB2 GLU 18 1HB GLU 18 10.930 2.505 -5.130 109 HB3 GLU 18 2HB GLU 18 11.312 1.883 -6.729 110 HG2 GLU 18 1HG GLU 18 12.249 4.218 -7.202 111 HG3 GLU 18 2HG GLU 18 12.193 4.443 -5.454 112 H THR 19 H THR 19 8.684 1.419 -5.542 113 HA THR 19 HA THR 19 8.254 -0.438 -7.492 114 HB THR 19 HB THR 19 6.443 0.224 -5.165 115 HG1 THR 19 1HG THR 19 8.142 -2.013 -5.317 116 HG21 THR 19 1HG2 THR 19 6.343 -1.957 -7.202 117 HG22 THR 19 2HG2 THR 19 5.024 -1.068 -6.441 118 HG23 THR 19 3HG2 THR 19 5.883 -2.315 -5.538 119 H LEU 20 H LEU 20 6.248 2.374 -6.758 120 HA LEU 20 HA LEU 20 4.213 1.697 -8.655 121 HB2 LEU 20 1HB LEU 20 4.849 4.247 -7.186 122 HB3 LEU 20 2HB LEU 20 3.460 4.055 -8.254 123 HG LEU 20 HG LEU 20 3.835 2.216 -5.920 124 HD11 LEU 20 1HD1 LEU 20 2.521 3.727 -4.539 125 HD12 LEU 20 2HD1 LEU 20 2.533 4.934 -5.824 126 HD13 LEU 20 3HD1 LEU 20 4.040 4.483 -5.025 127 HD21 LEU 20 1HD2 LEU 20 2.082 1.440 -7.169 128 HD22 LEU 20 2HD2 LEU 20 1.639 3.045 -7.751 129 HD23 LEU 20 3HD2 LEU 20 1.232 2.560 -6.105 130 H ARG 21 H ARG 21 7.032 3.822 -8.632 131 HA ARG 21 HA ARG 21 6.569 5.127 -11.069 132 HB2 ARG 21 1HB ARG 21 8.315 5.652 -9.268 133 HB3 ARG 21 2HB ARG 21 9.307 4.420 -10.036 134 HG2 ARG 21 1HG ARG 21 10.097 6.260 -11.107 135 HG3 ARG 21 2HG ARG 21 8.773 5.841 -12.197 136 HD2 ARG 21 1HD ARG 21 8.255 7.669 -9.897 137 HD3 ARG 21 2HD ARG 21 9.068 8.296 -11.331 138 HE ARG 21 HE ARG 21 6.899 7.037 -12.346 139 HH11 ARG 21 1HH1 ARG 21 7.333 9.436 -9.860 140 HH12 ARG 21 2HH1 ARG 21 5.790 10.178 -10.126 141 HH21 ARG 21 1HH2 ARG 21 4.866 8.007 -12.705 142 HH22 ARG 21 2HH2 ARG 21 4.388 9.364 -11.744 143 H GLU 22 H GLU 22 8.457 2.197 -10.358 144 HA GLU 22 HA GLU 22 9.354 1.659 -12.933 145 HB2 GLU 22 1HB GLU 22 8.588 -0.340 -10.797 146 HB3 GLU 22 2HB GLU 22 9.605 -0.668 -12.193 147 HG2 GLU 22 1HG GLU 22 11.019 1.320 -11.202 148 HG3 GLU 22 2HG GLU 22 10.215 0.839 -9.709 149 H ALA 23 H ALA 23 6.252 1.008 -11.434 150 HA ALA 23 HA ALA 23 5.319 -0.537 -13.708 151 HB1 ALA 23 1HB ALA 23 3.125 -0.433 -12.357 152 HB2 ALA 23 2HB ALA 23 4.469 -1.379 -11.717 153 HB3 ALA 23 3HB ALA 23 4.132 0.225 -11.067 154 H GLU 24 H GLU 24 5.534 2.716 -12.856 155 HA GLU 24 HA GLU 24 4.849 4.605 -13.938 156 HB2 GLU 24 1HB GLU 24 3.256 2.887 -15.831 157 HB3 GLU 24 2HB GLU 24 3.908 4.496 -16.111 158 HG2 GLU 24 1HG GLU 24 6.060 3.717 -16.423 159 HG3 GLU 24 2HG GLU 24 5.747 2.209 -15.565 160 H LYS 25 H LYS 25 3.508 3.753 -11.688 161 HA LYS 25 HA LYS 25 0.655 3.927 -12.179 162 HB2 LYS 25 1HB LYS 25 2.390 3.377 -9.821 163 HB3 LYS 25 2HB LYS 25 0.779 4.016 -9.520 164 HG2 LYS 25 1HG LYS 25 1.070 1.486 -9.508 165 HG3 LYS 25 2HG LYS 25 -0.267 2.150 -10.450 166 HD2 LYS 25 1HD LYS 25 1.107 1.981 -12.484 167 HD3 LYS 25 2HD LYS 25 2.414 1.277 -11.529 168 HE2 LYS 25 1HE LYS 25 -0.344 0.109 -11.889 169 HE3 LYS 25 2HE LYS 25 1.124 -0.444 -12.694 170 HZ1 LYS 25 1HZ LYS 25 2.023 -1.172 -10.653 171 HZ2 LYS 25 2HZ LYS 25 0.433 -1.746 -10.688 172 HZ3 LYS 25 3HZ LYS 25 0.824 -0.397 -9.746 173 H SER 26 H SER 26 -0.701 5.558 -11.287 174 HA SER 26 HA SER 26 0.590 8.177 -11.247 175 HB2 SER 26 1HB SER 26 -2.260 7.265 -11.594 176 HB3 SER 26 2HB SER 26 -1.870 8.955 -11.278 177 HG SER 26 HG SER 26 -0.790 9.071 -13.183 178 H SER 27 H SER 27 0.221 6.007 -8.997 179 HA SER 27 HA SER 27 -0.930 7.777 -6.958 180 HB2 SER 27 1HB SER 27 -0.913 5.711 -5.524 181 HB3 SER 27 2HB SER 27 -1.932 5.588 -6.959 182 HG SER 27 HG SER 27 0.709 4.573 -6.697 183 H SER 28 H SER 28 0.161 7.966 -4.891 184 HA SER 28 HA SER 28 2.810 7.120 -4.451 185 HB2 SER 28 1HB SER 28 4.077 9.114 -4.846 186 HB3 SER 28 2HB SER 28 3.179 8.777 -6.326 187 HG SER 28 HG SER 28 2.442 10.634 -4.308 188 H ILE 29 H ILE 29 3.705 7.960 -2.472 189 HA ILE 29 HA ILE 29 1.738 9.381 -0.801 190 HB ILE 29 HB ILE 29 2.699 8.027 1.132 191 HG12 ILE 29 1HG1 ILE 29 3.382 5.939 -0.893 192 HG13 ILE 29 2HG1 ILE 29 4.572 7.187 -0.543 193 HG21 ILE 29 1HG2 ILE 29 0.892 7.008 -1.004 194 HG22 ILE 29 2HG2 ILE 29 1.324 5.937 0.328 195 HG23 ILE 29 3HG2 ILE 29 0.526 7.475 0.658 196 HD11 ILE 29 1HD1 ILE 29 5.011 5.263 0.813 197 HD12 ILE 29 2HD1 ILE 29 4.440 6.573 1.847 198 HD13 ILE 29 3HD1 ILE 29 3.353 5.254 1.411 199 H SER 30 H SER 30 2.494 11.005 0.451 200 HA SER 30 HA SER 30 5.174 11.933 -0.030 201 HB2 SER 30 1HB SER 30 3.258 13.496 0.107 202 HB3 SER 30 2HB SER 30 3.044 13.063 1.803 203 HG SER 30 HG SER 30 4.508 14.487 2.243 204 H SER 31 H SER 31 3.362 10.656 2.723 205 HA SER 31 HA SER 31 5.717 9.624 3.945 206 HB2 SER 31 1HB SER 31 5.715 12.155 4.497 207 HB3 SER 31 2HB SER 31 4.379 11.767 5.582 208 HG SER 31 HG SER 31 6.529 11.704 6.538 209 H PHE 32 H PHE 32 5.180 8.757 6.207 210 HA PHE 32 HA PHE 32 3.228 6.880 6.119 211 HB2 PHE 32 1HB PHE 32 4.405 8.340 8.472 212 HB3 PHE 32 2HB PHE 32 3.216 7.062 8.696 213 HD1 PHE 32 2HD PHE 32 3.831 4.930 7.059 214 HD2 PHE 32 1HD PHE 32 6.559 7.677 8.829 215 HE1 PHE 32 2HE PHE 32 5.617 3.244 6.915 216 HE2 PHE 32 1HE PHE 32 8.350 5.995 8.688 217 HZ PHE 32 HZ PHE 32 7.880 3.776 7.732 218 H LYS 33 H LYS 33 2.803 10.259 6.695 219 HA LYS 33 HA LYS 33 -0.031 9.821 7.363 220 HB2 LYS 33 1HB LYS 33 1.728 12.240 7.810 221 HB3 LYS 33 2HB LYS 33 0.007 12.181 8.165 222 HG2 LYS 33 1HG LYS 33 0.564 10.201 9.676 223 HG3 LYS 33 2HG LYS 33 2.246 10.713 9.511 224 HD2 LYS 33 1HD LYS 33 1.492 11.761 11.470 225 HD3 LYS 33 2HD LYS 33 1.431 13.022 10.238 226 HE2 LYS 33 1HE LYS 33 -0.968 12.603 9.945 227 HE3 LYS 33 2HE LYS 33 -0.899 11.359 11.191 228 HZ1 LYS 33 1HZ LYS 33 -0.855 14.259 11.456 229 HZ2 LYS 33 2HZ LYS 33 0.135 13.394 12.521 230 HZ3 LYS 33 3HZ LYS 33 -1.529 13.088 12.475 231 H ASP 34 H ASP 34 0.438 9.397 4.781 232 HA ASP 34 HA ASP 34 0.115 11.852 3.268 233 HB2 ASP 34 1HB ASP 34 1.462 10.310 2.131 234 HB3 ASP 34 2HB ASP 34 0.417 8.953 2.541 235 HA PRO 35 HA PRO 35 -4.292 11.809 3.345 236 HB2 PRO 35 1HB PRO 35 -4.737 13.414 1.202 237 HB3 PRO 35 2HB PRO 35 -4.166 14.027 2.758 238 HG2 PRO 35 1HG PRO 35 -2.607 13.415 0.276 239 HG3 PRO 35 2HG PRO 35 -2.471 14.804 1.369 240 HD2 PRO 35 1HD PRO 35 -0.764 12.704 1.462 241 HD3 PRO 35 2HD PRO 35 -1.217 13.631 2.907 242 H LYS 36 H LYS 36 -2.727 11.377 0.175 243 HA LYS 36 HA LYS 36 -4.817 10.301 -1.254 244 HB2 LYS 36 1HB LYS 36 -1.854 9.939 -1.356 245 HB3 LYS 36 2HB LYS 36 -2.862 8.888 -2.342 246 HG2 LYS 36 1HG LYS 36 -2.165 10.747 -3.669 247 HG3 LYS 36 2HG LYS 36 -3.894 10.907 -3.347 248 HD2 LYS 36 1HD LYS 36 -2.016 12.218 -1.459 249 HD3 LYS 36 2HD LYS 36 -2.199 12.938 -3.061 250 HE2 LYS 36 1HE LYS 36 -4.765 12.620 -2.516 251 HE3 LYS 36 2HE LYS 36 -4.177 12.664 -0.855 252 HZ1 LYS 36 1HZ LYS 36 -3.395 14.818 -1.104 253 HZ2 LYS 36 2HZ LYS 36 -4.856 14.851 -1.957 254 HZ3 LYS 36 3HZ LYS 36 -3.390 14.744 -2.794 255 H ILE 37 H ILE 37 -2.902 8.818 1.248 256 HA ILE 37 HA ILE 37 -3.399 6.123 0.774 257 HB ILE 37 HB ILE 37 -3.003 7.627 3.352 258 HG12 ILE 37 1HG1 ILE 37 -1.241 5.760 1.749 259 HG13 ILE 37 2HG1 ILE 37 -1.071 7.510 1.858 260 HG21 ILE 37 1HG2 ILE 37 -3.181 4.639 2.983 261 HG22 ILE 37 2HG2 ILE 37 -2.719 5.470 4.467 262 HG23 ILE 37 3HG2 ILE 37 -4.352 5.650 3.829 263 HD11 ILE 37 1HD1 ILE 37 -1.038 6.623 4.492 264 HD12 ILE 37 2HD1 ILE 37 -0.064 5.457 3.597 265 HD13 ILE 37 3HD1 ILE 37 0.333 7.173 3.530 266 H SER 38 H SER 38 -5.457 8.598 2.126 267 HA SER 38 HA SER 38 -7.379 7.001 3.377 268 HB2 SER 38 1HB SER 38 -7.576 9.283 3.833 269 HB3 SER 38 2HB SER 38 -7.448 9.735 2.134 270 HG SER 38 HG SER 38 -9.540 9.730 2.125 271 H THR 39 H THR 39 -6.869 7.771 0.011 272 HA THR 39 HA THR 39 -9.405 6.605 -0.796 273 HB THR 39 HB THR 39 -8.600 7.094 -3.119 274 HG1 THR 39 1HG THR 39 -6.712 8.717 -2.925 275 HG21 THR 39 1HG2 THR 39 -9.041 9.414 -3.000 276 HG22 THR 39 2HG2 THR 39 -8.394 9.531 -1.363 277 HG23 THR 39 3HG2 THR 39 -9.922 8.699 -1.650 278 H SER 40 H SER 40 -6.349 5.484 -0.043 279 HA SER 40 HA SER 40 -5.383 3.427 -0.201 280 HB2 SER 40 1HB SER 40 -7.823 2.486 -1.710 281 HB3 SER 40 2HB SER 40 -6.702 1.522 -0.749 282 HG SER 40 HG SER 40 -8.571 3.442 0.179 283 H LEU 41 H LEU 41 -5.227 5.513 -2.309 284 HA LEU 41 HA LEU 41 -5.068 4.247 -4.846 285 HB2 LEU 41 1HB LEU 41 -4.166 6.845 -3.701 286 HB3 LEU 41 2HB LEU 41 -3.513 6.331 -5.255 287 HG LEU 41 HG LEU 41 -6.430 6.771 -4.616 288 HD11 LEU 41 1HD1 LEU 41 -4.382 8.396 -6.096 289 HD12 LEU 41 2HD1 LEU 41 -5.411 8.886 -4.752 290 HD13 LEU 41 3HD1 LEU 41 -6.115 8.603 -6.343 291 HD21 LEU 41 1HD2 LEU 41 -5.987 6.670 -7.380 292 HD22 LEU 41 2HD2 LEU 41 -6.851 5.498 -6.385 293 HD23 LEU 41 3HD2 LEU 41 -5.129 5.284 -6.703 294 HA PRO 42 HA PRO 42 -0.309 4.151 -3.949 295 HB2 PRO 42 1HB PRO 42 0.454 4.520 -1.369 296 HB3 PRO 42 2HB PRO 42 0.288 5.850 -2.521 297 HG2 PRO 42 1HG PRO 42 -1.621 4.925 -0.410 298 HG3 PRO 42 2HG PRO 42 -1.158 6.578 -0.851 299 HD2 PRO 42 1HD PRO 42 -3.470 5.442 -1.683 300 HD3 PRO 42 2HD PRO 42 -2.584 6.629 -2.662 301 H VAL 43 H VAL 43 -2.592 2.937 -1.586 302 HA VAL 43 HA VAL 43 -0.970 0.645 -0.898 303 HB VAL 43 HB VAL 43 -3.893 0.974 -0.262 304 HG11 VAL 43 1HG1 VAL 43 -1.620 -0.446 1.121 305 HG12 VAL 43 2HG1 VAL 43 -3.272 -0.336 1.732 306 HG13 VAL 43 3HG1 VAL 43 -2.941 -1.197 0.228 307 HG21 VAL 43 1HG2 VAL 43 -2.174 1.824 1.879 308 HG22 VAL 43 2HG2 VAL 43 -1.884 2.798 0.438 309 HG23 VAL 43 3HG2 VAL 43 -3.510 2.682 1.111 310 H LEU 44 H LEU 44 -3.741 1.359 -2.946 311 HA LEU 44 HA LEU 44 -4.250 -1.382 -3.615 312 HB2 LEU 44 1HB LEU 44 -5.197 1.236 -4.748 313 HB3 LEU 44 2HB LEU 44 -5.661 -0.316 -5.443 314 HG LEU 44 HG LEU 44 -6.219 0.453 -2.583 315 HD11 LEU 44 1HD1 LEU 44 -8.345 1.196 -3.180 316 HD12 LEU 44 2HD1 LEU 44 -8.240 0.501 -4.796 317 HD13 LEU 44 3HD1 LEU 44 -7.291 1.929 -4.389 318 HD21 LEU 44 1HD2 LEU 44 -8.054 -1.346 -3.121 319 HD22 LEU 44 2HD2 LEU 44 -6.423 -1.830 -2.652 320 HD23 LEU 44 3HD2 LEU 44 -6.894 -1.847 -4.352 321 H ASP 45 H ASP 45 -2.892 1.380 -5.412 322 HA ASP 45 HA ASP 45 -2.200 -0.049 -7.722 323 HB2 ASP 45 1HB ASP 45 -1.087 2.487 -6.521 324 HB3 ASP 45 2HB ASP 45 -0.554 1.856 -8.077 325 H LEU 46 H LEU 46 -0.357 0.651 -4.780 326 HA LEU 46 HA LEU 46 2.135 -0.267 -5.494 327 HB2 LEU 46 1HB LEU 46 1.888 0.740 -3.384 328 HB3 LEU 46 2HB LEU 46 0.639 -0.402 -2.895 329 HG LEU 46 HG LEU 46 2.321 -2.172 -2.730 330 HD11 LEU 46 1HD1 LEU 46 4.385 -2.015 -3.550 331 HD12 LEU 46 2HD1 LEU 46 4.641 -0.427 -2.828 332 HD13 LEU 46 3HD1 LEU 46 3.828 -0.565 -4.387 333 HD21 LEU 46 1HD2 LEU 46 3.218 -1.497 -0.689 334 HD22 LEU 46 2HD2 LEU 46 1.772 -0.501 -0.854 335 HD23 LEU 46 3HD2 LEU 46 3.362 0.185 -1.196 336 H ILE 47 H ILE 47 -0.646 -2.157 -4.381 337 HA ILE 47 HA ILE 47 0.612 -4.651 -4.220 338 HB ILE 47 HB ILE 47 -2.260 -4.069 -4.950 339 HG12 ILE 47 1HG1 ILE 47 -1.244 -4.860 -2.234 340 HG13 ILE 47 2HG1 ILE 47 -1.254 -3.172 -2.734 341 HG21 ILE 47 1HG2 ILE 47 -1.196 -6.416 -5.360 342 HG22 ILE 47 2HG2 ILE 47 -1.334 -6.567 -3.608 343 HG23 ILE 47 3HG2 ILE 47 -2.775 -6.285 -4.585 344 HD11 ILE 47 1HD1 ILE 47 -3.385 -3.006 -2.188 345 HD12 ILE 47 2HD1 ILE 47 -3.799 -4.317 -3.294 346 HD13 ILE 47 3HD1 ILE 47 -3.353 -4.677 -1.626 347 H ASP 48 H ASP 48 -1.492 -3.481 -6.856 348 HA ASP 48 HA ASP 48 -1.226 -5.440 -8.688 349 HB2 ASP 48 1HB ASP 48 -2.497 -3.310 -9.000 350 HB3 ASP 48 2HB ASP 48 -0.976 -2.509 -9.388 351 H ALA 49 H ALA 49 1.072 -2.729 -8.394 352 HA ALA 49 HA ALA 49 2.889 -3.364 -10.318 353 HB1 ALA 49 1HB ALA 49 4.629 -2.480 -8.592 354 HB2 ALA 49 2HB ALA 49 3.367 -1.407 -9.196 355 HB3 ALA 49 3HB ALA 49 3.203 -2.153 -7.607 356 H ILE 50 H ILE 50 2.566 -4.866 -7.142 357 HA ILE 50 HA ILE 50 4.911 -6.430 -7.246 358 HB ILE 50 HB ILE 50 2.373 -7.171 -5.796 359 HG12 ILE 50 1HG1 ILE 50 2.924 -4.856 -5.263 360 HG13 ILE 50 2HG1 ILE 50 3.280 -5.893 -3.886 361 HG21 ILE 50 1HG2 ILE 50 3.561 -8.778 -4.817 362 HG22 ILE 50 2HG2 ILE 50 4.802 -8.480 -6.032 363 HG23 ILE 50 3HG2 ILE 50 4.893 -7.676 -4.466 364 HD11 ILE 50 1HD1 ILE 50 5.611 -5.781 -4.308 365 HD12 ILE 50 2HD1 ILE 50 5.353 -4.994 -5.865 366 HD13 ILE 50 3HD1 ILE 50 4.983 -4.135 -4.369 367 H GLN 51 H GLN 51 1.519 -7.390 -7.811 368 HA GLN 51 HA GLN 51 2.520 -9.474 -9.635 369 HB2 GLN 51 1HB GLN 51 1.682 -10.340 -7.403 370 HB3 GLN 51 2HB GLN 51 0.084 -9.780 -7.882 371 HG2 GLN 51 1HG GLN 51 0.159 -11.254 -9.834 372 HG3 GLN 51 2HG GLN 51 1.749 -11.827 -9.331 373 HE21 GLN 51 1HE2 GLN 51 -1.567 -11.486 -8.135 374 HE22 GLN 51 2HE2 GLN 51 -1.579 -12.959 -7.234 375 HA PRO 52 HA PRO 52 -0.147 -7.163 -12.385 376 HB2 PRO 52 1HB PRO 52 0.519 -8.566 -14.611 377 HB3 PRO 52 2HB PRO 52 1.552 -7.307 -13.924 378 HG2 PRO 52 1HG PRO 52 1.740 -10.281 -13.633 379 HG3 PRO 52 2HG PRO 52 3.034 -9.100 -13.910 380 HD2 PRO 52 1HD PRO 52 2.514 -10.142 -11.467 381 HD3 PRO 52 2HD PRO 52 3.127 -8.492 -11.690 382 H GLY 53 H GLY 53 -2.270 -7.513 -12.509 383 HA2 GLY 53 1HA GLY 53 -4.067 -8.754 -13.567 384 HA3 GLY 53 2HA GLY 53 -3.202 -10.233 -13.173 385 H SER 54 H SER 54 -3.714 -7.505 -11.002 386 HA SER 54 HA SER 54 -5.526 -9.194 -9.407 387 HB2 SER 54 1HB SER 54 -4.480 -8.133 -7.371 388 HB3 SER 54 2HB SER 54 -3.413 -9.218 -8.264 389 HG SER 54 HG SER 54 -2.150 -7.510 -8.096 390 H ILE 55 H ILE 55 -4.311 -5.839 -9.515 391 HA ILE 55 HA ILE 55 -6.862 -4.817 -8.635 392 HB ILE 55 HB ILE 55 -4.434 -3.295 -9.587 393 HG12 ILE 55 1HG1 ILE 55 -4.041 -4.784 -7.605 394 HG13 ILE 55 2HG1 ILE 55 -3.808 -3.070 -7.278 395 HG21 ILE 55 1HG2 ILE 55 -5.934 -1.821 -7.724 396 HG22 ILE 55 2HG2 ILE 55 -5.728 -1.497 -9.444 397 HG23 ILE 55 3HG2 ILE 55 -7.086 -2.474 -8.887 398 HD11 ILE 55 1HD1 ILE 55 -5.656 -2.937 -5.936 399 HD12 ILE 55 2HD1 ILE 55 -6.457 -4.302 -6.718 400 HD13 ILE 55 3HD1 ILE 55 -5.116 -4.584 -5.608 401 H ASN 56 H ASN 56 -8.342 -3.670 -9.819 402 HA ASN 56 HA ASN 56 -7.869 -3.476 -12.717 403 HB2 ASN 56 1HB ASN 56 -9.500 -5.339 -11.787 404 HB3 ASN 56 2HB ASN 56 -10.629 -3.990 -11.694 405 HD21 ASN 56 1HD2 ASN 56 -11.138 -2.855 -13.632 406 HD22 ASN 56 2HD2 ASN 56 -11.008 -3.642 -15.163 407 H TYR 57 H TYR 57 -7.315 -1.272 -12.405 408 HA TYR 57 HA TYR 57 -8.588 0.698 -11.053 409 HB2 TYR 57 1HB TYR 57 -7.537 0.903 -13.882 410 HB3 TYR 57 2HB TYR 57 -7.857 2.266 -12.818 411 HD1 TYR 57 2HD TYR 57 -6.722 1.618 -10.303 412 HD2 TYR 57 1HD TYR 57 -5.273 0.602 -14.172 413 HE1 TYR 57 2HE TYR 57 -4.441 1.449 -9.398 414 HE2 TYR 57 1HE TYR 57 -2.988 0.429 -13.278 415 HH TYR 57 HH TYR 57 -2.167 -0.043 -10.409 416 H ASP 58 H ASP 58 -9.602 -0.691 -14.139 417 HA ASP 58 HA ASP 58 -11.625 1.013 -14.874 418 HB2 ASP 58 1HB ASP 58 -10.742 -1.247 -15.920 419 HB3 ASP 58 2HB ASP 58 -12.129 -1.926 -15.071 420 H LEU 59 H LEU 59 -11.759 -1.603 -12.497 421 HA LEU 59 HA LEU 59 -14.540 -1.049 -11.893 422 HB2 LEU 59 1HB LEU 59 -12.685 -2.886 -10.402 423 HB3 LEU 59 2HB LEU 59 -14.446 -2.916 -10.431 424 HG LEU 59 HG LEU 59 -12.642 -3.610 -12.748 425 HD11 LEU 59 1HD1 LEU 59 -12.525 -5.272 -10.976 426 HD12 LEU 59 2HD1 LEU 59 -13.408 -5.902 -12.367 427 HD13 LEU 59 3HD1 LEU 59 -14.286 -5.369 -10.933 428 HD21 LEU 59 1HD2 LEU 59 -15.489 -3.042 -12.533 429 HD22 LEU 59 2HD2 LEU 59 -15.153 -4.627 -13.231 430 HD23 LEU 59 3HD2 LEU 59 -14.464 -3.176 -13.962 431 H LEU 60 H LEU 60 -11.394 -0.272 -10.657 432 HA LEU 60 HA LEU 60 -12.142 0.461 -8.031 433 HB2 LEU 60 1HB LEU 60 -9.859 1.475 -9.720 434 HB3 LEU 60 2HB LEU 60 -10.016 1.673 -7.975 435 HG LEU 60 HG LEU 60 -9.679 -0.957 -9.417 436 HD11 LEU 60 1HD1 LEU 60 -7.784 1.021 -8.427 437 HD12 LEU 60 2HD1 LEU 60 -7.535 -0.351 -9.507 438 HD13 LEU 60 3HD1 LEU 60 -7.523 -0.592 -7.760 439 HD21 LEU 60 1HD2 LEU 60 -10.990 -1.097 -7.331 440 HD22 LEU 60 2HD2 LEU 60 -9.656 -0.335 -6.465 441 HD23 LEU 60 3HD2 LEU 60 -9.433 -1.917 -7.213 442 H LYS 61 H LYS 61 -12.515 2.507 -7.130 443 HA LYS 61 HA LYS 61 -13.987 4.295 -8.841 444 HB2 LYS 61 1HB LYS 61 -13.286 4.752 -5.944 445 HB3 LYS 61 2HB LYS 61 -14.638 5.422 -6.848 446 HG2 LYS 61 1HG LYS 61 -14.409 2.468 -6.494 447 HG3 LYS 61 2HG LYS 61 -15.029 3.473 -5.182 448 HD2 LYS 61 1HD LYS 61 -16.716 4.396 -6.739 449 HD3 LYS 61 2HD LYS 61 -16.127 3.296 -7.988 450 HE2 LYS 61 1HE LYS 61 -18.016 2.242 -7.053 451 HE3 LYS 61 2HE LYS 61 -16.620 1.414 -6.363 452 HZ1 LYS 61 1HZ LYS 61 -18.098 3.598 -5.002 453 HZ2 LYS 61 2HZ LYS 61 -16.873 2.636 -4.343 454 HZ3 LYS 61 3HZ LYS 61 -18.371 1.951 -4.726 455 H THR 62 H THR 62 -11.466 5.035 -6.435 456 HA THR 62 HA THR 62 -9.945 6.748 -6.365 457 HB THR 62 HB THR 62 -8.777 5.094 -7.769 458 HG1 THR 62 1HG THR 62 -8.207 7.627 -8.883 459 HG21 THR 62 1HG2 THR 62 -10.063 6.622 -10.031 460 HG22 THR 62 2HG2 THR 62 -10.237 4.908 -9.655 461 HG23 THR 62 3HG2 THR 62 -8.696 5.530 -10.241 462 H GLU 63 H GLU 63 -12.581 7.614 -7.062 463 HA GLU 63 HA GLU 63 -11.898 9.974 -8.683 464 HB2 GLU 63 1HB GLU 63 -14.358 9.946 -9.382 465 HB3 GLU 63 2HB GLU 63 -13.299 8.754 -10.122 466 HG2 GLU 63 1HG GLU 63 -14.102 7.182 -8.260 467 HG3 GLU 63 2HG GLU 63 -15.393 8.358 -8.023 468 H ASN 64 H ASN 64 -11.447 11.013 -6.655 469 HA ASN 64 HA ASN 64 -11.937 12.220 -4.780 470 HB2 ASN 64 1HB ASN 64 -13.814 13.754 -5.013 471 HB3 ASN 64 2HB ASN 64 -12.967 13.609 -6.550 472 HD21 ASN 64 1HD2 ASN 64 -13.958 12.567 -8.265 473 HD22 ASN 64 2HD2 ASN 64 -15.651 12.219 -8.281 474 H LEU 65 H LEU 65 -12.455 9.539 -4.394 475 HA LEU 65 HA LEU 65 -14.885 8.647 -3.594 476 HB2 LEU 65 1HB LEU 65 -12.315 8.282 -2.062 477 HB3 LEU 65 2HB LEU 65 -13.750 7.269 -1.925 478 HG LEU 65 HG LEU 65 -13.256 7.019 -4.560 479 HD11 LEU 65 1HD1 LEU 65 -10.628 6.528 -4.368 480 HD12 LEU 65 2HD1 LEU 65 -10.747 7.924 -3.298 481 HD13 LEU 65 3HD1 LEU 65 -11.289 8.049 -4.971 482 HD21 LEU 65 1HD2 LEU 65 -13.402 5.353 -2.518 483 HD22 LEU 65 2HD2 LEU 65 -11.653 5.297 -2.742 484 HD23 LEU 65 3HD2 LEU 65 -12.726 4.852 -4.069 485 H ASN 66 H ASN 66 -15.723 8.354 -1.316 486 HA ASN 66 HA ASN 66 -15.322 10.764 0.314 487 HB2 ASN 66 1HB ASN 66 -17.941 10.399 0.732 488 HB3 ASN 66 2HB ASN 66 -17.327 11.433 -0.554 489 HD21 ASN 66 1HD2 ASN 66 -19.201 8.738 0.216 490 HD22 ASN 66 2HD2 ASN 66 -19.515 8.187 -1.391 491 H ASP 67 H ASP 67 -16.635 10.438 2.473 492 HA ASP 67 HA ASP 67 -15.413 8.607 4.043 493 HB2 ASP 67 1HB ASP 67 -18.296 9.481 4.340 494 HB3 ASP 67 2HB ASP 67 -17.289 8.806 5.617 495 H ASP 68 H ASP 68 -17.915 7.976 1.752 496 HA ASP 68 HA ASP 68 -18.438 5.313 2.815 497 HB2 ASP 68 1HB ASP 68 -19.634 6.922 0.566 498 HB3 ASP 68 2HB ASP 68 -19.999 5.213 0.781 499 H GLU 69 H GLU 69 -17.834 6.467 -0.502 500 HA GLU 69 HA GLU 69 -16.953 4.108 -1.585 501 HB2 GLU 69 1HB GLU 69 -15.692 6.743 -2.315 502 HB3 GLU 69 2HB GLU 69 -16.014 5.364 -3.357 503 HG2 GLU 69 1HG GLU 69 -18.504 5.854 -2.741 504 HG3 GLU 69 2HG GLU 69 -17.877 7.455 -2.350 505 H LYS 70 H LYS 70 -14.923 6.626 -0.097 506 HA LYS 70 HA LYS 70 -12.429 5.605 -0.414 507 HB2 LYS 70 1HB LYS 70 -13.577 6.841 2.096 508 HB3 LYS 70 2HB LYS 70 -11.859 6.610 1.798 509 HG2 LYS 70 1HG LYS 70 -11.960 8.102 -0.108 510 HG3 LYS 70 2HG LYS 70 -13.701 8.294 0.112 511 HD2 LYS 70 1HD LYS 70 -13.449 9.566 2.027 512 HD3 LYS 70 2HD LYS 70 -11.843 8.922 2.369 513 HE2 LYS 70 1HE LYS 70 -10.843 10.249 0.701 514 HE3 LYS 70 2HE LYS 70 -12.397 10.627 -0.043 515 HZ1 LYS 70 1HZ LYS 70 -11.048 12.156 1.788 516 HZ2 LYS 70 2HZ LYS 70 -12.305 11.461 2.681 517 HZ3 LYS 70 3HZ LYS 70 -12.653 12.364 1.294 518 H LEU 71 H LEU 71 -14.739 4.641 2.107 519 HA LEU 71 HA LEU 71 -13.102 2.784 3.412 520 HB2 LEU 71 1HB LEU 71 -15.128 3.551 4.431 521 HB3 LEU 71 2HB LEU 71 -16.095 2.909 3.104 522 HG LEU 71 HG LEU 71 -15.446 0.617 3.810 523 HD11 LEU 71 1HD1 LEU 71 -13.573 0.544 5.048 524 HD12 LEU 71 2HD1 LEU 71 -14.679 0.805 6.396 525 HD13 LEU 71 3HD1 LEU 71 -13.808 2.168 5.694 526 HD21 LEU 71 1HD2 LEU 71 -16.780 2.311 5.921 527 HD22 LEU 71 2HD2 LEU 71 -16.897 0.556 5.778 528 HD23 LEU 71 3HD2 LEU 71 -17.566 1.591 4.515 529 H ASN 72 H ASN 72 -15.745 2.069 1.120 530 HA ASN 72 HA ASN 72 -15.494 -0.575 0.748 531 HB2 ASN 72 1HB ASN 72 -15.760 1.435 -1.499 532 HB3 ASN 72 2HB ASN 72 -16.192 -0.269 -1.595 533 HD21 ASN 72 1HD2 ASN 72 -16.945 2.773 -0.014 534 HD22 ASN 72 2HD2 ASN 72 -18.584 2.382 0.368 535 H ASN 73 H ASN 73 -13.382 1.852 -0.741 536 HA ASN 73 HA ASN 73 -11.806 0.031 -2.215 537 HB2 ASN 73 1HB ASN 73 -11.584 2.881 -1.403 538 HB3 ASN 73 2HB ASN 73 -10.095 2.070 -1.882 539 HD21 ASN 73 1HD2 ASN 73 -10.518 3.964 -3.478 540 HD22 ASN 73 2HD2 ASN 73 -11.286 3.505 -4.957 541 H ALA 74 H ALA 74 -11.525 1.352 1.043 542 HA ALA 74 HA ALA 74 -8.960 0.490 1.685 543 HB1 ALA 74 1HB ALA 74 -9.819 0.455 4.058 544 HB2 ALA 74 2HB ALA 74 -10.059 1.963 3.175 545 HB3 ALA 74 3HB ALA 74 -11.407 0.848 3.398 546 H LYS 75 H LYS 75 -12.033 -1.250 1.807 547 HA LYS 75 HA LYS 75 -11.074 -3.570 3.090 548 HB2 LYS 75 1HB LYS 75 -13.437 -3.030 1.307 549 HB3 LYS 75 2HB LYS 75 -13.105 -4.642 1.926 550 HG2 LYS 75 1HG LYS 75 -14.483 -3.958 3.571 551 HG3 LYS 75 2HG LYS 75 -12.989 -3.277 4.219 552 HD2 LYS 75 1HD LYS 75 -14.321 -1.428 4.340 553 HD3 LYS 75 2HD LYS 75 -13.704 -1.226 2.698 554 HE2 LYS 75 1HE LYS 75 -16.065 -0.874 2.643 555 HE3 LYS 75 2HE LYS 75 -15.732 -2.423 1.871 556 HZ1 LYS 75 1HZ LYS 75 -17.424 -3.030 3.229 557 HZ2 LYS 75 2HZ LYS 75 -17.082 -1.859 4.399 558 HZ3 LYS 75 3HZ LYS 75 -16.151 -3.269 4.316 559 H TYR 76 H TYR 76 -11.342 -2.685 -0.323 560 HA TYR 76 HA TYR 76 -10.638 -5.140 -1.447 561 HB2 TYR 76 1HB TYR 76 -11.488 -3.006 -2.604 562 HB3 TYR 76 2HB TYR 76 -9.804 -2.495 -2.624 563 HD1 TYR 76 1HD TYR 76 -11.527 -5.745 -3.315 564 HD2 TYR 76 2HD TYR 76 -8.906 -2.708 -4.733 565 HE1 TYR 76 1HE TYR 76 -11.168 -7.029 -5.382 566 HE2 TYR 76 2HE TYR 76 -8.541 -3.983 -6.805 567 HH TYR 76 HH TYR 76 -10.474 -6.610 -7.712 568 H ALA 77 H ALA 77 -8.570 -2.384 -0.562 569 HA ALA 77 HA ALA 77 -6.124 -3.380 -1.384 570 HB1 ALA 77 1HB ALA 77 -7.012 -1.174 0.062 571 HB2 ALA 77 2HB ALA 77 -5.866 -1.985 1.130 572 HB3 ALA 77 3HB ALA 77 -5.365 -1.492 -0.487 573 H ILE 78 H ILE 78 -7.343 -3.501 1.970 574 HA ILE 78 HA ILE 78 -5.401 -5.277 2.918 575 HB ILE 78 HB ILE 78 -8.213 -4.835 3.926 576 HG12 ILE 78 1HG1 ILE 78 -5.649 -3.741 5.073 577 HG13 ILE 78 2HG1 ILE 78 -6.545 -2.883 3.823 578 HG21 ILE 78 1HG2 ILE 78 -6.539 -5.614 6.028 579 HG22 ILE 78 2HG2 ILE 78 -7.855 -6.539 5.305 580 HG23 ILE 78 3HG2 ILE 78 -6.207 -6.739 4.711 581 HD11 ILE 78 1HD1 ILE 78 -6.905 -2.423 6.403 582 HD12 ILE 78 2HD1 ILE 78 -8.220 -2.305 5.234 583 HD13 ILE 78 3HD1 ILE 78 -8.045 -3.756 6.221 584 H SER 79 H SER 79 -8.415 -5.838 1.247 585 HA SER 79 HA SER 79 -8.601 -8.620 1.839 586 HB2 SER 79 1HB SER 79 -9.935 -6.771 -0.106 587 HB3 SER 79 2HB SER 79 -10.122 -8.514 -0.301 588 HG SER 79 HG SER 79 -10.498 -7.869 2.266 589 H MET 80 H MET 80 -6.945 -6.730 -0.567 590 HA MET 80 HA MET 80 -6.380 -8.985 -2.278 591 HB2 MET 80 1HB MET 80 -6.633 -6.658 -3.142 592 HB3 MET 80 2HB MET 80 -5.149 -6.225 -2.305 593 HG2 MET 80 1HG MET 80 -4.743 -6.635 -4.662 594 HG3 MET 80 2HG MET 80 -3.903 -7.813 -3.656 595 HE1 MET 80 1HE MET 80 -7.662 -8.487 -6.153 596 HE2 MET 80 2HE MET 80 -7.948 -8.377 -4.416 597 HE3 MET 80 3HE MET 80 -7.193 -7.032 -5.272 598 H ALA 81 H ALA 81 -4.623 -7.018 0.083 599 HA ALA 81 HA ALA 81 -2.061 -7.893 -0.187 600 HB1 ALA 81 1HB ALA 81 -1.725 -6.846 1.752 601 HB2 ALA 81 2HB ALA 81 -3.453 -6.494 1.731 602 HB3 ALA 81 3HB ALA 81 -2.850 -7.897 2.612 603 H ARG 82 H ARG 82 -4.346 -9.425 2.091 604 HA ARG 82 HA ARG 82 -2.765 -11.688 2.572 605 HB2 ARG 82 1HB ARG 82 -4.620 -12.584 3.720 606 HB3 ARG 82 2HB ARG 82 -4.762 -10.842 3.913 607 HG2 ARG 82 1HG ARG 82 -6.907 -11.311 3.366 608 HG3 ARG 82 2HG ARG 82 -6.257 -11.105 1.739 609 HD2 ARG 82 1HD ARG 82 -7.597 -13.108 1.816 610 HD3 ARG 82 2HD ARG 82 -5.902 -13.546 1.610 611 HE ARG 82 HE ARG 82 -6.620 -13.544 4.353 612 HH11 ARG 82 1HH1 ARG 82 -6.949 -15.382 1.414 613 HH12 ARG 82 2HH1 ARG 82 -7.123 -16.901 2.230 614 HH21 ARG 82 1HH2 ARG 82 -6.849 -15.537 5.438 615 HH22 ARG 82 2HH2 ARG 82 -7.067 -16.988 4.519 616 H LYS 83 H LYS 83 -4.971 -10.920 0.002 617 HA LYS 83 HA LYS 83 -5.554 -13.486 -0.949 618 HB2 LYS 83 1HB LYS 83 -6.458 -11.140 -1.664 619 HB3 LYS 83 2HB LYS 83 -5.132 -11.180 -2.821 620 HG2 LYS 83 1HG LYS 83 -6.138 -12.711 -4.120 621 HG3 LYS 83 2HG LYS 83 -6.799 -13.600 -2.746 622 HD2 LYS 83 1HD LYS 83 -8.710 -12.353 -2.684 623 HD3 LYS 83 2HD LYS 83 -7.915 -10.906 -3.309 624 HE2 LYS 83 1HE LYS 83 -7.724 -12.210 -5.512 625 HE3 LYS 83 2HE LYS 83 -8.918 -13.303 -4.812 626 HZ1 LYS 83 1HZ LYS 83 -10.516 -11.884 -5.332 627 HZ2 LYS 83 2HZ LYS 83 -9.384 -10.897 -6.109 628 HZ3 LYS 83 3HZ LYS 83 -9.762 -10.631 -4.481 629 H ILE 84 H ILE 84 -3.056 -11.226 -2.131 630 HA ILE 84 HA ILE 84 -1.802 -13.155 -3.789 631 HB ILE 84 HB ILE 84 0.057 -11.530 -3.944 632 HG12 ILE 84 1HG1 ILE 84 -1.562 -9.692 -2.196 633 HG13 ILE 84 2HG1 ILE 84 -0.338 -10.753 -1.509 634 HG21 ILE 84 1HG2 ILE 84 -2.779 -10.782 -4.419 635 HG22 ILE 84 2HG2 ILE 84 -1.539 -9.555 -4.672 636 HG23 ILE 84 3HG2 ILE 84 -1.475 -11.070 -5.571 637 HD11 ILE 84 1HD1 ILE 84 -0.002 -8.428 -3.350 638 HD12 ILE 84 2HD1 ILE 84 0.798 -8.768 -1.815 639 HD13 ILE 84 3HD1 ILE 84 1.229 -9.687 -3.258 640 H GLY 85 H GLY 85 -1.409 -12.215 -0.449 641 HA2 GLY 85 1HA GLY 85 -0.484 -14.130 0.907 642 HA3 GLY 85 2HA GLY 85 0.859 -14.096 -0.226 643 H ALA 86 H ALA 86 -0.870 -12.084 2.131 644 HA ALA 86 HA ALA 86 1.595 -11.220 3.309 645 HB1 ALA 86 1HB ALA 86 0.429 -8.736 2.728 646 HB2 ALA 86 2HB ALA 86 1.957 -9.379 2.126 647 HB3 ALA 86 3HB ALA 86 0.472 -9.627 1.206 648 H ARG 87 H ARG 87 0.985 -11.589 5.351 649 HA ARG 87 HA ARG 87 -1.613 -11.393 6.364 650 HB2 ARG 87 1HB ARG 87 1.110 -11.519 7.593 651 HB3 ARG 87 2HB ARG 87 -0.270 -11.152 8.620 652 HG2 ARG 87 1HG ARG 87 -1.342 -13.250 7.693 653 HG3 ARG 87 2HG ARG 87 0.242 -13.637 7.017 654 HD2 ARG 87 1HD ARG 87 0.069 -12.907 9.896 655 HD3 ARG 87 2HD ARG 87 -0.504 -14.500 9.403 656 HE ARG 87 HE ARG 87 1.976 -14.217 8.250 657 HH11 ARG 87 1HH1 ARG 87 0.679 -14.160 11.480 658 HH12 ARG 87 2HH1 ARG 87 2.127 -14.767 12.213 659 HH21 ARG 87 1HH2 ARG 87 3.889 -15.015 9.203 660 HH22 ARG 87 2HH2 ARG 87 3.953 -15.251 10.917 661 H VAL 88 H VAL 88 -2.807 -9.760 7.145 662 HA VAL 88 HA VAL 88 -1.502 -7.179 7.667 663 HB VAL 88 HB VAL 88 -4.033 -7.555 6.059 664 HG11 VAL 88 1HG1 VAL 88 -4.352 -5.614 7.362 665 HG12 VAL 88 2HG1 VAL 88 -2.683 -5.090 7.130 666 HG13 VAL 88 3HG1 VAL 88 -3.818 -5.044 5.781 667 HG21 VAL 88 1HG2 VAL 88 -1.367 -6.406 5.241 668 HG22 VAL 88 2HG2 VAL 88 -1.939 -8.022 4.832 669 HG23 VAL 88 3HG2 VAL 88 -2.788 -6.605 4.216 670 H TYR 89 H TYR 89 -1.939 -6.546 9.665 671 HA TYR 89 HA TYR 89 -4.424 -7.476 10.933 672 HB2 TYR 89 1HB TYR 89 -1.972 -7.906 11.861 673 HB3 TYR 89 2HB TYR 89 -2.201 -6.296 12.534 674 HD1 TYR 89 1HD TYR 89 -4.686 -6.038 13.639 675 HD2 TYR 89 2HD TYR 89 -2.459 -9.646 13.280 676 HE1 TYR 89 1HE TYR 89 -5.953 -6.999 15.514 677 HE2 TYR 89 2HE TYR 89 -3.722 -10.618 15.155 678 HH TYR 89 HH TYR 89 -6.534 -9.113 16.454 679 H ALA 90 H ALA 90 -5.051 -5.497 9.383 680 HA ALA 90 HA ALA 90 -5.238 -3.158 11.162 681 HB1 ALA 90 1HB ALA 90 -4.646 -3.201 8.217 682 HB2 ALA 90 2HB ALA 90 -5.264 -1.767 9.037 683 HB3 ALA 90 3HB ALA 90 -3.713 -2.457 9.515 684 H LEU 91 H LEU 91 -6.978 -1.593 9.928 685 HA LEU 91 HA LEU 91 -9.308 -3.262 9.273 686 HB2 LEU 91 1HB LEU 91 -9.172 -2.309 11.682 687 HB3 LEU 91 2HB LEU 91 -9.585 -0.776 10.917 688 HG LEU 91 HG LEU 91 -11.644 -1.908 10.010 689 HD11 LEU 91 1HD1 LEU 91 -12.369 -3.936 11.278 690 HD12 LEU 91 2HD1 LEU 91 -10.722 -4.068 11.894 691 HD13 LEU 91 3HD1 LEU 91 -11.028 -4.205 10.163 692 HD21 LEU 91 1HD2 LEU 91 -12.003 -2.168 12.889 693 HD22 LEU 91 2HD2 LEU 91 -12.755 -1.052 11.747 694 HD23 LEU 91 3HD2 LEU 91 -11.169 -0.685 12.425 695 HA PRO 92 HA PRO 92 -9.624 -0.516 5.828 696 HB2 PRO 92 1HB PRO 92 -12.134 -1.196 5.048 697 HB3 PRO 92 2HB PRO 92 -10.727 -2.230 4.769 698 HG2 PRO 92 1HG PRO 92 -12.805 -2.397 6.918 699 HG3 PRO 92 2HG PRO 92 -12.081 -3.700 5.958 700 HD2 PRO 92 1HD PRO 92 -11.295 -3.147 8.489 701 HD3 PRO 92 2HD PRO 92 -10.180 -3.774 7.258 702 H GLU 93 H GLU 93 -11.492 -0.343 8.663 703 HA GLU 93 HA GLU 93 -13.152 1.867 7.819 704 HB2 GLU 93 1HB GLU 93 -12.720 0.474 10.454 705 HB3 GLU 93 2HB GLU 93 -13.698 1.929 10.323 706 HG2 GLU 93 1HG GLU 93 -15.055 0.706 8.580 707 HG3 GLU 93 2HG GLU 93 -14.193 -0.753 9.068 708 H ASP 94 H ASP 94 -10.236 1.378 9.736 709 HA ASP 94 HA ASP 94 -10.037 4.212 10.345 710 HB2 ASP 94 1HB ASP 94 -8.548 1.752 11.167 711 HB3 ASP 94 2HB ASP 94 -7.754 3.317 11.323 712 H LEU 95 H LEU 95 -8.814 1.931 8.057 713 HA LEU 95 HA LEU 95 -6.447 3.205 7.273 714 HB2 LEU 95 1HB LEU 95 -6.785 1.018 6.501 715 HB3 LEU 95 2HB LEU 95 -8.378 1.403 5.852 716 HG LEU 95 HG LEU 95 -7.407 2.590 4.008 717 HD11 LEU 95 1HD1 LEU 95 -5.408 3.316 5.559 718 HD12 LEU 95 2HD1 LEU 95 -5.224 3.229 3.807 719 HD13 LEU 95 3HD1 LEU 95 -4.627 1.916 4.823 720 HD21 LEU 95 1HD2 LEU 95 -5.565 0.393 3.759 721 HD22 LEU 95 2HD2 LEU 95 -7.085 0.684 2.914 722 HD23 LEU 95 3HD2 LEU 95 -7.086 -0.148 4.470 723 H VAL 96 H VAL 96 -9.770 3.952 6.643 724 HA VAL 96 HA VAL 96 -9.457 5.522 4.322 725 HB VAL 96 HB VAL 96 -11.543 5.480 6.486 726 HG11 VAL 96 1HG1 VAL 96 -11.916 7.646 5.955 727 HG12 VAL 96 2HG1 VAL 96 -11.096 7.519 4.397 728 HG13 VAL 96 3HG1 VAL 96 -12.749 6.930 4.576 729 HG21 VAL 96 1HG2 VAL 96 -12.653 4.075 5.143 730 HG22 VAL 96 2HG2 VAL 96 -12.302 5.030 3.701 731 HG23 VAL 96 3HG2 VAL 96 -11.113 3.876 4.306 732 H GLU 97 H GLU 97 -9.160 6.258 7.750 733 HA GLU 97 HA GLU 97 -8.718 9.083 7.197 734 HB2 GLU 97 1HB GLU 97 -8.888 7.486 9.749 735 HB3 GLU 97 2HB GLU 97 -8.431 9.184 9.723 736 HG2 GLU 97 1HG GLU 97 -10.626 9.563 8.467 737 HG3 GLU 97 2HG GLU 97 -11.059 7.941 9.004 738 H VAL 98 H VAL 98 -6.855 6.776 6.457 739 HA VAL 98 HA VAL 98 -4.617 6.358 6.358 740 HB VAL 98 HB VAL 98 -4.340 9.262 7.144 741 HG11 VAL 98 1HG1 VAL 98 -2.154 8.974 6.893 742 HG12 VAL 98 2HG1 VAL 98 -2.422 7.248 6.645 743 HG13 VAL 98 3HG1 VAL 98 -2.400 8.345 5.264 744 HG21 VAL 98 1HG2 VAL 98 -4.676 8.031 4.410 745 HG22 VAL 98 2HG2 VAL 98 -5.856 9.035 5.252 746 HG23 VAL 98 3HG2 VAL 98 -4.318 9.727 4.734 747 H ASN 99 H ASN 99 -5.981 5.966 8.920 748 HA ASN 99 HA ASN 99 -4.743 6.791 11.183 749 HB2 ASN 99 1HB ASN 99 -5.910 4.159 10.383 750 HB3 ASN 99 2HB ASN 99 -5.055 4.266 11.919 751 HD21 ASN 99 1HD2 ASN 99 -7.113 6.606 10.244 752 HD22 ASN 99 2HD2 ASN 99 -8.273 6.757 11.516 753 HA PRO 100 HA PRO 100 -0.508 5.588 10.162 754 HB2 PRO 100 1HB PRO 100 0.622 7.162 12.063 755 HB3 PRO 100 2HB PRO 100 0.089 7.782 10.497 756 HG2 PRO 100 1HG PRO 100 -1.296 7.890 13.148 757 HG3 PRO 100 2HG PRO 100 -1.139 9.156 11.916 758 HD2 PRO 100 1HD PRO 100 -3.386 7.673 12.202 759 HD3 PRO 100 2HD PRO 100 -2.843 8.290 10.629 760 H LYS 101 H LYS 101 -2.507 4.859 12.702 761 HA LYS 101 HA LYS 101 -0.473 3.700 14.426 762 HB2 LYS 101 1HB LYS 101 -3.488 3.615 14.646 763 HB3 LYS 101 2HB LYS 101 -2.349 3.085 15.878 764 HG2 LYS 101 1HG LYS 101 -1.739 5.235 16.435 765 HG3 LYS 101 2HG LYS 101 -2.236 5.892 14.874 766 HD2 LYS 101 1HD LYS 101 -3.924 6.648 16.253 767 HD3 LYS 101 2HD LYS 101 -4.618 5.145 15.640 768 HE2 LYS 101 1HE LYS 101 -4.138 3.993 17.645 769 HE3 LYS 101 2HE LYS 101 -3.072 5.276 18.215 770 HZ1 LYS 101 1HZ LYS 101 -5.888 5.008 18.526 771 HZ2 LYS 101 2HZ LYS 101 -5.499 6.489 17.810 772 HZ3 LYS 101 3HZ LYS 101 -4.821 6.067 19.300 773 H MET 102 H MET 102 -2.692 2.738 11.942 774 HA MET 102 HA MET 102 -2.126 -0.096 12.476 775 HB2 MET 102 1HB MET 102 -4.025 -0.606 11.050 776 HB3 MET 102 2HB MET 102 -4.505 0.534 12.300 777 HG2 MET 102 1HG MET 102 -4.332 2.367 10.692 778 HG3 MET 102 2HG MET 102 -3.864 1.219 9.440 779 HE1 MET 102 1HE MET 102 -6.545 0.749 12.292 780 HE2 MET 102 2HE MET 102 -7.743 -0.110 11.323 781 HE3 MET 102 3HE MET 102 -6.112 -0.762 11.491 782 H VAL 103 H VAL 103 -1.849 2.440 10.068 783 HA VAL 103 HA VAL 103 -1.177 1.087 7.792 784 HB VAL 103 HB VAL 103 0.253 3.550 8.798 785 HG11 VAL 103 1HG1 VAL 103 1.381 2.585 6.903 786 HG12 VAL 103 2HG1 VAL 103 -0.141 2.439 6.023 787 HG13 VAL 103 3HG1 VAL 103 0.521 4.034 6.381 788 HG21 VAL 103 1HG2 VAL 103 -2.470 3.221 8.328 789 HG22 VAL 103 2HG2 VAL 103 -1.594 4.745 8.454 790 HG23 VAL 103 3HG2 VAL 103 -1.853 4.006 6.875 791 H MET 104 H MET 104 0.582 1.194 10.746 792 HA MET 104 HA MET 104 3.195 0.798 10.041 793 HB2 MET 104 1HB MET 104 3.079 -0.920 12.082 794 HB3 MET 104 2HB MET 104 2.998 0.822 12.311 795 HG2 MET 104 1HG MET 104 0.793 0.793 12.860 796 HG3 MET 104 2HG MET 104 0.452 -0.629 11.878 797 HE1 MET 104 1HE MET 104 -0.801 -1.859 12.991 798 HE2 MET 104 2HE MET 104 -0.029 -3.223 13.798 799 HE3 MET 104 3HE MET 104 -0.897 -2.014 14.745 800 H THR 105 H THR 105 0.649 -1.675 10.209 801 HA THR 105 HA THR 105 2.441 -3.681 9.110 802 HB THR 105 HB THR 105 0.530 -5.225 9.342 803 HG1 THR 105 1HG THR 105 -1.309 -4.242 10.583 804 HG21 THR 105 1HG2 THR 105 1.605 -3.631 11.592 805 HG22 THR 105 2HG2 THR 105 1.673 -5.369 11.299 806 HG23 THR 105 3HG2 THR 105 0.203 -4.641 11.943 807 H VAL 106 H VAL 106 -0.373 -1.795 8.140 808 HA VAL 106 HA VAL 106 -1.274 -2.931 5.882 809 HB VAL 106 HB VAL 106 -0.585 -0.013 6.233 810 HG11 VAL 106 1HG1 VAL 106 -2.240 0.374 4.416 811 HG12 VAL 106 2HG1 VAL 106 -0.768 -0.435 3.875 812 HG13 VAL 106 3HG1 VAL 106 -2.249 -1.363 4.112 813 HG21 VAL 106 1HG2 VAL 106 -3.197 -1.495 6.525 814 HG22 VAL 106 2HG2 VAL 106 -2.188 -0.922 7.853 815 HG23 VAL 106 3HG2 VAL 106 -2.949 0.236 6.762 816 H PHE 107 H PHE 107 1.662 -0.922 6.018 817 HA PHE 107 HA PHE 107 2.352 -1.642 3.295 818 HB2 PHE 107 1HB PHE 107 3.429 0.259 5.333 819 HB3 PHE 107 2HB PHE 107 4.488 -0.266 4.029 820 HD1 PHE 107 2HD PHE 107 2.746 -0.408 1.732 821 HD2 PHE 107 1HD PHE 107 2.816 2.433 4.902 822 HE1 PHE 107 2HE PHE 107 1.745 1.275 0.242 823 HE2 PHE 107 1HE PHE 107 1.815 4.119 3.416 824 HZ PHE 107 HZ PHE 107 1.279 3.542 1.083 825 H ALA 108 H ALA 108 3.506 -2.261 6.572 826 HA ALA 108 HA ALA 108 5.886 -3.459 6.297 827 HB1 ALA 108 1HB ALA 108 3.644 -4.727 7.863 828 HB2 ALA 108 2HB ALA 108 5.376 -4.876 8.166 829 HB3 ALA 108 3HB ALA 108 4.570 -3.325 8.401 830 H CYS 109 H CYS 109 2.934 -5.456 6.116 831 HA CYS 109 HA CYS 109 3.964 -7.780 5.193 832 HB2 CYS 109 1HB CYS 109 1.805 -8.207 4.082 833 HB3 CYS 109 2HB CYS 109 1.589 -7.497 5.678 834 HG CYS 109 HG CYS 109 0.318 -5.366 4.947 835 H LEU 110 H LEU 110 3.475 -4.848 3.340 836 HA LEU 110 HA LEU 110 4.163 -6.112 0.831 837 HB2 LEU 110 1HB LEU 110 3.782 -3.203 1.528 838 HB3 LEU 110 2HB LEU 110 3.980 -3.849 -0.100 839 HG LEU 110 HG LEU 110 1.685 -4.608 1.698 840 HD11 LEU 110 1HD1 LEU 110 2.069 -2.075 0.848 841 HD12 LEU 110 2HD1 LEU 110 0.484 -2.813 1.074 842 HD13 LEU 110 3HD1 LEU 110 1.207 -2.753 -0.534 843 HD21 LEU 110 1HD2 LEU 110 1.045 -5.939 0.036 844 HD22 LEU 110 2HD2 LEU 110 2.628 -5.671 -0.694 845 HD23 LEU 110 3HD2 LEU 110 1.259 -4.659 -1.159 846 H MET 111 H MET 111 5.539 -3.226 2.406 847 HA MET 111 HA MET 111 7.916 -3.057 1.129 848 HB2 MET 111 1HB MET 111 8.678 -1.729 2.861 849 HB3 MET 111 2HB MET 111 6.940 -1.679 3.123 850 HG2 MET 111 1HG MET 111 7.757 -2.039 5.244 851 HG3 MET 111 2HG MET 111 7.349 -3.667 4.709 852 HE1 MET 111 1HE MET 111 10.040 -1.027 4.509 853 HE2 MET 111 2HE MET 111 11.558 -1.863 4.837 854 HE3 MET 111 3HE MET 111 10.800 -1.999 3.249 855 H GLY 112 H GLY 112 6.966 -5.529 3.360 856 HA2 GLY 112 1HA GLY 112 9.206 -6.575 4.423 857 HA3 GLY 112 2HA GLY 112 7.966 -7.592 3.708 858 H LYS 113 H LYS 113 8.464 -6.495 1.011 859 HA LYS 113 HA LYS 113 10.356 -8.398 0.144 860 HB2 LYS 113 1HB LYS 113 8.394 -7.139 -1.112 861 HB3 LYS 113 2HB LYS 113 9.690 -6.034 -1.555 862 HG2 LYS 113 1HG LYS 113 9.945 -8.986 -1.992 863 HG3 LYS 113 2HG LYS 113 9.125 -7.946 -3.158 864 HD2 LYS 113 1HD LYS 113 11.338 -6.516 -2.880 865 HD3 LYS 113 2HD LYS 113 12.002 -8.085 -2.419 866 HE2 LYS 113 1HE LYS 113 11.174 -9.037 -4.525 867 HE3 LYS 113 2HE LYS 113 10.541 -7.456 -4.983 868 HZ1 LYS 113 1HZ LYS 113 12.524 -6.857 -5.725 869 HZ2 LYS 113 2HZ LYS 113 13.068 -8.438 -5.474 870 HZ3 LYS 113 3HZ LYS 113 13.278 -7.271 -4.268 871 H GLY 114 H GLY 114 10.548 -4.867 0.508 872 HA2 GLY 114 1HA GLY 114 13.217 -4.645 -0.436 873 HA3 GLY 114 2HA GLY 114 12.349 -3.440 0.503 874 H MET 115 H MET 115 11.982 -4.305 2.896 875 HA MET 115 HA MET 115 14.562 -5.368 3.839 876 HB2 MET 115 1HB MET 115 14.004 -2.825 4.175 877 HB3 MET 115 2HB MET 115 12.993 -3.422 5.484 878 HG2 MET 115 1HG MET 115 15.105 -4.669 6.258 879 HG3 MET 115 2HG MET 115 15.963 -3.563 5.188 880 HE1 MET 115 1HE MET 115 15.782 -4.404 8.191 881 HE2 MET 115 2HE MET 115 16.463 -2.947 8.916 882 HE3 MET 115 3HE MET 115 14.787 -3.390 9.238 883 H LYS 116 H LYS 116 14.500 -6.479 5.888 884 HA LYS 116 HA LYS 116 11.830 -7.473 6.629 885 HB2 LYS 116 1HB LYS 116 12.601 -9.709 6.765 886 HB3 LYS 116 2HB LYS 116 13.175 -9.096 5.219 887 HG2 LYS 116 1HG LYS 116 14.953 -8.935 7.605 888 HG3 LYS 116 2HG LYS 116 14.754 -10.475 6.767 889 HD2 LYS 116 1HD LYS 116 15.341 -8.037 5.157 890 HD3 LYS 116 2HD LYS 116 16.651 -8.777 6.081 891 HE2 LYS 116 1HE LYS 116 14.936 -10.095 3.981 892 HE3 LYS 116 2HE LYS 116 16.646 -9.681 3.848 893 HZ1 LYS 116 1HZ LYS 116 16.900 -11.815 4.457 894 HZ2 LYS 116 2HZ LYS 116 15.380 -11.921 5.191 895 HZ3 LYS 116 3HZ LYS 116 16.674 -11.213 6.021 896 H ARG 117 H ARG 117 11.989 -8.724 8.790 897 HA ARG 117 HA ARG 117 13.936 -7.482 10.595 898 HB2 ARG 117 1HB ARG 117 10.946 -7.526 11.043 899 HB3 ARG 117 2HB ARG 117 12.138 -7.033 12.240 900 HG2 ARG 117 1HG ARG 117 12.710 -5.103 11.038 901 HG3 ARG 117 2HG ARG 117 11.925 -5.686 9.569 902 HD2 ARG 117 1HD ARG 117 10.275 -5.328 12.020 903 HD3 ARG 117 2HD ARG 117 10.780 -3.891 11.130 904 HE ARG 117 HE ARG 117 8.785 -5.778 10.352 905 HH11 ARG 117 1HH1 ARG 117 11.193 -3.577 9.137 906 HH12 ARG 117 2HH1 ARG 117 10.393 -3.333 7.619 907 HH21 ARG 117 1HH2 ARG 117 7.722 -5.465 8.359 908 HH22 ARG 117 2HH2 ARG 117 8.418 -4.407 7.178 909 H VAL 118 H VAL 118 13.406 -8.474 12.940 910 HA VAL 118 HA VAL 118 13.583 -11.367 12.551 911 HB VAL 118 HB VAL 118 15.377 -10.228 13.824 912 HG11 VAL 118 1HG1 VAL 118 13.854 -8.526 14.858 913 HG12 VAL 118 2HG1 VAL 118 13.304 -9.787 15.964 914 HG13 VAL 118 3HG1 VAL 118 14.993 -9.277 15.974 915 HG21 VAL 118 1HG2 VAL 118 14.965 -11.735 15.980 916 HG22 VAL 118 2HG2 VAL 118 13.708 -12.407 14.942 917 HG23 VAL 118 3HG2 VAL 118 15.389 -12.424 14.414 918 H SER 119 H SER 119 12.160 -12.800 13.384 919 HA SER 119 HA SER 119 9.982 -11.756 15.066 920 HB2 SER 119 1HB SER 119 9.040 -11.971 12.866 921 HB3 SER 119 2HB SER 119 9.747 -13.574 12.662 922 HG SER 119 HG SER 119 8.378 -14.312 14.329 923 H GLY 120 H GLY 120 9.218 -13.108 16.662 924 HA2 GLY 120 1HA GLY 120 9.975 -15.873 16.808 925 HA3 GLY 120 2HA GLY 120 10.895 -14.865 17.914 926 HA PRO 121 HA PRO 121 6.906 -16.251 19.931 927 HB2 PRO 121 1HB PRO 121 8.078 -17.389 22.099 928 HB3 PRO 121 2HB PRO 121 7.770 -18.271 20.599 929 HG2 PRO 121 1HG PRO 121 10.308 -17.014 21.570 930 HG3 PRO 121 2HG PRO 121 10.066 -18.589 20.793 931 HD2 PRO 121 1HD PRO 121 10.973 -16.421 19.445 932 HD3 PRO 121 2HD PRO 121 9.970 -17.672 18.681 933 H SER 122 H SER 122 6.080 -14.404 20.719 934 HA SER 122 HA SER 122 7.616 -12.936 22.756 935 HB2 SER 122 1HB SER 122 5.410 -11.992 20.912 936 HB3 SER 122 2HB SER 122 6.134 -11.006 22.183 937 HG SER 122 HG SER 122 7.124 -10.621 20.168 938 H SER 123 H SER 123 7.014 -13.912 24.632 939 HA SER 123 HA SER 123 4.380 -13.332 25.623 940 HB2 SER 123 1HB SER 123 5.224 -16.218 25.273 941 HB3 SER 123 2HB SER 123 3.826 -15.684 26.206 942 HG SER 123 HG SER 123 2.965 -16.072 24.271 943 H GLY 124 H GLY 124 4.210 -13.559 27.895 944 HA2 GLY 124 1HA GLY 124 6.678 -13.189 29.275 945 HA3 GLY 124 2HA GLY 124 5.082 -13.271 30.006 Start of MODEL 17 1 H1 GLY 1 H GLY 1 28.043 3.180 -0.321 2 HA2 GLY 1 1HA GLY 1 25.862 2.809 -2.143 3 HA3 GLY 1 2HA GLY 1 27.200 1.720 -2.483 4 H SER 2 H SER 2 26.565 -0.224 -1.799 5 HA SER 2 HA SER 2 24.849 -0.613 0.444 6 HB2 SER 2 1HB SER 2 26.499 -2.554 -1.187 7 HB3 SER 2 2HB SER 2 25.373 -3.044 0.079 8 HG SER 2 HG SER 2 24.872 -2.039 -2.463 9 H SER 3 H SER 3 25.826 0.294 2.248 10 HA SER 3 HA SER 3 27.854 -1.369 3.491 11 HB2 SER 3 1HB SER 3 29.256 0.256 2.376 12 HB3 SER 3 2HB SER 3 28.275 1.586 2.991 13 HG SER 3 HG SER 3 30.387 0.683 4.109 14 H GLY 4 H GLY 4 27.050 -1.829 5.423 15 HA2 GLY 4 1HA GLY 4 26.440 -1.271 7.633 16 HA3 GLY 4 2HA GLY 4 25.979 0.331 7.076 17 H SER 5 H SER 5 24.325 -0.984 8.779 18 HA SER 5 HA SER 5 22.327 -2.510 7.427 19 HB2 SER 5 1HB SER 5 21.061 -2.325 9.516 20 HB3 SER 5 2HB SER 5 22.743 -2.739 9.849 21 HG SER 5 HG SER 5 23.097 -0.755 10.636 22 H SER 6 H SER 6 21.376 -1.468 5.750 23 HA SER 6 HA SER 6 20.738 1.242 5.604 24 HB2 SER 6 1HB SER 6 19.174 0.574 3.783 25 HB3 SER 6 2HB SER 6 20.771 -0.155 3.617 26 HG SER 6 HG SER 6 19.814 -2.024 4.716 27 H GLY 7 H GLY 7 18.327 1.943 5.233 28 HA2 GLY 7 1HA GLY 7 17.029 1.615 7.790 29 HA3 GLY 7 2HA GLY 7 16.508 2.664 6.479 30 H ASN 8 H ASN 8 15.102 0.650 8.245 31 HA ASN 8 HA ASN 8 13.989 -1.055 6.118 32 HB2 ASN 8 1HB ASN 8 13.289 -2.601 7.830 33 HB3 ASN 8 2HB ASN 8 14.991 -2.229 8.090 34 HD21 ASN 8 1HD2 ASN 8 12.357 -2.878 9.716 35 HD22 ASN 8 2HD2 ASN 8 12.548 -1.868 11.104 36 H ASP 9 H ASP 9 13.203 1.151 8.743 37 HA ASP 9 HA ASP 9 10.361 1.020 8.126 38 HB2 ASP 9 1HB ASP 9 11.989 2.324 10.283 39 HB3 ASP 9 2HB ASP 9 10.329 2.838 9.994 40 H ASP 10 H ASP 10 13.111 2.919 7.368 41 HA ASP 10 HA ASP 10 11.623 5.292 6.662 42 HB2 ASP 10 1HB ASP 10 13.764 5.853 7.358 43 HB3 ASP 10 2HB ASP 10 14.500 4.472 6.548 44 H ILE 11 H ILE 11 12.919 2.467 5.062 45 HA ILE 11 HA ILE 11 12.656 3.434 2.401 46 HB ILE 11 HB ILE 11 14.076 1.473 3.135 47 HG12 ILE 11 1HG1 ILE 11 12.228 0.706 0.888 48 HG13 ILE 11 2HG1 ILE 11 13.311 2.086 0.740 49 HG21 ILE 11 1HG2 ILE 11 12.205 -0.591 2.693 50 HG22 ILE 11 2HG2 ILE 11 13.104 -0.233 4.166 51 HG23 ILE 11 3HG2 ILE 11 11.514 0.483 3.909 52 HD11 ILE 11 1HD1 ILE 11 14.952 0.734 0.154 53 HD12 ILE 11 2HD1 ILE 11 14.816 -0.120 1.692 54 HD13 ILE 11 3HD1 ILE 11 13.865 -0.648 0.303 55 H ILE 12 H ILE 12 10.381 2.501 4.706 56 HA ILE 12 HA ILE 12 8.419 1.150 3.320 57 HB ILE 12 HB ILE 12 7.944 3.362 5.321 58 HG12 ILE 12 1HG1 ILE 12 8.342 0.392 5.755 59 HG13 ILE 12 2HG1 ILE 12 9.499 1.652 6.171 60 HG21 ILE 12 1HG2 ILE 12 6.216 0.998 4.604 61 HG22 ILE 12 2HG2 ILE 12 5.836 2.274 5.760 62 HG23 ILE 12 3HG2 ILE 12 5.954 2.649 4.041 63 HD11 ILE 12 1HD1 ILE 12 7.007 2.284 7.380 64 HD12 ILE 12 2HD1 ILE 12 7.407 0.604 7.740 65 HD13 ILE 12 3HD1 ILE 12 8.545 1.887 8.147 66 H VAL 13 H VAL 13 9.168 4.594 3.282 67 HA VAL 13 HA VAL 13 6.919 5.214 1.568 68 HB VAL 13 HB VAL 13 9.225 6.921 2.513 69 HG11 VAL 13 1HG1 VAL 13 8.671 8.156 0.706 70 HG12 VAL 13 2HG1 VAL 13 7.076 7.416 0.555 71 HG13 VAL 13 3HG1 VAL 13 7.350 8.691 1.744 72 HG21 VAL 13 1HG2 VAL 13 7.287 8.029 3.780 73 HG22 VAL 13 2HG2 VAL 13 6.395 6.548 3.435 74 HG23 VAL 13 3HG2 VAL 13 7.885 6.479 4.374 75 H ASN 14 H ASN 14 10.453 5.066 1.279 76 HA ASN 14 HA ASN 14 10.680 5.912 -1.367 77 HB2 ASN 14 1HB ASN 14 12.356 4.309 0.491 78 HB3 ASN 14 2HB ASN 14 12.745 4.206 -1.223 79 HD21 ASN 14 1HD2 ASN 14 13.652 5.930 -2.247 80 HD22 ASN 14 2HD2 ASN 14 14.169 7.360 -1.428 81 H TRP 15 H TRP 15 10.637 2.554 -0.164 82 HA TRP 15 HA TRP 15 10.657 1.179 -2.515 83 HB2 TRP 15 1HB TRP 15 10.484 0.315 -0.079 84 HB3 TRP 15 2HB TRP 15 8.744 0.374 -0.341 85 HD1 TRP 15 HD TRP 15 11.772 -1.120 -2.281 86 HE1 TRP 15 1HE TRP 15 11.086 -3.452 -3.126 87 HE3 TRP 15 3HE TRP 15 6.980 -1.248 -0.505 88 HZ2 TRP 15 2HZ TRP 15 8.813 -5.125 -3.049 89 HZ3 TRP 15 3HZ TRP 15 5.616 -3.251 -0.934 90 HH2 TRP 15 HH TRP 15 6.516 -5.148 -2.180 91 H VAL 16 H VAL 16 7.674 2.225 -0.855 92 HA VAL 16 HA VAL 16 5.813 1.455 -2.712 93 HB VAL 16 HB VAL 16 5.730 4.052 -1.171 94 HG11 VAL 16 1HG1 VAL 16 3.993 4.080 -2.767 95 HG12 VAL 16 2HG1 VAL 16 3.613 2.377 -2.499 96 HG13 VAL 16 3HG1 VAL 16 3.241 3.572 -1.256 97 HG21 VAL 16 1HG2 VAL 16 6.064 1.602 -0.066 98 HG22 VAL 16 2HG2 VAL 16 5.222 2.938 0.718 99 HG23 VAL 16 3HG2 VAL 16 4.304 1.698 -0.137 100 H ASN 17 H ASN 17 7.615 4.520 -2.658 101 HA ASN 17 HA ASN 17 6.441 5.662 -4.928 102 HB2 ASN 17 1HB ASN 17 8.979 6.083 -3.421 103 HB3 ASN 17 2HB ASN 17 8.844 6.809 -5.020 104 HD21 ASN 17 1HD2 ASN 17 7.777 6.872 -1.748 105 HD22 ASN 17 2HD2 ASN 17 6.841 8.320 -1.855 106 H GLU 18 H GLU 18 9.701 4.217 -4.747 107 HA GLU 18 HA GLU 18 10.241 4.109 -7.440 108 HB2 GLU 18 1HB GLU 18 11.113 2.454 -5.111 109 HB3 GLU 18 2HB GLU 18 11.562 1.938 -6.730 110 HG2 GLU 18 1HG GLU 18 12.757 3.953 -7.130 111 HG3 GLU 18 2HG GLU 18 12.134 4.683 -5.651 112 H THR 19 H THR 19 8.990 1.373 -5.519 113 HA THR 19 HA THR 19 8.545 -0.503 -7.389 114 HB THR 19 HB THR 19 6.564 0.286 -5.244 115 HG1 THR 19 1HG THR 19 8.858 -1.366 -5.312 116 HG21 THR 19 1HG2 THR 19 5.275 -1.155 -6.466 117 HG22 THR 19 2HG2 THR 19 6.167 -2.328 -5.497 118 HG23 THR 19 3HG2 THR 19 6.668 -1.990 -7.153 119 H LEU 20 H LEU 20 6.463 2.313 -6.840 120 HA LEU 20 HA LEU 20 4.597 1.589 -8.886 121 HB2 LEU 20 1HB LEU 20 5.061 4.207 -7.465 122 HB3 LEU 20 2HB LEU 20 3.706 3.869 -8.540 123 HG LEU 20 HG LEU 20 4.183 2.231 -6.070 124 HD11 LEU 20 1HD1 LEU 20 2.213 4.430 -5.976 125 HD12 LEU 20 2HD1 LEU 20 3.911 4.878 -5.830 126 HD13 LEU 20 3HD1 LEU 20 3.202 3.732 -4.694 127 HD21 LEU 20 1HD2 LEU 20 2.451 1.941 -8.165 128 HD22 LEU 20 2HD2 LEU 20 1.473 2.823 -6.991 129 HD23 LEU 20 3HD2 LEU 20 2.212 1.284 -6.546 130 H ARG 21 H ARG 21 7.251 3.933 -8.635 131 HA ARG 21 HA ARG 21 7.023 5.242 -11.034 132 HB2 ARG 21 1HB ARG 21 8.705 5.802 -9.342 133 HB3 ARG 21 2HB ARG 21 9.576 4.317 -9.705 134 HG2 ARG 21 1HG ARG 21 9.069 6.208 -11.934 135 HG3 ARG 21 2HG ARG 21 10.286 6.641 -10.732 136 HD2 ARG 21 1HD ARG 21 11.579 4.732 -11.200 137 HD3 ARG 21 2HD ARG 21 10.260 3.956 -12.078 138 HE ARG 21 HE ARG 21 10.867 5.120 -13.956 139 HH11 ARG 21 1HH1 ARG 21 12.424 6.527 -11.178 140 HH12 ARG 21 2HH1 ARG 21 13.435 7.577 -12.115 141 HH21 ARG 21 1HH2 ARG 21 12.193 6.498 -15.199 142 HH22 ARG 21 2HH2 ARG 21 13.302 7.560 -14.402 143 H GLU 22 H GLU 22 8.696 2.159 -10.441 144 HA GLU 22 HA GLU 22 9.486 1.761 -13.129 145 HB2 GLU 22 1HB GLU 22 9.046 -0.350 -11.012 146 HB3 GLU 22 2HB GLU 22 10.036 -0.498 -12.457 147 HG2 GLU 22 1HG GLU 22 10.677 1.678 -10.546 148 HG3 GLU 22 2HG GLU 22 11.078 0.023 -10.092 149 H ALA 23 H ALA 23 6.571 1.051 -11.357 150 HA ALA 23 HA ALA 23 5.495 -0.686 -13.401 151 HB1 ALA 23 1HB ALA 23 4.396 0.435 -10.841 152 HB2 ALA 23 2HB ALA 23 3.394 -0.475 -11.974 153 HB3 ALA 23 3HB ALA 23 4.799 -1.238 -11.229 154 H GLU 24 H GLU 24 5.763 2.645 -12.957 155 HA GLU 24 HA GLU 24 4.996 4.414 -14.171 156 HB2 GLU 24 1HB GLU 24 3.461 2.445 -15.865 157 HB3 GLU 24 2HB GLU 24 3.983 4.065 -16.306 158 HG2 GLU 24 1HG GLU 24 6.187 3.422 -16.588 159 HG3 GLU 24 2HG GLU 24 5.996 1.973 -15.603 160 H LYS 25 H LYS 25 3.698 3.762 -11.836 161 HA LYS 25 HA LYS 25 0.833 3.954 -12.374 162 HB2 LYS 25 1HB LYS 25 2.503 3.247 -10.017 163 HB3 LYS 25 2HB LYS 25 0.939 3.987 -9.701 164 HG2 LYS 25 1HG LYS 25 1.060 1.443 -9.757 165 HG3 LYS 25 2HG LYS 25 -0.230 2.219 -10.677 166 HD2 LYS 25 1HD LYS 25 1.066 1.983 -12.725 167 HD3 LYS 25 2HD LYS 25 2.397 1.262 -11.817 168 HE2 LYS 25 1HE LYS 25 1.186 -0.689 -11.372 169 HE3 LYS 25 2HE LYS 25 -0.356 0.072 -11.758 170 HZ1 LYS 25 1HZ LYS 25 1.637 -1.090 -13.534 171 HZ2 LYS 25 2HZ LYS 25 0.861 0.306 -14.090 172 HZ3 LYS 25 3HZ LYS 25 -0.049 -1.058 -13.673 173 H SER 26 H SER 26 -0.450 5.663 -11.664 174 HA SER 26 HA SER 26 0.956 8.201 -11.456 175 HB2 SER 26 1HB SER 26 -1.842 7.365 -12.086 176 HB3 SER 26 2HB SER 26 -1.576 8.993 -11.461 177 HG SER 26 HG SER 26 0.096 8.136 -13.512 178 H SER 27 H SER 27 0.458 6.033 -9.257 179 HA SER 27 HA SER 27 -0.716 7.808 -7.230 180 HB2 SER 27 1HB SER 27 -1.215 5.895 -5.940 181 HB3 SER 27 2HB SER 27 -1.573 5.412 -7.598 182 HG SER 27 HG SER 27 0.665 4.564 -7.585 183 H SER 28 H SER 28 0.318 8.009 -5.165 184 HA SER 28 HA SER 28 2.907 7.031 -4.614 185 HB2 SER 28 1HB SER 28 4.206 9.103 -4.869 186 HB3 SER 28 2HB SER 28 3.567 8.563 -6.421 187 HG SER 28 HG SER 28 2.165 10.428 -4.838 188 H ILE 29 H ILE 29 3.896 8.182 -2.706 189 HA ILE 29 HA ILE 29 1.876 9.561 -1.078 190 HB ILE 29 HB ILE 29 2.787 8.242 0.908 191 HG12 ILE 29 1HG1 ILE 29 3.432 6.077 -1.042 192 HG13 ILE 29 2HG1 ILE 29 4.650 7.310 -0.739 193 HG21 ILE 29 1HG2 ILE 29 0.990 7.185 -1.224 194 HG22 ILE 29 2HG2 ILE 29 1.362 6.176 0.173 195 HG23 ILE 29 3HG2 ILE 29 0.599 7.750 0.400 196 HD11 ILE 29 1HD1 ILE 29 4.521 5.073 0.660 197 HD12 ILE 29 2HD1 ILE 29 5.037 6.600 1.379 198 HD13 ILE 29 3HD1 ILE 29 3.384 6.029 1.611 199 H SER 30 H SER 30 2.652 11.088 0.334 200 HA SER 30 HA SER 30 5.373 11.976 -0.157 201 HB2 SER 30 1HB SER 30 3.219 13.452 -0.023 202 HB3 SER 30 2HB SER 30 3.474 13.352 1.719 203 HG SER 30 HG SER 30 5.561 14.103 -0.024 204 H SER 31 H SER 31 3.392 10.850 2.543 205 HA SER 31 HA SER 31 5.639 9.796 3.924 206 HB2 SER 31 1HB SER 31 5.936 12.218 4.434 207 HB3 SER 31 2HB SER 31 4.345 12.220 5.196 208 HG SER 31 HG SER 31 6.425 10.468 5.985 209 H PHE 32 H PHE 32 4.944 9.129 6.242 210 HA PHE 32 HA PHE 32 2.893 7.329 6.124 211 HB2 PHE 32 1HB PHE 32 4.056 8.796 8.486 212 HB3 PHE 32 2HB PHE 32 2.837 7.541 8.677 213 HD1 PHE 32 2HD PHE 32 3.460 5.363 7.140 214 HD2 PHE 32 1HD PHE 32 6.200 8.120 8.873 215 HE1 PHE 32 2HE PHE 32 5.221 3.645 7.081 216 HE2 PHE 32 1HE PHE 32 7.965 6.407 8.816 217 HZ PHE 32 HZ PHE 32 7.477 4.166 7.920 218 H LYS 33 H LYS 33 2.695 10.745 6.786 219 HA LYS 33 HA LYS 33 -0.165 10.523 7.388 220 HB2 LYS 33 1HB LYS 33 1.845 12.738 7.735 221 HB3 LYS 33 2HB LYS 33 0.115 13.033 7.859 222 HG2 LYS 33 1HG LYS 33 -0.044 11.444 9.692 223 HG3 LYS 33 2HG LYS 33 1.682 11.098 9.554 224 HD2 LYS 33 1HD LYS 33 2.261 13.302 10.236 225 HD3 LYS 33 2HD LYS 33 0.592 13.855 10.090 226 HE2 LYS 33 1HE LYS 33 0.746 13.555 12.359 227 HE3 LYS 33 2HE LYS 33 0.143 11.975 11.861 228 HZ1 LYS 33 1HZ LYS 33 3.013 12.179 11.844 229 HZ2 LYS 33 2HZ LYS 33 2.019 10.983 12.506 230 HZ3 LYS 33 3HZ LYS 33 2.336 12.396 13.378 231 H ASP 34 H ASP 34 0.454 9.916 4.787 232 HA ASP 34 HA ASP 34 0.074 12.287 3.157 233 HB2 ASP 34 1HB ASP 34 1.536 10.703 2.184 234 HB3 ASP 34 2HB ASP 34 0.446 9.364 2.532 235 HA PRO 35 HA PRO 35 -4.339 12.026 3.220 236 HB2 PRO 35 1HB PRO 35 -4.818 13.715 1.149 237 HB3 PRO 35 2HB PRO 35 -4.315 14.274 2.748 238 HG2 PRO 35 1HG PRO 35 -2.673 13.873 0.278 239 HG3 PRO 35 2HG PRO 35 -2.633 15.209 1.444 240 HD2 PRO 35 1HD PRO 35 -0.821 13.197 1.472 241 HD3 PRO 35 2HD PRO 35 -1.353 14.022 2.950 242 H LYS 36 H LYS 36 -2.633 11.773 0.109 243 HA LYS 36 HA LYS 36 -4.621 10.714 -1.469 244 HB2 LYS 36 1HB LYS 36 -1.657 10.489 -1.430 245 HB3 LYS 36 2HB LYS 36 -2.533 9.345 -2.439 246 HG2 LYS 36 1HG LYS 36 -2.218 11.001 -3.954 247 HG3 LYS 36 2HG LYS 36 -3.742 11.553 -3.256 248 HD2 LYS 36 1HD LYS 36 -2.442 13.477 -3.246 249 HD3 LYS 36 2HD LYS 36 -2.239 12.858 -1.604 250 HE2 LYS 36 1HE LYS 36 -0.065 13.359 -2.217 251 HE3 LYS 36 2HE LYS 36 -0.173 11.639 -2.588 252 HZ1 LYS 36 1HZ LYS 36 0.639 12.296 -4.557 253 HZ2 LYS 36 2HZ LYS 36 0.135 13.901 -4.370 254 HZ3 LYS 36 3HZ LYS 36 -0.962 12.724 -4.897 255 H ILE 37 H ILE 37 -2.677 9.107 0.972 256 HA ILE 37 HA ILE 37 -3.144 6.451 0.404 257 HB ILE 37 HB ILE 37 -2.974 7.805 3.094 258 HG12 ILE 37 1HG1 ILE 37 -0.986 6.376 1.329 259 HG13 ILE 37 2HG1 ILE 37 -0.935 8.049 1.875 260 HG21 ILE 37 1HG2 ILE 37 -2.730 4.857 2.521 261 HG22 ILE 37 2HG2 ILE 37 -2.644 5.650 4.092 262 HG23 ILE 37 3HG2 ILE 37 -4.165 5.623 3.200 263 HD11 ILE 37 1HD1 ILE 37 0.510 7.263 3.385 264 HD12 ILE 37 2HD1 ILE 37 -0.936 6.724 4.238 265 HD13 ILE 37 3HD1 ILE 37 -0.050 5.600 3.207 266 H SER 38 H SER 38 -5.314 8.815 1.793 267 HA SER 38 HA SER 38 -7.253 7.214 2.930 268 HB2 SER 38 1HB SER 38 -7.360 9.626 3.114 269 HB3 SER 38 2HB SER 38 -7.592 9.787 1.373 270 HG SER 38 HG SER 38 -9.380 8.821 3.323 271 H THR 39 H THR 39 -6.912 8.166 -0.468 272 HA THR 39 HA THR 39 -9.236 6.726 -1.317 273 HB THR 39 HB THR 39 -8.412 7.173 -3.615 274 HG1 THR 39 1HG THR 39 -6.239 8.445 -2.273 275 HG21 THR 39 1HG2 THR 39 -9.300 9.225 -3.507 276 HG22 THR 39 2HG2 THR 39 -8.004 9.817 -2.466 277 HG23 THR 39 3HG2 THR 39 -9.387 8.978 -1.764 278 H SER 40 H SER 40 -6.198 5.737 -0.368 279 HA SER 40 HA SER 40 -5.099 3.747 -0.451 280 HB2 SER 40 1HB SER 40 -7.806 2.904 -1.470 281 HB3 SER 40 2HB SER 40 -6.472 1.756 -1.347 282 HG SER 40 HG SER 40 -8.052 2.790 0.608 283 H LEU 41 H LEU 41 -5.037 5.666 -2.693 284 HA LEU 41 HA LEU 41 -4.925 4.261 -5.151 285 HB2 LEU 41 1HB LEU 41 -3.950 6.907 -4.177 286 HB3 LEU 41 2HB LEU 41 -3.393 6.303 -5.736 287 HG LEU 41 HG LEU 41 -6.275 6.774 -4.976 288 HD11 LEU 41 1HD1 LEU 41 -5.137 8.878 -5.159 289 HD12 LEU 41 2HD1 LEU 41 -6.113 8.636 -6.607 290 HD13 LEU 41 3HD1 LEU 41 -4.369 8.382 -6.667 291 HD21 LEU 41 1HD2 LEU 41 -6.075 4.998 -6.594 292 HD22 LEU 41 2HD2 LEU 41 -4.980 5.970 -7.578 293 HD23 LEU 41 3HD2 LEU 41 -6.668 6.453 -7.396 294 HA PRO 42 HA PRO 42 -0.148 4.184 -4.320 295 HB2 PRO 42 1HB PRO 42 0.637 4.596 -1.753 296 HB3 PRO 42 2HB PRO 42 0.467 5.907 -2.928 297 HG2 PRO 42 1HG PRO 42 -1.429 5.027 -0.786 298 HG3 PRO 42 2HG PRO 42 -0.962 6.671 -1.261 299 HD2 PRO 42 1HD PRO 42 -3.286 5.530 -2.054 300 HD3 PRO 42 2HD PRO 42 -2.403 6.695 -3.060 301 H VAL 43 H VAL 43 -2.275 3.108 -1.710 302 HA VAL 43 HA VAL 43 -0.714 0.829 -1.007 303 HB VAL 43 HB VAL 43 -3.665 1.220 -0.510 304 HG11 VAL 43 1HG1 VAL 43 -3.406 -0.313 1.280 305 HG12 VAL 43 2HG1 VAL 43 -2.616 -1.043 -0.120 306 HG13 VAL 43 3HG1 VAL 43 -1.648 -0.282 1.143 307 HG21 VAL 43 1HG2 VAL 43 -1.984 1.868 1.732 308 HG22 VAL 43 2HG2 VAL 43 -1.580 2.879 0.345 309 HG23 VAL 43 3HG2 VAL 43 -3.234 2.838 0.954 310 H LEU 44 H LEU 44 -3.541 1.339 -3.075 311 HA LEU 44 HA LEU 44 -3.880 -1.417 -3.717 312 HB2 LEU 44 1HB LEU 44 -4.886 1.114 -4.994 313 HB3 LEU 44 2HB LEU 44 -5.306 -0.493 -5.582 314 HG LEU 44 HG LEU 44 -5.893 0.407 -2.770 315 HD11 LEU 44 1HD1 LEU 44 -6.974 1.602 -4.982 316 HD12 LEU 44 2HD1 LEU 44 -7.735 1.505 -3.394 317 HD13 LEU 44 3HD1 LEU 44 -8.135 0.319 -4.637 318 HD21 LEU 44 1HD2 LEU 44 -7.325 -1.669 -4.393 319 HD22 LEU 44 2HD2 LEU 44 -7.278 -1.464 -2.642 320 HD23 LEU 44 3HD2 LEU 44 -5.854 -2.057 -3.500 321 H ASP 45 H ASP 45 -2.522 1.345 -5.506 322 HA ASP 45 HA ASP 45 -1.752 -0.075 -7.794 323 HB2 ASP 45 1HB ASP 45 -0.742 2.471 -6.539 324 HB3 ASP 45 2HB ASP 45 -0.048 1.835 -8.028 325 H LEU 46 H LEU 46 -0.019 0.579 -4.780 326 HA LEU 46 HA LEU 46 2.493 -0.363 -5.450 327 HB2 LEU 46 1HB LEU 46 2.275 0.685 -3.373 328 HB3 LEU 46 2HB LEU 46 0.948 -0.365 -2.883 329 HG LEU 46 HG LEU 46 2.506 -2.220 -2.599 330 HD11 LEU 46 1HD1 LEU 46 4.980 -0.793 -2.662 331 HD12 LEU 46 2HD1 LEU 46 4.184 -0.652 -4.227 332 HD13 LEU 46 3HD1 LEU 46 4.509 -2.245 -3.545 333 HD21 LEU 46 1HD2 LEU 46 3.775 0.051 -1.140 334 HD22 LEU 46 2HD2 LEU 46 3.312 -1.547 -0.554 335 HD23 LEU 46 3HD2 LEU 46 2.076 -0.324 -0.849 336 H ILE 47 H ILE 47 -0.383 -2.161 -4.501 337 HA ILE 47 HA ILE 47 0.919 -4.690 -4.305 338 HB ILE 47 HB ILE 47 -2.008 -4.087 -4.747 339 HG12 ILE 47 1HG1 ILE 47 -0.707 -4.844 -2.141 340 HG13 ILE 47 2HG1 ILE 47 -0.809 -3.163 -2.654 341 HG21 ILE 47 1HG2 ILE 47 -2.492 -6.288 -4.417 342 HG22 ILE 47 2HG2 ILE 47 -0.913 -6.459 -5.182 343 HG23 ILE 47 3HG2 ILE 47 -1.059 -6.570 -3.429 344 HD11 ILE 47 1HD1 ILE 47 -2.920 -3.020 -2.001 345 HD12 ILE 47 2HD1 ILE 47 -3.362 -4.485 -2.880 346 HD13 ILE 47 3HD1 ILE 47 -2.710 -4.599 -1.245 347 H ASP 48 H ASP 48 -0.830 -3.001 -6.864 348 HA ASP 48 HA ASP 48 -0.886 -5.161 -8.695 349 HB2 ASP 48 1HB ASP 48 -2.407 -3.337 -9.023 350 HB3 ASP 48 2HB ASP 48 -1.085 -2.173 -9.092 351 H ALA 49 H ALA 49 1.336 -2.429 -8.276 352 HA ALA 49 HA ALA 49 2.983 -2.636 -10.416 353 HB1 ALA 49 1HB ALA 49 4.861 -1.987 -8.850 354 HB2 ALA 49 2HB ALA 49 3.432 -0.955 -8.822 355 HB3 ALA 49 3HB ALA 49 3.692 -2.136 -7.537 356 H ILE 50 H ILE 50 2.966 -4.762 -7.596 357 HA ILE 50 HA ILE 50 5.211 -6.306 -8.551 358 HB ILE 50 HB ILE 50 3.307 -6.996 -6.313 359 HG12 ILE 50 1HG1 ILE 50 5.992 -5.667 -5.995 360 HG13 ILE 50 2HG1 ILE 50 4.513 -4.728 -6.169 361 HG21 ILE 50 1HG2 ILE 50 5.818 -8.148 -7.357 362 HG22 ILE 50 2HG2 ILE 50 5.664 -8.056 -5.603 363 HG23 ILE 50 3HG2 ILE 50 4.458 -8.929 -6.549 364 HD11 ILE 50 1HD1 ILE 50 5.356 -5.177 -3.815 365 HD12 ILE 50 2HD1 ILE 50 3.654 -5.502 -4.140 366 HD13 ILE 50 3HD1 ILE 50 4.806 -6.834 -4.060 367 H GLN 51 H GLN 51 1.823 -7.156 -7.807 368 HA GLN 51 HA GLN 51 2.013 -9.315 -9.789 369 HB2 GLN 51 1HB GLN 51 1.332 -9.785 -7.375 370 HB3 GLN 51 2HB GLN 51 -0.173 -8.955 -7.746 371 HG2 GLN 51 1HG GLN 51 -0.908 -10.617 -9.144 372 HG3 GLN 51 2HG GLN 51 0.722 -11.182 -9.508 373 HE21 GLN 51 1HE2 GLN 51 1.847 -11.732 -7.201 374 HE22 GLN 51 2HE2 GLN 51 0.957 -12.911 -6.307 375 HA PRO 52 HA PRO 52 -0.458 -6.378 -12.203 376 HB2 PRO 52 1HB PRO 52 0.066 -7.576 -14.581 377 HB3 PRO 52 2HB PRO 52 1.184 -6.446 -13.809 378 HG2 PRO 52 1HG PRO 52 1.227 -9.439 -13.826 379 HG3 PRO 52 2HG PRO 52 2.571 -8.299 -14.030 380 HD2 PRO 52 1HD PRO 52 2.074 -9.560 -11.686 381 HD3 PRO 52 2HD PRO 52 2.765 -7.927 -11.764 382 H GLY 53 H GLY 53 -2.593 -6.577 -12.432 383 HA2 GLY 53 1HA GLY 53 -4.412 -7.719 -13.618 384 HA3 GLY 53 2HA GLY 53 -3.679 -9.237 -13.123 385 H SER 54 H SER 54 -3.109 -8.274 -10.414 386 HA SER 54 HA SER 54 -5.370 -9.197 -9.096 387 HB2 SER 54 1HB SER 54 -3.015 -7.554 -8.208 388 HB3 SER 54 2HB SER 54 -4.325 -7.919 -7.085 389 HG SER 54 HG SER 54 -2.412 -9.431 -7.294 390 H ILE 55 H ILE 55 -4.244 -5.810 -9.187 391 HA ILE 55 HA ILE 55 -6.871 -4.890 -8.368 392 HB ILE 55 HB ILE 55 -4.437 -3.249 -9.078 393 HG12 ILE 55 1HG1 ILE 55 -4.100 -4.867 -7.182 394 HG13 ILE 55 2HG1 ILE 55 -3.917 -3.173 -6.738 395 HG21 ILE 55 1HG2 ILE 55 -5.717 -1.655 -7.454 396 HG22 ILE 55 2HG2 ILE 55 -6.185 -1.754 -9.150 397 HG23 ILE 55 3HG2 ILE 55 -7.117 -2.618 -7.927 398 HD11 ILE 55 1HD1 ILE 55 -6.517 -3.517 -6.176 399 HD12 ILE 55 2HD1 ILE 55 -5.917 -5.151 -5.887 400 HD13 ILE 55 3HD1 ILE 55 -5.217 -3.787 -5.016 401 H ASN 56 H ASN 56 -8.082 -3.305 -9.550 402 HA ASN 56 HA ASN 56 -7.445 -2.929 -12.360 403 HB2 ASN 56 1HB ASN 56 -8.742 -5.099 -12.149 404 HB3 ASN 56 2HB ASN 56 -10.107 -4.134 -11.594 405 HD21 ASN 56 1HD2 ASN 56 -11.408 -4.630 -13.316 406 HD22 ASN 56 2HD2 ASN 56 -11.111 -4.052 -14.917 407 H TYR 57 H TYR 57 -7.508 -0.767 -12.383 408 HA TYR 57 HA TYR 57 -8.907 0.945 -10.763 409 HB2 TYR 57 1HB TYR 57 -7.759 1.166 -13.498 410 HB3 TYR 57 2HB TYR 57 -8.858 2.440 -12.981 411 HD1 TYR 57 1HD TYR 57 -6.439 0.557 -10.884 412 HD2 TYR 57 2HD TYR 57 -7.411 4.270 -12.721 413 HE1 TYR 57 1HE TYR 57 -4.601 1.638 -9.657 414 HE2 TYR 57 2HE TYR 57 -5.575 5.360 -11.501 415 HH TYR 57 HH TYR 57 -3.600 4.896 -10.346 416 H ASP 58 H ASP 58 -10.000 -0.590 -13.746 417 HA ASP 58 HA ASP 58 -12.316 0.730 -14.307 418 HB2 ASP 58 1HB ASP 58 -11.232 -1.469 -15.309 419 HB3 ASP 58 2HB ASP 58 -12.438 -2.254 -14.291 420 H LEU 59 H LEU 59 -11.817 -1.672 -11.765 421 HA LEU 59 HA LEU 59 -14.580 -1.467 -10.897 422 HB2 LEU 59 1HB LEU 59 -12.347 -2.933 -9.518 423 HB3 LEU 59 2HB LEU 59 -14.081 -3.202 -9.360 424 HG LEU 59 HG LEU 59 -12.459 -3.782 -11.838 425 HD11 LEU 59 1HD1 LEU 59 -11.819 -5.277 -10.049 426 HD12 LEU 59 2HD1 LEU 59 -12.801 -6.142 -11.232 427 HD13 LEU 59 3HD1 LEU 59 -13.512 -5.629 -9.701 428 HD21 LEU 59 1HD2 LEU 59 -15.322 -3.723 -11.239 429 HD22 LEU 59 2HD2 LEU 59 -14.771 -5.230 -11.969 430 HD23 LEU 59 3HD2 LEU 59 -14.484 -3.696 -12.792 431 H LEU 60 H LEU 60 -11.396 -0.373 -9.920 432 HA LEU 60 HA LEU 60 -12.017 0.499 -7.325 433 HB2 LEU 60 1HB LEU 60 -10.015 1.675 -9.248 434 HB3 LEU 60 2HB LEU 60 -10.032 1.893 -7.500 435 HG LEU 60 HG LEU 60 -9.509 -0.693 -8.965 436 HD11 LEU 60 1HD1 LEU 60 -7.288 -0.239 -7.567 437 HD12 LEU 60 2HD1 LEU 60 -7.781 1.432 -7.843 438 HD13 LEU 60 3HD1 LEU 60 -7.515 0.354 -9.213 439 HD21 LEU 60 1HD2 LEU 60 -10.419 -1.463 -7.014 440 HD22 LEU 60 2HD2 LEU 60 -9.960 -0.025 -6.100 441 HD23 LEU 60 3HD2 LEU 60 -8.746 -1.242 -6.500 442 H LYS 61 H LYS 61 -12.416 2.617 -6.525 443 HA LYS 61 HA LYS 61 -14.264 4.104 -8.176 444 HB2 LYS 61 1HB LYS 61 -13.323 4.660 -5.357 445 HB3 LYS 61 2HB LYS 61 -14.693 5.415 -6.161 446 HG2 LYS 61 1HG LYS 61 -14.475 2.470 -5.574 447 HG3 LYS 61 2HG LYS 61 -15.325 3.639 -4.559 448 HD2 LYS 61 1HD LYS 61 -16.960 4.034 -6.185 449 HD3 LYS 61 2HD LYS 61 -15.972 3.345 -7.476 450 HE2 LYS 61 1HE LYS 61 -17.768 1.825 -6.898 451 HE3 LYS 61 2HE LYS 61 -16.213 1.124 -6.448 452 HZ1 LYS 61 1HZ LYS 61 -17.139 0.798 -4.466 453 HZ2 LYS 61 2HZ LYS 61 -18.443 1.825 -4.791 454 HZ3 LYS 61 3HZ LYS 61 -16.988 2.464 -4.214 455 H THR 62 H THR 62 -11.531 5.173 -6.147 456 HA THR 62 HA THR 62 -10.211 7.045 -6.326 457 HB THR 62 HB THR 62 -9.046 5.415 -7.760 458 HG1 THR 62 1HG THR 62 -8.566 7.883 -7.597 459 HG21 THR 62 1HG2 THR 62 -9.278 5.582 -10.213 460 HG22 THR 62 2HG2 THR 62 -10.620 6.704 -9.993 461 HG23 THR 62 3HG2 THR 62 -10.765 5.038 -9.437 462 H GLU 63 H GLU 63 -13.066 7.466 -6.974 463 HA GLU 63 HA GLU 63 -12.730 9.930 -8.540 464 HB2 GLU 63 1HB GLU 63 -14.912 9.570 -9.596 465 HB3 GLU 63 2HB GLU 63 -13.789 8.275 -9.990 466 HG2 GLU 63 1HG GLU 63 -14.921 7.110 -7.925 467 HG3 GLU 63 2HG GLU 63 -16.237 8.219 -8.309 468 H ASN 64 H ASN 64 -12.850 11.372 -6.902 469 HA ASN 64 HA ASN 64 -13.625 12.480 -5.054 470 HB2 ASN 64 1HB ASN 64 -16.400 11.962 -6.064 471 HB3 ASN 64 2HB ASN 64 -15.717 13.442 -5.397 472 HD21 ASN 64 1HD2 ASN 64 -16.064 11.459 -8.215 473 HD22 ASN 64 2HD2 ASN 64 -15.473 12.615 -9.354 474 H LEU 65 H LEU 65 -13.045 9.987 -4.265 475 HA LEU 65 HA LEU 65 -15.029 8.367 -3.223 476 HB2 LEU 65 1HB LEU 65 -12.219 8.949 -2.370 477 HB3 LEU 65 2HB LEU 65 -13.235 7.868 -1.418 478 HG LEU 65 HG LEU 65 -12.946 7.323 -4.330 479 HD11 LEU 65 1HD1 LEU 65 -10.934 5.840 -3.145 480 HD12 LEU 65 2HD1 LEU 65 -10.721 7.459 -2.479 481 HD13 LEU 65 3HD1 LEU 65 -10.727 7.219 -4.226 482 HD21 LEU 65 1HD2 LEU 65 -14.032 5.500 -3.687 483 HD22 LEU 65 2HD2 LEU 65 -13.965 6.021 -2.004 484 HD23 LEU 65 3HD2 LEU 65 -12.655 5.052 -2.681 485 H ASN 66 H ASN 66 -15.282 8.032 -0.735 486 HA ASN 66 HA ASN 66 -15.316 10.407 0.869 487 HB2 ASN 66 1HB ASN 66 -17.589 10.868 0.973 488 HB3 ASN 66 2HB ASN 66 -17.384 10.473 -0.731 489 HD21 ASN 66 1HD2 ASN 66 -17.936 8.307 -1.410 490 HD22 ASN 66 2HD2 ASN 66 -19.181 7.449 -0.574 491 H ASP 67 H ASP 67 -16.546 9.947 2.989 492 HA ASP 67 HA ASP 67 -15.398 7.986 4.426 493 HB2 ASP 67 1HB ASP 67 -18.297 8.765 4.795 494 HB3 ASP 67 2HB ASP 67 -17.202 8.145 6.028 495 H ASP 68 H ASP 68 -18.111 7.589 2.252 496 HA ASP 68 HA ASP 68 -18.607 4.860 3.059 497 HB2 ASP 68 1HB ASP 68 -19.798 6.766 1.103 498 HB3 ASP 68 2HB ASP 68 -20.019 5.043 0.805 499 H GLU 69 H GLU 69 -17.873 6.228 -0.151 500 HA GLU 69 HA GLU 69 -17.037 3.898 -1.358 501 HB2 GLU 69 1HB GLU 69 -15.887 6.643 -1.880 502 HB3 GLU 69 2HB GLU 69 -15.899 5.284 -2.994 503 HG2 GLU 69 1HG GLU 69 -18.500 6.252 -1.945 504 HG3 GLU 69 2HG GLU 69 -17.667 7.232 -3.149 505 H LYS 70 H LYS 70 -14.946 6.349 0.170 506 HA LYS 70 HA LYS 70 -12.481 5.304 -0.139 507 HB2 LYS 70 1HB LYS 70 -13.639 6.442 2.410 508 HB3 LYS 70 2HB LYS 70 -11.920 6.188 2.134 509 HG2 LYS 70 1HG LYS 70 -12.059 7.724 0.192 510 HG3 LYS 70 2HG LYS 70 -13.740 8.046 0.619 511 HD2 LYS 70 1HD LYS 70 -13.158 9.147 2.585 512 HD3 LYS 70 2HD LYS 70 -11.557 8.405 2.640 513 HE2 LYS 70 1HE LYS 70 -10.734 9.800 0.944 514 HE3 LYS 70 2HE LYS 70 -12.350 10.279 0.433 515 HZ1 LYS 70 1HZ LYS 70 -10.856 11.833 1.910 516 HZ2 LYS 70 2HZ LYS 70 -11.536 10.927 3.166 517 HZ3 LYS 70 3HZ LYS 70 -12.536 11.785 2.105 518 H LEU 71 H LEU 71 -14.748 4.299 2.417 519 HA LEU 71 HA LEU 71 -13.166 2.362 3.620 520 HB2 LEU 71 1HB LEU 71 -15.128 2.948 4.740 521 HB3 LEU 71 2HB LEU 71 -16.129 2.680 3.314 522 HG LEU 71 HG LEU 71 -15.695 0.228 3.572 523 HD11 LEU 71 1HD1 LEU 71 -15.011 -0.380 5.978 524 HD12 LEU 71 2HD1 LEU 71 -14.288 1.227 6.020 525 HD13 LEU 71 3HD1 LEU 71 -13.746 0.048 4.826 526 HD21 LEU 71 1HD2 LEU 71 -17.742 0.449 4.422 527 HD22 LEU 71 2HD2 LEU 71 -17.330 1.961 5.232 528 HD23 LEU 71 3HD2 LEU 71 -16.977 0.418 6.011 529 H ASN 72 H ASN 72 -15.692 1.819 1.155 530 HA ASN 72 HA ASN 72 -15.396 -0.852 0.717 531 HB2 ASN 72 1HB ASN 72 -15.826 1.282 -1.387 532 HB3 ASN 72 2HB ASN 72 -16.137 -0.438 -1.614 533 HD21 ASN 72 1HD2 ASN 72 -17.119 2.448 0.096 534 HD22 ASN 72 2HD2 ASN 72 -18.702 1.893 0.513 535 H ASN 73 H ASN 73 -13.335 1.737 -0.500 536 HA ASN 73 HA ASN 73 -11.747 0.065 -2.172 537 HB2 ASN 73 1HB ASN 73 -11.449 2.853 -1.091 538 HB3 ASN 73 2HB ASN 73 -10.118 2.082 -1.948 539 HD21 ASN 73 1HD2 ASN 73 -10.443 3.898 -3.419 540 HD22 ASN 73 2HD2 ASN 73 -11.624 3.749 -4.673 541 H ALA 74 H ALA 74 -11.492 1.186 1.157 542 HA ALA 74 HA ALA 74 -8.872 0.358 1.689 543 HB1 ALA 74 1HB ALA 74 -11.185 0.432 3.622 544 HB2 ALA 74 2HB ALA 74 -9.468 0.470 4.028 545 HB3 ALA 74 3HB ALA 74 -10.200 1.823 3.164 546 H LYS 75 H LYS 75 -11.949 -1.377 2.004 547 HA LYS 75 HA LYS 75 -11.004 -3.713 3.183 548 HB2 LYS 75 1HB LYS 75 -13.215 -3.554 1.130 549 HB3 LYS 75 2HB LYS 75 -13.014 -4.776 2.379 550 HG2 LYS 75 1HG LYS 75 -13.821 -3.433 4.024 551 HG3 LYS 75 2HG LYS 75 -13.249 -1.953 3.251 552 HD2 LYS 75 1HD LYS 75 -15.476 -1.708 2.856 553 HD3 LYS 75 2HD LYS 75 -15.061 -2.673 1.438 554 HE2 LYS 75 1HE LYS 75 -15.801 -4.096 3.942 555 HE3 LYS 75 2HE LYS 75 -17.083 -3.314 3.020 556 HZ1 LYS 75 1HZ LYS 75 -15.160 -5.275 1.893 557 HZ2 LYS 75 2HZ LYS 75 -16.489 -4.596 1.098 558 HZ3 LYS 75 3HZ LYS 75 -16.731 -5.652 2.397 559 H TYR 76 H TYR 76 -11.145 -2.789 -0.226 560 HA TYR 76 HA TYR 76 -10.280 -5.282 -1.255 561 HB2 TYR 76 1HB TYR 76 -11.397 -3.257 -2.462 562 HB3 TYR 76 2HB TYR 76 -9.745 -2.680 -2.652 563 HD1 TYR 76 1HD TYR 76 -11.652 -5.868 -3.120 564 HD2 TYR 76 2HD TYR 76 -8.705 -3.201 -4.637 565 HE1 TYR 76 1HE TYR 76 -11.389 -7.297 -5.105 566 HE2 TYR 76 2HE TYR 76 -8.434 -4.622 -6.627 567 HH TYR 76 HH TYR 76 -10.548 -7.350 -7.237 568 H ALA 77 H ALA 77 -8.542 -2.232 -0.658 569 HA ALA 77 HA ALA 77 -6.025 -2.906 -1.499 570 HB1 ALA 77 1HB ALA 77 -5.499 -0.934 -0.620 571 HB2 ALA 77 2HB ALA 77 -7.146 -0.847 0.005 572 HB3 ALA 77 3HB ALA 77 -5.854 -1.498 1.013 573 H ILE 78 H ILE 78 -7.500 -3.650 1.640 574 HA ILE 78 HA ILE 78 -5.157 -5.066 2.554 575 HB ILE 78 HB ILE 78 -7.918 -4.846 3.756 576 HG12 ILE 78 1HG1 ILE 78 -5.384 -3.585 4.778 577 HG13 ILE 78 2HG1 ILE 78 -6.375 -2.783 3.564 578 HG21 ILE 78 1HG2 ILE 78 -5.758 -6.625 4.360 579 HG22 ILE 78 2HG2 ILE 78 -6.016 -5.521 5.710 580 HG23 ILE 78 3HG2 ILE 78 -7.349 -6.508 5.112 581 HD11 ILE 78 1HD1 ILE 78 -7.800 -3.739 5.952 582 HD12 ILE 78 2HD1 ILE 78 -6.659 -2.417 6.201 583 HD13 ILE 78 3HD1 ILE 78 -7.976 -2.239 5.041 584 H SER 79 H SER 79 -8.292 -5.850 1.187 585 HA SER 79 HA SER 79 -8.339 -8.595 1.741 586 HB2 SER 79 1HB SER 79 -10.310 -7.398 0.925 587 HB3 SER 79 2HB SER 79 -9.512 -7.105 -0.621 588 HG SER 79 HG SER 79 -9.444 -9.724 -0.056 589 H MET 80 H MET 80 -6.924 -6.788 -0.947 590 HA MET 80 HA MET 80 -6.147 -9.052 -2.462 591 HB2 MET 80 1HB MET 80 -6.349 -6.630 -3.247 592 HB3 MET 80 2HB MET 80 -4.772 -6.371 -2.515 593 HG2 MET 80 1HG MET 80 -4.663 -6.795 -4.935 594 HG3 MET 80 2HG MET 80 -3.763 -7.972 -3.983 595 HE1 MET 80 1HE MET 80 -7.622 -7.755 -4.374 596 HE2 MET 80 2HE MET 80 -7.123 -7.352 -6.017 597 HE3 MET 80 3HE MET 80 -7.950 -8.877 -5.695 598 H ALA 81 H ALA 81 -4.516 -7.100 -0.011 599 HA ALA 81 HA ALA 81 -1.933 -7.996 -0.188 600 HB1 ALA 81 1HB ALA 81 -3.618 -7.217 2.161 601 HB2 ALA 81 2HB ALA 81 -1.955 -7.763 2.389 602 HB3 ALA 81 3HB ALA 81 -2.289 -6.342 1.398 603 H ARG 82 H ARG 82 -4.292 -9.413 2.089 604 HA ARG 82 HA ARG 82 -2.780 -11.684 2.686 605 HB2 ARG 82 1HB ARG 82 -4.836 -12.619 3.606 606 HB3 ARG 82 2HB ARG 82 -4.684 -10.922 4.043 607 HG2 ARG 82 1HG ARG 82 -6.236 -10.354 2.200 608 HG3 ARG 82 2HG ARG 82 -6.450 -12.080 1.898 609 HD2 ARG 82 1HD ARG 82 -7.052 -12.169 4.429 610 HD3 ARG 82 2HD ARG 82 -7.328 -10.437 4.238 611 HE ARG 82 HE ARG 82 -8.667 -12.105 2.297 612 HH11 ARG 82 1HH1 ARG 82 -8.860 -10.526 5.393 613 HH12 ARG 82 2HH1 ARG 82 -10.592 -10.498 5.418 614 HH21 ARG 82 1HH2 ARG 82 -10.948 -12.074 2.317 615 HH22 ARG 82 2HH2 ARG 82 -11.779 -11.380 3.669 616 H LYS 83 H LYS 83 -4.932 -10.999 0.031 617 HA LYS 83 HA LYS 83 -5.440 -13.603 -0.863 618 HB2 LYS 83 1HB LYS 83 -6.478 -11.396 -1.655 619 HB3 LYS 83 2HB LYS 83 -5.068 -11.239 -2.695 620 HG2 LYS 83 1HG LYS 83 -6.494 -12.243 -4.146 621 HG3 LYS 83 2HG LYS 83 -5.775 -13.681 -3.418 622 HD2 LYS 83 1HD LYS 83 -8.084 -14.094 -3.394 623 HD3 LYS 83 2HD LYS 83 -7.704 -13.584 -1.746 624 HE2 LYS 83 1HE LYS 83 -8.357 -11.240 -2.495 625 HE3 LYS 83 2HE LYS 83 -9.032 -12.004 -3.934 626 HZ1 LYS 83 1HZ LYS 83 -10.840 -11.943 -2.553 627 HZ2 LYS 83 2HZ LYS 83 -9.933 -12.174 -1.144 628 HZ3 LYS 83 3HZ LYS 83 -10.233 -13.478 -2.179 629 H ILE 84 H ILE 84 -2.959 -11.309 -2.011 630 HA ILE 84 HA ILE 84 -1.638 -13.224 -3.637 631 HB ILE 84 HB ILE 84 0.196 -11.572 -3.760 632 HG12 ILE 84 1HG1 ILE 84 -1.501 -9.859 -1.939 633 HG13 ILE 84 2HG1 ILE 84 -0.111 -10.781 -1.376 634 HG21 ILE 84 1HG2 ILE 84 -1.634 -9.607 -4.345 635 HG22 ILE 84 2HG2 ILE 84 -1.139 -10.910 -5.422 636 HG23 ILE 84 3HG2 ILE 84 -2.593 -11.084 -4.440 637 HD11 ILE 84 1HD1 ILE 84 1.182 -9.508 -3.205 638 HD12 ILE 84 2HD1 ILE 84 -0.192 -8.401 -3.175 639 HD13 ILE 84 3HD1 ILE 84 0.757 -8.671 -1.713 640 H GLY 85 H GLY 85 -1.356 -12.291 -0.287 641 HA2 GLY 85 1HA GLY 85 -0.386 -14.302 0.986 642 HA3 GLY 85 2HA GLY 85 1.033 -13.990 -0.003 643 H ALA 86 H ALA 86 -1.146 -11.685 1.582 644 HA ALA 86 HA ALA 86 1.061 -10.897 3.356 645 HB1 ALA 86 1HB ALA 86 0.353 -8.498 2.972 646 HB2 ALA 86 2HB ALA 86 1.201 -9.283 1.640 647 HB3 ALA 86 3HB ALA 86 -0.551 -9.087 1.577 648 H ARG 87 H ARG 87 0.152 -11.696 5.202 649 HA ARG 87 HA ARG 87 -2.618 -11.210 5.845 650 HB2 ARG 87 1HB ARG 87 -0.412 -12.366 7.560 651 HB3 ARG 87 2HB ARG 87 -2.133 -12.412 7.917 652 HG2 ARG 87 1HG ARG 87 -0.850 -13.712 5.524 653 HG3 ARG 87 2HG ARG 87 -1.248 -14.540 7.031 654 HD2 ARG 87 1HD ARG 87 -3.606 -13.986 6.718 655 HD3 ARG 87 2HD ARG 87 -3.213 -13.137 5.224 656 HE ARG 87 HE ARG 87 -3.082 -15.156 4.149 657 HH11 ARG 87 1HH1 ARG 87 -3.046 -15.682 7.590 658 HH12 ARG 87 2HH1 ARG 87 -3.197 -17.403 7.461 659 HH21 ARG 87 1HH2 ARG 87 -3.280 -17.421 3.966 660 HH22 ARG 87 2HH2 ARG 87 -3.328 -18.391 5.398 661 H VAL 88 H VAL 88 -3.283 -9.300 6.556 662 HA VAL 88 HA VAL 88 -1.547 -7.813 8.417 663 HB VAL 88 HB VAL 88 -2.527 -5.716 7.507 664 HG11 VAL 88 1HG1 VAL 88 -0.404 -6.042 6.694 665 HG12 VAL 88 2HG1 VAL 88 -0.834 -7.541 5.867 666 HG13 VAL 88 3HG1 VAL 88 -1.327 -5.988 5.192 667 HG21 VAL 88 1HG2 VAL 88 -3.834 -5.660 5.566 668 HG22 VAL 88 2HG2 VAL 88 -3.469 -7.339 5.163 669 HG23 VAL 88 3HG2 VAL 88 -4.531 -6.969 6.521 670 H TYR 89 H TYR 89 -2.520 -6.831 10.160 671 HA TYR 89 HA TYR 89 -5.189 -7.804 10.802 672 HB2 TYR 89 1HB TYR 89 -3.270 -6.262 12.555 673 HB3 TYR 89 2HB TYR 89 -4.705 -7.138 13.076 674 HD1 TYR 89 2HD TYR 89 -1.255 -7.483 11.844 675 HD2 TYR 89 1HD TYR 89 -4.668 -9.523 13.356 676 HE1 TYR 89 2HE TYR 89 0.110 -9.499 12.189 677 HE2 TYR 89 1HE TYR 89 -3.312 -11.545 13.706 678 HH TYR 89 HH TYR 89 -0.203 -11.922 12.393 679 H ALA 90 H ALA 90 -3.570 -4.879 9.924 680 HA ALA 90 HA ALA 90 -4.940 -2.807 10.906 681 HB1 ALA 90 1HB ALA 90 -4.758 -1.691 8.706 682 HB2 ALA 90 2HB ALA 90 -3.271 -2.504 9.195 683 HB3 ALA 90 3HB ALA 90 -4.323 -3.241 7.987 684 H LEU 91 H LEU 91 -6.850 -1.633 10.394 685 HA LEU 91 HA LEU 91 -9.020 -3.350 9.394 686 HB2 LEU 91 1HB LEU 91 -8.975 -2.381 11.797 687 HB3 LEU 91 2HB LEU 91 -9.443 -0.871 11.018 688 HG LEU 91 HG LEU 91 -11.419 -2.141 10.060 689 HD11 LEU 91 1HD1 LEU 91 -11.935 -4.088 11.815 690 HD12 LEU 91 2HD1 LEU 91 -10.179 -4.230 11.743 691 HD13 LEU 91 3HD1 LEU 91 -11.135 -4.375 10.269 692 HD21 LEU 91 1HD2 LEU 91 -12.743 -1.740 11.972 693 HD22 LEU 91 2HD2 LEU 91 -11.427 -0.568 12.042 694 HD23 LEU 91 3HD2 LEU 91 -11.384 -2.006 13.065 695 HA PRO 92 HA PRO 92 -9.401 -0.645 5.921 696 HB2 PRO 92 1HB PRO 92 -11.843 -1.481 5.081 697 HB3 PRO 92 2HB PRO 92 -10.369 -2.428 4.844 698 HG2 PRO 92 1HG PRO 92 -12.486 -2.713 6.941 699 HG3 PRO 92 2HG PRO 92 -11.661 -3.974 6.006 700 HD2 PRO 92 1HD PRO 92 -10.974 -3.363 8.554 701 HD3 PRO 92 2HD PRO 92 -9.793 -3.926 7.354 702 H GLU 93 H GLU 93 -11.260 -0.519 8.735 703 HA GLU 93 HA GLU 93 -13.053 1.572 7.828 704 HB2 GLU 93 1HB GLU 93 -12.679 0.039 10.363 705 HB3 GLU 93 2HB GLU 93 -13.505 1.589 10.433 706 HG2 GLU 93 1HG GLU 93 -14.342 -0.546 8.506 707 HG3 GLU 93 2HG GLU 93 -14.920 -0.519 10.171 708 H ASP 94 H ASP 94 -10.017 1.263 9.478 709 HA ASP 94 HA ASP 94 -10.035 4.060 10.309 710 HB2 ASP 94 1HB ASP 94 -7.979 1.879 10.719 711 HB3 ASP 94 2HB ASP 94 -7.856 3.513 11.363 712 H LEU 95 H LEU 95 -8.429 1.911 8.032 713 HA LEU 95 HA LEU 95 -6.365 3.496 7.136 714 HB2 LEU 95 1HB LEU 95 -6.472 1.321 6.293 715 HB3 LEU 95 2HB LEU 95 -8.134 1.520 5.742 716 HG LEU 95 HG LEU 95 -7.329 3.023 3.956 717 HD11 LEU 95 1HD1 LEU 95 -5.239 3.659 5.269 718 HD12 LEU 95 2HD1 LEU 95 -5.059 3.406 3.534 719 HD13 LEU 95 3HD1 LEU 95 -4.546 2.154 4.665 720 HD21 LEU 95 1HD2 LEU 95 -5.985 1.182 2.736 721 HD22 LEU 95 2HD2 LEU 95 -7.654 0.855 3.205 722 HD23 LEU 95 3HD2 LEU 95 -6.325 0.212 4.170 723 H VAL 96 H VAL 96 -9.787 3.742 6.430 724 HA VAL 96 HA VAL 96 -9.763 5.414 4.220 725 HB VAL 96 HB VAL 96 -11.693 5.306 6.535 726 HG11 VAL 96 1HG1 VAL 96 -12.572 7.219 5.819 727 HG12 VAL 96 2HG1 VAL 96 -11.481 7.269 4.432 728 HG13 VAL 96 3HG1 VAL 96 -13.005 6.386 4.326 729 HG21 VAL 96 1HG2 VAL 96 -12.378 4.436 3.785 730 HG22 VAL 96 2HG2 VAL 96 -11.264 3.421 4.703 731 HG23 VAL 96 3HG2 VAL 96 -12.871 3.769 5.342 732 H GLU 97 H GLU 97 -9.382 6.208 7.636 733 HA GLU 97 HA GLU 97 -9.114 9.045 6.992 734 HB2 GLU 97 1HB GLU 97 -9.365 7.515 9.569 735 HB3 GLU 97 2HB GLU 97 -8.854 9.196 9.553 736 HG2 GLU 97 1HG GLU 97 -11.036 9.454 8.072 737 HG3 GLU 97 2HG GLU 97 -11.503 8.010 8.967 738 H VAL 98 H VAL 98 -7.107 7.196 6.070 739 HA VAL 98 HA VAL 98 -4.850 6.711 6.224 740 HB VAL 98 HB VAL 98 -4.790 9.700 6.656 741 HG11 VAL 98 1HG1 VAL 98 -2.706 7.881 6.580 742 HG12 VAL 98 2HG1 VAL 98 -2.757 8.538 4.943 743 HG13 VAL 98 3HG1 VAL 98 -2.587 9.622 6.325 744 HG21 VAL 98 1HG2 VAL 98 -4.581 9.696 4.114 745 HG22 VAL 98 2HG2 VAL 98 -5.197 8.046 4.180 746 HG23 VAL 98 3HG2 VAL 98 -6.179 9.378 4.788 747 H ASN 99 H ASN 99 -5.848 6.021 8.631 748 HA ASN 99 HA ASN 99 -4.530 7.388 10.786 749 HB2 ASN 99 1HB ASN 99 -6.295 5.007 10.514 750 HB3 ASN 99 2HB ASN 99 -5.270 5.094 11.942 751 HD21 ASN 99 1HD2 ASN 99 -7.813 5.082 12.482 752 HD22 ASN 99 2HD2 ASN 99 -8.412 6.649 12.892 753 HA PRO 100 HA PRO 100 -0.664 5.256 9.988 754 HB2 PRO 100 1HB PRO 100 0.751 6.628 11.855 755 HB3 PRO 100 2HB PRO 100 0.360 7.294 10.264 756 HG2 PRO 100 1HG PRO 100 -0.987 7.761 12.897 757 HG3 PRO 100 2HG PRO 100 -0.572 8.930 11.629 758 HD2 PRO 100 1HD PRO 100 -3.073 7.940 11.936 759 HD3 PRO 100 2HD PRO 100 -2.411 8.386 10.351 760 H LYS 101 H LYS 101 -2.782 5.020 12.525 761 HA LYS 101 HA LYS 101 -1.092 3.665 14.417 762 HB2 LYS 101 1HB LYS 101 -4.069 4.068 14.200 763 HB3 LYS 101 2HB LYS 101 -3.357 3.058 15.452 764 HG2 LYS 101 1HG LYS 101 -3.538 5.047 16.560 765 HG3 LYS 101 2HG LYS 101 -1.902 5.188 15.912 766 HD2 LYS 101 1HD LYS 101 -2.704 6.540 14.077 767 HD3 LYS 101 2HD LYS 101 -4.375 6.312 14.596 768 HE2 LYS 101 1HE LYS 101 -2.285 7.587 16.344 769 HE3 LYS 101 2HE LYS 101 -3.280 8.513 15.222 770 HZ1 LYS 101 1HZ LYS 101 -5.237 7.438 16.397 771 HZ2 LYS 101 2HZ LYS 101 -4.391 8.623 17.255 772 HZ3 LYS 101 3HZ LYS 101 -4.142 6.987 17.604 773 H MET 102 H MET 102 -3.138 2.769 11.741 774 HA MET 102 HA MET 102 -2.752 -0.075 12.366 775 HB2 MET 102 1HB MET 102 -4.639 1.237 10.401 776 HB3 MET 102 2HB MET 102 -4.529 -0.490 10.710 777 HG2 MET 102 1HG MET 102 -5.238 1.542 12.808 778 HG3 MET 102 2HG MET 102 -6.424 0.670 11.839 779 HE1 MET 102 1HE MET 102 -6.140 -0.652 15.686 780 HE2 MET 102 2HE MET 102 -4.955 0.608 15.346 781 HE3 MET 102 3HE MET 102 -6.614 0.780 14.771 782 H VAL 103 H VAL 103 -2.323 2.339 9.823 783 HA VAL 103 HA VAL 103 -1.448 0.830 7.719 784 HB VAL 103 HB VAL 103 -0.320 3.472 8.654 785 HG11 VAL 103 1HG1 VAL 103 1.261 3.126 7.113 786 HG12 VAL 103 2HG1 VAL 103 0.410 1.741 6.423 787 HG13 VAL 103 3HG1 VAL 103 -0.019 3.378 5.927 788 HG21 VAL 103 1HG2 VAL 103 -2.839 2.782 7.618 789 HG22 VAL 103 2HG2 VAL 103 -2.178 4.399 7.860 790 HG23 VAL 103 3HG2 VAL 103 -1.968 3.584 6.310 791 H MET 104 H MET 104 0.099 1.261 10.761 792 HA MET 104 HA MET 104 2.761 0.939 10.314 793 HB2 MET 104 1HB MET 104 2.760 -0.494 12.427 794 HB3 MET 104 2HB MET 104 2.069 1.117 12.556 795 HG2 MET 104 1HG MET 104 -0.079 0.333 12.766 796 HG3 MET 104 2HG MET 104 0.285 -1.188 11.954 797 HE1 MET 104 1HE MET 104 -0.100 -3.362 13.717 798 HE2 MET 104 2HE MET 104 -0.745 -2.714 15.226 799 HE3 MET 104 3HE MET 104 -1.293 -2.062 13.680 800 H THR 105 H THR 105 0.274 -1.549 10.091 801 HA THR 105 HA THR 105 2.280 -3.535 9.319 802 HB THR 105 HB THR 105 0.640 -4.280 10.956 803 HG1 THR 105 1HG THR 105 1.132 -6.011 9.775 804 HG21 THR 105 1HG2 THR 105 -1.742 -4.511 10.309 805 HG22 THR 105 2HG2 THR 105 -1.400 -3.604 8.835 806 HG23 THR 105 3HG2 THR 105 -1.219 -2.830 10.409 807 H VAL 106 H VAL 106 -0.574 -1.874 8.071 808 HA VAL 106 HA VAL 106 -1.177 -3.108 5.766 809 HB VAL 106 HB VAL 106 -0.740 -0.134 6.051 810 HG11 VAL 106 1HG1 VAL 106 -1.992 0.203 4.100 811 HG12 VAL 106 2HG1 VAL 106 -0.875 -1.098 3.686 812 HG13 VAL 106 3HG1 VAL 106 -2.557 -1.466 4.069 813 HG21 VAL 106 1HG2 VAL 106 -2.342 -1.297 7.637 814 HG22 VAL 106 2HG2 VAL 106 -3.010 0.026 6.680 815 HG23 VAL 106 3HG2 VAL 106 -3.334 -1.646 6.221 816 H PHE 107 H PHE 107 1.516 -0.792 6.064 817 HA PHE 107 HA PHE 107 2.508 -1.487 3.441 818 HB2 PHE 107 1HB PHE 107 3.232 0.498 5.544 819 HB3 PHE 107 2HB PHE 107 4.471 0.041 4.381 820 HD1 PHE 107 2HD PHE 107 3.044 -0.247 1.899 821 HD2 PHE 107 1HD PHE 107 2.492 2.607 5.007 822 HE1 PHE 107 2HE PHE 107 2.101 1.338 0.271 823 HE2 PHE 107 1HE PHE 107 1.547 4.196 3.384 824 HZ PHE 107 HZ PHE 107 1.352 3.563 1.012 825 H ALA 108 H ALA 108 3.750 -1.720 6.772 826 HA ALA 108 HA ALA 108 6.135 -2.906 6.496 827 HB1 ALA 108 1HB ALA 108 5.776 -4.078 8.576 828 HB2 ALA 108 2HB ALA 108 5.019 -2.487 8.656 829 HB3 ALA 108 3HB ALA 108 4.029 -3.923 8.397 830 H CYS 109 H CYS 109 3.165 -4.880 6.694 831 HA CYS 109 HA CYS 109 4.160 -7.339 6.124 832 HB2 CYS 109 1HB CYS 109 1.702 -6.528 6.487 833 HB3 CYS 109 2HB CYS 109 1.651 -6.469 4.729 834 HG CYS 109 HG CYS 109 1.774 -9.085 4.269 835 H LEU 110 H LEU 110 3.456 -4.782 3.792 836 HA LEU 110 HA LEU 110 4.080 -6.368 1.500 837 HB2 LEU 110 1HB LEU 110 3.785 -3.403 1.920 838 HB3 LEU 110 2HB LEU 110 4.150 -4.120 0.351 839 HG LEU 110 HG LEU 110 1.726 -5.031 1.832 840 HD11 LEU 110 1HD1 LEU 110 0.400 -3.242 1.040 841 HD12 LEU 110 2HD1 LEU 110 1.729 -2.581 0.088 842 HD13 LEU 110 3HD1 LEU 110 1.785 -2.510 1.849 843 HD21 LEU 110 1HD2 LEU 110 0.881 -5.230 -0.492 844 HD22 LEU 110 2HD2 LEU 110 2.317 -6.207 -0.180 845 HD23 LEU 110 3HD2 LEU 110 2.457 -4.691 -1.074 846 H MET 111 H MET 111 5.825 -3.890 3.348 847 HA MET 111 HA MET 111 8.087 -3.550 1.883 848 HB2 MET 111 1HB MET 111 7.606 -3.668 4.831 849 HB3 MET 111 2HB MET 111 9.259 -3.539 4.245 850 HG2 MET 111 1HG MET 111 8.234 -1.367 4.806 851 HG3 MET 111 2HG MET 111 8.772 -1.480 3.132 852 HE1 MET 111 1HE MET 111 6.936 0.546 2.008 853 HE2 MET 111 2HE MET 111 7.679 -0.909 1.345 854 HE3 MET 111 3HE MET 111 5.961 -0.601 1.089 855 H GLY 112 H GLY 112 7.214 -6.366 3.785 856 HA2 GLY 112 1HA GLY 112 9.512 -7.755 4.104 857 HA3 GLY 112 2HA GLY 112 8.015 -8.529 3.608 858 H LYS 113 H LYS 113 7.978 -7.047 1.049 859 HA LYS 113 HA LYS 113 9.515 -8.927 -0.470 860 HB2 LYS 113 1HB LYS 113 7.583 -6.747 -1.069 861 HB3 LYS 113 2HB LYS 113 8.685 -7.220 -2.354 862 HG2 LYS 113 1HG LYS 113 6.827 -8.540 -2.738 863 HG3 LYS 113 2HG LYS 113 7.903 -9.620 -1.848 864 HD2 LYS 113 1HD LYS 113 5.902 -9.956 -0.752 865 HD3 LYS 113 2HD LYS 113 6.638 -8.695 0.241 866 HE2 LYS 113 1HE LYS 113 5.244 -7.039 -0.615 867 HE3 LYS 113 2HE LYS 113 4.841 -7.983 -2.048 868 HZ1 LYS 113 1HZ LYS 113 3.733 -9.570 -0.414 869 HZ2 LYS 113 2HZ LYS 113 2.952 -8.101 -0.720 870 HZ3 LYS 113 3HZ LYS 113 3.832 -8.308 0.709 871 H GLY 114 H GLY 114 9.792 -5.504 0.327 872 HA2 GLY 114 1HA GLY 114 11.629 -4.505 -1.360 873 HA3 GLY 114 2HA GLY 114 11.715 -4.206 0.370 874 H MET 115 H MET 115 12.830 -5.960 1.655 875 HA MET 115 HA MET 115 15.319 -6.619 0.285 876 HB2 MET 115 1HB MET 115 14.551 -6.719 3.206 877 HB3 MET 115 2HB MET 115 16.137 -7.153 2.581 878 HG2 MET 115 1HG MET 115 16.724 -4.996 2.168 879 HG3 MET 115 2HG MET 115 15.063 -4.482 1.881 880 HE1 MET 115 1HE MET 115 14.282 -2.847 3.022 881 HE2 MET 115 2HE MET 115 13.347 -3.712 4.242 882 HE3 MET 115 3HE MET 115 14.451 -2.424 4.726 883 H LYS 116 H LYS 116 12.806 -8.220 2.218 884 HA LYS 116 HA LYS 116 12.075 -10.375 2.264 885 HB2 LYS 116 1HB LYS 116 12.233 -10.071 -0.259 886 HB3 LYS 116 2HB LYS 116 13.787 -10.888 -0.166 887 HG2 LYS 116 1HG LYS 116 12.707 -12.866 0.757 888 HG3 LYS 116 2HG LYS 116 11.144 -12.047 0.695 889 HD2 LYS 116 1HD LYS 116 11.144 -12.014 -1.665 890 HD3 LYS 116 2HD LYS 116 12.856 -12.437 -1.748 891 HE2 LYS 116 1HE LYS 116 10.825 -14.277 -0.519 892 HE3 LYS 116 2HE LYS 116 11.143 -14.273 -2.253 893 HZ1 LYS 