NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
17282 | 2bzb | 7350 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 20.021 -18.427 -1.239 2 H2 MET 1 HT3 MET 1 18.955 -18.469 -2.558 3 H3 MET 1 HT2 MET 1 20.612 -18.180 -2.777 4 HA MET 1 HA MET 1 20.588 -16.184 -1.649 5 1HB MET 1 HB2 MET 1 19.131 -14.792 -3.111 6 2HB MET 1 HB1 MET 1 20.083 -15.959 -4.006 7 1HG MET 1 HG2 MET 1 18.103 -17.410 -4.170 8 2HG MET 1 HG1 MET 1 17.154 -16.179 -3.334 9 1HE MET 1 HE2 MET 1 18.336 -13.491 -4.571 10 2HE MET 1 HE1 MET 1 17.283 -13.234 -5.962 11 3HE MET 1 HE3 MET 1 16.596 -13.762 -4.430 12 H GLU 2 HN GLU 2 17.794 -18.071 -1.051 13 HA GLU 2 HA GLU 2 16.479 -18.231 0.641 14 1HB GLU 2 HB2 GLU 2 18.417 -16.334 1.946 15 2HB GLU 2 HB1 GLU 2 17.090 -17.087 2.812 16 1HG GLU 2 HG2 GLU 2 19.106 -18.326 3.259 17 2HG GLU 2 HG1 GLU 2 18.055 -19.317 2.266 18 H MET 3 HN MET 3 14.493 -17.692 0.830 19 HA MET 3 HA MET 3 13.555 -15.172 -0.126 20 1HB MET 3 HB2 MET 3 12.049 -17.414 1.222 21 2HB MET 3 HB1 MET 3 11.287 -15.978 0.564 22 1HG MET 3 HG2 MET 3 12.171 -16.578 -1.668 23 2HG MET 3 HG1 MET 3 12.816 -18.061 -0.970 24 1HE MET 3 HE3 MET 3 11.323 -19.960 0.088 25 2HE MET 3 HE2 MET 3 10.435 -18.821 1.101 26 3HE MET 3 HE1 MET 3 9.557 -19.956 0.083 27 H GLY 4 HN GLY 4 14.365 -16.404 2.954 28 1HA GLY 4 HA1 GLY 4 14.433 -15.406 5.041 29 2HA GLY 4 HA2 GLY 4 12.945 -14.582 4.588 30 H GLN 5 HN GLN 5 16.006 -14.406 2.923 31 HA GLN 5 HA GLN 5 16.818 -11.895 4.021 32 1HB GLN 5 HB2 GLN 5 17.695 -13.293 1.487 33 2HB GLN 5 HB1 GLN 5 18.495 -11.909 2.219 34 1HG GLN 5 HG2 GLN 5 19.037 -13.230 4.179 35 2HG GLN 5 HG1 GLN 5 18.178 -14.611 3.506 36 1HE2 GLN 5 1HE2 GLN 5 20.143 -12.483 1.577 37 2HE2 GLN 5 2HE2 GLN 5 21.386 -13.638 1.266 38 H LEU 6 HN LEU 6 15.217 -13.004 1.128 39 HA LEU 6 HA LEU 6 14.915 -10.581 -0.222 40 1HB LEU 6 HB2 LEU 6 14.489 -12.855 -1.182 41 2HB LEU 6 HB1 LEU 6 13.089 -13.004 -0.161 42 HG LEU 6 HG LEU 6 12.686 -12.555 -2.621 43 1HD1 LEU 6 HD1 LEU 6 11.463 -10.730 -0.585 44 2HD1 LEU 6 HD1 LEU 6 10.890 -10.906 -2.230 45 3HD1 LEU 6 HD1 LEU 6 10.841 -12.288 -1.143 46 1HD2 LEU 6 HD2 LEU 6 13.609 -9.789 -1.863 47 2HD2 LEU 6 HD2 LEU 6 14.398 -10.890 -2.997 48 3HD2 LEU 6 HD2 LEU 6 12.806 -10.228 -3.370 49 H LYS 7 HN LYS 7 12.768 -12.204 2.086 50 HA LYS 7 HA LYS 7 10.806 -10.233 2.282 51 1HB LYS 7 HB2 LYS 7 11.522 -12.645 3.686 52 2HB LYS 7 HB1 LYS 7 11.007 -11.411 4.823 53 1HG LYS 7 HG2 LYS 7 9.416 -12.162 2.388 54 2HG LYS 7 HG1 LYS 7 9.208 -12.960 3.942 55 1HD LYS 7 HD2 LYS 7 8.973 -9.971 3.572 56 2HD LYS 7 HD1 LYS 7 7.579 -11.053 3.444 57 1HE LYS 7 HE2 LYS 7 8.072 -11.811 5.779 58 2HE LYS 7 HE1 LYS 7 9.347 -10.600 5.856 59 1HZ LYS 7 HZ1 LYS 7 6.478 -9.962 5.367 60 2HZ LYS 7 HZ3 LYS 7 7.229 -9.908 6.857 61 3HZ LYS 7 HZ2 LYS 7 7.714 -8.847 5.658 62 H ASN 8 HN ASN 8 13.884 -10.559 3.884 63 HA ASN 8 HA ASN 8 13.506 -8.562 5.837 64 1HB ASN 8 HB2 ASN 8 15.375 -10.227 5.873 65 2HB ASN 8 HB1 ASN 8 16.114 -9.376 4.525 66 1HD2 ASN 8 HD2 ASN 8 17.987 -8.757 5.602 67 2HD2 ASN 8 HD2 ASN 8 17.960 -7.660 6.920 68 H LYS 9 HN LYS 9 14.779 -8.492 2.540 69 HA LYS 9 HA LYS 9 15.414 -5.734 2.541 70 1HB LYS 9 HB2 LYS 9 14.838 -7.577 0.208 71 2HB LYS 9 HB1 LYS 9 15.510 -5.960 0.066 72 1HG LYS 9 HG2 LYS 9 16.806 -8.315 1.435 73 2HG LYS 9 HG1 LYS 9 17.255 -7.626 -0.126 74 1HD LYS 9 HD2 LYS 9 17.836 -5.510 0.981 75 2HD LYS 9 HD1 LYS 9 17.390 -6.205 2.539 76 1HE LYS 9 HE2 LYS 9 19.792 -6.264 2.269 77 2HE LYS 9 HE1 LYS 9 19.135 -7.898 2.273 78 1HZ LYS 9 HZ2 LYS 9 19.856 -6.392 -0.181 79 2HZ LYS 9 HZ1 LYS 9 20.833 -7.527 0.567 80 3HZ LYS 9 HZ3 LYS 9 19.362 -8.007 -0.090 81 H ILE 10 HN ILE 10 12.554 -7.557 1.641 82 HA ILE 10 HA ILE 10 11.006 -5.431 0.689 83 HB ILE 10 HB ILE 10 10.190 -7.981 2.106 84 1HG1 ILE 10 2HG1 ILE 10 10.098 -7.121 -0.785 85 2HG1 ILE 10 1HG1 ILE 10 11.209 -8.284 -0.074 86 1HG2 ILE 10 1HG2 ILE 10 8.433 -6.321 2.502 87 2HG2 ILE 10 3HG2 ILE 10 8.340 -6.003 0.768 88 3HG2 ILE 10 2HG2 ILE 10 7.880 -7.582 1.400 89 1HD1 ILE 10 HD1 ILE 10 9.331 -9.762 0.399 90 2HD1 ILE 10 HD1 ILE 10 8.230 -8.597 -0.337 91 3HD1 ILE 10 HD1 ILE 10 9.466 -9.387 -1.319 92 H GLU 11 HN GLU 11 11.302 -6.733 3.974 93 HA GLU 11 HA GLU 11 9.635 -4.973 5.290 94 1HB GLU 11 HB2 GLU 11 12.215 -6.175 6.311 95 2HB GLU 11 HB1 GLU 11 11.032 -5.361 7.319 96 1HG GLU 11 HG2 GLU 11 10.628 -7.893 5.756 97 2HG GLU 11 HG1 GLU 11 10.756 -7.736 7.508 98 H ASN 12 HN ASN 12 13.120 -4.629 4.715 99 HA ASN 12 HA ASN 12 13.520 -2.184 5.883 100 1HB ASN 12 HB2 ASN 12 14.862 -3.838 3.836 101 2HB ASN 12 HB1 ASN 12 15.355 -2.165 3.974 102 1HD2 ASN 12 HD2 ASN 12 15.199 -5.266 5.589 103 2HD2 ASN 12 HD2 ASN 12 16.328 -4.878 6.832 104 H LYS 13 HN LYS 13 12.683 -2.937 2.507 105 HA LYS 13 HA LYS 13 12.900 -0.246 1.648 106 1HB LYS 13 HB2 LYS 13 12.902 -2.537 0.315 107 2HB LYS 13 HB1 LYS 13 11.187 -2.207 0.204 108 1HG LYS 13 HG2 LYS 13 12.396 -1.417 -1.774 109 2HG LYS 13 HG1 LYS 13 11.606 -0.099 -0.912 110 1HD LYS 13 HD2 LYS 13 13.927 0.436 -1.670 111 2HD LYS 13 HD1 LYS 13 13.709 0.617 0.063 112 1HE LYS 13 HE2 LYS 13 14.682 -1.612 0.390 113 2HE LYS 13 HE1 LYS 13 14.993 -1.742 -1.349 114 1HZ LYS 13 HZ1 LYS 13 16.090 0.235 0.561 115 2HZ LYS 13 HZ3 LYS 13 16.934 -1.057 -0.106 116 3HZ LYS 13 HZ2 LYS 13 16.468 0.214 -1.106 117 H LYS 14 HN LYS 14 10.172 -2.273 2.545 118 HA LYS 14 HA LYS 14 8.071 -0.533 2.169 119 1HB LYS 14 HB2 LYS 14 7.718 -2.819 2.545 120 2HB LYS 14 HB1 LYS 14 8.609 -2.818 4.073 121 1HG LYS 14 HG2 LYS 14 6.743 -1.348 4.986 122 2HG LYS 14 HG1 LYS 14 5.871 -1.698 3.490 123 1HD LYS 14 HD2 LYS 14 5.079 -3.247 5.160 124 2HD LYS 14 HD1 LYS 14 6.088 -4.134 4.014 125 1HE LYS 14 HE2 LYS 14 7.968 -3.987 5.588 126 2HE LYS 14 HE1 LYS 14 6.936 -3.154 6.735 127 1HZ LYS 14 HZ1 LYS 14 5.521 -5.273 6.822 128 2HZ LYS 14 HZ3 LYS 14 6.630 -5.965 5.760 129 3HZ LYS 14 HZ2 LYS 14 7.132 -5.538 7.237 130 H LYS 15 HN LYS 15 10.178 -1.046 4.990 131 HA LYS 15 HA LYS 15 8.999 0.915 6.639 132 1HB LYS 15 HB2 LYS 15 11.693 -0.420 6.671 133 2HB LYS 15 HB1 LYS 15 11.225 0.773 7.880 134 1HG LYS 15 HG2 LYS 15 9.588 -0.606 8.793 135 2HG LYS 15 HG1 LYS 15 9.493 -1.612 7.345 136 1HD LYS 15 HD2 LYS 15 11.555 -2.590 7.773 137 2HD LYS 15 HD1 LYS 15 11.956 -1.500 9.113 138 1HE LYS 15 HE2 LYS 15 9.757 -3.581 8.985 139 2HE LYS 15 HE1 LYS 15 11.273 -3.738 9.865 140 1HZ LYS 15 HZ3 LYS 15 10.578 -1.846 11.248 141 2HZ LYS 15 HZ2 LYS 15 9.093 -1.807 10.437 142 3HZ LYS 15 HZ1 LYS 15 9.510 -3.149 11.346 143 H GLU 16 HN GLU 16 11.748 1.101 4.419 144 HA GLU 16 HA GLU 16 12.473 3.777 4.816 145 1HB GLU 16 HB2 GLU 16 12.536 