116 1HZ LYS 116 12.790 -15.247 -0.069 894 HZ2 LYS 116 2HZ LYS 116 13.618 -14.435 -1.300 895 HZ3 LYS 116 3HZ LYS 116 12.676 -15.791 -1.667 896 H ARG 117 H ARG 117 13.955 -9.903 4.045 897 HA ARG 117 HA ARG 117 16.264 -11.571 3.803 898 HB2 ARG 117 1HB ARG 117 15.060 -9.857 5.908 899 HB3 ARG 117 2HB ARG 117 16.135 -11.140 6.448 900 HG2 ARG 117 1HG ARG 117 17.847 -10.245 4.848 901 HG3 ARG 117 2HG ARG 117 16.777 -8.865 4.593 902 HD2 ARG 117 1HD ARG 117 18.261 -8.138 6.243 903 HD3 ARG 117 2HD ARG 117 16.818 -8.607 7.141 904 HE ARG 117 HE ARG 117 17.998 -10.338 8.095 905 HH11 ARG 117 1HH1 ARG 117 19.842 -8.933 5.497 906 HH12 ARG 117 2HH1 ARG 117 21.299 -9.781 5.899 907 HH21 ARG 117 1HH2 ARG 117 19.910 -11.460 8.633 908 HH22 ARG 117 2HH2 ARG 117 21.336 -11.218 7.682 909 H VAL 118 H VAL 118 13.169 -12.441 3.982 910 HA VAL 118 HA VAL 118 13.006 -14.292 6.086 911 HB VAL 118 HB VAL 118 11.167 -15.323 4.852 912 HG11 VAL 118 1HG1 VAL 118 9.705 -13.446 4.787 913 HG12 VAL 118 2HG1 VAL 118 10.892 -13.136 6.056 914 HG13 VAL 118 3HG1 VAL 118 11.042 -12.336 4.490 915 HG21 VAL 118 1HG2 VAL 118 10.787 -13.823 2.586 916 HG22 VAL 118 2HG2 VAL 118 12.530 -14.096 2.581 917 HG23 VAL 118 3HG2 VAL 118 11.422 -15.467 2.632 918 H SER 119 H SER 119 12.935 -16.661 5.884 919 HA SER 119 HA SER 119 15.355 -17.666 4.817 920 HB2 SER 119 1HB SER 119 14.441 -18.720 6.768 921 HB3 SER 119 2HB SER 119 12.919 -19.056 5.946 922 HG SER 119 HG SER 119 15.452 -20.235 5.504 923 H GLY 120 H GLY 120 15.719 -17.870 2.705 924 HA2 GLY 120 1HA GLY 120 13.511 -18.564 0.914 925 HA3 GLY 120 2HA GLY 120 15.094 -17.977 0.429 926 HA PRO 121 HA PRO 121 14.952 -22.514 -0.446 927 HB2 PRO 121 1HB PRO 121 16.128 -22.310 -2.885 928 HB3 PRO 121 2HB PRO 121 14.387 -22.127 -2.639 929 HG2 PRO 121 1HG PRO 121 16.489 -20.017 -2.945 930 HG3 PRO 121 2HG PRO 121 14.868 -20.094 -3.661 931 HD2 PRO 121 1HD PRO 121 15.431 -18.579 -1.489 932 HD3 PRO 121 2HD PRO 121 13.845 -19.340 -1.738 933 H SER 122 H SER 122 17.477 -20.083 -0.735 934 HA SER 122 HA SER 122 19.732 -21.606 -1.077 935 HB2 SER 122 1HB SER 122 19.701 -19.126 -0.951 936 HB3 SER 122 2HB SER 122 19.483 -19.239 0.795 937 HG SER 122 HG SER 122 21.717 -18.985 -0.119 938 H SER 123 H SER 123 20.041 -23.507 -0.081 939 HA SER 123 HA SER 123 19.555 -23.730 2.792 940 HB2 SER 123 1HB SER 123 18.707 -25.470 1.162 941 HB3 SER 123 2HB SER 123 20.388 -25.928 0.891 942 HG SER 123 HG SER 123 18.832 -26.824 2.764 943 H GLY 124 H GLY 124 21.182 -24.956 4.093 944 HA2 GLY 124 1HA GLY 124 23.811 -23.801 3.610 945 HA3 GLY 124 2HA GLY 124 23.275 -24.597 5.083 Start of MODEL 18 1 H1 GLY 1 H GLY 1 14.306 7.896 -10.907 2 HA2 GLY 1 1HA GLY 1 16.307 6.569 -9.675 3 HA3 GLY 1 2HA GLY 1 17.181 7.571 -10.825 4 H SER 2 H SER 2 14.665 7.814 -8.318 5 HA SER 2 HA SER 2 15.637 10.521 -7.709 6 HB2 SER 2 1HB SER 2 13.270 10.469 -8.177 7 HB3 SER 2 2HB SER 2 13.027 9.145 -7.038 8 HG SER 2 HG SER 2 12.818 10.588 -5.541 9 H SER 3 H SER 3 17.386 10.092 -6.406 10 HA SER 3 HA SER 3 17.437 8.177 -4.339 11 HB2 SER 3 1HB SER 3 19.119 10.518 -5.108 12 HB3 SER 3 2HB SER 3 19.324 9.849 -3.490 13 HG SER 3 HG SER 3 20.474 8.359 -4.400 14 H GLY 4 H GLY 4 17.363 8.464 -2.063 15 HA2 GLY 4 1HA GLY 4 16.457 10.942 -0.922 16 HA3 GLY 4 2HA GLY 4 15.182 9.737 -1.026 17 H SER 5 H SER 5 17.251 11.040 1.063 18 HA SER 5 HA SER 5 18.579 8.939 2.321 19 HB2 SER 5 1HB SER 5 17.384 11.400 3.621 20 HB3 SER 5 2HB SER 5 18.650 10.378 4.302 21 HG SER 5 HG SER 5 19.274 12.391 3.118 22 H SER 6 H SER 6 17.970 7.314 3.608 23 HA SER 6 HA SER 6 15.485 7.393 5.080 24 HB2 SER 6 1HB SER 6 15.886 5.332 2.898 25 HB3 SER 6 2HB SER 6 14.561 5.349 4.061 26 HG SER 6 HG SER 6 13.582 6.645 2.747 27 H GLY 7 H GLY 7 15.906 6.531 6.997 28 HA2 GLY 7 1HA GLY 7 18.298 5.206 7.626 29 HA3 GLY 7 2HA GLY 7 16.872 5.268 8.651 30 H ASN 8 H ASN 8 16.099 3.349 9.183 31 HA ASN 8 HA ASN 8 16.601 1.084 7.377 32 HB2 ASN 8 1HB ASN 8 15.998 1.105 10.343 33 HB3 ASN 8 2HB ASN 8 16.257 -0.342 9.373 34 HD21 ASN 8 1HD2 ASN 8 17.827 2.760 10.080 35 HD22 ASN 8 2HD2 ASN 8 19.427 2.120 10.180 36 H ASP 9 H ASP 9 14.121 2.494 9.491 37 HA ASP 9 HA ASP 9 12.077 0.823 8.248 38 HB2 ASP 9 1HB ASP 9 12.140 2.621 10.652 39 HB3 ASP 9 2HB ASP 9 10.602 2.123 9.954 40 H ASP 10 H ASP 10 13.485 3.834 7.792 41 HA ASP 10 HA ASP 10 11.179 5.291 6.930 42 HB2 ASP 10 1HB ASP 10 13.469 6.207 7.729 43 HB3 ASP 10 2HB ASP 10 13.991 5.917 6.072 44 H ILE 11 H ILE 11 13.005 2.808 5.565 45 HA ILE 11 HA ILE 11 12.821 3.560 2.817 46 HB ILE 11 HB ILE 11 14.420 1.844 3.883 47 HG12 ILE 11 1HG1 ILE 11 13.067 0.847 1.388 48 HG13 ILE 11 2HG1 ILE 11 13.958 2.365 1.387 49 HG21 ILE 11 1HG2 ILE 11 12.034 0.574 4.485 50 HG22 ILE 11 2HG2 ILE 11 12.689 -0.357 3.139 51 HG23 ILE 11 3HG2 ILE 11 13.650 -0.121 4.598 52 HD11 ILE 11 1HD1 ILE 11 15.585 0.933 0.698 53 HD12 ILE 11 2HD1 ILE 11 15.842 0.863 2.442 54 HD13 ILE 11 3HD1 ILE 11 14.947 -0.420 1.630 55 H ILE 12 H ILE 12 10.563 2.435 5.057 56 HA ILE 12 HA ILE 12 8.924 0.765 3.528 57 HB ILE 12 HB ILE 12 8.048 2.717 5.660 58 HG12 ILE 12 1HG1 ILE 12 8.705 -0.209 5.999 59 HG13 ILE 12 2HG1 ILE 12 9.886 1.066 6.274 60 HG21 ILE 12 1HG2 ILE 12 6.121 1.977 4.528 61 HG22 ILE 12 2HG2 ILE 12 6.727 0.327 4.409 62 HG23 ILE 12 3HG2 ILE 12 6.232 0.972 5.973 63 HD11 ILE 12 1HD1 ILE 12 7.247 0.980 7.695 64 HD12 ILE 12 2HD1 ILE 12 8.691 0.172 8.305 65 HD13 ILE 12 3HD1 ILE 12 8.681 1.923 8.101 66 H VAL 13 H VAL 13 9.296 4.229 3.532 67 HA VAL 13 HA VAL 13 6.909 4.676 1.950 68 HB VAL 13 HB VAL 13 9.103 6.564 2.813 69 HG11 VAL 13 1HG1 VAL 13 6.525 7.123 1.353 70 HG12 VAL 13 2HG1 VAL 13 7.569 8.355 2.063 71 HG13 VAL 13 3HG1 VAL 13 8.161 7.354 0.737 72 HG21 VAL 13 1HG2 VAL 13 7.256 7.485 4.247 73 HG22 VAL 13 2HG2 VAL 13 6.305 6.064 3.813 74 HG23 VAL 13 3HG2 VAL 13 7.821 5.876 4.696 75 H ASN 14 H ASN 14 10.423 5.022 1.491 76 HA ASN 14 HA ASN 14 10.394 5.817 -1.174 77 HB2 ASN 14 1HB ASN 14 12.502 6.013 -0.301 78 HB3 ASN 14 2HB ASN 14 12.380 4.514 0.613 79 HD21 ASN 14 1HD2 ASN 14 12.972 5.901 -2.541 80 HD22 ASN 14 2HD2 ASN 14 13.799 4.533 -3.199 81 H TRP 15 H TRP 15 10.439 2.555 0.210 82 HA TRP 15 HA TRP 15 10.768 1.048 -2.074 83 HB2 TRP 15 1HB TRP 15 10.634 0.184 0.280 84 HB3 TRP 15 2HB TRP 15 8.883 0.355 0.186 85 HD1 TRP 15 HD TRP 15 11.759 -1.781 -1.166 86 HE1 TRP 15 1HE TRP 15 10.777 -3.936 -2.172 87 HE3 TRP 15 3HE TRP 15 6.788 -0.620 -0.880 88 HZ2 TRP 15 2HZ TRP 15 8.233 -5.005 -2.766 89 HZ3 TRP 15 3HZ TRP 15 5.145 -2.263 -1.689 90 HH2 TRP 15 HH TRP 15 5.854 -4.409 -2.613 91 H VAL 16 H VAL 16 7.734 2.321 -0.727 92 HA VAL 16 HA VAL 16 5.998 1.222 -2.627 93 HB VAL 16 HB VAL 16 5.711 3.806 -1.088 94 HG11 VAL 16 1HG1 VAL 16 3.926 2.373 -2.962 95 HG12 VAL 16 2HG1 VAL 16 3.191 3.009 -1.488 96 HG13 VAL 16 3HG1 VAL 16 4.039 4.093 -2.592 97 HG21 VAL 16 1HG2 VAL 16 5.636 1.069 -0.278 98 HG22 VAL 16 2HG2 VAL 16 5.405 2.519 0.698 99 HG23 VAL 16 3HG2 VAL 16 4.026 1.767 -0.105 100 H ASN 17 H ASN 17 7.619 4.385 -2.561 101 HA ASN 17 HA ASN 17 6.529 5.486 -4.857 102 HB2 ASN 17 1HB ASN 17 9.150 5.831 -3.448 103 HB3 ASN 17 2HB ASN 17 8.894 6.623 -5.000 104 HD21 ASN 17 1HD2 ASN 17 7.184 6.119 -1.931 105 HD22 ASN 17 2HD2 ASN 17 6.596 7.738 -1.799 106 H GLU 18 H GLU 18 9.544 3.603 -4.578 107 HA GLU 18 HA GLU 18 10.204 3.563 -7.283 108 HB2 GLU 18 1HB GLU 18 10.865 1.869 -4.930 109 HB3 GLU 18 2HB GLU 18 11.224 1.215 -6.521 110 HG2 GLU 18 1HG GLU 18 12.407 3.455 -6.947 111 HG3 GLU 18 2HG GLU 18 12.345 3.649 -5.196 112 H THR 19 H THR 19 8.590 0.972 -5.435 113 HA THR 19 HA THR 19 8.017 -0.818 -7.378 114 HB THR 19 HB THR 19 6.122 0.086 -5.202 115 HG1 THR 19 1HG THR 19 7.350 -1.097 -3.951 116 HG21 THR 19 1HG2 THR 19 5.409 -2.434 -5.554 117 HG22 THR 19 2HG2 THR 19 5.984 -2.127 -7.193 118 HG23 THR 19 3HG2 THR 19 4.691 -1.140 -6.511 119 H LEU 20 H LEU 20 6.384 2.256 -6.857 120 HA LEU 20 HA LEU 20 4.374 1.770 -8.850 121 HB2 LEU 20 1HB LEU 20 5.223 4.275 -7.408 122 HB3 LEU 20 2HB LEU 20 3.864 4.191 -8.529 123 HG LEU 20 HG LEU 20 3.920 2.373 -6.161 124 HD11 LEU 20 1HD1 LEU 20 4.322 4.994 -5.713 125 HD12 LEU 20 2HD1 LEU 20 3.397 3.947 -4.637 126 HD13 LEU 20 3HD1 LEU 20 2.562 4.964 -5.811 127 HD21 LEU 20 1HD2 LEU 20 1.508 2.589 -6.356 128 HD22 LEU 20 2HD2 LEU 20 2.210 2.108 -7.901 129 HD23 LEU 20 3HD2 LEU 20 1.701 3.777 -7.645 130 H ARG 21 H ARG 21 7.342 3.703 -8.658 131 HA ARG 21 HA ARG 21 7.202 4.924 -11.158 132 HB2 ARG 21 1HB ARG 21 8.847 5.417 -9.307 133 HB3 ARG 21 2HB ARG 21 9.743 3.993 -9.819 134 HG2 ARG 21 1HG ARG 21 10.421 4.966 -11.798 135 HG3 ARG 21 2HG ARG 21 9.099 6.135 -11.796 136 HD2 ARG 21 1HD ARG 21 10.168 7.547 -10.349 137 HD3 ARG 21 2HD ARG 21 11.073 6.246 -9.577 138 HE ARG 21 HE ARG 21 12.765 6.624 -11.056 139 HH11 ARG 21 1HH1 ARG 21 9.827 7.949 -12.371 140 HH12 ARG 21 2HH1 ARG 21 10.608 8.665 -13.740 141 HH21 ARG 21 1HH2 ARG 21 13.807 7.563 -12.855 142 HH22 ARG 21 2HH2 ARG 21 12.872 8.445 -14.015 143 H GLU 22 H GLU 22 8.801 1.873 -10.251 144 HA GLU 22 HA GLU 22 9.712 1.205 -12.818 145 HB2 GLU 22 1HB GLU 22 10.094 -0.997 -11.962 146 HB3 GLU 22 2HB GLU 22 10.450 0.144 -10.673 147 HG2 GLU 22 1HG GLU 22 8.502 -0.395 -9.499 148 HG3 GLU 22 2HG GLU 22 7.778 -1.191 -10.896 149 H ALA 23 H ALA 23 6.582 0.992 -11.370 150 HA ALA 23 HA ALA 23 5.583 -0.792 -13.455 151 HB1 ALA 23 1HB ALA 23 3.412 -0.532 -12.154 152 HB2 ALA 23 2HB ALA 23 4.737 -1.361 -11.338 153 HB3 ALA 23 3HB ALA 23 4.369 0.317 -10.941 154 H GLU 24 H GLU 24 5.981 2.506 -12.922 155 HA GLU 24 HA GLU 24 5.391 4.323 -14.171 156 HB2 GLU 24 1HB GLU 24 3.730 2.504 -15.908 157 HB3 GLU 24 2HB GLU 24 4.431 4.059 -16.330 158 HG2 GLU 24 1HG GLU 24 6.545 3.190 -16.595 159 HG3 GLU 24 2HG GLU 24 6.217 1.800 -15.561 160 H LYS 25 H LYS 25 4.019 3.814 -11.866 161 HA LYS 25 HA LYS 25 1.180 4.177 -12.446 162 HB2 LYS 25 1HB LYS 25 2.770 3.396 -10.060 163 HB3 LYS 25 2HB LYS 25 1.261 4.254 -9.769 164 HG2 LYS 25 1HG LYS 25 1.114 1.750 -9.743 165 HG3 LYS 25 2HG LYS 25 -0.013 2.568 -10.828 166 HD2 LYS 25 1HD LYS 25 1.569 2.138 -12.698 167 HD3 LYS 25 2HD LYS 25 2.570 1.202 -11.585 168 HE2 LYS 25 1HE LYS 25 1.273 -0.408 -12.666 169 HE3 LYS 25 2HE LYS 25 0.447 -0.160 -11.129 170 HZ1 LYS 25 1HZ LYS 25 -0.403 0.542 -13.829 171 HZ2 LYS 25 2HZ LYS 25 -0.825 1.619 -12.595 172 HZ3 LYS 25 3HZ LYS 25 -1.318 0.002 -12.512 173 H SER 26 H SER 26 -0.016 5.951 -11.641 174 HA SER 26 HA SER 26 1.562 8.405 -11.481 175 HB2 SER 26 1HB SER 26 -0.475 8.038 -13.047 176 HB3 SER 26 2HB SER 26 -1.442 8.301 -11.597 177 HG SER 26 HG SER 26 -0.611 10.344 -11.420 178 H SER 27 H SER 27 0.954 6.332 -9.271 179 HA SER 27 HA SER 27 -0.312 8.108 -7.313 180 HB2 SER 27 1HB SER 27 -1.114 5.744 -7.534 181 HB3 SER 27 2HB SER 27 0.469 5.204 -6.978 182 HG SER 27 HG SER 27 -1.557 5.804 -5.481 183 H SER 28 H SER 28 0.660 8.048 -5.077 184 HA SER 28 HA SER 28 3.363 7.416 -4.643 185 HB2 SER 28 1HB SER 28 4.384 9.638 -4.678 186 HB3 SER 28 2HB SER 28 3.755 9.231 -6.275 187 HG SER 28 HG SER 28 1.770 10.405 -5.232 188 H ILE 29 H ILE 29 4.168 8.248 -2.575 189 HA ILE 29 HA ILE 29 2.103 9.392 -0.837 190 HB ILE 29 HB ILE 29 2.875 7.736 0.958 191 HG12 ILE 29 1HG1 ILE 29 3.469 5.866 -1.290 192 HG13 ILE 29 2HG1 ILE 29 4.741 6.963 -0.766 193 HG21 ILE 29 1HG2 ILE 29 0.689 7.436 0.346 194 HG22 ILE 29 2HG2 ILE 29 1.086 7.171 -1.351 195 HG23 ILE 29 3HG2 ILE 29 1.374 5.894 -0.169 196 HD11 ILE 29 1HD1 ILE 29 4.056 6.025 1.610 197 HD12 ILE 29 2HD1 ILE 29 3.529 4.656 0.631 198 HD13 ILE 29 3HD1 ILE 29 5.207 5.193 0.565 199 H SER 30 H SER 30 2.910 11.071 0.215 200 HA SER 30 HA SER 30 5.656 11.738 0.179 201 HB2 SER 30 1HB SER 30 3.291 12.852 1.682 202 HB3 SER 30 2HB SER 30 4.917 13.505 1.884 203 HG SER 30 HG SER 30 3.164 13.746 -0.228 204 H SER 31 H SER 31 3.539 10.479 2.730 205 HA SER 31 HA SER 31 5.667 9.082 3.995 206 HB2 SER 31 1HB SER 31 4.909 11.766 5.035 207 HB3 SER 31 2HB SER 31 5.186 10.488 6.219 208 HG SER 31 HG SER 31 7.074 10.718 4.202 209 H PHE 32 H PHE 32 4.911 8.169 6.166 210 HA PHE 32 HA PHE 32 2.715 6.606 5.892 211 HB2 PHE 32 1HB PHE 32 3.915 7.757 8.409 212 HB3 PHE 32 2HB PHE 32 2.631 6.551 8.439 213 HD1 PHE 32 2HD PHE 32 3.220 4.555 6.616 214 HD2 PHE 32 1HD PHE 32 5.982 6.897 8.850 215 HE1 PHE 32 2HE PHE 32 4.895 2.765 6.412 216 HE2 PHE 32 1HE PHE 32 7.663 5.112 8.649 217 HZ PHE 32 HZ PHE 32 7.121 3.042 7.430 218 H LYS 33 H LYS 33 2.767 9.963 6.763 219 HA LYS 33 HA LYS 33 -0.112 9.915 7.337 220 HB2 LYS 33 1HB LYS 33 1.974 12.044 7.839 221 HB3 LYS 33 2HB LYS 33 0.259 12.242 8.171 222 HG2 LYS 33 1HG LYS 33 0.464 10.208 9.673 223 HG3 LYS 33 2HG LYS 33 2.212 10.395 9.506 224 HD2 LYS 33 1HD LYS 33 1.741 11.573 11.454 225 HD3 LYS 33 2HD LYS 33 1.787 12.840 10.226 226 HE2 LYS 33 1HE LYS 33 -0.682 12.687 10.051 227 HE3 LYS 33 2HE LYS 33 -0.672 11.520 11.372 228 HZ1 LYS 33 1HZ LYS 33 0.694 14.041 11.864 229 HZ2 LYS 33 2HZ LYS 33 -0.272 13.113 12.896 230 HZ3 LYS 33 3HZ LYS 33 -0.991 14.120 11.743 231 H ASP 34 H ASP 34 0.576 9.518 4.694 232 HA ASP 34 HA ASP 34 0.441 12.041 3.285 233 HB2 ASP 34 1HB ASP 34 1.736 10.437 2.158 234 HB3 ASP 34 2HB ASP 34 0.555 9.159 2.432 235 HA PRO 35 HA PRO 35 -3.957 12.303 3.159 236 HB2 PRO 35 1HB PRO 35 -4.194 13.991 1.047 237 HB3 PRO 35 2HB PRO 35 -3.653 14.520 2.643 238 HG2 PRO 35 1HG PRO 35 -2.031 13.868 0.213 239 HG3 PRO 35 2HG PRO 35 -1.848 15.215 1.352 240 HD2 PRO 35 1HD PRO 35 -0.296 12.998 1.455 241 HD3 PRO 35 2HD PRO 35 -0.747 13.916 2.906 242 H LYS 36 H LYS 36 -2.309 11.886 0.025 243 HA LYS 36 HA LYS 36 -4.408 10.975 -1.501 244 HB2 LYS 36 1HB LYS 36 -1.468 10.524 -1.537 245 HB3 LYS 36 2HB LYS 36 -2.457 9.466 -2.534 246 HG2 LYS 36 1HG LYS 36 -2.047 11.110 -4.041 247 HG3 LYS 36 2HG LYS 36 -3.506 11.772 -3.300 248 HD2 LYS 36 1HD LYS 36 -2.004 13.570 -3.353 249 HD3 LYS 36 2HD LYS 36 -1.923 12.978 -1.692 250 HE2 LYS 36 1HE LYS 36 0.091 11.675 -2.304 251 HE3 LYS 36 2HE LYS 36 0.027 12.384 -3.917 252 HZ1 LYS 36 1HZ LYS 36 0.567 13.745 -1.346 253 HZ2 LYS 36 2HZ LYS 36 0.143 14.601 -2.741 254 HZ3 LYS 36 3HZ LYS 36 1.555 13.669 -2.718 255 H ILE 37 H ILE 37 -2.596 9.270 0.953 256 HA ILE 37 HA ILE 37 -3.225 6.636 0.386 257 HB ILE 37 HB ILE 37 -2.909 8.009 3.051 258 HG12 ILE 37 1HG1 ILE 37 -1.095 6.268 1.371 259 HG13 ILE 37 2HG1 ILE 37 -0.896 7.985 1.707 260 HG21 ILE 37 1HG2 ILE 37 -3.912 6.204 3.922 261 HG22 ILE 37 2HG2 ILE 37 -3.770 5.283 2.426 262 HG23 ILE 37 3HG2 ILE 37 -2.403 5.376 3.536 263 HD11 ILE 37 1HD1 ILE 37 -1.031 6.739 4.203 264 HD12 ILE 37 2HD1 ILE 37 0.006 5.718 3.206 265 HD13 ILE 37 3HD1 ILE 37 0.389 7.427 3.415 266 H SER 38 H SER 38 -5.232 9.159 1.717 267 HA SER 38 HA SER 38 -7.260 7.754 2.933 268 HB2 SER 38 1HB SER 38 -8.709 9.637 2.447 269 HB3 SER 38 2HB SER 38 -7.093 10.240 2.812 270 HG SER 38 HG SER 38 -8.523 10.702 0.658 271 H THR 39 H THR 39 -6.805 8.375 -0.519 272 HA THR 39 HA THR 39 -9.224 6.983 -1.248 273 HB THR 39 HB THR 39 -8.474 7.325 -3.577 274 HG1 THR 39 1HG THR 39 -6.105 7.941 -2.266 275 HG21 THR 39 1HG2 THR 39 -7.948 9.990 -2.462 276 HG22 THR 39 2HG2 THR 39 -9.399 9.207 -1.836 277 HG23 THR 39 3HG2 THR 39 -9.209 9.454 -3.572 278 H SER 40 H SER 40 -6.148 6.027 -0.353 279 HA SER 40 HA SER 40 -5.078 4.019 -0.352 280 HB2 SER 40 1HB SER 40 -7.672 2.969 -1.509 281 HB3 SER 40 2HB SER 40 -6.375 1.986 -0.829 282 HG SER 40 HG SER 40 -8.245 3.614 0.453 283 H LEU 41 H LEU 41 -5.038 5.836 -2.675 284 HA LEU 41 HA LEU 41 -4.986 4.326 -5.072 285 HB2 LEU 41 1HB LEU 41 -3.949 6.999 -4.235 286 HB3 LEU 41 2HB LEU 41 -3.460 6.321 -5.786 287 HG LEU 41 HG LEU 41 -6.323 6.803 -4.968 288 HD11 LEU 41 1HD1 LEU 41 -4.427 8.482 -6.597 289 HD12 LEU 41 2HD1 LEU 41 -5.272 8.934 -5.118 290 HD13 LEU 41 3HD1 LEU 41 -6.179 8.685 -6.609 291 HD21 LEU 41 1HD2 LEU 41 -5.954 5.032 -6.649 292 HD22 LEU 41 2HD2 LEU 41 -5.107 6.202 -7.662 293 HD23 LEU 41 3HD2 LEU 41 -6.819 6.424 -7.301 294 HA PRO 42 HA PRO 42 -0.194 4.238 -4.333 295 HB2 PRO 42 1HB PRO 42 0.648 4.764 -1.806 296 HB3 PRO 42 2HB PRO 42 0.467 6.017 -3.039 297 HG2 PRO 42 1HG PRO 42 -1.393 5.262 -0.818 298 HG3 PRO 42 2HG PRO 42 -0.921 6.875 -1.381 299 HD2 PRO 42 1HD PRO 42 -3.272 5.723 -2.069 300 HD3 PRO 42 2HD PRO 42 -2.398 6.828 -3.149 301 H VAL 43 H VAL 43 -2.443 3.202 -1.863 302 HA VAL 43 HA VAL 43 -0.833 0.963 -1.016 303 HB VAL 43 HB VAL 43 -3.757 1.449 -0.447 304 HG11 VAL 43 1HG1 VAL 43 -1.707 -0.454 0.535 305 HG12 VAL 43 2HG1 VAL 43 -2.854 0.188 1.712 306 HG13 VAL 43 3HG1 VAL 43 -3.440 -0.678 0.292 307 HG21 VAL 43 1HG2 VAL 43 -2.726 3.394 0.344 308 HG22 VAL 43 2HG2 VAL 43 -2.806 2.345 1.759 309 HG23 VAL 43 3HG2 VAL 43 -1.288 2.525 0.879 310 H LEU 44 H LEU 44 -3.533 1.533 -3.188 311 HA LEU 44 HA LEU 44 -3.956 -1.279 -3.689 312 HB2 LEU 44 1HB LEU 44 -5.077 1.211 -4.959 313 HB3 LEU 44 2HB LEU 44 -5.523 -0.421 -5.451 314 HG LEU 44 HG LEU 44 -5.889 0.466 -2.613 315 HD11 LEU 44 1HD1 LEU 44 -6.957 2.030 -4.416 316 HD12 LEU 44 2HD1 LEU 44 -7.898 1.499 -3.023 317 HD13 LEU 44 3HD1 LEU 44 -8.113 0.708 -4.584 318 HD21 LEU 44 1HD2 LEU 44 -7.935 -1.151 -3.166 319 HD22 LEU 44 2HD2 LEU 44 -6.361 -1.752 -2.645 320 HD23 LEU 44 3HD2 LEU 44 -6.783 -1.752 -4.358 321 H ASP 45 H ASP 45 -2.613 1.489 -5.453 322 HA ASP 45 HA ASP 45 -1.990 0.083 -7.819 323 HB2 ASP 45 1HB ASP 45 -0.850 2.614 -6.630 324 HB3 ASP 45 2HB ASP 45 -0.395 2.003 -8.218 325 H LEU 46 H LEU 46 -0.188 0.670 -4.848 326 HA LEU 46 HA LEU 46 2.326 -0.216 -5.652 327 HB2 LEU 46 1HB LEU 46 2.230 0.828 -3.574 328 HB3 LEU 46 2HB LEU 46 0.897 -0.185 -3.021 329 HG LEU 46 HG LEU 46 2.375 -2.046 -2.682 330 HD11 LEU 46 1HD1 LEU 46 4.914 -0.771 -3.143 331 HD12 LEU 46 2HD1 LEU 46 3.955 -0.813 -4.622 332 HD13 LEU 46 3HD1 LEU 46 4.300 -2.308 -3.754 333 HD21 LEU 46 1HD2 LEU 46 3.544 -1.268 -0.824 334 HD22 LEU 46 2HD2 LEU 46 2.244 -0.092 -1.016 335 HD23 LEU 46 3HD2 LEU 46 3.875 0.298 -1.566 336 H ILE 47 H ILE 47 -0.482 -2.033 -4.532 337 HA ILE 47 HA ILE 47 0.796 -4.545 -4.326 338 HB ILE 47 HB ILE 47 -2.114 -3.932 -4.855 339 HG12 ILE 47 1HG1 ILE 47 -0.893 -4.735 -2.224 340 HG13 ILE 47 2HG1 ILE 47 -0.950 -3.047 -2.721 341 HG21 ILE 47 1HG2 ILE 47 -2.101 -6.142 -5.352 342 HG22 ILE 47 2HG2 ILE 47 -0.624 -6.451 -4.442 343 HG23 ILE 47 3HG2 ILE 47 -2.163 -6.289 -3.596 344 HD11 ILE 47 1HD1 ILE 47 -3.510 -4.395 -2.992 345 HD12 ILE 47 2HD1 ILE 47 -2.895 -4.385 -1.338 346 HD13 ILE 47 3HD1 ILE 47 -3.105 -2.867 -2.210 347 H ASP 48 H ASP 48 -1.299 -3.216 -6.888 348 HA ASP 48 HA ASP 48 -1.100 -5.327 -8.680 349 HB2 ASP 48 1HB ASP 48 -2.701 -3.518 -8.988 350 HB3 ASP 48 2HB ASP 48 -1.390 -2.372 -9.259 351 H ALA 49 H ALA 49 0.991 -2.490 -8.315 352 HA ALA 49 HA ALA 49 2.644 -2.574 -10.428 353 HB1 ALA 49 1HB ALA 49 3.346 -0.982 -8.979 354 HB2 ALA 49 2HB ALA 49 3.103 -2.004 -7.562 355 HB3 ALA 49 3HB ALA 49 4.531 -2.222 -8.573 356 H ILE 50 H ILE 50 3.043 -4.673 -7.575 357 HA ILE 50 HA ILE 50 5.143 -6.194 -8.794 358 HB ILE 50 HB ILE 50 3.496 -6.940 -6.377 359 HG12 ILE 50 1HG1 ILE 50 6.131 -5.460 -6.426 360 HG13 ILE 50 2HG1 ILE 50 4.572 -4.664 -6.242 361 HG21 ILE 50 1HG2 ILE 50 6.295 -7.722 -6.450 362 HG22 ILE 50 2HG2 ILE 50 4.858 -8.686 -6.109 363 HG23 ILE 50 3HG2 ILE 50 5.359 -8.409 -7.777 364 HD11 ILE 50 1HD1 ILE 50 6.167 -5.566 -4.211 365 HD12 ILE 50 2HD1 ILE 50 4.450 -5.186 -4.084 366 HD13 ILE 50 3HD1 ILE 50 4.966 -6.849 -4.363 367 H GLN 51 H GLN 51 1.749 -6.890 -7.963 368 HA GLN 51 HA GLN 51 1.835 -9.124 -9.883 369 HB2 GLN 51 1HB GLN 51 1.381 -9.622 -7.415 370 HB3 GLN 51 2HB GLN 51 -0.170 -8.828 -7.654 371 HG2 GLN 51 1HG GLN 51 -0.635 -11.089 -7.920 372 HG3 GLN 51 2HG GLN 51 -0.522 -10.474 -9.568 373 HE21 GLN 51 1HE2 GLN 51 -0.261 -12.886 -9.842 374 HE22 GLN 51 2HE2 GLN 51 1.355 -13.497 -9.827 375 HA PRO 52 HA PRO 52 -0.889 -6.163 -11.990 376 HB2 PRO 52 1HB PRO 52 -0.511 -7.252 -14.448 377 HB3 PRO 52 2HB PRO 52 0.625 -6.111 -13.717 378 HG2 PRO 52 1HG PRO 52 0.766 -9.098 -13.857 379 HG3 PRO 52 2HG PRO 52 2.051 -7.903 -14.116 380 HD2 PRO 52 1HD PRO 52 1.779 -9.267 -11.794 381 HD3 PRO 52 2HD PRO 52 2.407 -7.608 -11.858 382 H GLY 53 H GLY 53 -3.028 -6.429 -12.076 383 HA2 GLY 53 1HA GLY 53 -4.839 -7.671 -13.252 384 HA3 GLY 53 2HA GLY 53 -4.068 -9.134 -12.657 385 H SER 54 H SER 54 -3.528 -8.436 -10.040 386 HA SER 54 HA SER 54 -5.820 -9.095 -8.695 387 HB2 SER 54 1HB SER 54 -4.667 -7.886 -6.697 388 HB3 SER 54 2HB SER 54 -3.861 -9.270 -7.435 389 HG SER 54 HG SER 54 -3.283 -6.808 -8.555 390 H ILE 55 H ILE 55 -4.640 -5.859 -9.482 391 HA ILE 55 HA ILE 55 -7.022 -4.664 -8.278 392 HB ILE 55 HB ILE 55 -4.624 -3.314 -9.524 393 HG12 ILE 55 1HG1 ILE 55 -4.166 -4.632 -7.433 394 HG13 ILE 55 2HG1 ILE 55 -3.846 -2.907 -7.288 395 HG21 ILE 55 1HG2 ILE 55 -6.103 -1.613 -9.624 396 HG22 ILE 55 2HG2 ILE 55 -7.173 -2.330 -8.421 397 HG23 ILE 55 3HG2 ILE 55 -5.724 -1.465 -7.908 398 HD11 ILE 55 1HD1 ILE 55 -6.080 -2.665 -6.212 399 HD12 ILE 55 2HD1 ILE 55 -6.204 -4.425 -6.212 400 HD13 ILE 55 3HD1 ILE 55 -4.922 -3.631 -5.299 401 H ASN 56 H ASN 56 -8.631 -3.724 -9.421 402 HA ASN 56 HA ASN 56 -8.340 -3.578 -12.344 403 HB2 ASN 56 1HB ASN 56 -9.749 -5.562 -11.312 404 HB3 ASN 56 2HB ASN 56 -10.985 -4.317 -11.164 405 HD21 ASN 56 1HD2 ASN 56 -11.843 -3.382 -13.026 406 HD22 ASN 56 2HD2 ASN 56 -11.677 -4.123 -14.578 407 H TYR 57 H TYR 57 -7.997 -1.336 -12.166 408 HA TYR 57 HA TYR 57 -9.307 0.563 -10.756 409 HB2 TYR 57 1HB TYR 57 -8.547 0.731 -13.679 410 HB3 TYR 57 2HB TYR 57 -8.925 2.113 -12.658 411 HD1 TYR 57 2HD TYR 57 -7.525 1.646 -10.203 412 HD2 TYR 57 1HD TYR 57 -6.293 0.742 -14.174 413 HE1 TYR 57 2HE TYR 57 -5.172 1.771 -9.496 414 HE2 TYR 57 1HE TYR 57 -3.937 0.862 -13.477 415 HH TYR 57 HH TYR 57 -2.962 0.829 -10.285 416 H ASP 58 H ASP 58 -10.486 -0.990 -13.709 417 HA ASP 58 HA ASP 58 -12.706 0.466 -14.310 418 HB2 ASP 58 1HB ASP 58 -11.765 -1.822 -15.259 419 HB3 ASP 58 2HB ASP 58 -13.029 -2.502 -14.238 420 H LEU 59 H LEU 59 -12.434 -1.991 -11.773 421 HA LEU 59 HA LEU 59 -15.165 -1.591 -10.920 422 HB2 LEU 59 1HB LEU 59 -13.024 -3.094 -9.444 423 HB3 LEU 59 2HB LEU 59 -14.771 -3.297 -9.331 424 HG LEU 59 HG LEU 59 -13.103 -4.010 -11.742 425 HD11 LEU 59 1HD1 LEU 59 -13.883 -5.519 -9.319 426 HD12 LEU 59 2HD1 LEU 59 -12.461 -5.680 -10.351 427 HD13 LEU 59 3HD1 LEU 59 -14.008 -6.356 -10.865 428 HD21 LEU 59 1HD2 LEU 59 -15.471 -5.389 -11.858 429 HD22 LEU 59 2HD2 LEU 59 -15.089 -3.924 -12.762 430 HD23 LEU 59 3HD2 LEU 59 -15.968 -3.815 -11.237 431 H LEU 60 H LEU 60 -11.954 -0.599 -9.927 432 HA LEU 60 HA LEU 60 -12.602 0.401 -7.379 433 HB2 LEU 60 1HB LEU 60 -10.471 1.397 -9.264 434 HB3 LEU 60 2HB LEU 60 -10.528 1.646 -7.520 435 HG LEU 60 HG LEU 60 -10.205 -1.038 -8.862 436 HD11 LEU 60 1HD1 LEU 60 -8.153 -0.191 -9.302 437 HD12 LEU 60 2HD1 LEU 60 -7.873 -0.634 -7.619 438 HD13 LEU 60 3HD1 LEU 60 -8.264 1.034 -8.038 439 HD21 LEU 60 1HD2 LEU 60 -11.166 -0.573 -6.390 440 HD22 LEU 60 2HD2 LEU 60 -9.435 -0.587 -6.052 441 HD23 LEU 60 3HD2 LEU 60 -10.195 -1.984 -6.814 442 H LYS 61 H LYS 61 -12.943 2.551 -6.672 443 HA LYS 61 HA LYS 61 -14.662 4.065 -8.405 444 HB2 LYS 61 1HB LYS 61 -13.659 4.571 -5.600 445 HB3 LYS 61 2HB LYS 61 -14.801 5.616 -6.434 446 HG2 LYS 61 1HG LYS 61 -15.244 2.710 -5.779 447 HG3 LYS 61 2HG LYS 61 -15.919 4.082 -4.899 448 HD2 LYS 61 1HD LYS 61 -17.091 4.792 -6.941 449 HD3 LYS 61 2HD LYS 61 -16.439 3.389 -7.791 450 HE2 LYS 61 1HE LYS 61 -17.543 1.985 -5.974 451 HE3 LYS 61 2HE LYS 61 -18.409 3.452 -5.520 452 HZ1 LYS 61 1HZ LYS 61 -19.797 3.206 -7.217 453 HZ2 LYS 61 2HZ LYS 61 -19.156 1.658 -7.444 454 HZ3 LYS 61 3HZ LYS 61 -18.543 2.963 -8.328 455 H THR 62 H THR 62 -12.011 5.318 -6.399 456 HA THR 62 HA THR 62 -10.453 6.934 -6.777 457 HB THR 62 HB THR 62 -9.129 6.768 -8.714 458 HG1 THR 62 1HG THR 62 -10.182 5.485 -10.566 459 HG21 THR 62 1HG2 THR 62 -10.451 4.090 -8.267 460 HG22 THR 62 2HG2 THR 62 -9.030 4.722 -7.434 461 HG23 THR 62 3HG2 THR 62 -8.944 4.329 -9.151 462 H GLU 63 H GLU 63 -13.153 7.766 -6.898 463 HA GLU 63 HA GLU 63 -12.813 10.241 -8.342 464 HB2 GLU 63 1HB GLU 63 -15.050 9.987 -9.498 465 HB3 GLU 63 2HB GLU 63 -13.734 9.024 -10.155 466 HG2 GLU 63 1HG GLU 63 -14.620 7.044 -9.400 467 HG3 GLU 63 2HG GLU 63 -15.546 7.824 -8.118 468 H ASN 64 H ASN 64 -13.277 11.650 -6.791 469 HA ASN 64 HA ASN 64 -14.229 12.606 -4.946 470 HB2 ASN 64 1HB ASN 64 -16.679 12.864 -5.096 471 HB3 ASN 64 2HB ASN 64 -15.895 13.159 -6.645 472 HD21 ASN 64 1HD2 ASN 64 -16.472 11.979 -8.363 473 HD22 ASN 64 2HD2 ASN 64 -17.596 10.667 -8.325 474 H LEU 65 H LEU 65 -13.230 10.224 -4.210 475 HA LEU 65 HA LEU 65 -15.047 8.388 -3.092 476 HB2 LEU 65 1HB LEU 65 -12.166 9.031 -2.561 477 HB3 LEU 65 2HB LEU 65 -13.026 7.829 -1.600 478 HG LEU 65 HG LEU 65 -13.092 7.528 -4.554 479 HD11 LEU 65 1HD1 LEU 65 -10.937 6.886 -4.843 480 HD12 LEU 65 2HD1 LEU 65 -10.743 6.379 -3.165 481 HD13 LEU 65 3HD1 LEU 65 -10.682 8.091 -3.581 482 HD21 LEU 65 1HD2 LEU 65 -12.432 5.167 -3.158 483 HD22 LEU 65 2HD2 LEU 65 -13.967 5.591 -3.918 484 HD23 LEU 65 3HD2 LEU 65 -13.682 5.990 -2.223 485 H ASN 66 H ASN 66 -15.669 8.059 -0.917 486 HA ASN 66 HA ASN 66 -15.220 10.214 0.984 487 HB2 ASN 66 1HB ASN 66 -17.452 10.837 1.274 488 HB3 ASN 66 2HB ASN 66 -17.322 10.668 -0.473 489 HD21 ASN 66 1HD2 ASN 66 -18.231 8.842 -1.476 490 HD22 ASN 66 2HD2 ASN 66 -19.472 7.920 -0.703 491 H ASP 67 H ASP 67 -16.437 9.664 3.106 492 HA ASP 67 HA ASP 67 -15.420 7.532 4.349 493 HB2 ASP 67 1HB ASP 67 -16.868 9.258 5.416 494 HB3 ASP 67 2HB ASP 67 -18.280 8.419 4.778 495 H ASP 68 H ASP 68 -18.099 7.438 2.113 496 HA ASP 68 HA ASP 68 -18.798 4.706 2.694 497 HB2 ASP 68 1HB ASP 68 -20.267 6.640 1.681 498 HB3 ASP 68 2HB ASP 68 -19.593 6.077 0.155 499 H GLU 69 H GLU 69 -17.674 6.216 -0.339 500 HA GLU 69 HA GLU 69 -16.884 3.836 -1.565 501 HB2 GLU 69 1HB GLU 69 -15.594 6.518 -2.058 502 HB3 GLU 69 2HB GLU 69 -15.777 5.186 -3.191 503 HG2 GLU 69 1HG GLU 69 -18.338 5.593 -2.724 504 HG3 GLU 69 2HG GLU 69 -17.761 7.202 -2.293 505 H LYS 70 H LYS 70 -14.795 6.292 -0.035 506 HA LYS 70 HA LYS 70 -12.349 5.198 -0.219 507 HB2 LYS 70 1HB LYS 70 -13.612 6.463 2.213 508 HB3 LYS 70 2HB LYS 70 -11.899 6.080 2.116 509 HG2 LYS 70 1HG LYS 70 -11.873 7.506 0.002 510 HG3 LYS 70 2HG LYS 70 -13.459 8.082 0.521 511 HD2 LYS 70 1HD LYS 70 -12.573 9.002 2.516 512 HD3 LYS 70 2HD LYS 70 -11.033 8.169 2.300 513 HE2 LYS 70 1HE LYS 70 -10.410 9.570 0.512 514 HE3 LYS 70 2HE LYS 70 -12.049 10.190 0.323 515 HZ1 LYS 70 1HZ LYS 70 -9.957 11.054 2.097 516 HZ2 LYS 70 2HZ LYS 70 -11.447 10.853 2.871 517 HZ3 LYS 70 3HZ LYS 70 -11.318 11.892 1.542 518 H LEU 71 H LEU 71 -14.735 4.267 2.253 519 HA LEU 71 HA LEU 71 -13.241 2.350 3.583 520 HB2 LEU 71 1HB LEU 71 -15.301 3.009 4.517 521 HB3 LEU 71 2HB LEU 71 -16.188 2.582 3.056 522 HG LEU 71 HG LEU 71 -15.723 0.190 3.536 523 HD11 LEU 71 1HD1 LEU 71 -15.057 -0.285 5.943 524 HD12 LEU 71 2HD1 LEU 71 -14.462 1.374 5.989 525 HD13 LEU 71 3HD1 LEU 71 -13.775 0.224 4.844 526 HD21 LEU 71 1HD2 LEU 71 -17.018 1.126 6.009 527 HD22 LEU 71 2HD2 LEU 71 -17.606 0.026 4.762 528 HD23 LEU 71 3HD2 LEU 71 -17.682 1.771 4.507 529 H ASN 72 H ASN 72 -15.553 1.794 0.922 530 HA ASN 72 HA ASN 72 -15.193 -0.911 0.581 531 HB2 ASN 72 1HB ASN 72 -15.656 1.195 -1.542 532 HB3 ASN 72 2HB ASN 72 -15.845 -0.536 -1.799 533 HD21 ASN 72 1HD2 ASN 72 -17.098 2.272 -0.156 534 HD22 ASN 72 2HD2 ASN 72 -18.648 1.605 0.217 535 H ASN 73 H ASN 73 -13.227 1.732 -0.705 536 HA ASN 73 HA ASN 73 -11.513 0.069 -2.250 537 HB2 ASN 73 1HB ASN 73 -11.514 2.919 -1.380 538 HB3 ASN 73 2HB ASN 73 -9.989 2.232 -1.930 539 HD21 ASN 73 1HD2 ASN 73 -10.659 4.154 -3.440 540 HD22 ASN 73 2HD2 ASN 73 -11.423 3.664 -4.911 541 H ALA 74 H ALA 74 -11.527 1.151 1.068 542 HA ALA 74 HA ALA 74 -8.822 0.430 1.640 543 HB1 ALA 74 1HB ALA 74 -9.489 0.719 4.000 544 HB2 ALA 74 2HB ALA 74 -9.932 2.096 2.989 545 HB3 ALA 74 3HB ALA 74 -11.161 0.927 3.477 546 H LYS 75 H LYS 75 -11.969 -1.124 2.148 547 HA LYS 75 HA LYS 75 -10.980 -3.397 3.501 548 HB2 LYS 75 1HB LYS 75 -13.499 -3.061 1.862 549 HB3 LYS 75 2HB LYS 75 -13.166 -4.418 2.930 550 HG2 LYS 75 1HG LYS 75 -13.485 -3.184 4.829 551 HG3 LYS 75 2HG LYS 75 -13.045 -1.664 4.048 552 HD2 LYS 75 1HD LYS 75 -15.392 -1.599 4.466 553 HD3 LYS 75 2HD LYS 75 -15.173 -1.834 2.729 554 HE2 LYS 75 1HE LYS 75 -16.907 -3.307 3.456 555 HE3 LYS 75 2HE LYS 75 -15.484 -4.284 3.100 556 HZ1 LYS 75 1HZ LYS 75 -14.986 -4.185 5.535 557 HZ2 LYS 75 2HZ LYS 75 -16.373 -5.063 5.128 558 HZ3 LYS 75 3HZ LYS 75 -16.518 -3.503 5.767 559 H TYR 76 H TYR 76 -11.403 -2.632 0.103 560 HA TYR 76 HA TYR 76 -10.993 -5.265 -0.879 561 HB2 TYR 76 1HB TYR 76 -12.064 -3.377 -2.150 562 HB3 TYR 76 2HB TYR 76 -10.462 -2.673 -2.339 563 HD1 TYR 76 1HD TYR 76 -11.894 -6.111 -2.728 564 HD2 TYR 76 2HD TYR 76 -9.630 -2.955 -4.464 565 HE1 TYR 76 1HE TYR 76 -11.536 -7.483 -4.737 566 HE2 TYR 76 2HE TYR 76 -9.265 -4.318 -6.479 567 HH TYR 76 HH TYR 76 -9.257 -6.681 -7.126 568 H ALA 77 H ALA 77 -8.848 -2.466 -0.479 569 HA ALA 77 HA ALA 77 -6.534 -3.459 -1.602 570 HB1 ALA 77 1HB ALA 77 -5.353 -1.825 -0.394 571 HB2 ALA 77 2HB ALA 77 -6.965 -1.149 -0.626 572 HB3 ALA 77 3HB ALA 77 -6.518 -1.843 0.931 573 H ILE 78 H ILE 78 -7.330 -3.589 1.878 574 HA ILE 78 HA ILE 78 -5.261 -5.143 2.763 575 HB ILE 78 HB ILE 78 -8.133 -5.310 3.684 576 HG12 ILE 78 1HG1 ILE 78 -5.815 -3.638 4.676 577 HG13 ILE 78 2HG1 ILE 78 -7.210 -3.039 3.786 578 HG21 ILE 78 1HG2 ILE 78 -6.135 -7.039 4.336 579 HG22 ILE 78 2HG2 ILE 78 -5.984 -5.825 5.604 580 HG23 ILE 78 3HG2 ILE 78 -7.517 -6.662 5.363 581 HD11 ILE 78 1HD1 ILE 78 -6.898 -3.573 6.611 582 HD12 ILE 78 2HD1 ILE 78 -8.115 -2.617 5.765 583 HD13 ILE 78 3HD1 ILE 78 -8.324 -4.360 5.936 584 H SER 79 H SER 79 -8.237 -6.222 1.196 585 HA SER 79 HA SER 79 -7.889 -8.983 1.572 586 HB2 SER 79 1HB SER 79 -10.020 -8.019 0.845 587 HB3 SER 79 2HB SER 79 -9.289 -7.526 -0.683 588 HG SER 79 HG SER 79 -9.080 -10.212 0.018 589 H MET 80 H MET 80 -7.279 -7.083 -1.389 590 HA MET 80 HA MET 80 -6.085 -8.976 -2.941 591 HB2 MET 80 1HB MET 80 -5.693 -6.029 -2.680 592 HB3 MET 80 2HB MET 80 -4.581 -6.932 -3.701 593 HG2 MET 80 1HG MET 80 -6.497 -5.939 -4.915 594 HG3 MET 80 2HG MET 80 -6.356 -7.685 -5.097 595 HE1 MET 80 1HE MET 80 -9.661 -8.322 -5.320 596 HE2 MET 80 2HE MET 80 -7.979 -8.849 -5.395 597 HE3 MET 80 3HE MET 80 -8.998 -9.340 -4.041 598 H ALA 81 H ALA 81 -4.442 -6.924 -0.543 599 HA ALA 81 HA ALA 81 -1.860 -7.936 -0.908 600 HB1 ALA 81 1HB ALA 81 -2.120 -7.270 1.813 601 HB2 ALA 81 2HB ALA 81 -1.472 -6.274 0.508 602 HB3 ALA 81 3HB ALA 81 -3.184 -6.181 0.922 603 H ARG 82 H ARG 82 -3.987 -8.670 1.863 604 HA ARG 82 HA ARG 82 -2.536 -10.885 2.749 605 HB2 ARG 82 1HB ARG 82 -4.358 -11.350 4.191 606 HB3 ARG 82 2HB ARG 82 -4.320 -9.601 4.007 607 HG2 ARG 82 1HG ARG 82 -6.545 -9.951 3.740 608 HG3 ARG 82 2HG ARG 82 -6.031 -10.132 2.061 609 HD2 ARG 82 1HD ARG 82 -6.038 -12.520 2.250 610 HD3 ARG 82 2HD ARG 82 -6.319 -12.429 3.988 611 HE ARG 82 HE ARG 82 -8.364 -11.186 2.381 612 HH11 ARG 82 1HH1 ARG 82 -7.263 -14.123 3.890 613 HH12 ARG 82 2HH1 ARG 82 -8.841 -14.837 3.952 614 HH21 ARG 82 1HH2 ARG 82 -10.446 -12.115 2.456 615 HH22 ARG 82 2HH2 ARG 82 -10.651 -13.695 3.134 616 H LYS 83 H LYS 83 -4.402 -10.556 -0.024 617 HA LYS 83 HA LYS 83 -5.223 -13.335 -0.180 618 HB2 LYS 83 1HB LYS 83 -6.678 -11.562 -1.079 619 HB3 LYS 83 2HB LYS 83 -5.421 -11.115 -2.225 620 HG2 LYS 83 1HG LYS 83 -6.400 -13.923 -2.207 621 HG3 LYS 83 2HG LYS 83 -7.415 -12.669 -2.923 622 HD2 LYS 83 1HD LYS 83 -5.239 -11.992 -4.174 623 HD3 LYS 83 2HD LYS 83 -4.703 -13.621 -3.759 624 HE2 LYS 83 1HE LYS 83 -6.294 -14.626 -5.085 625 HE3 LYS 83 2HE LYS 83 -7.389 -13.247 -4.999 626 HZ1 LYS 83 1HZ LYS 83 -4.877 -13.421 -6.572 627 HZ2 LYS 83 2HZ LYS 83 -5.805 -12.016 -6.410 628 HZ3 LYS 83 3HZ LYS 83 -6.453 -13.374 -7.183 629 H ILE 84 H ILE 84 -2.885 -11.173 -1.721 630 HA ILE 84 HA ILE 84 -1.849 -13.246 -3.431 631 HB ILE 84 HB ILE 84 -0.170 -11.606 -4.106 632 HG12 ILE 84 1HG1 ILE 84 -1.445 -9.680 -2.163 633 HG13 ILE 84 2HG1 ILE 84 0.008 -10.596 -1.776 634 HG21 ILE 84 1HG2 ILE 84 -2.086 -11.377 -5.380 635 HG22 ILE 84 2HG2 ILE 84 -3.046 -10.800 -4.019 636 HG23 ILE 84 3HG2 ILE 84 -1.851 -9.741 -4.766 637 HD11 ILE 84 1HD1 ILE 84 1.318 -9.311 -3.073 638 HD12 ILE 84 2HD1 ILE 84 0.074 -9.093 -4.305 639 HD13 ILE 84 3HD1 ILE 84 0.030 -8.132 -2.826 640 H GLY 85 H GLY 85 -1.273 -12.139 -0.234 641 HA2 GLY 85 1HA GLY 85 0.015 -13.860 1.076 642 HA3 GLY 85 2HA GLY 85 1.260 -13.661 -0.150 643 H ALA 86 H ALA 86 -0.452 -12.057 2.478 644 HA ALA 86 HA ALA 86 1.901 -10.754 3.380 645 HB1 ALA 86 1HB ALA 86 0.068 -9.240 1.616 646 HB2 ALA 86 2HB ALA 86 0.683 -8.408 3.045 647 HB3 ALA 86 3HB ALA 86 1.807 -9.073 1.859 648 H ARG 87 H ARG 87 1.624 -10.943 5.498 649 HA ARG 87 HA ARG 87 -0.873 -11.276 6.758 650 HB2 ARG 87 1HB ARG 87 1.097 -12.179 7.787 651 HB3 ARG 87 2HB ARG 87 1.851 -10.591 7.864 652 HG2 ARG 87 1HG ARG 87 1.093 -11.187 10.050 653 HG3 ARG 87 2HG ARG 87 0.072 -9.883 9.441 654 HD2 ARG 87 1HD ARG 87 -1.747 -11.283 9.120 655 HD3 ARG 87 2HD ARG 87 -0.745 -12.732 9.056 656 HE ARG 87 HE ARG 87 -1.830 -11.477 11.404 657 HH11 ARG 87 1HH1 ARG 87 0.677 -13.547 10.159 658 HH12 ARG 87 2HH1 ARG 87 0.955 -14.339 11.675 659 HH21 ARG 87 1HH2 ARG 87 -1.473 -12.512 13.404 660 HH22 ARG 87 2HH2 ARG 87 -0.269 -13.751 13.520 661 H VAL 88 H VAL 88 -2.272 -9.599 6.329 662 HA VAL 88 HA VAL 88 -1.468 -6.906 7.187 663 HB VAL 88 HB VAL 88 -3.873 -7.737 5.558 664 HG11 VAL 88 1HG1 VAL 88 -2.779 -5.019 6.272 665 HG12 VAL 88 2HG1 VAL 88 -4.055 -5.311 5.088 666 HG13 VAL 88 3HG1 VAL 88 -4.317 -5.713 6.786 667 HG21 VAL 88 1HG2 VAL 88 -1.935 -6.082 4.206 668 HG22 VAL 88 2HG2 VAL 88 -1.204 -7.584 4.770 669 HG23 VAL 88 3HG2 VAL 88 -2.621 -7.634 3.722 670 H TYR 89 H TYR 89 -1.719 -7.178 9.418 671 HA TYR 89 HA TYR 89 -4.340 -7.961 10.430 672 HB2 TYR 89 1HB TYR 89 -1.953 -8.594 11.389 673 HB3 TYR 89 2HB TYR 89 -2.134 -7.058 12.229 674 HD1 TYR 89 2HD TYR 89 -4.279 -10.038 11.494 675 HD2 TYR 89 1HD TYR 89 -2.925 -7.220 14.380 676 HE1 TYR 89 2HE TYR 89 -5.651 -11.145 13.210 677 HE2 TYR 89 1HE TYR 89 -4.292 -8.319 16.104 678 HH TYR 89 HH TYR 89 -6.656 -9.952 15.813 679 H ALA 90 H ALA 90 -4.682 -5.718 9.043 680 HA ALA 90 HA ALA 90 -4.984 -3.649 11.120 681 HB1 ALA 90 1HB ALA 90 -3.292 -3.381 9.028 682 HB2 ALA 90 2HB ALA 90 -4.767 -2.693 8.348 683 HB3 ALA 90 3HB ALA 90 -4.092 -2.031 9.837 684 H LEU 91 H LEU 91 -6.701 -2.019 10.519 685 HA LEU 91 HA LEU 91 -8.987 -3.437 9.326 686 HB2 LEU 91 1HB LEU 91 -8.957 -2.664 11.795 687 HB3 LEU 91 2HB LEU 91 -9.225 -1.055 11.125 688 HG LEU 91 HG LEU 91 -11.282 -2.013 9.998 689 HD11 LEU 91 1HD1 LEU 91 -11.938 -4.056 11.733 690 HD12 LEU 91 2HD1 LEU 91 -10.259 -4.393 11.308 691 HD13 LEU 91 3HD1 LEU 91 -11.475 -4.230 10.040 692 HD21 LEU 91 1HD2 LEU 91 -11.542 -2.252 12.960 693 HD22 LEU 91 2HD2 LEU 91 -12.602 -1.455 11.797 694 HD23 LEU 91 3HD2 LEU 91 -11.070 -0.707 12.251 695 HA PRO 92 HA PRO 92 -8.955 -0.460 6.061 696 HB2 PRO 92 1HB PRO 92 -11.436 -0.972 5.083 697 HB3 PRO 92 2HB PRO 92 -10.058 -2.049 4.820 698 HG2 PRO 92 1HG PRO 92 -12.276 -2.261 6.821 699 HG3 PRO 92 2HG PRO 92 -11.547 -3.530 5.819 700 HD2 PRO 92 1HD PRO 92 -10.904 -3.182 8.426 701 HD3 PRO 92 2HD PRO 92 -9.738 -3.777 7.227 702 H GLU 93 H GLU 93 -11.270 -0.512 8.637 703 HA GLU 93 HA GLU 93 -12.761 1.785 7.917 704 HB2 GLU 93 1HB GLU 93 -12.347 0.250 10.453 705 HB3 GLU 93 2HB GLU 93 -13.161 1.807 10.509 706 HG2 GLU 93 1HG GLU 93 -14.015 -0.535 8.824 707 HG3 GLU 93 2HG GLU 93 -14.721 -0.081 10.374 708 H ASP 94 H ASP 94 -9.739 1.305 9.608 709 HA ASP 94 HA ASP 94 -9.582 4.083 10.435 710 HB2 ASP 94 1HB ASP 94 -7.496 1.901 10.642 711 HB3 ASP 94 2HB ASP 94 -7.464 3.461 11.460 712 H LEU 95 H LEU 95 -8.331 1.997 7.928 713 HA LEU 95 HA LEU 95 -6.210 3.562 7.006 714 HB2 LEU 95 1HB LEU 95 -6.412 1.358 6.190 715 HB3 LEU 95 2HB LEU 95 -8.057 1.640 5.623 716 HG LEU 95 HG LEU 95 -7.200 3.081 3.843 717 HD11 LEU 95 1HD1 LEU 95 -4.417 2.251 4.576 718 HD12 LEU 95 2HD1 LEU 95 -5.137 3.720 5.235 719 HD13 LEU 95 3HD1 LEU 95 -4.947 3.536 3.491 720 HD21 LEU 95 1HD2 LEU 95 -6.494 0.249 4.142 721 HD22 LEU 95 2HD2 LEU 95 -5.590 1.109 2.894 722 HD23 LEU 95 3HD2 LEU 95 -7.354 1.077 2.843 723 H VAL 96 H VAL 96 -9.663 3.772 6.396 724 HA VAL 96 HA VAL 96 -9.684 5.510 4.228 725 HB VAL 96 HB VAL 96 -11.628 5.375 6.537 726 HG11 VAL 96 1HG1 VAL 96 -12.653 6.269 3.962 727 HG12 VAL 96 2HG1 VAL 96 -12.897 6.941 5.575 728 HG13 VAL 96 3HG1 VAL 96 -11.459 7.369 4.649 729 HG21 VAL 96 1HG2 VAL 96 -12.635 3.640 5.516 730 HG22 VAL 96 2HG2 VAL 96 -12.339 4.282 3.900 731 HG23 VAL 96 3HG2 VAL 96 -11.060 3.417 4.753 732 H GLU 97 H GLU 97 -9.501 6.235 7.694 733 HA GLU 97 HA GLU 97 -9.262 9.083 7.140 734 HB2 GLU 97 1HB GLU 97 -9.413 7.491 9.697 735 HB3 GLU 97 2HB GLU 97 -9.109 9.222 9.672 736 HG2 GLU 97 1HG GLU 97 -11.286 9.276 8.223 737 HG3 GLU 97 2HG GLU 97 -11.588 7.722 8.998 738 H VAL 98 H VAL 98 -7.178 7.451 6.127 739 HA VAL 98 HA VAL 98 -4.906 7.027 6.286 740 HB VAL 98 HB VAL 98 -5.021 9.981 6.910 741 HG11 VAL 98 1HG1 VAL 98 -2.821 8.293 6.856 742 HG12 VAL 98 2HG1 VAL 98 -2.816 9.071 5.272 743 HG13 VAL 98 3HG1 VAL 98 -2.803 10.052 6.738 744 HG21 VAL 98 1HG2 VAL 98 -6.316 9.345 4.912 745 HG22 VAL 98 2HG2 VAL 98 -4.906 10.325 4.512 746 HG23 VAL 98 3HG2 VAL 98 -4.875 8.582 4.240 747 H ASN 99 H ASN 99 -5.794 6.032 8.569 748 HA ASN 99 HA ASN 99 -4.458 7.307 10.816 749 HB2 ASN 99 1HB ASN 99 -6.282 4.928 10.540 750 HB3 ASN 99 2HB ASN 99 -5.400 5.234 12.034 751 HD21 ASN 99 1HD2 ASN 99 -7.745 5.277 12.718 752 HD22 ASN 99 2HD2 ASN 99 -8.516 6.824 12.720 753 HA PRO 100 HA PRO 100 -0.807 4.875 9.871 754 HB2 PRO 100 1HB PRO 100 0.754 6.057 11.751 755 HB3 PRO 100 2HB PRO 100 0.398 6.805 10.190 756 HG2 PRO 100 1HG PRO 100 -0.859 7.304 12.861 757 HG3 PRO 100 2HG PRO 100 -0.363 8.472 11.622 758 HD2 PRO 100 1HD PRO 100 -2.937 7.696 11.947 759 HD3 PRO 100 2HD PRO 100 -2.264 8.132 10.363 760 H LYS 101 H LYS 101 -2.848 4.827 12.519 761 HA LYS 101 HA LYS 101 -1.277 3.264 14.324 762 HB2 LYS 101 1HB LYS 101 -4.271 3.654 14.154 763 HB3 LYS 101 2HB LYS 101 -3.430 2.881 15.491 764 HG2 LYS 101 1HG LYS 101 -2.528 4.864 16.247 765 HG3 LYS 101 2HG LYS 101 -2.693 5.658 14.679 766 HD2 LYS 101 1HD LYS 101 -5.109 5.738 14.955 767 HD3 LYS 101 2HD LYS 101 -4.979 4.883 16.493 768 HE2 LYS 101 1HE LYS 101 -3.702 6.735 17.428 769 HE3 LYS 101 2HE LYS 101 -3.776 7.582 15.883 770 HZ1 LYS 101 1HZ LYS 101 -5.433 8.284 17.620 771 HZ2 LYS 101 2HZ LYS 101 -6.206 6.798 17.383 772 HZ3 LYS 101 3HZ LYS 101 -6.080 7.899 16.104 773 H MET 102 H MET 102 -3.570 2.558 11.752 774 HA MET 102 HA MET 102 -3.242 -0.316 12.244 775 HB2 MET 102 1HB MET 102 -5.193 1.098 10.419 776 HB3 MET 102 2HB MET 102 -5.165 -0.625 10.771 777 HG2 MET 102 1HG MET 102 -5.887 1.636 12.604 778 HG3 MET 102 2HG MET 102 -6.892 0.289 12.076 779 HE1 MET 102 1HE MET 102 -4.856 -2.671 13.855 780 HE2 MET 102 2HE MET 102 -6.320 -2.360 12.924 781 HE3 MET 102 3HE MET 102 -4.740 -2.001 12.228 782 H VAL 103 H VAL 103 -2.736 2.200 9.849 783 HA VAL 103 HA VAL 103 -2.068 0.602 7.649 784 HB VAL 103 HB VAL 103 -1.117 3.365 8.407 785 HG11 VAL 103 1HG1 VAL 103 0.493 2.266 6.905 786 HG12 VAL 103 2HG1 VAL 103 -0.810 1.955 5.758 787 HG13 VAL 103 3HG1 VAL 103 -0.336 3.614 6.125 788 HG21 VAL 103 1HG2 VAL 103 -2.707 4.007 6.570 789 HG22 VAL 103 2HG2 VAL 103 -3.277 2.337 6.575 790 HG23 VAL 103 3HG2 VAL 103 -3.464 3.338 8.015 791 H MET 104 H MET 104 -0.226 1.539 10.465 792 HA MET 104 HA MET 104 2.362 1.289 9.859 793 HB2 MET 104 1HB MET 104 2.780 0.665 12.046 794 HB3 MET 104 2HB MET 104 1.154 1.323 12.178 795 HG2 MET 104 1HG MET 104 1.749 -1.604 11.841 796 HG3 MET 104 2HG MET 104 1.537 -0.814 13.402 797 HE1 MET 104 1HE MET 104 -1.214 -3.198 12.813 798 HE2 MET 104 2HE MET 104 0.153 -2.658 13.788 799 HE3 MET 104 3HE MET 104 -1.468 -2.053 14.132 800 H THR 105 H THR 105 0.039 -1.335 9.800 801 HA THR 105 HA THR 105 2.128 -3.260 9.106 802 HB THR 105 HB THR 105 0.094 -4.864 9.073 803 HG1 THR 105 1HG THR 105 -1.488 -3.859 10.704 804 HG21 THR 105 1HG2 THR 105 0.746 -3.614 11.736 805 HG22 THR 105 2HG2 THR 105 1.882 -4.640 10.859 806 HG23 THR 105 3HG2 THR 105 0.334 -5.293 11.392 807 H VAL 106 H VAL 106 -0.773 -1.756 7.765 808 HA VAL 106 HA VAL 106 -1.288 -3.087 5.492 809 HB VAL 106 HB VAL 106 -1.088 -0.116 5.905 810 HG11 VAL 106 1HG1 VAL 106 -0.855 0.030 3.662 811 HG12 VAL 106 2HG1 VAL 106 -1.468 -1.601 3.383 812 HG13 VAL 106 3HG1 VAL 106 -2.591 -0.276 3.685 813 HG21 VAL 106 1HG2 VAL 106 -3.348 -0.174 6.273 814 HG22 VAL 106 2HG2 VAL 106 -3.589 -1.606 5.271 815 HG23 VAL 106 3HG2 VAL 106 -2.894 -1.764 6.885 816 H PHE 107 H PHE 107 1.392 -0.782 5.868 817 HA PHE 107 HA PHE 107 2.417 -1.414 3.234 818 HB2 PHE 107 1HB PHE 107 3.124 0.529 5.388 819 HB3 PHE 107 2HB PHE 107 4.356 0.107 4.203 820 HD1 PHE 107 2HD PHE 107 2.955 -0.104 1.718 821 HD2 PHE 107 1HD PHE 107 2.326 2.629 4.921 822 HE1 PHE 107 2HE PHE 107 1.993 1.520 0.140 823 HE2 PHE 107 1HE PHE 107 1.362 4.256 3.348 824 HZ PHE 107 HZ PHE 107 1.195 3.703 0.953 825 H ALA 108 H ALA 108 3.511 -1.777 6.598 826 HA ALA 108 HA ALA 108 5.935 -2.930 6.348 827 HB1 ALA 108 1HB ALA 108 5.551 -4.106 8.405 828 HB2 ALA 108 2HB ALA 108 4.729 -2.548 8.484 829 HB3 ALA 108 3HB ALA 108 3.804 -4.017 8.179 830 H CYS 109 H CYS 109 2.894 -4.798 6.257 831 HA CYS 109 HA CYS 109 3.990 -7.275 5.663 832 HB2 CYS 109 1HB CYS 109 1.734 -7.771 4.626 833 HB3 CYS 109 2HB CYS 109 1.693 -7.166 6.277 834 HG CYS 109 HG CYS 109 0.347 -5.892 3.526 835 H LEU 110 H LEU 110 3.345 -4.550 3.573 836 HA LEU 110 HA LEU 110 3.805 -6.046 1.146 837 HB2 LEU 110 1HB LEU 110 3.343 -3.145 1.759 838 HB3 LEU 110 2HB LEU 110 3.791 -3.690 0.145 839 HG LEU 110 HG LEU 110 1.330 -4.607 1.629 840 HD11 LEU 110 1HD1 LEU 110 0.153 -3.162 -0.060 841 HD12 LEU 110 2HD1 LEU 110 1.719 -2.430 -0.412 842 HD13 LEU 110 3HD1 LEU 110 1.027 -2.297 1.205 843 HD21 LEU 110 1HD2 LEU 110 2.123 -4.889 -1.267 844 HD22 LEU 110 2HD2 LEU 110 0.647 -5.495 -0.516 845 HD23 LEU 110 3HD2 LEU 110 2.211 -6.171 -0.059 846 H MET 111 H MET 111 5.406 -3.133 2.444 847 HA MET 111 HA MET 111 7.692 -3.231 0.921 848 HB2 MET 111 1HB MET 111 8.667 -1.733 2.448 849 HB3 MET 111 2HB MET 111 6.939 -1.438 2.585 850 HG2 MET 111 1HG MET 111 7.651 -1.461 4.783 851 HG3 MET 111 2HG MET 111 7.018 -3.090 4.545 852 HE1 MET 111 1HE MET 111 10.403 -1.284 5.954 853 HE2 MET 111 2HE MET 111 11.378 -1.800 4.579 854 HE3 MET 111 3HE MET 111 9.935 -0.819 4.318 855 H GLY 112 H GLY 112 6.802 -5.243 3.597 856 HA2 GLY 112 1HA GLY 112 9.059 -6.181 4.712 857 HA3 GLY 112 2HA GLY 112 7.757 -7.259 4.233 858 H LYS 113 H LYS 113 8.121 -6.696 1.378 859 HA LYS 113 HA LYS 113 9.844 -8.783 0.711 860 HB2 LYS 113 1HB LYS 113 8.684 -6.507 -0.872 861 HB3 LYS 113 2HB LYS 113 9.781 -7.660 -1.620 862 HG2 LYS 113 1HG LYS 113 7.462 -8.730 -0.111 863 HG3 LYS 113 2HG LYS 113 7.161 -7.976 -1.678 864 HD2 LYS 113 1HD LYS 113 7.527 -10.146 -2.325 865 HD3 LYS 113 2HD LYS 113 9.168 -9.502 -2.429 866 HE2 LYS 113 1HE LYS 113 9.774 -10.473 -0.353 867 HE3 LYS 113 2HE LYS 113 8.098 -10.859 0.034 868 HZ1 LYS 113 1HZ LYS 113 8.240 -12.278 -2.101 869 HZ2 LYS 113 2HZ LYS 113 8.926 -12.870 -0.672 870 HZ3 LYS 113 3HZ LYS 113 9.913 -12.188 -1.864 871 H GLY 114 H GLY 114 10.405 -5.275 0.660 872 HA2 GLY 114 1HA GLY 114 12.980 -5.296 -0.418 873 HA3 GLY 114 2HA GLY 114 12.348 -4.055 0.654 874 H MET 115 H MET 115 12.909 -4.054 2.803 875 HA MET 115 HA MET 115 15.334 -5.338 3.494 876 HB2 MET 115 1HB MET 115 14.178 -3.134 4.394 877 HB3 MET 115 2HB MET 115 13.528 -4.235 5.601 878 HG2 MET 115 1HG MET 115 15.557 -3.151 6.385 879 HG3 MET 115 2HG MET 115 15.773 -4.894 6.241 880 HE1 MET 115 1HE MET 115 17.628 -2.615 6.673 881 HE2 MET 115 2HE MET 115 19.066 -3.149 5.800 882 HE3 MET 115 3HE MET 115 18.193 -1.709 5.269 883 H LYS 116 H LYS 116 15.737 -6.909 5.105 884 HA LYS 116 HA LYS 116 13.773 -9.012 5.167 885 HB2 LYS 116 1HB LYS 116 16.518 -8.789 6.413 886 HB3 LYS 116 2HB LYS 116 15.523 -10.238 6.462 887 HG2 LYS 116 1HG LYS 116 16.816 -10.742 4.669 888 HG3 LYS 116 2HG LYS 116 15.517 -9.881 3.840 889 HD2 LYS 116 1HD LYS 116 16.824 -7.858 3.792 890 HD3 LYS 116 2HD LYS 116 18.086 -8.604 4.775 891 HE2 LYS 116 1HE LYS 116 18.802 -8.603 2.486 892 HE3 LYS 116 2HE LYS 116 18.437 -10.262 2.957 893 HZ1 LYS 116 1HZ LYS 116 17.261 -10.260 1.067 894 HZ2 LYS 116 2HZ LYS 116 17.149 -8.574 0.994 895 HZ3 LYS 116 3HZ LYS 116 16.084 -9.450 1.974 896 H ARG 117 H ARG 117 12.236 -9.226 6.642 897 HA ARG 117 HA ARG 117 12.756 -8.361 9.393 898 HB2 ARG 117 1HB ARG 117 10.433 -7.510 7.674 899 HB3 ARG 117 2HB ARG 117 10.358 -7.471 9.431 900 HG2 ARG 117 1HG ARG 117 12.571 -6.093 7.962 901 HG3 ARG 117 2HG ARG 117 10.994 -5.326 8.163 902 HD2 ARG 117 1HD ARG 117 12.695 -6.385 10.417 903 HD3 ARG 117 2HD ARG 117 12.632 -4.696 9.914 904 HE ARG 117 HE ARG 117 10.048 -5.755 10.518 905 HH11 ARG 117 1HH1 ARG 117 12.941 -4.410 11.911 906 HH12 ARG 117 2HH1 ARG 117 12.141 -3.823 13.331 907 HH21 ARG 117 1HH2 ARG 117 8.982 -4.986 12.383 908 HH22 ARG 117 2HH2 ARG 117 9.890 -4.152 13.599 909 H VAL 118 H VAL 118 11.233 -9.281 10.953 910 HA VAL 118 HA VAL 118 10.952 -12.013 10.754 911 HB VAL 118 HB VAL 118 10.803 -10.847 12.888 912 HG11 VAL 118 1HG1 VAL 118 9.192 -9.343 13.473 913 HG12 VAL 118 2HG1 VAL 118 9.232 -9.051 11.733 914 HG13 VAL 118 3HG1 VAL 118 7.974 -10.073 12.429 915 HG21 VAL 118 1HG2 VAL 118 9.508 -13.100 12.237 916 HG22 VAL 118 2HG2 VAL 118 9.497 -12.421 13.865 917 HG23 VAL 118 3HG2 VAL 118 8.140 -12.126 12.777 918 H SER 119 H SER 119 8.616 -9.500 9.917 919 HA SER 119 HA SER 119 6.354 -11.031 9.501 920 HB2 SER 119 1HB SER 119 6.286 -8.605 9.384 921 HB3 SER 119 2HB SER 119 7.308 -8.614 7.947 922 HG SER 119 HG SER 119 5.485 -8.693 6.911 923 H GLY 120 H GLY 120 8.894 -10.233 7.131 924 HA2 GLY 120 1HA GLY 120 7.771 -12.212 5.288 925 HA3 GLY 120 2HA GLY 120 9.016 -11.031 4.907 926 HA PRO 121 HA PRO 121 10.695 -15.341 6.280 927 HB2 PRO 121 1HB PRO 121 10.657 -16.719 3.942 928 HB3 PRO 121 2HB PRO 121 9.333 -16.775 5.111 929 HG2 PRO 121 1HG PRO 121 9.576 -15.165 2.598 930 HG3 PRO 121 2HG PRO 121 8.178 -16.060 3.223 931 HD2 PRO 121 1HD PRO 121 8.427 -13.377 3.488 932 HD3 PRO 121 2HD PRO 121 7.605 -14.383 4.697 933 H SER 122 H SER 122 11.055 -13.932 3.022 934 HA SER 122 HA SER 122 13.735 -13.128 3.467 935 HB2 SER 122 1HB SER 122 13.754 -15.753 3.113 936 HB3 SER 122 2HB SER 122 13.642 -15.298 1.413 937 HG SER 122 HG SER 122 15.480 -13.760 2.233 938 H SER 123 H SER 123 14.701 -12.134 1.568 939 HA SER 123 HA SER 123 12.690 -10.869 -0.066 940 HB2 SER 123 1HB SER 123 14.556 -9.555 0.846 941 HB3 SER 123 2HB SER 123 15.702 -10.543 -0.060 942 HG SER 123 HG SER 123 14.489 -9.816 -1.973 943 H GLY 124 H GLY 124 11.904 -12.508 -1.405 944 HA2 GLY 124 1HA GLY 124 12.629 -12.790 -3.925 945 HA3 GLY 124 2HA GLY 124 13.795 -13.867 -3.172 Start of MODEL 19 1 H1 GLY 1 H GLY 1 15.291 6.268 14.711 2 HA2 GLY 1 1HA GLY 1 16.540 3.884 13.792 3 HA3 GLY 1 2HA GLY 1 15.262 4.373 12.691 4 H SER 2 H SER 2 16.897 4.660 11.078 5 HA SER 2 HA SER 2 18.413 7.164 11.422 6 HB2 SER 2 1HB SER 2 20.107 6.249 9.885 7 HB3 SER 2 2HB SER 2 19.923 5.233 11.314 8 HG SER 2 HG SER 2 18.257 4.176 9.735 9 H SER 3 H SER 3 18.441 8.616 9.723 10 HA SER 3 HA SER 3 16.515 8.058 7.563 11 HB2 SER 3 1HB SER 3 16.053 10.465 7.498 12 HB3 SER 3 2HB SER 3 15.764 9.826 9.115 13 HG SER 3 HG SER 3 16.947 11.651 9.402 14 H GLY 4 H GLY 4 17.138 8.328 5.489 15 HA2 GLY 4 1HA GLY 4 18.596 9.746 3.992 16 HA3 GLY 4 2HA GLY 4 19.908 9.259 5.056 17 H SER 5 H SER 5 21.111 7.637 4.352 18 HA SER 5 HA SER 5 20.318 6.118 2.048 19 HB2 SER 5 1HB SER 5 22.688 6.913 2.631 20 HB3 SER 5 2HB SER 5 22.736 5.563 3.764 21 HG SER 5 HG SER 5 22.257 4.190 1.955 22 H SER 6 H SER 6 21.245 5.202 5.370 23 HA SER 6 HA SER 6 20.121 2.557 5.002 24 HB2 SER 6 1HB SER 6 22.254 3.284 6.384 25 HB3 SER 6 2HB SER 6 21.066 3.544 7.662 26 HG SER 6 HG SER 6 20.891 1.465 7.890 27 H GLY 7 H GLY 7 18.389 1.692 6.170 28 HA2 GLY 7 1HA GLY 7 16.913 2.723 8.201 29 HA3 GLY 7 2HA GLY 7 16.321 3.603 6.799 30 H ASN 8 H ASN 8 14.995 1.639 8.585 31 HA ASN 8 HA ASN 8 14.248 -0.349 6.541 32 HB2 ASN 8 1HB ASN 8 13.427 -1.665 8.626 33 HB3 ASN 8 2HB ASN 8 15.150 -1.639 8.264 34 HD21 ASN 8 1HD2 ASN 8 16.521 -0.888 9.749 35 HD22 ASN 8 2HD2 ASN 8 16.059 -0.150 11.241 36 H ASP 9 H ASP 9 13.071 1.702 9.172 37 HA ASP 9 HA ASP 9 10.304 1.195 8.483 38 HB2 ASP 9 1HB ASP 9 11.571 3.045 10.511 39 HB3 ASP 9 2HB ASP 9 9.834 2.844 10.304 40 H ASP 10 H ASP 10 12.735 3.634 7.935 41 HA ASP 10 HA ASP 10 10.928 5.651 7.011 42 HB2 ASP 10 1HB ASP 10 13.057 6.354 7.871 43 HB3 ASP 10 2HB ASP 10 13.918 5.318 6.737 44 H ILE 11 H ILE 11 12.915 3.171 5.476 45 HA ILE 11 HA ILE 11 12.583 3.952 2.812 46 HB ILE 11 HB ILE 11 14.151 2.169 3.689 47 HG12 ILE 11 1HG1 ILE 11 12.548 1.137 1.366 48 HG13 ILE 11 2HG1 ILE 11 13.451 2.641 1.232 49 HG21 ILE 11 1HG2 ILE 11 12.345 -0.018 3.174 50 HG22 ILE 11 2HG2 ILE 11 13.384 0.277 4.568 51 HG23 ILE 11 3HG2 ILE 11 11.767 0.980 4.509 52 HD11 ILE 11 1HD1 ILE 11 15.512 1.475 1.727 53 HD12 ILE 11 2HD1 ILE 11 14.626 -0.034 1.948 54 HD13 ILE 11 3HD1 ILE 11 14.691 0.726 0.359 55 H ILE 12 H ILE 12 10.373 2.506 5.020 56 HA ILE 12 HA ILE 12 8.638 1.049 3.518 57 HB ILE 12 HB ILE 12 7.832 3.132 5.552 58 HG12 ILE 12 1HG1 ILE 12 8.425 0.186 5.902 59 HG13 ILE 12 2HG1 ILE 12 9.495 1.497 6.386 60 HG21 ILE 12 1HG2 ILE 12 6.299 0.633 4.993 61 HG22 ILE 12 2HG2 ILE 12 5.746 2.164 5.672 62 HG23 ILE 12 3HG2 ILE 12 6.090 2.038 3.947 63 HD11 ILE 12 1HD1 ILE 12 8.402 1.803 8.292 64 HD12 ILE 12 2HD1 ILE 12 6.832 1.786 7.488 65 HD13 ILE 12 3HD1 ILE 12 7.600 0.269 7.954 66 H VAL 13 H VAL 13 9.029 4.538 3.491 67 HA VAL 13 HA VAL 13 6.757 4.951 1.747 68 HB VAL 13 HB VAL 13 8.904 6.876 2.649 69 HG11 VAL 13 1HG1 VAL 13 7.325 7.176 0.461 70 HG12 VAL 13 2HG1 VAL 13 6.323 7.914 1.712 71 HG13 VAL 13 3HG1 VAL 13 7.960 8.507 1.427 72 HG21 VAL 13 1HG2 VAL 13 6.045 6.685 3.576 73 HG22 VAL 13 2HG2 VAL 13 7.394 5.923 4.420 74 HG23 VAL 13 3HG2 VAL 13 7.337 7.678 4.251 75 H ASN 14 H ASN 14 10.295 5.135 1.496 76 HA ASN 14 HA ASN 14 10.438 5.942 -1.179 77 HB2 ASN 14 1HB ASN 14 12.289 4.637 0.746 78 HB3 ASN 14 2HB ASN 14 12.707 4.528 -0.962 79 HD21 ASN 14 1HD2 ASN 14 12.383 6.726 -2.123 80 HD22 ASN 14 2HD2 ASN 14 13.090 8.082 -1.319 81 H TRP 15 H TRP 15 10.817 2.650 0.147 82 HA TRP 15 HA TRP 15 11.069 1.183 -2.113 83 HB2 TRP 15 1HB TRP 15 10.997 0.269 0.206 84 HB3 TRP 15 2HB TRP 15 9.242 0.426 0.175 85 HD1 TRP 15 HD TRP 15 12.076 -1.580 -1.496 86 HE1 TRP 15 1HE TRP 15 11.081 -3.769 -2.414 87 HE3 TRP 15 3HE TRP 15 7.132 -0.682 -0.554 88 HZ2 TRP 15 2HZ TRP 15 8.537 -4.958 -2.700 89 HZ3 TRP 15 3HZ TRP 15 5.482 -2.397 -1.180 90 HH2 TRP 15 HH TRP 15 6.172 -4.489 -2.231 91 H VAL 16 H VAL 16 7.991 2.327 -0.758 92 HA VAL 16 HA VAL 16 6.306 1.172 -2.679 93 HB VAL 16 HB VAL 16 5.899 3.700 -1.075 94 HG11 VAL 16 1HG1 VAL 16 4.460 3.406 -3.148 95 HG12 VAL 16 2HG1 VAL 16 3.754 2.010 -2.332 96 HG13 VAL 16 3HG1 VAL 16 3.609 3.616 -1.619 97 HG21 VAL 16 1HG2 VAL 16 6.091 1.060 -0.228 98 HG22 VAL 16 2HG2 VAL 16 5.411 2.413 0.677 99 HG23 VAL 16 3HG2 VAL 16 4.358 1.383 -0.292 100 H ASN 17 H ASN 17 7.675 4.456 -2.518 101 HA ASN 17 HA ASN 17 6.564 5.506 -4.819 102 HB2 ASN 17 1HB ASN 17 9.095 6.031 -3.319 103 HB3 ASN 17 2HB ASN 17 8.870 6.799 -4.888 104 HD21 ASN 17 1HD2 ASN 17 6.997 6.180 -1.934 105 HD22 ASN 17 2HD2 ASN 17 6.316 7.764 -1.834 106 H GLU 18 H GLU 18 9.661 3.779 -4.497 107 HA GLU 18 HA GLU 18 10.385 3.865 -7.199 108 HB2 GLU 18 1HB GLU 18 11.124 2.133 -4.881 109 HB3 GLU 18 2HB GLU 18 11.620 1.637 -6.493 110 HG2 GLU 18 1HG GLU 18 12.225 4.339 -5.324 111 HG3 GLU 18 2HG GLU 18 13.311 2.955 -5.212 112 H THR 19 H THR 19 8.781 1.255 -5.380 113 HA THR 19 HA THR 19 8.432 -0.599 -7.357 114 HB THR 19 HB THR 19 6.454 0.154 -5.199 115 HG1 THR 19 1HG THR 19 7.950 -2.172 -5.037 116 HG21 THR 19 1HG2 THR 19 5.908 -2.407 -5.603 117 HG22 THR 19 2HG2 THR 19 6.460 -2.018 -7.233 118 HG23 THR 19 3HG2 THR 19 5.106 -1.137 -6.526 119 H LEU 20 H LEU 20 6.350 2.198 -6.689 120 HA LEU 20 HA LEU 20 4.509 1.636 -8.784 121 HB2 LEU 20 1HB LEU 20 5.082 4.232 -7.361 122 HB3 LEU 20 2HB LEU 20 3.683 3.908 -8.384 123 HG LEU 20 HG LEU 20 4.198 2.250 -5.941 124 HD11 LEU 20 1HD1 LEU 20 2.566 3.865 -4.818 125 HD12 LEU 20 2HD1 LEU 20 3.032 5.010 -6.075 126 HD13 LEU 20 3HD1 LEU 20 4.249 4.374 -4.967 127 HD21 LEU 20 1HD2 LEU 20 1.613 2.336 -6.060 128 HD22 LEU 20 2HD2 LEU 20 2.492 1.318 -7.200 129 HD23 LEU 20 3HD2 LEU 20 1.874 2.888 -7.714 130 H ARG 21 H ARG 21 7.296 3.806 -8.489 131 HA ARG 21 HA ARG 21 7.082 5.099 -10.945 132 HB2 ARG 21 1HB ARG 21 8.638 5.812 -9.198 133 HB3 ARG 21 2HB ARG 21 9.582 4.344 -9.423 134 HG2 ARG 21 1HG ARG 21 10.377 5.037 -11.510 135 HG3 ARG 21 2HG ARG 21 9.139 6.285 -11.663 136 HD2 ARG 21 1HD ARG 21 10.286 7.190 -9.462 137 HD3 ARG 21 2HD ARG 21 11.665 6.287 -10.091 138 HE ARG 21 HE ARG 21 11.902 7.857 -11.746 139 HH11 ARG 21 1HH1 ARG 21 8.807 8.259 -10.204 140 HH12 ARG 21 2HH1 ARG 21 8.457 9.756 -11.003 141 HH21 ARG 21 1HH2 ARG 21 11.453 9.828 -12.803 142 HH22 ARG 21 2HH2 ARG 21 9.962 10.648 -12.481 143 H GLU 22 H GLU 22 8.649 2.035 -10.114 144 HA GLU 22 HA GLU 22 9.888 1.500 -12.547 145 HB2 GLU 22 1HB GLU 22 8.659 -0.415 -10.558 146 HB3 GLU 22 2HB GLU 22 9.703 -0.902 -11.886 147 HG2 GLU 22 1HG GLU 22 11.314 0.887 -10.783 148 HG3 GLU 22 2HG GLU 22 10.371 0.476 -9.352 149 H ALA 23 H ALA 23 6.573 0.854 -11.501 150 HA ALA 23 HA ALA 23 5.887 -0.380 -14.031 151 HB1 ALA 23 1HB ALA 23 4.591 -1.418 -12.508 152 HB2 ALA 23 2HB ALA 23 4.592 -0.039 -11.408 153 HB3 ALA 23 3HB ALA 23 3.509 -0.056 -12.800 154 H GLU 24 H GLU 24 6.123 2.759 -12.849 155 HA GLU 24 HA GLU 24 5.671 4.767 -13.844 156 HB2 GLU 24 1HB GLU 24 4.128 3.342 -15.997 157 HB3 GLU 24 2HB GLU 24 4.951 4.893 -16.087 158 HG2 GLU 24 1HG GLU 24 7.004 3.949 -16.390 159 HG3 GLU 24 2HG GLU 24 6.574 2.470 -15.530 160 H LYS 25 H LYS 25 4.007 3.572 -11.855 161 HA LYS 25 HA LYS 25 1.255 3.984 -12.510 162 HB2 LYS 25 1HB LYS 25 2.815 3.270 -10.099 163 HB3 LYS 25 2HB LYS 25 1.279 4.074 -9.806 164 HG2 LYS 25 1HG LYS 25 1.024 1.663 -9.759 165 HG3 LYS 25 2HG LYS 25 0.125 2.362 -11.107 166 HD2 LYS 25 1HD LYS 25 2.075 1.804 -12.579 167 HD3 LYS 25 2HD LYS 25 2.778 0.931 -11.215 168 HE2 LYS 25 1HE LYS 25 1.245 -0.757 -11.329 169 HE3 LYS 25 2HE LYS 25 -0.019 0.287 -11.978 170 HZ1 LYS 25 1HZ LYS 25 0.484 -0.890 -13.832 171 HZ2 LYS 25 2HZ LYS 25 2.088 -1.172 -13.378 172 HZ3 LYS 25 3HZ LYS 25 1.640 0.331 -14.011 173 H SER 26 H SER 26 -0.132 5.626 -11.697 174 HA SER 26 HA SER 26 1.175 8.224 -11.570 175 HB2 SER 26 1HB SER 26 -0.886 9.166 -12.167 176 HB3 SER 26 2HB SER 26 -0.892 7.624 -13.023 177 HG SER 26 HG SER 26 -2.139 6.775 -11.286 178 H SER 27 H SER 27 0.610 6.000 -9.351 179 HA SER 27 HA SER 27 -0.512 7.792 -7.323 180 HB2 SER 27 1HB SER 27 -0.848 5.837 -5.962 181 HB3 SER 27 2HB SER 27 -1.420 5.458 -7.587 182 HG SER 27 HG SER 27 1.084 4.731 -6.464 183 H SER 28 H SER 28 0.524 7.917 -5.216 184 HA SER 28 HA SER 28 3.146 7.024 -4.723 185 HB2 SER 28 1HB SER 28 4.483 8.935 -5.117 186 HB3 SER 28 2HB SER 28 3.514 8.757 -6.580 187 HG SER 28 HG SER 28 2.034 10.254 -5.187 188 H ILE 29 H ILE 29 4.065 7.968 -2.747 189 HA ILE 29 HA ILE 29 2.104 9.412 -1.108 190 HB ILE 29 HB ILE 29 2.871 7.937 0.837 191 HG12 ILE 29 1HG1 ILE 29 3.375 5.831 -1.221 192 HG13 ILE 29 2HG1 ILE 29 4.686 6.932 -0.811 193 HG21 ILE 29 1HG2 ILE 29 0.695 7.520 0.413 194 HG22 ILE 29 2HG2 ILE 29 0.960 7.317 -1.318 195 HG23 ILE 29 3HG2 ILE 29 1.326 5.996 -0.209 196 HD11 ILE 29 1HD1 ILE 29 4.007 4.598 0.501 197 HD12 ILE 29 2HD1 ILE 29 5.100 5.856 1.081 198 HD13 ILE 29 3HD1 ILE 29 3.400 5.878 1.551 199 H SER 30 H SER 30 2.947 10.833 0.369 200 HA SER 30 HA SER 30 5.748 11.509 0.009 201 HB2 SER 30 1HB SER 30 4.281 13.382 -0.065 202 HB3 SER 30 2HB SER 30 3.452 12.881 1.409 203 HG SER 30 HG SER 30 4.810 14.297 2.231 204 H SER 31 H SER 31 3.567 10.505 2.605 205 HA SER 31 HA SER 31 5.664 9.225 4.039 206 HB2 SER 31 1HB SER 31 6.122 11.604 4.634 207 HB3 SER 31 2HB SER 31 4.505 11.706 5.331 208 HG SER 31 HG SER 31 5.475 11.025 7.068 209 H PHE 32 H PHE 32 4.828 8.515 6.279 210 HA PHE 32 HA PHE 32 2.603 6.934 5.993 211 HB2 PHE 32 1HB PHE 32 3.720 8.116 8.543 212 HB3 PHE 32 2HB PHE 32 2.572 6.783 8.478 213 HD1 PHE 32 2HD PHE 32 3.259 4.602 7.575 214 HD2 PHE 32 1HD PHE 32 6.031 7.790 8.088 215 HE1 PHE 32 2HE PHE 32 5.122 3.007 7.387 216 HE2 PHE 32 1HE PHE 32 7.900 6.200 7.901 217 HZ PHE 32 HZ PHE 32 7.446 3.805 7.551 218 H LYS 33 H LYS 33 2.767 10.294 6.882 219 HA LYS 33 HA LYS 33 -0.083 10.352 7.538 220 HB2 LYS 33 1HB LYS 33 2.109 12.412 7.790 221 HB3 LYS 33 2HB LYS 33 0.416 12.772 8.101 222 HG2 LYS 33 1HG LYS 33 1.087 12.308 10.216 223 HG3 LYS 33 2HG LYS 33 0.642 10.679 9.703 224 HD2 LYS 33 1HD LYS 33 2.958 10.179 9.183 225 HD3 LYS 33 2HD LYS 33 3.429 11.832 9.585 226 HE2 LYS 33 1HE LYS 33 2.890 11.508 11.882 227 HE3 LYS 33 2HE LYS 33 2.115 9.960 11.544 228 HZ1 LYS 33 1HZ LYS 33 4.799 10.457 12.170 229 HZ2 LYS 33 2HZ LYS 33 4.742 9.845 10.595 230 HZ3 LYS 33 3HZ LYS 33 4.052 8.970 11.868 231 H ASP 34 H ASP 34 0.561 9.773 4.865 232 HA ASP 34 HA ASP 34 0.207 12.224 3.347 233 HB2 ASP 34 1HB ASP 34 1.663 10.722 2.274 234 HB3 ASP 34 2HB ASP 34 0.625 9.338 2.606 235 HA PRO 35 HA PRO 35 -4.213 11.924 3.449 236 HB2 PRO 35 1HB PRO 35 -4.708 13.854 1.607 237 HB3 PRO 35 2HB PRO 35 -4.210 14.213 3.264 238 HG2 PRO 35 1HG PRO 35 -2.563 14.140 0.766 239 HG3 PRO 35 2HG PRO 35 -2.535 15.319 2.089 240 HD2 PRO 35 1HD PRO 35 -0.706 13.335 1.867 241 HD3 PRO 35 2HD PRO 35 -1.246 13.964 3.436 242 H LYS 36 H LYS 36 -2.333 11.777 0.477 243 HA LYS 36 HA LYS 36 -4.340 11.025 -1.310 244 HB2 LYS 36 1HB LYS 36 -1.382 10.673 -1.198 245 HB3 LYS 36 2HB LYS 36 -2.280 9.731 -2.381 246 HG2 LYS 36 1HG LYS 36 -1.753 11.586 -3.608 247 HG3 LYS 36 2HG LYS 36 -3.339 12.042 -2.983 248 HD2 LYS 36 1HD LYS 36 -2.390 13.443 -1.331 249 HD3 LYS 36 2HD LYS 36 -0.776 12.773 -1.586 250 HE2 LYS 36 1HE LYS 36 -1.105 13.677 -4.015 251 HE3 LYS 36 2HE LYS 36 -2.320 14.707 -3.260 252 HZ1 LYS 36 1HZ LYS 36 -0.437 15.244 -1.611 253 HZ2 LYS 36 2HZ LYS 36 -0.415 15.976 -3.136 254 HZ3 LYS 36 3HZ LYS 36 0.592 14.654 -2.817 255 H ILE 37 H ILE 37 -2.797 9.245 1.215 256 HA ILE 37 HA ILE 37 -3.254 6.622 0.291 257 HB ILE 37 HB ILE 37 -3.088 7.638 3.130 258 HG12 ILE 37 1HG1 ILE 37 -1.020 6.502 1.242 259 HG13 ILE 37 2HG1 ILE 37 -1.059 8.125 1.923 260 HG21 ILE 37 1HG2 ILE 37 -4.194 5.455 2.983 261 HG22 ILE 37 2HG2 ILE 37 -2.817 4.825 2.082 262 HG23 ILE 37 3HG2 ILE 37 -2.614 5.337 3.757 263 HD11 ILE 37 1HD1 ILE 37 0.414 7.271 3.375 264 HD12 ILE 37 2HD1 ILE 37 -1.024 6.634 4.174 265 HD13 ILE 37 3HD1 ILE 37 -0.097 5.610 3.079 266 H SER 38 H SER 38 -5.340 8.994 1.708 267 HA SER 38 HA SER 38 -7.346 7.454 2.824 268 HB2 SER 38 1HB SER 38 -7.344 9.882 3.002 269 HB3 SER 38 2HB SER 38 -7.607 10.037 1.265 270 HG SER 38 HG SER 38 -9.520 8.484 2.130 271 H THR 39 H THR 39 -6.766 8.240 -0.560 272 HA THR 39 HA THR 39 -9.184 6.946 -1.457 273 HB THR 39 HB THR 39 -8.368 7.401 -3.724 274 HG1 THR 39 1HG THR 39 -6.301 8.807 -3.604 275 HG21 THR 39 1HG2 THR 39 -7.679 9.996 -2.681 276 HG22 THR 39 2HG2 THR 39 -9.025 9.305 -1.774 277 HG23 THR 39 3HG2 THR 39 -9.140 9.483 -3.525 278 H SER 40 H SER 40 -6.183 5.871 -0.459 279 HA SER 40 HA SER 40 -5.140 3.849 -0.523 280 HB2 SER 40 1HB SER 40 -7.803 2.992 -1.676 281 HB3 SER 40 2HB SER 40 -6.508 1.869 -1.260 282 HG SER 40 HG SER 40 -7.949 3.584 0.473 283 H LEU 41 H LEU 41 -5.037 5.750 -2.793 284 HA LEU 41 HA LEU 41 -4.936 4.310 -5.230 285 HB2 LEU 41 1HB LEU 41 -3.909 6.951 -4.291 286 HB3 LEU 41 2HB LEU 41 -3.378 6.316 -5.847 287 HG LEU 41 HG LEU 41 -6.250 6.835 -5.078 288 HD11 LEU 41 1HD1 LEU 41 -6.152 8.783 -6.437 289 HD12 LEU 41 2HD1 LEU 41 -4.514 8.405 -6.972 290 HD13 LEU 41 3HD1 LEU 41 -4.809 8.874 -5.298 291 HD21 LEU 41 1HD2 LEU 41 -6.669 6.509 -7.477 292 HD22 LEU 41 2HD2 LEU 41 -6.030 5.055 -6.710 293 HD23 LEU 41 3HD2 LEU 41 -4.977 6.064 -7.702 294 HA PRO 42 HA PRO 42 -0.164 4.168 -4.380 295 HB2 PRO 42 1HB PRO 42 0.619 4.610 -1.818 296 HB3 PRO 42 2HB PRO 42 0.475 5.903 -3.016 297 HG2 PRO 42 1HG PRO 42 -1.443 5.090 -0.865 298 HG3 PRO 42 2HG PRO 42 -0.947 6.718 -1.366 299 HD2 PRO 42 1HD PRO 42 -3.288 5.602 -2.147 300 HD3 PRO 42 2HD PRO 42 -2.381 6.736 -3.170 301 H VAL 43 H VAL 43 -2.385 3.131 -1.850 302 HA VAL 43 HA VAL 43 -0.846 0.858 -1.051 303 HB VAL 43 HB VAL 43 -3.807 1.257 -0.639 304 HG11 VAL 43 1HG1 VAL 43 -3.717 -0.405 0.901 305 HG12 VAL 43 2HG1 VAL 43 -2.373 -0.935 -0.114 306 HG13 VAL 43 3HG1 VAL 43 -2.058 -0.033 1.369 307 HG21 VAL 43 1HG2 VAL 43 -1.755 2.957 0.223 308 HG22 VAL 43 2HG2 VAL 43 -3.429 2.928 0.779 309 HG23 VAL 43 3HG2 VAL 43 -2.202 1.990 1.630 310 H LEU 44 H LEU 44 -3.513 1.410 -3.290 311 HA LEU 44 HA LEU 44 -3.867 -1.377 -3.885 312 HB2 LEU 44 1HB LEU 44 -4.898 1.150 -5.147 313 HB3 LEU 44 2HB LEU 44 -5.269 -0.451 -5.782 314 HG LEU 44 HG LEU 44 -5.917 0.290 -2.946 315 HD11 LEU 44 1HD1 LEU 44 -8.084 1.024 -3.603 316 HD12 LEU 44 2HD1 LEU 44 -7.774 0.626 -5.293 317 HD13 LEU 44 3HD1 LEU 44 -6.907 1.958 -4.527 318 HD21 LEU 44 1HD2 LEU 44 -7.086 -1.709 -4.879 319 HD22 LEU 44 2HD2 LEU 44 -7.588 -1.466 -3.206 320 HD23 LEU 44 3HD2 LEU 44 -5.972 -2.075 -3.562 321 H ASP 45 H ASP 45 -2.528 1.405 -5.656 322 HA ASP 45 HA ASP 45 -1.720 0.026 -7.945 323 HB2 ASP 45 1HB ASP 45 -0.931 2.588 -6.644 324 HB3 ASP 45 2HB ASP 45 0.112 1.955 -7.914 325 H LEU 46 H LEU 46 -0.028 0.593 -4.893 326 HA LEU 46 HA LEU 46 2.481 -0.388 -5.578 327 HB2 LEU 46 1HB LEU 46 2.314 0.688 -3.516 328 HB3 LEU 46 2HB LEU 46 0.949 -0.304 -3.006 329 HG LEU 46 HG LEU 46 2.386 -2.179 -2.596 330 HD11 LEU 46 1HD1 LEU 46 4.074 -0.935 -4.468 331 HD12 LEU 46 2HD1 LEU 46 4.308 -2.482 -3.656 332 HD13 LEU 46 3HD1 LEU 46 4.969 -1.007 -2.950 333 HD21 LEU 46 1HD2 LEU 46 4.180 -0.777 -1.117 334 HD22 LEU 46 2HD2 LEU 46 2.519 -1.112 -0.625 335 HD23 LEU 46 3HD2 LEU 46 2.923 0.434 -1.374 336 H ILE 47 H ILE 47 -0.414 -2.111 -4.525 337 HA ILE 47 HA ILE 47 0.824 -4.662 -4.323 338 HB ILE 47 HB ILE 47 -2.089 -3.980 -4.737 339 HG12 ILE 47 1HG1 ILE 47 -0.788 -4.796 -2.151 340 HG13 ILE 47 2HG1 ILE 47 -0.824 -3.110 -2.655 341 HG21 ILE 47 1HG2 ILE 47 -2.644 -6.173 -4.302 342 HG22 ILE 47 2HG2 ILE 47 -1.172 -6.364 -5.253 343 HG23 ILE 47 3HG2 ILE 47 -1.111 -6.512 -3.497 344 HD11 ILE 47 1HD1 ILE 47 -3.440 -4.197 -2.910 345 HD12 ILE 47 2HD1 ILE 47 -2.811 -4.576 -1.306 346 HD13 ILE 47 3HD1 ILE 47 -2.870 -2.902 -1.858 347 H ASP 48 H ASP 48 -1.304 -3.241 -6.805 348 HA ASP 48 HA ASP 48 -1.270 -5.351 -8.608 349 HB2 ASP 48 1HB ASP 48 -2.718 -3.303 -8.738 350 HB3 ASP 48 2HB ASP 48 -1.322 -2.420 -9.350 351 H ALA 49 H ALA 49 0.897 -2.530 -8.474 352 HA ALA 49 HA ALA 49 2.484 -2.852 -10.624 353 HB1 ALA 49 1HB ALA 49 2.766 -1.140 -8.836 354 HB2 ALA 49 2HB ALA 49 3.604 -2.356 -7.871 355 HB3 ALA 49 3HB ALA 49 4.281 -1.836 -9.414 356 H ILE 50 H ILE 50 2.752 -4.727 -7.623 357 HA ILE 50 HA ILE 50 4.934 -6.313 -8.608 358 HB ILE 50 HB ILE 50 3.158 -6.871 -6.231 359 HG12 ILE 50 1HG1 ILE 50 5.836 -5.478 -6.207 360 HG13 ILE 50 2HG1 ILE 50 4.312 -4.600 -6.260 361 HG21 ILE 50 1HG2 ILE 50 5.157 -8.405 -7.441 362 HG22 ILE 50 2HG2 ILE 50 5.899 -7.710 -6.002 363 HG23 ILE 50 3HG2 ILE 50 4.420 -8.661 -5.860 364 HD11 ILE 50 1HD1 ILE 50 4.513 -6.614 -4.137 365 HD12 ILE 50 2HD1 ILE 50 5.619 -5.246 -3.996 366 HD13 ILE 50 3HD1 ILE 50 3.879 -4.969 -4.094 367 H GLN 51 H GLN 51 1.611 -7.187 -7.635 368 HA GLN 51 HA GLN 51 1.741 -9.424 -9.542 369 HB2 GLN 51 1HB GLN 51 1.383 -10.073 -7.197 370 HB3 GLN 51 2HB GLN 51 -0.052 -9.060 -7.135 371 HG2 GLN 51 1HG GLN 51 -0.952 -11.143 -7.472 372 HG3 GLN 51 2HG GLN 51 -0.861 -10.516 -9.117 373 HE21 GLN 51 1HE2 GLN 51 -0.216 -13.113 -7.188 374 HE22 GLN 51 2HE2 GLN 51 0.941 -13.924 -8.183 375 HA PRO 52 HA PRO 52 -1.140 -6.666 -11.712 376 HB2 PRO 52 1HB PRO 52 -0.763 -7.841 -14.130 377 HB3 PRO 52 2HB PRO 52 0.341 -6.628 -13.469 378 HG2 PRO 52 1HG PRO 52 0.596 -9.611 -13.489 379 HG3 PRO 52 2HG PRO 52 1.829 -8.380 -13.822 380 HD2 PRO 52 1HD PRO 52 1.650 -9.656 -11.441 381 HD3 PRO 52 2HD PRO 52 2.212 -7.978 -11.585 382 H GLY 53 H GLY 53 -3.250 -6.975 -12.287 383 HA2 GLY 53 1HA GLY 53 -5.019 -8.340 -13.199 384 HA3 GLY 53 2HA GLY 53 -4.198 -9.753 -12.551 385 H SER 54 H SER 54 -3.667 -8.425 -9.975 386 HA SER 54 HA SER 54 -5.955 -9.287 -8.585 387 HB2 SER 54 1HB SER 54 -3.781 -7.425 -7.599 388 HB3 SER 54 2HB SER 54 -4.885 -8.365 -6.595 389 HG SER 54 HG SER 54 -2.558 -9.115 -7.708 390 H ILE 55 H ILE 55 -4.683 -5.960 -8.826 391 HA ILE 55 HA ILE 55 -7.184 -4.839 -7.964 392 HB ILE 55 HB ILE 55 -4.842 -3.374 -9.178 393 HG12 ILE 55 1HG1 ILE 55 -4.288 -4.853 -7.180 394 HG13 ILE 55 2HG1 ILE 55 -3.898 -3.144 -7.015 395 HG21 ILE 55 1HG2 ILE 55 -7.030 -2.180 -8.990 396 HG22 ILE 55 2HG2 ILE 55 -6.933 -2.396 -7.244 397 HG23 ILE 55 3HG2 ILE 55 -5.712 -1.439 -8.083 398 HD11 ILE 55 1HD1 ILE 55 -5.498 -2.793 -5.433 399 HD12 ILE 55 2HD1 ILE 55 -6.531 -4.093 -6.028 400 HD13 ILE 55 3HD1 ILE 55 -5.086 -4.473 -5.092 401 H ASN 56 H ASN 56 -8.563 -3.486 -9.174 402 HA ASN 56 HA ASN 56 -8.236 -3.465 -12.075 403 HB2 ASN 56 1HB ASN 56 -9.643 -5.490 -11.229 404 HB3 ASN 56 2HB ASN 56 -10.896 -4.286 -10.948 405 HD21 ASN 56 1HD2 ASN 56 -12.275 -5.052 -12.497 406 HD22 ASN 56 2HD2 ASN 56 -11.950 -4.941 -14.190 407 H TYR 57 H TYR 57 -8.197 -1.321 -12.380 408 HA TYR 57 HA TYR 57 -9.381 0.643 -10.840 409 HB2 TYR 57 1HB TYR 57 -8.364 0.508 -13.631 410 HB3 TYR 57 2HB TYR 57 -9.366 1.892 -13.208 411 HD1 TYR 57 1HD TYR 57 -6.938 0.097 -11.040 412 HD2 TYR 57 2HD TYR 57 -7.821 3.655 -13.201 413 HE1 TYR 57 1HE TYR 57 -4.986 1.194 -10.021 414 HE2 TYR 57 2HE TYR 57 -5.871 4.760 -12.189 415 HH TYR 57 HH TYR 57 -4.398 4.598 -10.377 416 H ASP 58 H ASP 58 -10.729 -1.207 -13.508 417 HA ASP 58 HA ASP 58 -12.988 0.196 -14.147 418 HB2 ASP 58 1HB ASP 58 -12.087 -2.176 -14.907 419 HB3 ASP 58 2HB ASP 58 -13.275 -2.749 -13.739 420 H LEU 59 H LEU 59 -12.499 -1.913 -11.352 421 HA LEU 59 HA LEU 59 -15.191 -1.436 -10.387 422 HB2 LEU 59 1HB LEU 59 -12.961 -2.807 -8.910 423 HB3 LEU 59 2HB LEU 59 -14.697 -2.977 -8.661 424 HG LEU 59 HG LEU 59 -13.189 -3.955 -11.085 425 HD11 LEU 59 1HD1 LEU 59 -14.118 -6.173 -9.890 426 HD12 LEU 59 2HD1 LEU 59 -13.802 -5.176 -8.471 427 HD13 LEU 59 3HD1 LEU 59 -12.502 -5.521 -9.613 428 HD21 LEU 59 1HD2 LEU 59 -16.015 -3.640 -10.455 429 HD22 LEU 59 2HD2 LEU 59 -15.588 -5.289 -10.913 430 HD23 LEU 59 3HD2 LEU 59 -15.225 -3.948 -12.001 431 H LEU 60 H LEU 60 -11.907 -0.415 -9.675 432 HA LEU 60 HA LEU 60 -12.221 0.779 -7.209 433 HB2 LEU 60 1HB LEU 60 -10.586 1.773 -9.540 434 HB3 LEU 60 2HB LEU 60 -10.389 2.285 -7.865 435 HG LEU 60 HG LEU 60 -9.901 -0.496 -8.932 436 HD11 LEU 60 1HD1 LEU 60 -7.707 -0.012 -9.101 437 HD12 LEU 60 2HD1 LEU 60 -7.736 1.108 -7.740 438 HD13 LEU 60 3HD1 LEU 60 -8.306 1.632 -9.324 439 HD21 LEU 60 1HD2 LEU 60 -9.607 0.687 -6.176 440 HD22 LEU 60 2HD2 LEU 60 -8.905 -0.853 -6.672 441 HD23 LEU 60 3HD2 LEU 60 -10.657 -0.643 -6.670 442 H LYS 61 H LYS 61 -12.139 3.237 -6.848 443 HA LYS 61 HA LYS 61 -14.339 4.456 -8.381 444 HB2 LYS 61 1HB LYS 61 -13.621 4.483 -5.493 445 HB3 LYS 61 2HB LYS 61 -14.336 5.943 -6.165 446 HG2 LYS 61 1HG LYS 61 -16.224 4.879 -5.493 447 HG3 LYS 61 2HG LYS 61 -16.089 4.212 -7.122 448 HD2 LYS 61 1HD LYS 61 -14.628 2.397 -5.862 449 HD3 LYS 61 2HD LYS 61 -15.602 2.921 -4.486 450 HE2 LYS 61 1HE LYS 61 -16.984 2.312 -7.050 451 HE3 LYS 61 2HE LYS 61 -16.384 0.964 -6.085 452 HZ1 LYS 61 1HZ LYS 61 -17.601 2.200 -4.178 453 HZ2 LYS 61 2HZ LYS 61 -18.490 1.246 -5.255 454 HZ3 LYS 61 3HZ LYS 61 -18.471 2.929 -5.432 455 H THR 62 H THR 62 -11.443 5.361 -6.507 456 HA THR 62 HA THR 62 -10.204 7.318 -6.612 457 HB THR 62 HB THR 62 -9.251 5.599 -8.257 458 HG1 THR 62 1HG THR 62 -7.986 7.492 -9.281 459 HG21 THR 62 1HG2 THR 62 -9.471 7.182 -10.581 460 HG22 THR 62 2HG2 THR 62 -11.110 6.951 -9.971 461 HG23 THR 62 3HG2 THR 62 -10.092 5.553 -10.319 462 H GLU 63 H GLU 63 -13.014 7.852 -7.018 463 HA GLU 63 HA GLU 63 -12.750 10.310 -8.597 464 HB2 GLU 63 1HB GLU 63 -14.929 9.998 -9.612 465 HB3 GLU 63 2HB GLU 63 -13.899 8.625 -9.992 466 HG2 GLU 63 1HG GLU 63 -15.020 7.497 -7.971 467 HG3 GLU 63 2HG GLU 63 -16.233 8.766 -8.129 468 H ASN 64 H ASN 64 -12.915 11.836 -7.083 469 HA ASN 64 HA ASN 64 -13.550 12.879 -5.125 470 HB2 ASN 64 1HB ASN 64 -16.359 12.382 -6.060 471 HB3 ASN 64 2HB ASN 64 -15.667 13.838 -5.352 472 HD21 ASN 64 1HD2 ASN 64 -15.682 11.813 -8.229 473 HD22 ASN 64 2HD2 ASN 64 -15.273 13.071 -9.340 474 H LEU 65 H LEU 65 -13.088 10.165 -4.617 475 HA LEU 65 HA LEU 65 -14.987 8.618 -3.455 476 HB2 LEU 65 1HB LEU 65 -12.161 9.179 -2.625 477 HB3 LEU 65 2HB LEU 65 -13.162 8.034 -1.735 478 HG LEU 65 HG LEU 65 -12.868 7.678 -4.678 479 HD11 LEU 65 1HD1 LEU 65 -10.590 8.097 -3.399 480 HD12 LEU 65 2HD1 LEU 65 -10.750 6.842 -4.628 481 HD13 LEU 65 3HD1 LEU 65 -10.836 6.417 -2.918 482 HD21 LEU 65 1HD2 LEU 65 -12.605 5.278 -3.294 483 HD22 LEU 65 2HD2 LEU 65 -14.046 5.880 -4.112 484 HD23 LEU 65 3HD2 LEU 65 -13.815 6.191 -2.391 485 H ASN 66 H ASN 66 -15.458 8.246 -1.111 486 HA ASN 66 HA ASN 66 -15.380 10.610 0.575 487 HB2 ASN 66 1HB ASN 66 -17.957 10.141 0.980 488 HB3 ASN 66 2HB ASN 66 -17.417 11.211 -0.310 489 HD21 ASN 66 1HD2 ASN 66 -19.059 8.342 0.488 490 HD22 ASN 66 2HD2 ASN 66 -19.425 7.827 -1.121 491 H ASP 67 H ASP 67 -16.306 10.139 2.767 492 HA ASP 67 HA ASP 67 -15.081 8.127 4.069 493 HB2 ASP 67 1HB ASP 67 -16.721 10.035 4.902 494 HB3 ASP 67 2HB ASP 67 -17.875 8.706 4.948 495 H ASP 68 H ASP 68 -17.908 7.824 2.080 496 HA ASP 68 HA ASP 68 -18.572 5.173 3.008 497 HB2 ASP 68 1HB ASP 68 -20.161 6.971 1.994 498 HB3 ASP 68 2HB ASP 68 -19.584 6.365 0.445 499 H GLU 69 H GLU 69 -17.648 6.415 -0.210 500 HA GLU 69 HA GLU 69 -17.014 3.926 -1.309 501 HB2 GLU 69 1HB GLU 69 -15.786 6.584 -2.055 502 HB3 GLU 69 2HB GLU 69 -15.888 5.151 -3.070 503 HG2 GLU 69 1HG GLU 69 -18.369 6.428 -2.004 504 HG3 GLU 69 2HG GLU 69 -17.561 7.083 -3.427 505 H LYS 70 H LYS 70 -14.831 6.392 0.050 506 HA LYS 70 HA LYS 70 -12.397 5.269 -0.267 507 HB2 LYS 70 1HB LYS 70 -13.436 6.538 2.273 508 HB3 LYS 70 2HB LYS 70 -11.737 6.283 1.898 509 HG2 LYS 70 1HG LYS 70 -11.968 7.751 -0.060 510 HG3 LYS 70 2HG LYS 70 -13.653 8.041 0.380 511 HD2 LYS 70 1HD LYS 70 -13.093 9.301 2.226 512 HD3 LYS 70 2HD LYS 70 -11.512 8.534 2.401 513 HE2 LYS 70 1HE LYS 70 -10.598 9.781 0.624 514 HE3 LYS 70 2HE LYS 70 -12.188 10.289 0.057 515 HZ1 LYS 70 1HZ LYS 70 -11.849 11.124 2.719 516 HZ2 LYS 70 2HZ LYS 70 -12.055 12.073 1.335 517 HZ3 LYS 70 3HZ LYS 70 -10.501 11.620 1.825 518 H LEU 71 H LEU 71 -14.726 4.386 2.262 519 HA LEU 71 HA LEU 71 -13.155 2.508 3.603 520 HB2 LEU 71 1HB LEU 71 -15.178 3.276 4.592 521 HB3 LEU 71 2HB LEU 71 -16.133 2.710 3.223 522 HG LEU 71 HG LEU 71 -15.658 0.387 3.867 523 HD11 LEU 71 1HD1 LEU 71 -14.590 1.261 6.494 524 HD12 LEU 71 2HD1 LEU 71 -13.489 1.243 5.117 525 HD13 LEU 71 3HD1 LEU 71 -14.320 -0.234 5.600 526 HD21 LEU 71 1HD2 LEU 71 -17.136 0.300 5.734 527 HD22 LEU 71 2HD2 LEU 71 -17.645 1.651 4.721 528 HD23 LEU 71 3HD2 LEU 71 -16.737 1.953 6.203 529 H ASN 72 H ASN 72 -15.602 1.940 1.069 530 HA ASN 72 HA ASN 72 -15.346 -0.779 0.785 531 HB2 ASN 72 1HB ASN 72 -15.755 1.245 -1.429 532 HB3 ASN 72 2HB ASN 72 -16.110 -0.476 -1.542 533 HD21 ASN 72 1HD2 ASN 72 -17.003 2.534 -0.002 534 HD22 ASN 72 2HD2 ASN 72 -18.597 2.049 0.454 535 H ASN 73 H ASN 73 -13.246 1.748 -0.466 536 HA ASN 73 HA ASN 73 -11.681 0.053 -2.129 537 HB2 ASN 73 1HB ASN 73 -11.427 2.837 -1.076 538 HB3 ASN 73 2HB ASN 73 -9.993 2.061 -1.743 539 HD21 ASN 73 1HD2 ASN 73 -10.579 4.149 -3.077 540 HD22 ASN 73 2HD2 ASN 73 -11.433 3.824 -4.544 541 H ALA 74 H ALA 74 -11.384 1.176 1.204 542 HA ALA 74 HA ALA 74 -8.802 0.151 1.696 543 HB1 ALA 74 1HB ALA 74 -9.806 1.821 3.140 544 HB2 ALA 74 2HB ALA 74 -11.058 0.676 3.627 545 HB3 ALA 74 3HB ALA 74 -9.377 0.386 4.073 546 H LYS 75 H LYS 75 -12.028 -1.194 2.372 547 HA LYS 75 HA LYS 75 -11.200 -3.581 3.556 548 HB2 LYS 75 1HB LYS 75 -13.661 -3.053 1.879 549 HB3 LYS 75 2HB LYS 75 -13.429 -4.452 2.920 550 HG2 LYS 75 1HG LYS 75 -13.279 -2.955 4.865 551 HG3 LYS 75 2HG LYS 75 -13.579 -1.577 3.804 552 HD2 LYS 75 1HD LYS 75 -15.453 -3.914 4.166 553 HD3 LYS 75 2HD LYS 75 -15.609 -2.360 4.989 554 HE2 LYS 75 1HE LYS 75 -15.720 -1.274 2.742 555 HE3 LYS 75 2HE LYS 75 -15.765 -2.883 2.024 556 HZ1 LYS 75 1HZ LYS 75 -17.926 -3.003 2.417 557 HZ2 LYS 75 2HZ LYS 75 -17.905 -1.404 2.969 558 HZ3 LYS 75 3HZ LYS 75 -17.709 -2.679 4.063 559 H TYR 76 H TYR 76 -11.745 -2.783 0.153 560 HA TYR 76 HA TYR 76 -11.294 -5.409 -0.827 561 HB2 TYR 76 1HB TYR 76 -12.517 -3.764 -2.146 562 HB3 TYR 76 2HB TYR 76 -11.093 -2.733 -2.223 563 HD1 TYR 76 1HD TYR 76 -12.492 -5.977 -3.325 564 HD2 TYR 76 2HD TYR 76 -9.416 -3.088 -3.859 565 HE1 TYR 76 1HE TYR 76 -11.791 -7.115 -5.391 566 HE2 TYR 76 2HE TYR 76 -8.706 -4.215 -5.926 567 HH TYR 76 HH TYR 76 -9.033 -5.930 -7.293 568 H ALA 77 H ALA 77 -9.233 -2.506 -0.743 569 HA ALA 77 HA ALA 77 -6.953 -3.478 -1.914 570 HB1 ALA 77 1HB ALA 77 -5.971 -1.951 0.171 571 HB2 ALA 77 2HB ALA 77 -6.452 -1.364 -1.421 572 HB3 ALA 77 3HB ALA 77 -7.599 -1.325 -0.082 573 H ILE 78 H ILE 78 -7.523 -3.464 1.612 574 HA ILE 78 HA ILE 78 -5.349 -4.927 2.415 575 HB ILE 78 HB ILE 78 -8.132 -5.106 3.575 576 HG12 ILE 78 1HG1 ILE 78 -5.831 -3.351 4.445 577 HG13 ILE 78 2HG1 ILE 78 -7.114 -2.802 3.373 578 HG21 ILE 78 1HG2 ILE 78 -6.285 -6.842 4.191 579 HG22 ILE 78 2HG2 ILE 78 -5.622 -5.511 5.138 580 HG23 ILE 78 3HG2 ILE 78 -7.254 -6.096 5.461 581 HD11 ILE 78 1HD1 ILE 78 -8.130 -2.140 5.236 582 HD12 ILE 78 2HD1 ILE 78 -8.512 -3.846 5.477 583 HD13 ILE 78 3HD1 ILE 78 -7.099 -3.137 6.262 584 H SER 79 H SER 79 -8.447 -6.150 1.222 585 HA SER 79 HA SER 79 -8.129 -8.851 1.717 586 HB2 SER 79 1HB SER 79 -10.143 -7.599 0.704 587 HB3 SER 79 2HB SER 79 -9.342 -7.839 -0.849 588 HG SER 79 HG SER 79 -9.348 -10.109 -0.361 589 H MET 80 H MET 80 -7.156 -7.057 -1.203 590 HA MET 80 HA MET 80 -6.058 -9.129 -2.654 591 HB2 MET 80 1HB MET 80 -5.573 -6.198 -2.519 592 HB3 MET 80 2HB MET 80 -4.388 -7.175 -3.376 593 HG2 MET 80 1HG MET 80 -6.191 -6.195 -4.797 594 HG3 MET 80 2HG MET 80 -6.002 -7.943 -4.922 595 HE1 MET 80 1HE MET 80 -9.332 -9.296 -4.353 596 HE2 MET 80 2HE MET 80 -8.543 -8.654 -5.794 597 HE3 MET 80 3HE MET 80 -7.607 -9.567 -4.608 598 H ALA 81 H ALA 81 -4.482 -7.108 -0.196 599 HA ALA 81 HA ALA 81 -1.898 -7.949 -0.322 600 HB1 ALA 81 1HB ALA 81 -3.519 -6.665 1.597 601 HB2 ALA 81 2HB ALA 81 -2.628 -7.936 2.437 602 HB3 ALA 81 3HB ALA 81 -1.758 -6.713 1.512 603 H ARG 82 H ARG 82 -4.541 -9.620 1.373 604 HA ARG 82 HA ARG 82 -2.919 -11.791 2.241 605 HB2 ARG 82 1HB ARG 82 -5.001 -11.177 3.385 606 HB3 ARG 82 2HB ARG 82 -5.922 -11.607 1.950 607 HG2 ARG 82 1HG ARG 82 -6.191 -13.487 3.223 608 HG3 ARG 82 2HG ARG 82 -4.774 -13.932 2.269 609 HD2 ARG 82 1HD ARG 82 -3.328 -13.203 4.125 610 HD3 ARG 82 2HD ARG 82 -4.764 -12.827 5.076 611 HE ARG 82 HE ARG 82 -3.669 -15.443 4.532 612 HH11 ARG 82 1HH1 ARG 82 -6.454 -13.617 5.545 613 HH12 ARG 82 2HH1 ARG 82 -7.188 -14.948 6.376 614 HH21 ARG 82 1HH2 ARG 82 -4.625 -17.204 5.622 615 HH22 ARG 82 2HH2 ARG 82 -6.146 -16.988 6.420 616 H LYS 83 H LYS 83 -5.115 -11.303 -0.489 617 HA LYS 83 HA LYS 83 -5.166 -13.875 -1.520 618 HB2 LYS 83 1HB LYS 83 -5.501 -11.150 -2.664 619 HB3 LYS 83 2HB LYS 83 -5.264 -12.475 -3.796 620 HG2 LYS 83 1HG LYS 83 -7.596 -12.192 -3.549 621 HG3 LYS 83 2HG LYS 83 -7.166 -13.654 -2.659 622 HD2 LYS 83 1HD LYS 83 -6.936 -11.925 -0.663 623 HD3 LYS 83 2HD LYS 83 -8.072 -11.006 -1.654 624 HE2 LYS 83 1HE LYS 83 -9.505 -12.242 -0.342 625 HE3 LYS 83 2HE LYS 83 -9.364 -13.269 -1.766 626 HZ1 LYS 83 1HZ LYS 83 -8.280 -13.665 0.926 627 HZ2 LYS 83 2HZ LYS 83 -7.403 -14.281 -0.382 628 HZ3 LYS 83 3HZ LYS 83 -8.998 -14.782 -0.122 629 H ILE 84 H ILE 84 -2.855 -11.263 -2.211 630 HA ILE 84 HA ILE 84 -1.268 -12.816 -3.987 631 HB ILE 84 HB ILE 84 0.425 -11.024 -3.712 632 HG12 ILE 84 1HG1 ILE 84 -1.585 -9.717 -1.876 633 HG13 ILE 84 2HG1 ILE 84 -0.169 -10.584 -1.293 634 HG21 ILE 84 1HG2 ILE 84 -2.319 -9.854 -4.103 635 HG22 ILE 84 2HG2 ILE 84 -0.805 -9.353 -4.855 636 HG23 ILE 84 3HG2 ILE 84 -1.536 -10.897 -5.291 637 HD11 ILE 84 1HD1 ILE 84 -0.136 -7.988 -1.599 638 HD12 ILE 84 2HD1 ILE 84 1.278 -8.963 -2.001 639 HD13 ILE 84 3HD1 ILE 84 0.202 -8.403 -3.279 640 H GLY 85 H GLY 85 -1.390 -12.469 -0.543 641 HA2 GLY 85 1HA GLY 85 -0.406 -14.324 0.729 642 HA3 GLY 85 2HA GLY 85 0.986 -14.213 -0.336 643 H ALA 86 H ALA 86 -0.726 -12.704 2.321 644 HA ALA 86 HA ALA 86 1.646 -11.803 3.550 645 HB1 ALA 86 1HB ALA 86 1.913 -9.678 2.905 646 HB2 ALA 86 2HB ALA 86 0.937 -10.131 1.508 647 HB3 ALA 86 3HB ALA 86 0.178 -9.361 2.900 648 H ARG 87 H ARG 87 1.027 -12.301 5.553 649 HA ARG 87 HA ARG 87 -1.679 -12.022 6.454 650 HB2 ARG 87 1HB ARG 87 0.855 -12.667 7.975 651 HB3 ARG 87 2HB ARG 87 -0.771 -12.772 8.636 652 HG2 ARG 87 1HG ARG 87 -1.181 -14.363 6.606 653 HG3 ARG 87 2HG ARG 87 0.577 -14.517 6.635 654 HD2 ARG 87 1HD ARG 87 -0.965 -14.825 9.171 655 HD3 ARG 87 2HD ARG 87 -0.932 -16.155 8.014 656 HE ARG 87 HE ARG 87 1.678 -15.534 8.287 657 HH11 ARG 87 1HH1 ARG 87 -0.855 -16.192 10.583 658 HH12 ARG 87 2HH1 ARG 87 0.216 -16.861 11.769 659 HH21 ARG 87 1HH2 ARG 87 3.098 -16.413 9.840 660 HH22 ARG 87 2HH2 ARG 87 2.464 -16.987 11.346 661 H VAL 88 H VAL 88 -2.247 -9.864 6.370 662 HA VAL 88 HA VAL 88 -0.662 -7.972 7.955 663 HB VAL 88 HB VAL 88 -1.282 -7.330 5.634 664 HG11 VAL 88 1HG1 VAL 88 -4.090 -7.326 6.737 665 HG12 VAL 88 2HG1 VAL 88 -3.606 -6.693 5.163 666 HG13 VAL 88 3HG1 VAL 88 -3.452 -8.416 5.506 667 HG21 VAL 88 1HG2 VAL 88 -1.544 -5.810 8.024 668 HG22 VAL 88 2HG2 VAL 88 -1.045 -5.267 6.422 669 HG23 VAL 88 3HG2 VAL 88 -2.751 -5.245 6.869 670 H TYR 89 H TYR 89 -1.483 -6.894 9.703 671 HA TYR 89 HA TYR 89 -4.144 -7.756 10.636 672 HB2 TYR 89 1HB TYR 89 -2.072 -8.595 11.907 673 HB3 TYR 89 2HB TYR 89 -1.899 -6.937 12.469 674 HD1 TYR 89 2HD TYR 89 -4.716 -9.379 12.110 675 HD2 TYR 89 1HD TYR 89 -2.683 -6.593 14.602 676 HE1 TYR 89 2HE TYR 89 -6.322 -9.829 13.917 677 HE2 TYR 89 1HE TYR 89 -4.284 -7.036 16.415 678 HH TYR 89 HH TYR 89 -6.937 -7.997 16.332 679 H ALA 90 H ALA 90 -4.805 -5.817 9.358 680 HA ALA 90 HA ALA 90 -4.736 -3.450 11.094 681 HB1 ALA 90 1HB ALA 90 -4.828 -2.239 8.701 682 HB2 ALA 90 2HB ALA 90 -3.328 -2.549 9.574 683 HB3 ALA 90 3HB ALA 90 -3.841 -3.641 8.288 684 H LEU 91 H LEU 91 -6.395 -1.768 10.063 685 HA LEU 91 HA LEU 91 -8.830 -3.251 9.327 686 HB2 LEU 91 1HB LEU 91 -8.671 -2.450 11.751 687 HB3 LEU 91 2HB LEU 91 -8.843 -0.823 11.094 688 HG LEU 91 HG LEU 91 -11.012 -1.704 10.028 689 HD11 LEU 91 1HD1 LEU 91 -11.843 -3.507 11.874 690 HD12 LEU 91 2HD1 LEU 91 -10.163 -3.994 11.653 691 HD13 LEU 91 3HD1 LEU 91 -11.250 -3.922 10.266 692 HD21 LEU 91 1HD2 LEU 91 -12.271 -1.098 11.958 693 HD22 LEU 91 2HD2 LEU 91 -10.803 -0.119 11.957 694 HD23 LEU 91 3HD2 LEU 91 -10.934 -1.511 13.033 695 HA PRO 92 HA PRO 92 -8.969 -0.386 5.964 696 HB2 PRO 92 1HB PRO 92 -11.509 -0.905 5.159 697 HB3 PRO 92 2HB PRO 92 -10.161 -2.004 4.849 698 HG2 PRO 92 1HG PRO 92 -12.250 -2.126 6.990 699 HG3 PRO 92 2HG PRO 92 -11.596 -3.436 5.988 700 HD2 PRO 92 1HD PRO 92 -10.787 -3.008 8.536 701 HD3 PRO 92 2HD PRO 92 -9.705 -3.655 7.287 702 H GLU 93 H GLU 93 -11.460 -0.450 8.458 703 HA GLU 93 HA GLU 93 -12.832 1.886 7.807 704 HB2 GLU 93 1HB GLU 93 -12.315 0.519 10.440 705 HB3 GLU 93 2HB GLU 93 -13.288 1.979 10.331 706 HG2 GLU 93 1HG GLU 93 -14.794 0.822 8.759 707 HG3 GLU 93 2HG GLU 93 -13.845 -0.648 8.974 708 H ASP 94 H ASP 94 -9.900 1.426 9.727 709 HA ASP 94 HA ASP 94 -9.667 4.204 10.404 710 HB2 ASP 94 1HB ASP 94 -7.723 1.901 10.634 711 HB3 ASP 94 2HB ASP 94 -7.397 3.525 11.230 712 H LEU 95 H LEU 95 -8.245 2.051 8.000 713 HA LEU 95 HA LEU 95 -6.229 3.638 6.994 714 HB2 LEU 95 1HB LEU 95 -6.435 1.432 6.187 715 HB3 LEU 95 2HB LEU 95 -8.091 1.704 5.647 716 HG LEU 95 HG LEU 95 -7.217 3.208 3.879 717 HD11 LEU 95 1HD1 LEU 95 -4.824 3.160 3.370 718 HD12 LEU 95 2HD1 LEU 95 -4.533 2.228 4.838 719 HD13 LEU 95 3HD1 LEU 95 -5.141 3.879 4.948 720 HD21 LEU 95 1HD2 LEU 95 -5.844 1.177 2.775 721 HD22 LEU 95 2HD2 LEU 95 -7.604 1.218 2.887 722 HD23 LEU 95 3HD2 LEU 95 -6.664 0.319 4.079 723 H VAL 96 H VAL 96 -9.685 3.744 6.256 724 HA VAL 96 HA VAL 96 -9.793 5.445 4.129 725 HB VAL 96 HB VAL 96 -11.577 5.432 6.565 726 HG11 VAL 96 1HG1 VAL 96 -12.917 6.374 4.240 727 HG12 VAL 96 2HG1 VAL 96 -12.652 7.205 5.774 728 HG13 VAL 96 3HG1 VAL 96 -11.465 7.344 4.477 729 HG21 VAL 96 1HG2 VAL 96 -12.786 3.799 5.565 730 HG22 VAL 96 2HG2 VAL 96 -12.460 4.399 3.939 731 HG23 VAL 96 3HG2 VAL 96 -11.240 3.452 4.790 732 H GLU 97 H GLU 97 -9.425 6.369 7.538 733 HA GLU 97 HA GLU 97 -9.032 9.155 6.762 734 HB2 GLU 97 1HB GLU 97 -9.202 7.843 9.480 735 HB3 GLU 97 2HB GLU 97 -8.981 9.568 9.218 736 HG2 GLU 97 1HG GLU 97 -11.138 9.592 7.981 737 HG3 GLU 97 2HG GLU 97 -11.367 7.907 8.448 738 H VAL 98 H VAL 98 -7.052 7.321 5.910 739 HA VAL 98 HA VAL 98 -4.814 6.770 6.118 740 HB VAL 98 HB VAL 98 -4.675 9.747 6.611 741 HG11 VAL 98 1HG1 VAL 98 -2.640 7.930 6.601 