2.059 2.323 146 2HB GLU 16 HB1 GLU 16 13.168 3.702 2.357 147 1HG GLU 16 HG2 GLU 16 14.810 2.996 4.029 148 2HG GLU 16 HG1 GLU 16 14.133 1.367 4.000 149 H LEU 17 HN LEU 17 9.893 2.368 2.923 150 HA LEU 17 HA LEU 17 9.036 4.802 1.755 151 1HB LEU 17 HB2 LEU 17 8.514 2.850 0.552 152 2HB LEU 17 HB1 LEU 17 7.879 2.040 1.962 153 HG LEU 17 HG LEU 17 6.174 2.656 0.219 154 1HD1 LEU 17 HD1 LEU 17 5.521 2.030 2.304 155 2HD1 LEU 17 HD1 LEU 17 5.658 3.682 2.902 156 3HD1 LEU 17 HD1 LEU 17 4.466 3.295 1.645 157 1HD2 LEU 17 HD2 LEU 17 6.712 5.454 1.149 158 2HD2 LEU 17 HD2 LEU 17 7.062 4.814 -0.458 159 3HD2 LEU 17 HD2 LEU 17 5.390 4.944 0.096 160 H ILE 18 HN ILE 18 7.970 2.898 4.516 161 HA ILE 18 HA ILE 18 5.747 4.377 5.166 162 HB ILE 18 HB ILE 18 7.659 3.009 7.090 163 1HG1 ILE 18 2HG1 ILE 18 5.028 2.016 5.989 164 2HG1 ILE 18 1HG1 ILE 18 6.594 1.610 5.295 165 1HG2 ILE 18 2HG2 ILE 18 4.799 3.917 7.570 166 2HG2 ILE 18 1HG2 ILE 18 5.762 2.959 8.686 167 3HG2 ILE 18 3HG2 ILE 18 6.239 4.610 8.303 168 1HD1 ILE 18 HD1 ILE 18 7.238 0.559 7.388 169 2HD1 ILE 18 HD1 ILE 18 5.666 0.958 8.078 170 3HD1 ILE 18 HD1 ILE 18 5.776 -0.164 6.713 171 H GLN 19 HN GLN 19 9.105 4.851 5.993 172 HA GLN 19 HA GLN 19 8.962 7.095 7.666 173 1HB GLN 19 HB2 GLN 19 11.069 6.309 5.664 174 2HB GLN 19 HB1 GLN 19 11.267 7.583 6.859 175 1HG GLN 19 HG2 GLN 19 11.073 5.975 8.646 176 2HG GLN 19 HG1 GLN 19 10.749 4.692 7.483 177 1HE2 GLN 19 1HE2 GLN 19 12.901 4.989 9.456 178 2HE2 GLN 19 2HE2 GLN 19 14.366 4.819 8.557 179 H LEU 20 HN LEU 20 8.997 6.838 4.149 180 HA LEU 20 HA LEU 20 9.176 9.627 3.672 181 1HB LEU 20 HB2 LEU 20 8.256 7.403 1.860 182 2HB LEU 20 HB1 LEU 20 8.512 9.061 1.355 183 HG LEU 20 HG LEU 20 10.666 7.239 2.427 184 1HD1 LEU 20 HD1 LEU 20 9.859 6.528 0.248 185 2HD1 LEU 20 HD1 LEU 20 10.082 8.162 -0.372 186 3HD1 LEU 20 HD1 LEU 20 11.478 7.212 0.137 187 1HD2 LEU 20 HD2 LEU 20 10.800 10.005 1.225 188 2HD2 LEU 20 HD2 LEU 20 11.124 9.575 2.906 189 3HD2 LEU 20 HD2 LEU 20 12.186 8.992 1.631 190 H VAL 21 HN VAL 21 6.401 7.341 3.521 191 HA VAL 21 HA VAL 21 4.456 9.330 3.085 192 HB VAL 21 HB VAL 21 3.999 6.821 4.717 193 1HG1 VAL 21 3HG1 VAL 21 2.122 8.364 4.690 194 2HG1 VAL 21 2HG1 VAL 21 2.157 8.401 2.929 195 3HG1 VAL 21 1HG1 VAL 21 1.734 6.908 3.771 196 1HG2 VAL 21 2HG2 VAL 21 4.062 7.117 1.725 197 2HG2 VAL 21 1HG2 VAL 21 5.178 6.189 2.738 198 3HG2 VAL 21 3HG2 VAL 21 3.494 5.685 2.597 199 H ALA 22 HN ALA 22 5.939 8.173 6.050 200 HA ALA 22 HA ALA 22 4.267 9.477 7.875 201 1HB ALA 22 HB1 ALA 22 7.163 8.722 8.217 202 2HB ALA 22 HB3 ALA 22 6.008 9.043 9.523 203 3HB ALA 22 HB2 ALA 22 5.783 7.655 8.460 204 H ARG 23 HN ARG 23 7.456 10.455 6.582 205 HA ARG 23 HA ARG 23 7.477 12.927 7.921 206 1HB ARG 23 HB2 ARG 23 9.354 13.574 6.497 207 2HB ARG 23 HB1 ARG 23 9.568 11.959 7.146 208 1HG ARG 23 HG2 ARG 23 8.881 11.025 5.010 209 2HG ARG 23 HG1 ARG 23 8.680 12.651 4.359 210 1HD ARG 23 HD2 ARG 23 11.264 11.510 5.427 211 2HD ARG 23 HD1 ARG 23 10.845 11.644 3.720 212 HE ARG 23 HE ARG 23 10.553 14.164 4.743 213 1HH1 ARG 23 1HH1 ARG 23 13.233 11.872 4.525 214 2HH1 ARG 23 2HH1 ARG 23 14.453 13.036 4.398 215 1HH2 ARG 23 1HH2 ARG 23 12.168 15.801 4.547 216 2HH2 ARG 23 2HH2 ARG 23 13.812 15.412 4.379 217 H HIS 24 HN HIS 24 5.850 11.979 5.096 218 HA HIS 24 HA HIS 24 5.416 14.402 3.797 219 1HB HIS 24 HB2 HIS 24 4.587 12.335 2.867 220 2HB HIS 24 HB1 HIS 24 3.519 12.046 4.227 221 HD1 HIS 24 HD1 HIS 24 1.250 13.503 4.239 222 HD2 HIS 24 HD2 HIS 24 3.704 14.060 0.937 223 HE1 HIS 24 HE1 HIS 24 -0.117 14.760 2.568 224 H GLY 25 HN GLY 25 3.746 13.006 6.581 225 1HA GLY 25 HA1 GLY 25 2.138 15.382 6.943 226 2HA GLY 25 HA2 GLY 25 3.440 15.206 8.109 227 H LEU 26 HN LEU 26 3.209 12.241 8.203 228 HA LEU 26 HA LEU 26 0.529 12.001 9.316 229 1HB LEU 26 HB2 LEU 26 2.618 9.894 8.856 230 2HB LEU 26 HB1 LEU 26 1.099 9.583 9.633 231 HG LEU 26 HG LEU 26 1.655 10.357 6.892 232 1HD1 LEU 26 HD1 LEU 26 0.392 7.886 8.040 233 2HD1 LEU 26 HD1 LEU 26 0.504 8.235 6.312 234 3HD1 LEU 26 HD1 LEU 26 1.970 8.034 7.264 235 1HD2 LEU 26 HD2 LEU 26 -1.064 10.249 8.166 236 2HD2 LEU 26 HD2 LEU 26 -0.271 11.613 7.367 237 3HD2 LEU 26 HD2 LEU 26 -0.793 10.226 6.425 238 H ASP 27 HN ASP 27 0.160 11.544 11.260 239 HA ASP 27 HA ASP 27 2.252 12.028 13.214 240 1HB ASP 27 HB2 ASP 27 -0.704 11.450 13.596 241 2HB ASP 27 HB1 ASP 27 0.433 11.815 14.891 242 H HIS 28 HN HIS 28 2.124 10.390 15.139 243 HA HIS 28 HA HIS 28 3.162 8.055 14.004 244 1HB HIS 28 HB2 HIS 28 2.529 8.711 16.864 245 2HB HIS 28 HB1 HIS 28 3.255 7.178 16.378 246 HD1 HIS 28 HD1 HIS 28 4.135 10.616 17.231 247 HD2 HIS 28 HD2 HIS 28 5.793 7.521 15.023 248 HE1 HIS 28 HE1 HIS 28 6.546 11.225 16.879 249 H ASP 29 HN ASP 29 0.001 8.684 15.329 250 HA ASP 29 HA ASP 29 -0.838 5.998 15.387 251 1HB ASP 29 HB2 ASP 29 -3.105 6.820 15.550 252 2HB ASP 29 HB1 ASP 29 -2.065 7.816 16.556 253 H LYS 30 HN LYS 30 -0.818 8.426 12.946 254 HA LYS 30 HA LYS 30 -2.262 6.980 10.966 255 1HB LYS 30 HB2 LYS 30 -0.328 9.266 10.774 256 2HB LYS 30 HB1 LYS 30 -1.129 8.683 9.350 257 1HG LYS 30 HG2 LYS 30 -2.366 9.920 11.819 258 2HG LYS 30 HG1 LYS 30 -2.250 10.639 10.214 259 1HD LYS 30 HD2 LYS 30 -3.757 8.926 9.327 260 2HD LYS 30 HD1 LYS 30 -3.847 8.169 10.915 261 1HE LYS 30 HE2 LYS 30 -4.772 10.950 10.225 262 2HE LYS 30 HE1 LYS 30 -5.810 9.549 10.490 263 1HZ LYS 30 HZ2 LYS 30 -4.730 9.477 12.799 264 2HZ LYS 30 HZ1 LYS 30 -4.116 10.963 12.465 265 3HZ LYS 30 HZ3 LYS 30 -5.784 10.781 12.507 266 H VAL 31 HN VAL 31 1.187 7.397 11.612 267 HA VAL 31 HA VAL 31 2.153 5.817 9.548 268 HB VAL 31 HB VAL 31 3.364 6.220 12.313 269 1HG1 VAL 31 2HG1 VAL 31 4.404 4.375 11.129 270 2HG1 VAL 31 1HG1 VAL 31 4.672 5.416 9.733 271 3HG1 VAL 31 3HG1 VAL 31 5.499 5.752 11.255 272 1HG2 VAL 31 2HG2 VAL 31 3.739 7.788 9.775 273 2HG2 VAL 31 1HG2 VAL 31 2.894 8.335 11.221 274 3HG2 VAL 31 3HG2 VAL 31 4.631 8.031 11.278 275 H LEU 32 HN LEU 32 1.185 4.941 12.855 276 HA LEU 32 HA LEU 32 1.824 2.168 12.724 277 1HB LEU 32 HB2 LEU 32 -0.339 3.493 14.345 278 2HB LEU 32 HB1 LEU 32 0.340 1.902 14.623 279 HG LEU 32 HG LEU 32 1.693 4.558 14.987 280 1HD1 LEU 32 HD1 LEU 32 0.950 2.408 16.928 281 2HD1 LEU 32 HD1 LEU 32 1.872 3.870 17.311 282 3HD1 LEU 32 HD1 LEU 32 0.202 4.001 16.749 283 1HD2 LEU 32 HD2 LEU 32 2.892 1.795 15.229 284 2HD2 LEU 32 HD2 LEU 32 3.309 3.054 14.060 285 3HD2 LEU 32 HD2 LEU 32 3.651 3.299 15.769 286 H LEU 33 HN LEU 33 -1.169 3.871 12.033 287 HA LEU 33 HA LEU 33 -2.636 1.556 11.387 288 1HB LEU 33 HB2 LEU 33 -2.973 4.403 10.511 289 2HB LEU 33 HB1 LEU 33 -4.145 3.132 10.204 290 HG LEU 33 HG LEU 33 -3.293 4.062 12.947 291 1HD1 LEU 33 HD1 LEU 33 -5.726 4.754 11.323 292 2HD1 LEU 33 HD1 LEU 33 -5.500 5.134 13.029 293 3HD1 LEU 33 HD1 LEU 33 -4.429 5.848 11.830 294 1HD2 LEU 33 HD2 LEU 33 -5.551 2.267 12.048 295 2HD2 LEU 33 HD2 LEU 33 -4.107 1.761 12.922 296 3HD2 LEU 33 HD2 LEU 33 -5.280 2.825 13.701 297 H PHE 34 HN PHE 34 -0.836 3.850 9.369 298 HA PHE 34 HA PHE 34 -1.436 2.678 6.910 299 1HB PHE 34 HB2 PHE 34 -0.502 4.908 6.985 300 2HB PHE 34 HB1 PHE 34 0.962 4.313 7.761 301 HD1 PHE 34 HD1 PHE 34 2.814 3.762 6.469 302 HD2 PHE 34 HD2 PHE 34 -1.023 3.975 4.627 303 HE1 PHE 34 HE1 PHE 34 3.849 3.412 4.237 304 HE2 PHE 34 HE2 PHE 34 0.024 3.630 2.425 305 HZ PHE 34 HZ PHE 34 2.467 3.344 2.265 306 H SER 35 HN SER 35 1.387 2.221 9.012 307 HA SER 35 HA SER 35 2.730 0.479 7.314 308 1HB SER 35 HB2 SER 35 4.063 -0.108 9.345 309 2HB SER 35 HB1 SER 35 3.883 1.623 9.083 310 HG SER 35 HG SER 35 2.595 1.799 10.731 311 H ARG 36 HN ARG 36 0.370 -0.207 9.848 312 HA ARG 36 HA ARG 36 0.762 -3.027 9.645 313 1HB ARG 36 HB2 ARG 36 -1.132 -3.277 11.130 314 2HB ARG 36 HB1 ARG 36 -0.023 -2.059 11.736 315 1HG ARG 36 HG2 ARG 36 -1.547 -0.327 10.809 316 2HG ARG 36 HG1 ARG 36 -2.679 -1.619 10.403 317 1HD ARG 36 HD2 ARG 36 -1.642 -0.937 13.134 318 2HD ARG 36 HD1 ARG 36 -3.247 -0.561 12.515 319 HE ARG 36 HE ARG 36 -2.546 -3.366 12.436 320 1HH1 ARG 36 1HH1 ARG 36 -4.129 -0.849 14.353 321 2HH1 ARG 36 2HH1 ARG 36 -5.126 -1.934 15.205 322 1HH2 ARG 36 1HH2 ARG 36 -3.899 -4.851 13.603 323 2HH2 ARG 36 2HH2 ARG 36 -4.967 -4.268 14.791 324 H ASP 37 HN ASP 37 -1.470 -0.756 8.149 325 HA ASP 37 HA ASP 37 -3.165 -2.781 7.023 326 1HB ASP 37 HB2 ASP 37 -3.682 -0.257 7.368 327 2HB ASP 37 HB1 ASP 37 -2.731 0.007 5.914 328 H LEU 38 HN LEU 38 -0.494 -0.820 5.905 329 HA LEU 38 HA LEU 38 -0.105 -1.767 3.334 330 1HB LEU 38 HB2 LEU 38 1.091 0.116 4.048 331 2HB LEU 38 HB1 LEU 38 1.686 -0.690 5.473 332 HG LEU 38 HG LEU 38 3.263 -1.970 4.095 333 1HD1 LEU 38 HD1 LEU 38 2.204 -0.357 1.793 334 2HD1 LEU 38 HD1 LEU 38 3.613 -1.424 1.794 335 3HD1 LEU 38 HD1 LEU 38 2.003 -2.102 2.044 336 1HD2 LEU 38 HD2 LEU 38 3.309 1.002 3.675 337 2HD2 LEU 38 HD2 LEU 38 3.969 0.111 5.045 338 3HD2 LEU 38 HD2 LEU 38 4.688 -0.074 3.448 339 H ASP 39 HN ASP 39 1.098 -3.000 6.401 340 HA ASP 39 HA ASP 39 2.700 -5.037 5.345 341 1HB ASP 39 HB2 ASP 39 2.833 -4.171 7.679 342 2HB ASP 39 HB1 ASP 39 1.340 -5.026 8.046 343 H LYS 40 HN LYS 40 -0.744 -4.978 6.179 344 HA LYS 40 HA LYS 40 -1.007 -7.804 5.899 345 1HB LYS 40 HB2 LYS 40 -3.278 -7.628 6.277 346 2HB LYS 40 HB1 LYS 40 -2.603 -6.242 7.154 347 1HG LYS 40 HG2 LYS 40 -3.443 -4.722 5.581 348 2HG LYS 40 HG1 LYS 40 -3.814 -5.996 4.418 349 1HD LYS 40 HD2 LYS 40 -5.466 -6.923 6.023 350 2HD LYS 40 HD1 LYS 40 -5.156 -5.567 7.094 351 1HE LYS 40 HE2 LYS 40 -6.175 -5.321 4.262 352 2HE LYS 40 HE1 LYS 40 -7.204 -5.326 5.691 353 1HZ LYS 40 HZ1 LYS 40 -5.987 -3.343 6.448 354 2HZ LYS 40 HZ3 LYS 40 -5.169 -3.264 4.970 355 3HZ LYS 40 HZ2 LYS 40 -6.829 -3.109 5.030 356 H LEU 41 HN LEU 41 -1.404 -5.102 3.745 357 HA LEU 41 HA LEU 41 -2.557 -6.483 1.580 358 1HB LEU 41 HB2 LEU 41 -2.525 -4.089 1.683 359 2HB LEU 41 HB1 LEU 41 -0.776 -4.060 1.685 360 HG LEU 41 HG LEU 41 -0.743 -4.912 -0.621 361 1HD1 LEU 41 HD1 LEU 41 -3.750 -4.705 -0.480 362 2HD1 LEU 41 HD1 LEU 41 -2.804 -4.967 -1.947 363 3HD1 LEU 41 HD1 LEU 41 -2.785 -6.177 -0.675 364 1HD2 LEU 41 HD2 LEU 41 -0.684 -2.521 -0.202 365 2HD2 LEU 41 HD2 LEU 41 -1.547 -2.874 -1.702 366 3HD2 LEU 41 HD2 LEU 41 -2.447 -2.461 -0.241 367 H ILE 42 HN ILE 42 0.653 -6.011 2.686 368 HA ILE 42 HA ILE 42 1.897 -7.197 0.407 369 HB ILE 42 HB ILE 42 2.975 -6.540 3.164 370 1HG1 ILE 42 2HG1 ILE 42 3.415 -5.341 0.439 371 2HG1 ILE 42 1HG1 ILE 42 2.411 -4.659 1.713 372 1HG2 ILE 42 2HG2 ILE 42 4.513 -7.630 0.797 373 2HG2 ILE 42 1HG2 ILE 42 5.226 -7.009 2.285 374 3HG2 ILE 42 3HG2 ILE 42 4.225 -8.459 2.327 375 1HD1 ILE 42 HD1 ILE 42 5.388 -5.060 1.827 376 2HD1 ILE 42 HD1 ILE 42 4.543 -3.534 1.521 377 3HD1 ILE 42 HD1 ILE 42 4.359 -4.338 3.075 378 H ASN 43 HN ASN 43 1.122 -8.321 3.639 379 HA ASN 43 HA ASN 43 2.071 -10.939 3.336 380 1HB ASN 43 HB2 ASN 43 -0.192 -9.931 5.056 381 2HB ASN 43 HB1 ASN 43 0.514 -11.540 5.183 382 1HD2 ASN 43 HD2 ASN 43 0.401 -9.368 7.106 383 2HD2 ASN 43 HD2 ASN 43 2.024 -8.996 7.525 384 H LYS 44 HN LYS 44 -0.952 -9.496 2.415 385 HA LYS 44 HA LYS 44 -2.460 -11.752 1.763 386 1HB LYS 44 HB2 LYS 44 -3.377 -9.505 1.852 387 2HB LYS 44 HB1 LYS 44 -2.412 -9.022 0.467 388 1HG LYS 44 HG2 LYS 44 -3.659 -10.650 -0.927 389 2HG LYS 44 HG1 LYS 44 -4.666 -11.031 0.467 390 1HD LYS 44 HD2 LYS 44 -4.425 -8.321 -0.861 391 2HD LYS 44 HD1 LYS 44 -5.791 -9.431 -1.012 392 1HE LYS 44 HE2 LYS 44 -6.074 -9.279 1.451 393 2HE LYS 44 HE1 LYS 44 -4.834 -8.040 1.480 394 1HZ LYS 44 HZ2 LYS 44 -7.426 -7.811 0.022 395 2HZ LYS 44 HZ1 LYS 44 -7.026 -7.078 1.475 396 3HZ LYS 44 HZ3 LYS 44 -6.213 -6.625 0.090 397 H PHE 45 HN PHE 45 -0.174 -9.913 -0.157 398 HA PHE 45 HA PHE 45 -0.552 -11.657 -2.383 399 1HB PHE 45 HB2 PHE 45 1.017 -9.156 -1.959 400 2HB PHE 45 HB1 PHE 45 1.311 -10.152 -3.378 401 HD1 PHE 45 HD1 PHE 45 -0.053 -9.969 -5.241 402 HD2 PHE 45 HD2 PHE 45 -1.425 -8.350 -1.538 403 HE1 PHE 45 HE1 PHE 45 -1.963 -8.951 -6.390 404 HE2 PHE 45 HE2 PHE 45 -3.324 -7.323 -2.695 405 HZ PHE 45 HZ PHE 45 -3.603 -7.622 -5.116 406 H MET 46 HN MET 46 1.642 -11.301 0.189 407 HA MET 46 HA MET 46 3.833 -12.724 -1.024 408 1HB MET 46 HB2 MET 46 3.372 -11.585 1.701 409 2HB MET 46 HB1 MET 46 4.779 -12.562 1.330 410 1HG MET 46 HG2 MET 46 4.046 -10.072 -0.185 411 2HG MET 46 HG1 MET 46 5.095 -10.074 1.231 412 1HE MET 46 HE1 MET 46 7.430 -11.109 1.348 413 2HE MET 46 HE3 MET 46 6.777 -12.703 0.950 414 3HE MET 46 HE2 MET 46 8.165 -12.070 0.070 415 H ASN 47 HN ASN 47 1.124 -13.519 1.063 416 HA ASN 47 HA ASN 47 1.978 -16.272 1.036 417 1HB ASN 47 HB2 ASN 47 3.344 -15.197 2.815 418 2HB ASN 47 HB1 ASN 47 1.868 -14.852 3.685 419 1HD2 ASN 47 HD2 ASN 47 4.103 -16.393 4.523 420 2HD2 ASN 47 HD2 ASN 47 3.569 -18.001 4.854 421 H VAL 48 HN VAL 48 0.208 -14.429 3.105 422 HA VAL 48 HA VAL 48 -1.908 -16.411 3.161 423 HB VAL 48 HB VAL 48 -2.899 -15.165 5.067 424 1HG1 VAL 48 3HG1 VAL 48 -1.380 -17.093 5.352 425 2HG1 VAL 48 2HG1 VAL 48 -0.005 -15.994 5.363 426 3HG1 VAL 48 1HG1 VAL 48 -1.186 -15.934 6.671 427 1HG2 VAL 48 1HG2 VAL 48 -1.973 -12.966 4.644 428 2HG2 VAL 48 3HG2 VAL 48 -1.494 -13.515 6.254 429 3HG2 VAL 48 2HG2 VAL 48 -0.340 -13.574 4.912 430 H LYS 49 HN LYS 49 -3.444 -16.334 1.929 431 HA LYS 49 HA LYS 49 -4.269 -13.818 0.772 432 1HB LYS 49 HB2 LYS 49 -5.177 -16.609 0.047 