742 HG12 VAL 98 2HG1 VAL 98 -2.668 8.456 4.917 743 HG13 VAL 98 3HG1 VAL 98 -2.473 9.641 6.210 744 HG21 VAL 98 1HG2 VAL 98 -5.701 9.968 4.645 745 HG22 VAL 98 2HG2 VAL 98 -4.256 9.272 3.911 746 HG23 VAL 98 3HG2 VAL 98 -5.621 8.236 4.326 747 H ASN 99 H ASN 99 -5.798 5.979 8.445 748 HA ASN 99 HA ASN 99 -4.507 7.303 10.666 749 HB2 ASN 99 1HB ASN 99 -6.396 5.030 10.328 750 HB3 ASN 99 2HB ASN 99 -5.386 5.027 11.770 751 HD21 ASN 99 1HD2 ASN 99 -8.113 6.343 10.233 752 HD22 ASN 99 2HD2 ASN 99 -8.555 7.473 11.464 753 HA PRO 100 HA PRO 100 -0.730 5.010 9.983 754 HB2 PRO 100 1HB PRO 100 0.642 6.173 12.016 755 HB3 PRO 100 2HB PRO 100 0.374 6.967 10.460 756 HG2 PRO 100 1HG PRO 100 -1.096 7.318 13.045 757 HG3 PRO 100 2HG PRO 100 -0.555 8.550 11.889 758 HD2 PRO 100 1HD PRO 100 -3.114 7.671 11.990 759 HD3 PRO 100 2HD PRO 100 -2.342 8.192 10.478 760 H LYS 101 H LYS 101 -2.990 4.718 12.393 761 HA LYS 101 HA LYS 101 -1.514 3.200 14.312 762 HB2 LYS 101 1HB LYS 101 -4.497 3.320 13.828 763 HB3 LYS 101 2HB LYS 101 -3.714 2.649 15.252 764 HG2 LYS 101 1HG LYS 101 -3.555 5.527 14.378 765 HG3 LYS 101 2HG LYS 101 -4.613 4.896 15.643 766 HD2 LYS 101 1HD LYS 101 -2.427 3.993 16.691 767 HD3 LYS 101 2HD LYS 101 -1.625 5.150 15.627 768 HE2 LYS 101 1HE LYS 101 -1.950 6.217 17.733 769 HE3 LYS 101 2HE LYS 101 -3.094 6.928 16.597 770 HZ1 LYS 101 1HZ LYS 101 -4.531 6.527 18.262 771 HZ2 LYS 101 2HZ LYS 101 -3.588 5.303 18.951 772 HZ3 LYS 101 3HZ LYS 101 -4.567 4.964 17.614 773 H MET 102 H MET 102 -3.413 2.444 11.456 774 HA MET 102 HA MET 102 -2.923 -0.420 11.890 775 HB2 MET 102 1HB MET 102 -4.808 0.942 9.958 776 HB3 MET 102 2HB MET 102 -4.645 -0.796 10.176 777 HG2 MET 102 1HG MET 102 -5.503 1.110 12.340 778 HG3 MET 102 2HG MET 102 -6.610 0.202 11.313 779 HE1 MET 102 1HE MET 102 -5.456 -1.062 15.266 780 HE2 MET 102 2HE MET 102 -5.170 0.505 14.511 781 HE3 MET 102 3HE MET 102 -6.805 -0.150 14.591 782 H VAL 103 H VAL 103 -2.432 2.219 9.617 783 HA VAL 103 HA VAL 103 -1.466 0.875 7.411 784 HB VAL 103 HB VAL 103 -0.506 3.507 8.538 785 HG11 VAL 103 1HG1 VAL 103 1.158 3.184 7.042 786 HG12 VAL 103 2HG1 VAL 103 0.240 1.998 6.112 787 HG13 VAL 103 3HG1 VAL 103 -0.071 3.721 5.897 788 HG21 VAL 103 1HG2 VAL 103 -2.945 3.275 7.959 789 HG22 VAL 103 2HG2 VAL 103 -2.081 4.543 7.090 790 HG23 VAL 103 3HG2 VAL 103 -2.446 3.015 6.288 791 H MET 104 H MET 104 -0.112 1.024 10.530 792 HA MET 104 HA MET 104 2.626 0.849 10.013 793 HB2 MET 104 1HB MET 104 2.789 -0.238 12.226 794 HB3 MET 104 2HB MET 104 1.777 1.200 12.257 795 HG2 MET 104 1HG MET 104 -0.145 0.013 12.611 796 HG3 MET 104 2HG MET 104 0.483 -1.442 11.841 797 HE1 MET 104 1HE MET 104 -0.480 -2.772 15.052 798 HE2 MET 104 2HE MET 104 -0.524 -2.777 13.290 799 HE3 MET 104 3HE MET 104 0.754 -3.645 14.142 800 H THR 105 H THR 105 0.115 -1.615 9.985 801 HA THR 105 HA THR 105 2.088 -3.681 9.350 802 HB THR 105 HB THR 105 0.454 -4.311 11.026 803 HG1 THR 105 1HG THR 105 1.046 -5.716 8.989 804 HG21 THR 105 1HG2 THR 105 -1.377 -2.981 9.223 805 HG22 THR 105 2HG2 THR 105 -1.593 -3.426 10.916 806 HG23 THR 105 3HG2 THR 105 -1.950 -4.593 9.643 807 H VAL 106 H VAL 106 -0.542 -1.866 7.933 808 HA VAL 106 HA VAL 106 -1.175 -3.343 5.703 809 HB VAL 106 HB VAL 106 -0.869 -0.341 5.865 810 HG11 VAL 106 1HG1 VAL 106 -1.147 -1.791 3.578 811 HG12 VAL 106 2HG1 VAL 106 -2.831 -1.479 4.008 812 HG13 VAL 106 3HG1 VAL 106 -1.710 -0.134 3.795 813 HG21 VAL 106 1HG2 VAL 106 -3.451 -0.607 6.033 814 HG22 VAL 106 2HG2 VAL 106 -3.068 -2.243 6.568 815 HG23 VAL 106 3HG2 VAL 106 -2.456 -0.856 7.468 816 H PHE 107 H PHE 107 1.353 -0.830 5.875 817 HA PHE 107 HA PHE 107 2.419 -1.549 3.310 818 HB2 PHE 107 1HB PHE 107 3.104 0.429 5.434 819 HB3 PHE 107 2HB PHE 107 4.350 0.006 4.265 820 HD1 PHE 107 2HD PHE 107 2.969 -0.263 1.774 821 HD2 PHE 107 1HD PHE 107 2.280 2.510 4.929 822 HE1 PHE 107 2HE PHE 107 1.996 1.323 0.164 823 HE2 PHE 107 1HE PHE 107 1.305 4.100 3.323 824 HZ PHE 107 HZ PHE 107 1.164 3.508 0.938 825 H ALA 108 H ALA 108 3.550 -1.873 6.666 826 HA ALA 108 HA ALA 108 5.987 -2.966 6.447 827 HB1 ALA 108 1HB ALA 108 5.485 -3.052 8.625 828 HB2 ALA 108 2HB ALA 108 3.771 -3.336 8.314 829 HB3 ALA 108 3HB ALA 108 4.909 -4.683 8.281 830 H CYS 109 H CYS 109 3.047 -4.991 6.331 831 HA CYS 109 HA CYS 109 4.201 -7.396 5.689 832 HB2 CYS 109 1HB CYS 109 1.541 -6.183 5.029 833 HB3 CYS 109 2HB CYS 109 1.971 -7.751 4.355 834 HG CYS 109 HG CYS 109 1.350 -9.132 6.424 835 H LEU 110 H LEU 110 3.362 -4.745 3.513 836 HA LEU 110 HA LEU 110 4.159 -6.190 1.156 837 HB2 LEU 110 1HB LEU 110 3.582 -3.257 1.545 838 HB3 LEU 110 2HB LEU 110 3.778 -4.070 -0.007 839 HG LEU 110 HG LEU 110 1.612 -4.856 1.920 840 HD11 LEU 110 1HD1 LEU 110 1.379 -2.461 1.503 841 HD12 LEU 110 2HD1 LEU 110 0.097 -3.379 0.714 842 HD13 LEU 110 3HD1 LEU 110 1.445 -2.754 -0.235 843 HD21 LEU 110 1HD2 LEU 110 1.172 -6.363 0.353 844 HD22 LEU 110 2HD2 LEU 110 2.512 -5.763 -0.626 845 HD23 LEU 110 3HD2 LEU 110 0.901 -5.065 -0.810 846 H MET 111 H MET 111 5.341 -3.065 2.400 847 HA MET 111 HA MET 111 7.682 -2.877 1.045 848 HB2 MET 111 1HB MET 111 8.470 -1.395 2.717 849 HB3 MET 111 2HB MET 111 6.718 -1.238 2.724 850 HG2 MET 111 1HG MET 111 7.221 -1.320 4.967 851 HG3 MET 111 2HG MET 111 6.803 -2.995 4.612 852 HE1 MET 111 1HE MET 111 9.635 -0.494 4.451 853 HE2 MET 111 2HE MET 111 11.053 -1.339 5.073 854 HE3 MET 111 3HE MET 111 10.486 -1.653 3.431 855 H GLY 112 H GLY 112 7.006 -4.976 3.763 856 HA2 GLY 112 1HA GLY 112 9.403 -5.717 4.751 857 HA3 GLY 112 2HA GLY 112 8.137 -6.888 4.412 858 H LYS 113 H LYS 113 8.192 -6.549 1.552 859 HA LYS 113 HA LYS 113 10.021 -8.504 0.830 860 HB2 LYS 113 1HB LYS 113 8.410 -6.492 -0.665 861 HB3 LYS 113 2HB LYS 113 9.687 -7.332 -1.537 862 HG2 LYS 113 1HG LYS 113 8.637 -9.363 -1.399 863 HG3 LYS 113 2HG LYS 113 7.754 -8.930 0.066 864 HD2 LYS 113 1HD LYS 113 6.267 -7.513 -1.186 865 HD3 LYS 113 2HD LYS 113 7.219 -7.742 -2.656 866 HE2 LYS 113 1HE LYS 113 6.683 -10.160 -2.564 867 HE3 LYS 113 2HE LYS 113 5.645 -9.847 -1.174 868 HZ1 LYS 113 1HZ LYS 113 4.486 -8.195 -2.716 869 HZ2 LYS 113 2HZ LYS 113 4.200 -9.842 -2.971 870 HZ3 LYS 113 3HZ LYS 113 5.270 -9.006 -3.978 871 H GLY 114 H GLY 114 10.313 -4.974 0.597 872 HA2 GLY 114 1HA GLY 114 12.602 -4.606 -0.792 873 HA3 GLY 114 2HA GLY 114 12.230 -3.678 0.653 874 H MET 115 H MET 115 12.438 -5.723 2.566 875 HA MET 115 HA MET 115 15.091 -5.641 3.267 876 HB2 MET 115 1HB MET 115 12.850 -7.487 3.981 877 HB3 MET 115 2HB MET 115 14.473 -7.860 4.543 878 HG2 MET 115 1HG MET 115 13.125 -5.220 5.027 879 HG3 MET 115 2HG MET 115 13.032 -6.581 6.143 880 HE1 MET 115 1HE MET 115 14.754 -7.735 7.079 881 HE2 MET 115 2HE MET 115 16.485 -7.404 7.001 882 HE3 MET 115 3HE MET 115 15.494 -6.637 8.244 883 H LYS 116 H LYS 116 16.453 -7.739 3.624 884 HA LYS 116 HA LYS 116 17.477 -8.549 1.184 885 HB2 LYS 116 1HB LYS 116 18.640 -8.737 3.378 886 HB3 LYS 116 2HB LYS 116 17.607 -10.103 3.774 887 HG2 LYS 116 1HG LYS 116 19.421 -11.224 3.005 888 HG3 LYS 116 2HG LYS 116 18.554 -11.018 1.480 889 HD2 LYS 116 1HD LYS 116 20.447 -8.882 2.326 890 HD3 LYS 116 2HD LYS 116 21.117 -10.399 1.720 891 HE2 LYS 116 1HE LYS 116 19.366 -10.026 -0.204 892 HE3 LYS 116 2HE LYS 116 19.473 -8.345 0.315 893 HZ1 LYS 116 1HZ LYS 116 22.000 -9.730 -0.076 894 HZ2 LYS 116 2HZ LYS 116 21.562 -8.143 -0.465 895 HZ3 LYS 116 3HZ LYS 116 21.103 -9.419 -1.477 896 H ARG 117 H ARG 117 15.455 -10.501 3.384 897 HA ARG 117 HA ARG 117 14.717 -12.171 1.074 898 HB2 ARG 117 1HB ARG 117 14.139 -13.912 2.719 899 HB3 ARG 117 2HB ARG 117 15.824 -13.421 2.843 900 HG2 ARG 117 1HG ARG 117 15.287 -13.444 5.046 901 HG3 ARG 117 2HG ARG 117 14.829 -11.782 4.668 902 HD2 ARG 117 1HD ARG 117 12.506 -12.770 4.157 903 HD3 ARG 117 2HD ARG 117 13.075 -14.183 5.046 904 HE ARG 117 HE ARG 117 13.359 -11.646 6.414 905 HH11 ARG 117 1HH1 ARG 117 11.408 -14.481 5.883 906 HH12 ARG 117 2HH1 ARG 117 10.525 -14.311 7.364 907 HH21 ARG 117 1HH2 ARG 117 12.203 -11.411 8.367 908 HH22 ARG 117 2HH2 ARG 117 10.978 -12.564 8.776 909 H VAL 118 H VAL 118 12.532 -12.811 0.819 910 HA VAL 118 HA VAL 118 10.651 -10.757 1.486 911 HB VAL 118 HB VAL 118 9.019 -12.097 0.254 912 HG11 VAL 118 1HG1 VAL 118 11.642 -12.115 -1.225 913 HG12 VAL 118 2HG1 VAL 118 10.021 -11.948 -1.901 914 HG13 VAL 118 3HG1 VAL 118 10.704 -10.653 -0.917 915 HG21 VAL 118 1HG2 VAL 118 9.395 -14.264 -0.520 916 HG22 VAL 118 2HG2 VAL 118 11.137 -14.157 -0.261 917 HG23 VAL 118 3HG2 VAL 118 10.046 -14.294 1.119 918 H SER 119 H SER 119 8.647 -11.065 2.609 919 HA SER 119 HA SER 119 8.883 -12.171 5.137 920 HB2 SER 119 1HB SER 119 6.365 -11.595 3.555 921 HB3 SER 119 2HB SER 119 6.410 -11.914 5.290 922 HG SER 119 HG SER 119 8.188 -10.025 4.786 923 H GLY 120 H GLY 120 7.831 -13.986 6.132 924 HA2 GLY 120 1HA GLY 120 6.577 -16.051 5.901 925 HA3 GLY 120 2HA GLY 120 7.203 -16.182 4.264 926 HA PRO 121 HA PRO 121 9.876 -18.425 7.540 927 HB2 PRO 121 1HB PRO 121 8.928 -20.950 7.236 928 HB3 PRO 121 2HB PRO 121 8.281 -19.819 8.429 929 HG2 PRO 121 1HG PRO 121 7.214 -20.538 5.727 930 HG3 PRO 121 2HG PRO 121 6.339 -20.325 7.255 931 HD2 PRO 121 1HD PRO 121 6.417 -18.410 5.342 932 HD3 PRO 121 2HD PRO 121 6.326 -18.027 7.073 933 H SER 122 H SER 122 11.794 -19.105 6.807 934 HA SER 122 HA SER 122 12.034 -19.821 3.989 935 HB2 SER 122 1HB SER 122 14.353 -19.321 4.190 936 HB3 SER 122 2HB SER 122 13.510 -18.073 5.108 937 HG SER 122 HG SER 122 13.893 -19.635 6.950 938 H SER 123 H SER 123 12.161 -21.862 3.358 939 HA SER 123 HA SER 123 12.345 -24.006 5.238 940 HB2 SER 123 1HB SER 123 12.265 -25.456 3.212 941 HB3 SER 123 2HB SER 123 10.964 -24.266 3.260 942 HG SER 123 HG SER 123 11.668 -23.631 1.396 943 H GLY 124 H GLY 124 14.256 -24.302 6.231 944 HA2 GLY 124 1HA GLY 124 16.363 -25.391 6.214 945 HA3 GLY 124 2HA GLY 124 16.557 -24.934 4.528 Start of MODEL 20 1 H1 GLY 1 H GLY 1 20.048 5.716 -9.750 2 HA2 GLY 1 1HA GLY 1 21.264 5.786 -7.673 3 HA3 GLY 1 2HA GLY 1 20.408 7.267 -7.272 4 H SER 2 H SER 2 20.713 4.610 -5.885 5 HA SER 2 HA SER 2 18.149 3.365 -5.900 6 HB2 SER 2 1HB SER 2 20.193 2.160 -5.226 7 HB3 SER 2 2HB SER 2 20.347 3.216 -3.822 8 HG SER 2 HG SER 2 18.900 2.067 -2.828 9 H SER 3 H SER 3 19.751 5.681 -3.751 10 HA SER 3 HA SER 3 18.951 7.104 -2.165 11 HB2 SER 3 1HB SER 3 16.623 6.782 -4.010 12 HB3 SER 3 2HB SER 3 16.368 7.612 -2.475 13 HG SER 3 HG SER 3 17.059 8.890 -4.413 14 H GLY 4 H GLY 4 19.188 4.468 -1.376 15 HA2 GLY 4 1HA GLY 4 17.485 4.428 0.911 16 HA3 GLY 4 2HA GLY 4 16.997 3.211 -0.258 17 H SER 5 H SER 5 19.724 4.347 1.688 18 HA SER 5 HA SER 5 20.695 1.567 1.773 19 HB2 SER 5 1HB SER 5 22.370 4.085 1.630 20 HB3 SER 5 2HB SER 5 23.010 2.465 1.901 21 HG SER 5 HG SER 5 22.789 2.040 -0.150 22 H SER 6 H SER 6 21.186 0.767 3.744 23 HA SER 6 HA SER 6 21.271 0.582 6.010 24 HB2 SER 6 1HB SER 6 23.105 2.410 5.469 25 HB3 SER 6 2HB SER 6 21.977 3.473 6.310 26 HG SER 6 HG SER 6 23.659 1.602 7.318 27 H GLY 7 H GLY 7 18.764 1.008 4.997 28 HA2 GLY 7 1HA GLY 7 17.439 2.156 7.291 29 HA3 GLY 7 2HA GLY 7 17.189 3.061 5.805 30 H ASN 8 H ASN 8 16.194 0.417 7.682 31 HA ASN 8 HA ASN 8 14.799 -0.891 5.482 32 HB2 ASN 8 1HB ASN 8 14.110 -2.530 7.234 33 HB3 ASN 8 2HB ASN 8 15.857 -2.363 7.078 34 HD21 ASN 8 1HD2 ASN 8 13.235 -2.297 9.172 35 HD22 ASN 8 2HD2 ASN 8 14.040 -1.673 10.569 36 H ASP 9 H ASP 9 14.204 1.292 8.099 37 HA ASP 9 HA ASP 9 11.314 0.971 7.925 38 HB2 ASP 9 1HB ASP 9 13.062 2.730 9.655 39 HB3 ASP 9 2HB ASP 9 11.301 2.745 9.708 40 H ASP 10 H ASP 10 13.832 3.096 6.828 41 HA ASP 10 HA ASP 10 12.060 5.242 6.095 42 HB2 ASP 10 1HB ASP 10 14.948 4.722 5.361 43 HB3 ASP 10 2HB ASP 10 14.067 6.205 5.006 44 H ILE 11 H ILE 11 13.785 2.656 4.395 45 HA ILE 11 HA ILE 11 13.110 3.348 1.782 46 HB ILE 11 HB ILE 11 14.745 1.574 2.436 47 HG12 ILE 11 1HG1 ILE 11 12.769 0.328 0.564 48 HG13 ILE 11 2HG1 ILE 11 13.501 1.870 0.134 49 HG21 ILE 11 1HG2 ILE 11 13.247 -0.731 2.472 50 HG22 ILE 11 2HG2 ILE 11 13.998 0.036 3.871 51 HG23 ILE 11 3HG2 ILE 11 12.310 0.369 3.482 52 HD11 ILE 11 1HD1 ILE 11 14.975 0.463 -0.855 53 HD12 ILE 11 2HD1 ILE 11 15.717 0.562 0.742 54 HD13 ILE 11 3HD1 ILE 11 14.711 -0.824 0.321 55 H ILE 12 H ILE 12 11.107 2.288 4.303 56 HA ILE 12 HA ILE 12 9.159 0.777 3.035 57 HB ILE 12 HB ILE 12 8.774 2.824 5.222 58 HG12 ILE 12 1HG1 ILE 12 9.302 -0.154 5.290 59 HG13 ILE 12 2HG1 ILE 12 10.368 1.122 5.871 60 HG21 ILE 12 1HG2 ILE 12 6.816 1.129 5.702 61 HG22 ILE 12 2HG2 ILE 12 6.612 2.466 4.570 62 HG23 ILE 12 3HG2 ILE 12 6.945 0.843 3.966 63 HD11 ILE 12 1HD1 ILE 12 7.843 0.079 7.069 64 HD12 ILE 12 2HD1 ILE 12 9.426 0.311 7.811 65 HD13 ILE 12 3HD1 ILE 12 8.409 1.706 7.449 66 H VAL 13 H VAL 13 9.764 4.210 2.898 67 HA VAL 13 HA VAL 13 7.265 4.715 1.483 68 HB VAL 13 HB VAL 13 9.475 6.592 2.329 69 HG11 VAL 13 1HG1 VAL 13 6.796 7.292 1.139 70 HG12 VAL 13 2HG1 VAL 13 8.083 8.408 1.600 71 HG13 VAL 13 3HG1 VAL 13 8.316 7.300 0.247 72 HG21 VAL 13 1HG2 VAL 13 7.507 5.425 3.850 73 HG22 VAL 13 2HG2 VAL 13 8.358 6.919 4.239 74 HG23 VAL 13 3HG2 VAL 13 6.799 6.981 3.417 75 H ASN 14 H ASN 14 10.763 5.084 0.927 76 HA ASN 14 HA ASN 14 10.769 6.030 -1.643 77 HB2 ASN 14 1HB ASN 14 12.853 5.803 -0.529 78 HB3 ASN 14 2HB ASN 14 12.620 4.074 -0.284 79 HD21 ASN 14 1HD2 ASN 14 12.494 6.295 -3.054 80 HD22 ASN 14 2HD2 ASN 14 13.530 5.355 -4.068 81 H TRP 15 H TRP 15 10.933 2.571 -0.777 82 HA TRP 15 HA TRP 15 10.788 1.432 -3.244 83 HB2 TRP 15 1HB TRP 15 10.960 0.208 -1.069 84 HB3 TRP 15 2HB TRP 15 9.229 0.450 -0.844 85 HD1 TRP 15 HD TRP 15 11.494 -1.080 -3.618 86 HE1 TRP 15 1HE TRP 15 10.331 -3.202 -4.495 87 HE3 TRP 15 3HE TRP 15 7.257 -0.922 -0.761 88 HZ2 TRP 15 2HZ TRP 15 7.935 -4.621 -4.038 89 HZ3 TRP 15 3HZ TRP 15 5.579 -2.700 -1.043 90 HH2 TRP 15 HH TRP 15 5.913 -4.509 -2.648 91 H VAL 16 H VAL 16 7.869 1.901 -1.243 92 HA VAL 16 HA VAL 16 5.903 1.324 -2.979 93 HB VAL 16 HB VAL 16 5.922 3.754 -1.184 94 HG11 VAL 16 1HG1 VAL 16 3.709 4.051 -1.551 95 HG12 VAL 16 2HG1 VAL 16 4.104 3.312 -3.104 96 HG13 VAL 16 3HG1 VAL 16 3.409 2.333 -1.811 97 HG21 VAL 16 1HG2 VAL 16 6.262 1.204 -0.393 98 HG22 VAL 16 2HG2 VAL 16 5.424 2.420 0.572 99 HG23 VAL 16 3HG2 VAL 16 4.500 1.286 -0.414 100 H ASN 17 H ASN 17 7.609 4.440 -2.875 101 HA ASN 17 HA ASN 17 6.171 5.598 -5.027 102 HB2 ASN 17 1HB ASN 17 8.738 6.258 -3.615 103 HB3 ASN 17 2HB ASN 17 8.281 7.132 -5.074 104 HD21 ASN 17 1HD2 ASN 17 7.704 6.667 -1.728 105 HD22 ASN 17 2HD2 ASN 17 6.509 7.900 -1.536 106 H GLU 18 H GLU 18 9.165 3.754 -4.816 107 HA GLU 18 HA GLU 18 9.991 4.160 -7.495 108 HB2 GLU 18 1HB GLU 18 10.721 2.293 -5.295 109 HB3 GLU 18 2HB GLU 18 11.187 1.845 -6.929 110 HG2 GLU 18 1HG GLU 18 12.099 4.313 -6.986 111 HG3 GLU 18 2HG GLU 18 12.126 4.096 -5.237 112 H THR 19 H THR 19 8.837 1.110 -6.057 113 HA THR 19 HA THR 19 8.368 -0.372 -8.252 114 HB THR 19 HB THR 19 7.770 -0.810 -5.722 115 HG1 THR 19 1HG THR 19 6.687 -1.966 -8.058 116 HG21 THR 19 1HG2 THR 19 5.067 -0.173 -6.910 117 HG22 THR 19 2HG2 THR 19 5.890 0.777 -5.673 118 HG23 THR 19 3HG2 THR 19 5.369 -0.869 -5.319 119 H LEU 20 H LEU 20 6.342 2.272 -7.112 120 HA LEU 20 HA LEU 20 4.230 1.843 -8.972 121 HB2 LEU 20 1HB LEU 20 5.046 4.209 -7.306 122 HB3 LEU 20 2HB LEU 20 3.645 4.235 -8.375 123 HG LEU 20 HG LEU 20 3.945 2.219 -6.162 124 HD11 LEU 20 1HD1 LEU 20 2.355 4.754 -5.944 125 HD12 LEU 20 2HD1 LEU 20 4.025 4.650 -5.387 126 HD13 LEU 20 3HD1 LEU 20 2.792 3.608 -4.676 127 HD21 LEU 20 1HD2 LEU 20 2.322 1.575 -7.772 128 HD22 LEU 20 2HD2 LEU 20 1.650 3.205 -7.843 129 HD23 LEU 20 3HD2 LEU 20 1.442 2.228 -6.389 130 H ARG 21 H ARG 21 7.015 4.044 -8.898 131 HA ARG 21 HA ARG 21 6.472 5.417 -11.273 132 HB2 ARG 21 1HB ARG 21 8.214 5.970 -9.501 133 HB3 ARG 21 2HB ARG 21 9.239 4.764 -10.269 134 HG2 ARG 21 1HG ARG 21 9.993 6.619 -11.333 135 HG3 ARG 21 2HG ARG 21 8.678 6.187 -12.426 136 HD2 ARG 21 1HD ARG 21 7.201 7.753 -11.238 137 HD3 ARG 21 2HD ARG 21 8.542 8.200 -10.184 138 HE ARG 21 HE ARG 21 9.070 8.549 -12.996 139 HH11 ARG 21 1HH1 ARG 21 7.814 10.003 -10.093 140 HH12 ARG 21 2HH1 ARG 21 8.062 11.627 -10.642 141 HH21 ARG 21 1HH2 ARG 21 9.402 10.683 -13.732 142 HH22 ARG 21 2HH2 ARG 21 8.965 12.013 -12.712 143 H GLU 22 H GLU 22 8.606 2.610 -10.743 144 HA GLU 22 HA GLU 22 9.384 2.211 -13.378 145 HB2 GLU 22 1HB GLU 22 9.701 -0.201 -12.679 146 HB3 GLU 22 2HB GLU 22 10.517 1.000 -11.686 147 HG2 GLU 22 1HG GLU 22 9.641 -0.248 -10.026 148 HG3 GLU 22 2HG GLU 22 8.255 0.807 -10.301 149 H ALA 23 H ALA 23 6.428 1.304 -11.739 150 HA ALA 23 HA ALA 23 5.497 -0.301 -13.969 151 HB1 ALA 23 1HB ALA 23 4.400 0.385 -11.272 152 HB2 ALA 23 2HB ALA 23 3.358 -0.314 -12.512 153 HB3 ALA 23 3HB ALA 23 4.780 -1.196 -11.957 154 H GLU 24 H GLU 24 5.571 2.960 -13.186 155 HA GLU 24 HA GLU 24 4.717 4.788 -14.254 156 HB2 GLU 24 1HB GLU 24 3.072 2.974 -16.003 157 HB3 GLU 24 2HB GLU 24 3.668 4.589 -16.360 158 HG2 GLU 24 1HG GLU 24 5.657 2.448 -15.843 159 HG3 GLU 24 2HG GLU 24 4.788 2.432 -17.376 160 H LYS 25 H LYS 25 3.606 4.067 -11.901 161 HA LYS 25 HA LYS 25 0.708 4.048 -12.200 162 HB2 LYS 25 1HB LYS 25 2.622 3.584 -9.973 163 HB3 LYS 25 2HB LYS 25 1.034 4.209 -9.549 164 HG2 LYS 25 1HG LYS 25 1.336 1.693 -9.503 165 HG3 LYS 25 2HG LYS 25 -0.061 2.316 -10.386 166 HD2 LYS 25 1HD LYS 25 1.292 2.151 -12.482 167 HD3 LYS 25 2HD LYS 25 2.549 1.344 -11.542 168 HE2 LYS 25 1HE LYS 25 1.271 -0.550 -11.213 169 HE3 LYS 25 2HE LYS 25 -0.250 0.309 -11.453 170 HZ1 LYS 25 1HZ LYS 25 0.712 -1.269 -13.283 171 HZ2 LYS 25 2HZ LYS 25 1.603 0.103 -13.712 172 HZ3 LYS 25 3HZ LYS 25 -0.087 0.161 -13.707 173 H SER 26 H SER 26 -0.657 5.661 -11.373 174 HA SER 26 HA SER 26 0.558 8.317 -11.359 175 HB2 SER 26 1HB SER 26 -1.487 7.665 -12.782 176 HB3 SER 26 2HB SER 26 -2.398 7.736 -11.274 177 HG SER 26 HG SER 26 -2.433 9.730 -12.403 178 H SER 27 H SER 27 0.453 6.255 -9.078 179 HA SER 27 HA SER 27 -0.808 7.981 -7.055 180 HB2 SER 27 1HB SER 27 -1.581 5.567 -7.280 181 HB3 SER 27 2HB SER 27 0.007 5.098 -6.673 182 HG SER 27 HG SER 27 -0.435 6.224 -4.771 183 H SER 28 H SER 28 0.297 8.072 -4.938 184 HA SER 28 HA SER 28 2.997 7.354 -4.601 185 HB2 SER 28 1HB SER 28 4.159 9.407 -4.938 186 HB3 SER 28 2HB SER 28 3.201 9.145 -6.396 187 HG SER 28 HG SER 28 1.639 10.583 -5.511 188 H ILE 29 H ILE 29 3.900 8.155 -2.603 189 HA ILE 29 HA ILE 29 1.926 9.420 -0.824 190 HB ILE 29 HB ILE 29 2.946 7.944 1.011 191 HG12 ILE 29 1HG1 ILE 29 3.482 5.997 -1.198 192 HG13 ILE 29 2HG1 ILE 29 4.729 7.158 -0.759 193 HG21 ILE 29 1HG2 ILE 29 0.804 7.325 0.747 194 HG22 ILE 29 2HG2 ILE 29 0.920 7.311 -1.012 195 HG23 ILE 29 3HG2 ILE 29 1.492 5.928 -0.078 196 HD11 ILE 29 1HD1 ILE 29 5.284 5.344 0.531 197 HD12 ILE 29 2HD1 ILE 29 4.302 6.288 1.652 198 HD13 ILE 29 3HD1 ILE 29 3.603 4.899 0.820 199 H SER 30 H SER 30 2.695 10.937 0.559 200 HA SER 30 HA SER 30 5.390 11.877 0.115 201 HB2 SER 30 1HB SER 30 3.120 12.924 1.818 202 HB3 SER 30 2HB SER 30 4.691 13.716 1.692 203 HG SER 30 HG SER 30 3.441 14.668 0.167 204 H SER 31 H SER 31 3.539 10.446 2.756 205 HA SER 31 HA SER 31 5.817 9.296 3.962 206 HB2 SER 31 1HB SER 31 4.928 11.951 4.980 207 HB3 SER 31 2HB SER 31 5.379 10.731 6.171 208 HG SER 31 HG SER 31 6.963 11.807 4.086 209 H PHE 32 H PHE 32 5.269 8.320 6.129 210 HA PHE 32 HA PHE 32 3.157 6.643 6.039 211 HB2 PHE 32 1HB PHE 32 4.374 7.911 8.498 212 HB3 PHE 32 2HB PHE 32 3.267 6.544 8.551 213 HD1 PHE 32 2HD PHE 32 4.032 4.657 6.696 214 HD2 PHE 32 1HD PHE 32 6.565 7.352 8.803 215 HE1 PHE 32 2HE PHE 32 5.924 3.115 6.388 216 HE2 PHE 32 1HE PHE 32 8.461 5.814 8.497 217 HZ PHE 32 HZ PHE 32 8.142 3.692 7.290 218 H LYS 33 H LYS 33 3.060 10.009 6.874 219 HA LYS 33 HA LYS 33 0.235 9.793 7.649 220 HB2 LYS 33 1HB LYS 33 2.222 12.048 7.970 221 HB3 LYS 33 2HB LYS 33 0.521 12.164 8.405 222 HG2 LYS 33 1HG LYS 33 1.008 10.089 9.875 223 HG3 LYS 33 2HG LYS 33 2.697 10.572 9.692 224 HD2 LYS 33 1HD LYS 33 2.114 11.696 11.616 225 HD3 LYS 33 2HD LYS 33 1.789 12.925 10.390 226 HE2 LYS 33 1HE LYS 33 -0.536 12.536 10.478 227 HE3 LYS 33 2HE LYS 33 -0.329 11.031 11.372 228 HZ1 LYS 33 1HZ LYS 33 -0.195 12.109 13.310 229 HZ2 LYS 33 2HZ LYS 33 -0.923 13.398 12.490 230 HZ3 LYS 33 3HZ LYS 33 0.758 13.361 12.685 231 H ASP 34 H ASP 34 0.801 9.398 4.959 232 HA ASP 34 HA ASP 34 0.416 11.864 3.516 233 HB2 ASP 34 1HB ASP 34 1.681 10.261 2.341 234 HB3 ASP 34 2HB ASP 34 0.550 8.965 2.715 235 HA PRO 35 HA PRO 35 -3.995 11.892 3.921 236 HB2 PRO 35 1HB PRO 35 -4.479 13.842 2.096 237 HB3 PRO 35 2HB PRO 35 -3.836 14.175 3.709 238 HG2 PRO 35 1HG PRO 35 -2.385 13.962 1.099 239 HG3 PRO 35 2HG PRO 35 -2.174 15.145 2.403 240 HD2 PRO 35 1HD PRO 35 -0.518 13.028 2.073 241 HD3 PRO 35 2HD PRO 35 -0.894 13.706 3.669 242 H LYS 36 H LYS 36 -2.377 11.645 0.796 243 HA LYS 36 HA LYS 36 -4.575 10.992 -0.796 244 HB2 LYS 36 1HB LYS 36 -1.638 10.549 -0.968 245 HB3 LYS 36 2HB LYS 36 -2.663 9.608 -2.043 246 HG2 LYS 36 1HG LYS 36 -2.275 11.411 -3.370 247 HG3 LYS 36 2HG LYS 36 -3.723 11.976 -2.533 248 HD2 LYS 36 1HD LYS 36 -2.369 13.235 -0.970 249 HD3 LYS 36 2HD LYS 36 -0.890 12.597 -1.693 250 HE2 LYS 36 1HE LYS 36 -1.478 13.693 -3.814 251 HE3 LYS 36 2HE LYS 36 -2.928 14.353 -3.060 252 HZ1 LYS 36 1HZ LYS 36 -0.625 14.956 -1.517 253 HZ2 LYS 36 2HZ LYS 36 -1.755 16.009 -2.205 254 HZ3 LYS 36 3HZ LYS 36 -0.422 15.491 -3.108 255 H ILE 37 H ILE 37 -2.752 9.081 1.471 256 HA ILE 37 HA ILE 37 -3.376 6.504 0.639 257 HB ILE 37 HB ILE 37 -2.913 7.643 3.384 258 HG12 ILE 37 1HG1 ILE 37 -1.288 5.822 1.595 259 HG13 ILE 37 2HG1 ILE 37 -0.991 7.536 1.863 260 HG21 ILE 37 1HG2 ILE 37 -3.868 4.953 2.619 261 HG22 ILE 37 2HG2 ILE 37 -2.579 5.028 3.818 262 HG23 ILE 37 3HG2 ILE 37 -4.106 5.859 4.112 263 HD11 ILE 37 1HD1 ILE 37 0.269 7.056 3.610 264 HD12 ILE 37 2HD1 ILE 37 -1.079 6.222 4.383 265 HD13 ILE 37 3HD1 ILE 37 0.007 5.338 3.312 266 H SER 38 H SER 38 -5.374 8.910 2.123 267 HA SER 38 HA SER 38 -7.361 7.386 3.306 268 HB2 SER 38 1HB SER 38 -8.788 9.303 3.107 269 HB3 SER 38 2HB SER 38 -7.148 9.904 3.346 270 HG SER 38 HG SER 38 -8.402 9.617 0.817 271 H THR 39 H THR 39 -6.830 8.139 -0.081 272 HA THR 39 HA THR 39 -9.322 6.903 -0.900 273 HB THR 39 HB THR 39 -8.402 7.320 -3.233 274 HG1 THR 39 1HG THR 39 -6.166 7.477 -2.434 275 HG21 THR 39 1HG2 THR 39 -8.332 9.987 -2.088 276 HG22 THR 39 2HG2 THR 39 -9.646 9.016 -1.422 277 HG23 THR 39 3HG2 THR 39 -9.522 9.254 -3.164 278 H SER 40 H SER 40 -6.279 5.820 -0.064 279 HA SER 40 HA SER 40 -5.268 3.784 -0.188 280 HB2 SER 40 1HB SER 40 -7.834 2.894 -1.527 281 HB3 SER 40 2HB SER 40 -6.588 1.833 -0.870 282 HG SER 40 HG SER 40 -7.952 3.764 0.690 283 H LEU 41 H LEU 41 -5.148 5.800 -2.359 284 HA LEU 41 HA LEU 41 -5.013 4.470 -4.861 285 HB2 LEU 41 1HB LEU 41 -4.081 7.091 -3.793 286 HB3 LEU 41 2HB LEU 41 -3.460 6.535 -5.346 287 HG LEU 41 HG LEU 41 -6.363 7.003 -4.666 288 HD11 LEU 41 1HD1 LEU 41 -5.541 9.130 -4.905 289 HD12 LEU 41 2HD1 LEU 41 -5.936 8.740 -6.579 290 HD13 LEU 41 3HD1 LEU 41 -4.267 8.633 -6.019 291 HD21 LEU 41 1HD2 LEU 41 -5.915 6.839 -7.443 292 HD22 LEU 41 2HD2 LEU 41 -6.843 5.739 -6.424 293 HD23 LEU 41 3HD2 LEU 41 -5.128 5.439 -6.714 294 HA PRO 42 HA PRO 42 -0.245 4.377 -4.001 295 HB2 PRO 42 1HB PRO 42 0.534 4.778 -1.430 296 HB3 PRO 42 2HB PRO 42 0.366 6.093 -2.599 297 HG2 PRO 42 1HG PRO 42 -1.534 5.202 -0.465 298 HG3 PRO 42 2HG PRO 42 -1.067 6.847 -0.932 299 HD2 PRO 42 1HD PRO 42 -3.389 5.710 -1.734 300 HD3 PRO 42 2HD PRO 42 -2.504 6.880 -2.734 301 H VAL 43 H VAL 43 -2.464 3.237 -1.521 302 HA VAL 43 HA VAL 43 -0.869 0.952 -0.818 303 HB VAL 43 HB VAL 43 -3.803 1.298 -0.233 304 HG11 VAL 43 1HG1 VAL 43 -1.582 -0.376 0.829 305 HG12 VAL 43 2HG1 VAL 43 -2.870 0.122 1.926 306 HG13 VAL 43 3HG1 VAL 43 -3.253 -0.810 0.478 307 HG21 VAL 43 1HG2 VAL 43 -3.416 2.994 1.152 308 HG22 VAL 43 2HG2 VAL 43 -2.093 2.124 1.929 309 HG23 VAL 43 3HG2 VAL 43 -1.785 3.096 0.490 310 H LEU 44 H LEU 44 -3.612 1.601 -2.923 311 HA LEU 44 HA LEU 44 -4.051 -1.169 -3.557 312 HB2 LEU 44 1HB LEU 44 -5.096 1.411 -4.693 313 HB3 LEU 44 2HB LEU 44 -5.508 -0.160 -5.379 314 HG LEU 44 HG LEU 44 -6.040 0.464 -2.493 315 HD11 LEU 44 1HD1 LEU 44 -7.052 2.138 -4.219 316 HD12 LEU 44 2HD1 LEU 44 -8.061 1.463 -2.940 317 HD13 LEU 44 3HD1 LEU 44 -8.150 0.803 -4.574 318 HD21 LEU 44 1HD2 LEU 44 -8.003 -1.158 -3.283 319 HD22 LEU 44 2HD2 LEU 44 -6.443 -1.758 -2.718 320 HD23 LEU 44 3HD2 LEU 44 -6.768 -1.638 -4.447 321 H ASP 45 H ASP 45 -2.729 1.631 -5.314 322 HA ASP 45 HA ASP 45 -2.029 0.234 -7.652 323 HB2 ASP 45 1HB ASP 45 -0.943 2.776 -6.434 324 HB3 ASP 45 2HB ASP 45 -0.435 2.172 -8.008 325 H LEU 46 H LEU 46 -0.358 0.703 -4.606 326 HA LEU 46 HA LEU 46 2.211 -0.097 -5.365 327 HB2 LEU 46 1HB LEU 46 1.968 0.901 -3.253 328 HB3 LEU 46 2HB LEU 46 0.709 -0.234 -2.770 329 HG LEU 46 HG LEU 46 2.348 -2.004 -2.542 330 HD11 LEU 46 1HD1 LEU 46 4.000 -0.152 -4.055 331 HD12 LEU 46 2HD1 LEU 46 4.147 -1.896 -3.851 332 HD13 LEU 46 3HD1 LEU 46 4.823 -0.808 -2.640 333 HD21 LEU 46 1HD2 LEU 46 3.876 -0.759 -0.812 334 HD22 LEU 46 2HD2 LEU 46 2.148 -0.955 -0.510 335 HD23 LEU 46 3HD2 LEU 46 2.769 0.581 -1.119 336 H ILE 47 H ILE 47 -0.542 -2.007 -4.201 337 HA ILE 47 HA ILE 47 0.763 -4.494 -4.127 338 HB ILE 47 HB ILE 47 -2.162 -3.925 -4.626 339 HG12 ILE 47 1HG1 ILE 47 -0.921 -4.763 -2.017 340 HG13 ILE 47 2HG1 ILE 47 -0.998 -3.065 -2.477 341 HG21 ILE 47 1HG2 ILE 47 -1.084 -6.262 -5.148 342 HG22 ILE 47 2HG2 ILE 47 -1.157 -6.444 -3.396 343 HG23 ILE 47 3HG2 ILE 47 -2.634 -6.146 -4.313 344 HD11 ILE 47 1HD1 ILE 47 -3.018 -3.008 -1.582 345 HD12 ILE 47 2HD1 ILE 47 -3.568 -4.048 -2.896 346 HD13 ILE 47 3HD1 ILE 47 -3.036 -4.759 -1.371 347 H ASP 48 H ASP 48 -1.161 -2.951 -6.682 348 HA ASP 48 HA ASP 48 -1.097 -5.029 -8.539 349 HB2 ASP 48 1HB ASP 48 -2.446 -2.865 -8.634 350 HB3 ASP 48 2HB ASP 48 -0.995 -2.108 -9.283 351 H ALA 49 H ALA 49 1.135 -2.290 -8.147 352 HA ALA 49 HA ALA 49 2.837 -2.707 -10.254 353 HB1 ALA 49 1HB ALA 49 4.538 -2.032 -8.160 354 HB2 ALA 49 2HB ALA 49 3.707 -0.924 -9.252 355 HB3 ALA 49 3HB ALA 49 2.973 -1.356 -7.707 356 H ILE 50 H ILE 50 2.834 -4.359 -7.126 357 HA ILE 50 HA ILE 50 5.184 -5.887 -7.643 358 HB ILE 50 HB ILE 50 2.993 -6.583 -5.692 359 HG12 ILE 50 1HG1 ILE 50 5.427 -4.940 -5.032 360 HG13 ILE 50 2HG1 ILE 50 3.934 -4.180 -5.574 361 HG21 ILE 50 1HG2 ILE 50 5.889 -7.072 -5.225 362 HG22 ILE 50 2HG2 ILE 50 4.485 -7.983 -4.671 363 HG23 ILE 50 3HG2 ILE 50 5.025 -8.127 -6.343 364 HD11 ILE 50 1HD1 ILE 50 4.355 -5.836 -3.103 365 HD12 ILE 50 2HD1 ILE 50 3.963 -4.119 -3.205 366 HD13 ILE 50 3HD1 ILE 50 2.771 -5.325 -3.685 367 H GLN 51 H GLN 51 1.729 -6.771 -7.563 368 HA GLN 51 HA GLN 51 2.344 -8.940 -9.456 369 HB2 GLN 51 1HB GLN 51 1.912 -9.810 -7.167 370 HB3 GLN 51 2HB GLN 51 0.319 -9.068 -7.215 371 HG2 GLN 51 1HG GLN 51 -0.092 -11.279 -7.760 372 HG3 GLN 51 2HG GLN 51 -0.055 -10.470 -9.325 373 HE21 GLN 51 1HE2 GLN 51 0.596 -13.267 -8.227 374 HE22 GLN 51 2HE2 GLN 51 2.105 -13.645 -8.979 375 HA PRO 52 HA PRO 52 -0.711 -6.421 -11.636 376 HB2 PRO 52 1HB PRO 52 -0.145 -7.469 -14.076 377 HB3 PRO 52 2HB PRO 52 0.826 -6.196 -13.328 378 HG2 PRO 52 1HG PRO 52 1.330 -9.144 -13.441 379 