433 2HB LYS 49 HB1 LYS 49 -5.260 -15.161 -0.957 434 1HG LYS 49 HG2 LYS 49 -2.887 -15.091 -1.196 435 2HG LYS 49 HG1 LYS 49 -2.671 -16.364 -0.010 436 1HD LYS 49 HD2 LYS 49 -3.994 -17.858 -1.576 437 2HD LYS 49 HD1 LYS 49 -3.822 -16.580 -2.780 438 1HE LYS 49 HE2 LYS 49 -2.066 -18.243 -3.066 439 2HE LYS 49 HE1 LYS 49 -1.383 -16.698 -2.557 440 1HZ LYS 49 HZ3 LYS 49 -1.904 -19.025 -0.778 441 2HZ LYS 49 HZ2 LYS 49 -0.412 -18.609 -1.367 442 3HZ LYS 49 HZ1 LYS 49 -1.188 -17.584 -0.275 443 H ASP 50 HN ASP 50 -5.014 -13.413 2.988 444 HA ASP 50 HA ASP 50 -7.147 -14.870 4.149 445 1HB ASP 50 HB2 ASP 50 -5.516 -13.544 5.470 446 2HB ASP 50 HB1 ASP 50 -6.213 -12.067 4.810 447 H LYS 51 HN LYS 51 -8.879 -15.022 2.961 448 HA LYS 51 HA LYS 51 -10.076 -12.592 1.836 449 1HB LYS 51 HB2 LYS 51 -11.342 -14.112 0.354 450 2HB LYS 51 HB1 LYS 51 -9.599 -14.246 0.146 451 1HG LYS 51 HG2 LYS 51 -9.549 -16.270 1.455 452 2HG LYS 51 HG1 LYS 51 -11.264 -16.119 1.816 453 1HD LYS 51 HD2 LYS 51 -10.107 -16.479 -0.943 454 2HD LYS 51 HD1 LYS 51 -10.751 -17.783 0.057 455 1HE LYS 51 HE2 LYS 51 -12.931 -16.597 0.103 456 2HE LYS 51 HE1 LYS 51 -12.266 -15.396 -0.999 457 1HZ LYS 51 HZ2 LYS 51 -12.548 -18.288 -1.584 458 2HZ LYS 51 HZ1 LYS 51 -13.548 -17.076 -2.164 459 3HZ LYS 51 HZ3 LYS 51 -11.934 -17.116 -2.643 460 H VAL 52 HN VAL 52 -10.277 -14.279 4.417 461 HA VAL 52 HA VAL 52 -13.138 -14.613 4.527 462 HB VAL 52 HB VAL 52 -12.773 -15.348 6.946 463 1HG1 VAL 52 1HG1 VAL 52 -11.325 -16.821 4.743 464 2HG1 VAL 52 3HG1 VAL 52 -11.852 -17.529 6.269 465 3HG1 VAL 52 2HG1 VAL 52 -13.045 -16.936 5.116 466 1HG2 VAL 52 3HG2 VAL 52 -9.863 -15.220 6.096 467 2HG2 VAL 52 2HG2 VAL 52 -10.626 -14.239 7.340 468 3HG2 VAL 52 1HG2 VAL 52 -10.467 -15.982 7.571 469 H HIS 53 HN HIS 53 -13.380 -12.426 3.988 470 HA HIS 53 HA HIS 53 -12.967 -10.457 6.047 471 1HB HIS 53 HB2 HIS 53 -14.247 -10.229 3.314 472 2HB HIS 53 HB1 HIS 53 -13.974 -8.878 4.405 473 HD1 HIS 53 HD1 HIS 53 -12.424 -10.470 1.560 474 HD2 HIS 53 HD2 HIS 53 -11.061 -8.692 5.067 475 HE1 HIS 53 HE1 HIS 53 -10.031 -9.878 1.158 476 H LYS 54 HN LYS 54 -14.372 -10.015 7.550 477 HA LYS 54 HA LYS 54 -16.942 -11.242 7.599 478 1HB LYS 54 HB2 LYS 54 -15.778 -11.001 9.688 479 2HB LYS 54 HB1 LYS 54 -15.583 -9.275 9.447 480 1HG LYS 54 HG2 LYS 54 -17.286 -9.741 11.125 481 2HG LYS 54 HG1 LYS 54 -17.990 -8.954 9.718 482 1HD LYS 54 HD2 LYS 54 -18.775 -11.154 8.913 483 2HD LYS 54 HD1 LYS 54 -18.110 -11.907 10.368 484 1HE LYS 54 HE2 LYS 54 -19.577 -10.515 11.753 485 2HE LYS 54 HE1 LYS 54 -20.227 -9.757 10.304 486 1HZ LYS 54 HZ1 LYS 54 -21.133 -11.913 9.639 487 2HZ LYS 54 HZ3 LYS 54 -20.504 -12.631 11.028 488 3HZ LYS 54 HZ2 LYS 54 -21.706 -11.454 11.139 489 H LEU 55 HN LEU 55 -18.612 -10.491 6.554 490 HA LEU 55 HA LEU 55 -18.819 -7.627 6.057 491 1HB LEU 55 HB2 LEU 55 -20.413 -9.920 4.919 492 2HB LEU 55 HB1 LEU 55 -20.575 -8.235 4.469 493 HG LEU 55 HG LEU 55 -18.179 -9.996 3.946 494 1HD1 LEU 55 HD1 LEU 55 -20.263 -8.825 2.150 495 2HD1 LEU 55 HD1 LEU 55 -18.841 -9.731 1.606 496 3HD1 LEU 55 HD1 LEU 55 -20.090 -10.527 2.577 497 1HD2 LEU 55 HD2 LEU 55 -18.689 -7.117 3.170 498 2HD2 LEU 55 HD2 LEU 55 -17.485 -7.685 4.330 499 3HD2 LEU 55 HD2 LEU 55 -17.330 -8.102 2.628 500 H GLU 56 HN GLU 56 -19.871 -6.629 7.590 501 HA GLU 56 HA GLU 56 -21.664 -8.004 9.359 502 1HB GLU 56 HB2 GLU 56 -21.473 -5.005 9.147 503 2HB GLU 56 HB1 GLU 56 -21.903 -5.974 10.541 504 1HG GLU 56 HG2 GLU 56 -19.790 -5.398 11.150 505 2HG GLU 56 HG1 GLU 56 -19.411 -6.845 10.213 506 H HIS 57 HN HIS 57 -22.041 -5.373 7.028 507 HA HIS 57 HA HIS 57 -24.860 -5.958 6.873 508 1HB HIS 57 HB2 HIS 57 -23.177 -3.856 5.471 509 2HB HIS 57 HB1 HIS 57 -24.913 -4.044 5.250 510 HD1 HIS 57 HD1 HIS 57 -22.739 -1.888 6.977 511 HD2 HIS 57 HD2 HIS 57 -26.119 -4.028 8.093 512 HE1 HIS 57 HE1 HIS 57 -23.649 -0.734 9.002 513 H HIS 58 HN HIS 58 -25.722 -7.121 5.304 514 HA HIS 58 HA HIS 58 -23.929 -7.996 3.161 515 1HB HIS 58 HB2 HIS 58 -24.210 -9.717 4.946 516 2HB HIS 58 HB1 HIS 58 -25.941 -9.703 4.648 517 HD1 HIS 58 HD1 HIS 58 -26.370 -11.948 3.600 518 HD2 HIS 58 HD2 HIS 58 -23.023 -10.063 2.030 519 HE1 HIS 58 HE1 HIS 58 -25.562 -13.415 1.729 520 H HIS 59 HN HIS 59 -24.660 -7.284 1.340 521 HA HIS 59 HA HIS 59 -25.904 -6.863 -0.454 522 1HB HIS 59 HB2 HIS 59 -27.189 -8.976 0.053 523 2HB HIS 59 HB1 HIS 59 -28.292 -8.015 1.015 524 HD1 HIS 59 HD1 HIS 59 -30.363 -7.345 -0.218 525 HD2 HIS 59 HD2 HIS 59 -27.145 -7.954 -2.771 526 HE1 HIS 59 HE1 HIS 59 -31.254 -7.040 -2.553 527 H HIS 60 HN HIS 60 -28.069 -6.266 2.270 528 HA HIS 60 HA HIS 60 -28.435 -3.579 1.204 529 1HB HIS 60 HB2 HIS 60 -30.407 -3.373 2.691 530 2HB HIS 60 HB1 HIS 60 -30.554 -4.756 1.625 531 HD1 HIS 60 HD1 HIS 60 -31.112 -3.824 5.042 532 HD2 HIS 60 HD2 HIS 60 -29.721 -7.240 3.118 533 HE1 HIS 60 HE1 HIS 60 -31.412 -5.716 6.660 534 H HIS 61 HN HIS 61 -27.823 -1.825 2.253 535 HA HIS 61 HA HIS 61 -25.806 -2.161 4.263 536 1HB HIS 61 HB2 HIS 61 -25.458 0.268 4.028 537 2HB HIS 61 HB1 HIS 61 -25.514 -0.522 2.458 538 HD1 HIS 61 HD1 HIS 61 -27.622 0.056 0.925 539 HD2 HIS 61 HD2 HIS 61 -27.469 2.104 4.543 540 HE1 HIS 61 HE1 HIS 61 -29.332 1.887 0.770 541 H HIS 62 HN HIS 62 -29.146 -1.563 4.326 542 HA HIS 62 HA HIS 62 -29.010 -0.867 7.148 543 1HB HIS 62 HB2 HIS 62 -29.394 1.185 5.707 544 2HB HIS 62 HB1 HIS 62 -30.883 0.438 5.154 545 HD1 HIS 62 HD1 HIS 62 -32.902 1.209 6.439 546 HD2 HIS 62 HD2 HIS 62 -29.404 1.448 8.674 547 HE1 HIS 62 HE1 HIS 62 -33.529 2.323 8.609 548 H1 MET 101 HT2 MET 101 10.755 22.165 -0.015 549 H2 MET 101 HT1 MET 101 10.784 22.435 1.659 550 H3 MET 101 HT3 MET 101 10.373 20.925 1.065 551 HA MET 101 HA MET 101 8.430 22.011 1.851 552 1HB MET 101 HB2 MET 101 9.257 24.332 1.499 553 2HB MET 101 HB1 MET 101 9.082 24.102 -0.234 554 1HG MET 101 HG2 MET 101 6.685 23.758 0.055 555 2HG MET 101 HG1 MET 101 6.856 24.031 1.785 556 1HE MET 101 HE1 MET 101 4.797 25.581 -0.002 557 2HE MET 101 HE3 MET 101 4.998 25.896 1.720 558 3HE MET 101 HE2 MET 101 4.998 27.234 0.575 559 H GLU 102 HN GLU 102 9.637 21.977 -1.449 560 HA GLU 102 HA GLU 102 7.371 21.400 -2.824 561 1HB GLU 102 HB2 GLU 102 8.904 20.561 -4.569 562 2HB GLU 102 HB1 GLU 102 9.440 22.080 -3.890 563 1HG GLU 102 HG2 GLU 102 10.590 19.338 -3.336 564 2HG GLU 102 HG1 GLU 102 11.290 20.594 -4.348 565 H MET 103 HN MET 103 6.056 19.843 -2.621 566 HA MET 103 HA MET 103 6.912 17.368 -1.386 567 1HB MET 103 HB2 MET 103 4.129 18.372 -1.990 568 2HB MET 103 HB1 MET 103 4.470 16.778 -1.336 569 1HG MET 103 HG2 MET 103 5.513 17.793 0.620 570 2HG MET 103 HG1 MET 103 5.181 19.392 -0.038 571 1HE MET 103 HE2 MET 103 4.355 18.290 2.887 572 2HE MET 103 HE1 MET 103 4.058 19.945 2.358 573 3HE MET 103 HE3 MET 103 2.746 18.991 3.050 574 H GLY 104 HN GLY 104 6.507 18.564 -4.447 575 1HA GLY 104 HA1 GLY 104 6.645 17.571 -6.506 576 2HA GLY 104 HA2 GLY 104 5.648 16.274 -5.845 577 H GLN 105 HN GLN 105 8.814 17.412 -4.846 578 HA GLN 105 HA GLN 105 10.208 15.206 -5.995 579 1HB GLN 105 HB2 GLN 105 11.090 17.202 -3.914 580 2HB GLN 105 HB1 GLN 105 12.139 16.003 -4.658 581 1HG GLN 105 HG2 GLN 105 10.713 18.246 -6.074 582 2HG GLN 105 HG1 GLN 105 12.438 18.165 -5.715 583 1HE2 GLN 105 1HE2 GLN 105 13.718 16.715 -6.871 584 2HE2 GLN 105 2HE2 GLN 105 13.200 16.034 -8.376 585 H LEU 106 HN LEU 106 8.767 15.872 -2.943 586 HA LEU 106 HA LEU 106 9.898 13.705 -1.509 587 1HB LEU 106 HB2 LEU 106 8.897 15.700 -0.430 588 2HB LEU 106 HB1 LEU 106 7.335 15.269 -1.069 589 HG LEU 106 HG LEU 106 7.704 14.882 1.408 590 1HD1 LEU 106 HD1 LEU 106 5.845 13.872 0.275 591 2HD1 LEU 106 HD1 LEU 106 6.855 12.516 -0.212 592 3HD1 LEU 106 HD1 LEU 106 6.506 12.785 1.497 593 1HD2 LEU 106 HD2 LEU 106 9.959 13.974 1.318 594 2HD2 LEU 106 HD2 LEU 106 8.849 12.829 2.075 595 3HD2 LEU 106 HD2 LEU 106 9.372 12.578 0.411 596 H LYS 107 HN LYS 107 6.867 14.165 -3.265 597 HA LYS 107 HA LYS 107 5.876 11.557 -2.998 598 1HB LYS 107 HB2 LYS 107 5.209 13.934 -4.477 599 2HB LYS 107 HB1 LYS 107 5.008 12.506 -5.486 600 1HG LYS 107 HG2 LYS 107 3.871 12.721 -2.731 601 2HG LYS 107 HG1 LYS 107 2.992 13.260 -4.159 602 1HD LYS 107 HD2 LYS 107 4.134 10.493 -3.931 603 2HD LYS 107 HD1 LYS 107 2.504 10.861 -3.335 604 1HE LYS 107 HE2 LYS 107 2.045 11.737 -5.679 605 2HE LYS 107 HE1 LYS 107 3.583 11.022 -6.150 606 1HZ LYS 107 HZ3 LYS 107 1.336 9.536 -4.937 607 2HZ LYS 107 HZ2 LYS 107 1.611 9.589 -6.571 608 3HZ LYS 107 HZ1 LYS 107 2.732 8.821 -5.559 609 H ASN 108 HN ASN 108 8.043 13.004 -5.303 610 HA ASN 108 HA ASN 108 8.266 10.935 -7.135 611 1HB ASN 108 HB2 ASN 108 9.236 13.173 -7.497 612 2HB ASN 108 HB1 ASN 108 10.371 12.898 -6.191 613 1HD2 ASN 108 HD2 ASN 108 12.123 13.263 -7.499 614 2HD2 ASN 108 HD2 ASN 108 12.636 12.149 -8.706 615 H LYS 109 HN LYS 109 9.822 11.446 -4.035 616 HA LYS 109 HA LYS 109 11.526 9.172 -4.185 617 1HB LYS 109 HB2 LYS 109 10.621 10.803 -1.815 618 2HB LYS 109 HB1 LYS 109 11.830 9.531 -1.739 619 1HG LYS 109 HG2 LYS 109 13.204 10.782 -3.335 620 2HG LYS 109 HG1 LYS 109 12.004 12.073 -3.321 621 1HD LYS 109 HD2 LYS 109 12.384 12.452 -0.973 622 2HD LYS 109 HD1 LYS 109 13.484 11.073 -0.900 623 1HE LYS 109 HE2 LYS 109 13.884 13.607 -2.490 624 2HE LYS 109 HE1 LYS 109 14.731 13.152 -1.014 625 1HZ LYS 109 HZ3 LYS 109 15.651 11.233 -2.200 626 2HZ LYS 109 HZ2 LYS 109 14.903 11.759 -3.632 627 3HZ LYS 109 HZ1 LYS 109 16.084 12.695 -2.913 628 H ILE 110 HN ILE 110 8.412 9.849 -2.665 629 HA ILE 110 HA ILE 110 7.992 7.382 -1.431 630 HB ILE 110 HB ILE 110 5.952 9.279 -2.640 631 1HG1 ILE 110 2HG1 ILE 110 6.835 8.810 0.210 632 2HG1 ILE 110 1HG1 ILE 110 7.248 10.208 -0.780 633 1HG2 ILE 110 1HG2 ILE 110 4.954 7.059 -2.526 634 2HG2 ILE 110 3HG2 ILE 110 5.430 6.917 -0.835 635 3HG2 ILE 110 2HG2 ILE 110 4.236 8.120 -1.314 636 1HD1 ILE 110 HD1 ILE 110 4.868 10.833 -0.819 637 2HD1 ILE 110 HD1 ILE 110 4.504 9.443 0.210 638 3HD1 ILE 110 HD1 ILE 110 5.528 10.749 0.814 639 H GLU 111 HN GLU 111 7.071 8.426 -4.678 640 HA GLU 111 HA GLU 111 5.917 6.056 -5.571 641 1HB GLU 111 HB2 GLU 111 7.419 8.174 -7.096 642 2HB GLU 111 HB1 GLU 111 6.564 6.849 -7.869 643 1HG GLU 111 HG2 GLU 111 5.348 8.971 -6.119 644 2HG GLU 111 HG1 GLU 111 5.230 8.857 -7.879 645 H ASN 112 HN ASN 112 9.233 7.159 -5.898 646 HA ASN 112 HA ASN 112 10.211 4.961 -7.337 647 1HB ASN 112 HB2 ASN 112 11.330 7.212 -6.979 648 2HB ASN 112 HB1 ASN 112 11.815 6.637 -5.395 649 1HD2 ASN 112 HD2 ASN 112 13.462 7.488 -7.580 650 2HD2 ASN 112 HD2 ASN 112 14.470 6.173 -8.046 651 H LYS 113 HN LYS 113 10.202 5.612 -3.841 652 HA LYS 113 HA LYS 113 11.578 3.275 -3.064 653 1HB LYS 113 HB2 LYS 113 11.186 5.368 -1.682 654 2HB LYS 113 HB1 LYS 113 9.553 4.795 -1.436 655 1HG LYS 113 HG2 LYS 113 10.929 4.248 0.498 656 2HG LYS 113 HG1 LYS 113 10.401 2.783 -0.331 657 1HD LYS 113 HD2 LYS 113 12.743 2.649 0.340 658 2HD LYS 113 HD1 LYS 113 12.573 2.586 -1.407 659 1HE LYS 113 HE2 LYS 113 13.129 4.956 -1.537 660 2HE LYS 113 HE1 LYS 113 13.351 5.018 0.220 661 1HZ LYS 113 HZ2 LYS 113 14.866 3.390 -1.725 662 2HZ LYS 113 HZ1 LYS 113 15.441 4.768 -0.955 663 3HZ LYS 113 HZ3 LYS 113 15.127 3.386 -0.037 664 H LYS 114 HN LYS 114 8.164 4.048 -3.306 665 HA LYS 114 HA LYS 114 6.924 1.754 -2.369 666 1HB LYS 114 HB2 LYS 114 5.835 3.888 -3.047 667 2HB LYS 114 HB1 LYS 114 6.180 3.501 -4.715 668 1HG LYS 114 HG2 LYS 114 4.696 1.531 -4.523 669 2HG LYS 114 HG1 LYS 114 4.310 2.025 -2.872 670 1HD LYS 114 HD2 LYS 114 2.548 2.868 -4.262 671 2HD LYS 114 HD1 LYS 114 3.567 4.243 -3.827 672 1HE LYS 114 HE2 LYS 114 4.746 3.947 -6.030 673 2HE LYS 114 HE1 LYS 114 3.525 2.724 -6.391 674 1HZ LYS 114 HZ1 LYS 114 2.956 5.602 -5.837 675 2HZ LYS 114 HZ3 LYS 114 3.046 4.942 -7.332 676 3HZ LYS 114 HZ2 LYS 114 1.795 4.496 -6.329 677 H LYS 115 HN LYS 115 8.048 2.585 -5.566 678 HA LYS 115 HA LYS 115 7.339 0.113 -6.778 679 1HB LYS 115 HB2 LYS 115 9.118 2.343 -7.782 680 2HB LYS 115 HB1 LYS 115 8.558 0.988 -8.761 681 1HG LYS 115 HG2 LYS 115 6.272 1.676 -8.537 682 2HG LYS 115 HG1 LYS 115 6.709 2.900 -7.354 683 1HD LYS 115 HD2 LYS 115 6.317 4.041 -9.404 684 2HD LYS 115 HD1 LYS 115 8.053 4.013 -9.153 685 1HE LYS 115 HE2 LYS 115 8.320 2.206 -10.724 686 2HE LYS 115 HE1 LYS 115 6.571 2.069 -10.916 687 1HZ LYS 115 HZ1 LYS 115 8.200 4.437 -11.668 688 2HZ LYS 115 HZ3 LYS 115 7.551 3.305 -12.739 689 3HZ LYS 115 HZ2 LYS 115 6.537 4.295 -11.837 690 H GLU 116 HN GLU 116 10.302 1.338 -5.330 691 HA GLU 116 HA GLU 116 12.025 -0.749 -6.092 692 1HB GLU 116 HB2 GLU 116 11.975 0.865 -3.508 693 2HB GLU 116 HB1 GLU 116 13.243 -0.275 -3.911 694 1HG GLU 116 HG2 GLU 116 13.745 1.123 -5.905 695 2HG GLU 116 HG1 GLU 116 12.544 2.278 -5.322 696 H LEU 117 HN LEU 117 9.744 -0.417 -3.465 697 HA LEU 117 HA LEU 117 10.204 -2.901 -2.197 698 1HB LEU 117 HB2 LEU 117 9.061 -1.181 -1.026 699 2HB LEU 117 HB1 LEU 117 7.832 -1.066 -2.276 700 HG LEU 117 HG LEU 117 7.457 -3.611 -1.598 701 1HD1 LEU 117 HD1 LEU 117 8.711 -2.653 0.809 702 2HD1 LEU 117 HD1 LEU 117 7.586 -4.037 0.624 703 3HD1 LEU 117 HD1 LEU 117 9.094 -4.006 -0.274 704 1HD2 LEU 117 HD2 LEU 117 6.369 -1.285 -0.083 705 2HD2 LEU 117 HD2 LEU 117 5.840 -1.982 -1.633 706 3HD2 LEU 117 HD2 LEU 117 5.733 -2.963 -0.163 707 H ILE 118 HN ILE 118 7.754 -1.780 -4.503 