HG3 PRO 52 2HG PRO 52 2.468 -7.805 -13.680 380 HD2 PRO 52 1HD PRO 52 2.306 -9.180 -11.353 381 HD3 PRO 52 2HD PRO 52 2.731 -7.457 -11.417 382 H GLY 53 H GLY 53 -2.791 -6.892 -12.090 383 HA2 GLY 53 1HA GLY 53 -4.360 -8.410 -13.238 384 HA3 GLY 53 2HA GLY 53 -3.488 -9.738 -12.485 385 H SER 54 H SER 54 -3.239 -8.433 -9.907 386 HA SER 54 HA SER 54 -5.648 -9.331 -8.734 387 HB2 SER 54 1HB SER 54 -3.390 -7.668 -7.599 388 HB3 SER 54 2HB SER 54 -4.712 -8.328 -6.636 389 HG SER 54 HG SER 54 -3.011 -9.916 -8.256 390 H ILE 55 H ILE 55 -4.287 -6.037 -8.918 391 HA ILE 55 HA ILE 55 -6.706 -4.810 -8.036 392 HB ILE 55 HB ILE 55 -4.368 -3.523 -9.449 393 HG12 ILE 55 1HG1 ILE 55 -3.471 -4.548 -7.512 394 HG13 ILE 55 2HG1 ILE 55 -3.751 -2.870 -7.058 395 HG21 ILE 55 1HG2 ILE 55 -6.743 -2.392 -9.103 396 HG22 ILE 55 2HG2 ILE 55 -6.079 -2.083 -7.500 397 HG23 ILE 55 3HG2 ILE 55 -5.240 -1.485 -8.931 398 HD11 ILE 55 1HD1 ILE 55 -4.423 -4.382 -5.288 399 HD12 ILE 55 2HD1 ILE 55 -5.820 -3.526 -5.941 400 HD13 ILE 55 3HD1 ILE 55 -5.526 -5.206 -6.390 401 H ASN 56 H ASN 56 -8.297 -3.798 -9.185 402 HA ASN 56 HA ASN 56 -8.112 -3.838 -12.115 403 HB2 ASN 56 1HB ASN 56 -9.500 -5.768 -10.944 404 HB3 ASN 56 2HB ASN 56 -10.730 -4.512 -10.845 405 HD21 ASN 56 1HD2 ASN 56 -11.319 -3.442 -12.865 406 HD22 ASN 56 2HD2 ASN 56 -11.293 -4.361 -14.328 407 H TYR 57 H TYR 57 -7.696 -1.569 -11.875 408 HA TYR 57 HA TYR 57 -9.131 0.323 -10.543 409 HB2 TYR 57 1HB TYR 57 -8.051 0.541 -13.361 410 HB3 TYR 57 2HB TYR 57 -8.515 1.904 -12.347 411 HD1 TYR 57 2HD TYR 57 -7.253 2.234 -10.151 412 HD2 TYR 57 1HD TYR 57 -5.893 -0.360 -13.236 413 HE1 TYR 57 2HE TYR 57 -4.986 2.300 -9.199 414 HE2 TYR 57 1HE TYR 57 -3.622 -0.302 -12.293 415 HH TYR 57 HH TYR 57 -2.809 0.344 -9.497 416 H ASP 58 H ASP 58 -10.019 -1.288 -13.546 417 HA ASP 58 HA ASP 58 -12.106 0.200 -14.465 418 HB2 ASP 58 1HB ASP 58 -11.148 -2.156 -15.194 419 HB3 ASP 58 2HB ASP 58 -12.529 -2.751 -14.276 420 H LEU 59 H LEU 59 -12.096 -1.933 -11.669 421 HA LEU 59 HA LEU 59 -14.926 -1.446 -11.179 422 HB2 LEU 59 1HB LEU 59 -13.000 -3.003 -9.470 423 HB3 LEU 59 2HB LEU 59 -14.761 -3.071 -9.444 424 HG LEU 59 HG LEU 59 -12.989 -4.065 -11.676 425 HD11 LEU 59 1HD1 LEU 59 -12.789 -5.503 -9.772 426 HD12 LEU 59 2HD1 LEU 59 -13.840 -6.288 -10.951 427 HD13 LEU 59 3HD1 LEU 59 -14.537 -5.509 -9.531 428 HD21 LEU 59 1HD2 LEU 59 -14.835 -3.794 -12.907 429 HD22 LEU 59 2HD2 LEU 59 -15.849 -3.512 -11.493 430 HD23 LEU 59 3HD2 LEU 59 -15.480 -5.162 -12.000 431 H LEU 60 H LEU 60 -11.780 -0.547 -9.935 432 HA LEU 60 HA LEU 60 -12.508 0.541 -7.477 433 HB2 LEU 60 1HB LEU 60 -10.360 1.419 -9.400 434 HB3 LEU 60 2HB LEU 60 -10.490 1.965 -7.729 435 HG LEU 60 HG LEU 60 -10.007 -0.883 -8.602 436 HD11 LEU 60 1HD1 LEU 60 -8.198 1.069 -8.807 437 HD12 LEU 60 2HD1 LEU 60 -7.781 -0.576 -8.332 438 HD13 LEU 60 3HD1 LEU 60 -7.986 0.670 -7.102 439 HD21 LEU 60 1HD2 LEU 60 -9.272 -0.518 -5.942 440 HD22 LEU 60 2HD2 LEU 60 -10.673 -1.403 -6.545 441 HD23 LEU 60 3HD2 LEU 60 -10.828 0.296 -6.099 442 H LYS 61 H LYS 61 -12.266 3.006 -7.040 443 HA LYS 61 HA LYS 61 -14.110 4.390 -8.869 444 HB2 LYS 61 1HB LYS 61 -13.725 4.481 -5.904 445 HB3 LYS 61 2HB LYS 61 -14.354 5.901 -6.727 446 HG2 LYS 61 1HG LYS 61 -16.222 4.678 -5.971 447 HG3 LYS 61 2HG LYS 61 -16.126 4.411 -7.713 448 HD2 LYS 61 1HD LYS 61 -14.735 2.312 -7.030 449 HD3 LYS 61 2HD LYS 61 -15.523 2.533 -5.465 450 HE2 LYS 61 1HE LYS 61 -17.065 2.424 -8.043 451 HE3 LYS 61 2HE LYS 61 -16.654 0.970 -7.132 452 HZ1 LYS 61 1HZ LYS 61 -18.577 3.065 -6.516 453 HZ2 LYS 61 2HZ LYS 61 -17.711 2.441 -5.205 454 HZ3 LYS 61 3HZ LYS 61 -18.633 1.409 -6.176 455 H THR 62 H THR 62 -11.622 5.316 -6.483 456 HA THR 62 HA THR 62 -10.142 7.063 -6.479 457 HB THR 62 HB THR 62 -9.008 5.382 -7.924 458 HG1 THR 62 1HG THR 62 -7.870 7.261 -7.416 459 HG21 THR 62 1HG2 THR 62 -10.430 5.240 -9.820 460 HG22 THR 62 2HG2 THR 62 -8.922 5.956 -10.389 461 HG23 THR 62 3HG2 THR 62 -10.333 6.976 -10.110 462 H GLU 63 H GLU 63 -12.895 7.706 -7.347 463 HA GLU 63 HA GLU 63 -12.262 10.222 -8.723 464 HB2 GLU 63 1HB GLU 63 -14.360 10.041 -10.014 465 HB3 GLU 63 2HB GLU 63 -13.215 8.769 -10.413 466 HG2 GLU 63 1HG GLU 63 -15.091 7.517 -10.249 467 HG3 GLU 63 2HG GLU 63 -14.582 7.464 -8.562 468 H ASN 64 H ASN 64 -12.675 11.759 -7.282 469 HA ASN 64 HA ASN 64 -13.580 12.818 -5.452 470 HB2 ASN 64 1HB ASN 64 -16.044 13.284 -5.799 471 HB3 ASN 64 2HB ASN 64 -15.000 13.693 -7.157 472 HD21 ASN 64 1HD2 ASN 64 -14.948 12.263 -8.966 473 HD22 ASN 64 2HD2 ASN 64 -16.312 11.263 -9.322 474 H LEU 65 H LEU 65 -13.110 10.105 -4.881 475 HA LEU 65 HA LEU 65 -15.128 8.561 -3.892 476 HB2 LEU 65 1HB LEU 65 -12.371 9.073 -2.820 477 HB3 LEU 65 2HB LEU 65 -13.454 7.896 -2.080 478 HG LEU 65 HG LEU 65 -12.814 7.699 -4.994 479 HD11 LEU 65 1HD1 LEU 65 -10.627 7.754 -4.287 480 HD12 LEU 65 2HD1 LEU 65 -11.000 6.038 -4.126 481 HD13 LEU 65 3HD1 LEU 65 -11.007 7.079 -2.702 482 HD21 LEU 65 1HD2 LEU 65 -12.907 5.200 -4.045 483 HD22 LEU 65 2HD2 LEU 65 -14.341 6.083 -4.568 484 HD23 LEU 65 3HD2 LEU 65 -13.934 5.996 -2.852 485 H ASN 66 H ASN 66 -15.704 8.175 -1.552 486 HA ASN 66 HA ASN 66 -15.740 10.550 0.119 487 HB2 ASN 66 1HB ASN 66 -18.344 10.009 0.374 488 HB3 ASN 66 2HB ASN 66 -17.737 11.149 -0.824 489 HD21 ASN 66 1HD2 ASN 66 -19.841 8.739 -0.410 490 HD22 ASN 66 2HD2 ASN 66 -19.903 8.094 -2.012 491 H ASP 67 H ASP 67 -16.781 10.086 2.259 492 HA ASP 67 HA ASP 67 -15.620 8.146 3.680 493 HB2 ASP 67 1HB ASP 67 -18.456 9.138 4.007 494 HB3 ASP 67 2HB ASP 67 -17.622 8.159 5.211 495 H ASP 68 H ASP 68 -18.370 7.688 1.566 496 HA ASP 68 HA ASP 68 -18.897 4.998 2.415 497 HB2 ASP 68 1HB ASP 68 -19.924 6.819 0.292 498 HB3 ASP 68 2HB ASP 68 -20.150 5.088 0.062 499 H GLU 69 H GLU 69 -17.949 6.178 -0.813 500 HA GLU 69 HA GLU 69 -17.042 3.760 -1.802 501 HB2 GLU 69 1HB GLU 69 -15.938 6.488 -2.485 502 HB3 GLU 69 2HB GLU 69 -15.832 5.044 -3.481 503 HG2 GLU 69 1HG GLU 69 -18.511 6.054 -2.664 504 HG3 GLU 69 2HG GLU 69 -17.634 6.870 -3.957 505 H LYS 70 H LYS 70 -15.094 6.352 -0.327 506 HA LYS 70 HA LYS 70 -12.584 5.418 -0.451 507 HB2 LYS 70 1HB LYS 70 -13.997 6.600 1.935 508 HB3 LYS 70 2HB LYS 70 -12.267 6.286 1.927 509 HG2 LYS 70 1HG LYS 70 -12.302 7.699 -0.262 510 HG3 LYS 70 2HG LYS 70 -13.835 8.294 0.379 511 HD2 LYS 70 1HD LYS 70 -12.787 9.129 2.341 512 HD3 LYS 70 2HD LYS 70 -11.279 8.290 1.972 513 HE2 LYS 70 1HE LYS 70 -10.927 9.713 0.042 514 HE3 LYS 70 2HE LYS 70 -12.480 10.504 0.310 515 HZ1 LYS 70 1HZ LYS 70 -10.465 10.518 2.451 516 HZ2 LYS 70 2HZ LYS 70 -11.692 11.636 2.127 517 HZ3 LYS 70 3HZ LYS 70 -10.306 11.599 1.160 518 H LEU 71 H LEU 71 -15.025 4.239 1.838 519 HA LEU 71 HA LEU 71 -13.434 2.438 3.245 520 HB2 LEU 71 1HB LEU 71 -15.568 2.909 4.104 521 HB3 LEU 71 2HB LEU 71 -16.362 2.478 2.590 522 HG LEU 71 HG LEU 71 -15.714 0.099 3.026 523 HD11 LEU 71 1HD1 LEU 71 -15.351 -0.160 5.654 524 HD12 LEU 71 2HD1 LEU 71 -14.533 1.384 5.414 525 HD13 LEU 71 3HD1 LEU 71 -14.012 -0.038 4.512 526 HD21 LEU 71 1HD2 LEU 71 -17.352 1.188 5.292 527 HD22 LEU 71 2HD2 LEU 71 -17.560 -0.318 4.397 528 HD23 LEU 71 3HD2 LEU 71 -17.936 1.225 3.627 529 H ASN 72 H ASN 72 -15.576 1.750 0.475 530 HA ASN 72 HA ASN 72 -15.028 -0.908 0.106 531 HB2 ASN 72 1HB ASN 72 -15.451 1.206 -2.017 532 HB3 ASN 72 2HB ASN 72 -15.534 -0.530 -2.306 533 HD21 ASN 72 1HD2 ASN 72 -17.003 2.151 -0.591 534 HD22 ASN 72 2HD2 ASN 72 -18.554 1.417 -0.389 535 H ASN 73 H ASN 73 -13.131 1.857 -1.023 536 HA ASN 73 HA ASN 73 -11.240 0.374 -2.505 537 HB2 ASN 73 1HB ASN 73 -11.039 3.092 -1.194 538 HB3 ASN 73 2HB ASN 73 -9.822 2.431 -2.282 539 HD21 ASN 73 1HD2 ASN 73 -10.089 4.029 -3.805 540 HD22 ASN 73 2HD2 ASN 73 -11.497 4.147 -4.799 541 H ALA 74 H ALA 74 -11.334 1.442 0.861 542 HA ALA 74 HA ALA 74 -8.721 0.648 1.560 543 HB1 ALA 74 1HB ALA 74 -9.510 0.774 3.880 544 HB2 ALA 74 2HB ALA 74 -10.011 2.179 2.938 545 HB3 ALA 74 3HB ALA 74 -11.171 0.901 3.300 546 H LYS 75 H LYS 75 -11.823 -1.049 1.644 547 HA LYS 75 HA LYS 75 -10.935 -3.364 2.971 548 HB2 LYS 75 1HB LYS 75 -13.156 -3.127 0.934 549 HB3 LYS 75 2HB LYS 75 -12.955 -4.426 2.102 550 HG2 LYS 75 1HG LYS 75 -13.178 -2.689 3.909 551 HG3 LYS 75 2HG LYS 75 -13.648 -1.552 2.643 552 HD2 LYS 75 1HD LYS 75 -15.041 -4.190 2.963 553 HD3 LYS 75 2HD LYS 75 -15.505 -2.786 3.928 554 HE2 LYS 75 1HE LYS 75 -15.858 -1.514 1.841 555 HE3 LYS 75 2HE LYS 75 -15.475 -2.965 0.917 556 HZ1 LYS 75 1HZ LYS 75 -17.942 -2.202 1.960 557 HZ2 LYS 75 2HZ LYS 75 -17.456 -3.581 2.811 558 HZ3 LYS 75 3HZ LYS 75 -17.563 -3.624 1.123 559 H TYR 76 H TYR 76 -11.095 -2.536 -0.467 560 HA TYR 76 HA TYR 76 -10.338 -5.027 -1.498 561 HB2 TYR 76 1HB TYR 76 -11.215 -2.910 -2.715 562 HB3 TYR 76 2HB TYR 76 -9.521 -2.437 -2.788 563 HD1 TYR 76 1HD TYR 76 -11.422 -5.613 -3.356 564 HD2 TYR 76 2HD TYR 76 -8.567 -2.830 -4.842 565 HE1 TYR 76 1HE TYR 76 -11.129 -6.998 -5.368 566 HE2 TYR 76 2HE TYR 76 -8.267 -4.206 -6.859 567 HH TYR 76 HH TYR 76 -8.581 -6.656 -7.478 568 H ALA 77 H ALA 77 -8.383 -2.229 -0.541 569 HA ALA 77 HA ALA 77 -5.885 -3.134 -1.353 570 HB1 ALA 77 1HB ALA 77 -5.100 -1.303 -0.324 571 HB2 ALA 77 2HB ALA 77 -6.803 -0.915 -0.076 572 HB3 ALA 77 3HB ALA 77 -5.883 -1.705 1.205 573 H ILE 78 H ILE 78 -7.052 -3.227 2.018 574 HA ILE 78 HA ILE 78 -5.112 -4.936 3.007 575 HB ILE 78 HB ILE 78 -7.984 -4.700 3.913 576 HG12 ILE 78 1HG1 ILE 78 -5.542 -3.372 5.087 577 HG13 ILE 78 2HG1 ILE 78 -6.535 -2.603 3.854 578 HG21 ILE 78 1HG2 ILE 78 -5.925 -5.405 5.871 579 HG22 ILE 78 2HG2 ILE 78 -7.552 -6.047 5.652 580 HG23 ILE 78 3HG2 ILE 78 -6.228 -6.643 4.653 581 HD11 ILE 78 1HD1 ILE 78 -8.373 -2.435 5.284 582 HD12 ILE 78 2HD1 ILE 78 -7.704 -3.603 6.423 583 HD13 ILE 78 3HD1 ILE 78 -6.985 -2.000 6.280 584 H SER 79 H SER 79 -8.202 -5.709 1.479 585 HA SER 79 HA SER 79 -8.280 -8.446 1.985 586 HB2 SER 79 1HB SER 79 -10.154 -7.164 1.002 587 HB3 SER 79 2HB SER 79 -9.248 -7.013 -0.503 588 HG SER 79 HG SER 79 -9.906 -8.930 -1.020 589 H MET 80 H MET 80 -6.987 -6.779 -0.891 590 HA MET 80 HA MET 80 -6.044 -8.968 -2.276 591 HB2 MET 80 1HB MET 80 -5.276 -6.099 -2.146 592 HB3 MET 80 2HB MET 80 -4.154 -7.198 -2.937 593 HG2 MET 80 1HG MET 80 -5.799 -6.059 -4.441 594 HG3 MET 80 2HG MET 80 -5.750 -7.817 -4.558 595 HE1 MET 80 1HE MET 80 -9.219 -8.005 -5.248 596 HE2 MET 80 2HE MET 80 -7.531 -8.444 -5.513 597 HE3 MET 80 3HE MET 80 -8.462 -9.243 -4.244 598 H ALA 81 H ALA 81 -4.374 -7.088 0.231 599 HA ALA 81 HA ALA 81 -1.880 -8.075 0.268 600 HB1 ALA 81 1HB ALA 81 -1.733 -7.254 2.352 601 HB2 ALA 81 2HB ALA 81 -3.384 -6.704 2.066 602 HB3 ALA 81 3HB ALA 81 -3.096 -8.210 2.935 603 H ARG 82 H ARG 82 -4.725 -9.792 1.510 604 HA ARG 82 HA ARG 82 -3.212 -12.105 2.286 605 HB2 ARG 82 1HB ARG 82 -6.196 -11.751 1.952 606 HB3 ARG 82 2HB ARG 82 -5.408 -13.119 2.727 607 HG2 ARG 82 1HG ARG 82 -4.391 -11.383 4.315 608 HG3 ARG 82 2HG ARG 82 -5.623 -10.290 3.680 609 HD2 ARG 82 1HD ARG 82 -7.360 -11.507 4.586 610 HD3 ARG 82 2HD ARG 82 -6.420 -12.997 4.650 611 HE ARG 82 HE ARG 82 -5.402 -10.967 6.392 612 HH11 ARG 82 1HH1 ARG 82 -7.783 -13.485 6.065 613 HH12 ARG 82 2HH1 ARG 82 -7.934 -13.745 7.771 614 HH21 ARG 82 1HH2 ARG 82 -5.591 -11.299 8.641 615 HH22 ARG 82 2HH2 ARG 82 -6.687 -12.500 9.236 616 H LYS 83 H LYS 83 -5.400 -11.296 -0.386 617 HA LYS 83 HA LYS 83 -5.554 -13.722 -1.672 618 HB2 LYS 83 1HB LYS 83 -5.599 -10.889 -2.616 619 HB3 LYS 83 2HB LYS 83 -5.529 -12.173 -3.818 620 HG2 LYS 83 1HG LYS 83 -7.805 -11.668 -3.554 621 HG3 LYS 83 2HG LYS 83 -7.549 -13.174 -2.671 622 HD2 LYS 83 1HD LYS 83 -7.273 -11.767 -0.593 623 HD3 LYS 83 2HD LYS 83 -7.842 -10.395 -1.547 624 HE2 LYS 83 1HE LYS 83 -9.720 -11.278 -0.382 625 HE3 LYS 83 2HE LYS 83 -9.893 -11.734 -2.076 626 HZ1 LYS 83 1HZ LYS 83 -10.398 -13.652 -0.866 627 HZ2 LYS 83 2HZ LYS 83 -9.108 -13.441 0.207 628 HZ3 LYS 83 3HZ LYS 83 -8.810 -13.904 -1.393 629 H ILE 84 H ILE 84 -3.134 -11.180 -2.313 630 HA ILE 84 HA ILE 84 -1.582 -12.770 -4.065 631 HB ILE 84 HB ILE 84 0.180 -11.061 -3.752 632 HG12 ILE 84 1HG1 ILE 84 -1.759 -9.706 -1.875 633 HG13 ILE 84 2HG1 ILE 84 -0.394 -10.666 -1.316 634 HG21 ILE 84 1HG2 ILE 84 -0.892 -9.865 -5.285 635 HG22 ILE 84 2HG2 ILE 84 -2.357 -10.762 -4.891 636 HG23 ILE 84 3HG2 ILE 84 -2.014 -9.236 -4.079 637 HD11 ILE 84 1HD1 ILE 84 -0.476 -7.938 -2.234 638 HD12 ILE 84 2HD1 ILE 84 0.804 -8.807 -1.386 639 HD13 ILE 84 3HD1 ILE 84 0.698 -8.887 -3.145 640 H GLY 85 H GLY 85 -1.789 -12.596 -0.635 641 HA2 GLY 85 1HA GLY 85 -0.875 -14.482 0.608 642 HA3 GLY 85 2HA GLY 85 0.532 -14.410 -0.443 643 H ALA 86 H ALA 86 -1.200 -12.714 2.122 644 HA ALA 86 HA ALA 86 1.198 -12.032 3.472 645 HB1 ALA 86 1HB ALA 86 1.173 -10.392 1.535 646 HB2 ALA 86 2HB ALA 86 -0.219 -9.646 2.319 647 HB3 ALA 86 3HB ALA 86 1.335 -9.704 3.152 648 H ARG 87 H ARG 87 0.636 -12.132 5.536 649 HA ARG 87 HA ARG 87 -2.138 -11.647 6.298 650 HB2 ARG 87 1HB ARG 87 0.174 -12.779 7.884 651 HB3 ARG 87 2HB ARG 87 -1.484 -12.655 8.456 652 HG2 ARG 87 1HG ARG 87 -0.981 -14.115 5.919 653 HG3 ARG 87 2HG ARG 87 -0.532 -14.888 7.442 654 HD2 ARG 87 1HD ARG 87 -2.699 -15.070 8.145 655 HD3 ARG 87 2HD ARG 87 -3.222 -13.644 7.252 656 HE ARG 87 HE ARG 87 -2.671 -15.367 5.274 657 HH11 ARG 87 1HH1 ARG 87 -4.517 -15.707 8.206 658 HH12 ARG 87 2HH1 ARG 87 -5.604 -16.882 7.539 659 HH21 ARG 87 1HH2 ARG 87 -4.095 -16.912 4.385 660 HH22 ARG 87 2HH2 ARG 87 -5.362 -17.566 5.367 661 H VAL 88 H VAL 88 -2.561 -9.548 6.631 662 HA VAL 88 HA VAL 88 -0.682 -8.008 8.301 663 HB VAL 88 HB VAL 88 -0.914 -7.093 6.032 664 HG11 VAL 88 1HG1 VAL 88 -2.867 -7.064 4.980 665 HG12 VAL 88 2HG1 VAL 88 -3.647 -7.717 6.423 666 HG13 VAL 88 3HG1 VAL 88 -3.525 -5.971 6.199 667 HG21 VAL 88 1HG2 VAL 88 -2.002 -4.807 6.913 668 HG22 VAL 88 2HG2 VAL 88 -1.731 -5.614 8.457 669 HG23 VAL 88 3HG2 VAL 88 -0.380 -5.336 7.359 670 H TYR 89 H TYR 89 -1.435 -6.953 10.080 671 HA TYR 89 HA TYR 89 -4.176 -7.594 10.891 672 HB2 TYR 89 1HB TYR 89 -2.088 -6.397 12.692 673 HB3 TYR 89 2HB TYR 89 -3.482 -7.385 13.121 674 HD1 TYR 89 1HD TYR 89 -3.445 -9.840 12.594 675 HD2 TYR 89 2HD TYR 89 0.009 -7.384 12.215 676 HE1 TYR 89 1HE TYR 89 -2.023 -11.847 12.608 677 HE2 TYR 89 2HE TYR 89 1.440 -9.384 12.227 678 HH TYR 89 HH TYR 89 1.056 -11.913 13.266 679 H ALA 90 H ALA 90 -5.117 -5.947 9.547 680 HA ALA 90 HA ALA 90 -5.191 -3.368 10.903 681 HB1 ALA 90 1HB ALA 90 -5.207 -2.495 8.332 682 HB2 ALA 90 2HB ALA 90 -3.794 -2.478 9.387 683 HB3 ALA 90 3HB ALA 90 -4.026 -3.803 8.246 684 H LEU 91 H LEU 91 -6.826 -1.935 9.389 685 HA LEU 91 HA LEU 91 -9.054 -3.577 8.492 686 HB2 LEU 91 1HB LEU 91 -9.212 -3.113 11.011 687 HB3 LEU 91 2HB LEU 91 -9.554 -1.448 10.546 688 HG LEU 91 HG LEU 91 -11.518 -2.292 9.252 689 HD11 LEU 91 1HD1 LEU 91 -11.666 -4.790 10.735 690 HD12 LEU 91 2HD1 LEU 91 -10.338 -4.752 9.577 691 HD13 LEU 91 3HD1 LEU 91 -11.990 -4.459 9.033 692 HD21 LEU 91 1HD2 LEU 91 -12.535 -1.581 11.094 693 HD22 LEU 91 2HD2 LEU 91 -11.180 -2.085 12.104 694 HD23 LEU 91 3HD2 LEU 91 -12.460 -3.233 11.707 695 HA PRO 92 HA PRO 92 -9.304 -0.295 5.554 696 HB2 PRO 92 1HB PRO 92 -11.753 -0.877 4.536 697 HB3 PRO 92 2HB PRO 92 -10.309 -1.828 4.167 698 HG2 PRO 92 1HG PRO 92 -12.489 -2.382 6.143 699 HG3 PRO 92 2HG PRO 92 -11.687 -3.496 5.022 700 HD2 PRO 92 1HD PRO 92 -11.044 -3.359 7.648 701 HD3 PRO 92 2HD PRO 92 -9.853 -3.756 6.393 702 H GLU 93 H GLU 93 -11.301 -0.618 8.280 703 HA GLU 93 HA GLU 93 -13.128 1.504 7.783 704 HB2 GLU 93 1HB GLU 93 -12.215 0.274 10.389 705 HB3 GLU 93 2HB GLU 93 -13.563 1.389 10.224 706 HG2 GLU 93 1HG GLU 93 -14.503 -0.323 8.554 707 HG3 GLU 93 2HG GLU 93 -13.331 -1.433 9.262 708 H ASP 94 H ASP 94 -10.171 1.299 9.757 709 HA ASP 94 HA ASP 94 -10.166 4.151 10.211 710 HB2 ASP 94 1HB ASP 94 -8.553 1.830 11.129 711 HB3 ASP 94 2HB ASP 94 -7.761 3.403 11.126 712 H LEU 95 H LEU 95 -8.679 1.890 8.031 713 HA LEU 95 HA LEU 95 -6.474 3.363 7.170 714 HB2 LEU 95 1HB LEU 95 -6.643 1.113 6.492 715 HB3 LEU 95 2HB LEU 95 -8.237 1.365 5.787 716 HG LEU 95 HG LEU 95 -7.271 2.611 3.953 717 HD11 LEU 95 1HD1 LEU 95 -5.340 3.430 5.504 718 HD12 LEU 95 2HD1 LEU 95 -5.067 3.241 3.773 719 HD13 LEU 95 3HD1 LEU 95 -4.506 2.001 4.893 720 HD21 LEU 95 1HD2 LEU 95 -5.425 0.585 3.490 721 HD22 LEU 95 2HD2 LEU 95 -7.129 0.591 3.034 722 HD23 LEU 95 3HD2 LEU 95 -6.626 -0.140 4.559 723 H VAL 96 H VAL 96 -9.866 3.629 6.347 724 HA VAL 96 HA VAL 96 -9.720 5.164 4.034 725 HB VAL 96 HB VAL 96 -11.757 5.107 6.248 726 HG11 VAL 96 1HG1 VAL 96 -12.441 7.122 5.551 727 HG12 VAL 96 2HG1 VAL 96 -11.469 7.048 4.079 728 HG13 VAL 96 3HG1 VAL 96 -13.048 6.264 4.135 729 HG21 VAL 96 1HG2 VAL 96 -11.226 3.357 4.207 730 HG22 VAL 96 2HG2 VAL 96 -12.763 3.498 5.061 731 HG23 VAL 96 3HG2 VAL 96 -12.521 4.348 3.534 732 H GLU 97 H GLU 97 -9.379 6.102 7.402 733 HA GLU 97 HA GLU 97 -9.098 8.913 6.629 734 HB2 GLU 97 1HB GLU 97 -9.257 7.634 9.363 735 HB3 GLU 97 2HB GLU 97 -9.135 9.361 9.062 736 HG2 GLU 97 1HG GLU 97 -11.277 9.071 7.683 737 HG3 GLU 97 2HG GLU 97 -11.424 7.518 8.505 738 H VAL 98 H VAL 98 -7.096 6.731 6.130 739 HA VAL 98 HA VAL 98 -4.850 6.349 6.288 740 HB VAL 98 HB VAL 98 -4.801 9.340 6.714 741 HG11 VAL 98 1HG1 VAL 98 -2.714 7.476 6.826 742 HG12 VAL 98 2HG1 VAL 98 -2.575 8.263 5.253 743 HG13 VAL 98 3HG1 VAL 98 -2.583 9.231 6.727 744 HG21 VAL 98 1HG2 VAL 98 -5.928 9.073 4.706 745 HG22 VAL 98 2HG2 VAL 98 -4.249 9.215 4.185 746 HG23 VAL 98 3HG2 VAL 98 -5.014 7.629 4.268 747 H ASN 99 H ASN 99 -5.857 5.527 8.565 748 HA ASN 99 HA ASN 99 -4.874 6.872 10.882 749 HB2 ASN 99 1HB ASN 99 -6.791 5.043 10.553 750 HB3 ASN 99 2HB ASN 99 -5.469 3.956 10.972 751 HD21 ASN 99 1HD2 ASN 99 -8.002 5.036 12.330 752 HD22 ASN 99 2HD2 ASN 99 -7.450 5.465 13.910 753 HA PRO 100 HA PRO 100 -0.676 5.410 10.268 754 HB2 PRO 100 1HB PRO 100 0.376 6.853 12.313 755 HB3 PRO 100 2HB PRO 100 -0.002 7.556 10.736 756 HG2 PRO 100 1HG PRO 100 -1.585 7.639 13.275 757 HG3 PRO 100 2HG PRO 100 -1.270 8.938 12.111 758 HD2 PRO 100 1HD PRO 100 -3.602 7.564 12.164 759 HD3 PRO 100 2HD PRO 100 -2.908 8.209 10.663 760 H LYS 101 H LYS 101 -2.661 5.245 13.120 761 HA LYS 101 HA LYS 101 -0.918 3.781 14.786 762 HB2 LYS 101 1HB LYS 101 -3.879 4.205 14.690 763 HB3 LYS 101 2HB LYS 101 -3.219 2.986 15.772 764 HG2 LYS 101 1HG LYS 101 -3.269 4.777 17.174 765 HG3 LYS 101 2HG LYS 101 -1.646 4.966 16.503 766 HD2 LYS 101 1HD LYS 101 -2.311 6.708 15.088 767 HD3 LYS 101 2HD LYS 101 -4.021 6.299 15.241 768 HE2 LYS 101 1HE LYS 101 -3.632 6.857 17.760 769 HE3 LYS 101 2HE LYS 101 -2.231 7.738 17.153 770 HZ1 LYS 101 1HZ LYS 101 -4.477 8.951 17.395 771 HZ2 LYS 101 2HZ LYS 101 -4.881 8.177 15.947 772 HZ3 LYS 101 3HZ LYS 101 -3.549 9.217 16.006 773 H MET 102 H MET 102 -3.181 2.822 12.276 774 HA MET 102 HA MET 102 -2.556 -0.001 12.762 775 HB2 MET 102 1HB MET 102 -4.742 1.410 11.268 776 HB3 MET 102 2HB MET 102 -4.379 -0.277 10.928 777 HG2 MET 102 1HG MET 102 -5.070 -0.987 13.009 778 HG3 MET 102 2HG MET 102 -4.852 0.603 13.737 779 HE1 MET 102 1HE MET 102 -6.409 -0.246 10.385 780 HE2 MET 102 2HE MET 102 -7.334 -1.481 11.241 781 HE3 MET 102 3HE MET 102 -8.147 -0.048 10.610 782 H VAL 103 H VAL 103 -2.490 2.464 10.222 783 HA VAL 103 HA VAL 103 -1.693 1.102 8.024 784 HB VAL 103 HB VAL 103 -0.662 3.742 9.049 785 HG11 VAL 103 1HG1 VAL 103 1.071 3.234 7.633 786 HG12 VAL 103 2HG1 VAL 103 0.068 2.227 6.588 787 HG13 VAL 103 3HG1 VAL 103 -0.060 3.984 6.509 788 HG21 VAL 103 1HG2 VAL 103 -3.101 3.007 7.998 789 HG22 VAL 103 2HG2 VAL 103 -2.457 4.648 8.073 790 HG23 VAL 103 3HG2 VAL 103 -2.249 3.685 6.610 791 H MET 104 H MET 104 0.082 1.441 10.961 792 HA MET 104 HA MET 104 2.702 1.151 10.265 793 HB2 MET 104 1HB MET 104 3.097 0.356 12.406 794 HB3 MET 104 2HB MET 104 1.553 1.175 12.601 795 HG2 MET 104 1HG MET 104 0.651 -1.259 12.010 796 HG3 MET 104 2HG MET 104 2.205 -1.703 12.712 797 HE1 MET 104 1HE MET 104 -0.502 -2.757 14.178 798 HE2 MET 104 2HE MET 104 -1.392 -1.499 15.036 799 HE3 MET 104 3HE MET 104 -1.264 -1.446 13.277 800 H THR 105 H THR 105 0.181 -1.286 10.138 801 HA THR 105 HA THR 105 2.099 -3.328 9.305 802 HB THR 105 HB THR 105 0.103 -4.850 9.321 803 HG1 THR 105 1HG THR 105 -1.829 -4.045 9.701 804 HG21 THR 105 1HG2 THR 105 1.552 -3.759 11.483 805 HG22 THR 105 2HG2 THR 105 0.734 -5.320 11.405 806 HG23 THR 105 3HG2 THR 105 -0.123 -3.905 12.016 807 H VAL 106 H VAL 106 -0.652 -1.494 8.079 808 HA VAL 106 HA VAL 106 -1.326 -2.664 5.757 809 HB VAL 106 HB VAL 106 -0.854 0.243 6.338 810 HG11 VAL 106 1HG1 VAL 106 -0.371 0.035 3.988 811 HG12 VAL 106 2HG1 VAL 106 -1.824 -0.936 3.738 812 HG13 VAL 106 3HG1 VAL 106 -1.964 0.765 4.185 813 HG21 VAL 106 1HG2 VAL 106 -3.413 0.137 5.850 814 HG22 VAL 106 2HG2 VAL 106 -3.203 -1.592 6.132 815 HG23 VAL 106 3HG2 VAL 106 -2.789 -0.435 7.397 816 H PHE 107 H PHE 107 1.580 -0.668 6.205 817 HA PHE 107 HA PHE 107 2.517 -1.378 3.539 818 HB2 PHE 107 1HB PHE 107 3.356 0.609 5.614 819 HB3 PHE 107 2HB PHE 107 4.514 0.114 4.384 820 HD1 PHE 107 2HD PHE 107 2.859 -0.152 2.006 821 HD2 PHE 107 1HD PHE 107 2.737 2.769 5.099 822 HE1 PHE 107 2HE PHE 107 1.879 1.467 0.434 823 HE2 PHE 107 1HE PHE 107 1.755 4.393 3.533 824 HZ PHE 107 HZ PHE 107 1.326 3.743 1.196 825 H ALA 108 H ALA 108 3.802 -1.492 6.863 826 HA ALA 108 HA ALA 108 6.115 -2.816 6.605 827 HB1 ALA 108 1HB ALA 108 3.941 -3.098 8.629 828 HB2 ALA 108 2HB ALA 108 5.357 -4.148 8.720 829 HB3 ALA 108 3HB ALA 108 5.551 -2.397 8.796 830 H CYS 109 H CYS 109 2.984 -4.519 6.799 831 HA CYS 109 HA CYS 109 3.850 -7.098 6.431 832 HB2 CYS 109 1HB CYS 109 1.451 -6.123 6.781 833 HB3 CYS 109 2HB CYS 109 1.374 -6.159 5.024 834 HG CYS 109 HG CYS 109 1.004 -8.625 7.195 835 H LEU 110 H LEU 110 3.321 -4.613 3.989 836 HA LEU 110 HA LEU 110 3.770 -6.352 1.766 837 HB2 LEU 110 1HB LEU 110 3.765 -3.352 2.022 838 HB3 LEU 110 2HB LEU 110 3.970 -4.202 0.492 839 HG LEU 110 HG LEU 110 1.531 -4.482 2.240 840 HD11 LEU 110 1HD1 LEU 110 2.062 -2.140 1.266 841 HD12 LEU 110 2HD1 LEU 110 0.451 -2.822 1.049 842 HD13 LEU 110 3HD1 LEU 110 1.613 -2.869 -0.276 843 HD21 LEU 110 1HD2 LEU 110 2.480 -5.734 -0.204 844 HD22 LEU 110 2HD2 LEU 110 0.889 -4.996 -0.395 845 HD23 LEU 110 3HD2 LEU 110 1.157 -6.198 0.867 846 H MET 111 H MET 111 5.735 -3.911 3.442 847 HA MET 111 HA MET 111 8.026 -4.178 1.831 848 HB2 MET 111 1HB MET 111 7.400 -3.010 4.481 849 HB3 MET 111 2HB MET 111 9.089 -3.399 4.183 850 HG2 MET 111 1HG MET 111 7.636 -1.896 2.086 851 HG3 MET 111 2HG MET 111 8.042 -1.048 3.575 852 HE1 MET 111 1HE MET 111 9.449 -3.212 0.636 853 HE2 MET 111 2HE MET 111 9.144 -1.557 0.108 854 HE3 MET 111 3HE MET 111 10.796 -2.176 0.161 855 H GLY 112 H GLY 112 6.619 -6.392 3.892 856 HA2 GLY 112 1HA GLY 112 8.578 -7.630 5.327 857 HA3 GLY 112 2HA GLY 112 7.307 -8.511 4.491 858 H LYS 113 H LYS 113 8.414 -7.386 1.889 859 HA LYS 113 HA LYS 113 10.061 -9.618 1.261 860 HB2 LYS 113 1HB LYS 113 9.300 -7.125 -0.250 861 HB3 LYS 113 2HB LYS 113 10.387 -8.331 -0.928 862 HG2 LYS 113 1HG LYS 113 8.685 -10.000 -0.878 863 HG3 LYS 113 2HG LYS 113 7.607 -8.949 0.042 864 HD2 LYS 113 1HD LYS 113 8.626 -8.064 -2.625 865 HD3 LYS 113 2HD LYS 113 7.288 -9.212 -2.534 866 HE2 LYS 113 1HE LYS 113 7.179 -6.733 -0.883 867 HE3 LYS 113 2HE LYS 113 6.855 -6.618 -2.613 868 HZ1 LYS 113 1HZ LYS 113 5.068 -7.327 -0.666 869 HZ2 LYS 113 2HZ LYS 113 5.453 -8.793 -1.415 870 HZ3 LYS 113 3HZ LYS 113 4.854 -7.506 -2.335 871 H GLY 114 H GLY 114 10.709 -6.158 1.719 872 HA2 GLY 114 1HA GLY 114 13.447 -6.228 1.076 873 HA3 GLY 114 2HA GLY 114 12.666 -5.016 2.080 874 H MET 115 H MET 115 11.808 -6.527 4.216 875 HA MET 115 HA MET 115 13.930 -6.560 5.927 876 HB2 MET 115 1HB MET 115 11.530 -6.791 6.567 877 HB3 MET 115 2HB MET 115 11.598 -8.476 6.071 878 HG2 MET 115 1HG MET 115 13.205 -8.973 7.781 879 HG3 MET 115 2HG MET 115 13.329 -7.270 8.214 880 HE1 MET 115 1HE MET 115 11.919 -7.334 11.151 881 HE2 MET 115 2HE MET 115 12.003 -9.096 11.150 882 HE3 MET 115 3HE MET 115 13.279 -8.151 10.382 883 H LYS 116 H LYS 116 14.990 -8.414 7.028 884 HA LYS 116 HA LYS 116 15.588 -10.589 5.131 885 HB2 LYS 116 1HB LYS 116 17.518 -9.205 7.004 886 HB3 LYS 116 2HB LYS 116 17.905 -10.578 5.975 887 HG2 LYS 116 1HG LYS 116 17.758 -9.309 4.023 888 HG3 LYS 116 2HG LYS 116 16.861 -8.017 4.822 889 HD2 LYS 116 1HD LYS 116 19.594 -8.650 5.811 890 HD3 LYS 116 2HD LYS 116 19.442 -7.791 4.276 891 HE2 LYS 116 1HE LYS 116 18.098 -6.070 5.362 892 HE3 LYS 116 2HE LYS 116 18.205 -6.938 6.893 893 HZ1 LYS 116 1HZ LYS 116 19.814 -4.996 6.419 894 HZ2 LYS 116 2HZ LYS 116 20.664 -6.127 5.493 895 HZ3 LYS 116 3HZ LYS 116 20.415 -6.401 7.144 896 H ARG 117 H ARG 117 15.611 -12.631 5.918 897 HA ARG 117 HA ARG 117 15.413 -12.998 8.827 898 HB2 ARG 117 1HB ARG 117 13.611 -14.199 6.724 899 HB3 ARG 117 2HB ARG 117 13.710 -14.804 8.372 900 HG2 ARG 117 1HG ARG 117 13.063 -11.936 7.803 901 HG3 ARG 117 2HG ARG 117 11.819 -13.187 7.789 902 HD2 ARG 117 1HD ARG 117 12.426 -13.799 10.087 903 HD3 ARG 117 2HD ARG 117 13.647 -12.527 10.095 904 HE ARG 117 HE ARG 117 11.993 -11.003 10.492 905 HH11 ARG 117 1HH1 ARG 117 10.556 -13.937 9.289 906 HH12 ARG 117 2HH1 ARG 117 8.930 -13.405 9.557 907 HH21 ARG 117 1HH2 ARG 117 9.856 -10.291 10.848 908 HH22 ARG 117 2HH2 ARG 117 8.532 -11.330 10.443 909 H VAL 118 H VAL 118 16.135 -15.024 9.606 910 HA VAL 118 HA VAL 118 18.448 -16.032 8.551 911 HB VAL 118 HB VAL 118 17.717 -16.537 10.824 912 HG11 VAL 118 1HG1 VAL 118 15.660 -18.260 9.455 913 HG12 VAL 118 2HG1 VAL 118 16.063 -18.388 11.168 914 HG13 VAL 118 3HG1 VAL 118 15.377 -16.892 10.532 915 HG21 VAL 118 1HG2 VAL 118 18.866 -18.405 8.987 916 HG22 VAL 118 2HG2 VAL 118 19.214 -18.175 10.701 917 HG23 VAL 118 3HG2 VAL 118 17.932 -19.278 10.202 918 H SER 119 H SER 119 15.148 -17.083 7.887 919 HA SER 119 HA SER 119 16.200 -18.742 5.691 920 HB2 SER 119 1HB SER 119 15.376 -20.261 7.361 921 HB3 SER 119 2HB SER 119 13.888 -19.334 7.548 922 HG SER 119 HG SER 119 14.567 -20.391 5.035 923 H GLY 120 H GLY 120 15.898 -17.171 4.124 924 HA2 GLY 120 1HA GLY 120 13.306 -17.016 2.982 925 HA3 GLY 120 2HA GLY 120 13.692 -15.511 3.803 926 HA PRO 121 HA PRO 121 15.246 -14.742 -0.374 927 HB2 PRO 121 1HB PRO 121 15.202 -12.040 -0.120 928 HB3 PRO 121 2HB PRO 121 13.764 -12.992 -0.510 929 HG2 PRO 121 1HG PRO 121 14.641 -11.875 2.125 930 HG3 PRO 121 2HG PRO 121 13.021 -11.899 1.403 931 HD2 PRO 121 1HD PRO 121 13.794 -13.665 3.304 932 HD3 PRO 121 2HD PRO 121 12.639 -14.085 2.022 933 H SER 122 H SER 122 17.358 -15.014 -0.689 934 HA SER 122 HA SER 122 19.236 -13.300 0.783 935 HB2 SER 122 1HB SER 122 19.376 -16.295 0.456 936 HB3 SER 122 2HB SER 122 20.809 -15.327 0.802 937 HG SER 122 HG SER 122 19.791 -14.609 2.701 938 H SER 123 H SER 123 18.748 -15.482 -1.966 939 HA SER 123 HA SER 123 20.964 -15.182 -3.461 940 HB2 SER 123 1HB SER 123 19.558 -15.337 -5.479 941 HB3 SER 123 2HB SER 123 19.004 -16.444 -4.223 942 HG SER 123 HG SER 123 17.426 -14.833 -3.674 943 H GLY 124 H GLY 124 22.182 -13.480 -3.925 944 HA2 GLY 124 1HA GLY 124 21.893 -11.435 -5.514 945 HA3 GLY 124 2HA GLY 124 20.911 -10.845 -4.181
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