708 HA ILE 118 HA ILE 118 6.295 -4.095 -4.740 709 HB ILE 118 HB ILE 118 6.839 -2.029 -6.896 710 1HG1 ILE 118 2HG1 ILE 118 4.375 -2.375 -5.192 711 2HG1 ILE 118 1HG1 ILE 118 5.709 -1.335 -4.714 712 1HG2 ILE 118 1HG2 ILE 118 4.688 -4.183 -6.861 713 2HG2 ILE 118 3HG2 ILE 118 4.807 -2.881 -8.040 714 3HG2 ILE 118 2HG2 ILE 118 6.053 -4.115 -7.952 715 1HD1 ILE 118 HD1 ILE 118 4.086 -1.047 -7.226 716 2HD1 ILE 118 HD1 ILE 118 3.885 -0.103 -5.749 717 3HD1 ILE 118 HD1 ILE 118 5.378 0.022 -6.677 718 H GLN 119 HN GLN 119 9.138 -3.116 -6.602 719 HA GLN 119 HA GLN 119 9.263 -5.356 -8.258 720 1HB GLN 119 HB2 GLN 119 11.431 -3.516 -7.272 721 2HB GLN 119 HB1 GLN 119 11.711 -4.757 -8.479 722 1HG GLN 119 HG2 GLN 119 10.019 -3.671 -9.934 723 2HG GLN 119 HG1 GLN 119 9.828 -2.407 -8.723 724 1HE2 GLN 119 1HE2 GLN 119 12.883 -3.892 -9.566 725 2HE2 GLN 119 2HE2 GLN 119 13.593 -2.478 -10.255 726 H LEU 120 HN LEU 120 10.230 -4.965 -4.943 727 HA LEU 120 HA LEU 120 11.757 -7.401 -4.854 728 1HB LEU 120 HB2 LEU 120 10.701 -5.661 -2.621 729 2HB LEU 120 HB1 LEU 120 11.762 -7.036 -2.396 730 HG LEU 120 HG LEU 120 12.469 -4.508 -3.887 731 1HD1 LEU 120 HD1 LEU 120 13.321 -5.497 -1.174 732 2HD1 LEU 120 HD1 LEU 120 13.945 -4.066 -1.995 733 3HD1 LEU 120 HD1 LEU 120 12.254 -4.130 -1.500 734 1HD2 LEU 120 HD2 LEU 120 14.153 -6.906 -3.151 735 2HD2 LEU 120 HD2 LEU 120 13.659 -6.435 -4.778 736 3HD2 LEU 120 HD2 LEU 120 14.755 -5.408 -3.859 737 H VAL 121 HN VAL 121 8.521 -6.370 -3.620 738 HA VAL 121 HA VAL 121 7.704 -8.867 -2.702 739 HB VAL 121 HB VAL 121 5.945 -6.735 -3.971 740 1HG1 VAL 121 3HG1 VAL 121 4.766 -8.815 -3.439 741 2HG1 VAL 121 2HG1 VAL 121 5.370 -8.688 -1.773 742 3HG1 VAL 121 1HG1 VAL 121 4.268 -7.471 -2.396 743 1HG2 VAL 121 2HG2 VAL 121 6.960 -6.864 -1.139 744 2HG2 VAL 121 1HG2 VAL 121 7.410 -5.676 -2.363 745 3HG2 VAL 121 3HG2 VAL 121 5.757 -5.724 -1.755 746 H ALA 122 HN ALA 122 7.598 -7.430 -5.889 747 HA ALA 122 HA ALA 122 6.030 -9.274 -7.250 748 1HB ALA 122 HB2 ALA 122 8.238 -7.560 -8.348 749 2HB ALA 122 HB1 ALA 122 6.952 -8.325 -9.284 750 3HB ALA 122 HB3 ALA 122 6.561 -7.069 -8.109 751 H ARG 123 HN ARG 123 9.567 -9.059 -6.942 752 HA ARG 123 HA ARG 123 10.098 -11.270 -8.641 753 1HB ARG 123 HB2 ARG 123 12.411 -11.106 -7.915 754 2HB ARG 123 HB1 ARG 123 11.762 -9.516 -8.265 755 1HG ARG 123 HG2 ARG 123 11.441 -9.136 -5.872 756 2HG ARG 123 HG1 ARG 123 12.157 -10.699 -5.515 757 1HD ARG 123 HD2 ARG 123 13.803 -8.901 -5.268 758 2HD ARG 123 HD1 ARG 123 14.245 -9.981 -6.589 759 HE ARG 123 HE ARG 123 12.734 -7.942 -7.672 760 1HH1 ARG 123 1HH1 ARG 123 15.830 -8.120 -5.927 761 2HH1 ARG 123 2HH1 ARG 123 16.573 -6.909 -6.855 762 1HH2 ARG 123 1HH2 ARG 123 13.790 -6.300 -8.953 763 2HH2 ARG 123 2HH2 ARG 123 15.407 -5.863 -8.604 764 H HIS 124 HN HIS 124 9.040 -11.111 -5.473 765 HA HIS 124 HA HIS 124 10.223 -13.444 -4.431 766 1HB HIS 124 HB2 HIS 124 9.330 -11.781 -2.955 767 2HB HIS 124 HB1 HIS 124 7.736 -11.903 -3.624 768 HD1 HIS 124 HD1 HIS 124 10.183 -14.010 -1.545 769 HD2 HIS 124 HD2 HIS 124 6.169 -13.759 -2.501 770 HE1 HIS 124 HE1 HIS 124 9.033 -15.730 -0.108 771 H GLY 125 HN GLY 125 7.584 -12.990 -6.620 772 1HA GLY 125 HA1 GLY 125 6.476 -15.611 -6.026 773 2HA GLY 125 HA2 GLY 125 7.345 -15.495 -7.548 774 H LEU 126 HN LEU 126 5.697 -12.616 -6.559 775 HA LEU 126 HA LEU 126 3.221 -13.029 -7.507 776 1HB LEU 126 HB2 LEU 126 5.046 -10.801 -7.115 777 2HB LEU 126 HB1 LEU 126 3.592 -10.469 -8.054 778 HG LEU 126 HG LEU 126 2.289 -11.326 -6.143 779 1HD1 LEU 126 HD1 LEU 126 3.819 -12.738 -5.144 780 2HD1 LEU 126 HD1 LEU 126 4.863 -11.389 -4.643 781 3HD1 LEU 126 HD1 LEU 126 3.219 -11.564 -3.975 782 1HD2 LEU 126 HD2 LEU 126 2.580 -8.958 -6.456 783 2HD2 LEU 126 HD2 LEU 126 2.580 -9.332 -4.727 784 3HD2 LEU 126 HD2 LEU 126 4.100 -9.013 -5.563 785 H ASP 127 HN ASP 127 2.322 -13.012 -9.322 786 HA ASP 127 HA ASP 127 3.922 -13.127 -11.743 787 1HB ASP 127 HB2 ASP 127 0.935 -13.505 -11.366 788 2HB ASP 127 HB1 ASP 127 1.782 -13.713 -12.890 789 H HIS 128 HN HIS 128 2.647 -11.990 -13.691 790 HA HIS 128 HA HIS 128 3.257 -9.288 -13.268 791 1HB HIS 128 HB2 HIS 128 1.840 -10.624 -15.580 792 2HB HIS 128 HB1 HIS 128 2.307 -8.924 -15.572 793 HD1 HIS 128 HD1 HIS 128 3.740 -12.371 -15.991 794 HD2 HIS 128 HD2 HIS 128 5.063 -8.440 -15.674 795 HE1 HIS 128 HE1 HIS 128 6.160 -12.391 -16.651 796 H ASP 129 HN ASP 129 0.143 -10.917 -13.382 797 HA ASP 129 HA ASP 129 -1.414 -8.565 -13.233 798 1HB ASP 129 HB2 ASP 129 -2.342 -10.716 -13.991 799 2HB ASP 129 HB1 ASP 129 -2.099 -11.392 -12.388 800 H LYS 130 HN LYS 130 -0.024 -10.696 -10.882 801 HA LYS 130 HA LYS 130 -1.150 -9.725 -8.501 802 1HB LYS 130 HB2 LYS 130 1.549 -10.919 -9.071 803 2HB LYS 130 HB1 LYS 130 0.978 -10.544 -7.456 804 1HG LYS 130 HG2 LYS 130 -0.630 -12.301 -9.238 805 2HG LYS 130 HG1 LYS 130 0.785 -12.944 -8.406 806 1HD LYS 130 HD2 LYS 130 -0.123 -12.334 -6.286 807 2HD LYS 130 HD1 LYS 130 -1.516 -11.554 -7.014 808 1HE LYS 130 HE2 LYS 130 -2.207 -13.741 -7.944 809 2HE LYS 130 HE1 LYS 130 -0.784 -14.487 -7.223 810 1HZ LYS 130 HZ2 LYS 130 -1.650 -13.852 -5.033 811 2HZ LYS 130 HZ1 LYS 130 -3.040 -13.231 -5.750 812 3HZ LYS 130 HZ3 LYS 130 -2.692 -14.881 -5.851 813 H VAL 131 HN VAL 131 1.772 -8.742 -10.282 814 HA VAL 131 HA VAL 131 2.673 -6.801 -8.453 815 HB VAL 131 HB VAL 131 3.114 -6.769 -11.454 816 1HG1 VAL 131 1HG1 VAL 131 3.797 -4.730 -10.379 817 2HG1 VAL 131 3HG1 VAL 131 4.770 -5.639 -9.224 818 3HG1 VAL 131 2HG1 VAL 131 5.203 -5.638 -10.935 819 1HG2 VAL 131 2HG2 VAL 131 4.683 -8.235 -9.346 820 2HG2 VAL 131 1HG2 VAL 131 3.686 -8.957 -10.610 821 3HG2 VAL 131 3HG2 VAL 131 5.151 -8.073 -11.042 822 H LEU 132 HN LEU 132 0.613 -6.642 -11.305 823 HA LEU 132 HA LEU 132 0.239 -3.865 -11.366 824 1HB LEU 132 HB2 LEU 132 -1.677 -6.019 -12.232 825 2HB LEU 132 HB1 LEU 132 -1.774 -4.330 -12.687 826 HG LEU 132 HG LEU 132 0.368 -6.292 -13.480 827 1HD1 LEU 132 HD1 LEU 132 -1.714 -6.613 -14.636 828 2HD1 LEU 132 HD1 LEU 132 -1.760 -4.899 -15.067 829 3HD1 LEU 132 HD1 LEU 132 -0.496 -5.945 -15.727 830 1HD2 LEU 132 HD2 LEU 132 0.104 -3.359 -14.149 831 2HD2 LEU 132 HD2 LEU 132 1.361 -4.107 -13.162 832 3HD2 LEU 132 HD2 LEU 132 1.258 -4.479 -14.882 833 H LEU 133 HN LEU 133 -1.667 -6.409 -9.811 834 HA LEU 133 HA LEU 133 -3.655 -4.738 -8.704 835 1HB LEU 133 HB2 LEU 133 -2.581 -7.380 -7.755 836 2HB LEU 133 HB1 LEU 133 -4.010 -6.606 -7.106 837 HG LEU 133 HG LEU 133 -3.718 -7.498 -9.968 838 1HD1 LEU 133 HD1 LEU 133 -5.066 -8.830 -7.630 839 2HD1 LEU 133 HD1 LEU 133 -5.160 -9.350 -9.314 840 3HD1 LEU 133 HD1 LEU 133 -3.615 -9.394 -8.474 841 1HD2 LEU 133 HD2 LEU 133 -6.111 -6.629 -8.345 842 2HD2 LEU 133 HD2 LEU 133 -5.350 -5.705 -9.640 843 3HD2 LEU 133 HD2 LEU 133 -6.158 -7.230 -10.000 844 H PHE 134 HN PHE 134 -0.702 -6.071 -7.290 845 HA PHE 134 HA PHE 134 -1.024 -4.943 -4.776 846 1HB PHE 134 HB2 PHE 134 0.527 -6.752 -5.151 847 2HB PHE 134 HB1 PHE 134 1.509 -5.750 -6.217 848 HD1 PHE 134 HD1 PHE 134 3.278 -4.520 -5.344 849 HD2 PHE 134 HD2 PHE 134 0.284 -6.014 -2.722 850 HE1 PHE 134 HE1 PHE 134 4.609 -3.786 -3.413 851 HE2 PHE 134 HE2 PHE 134 1.609 -5.282 -0.791 852 HZ PHE 134 HZ PHE 134 3.784 -4.161 -1.145 853 H SER 135 HN SER 135 0.701 -3.663 -7.615 854 HA SER 135 HA SER 135 1.762 -1.448 -6.274 855 1HB SER 135 HB2 SER 135 2.111 -0.514 -8.594 856 2HB SER 135 HB1 SER 135 2.765 -2.129 -8.327 857 HG SER 135 HG SER 135 1.247 -2.995 -9.521 858 H ARG 136 HN ARG 136 -1.247 -1.797 -8.111 859 HA ARG 136 HA ARG 136 -1.865 0.972 -7.952 860 1HB ARG 136 HB2 ARG 136 -4.016 0.368 -8.934 861 2HB ARG 136 HB1 ARG 136 -2.702 -0.430 -9.777 862 1HG ARG 136 HG2 ARG 136 -3.209 -2.462 -8.359 863 2HG ARG 136 HG1 ARG 136 -4.680 -1.622 -7.868 864 1HD ARG 136 HD2 ARG 136 -3.888 -2.303 -10.693 865 2HD ARG 136 HD1 ARG 136 -5.071 -3.153 -9.714 866 HE ARG 136 HE ARG 136 -6.257 -0.926 -9.639 867 1HH1 ARG 136 1HH1 ARG 136 -4.212 -1.757 -12.420 868 2HH1 ARG 136 2HH1 ARG 136 -5.242 -1.040 -13.554 869 1HH2 ARG 136 1HH2 ARG 136 -7.619 -0.021 -11.129 870 2HH2 ARG 136 2HH2 ARG 136 -7.303 -0.005 -12.825 871 H ASP 137 HN ASP 137 -2.690 -1.820 -5.991 872 HA ASP 137 HA ASP 137 -4.682 -0.362 -4.523 873 1HB ASP 137 HB2 ASP 137 -4.364 -2.988 -4.940 874 2HB ASP 137 HB1 ASP 137 -3.506 -2.861 -3.408 875 H LEU 138 HN LEU 138 -1.315 -1.128 -4.179 876 HA LEU 138 HA LEU 138 -0.915 -0.164 -1.557 877 1HB LEU 138 HB2 LEU 138 0.748 -1.556 -2.537 878 2HB LEU 138 HB1 LEU 138 0.880 -0.537 -3.943 879 HG LEU 138 HG LEU 138 2.089 1.143 -2.672 880 1HD1 LEU 138 HD1 LEU 138 1.752 -0.699 -0.320 881 2HD1 LEU 138 HD1 LEU 138 2.733 0.775 -0.387 882 3HD1 LEU 138 HD1 LEU 138 0.977 0.878 -0.534 883 1HD2 LEU 138 HD2 LEU 138 3.145 -1.635 -2.205 884 2HD2 LEU 138 HD2 LEU 138 3.353 -0.670 -3.663 885 3HD2 LEU 138 HD2 LEU 138 4.092 -0.150 -2.150 886 H ASP 139 HN ASP 139 -0.620 1.348 -4.738 887 HA ASP 139 HA ASP 139 0.254 3.899 -4.059 888 1HB ASP 139 HB2 ASP 139 -0.003 3.055 -6.370 889 2HB ASP 139 HB1 ASP 139 -1.751 3.117 -6.189 890 H LYS 140 HN LYS 140 -3.043 2.710 -4.410 891 HA LYS 140 HA LYS 140 -4.633 4.776 -3.766 892 1HB LYS 140 HB2 LYS 140 -5.046 2.669 -4.695 893 2HB LYS 140 HB1 LYS 140 -4.721 1.861 -3.178 894 1HG LYS 140 HG2 LYS 140 -6.601 3.131 -2.208 895 2HG LYS 140 HG1 LYS 140 -6.965 3.674 -3.868 896 1HD LYS 140 HD2 LYS 140 -6.860 0.789 -2.930 897 2HD LYS 140 HD1 LYS 140 -8.333 1.679 -3.337 898 1HE LYS 140 HE2 LYS 140 -7.659 1.894 -5.615 899 2HE LYS 140 HE1 LYS 140 -6.063 1.237 -5.281 900 1HZ LYS 140 HZ2 LYS 140 -7.128 -0.885 -4.768 901 2HZ LYS 140 HZ1 LYS 140 -8.621 -0.230 -5.177 902 3HZ LYS 140 HZ3 LYS 140 -7.405 -0.308 -6.354 903 H LEU 141 HN LEU 141 -3.136 2.355 -1.634 904 HA LEU 141 HA LEU 141 -4.378 3.177 0.753 905 1HB LEU 141 HB2 LEU 141 -3.414 0.963 0.448 906 2HB LEU 141 HB1 LEU 141 -1.814 1.659 0.314 907 HG LEU 141 HG LEU 141 -1.954 2.406 2.658 908 1HD1 LEU 141 HD1 LEU 141 -4.569 0.914 2.665 909 2HD1 LEU 141 HD1 LEU 141 -3.737 1.539 4.090 910 3HD1 LEU 141 HD1 LEU 141 -4.343 2.655 2.870 911 1HD2 LEU 141 HD2 LEU 141 -2.475 -0.527 2.216 912 2HD2 LEU 141 HD2 LEU 141 -0.916 0.286 2.099 913 3HD2 LEU 141 HD2 LEU 141 -1.742 0.186 3.653 914 H ILE 142 HN ILE 142 -1.352 3.975 -0.761 915 HA ILE 142 HA ILE 142 -0.334 5.534 1.386 916 HB ILE 142 HB ILE 142 0.361 5.669 -1.572 917 1HG1 ILE 142 2HG1 ILE 142 1.709 4.302 0.751 918 2HG1 ILE 142 1HG1 ILE 142 0.799 3.497 -0.525 919 1HG2 ILE 142 3HG2 ILE 142 1.829 6.829 0.810 920 2HG2 ILE 142 2HG2 ILE 142 2.417 6.817 -0.852 921 3HG2 ILE 142 1HG2 ILE 142 0.981 7.748 -0.433 922 1HD1 ILE 142 HD1 ILE 142 3.362 5.037 -0.865 923 2HD1 ILE 142 HD1 ILE 142 3.193 3.278 -0.852 924 3HD1 ILE 142 HD1 ILE 142 2.455 4.231 -2.143 925 H ASN 143 HN ASN 143 -1.832 6.520 -1.645 926 HA ASN 143 HA ASN 143 -2.172 9.244 -1.254 927 1HB ASN 143 HB2 ASN 143 -4.026 7.287 -2.629 928 2HB ASN 143 HB1 ASN 143 -4.356 9.011 -2.560 929 1HD2 ASN 143 HD2 ASN 143 -2.230 6.569 -3.854 930 2HD2 ASN 143 HD2 ASN 143 -1.585 7.529 -5.114 931 H LYS 144 HN LYS 144 -4.153 6.637 -0.023 932 HA LYS 144 HA LYS 144 -6.287 8.026 1.101 933 1HB LYS 144 HB2 LYS 144 -6.186 5.590 0.905 934 2HB LYS 144 HB1 LYS 144 -4.906 5.536 2.102 935 1HG LYS 144 HG2 LYS 144 -6.487 6.478 3.766 936 2HG LYS 144 HG1 LYS 144 -7.765 6.361 2.554 937 1HD LYS 144 HD2 LYS 144 -6.157 4.075 3.703 938 2HD LYS 144 HD1 LYS 144 -7.847 4.443 4.045 939 1HE LYS 144 HE2 LYS 144 -8.350 4.104 1.648 940 2HE LYS 144 HE1 LYS 144 -6.678 3.630 1.393 941 1HZ LYS 144 HZ3 LYS 144 -7.029 1.785 2.979 942 2HZ LYS 144 HZ2 LYS 144 -8.629 2.239 3.126 943 3HZ LYS 144 HZ1 LYS 144 -8.049 1.703 1.638 944 H PHE 145 HN PHE 145 -3.220 7.066 2.575 945 HA PHE 145 HA PHE 145 -3.891 8.399 4.995 946 1HB PHE 145 HB2 PHE 145 -1.566 6.773 4.103 947 2HB PHE 145 HB1 PHE 145 -1.409 7.767 5.546 948 HD1 PHE 145 HD1 PHE 145 -3.365 5.003 4.011 949 HD2 PHE 145 HD2 PHE 145 -2.421 7.165 7.562 950 HE1 PHE 145 HE1 PHE 145 -4.527 3.305 5.353 951 HE2 PHE 145 HE2 PHE 145 -3.588 5.477 8.900 952 HZ PHE 145 HZ PHE 145 -4.645 3.539 7.799 953 H MET 146 HN MET 146 -2.010 9.152 2.216 954 HA MET 146 HA MET 146 -0.573 11.419 3.242 955 1HB MET 146 HB2 MET 146 -1.611 11.013 0.429 956 2HB MET 146 HB1 MET 146 -0.355 12.130 0.931 957 1HG MET 146 HG2 MET 146 1.043 10.114 1.545 958 2HG MET 146 HG1 MET 146 -0.252 9.143 0.895 959 1HE MET 146 HE1 MET 146 2.465 11.783 0.075 960 2HE MET 146 HE3 MET 146 2.231 12.052 -1.650 961 3HE MET 146 HE2 MET 146 1.011 12.601 -0.505 962 H ASN 147 HN ASN 147 -3.748 10.802 2.083 963 HA ASN 147 HA ASN 147 -5.678 11.840 1.952 964 1HB ASN 147 HB2 ASN 147 -5.108 12.948 4.157 965 2HB ASN 147 HB1 ASN 147 -4.459 14.308 3.250 966 1HD2 ASN 147 HD2 ASN 147 -5.963 15.735 4.111 967 2HD2 ASN 147 HD2 ASN 147 -7.629 15.722 3.675 968 H VAL 148 HN VAL 148 -3.063 12.508 0.505 969 HA VAL 148 HA VAL 148 -4.012 14.528 -1.364 970 HB VAL 148 HB VAL 148 -1.450 12.989 -1.419 971 1HG1 VAL 148 3HG1 VAL 148 -2.052 13.976 -3.574 972 2HG1 VAL 148 2HG1 VAL 148 -2.248 15.558 -2.818 973 3HG1 VAL 148 1HG1 VAL 148 -0.651 14.817 -2.907 974 1HG2 VAL 148 1HG2 VAL 148 -1.537 14.277 0.631 975 2HG2 VAL 148 3HG2 VAL 148 -0.350 14.986 -0.466 976 3HG2 VAL 148 2HG2 VAL 148 -1.941 15.728 -0.286 977 H LYS 149 HN LYS 149 -5.503 13.588 -2.254 978 HA LYS 149 HA LYS 149 -5.026 11.171 -3.834 979 1HB LYS 149 HB2 LYS 149 -7.509 10.789 -3.461 980 2HB LYS 149 HB1 LYS 149 -6.497 10.595 -2.033 981 1HG LYS 149 HG2 LYS 149 -7.064 12.933 -1.424 982 2HG LYS 149 HG1 LYS 149 -8.270 12.936 -2.721 983 1HD LYS 149 HD2 LYS 149 -9.295 10.924 -1.631 984 2HD LYS 149 HD1 LYS 149 -8.176 11.144 -0.287 985 1HE LYS 149 HE2 LYS 149 -10.279 13.093 -1.221 986 2HE LYS 149 HE1 LYS 149 -10.346 12.118 0.238 987 1HZ LYS 149 HZ1 LYS 149 -8.412 13.392 1.107 988 2HZ LYS 149 HZ3 LYS 149 -8.417 14.316 -0.316 989 3HZ LYS 149 HZ2 LYS 149 -9.717 14.371 0.724 990 H ASP 150 HN ASP 150 -4.535 13.837 -4.290 991 HA ASP 150 HA ASP 150 -4.545 15.463 -5.734 992 1HB ASP 150 HB2 ASP 150 -5.234 13.615 -7.347 993 2HB ASP 150 HB1 ASP 150 -6.872 14.269 -7.239 994 H LYS 151 HN LYS 151 -6.322 17.105 -6.749 995 HA LYS 151 HA LYS 151 -7.438 18.053 -4.226 996 1HB LYS 151 HB2 LYS 151 -7.514 20.276 -5.339 997 2HB LYS 151 HB1 LYS 151 -5.907 19.586 -5.208 998 1HG LYS 151 HG2 LYS 151 -6.084 18.852 -7.569 999 2HG LYS 151 HG1 LYS 151 -7.639 19.670 -7.670 1000 1HD LYS 151 HD2 LYS 151 -6.087 21.158 -8.598 1001 2HD LYS 151 HD1 LYS 151 -6.410 21.791 -6.989 1002 1HE LYS 151 HE2 LYS 151 -4.008 20.103 -7.739 1003 2HE LYS 151 HE1 LYS 151 -3.994 21.857 -7.694 1004 1HZ LYS 151 HZ1 LYS 151 -4.533 21.659 -5.271 1005 2HZ LYS 151 HZ3 LYS 151 -4.272 19.990 -5.383 1006 3HZ LYS 151 HZ2 LYS 151 -3.047 21.065 -5.715 1007 H VAL 152 HN VAL 152 -8.586 16.159 -6.251 1008 HA VAL 152 HA VAL 152 -11.275 17.260 -6.234 1009 HB VAL 152 HB VAL 152 -11.716 16.073 -8.371 1010 1HG1 VAL 152 1HG1 VAL 152 -11.291 18.465 -8.428 1011 2HG1 VAL 152 3HG1 VAL 152 -9.558 18.170 -8.570 1012 3HG1 VAL 152 2HG1 VAL 152 -10.643 17.694 -9.875 1013 1HG2 VAL 152 2HG2 VAL 152 -8.717 15.728 -8.501 1014 2HG2 VAL 152 1HG2 VAL 152 -9.910 14.443 -8.330 1015 3HG2 VAL 152 3HG2 VAL 152 -9.835 15.384 -9.819 1016 H HIS 153 HN HIS 153 -12.836 15.385 -6.533 1017 HA HIS 153 HA HIS 153 -11.733 12.916 -5.510 1018 1HB HIS 153 HB2 HIS 153 -13.863 12.574 -4.140 1019 2HB HIS 153 HB1 HIS 153 -12.774 13.804 -3.531 1020 HD1 HIS 153 HD1 HIS 153 -16.273 13.273 -4.613 1021 HD2 HIS 153 HD2 HIS 153 -13.713 16.480 -3.956 1022 HE1 HIS 153 HE1 HIS 153 -17.738 15.305 -4.389 1023 H LYS 154 HN LYS 154 -11.655 12.152 -7.469 1024 HA LYS 154 HA LYS 154 -13.731 12.411 -9.400 1025 1HB LYS 154 HB2 LYS 154 -11.372 12.151 -10.022 1026 2HB LYS 154 HB1 LYS 154 -11.407 10.503 -9.392 1027 1HG LYS 154 HG2 LYS 154 -13.225 9.986 -10.981 1028 2HG LYS 154 HG1 LYS 154 -13.043 11.598 -11.656 1029 1HD LYS 154 HD2 LYS 154 -10.709 11.036 -12.252 1030 2HD LYS 154 HD1 LYS 154 -10.984 9.408 -11.626 1031 1HE LYS 154 HE2 LYS 154 -12.620 10.700 -13.766 1032 2HE LYS 154 HE1 LYS 154 -11.288 9.577 -14.096 1033 1HZ LYS 154 HZ1 LYS 154 -13.765 8.924 -12.538 1034 2HZ LYS 154 HZ3 LYS 154 -13.462 8.487 -14.140 1035 3HZ LYS 154 HZ2 LYS 154 -12.491 7.867 -12.925 1036 H LEU 155 HN LEU 155 -15.553 11.339 -9.496 1037 HA LEU 155 HA LEU 155 -15.920 8.888 -8.133 1038 1HB LEU 155 HB2 LEU 155 -18.080 8.694 -9.219 1039 2HB LEU 155 HB1 LEU 155 -17.877 10.333 -8.670 1040 HG LEU 155 HG LEU 155 -17.561 9.457 -11.557 1041 1HD1 LEU 155 HD1 LEU 155 -19.905 10.735 -10.162 1042 2HD1 LEU 155 HD1 LEU 155 -19.767 10.464 -11.897 1043 3HD1 LEU 155 HD1 LEU 155 -19.834 9.090 -10.793 1044 1HD2 LEU 155 HD2 LEU 155 -17.851 12.200 -10.316 1045 2HD2 LEU 155 HD2 LEU 155 -16.386 11.540 -11.055 1046 3HD2 LEU 155 HD2 LEU 155 -17.805 11.853 -12.047 1047 H GLU 156 HN GLU 156 -15.496 6.967 -8.773 1048 HA GLU 156 HA GLU 156 -14.630 6.581 -11.553 1049 1HB GLU 156 HB2 GLU 156 -12.712 6.851 -9.989 1050 2HB GLU 156 HB1 GLU 156 -13.248 5.406 -9.145 1051 1HG GLU 156 HG2 GLU 156 -11.428 4.893 -10.659 1052 2HG GLU 156 HG1 GLU 156 -12.918 4.104 -11.182 1053 H HIS 157 HN HIS 157 -15.710 4.934 -8.571 1054 HA HIS 157 HA HIS 157 -17.174 3.099 -10.289 1055 1HB HIS 157 HB2 HIS 157 -14.849 2.153 -9.715 1056 2HB HIS 157 HB1 HIS 157 -15.449 1.977 -8.075 1057 HD1 HIS 157 HD1 HIS 157 -15.612 0.473 -11.475 1058 HD2 HIS 157 HD2 HIS 157 -17.315 -0.089 -7.727 1059 HE1 HIS 157 HE1 HIS 157 -16.696 -1.795 -11.538 1060 H HIS 158 HN HIS 158 -16.500 2.636 -6.824 1061 HA HIS 158 HA HIS 158 -19.321 3.036 -6.313 1062 1HB HIS 158 HB2 HIS 158 -18.764 2.339 -3.925 1063 2HB HIS 158 HB1 HIS 158 -18.369 1.129 -5.130 1064 HD1 HIS 158 HD1 HIS 158 -15.871 0.382 -5.248 1065 HD2 HIS 158 HD2 HIS 158 -16.544 3.582 -2.677 1066 HE1 HIS 158 HE1 HIS 158 -13.720 0.766 -4.039 1067 H HIS 159 HN HIS 159 -16.281 4.382 -5.393 1068 HA HIS 159 HA HIS 159 -17.451 7.005 -5.359 1069 1HB HIS 159 HB2 HIS 159 -17.236 6.433 -2.952 1070 2HB HIS 159 HB1 HIS 159 -15.585 5.897 -3.196 1071 HD1 HIS 159 HD1 HIS 159 -17.653 8.991 -2.700 1072 HD2 HIS 159 HD2 HIS 159 -13.686 7.971 -3.384 1073 HE1 HIS 159 HE1 HIS 159 -16.307 11.052 -2.216 1074 H HIS 160 HN HIS 160 -14.239 5.745 -4.563 1075 HA HIS 160 HA HIS 160 -13.379 6.644 -7.197 1076 1HB HIS 160 HB2 HIS 160 -12.347 7.848 -5.197 1077 2HB HIS 160 HB1 HIS 160 -11.660 6.308 -4.696 1078 HD1 HIS 160 HD1 HIS 160 -9.211 6.178 -5.362 1079 HD2 HIS 160 HD2 HIS 160 -11.488 8.365 -8.073 1080 HE1 HIS 160 HE1 HIS 160 -7.650 6.851 -7.211 1081 H HIS 161 HN HIS 161 -11.219 5.185 -7.681 1082 HA HIS 161 HA HIS 161 -11.222 2.527 -6.814 1083 1HB HIS 161 HB2 HIS 161 -13.319 2.376 -8.065 1084 2HB HIS 161 HB1 HIS 161 -12.583 3.134 -9.458 1085 HD1 HIS 161 HD1 HIS 161 -13.118 -0.185 -7.842 1086 HD2 HIS 161 HD2 HIS 161 -10.870 1.437 -10.936 1087 HE1 HIS 161 HE1 HIS 161 -12.383 -2.116 -9.255 1088 H HIS 162 HN HIS 162 -9.357 1.635 -7.490 1089 HA HIS 162 HA HIS 162 -8.017 2.538 -9.818 1090 1HB HIS 162 HB2 HIS 162 -7.278 4.208 -8.023 1091 2HB HIS 162 HB1 HIS 162 -6.607 2.854 -7.129 1092 HD1 HIS 162 HD1 HIS 162 -6.124 4.618 -10.483 1093 HD2 HIS 162 HD2 HIS 162 -4.045 2.262 -7.764 1094 HE1 HIS 162 HE1 HIS 162 -3.744 4.533 -11.305 No H/Q in entry = 1094 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 19.353 -17.795 -2.622 2 H2 MET 1 HT3 MET 1 18.755 -17.431 -4.152 3 H3 MET 1 HT2 MET 1 20.247 -16.790 -3.666 4 HA MET 1 HA MET 1 19.151 -15.536 -1.950 5 1HB MET 1 HB2 MET 1 17.777 -15.182 -4.643 6 2HB MET 1 HB1 MET 1 17.793 -13.993 -3.355 7 1HG MET 1 HG2 MET 1 19.375 -13.309 -4.994 8 2HG MET 1 HG1 MET 1 20.279 -13.879 -3.594 9 1HE MET 1 HE2 MET 1 21.661 -13.442 -6.396 10 2HE MET 1 HE1 MET 1 22.516 -14.082 -4.993 11 3HE MET 1 HE3 MET 1 22.623 -14.911 -6.544 12 H GLU 2 HN GLU 2 17.916 -16.233 -0.437 13 HA GLU 2 HA GLU 2 15.524 -17.766 -1.130 14 1HB GLU 2 HB2 GLU 2 17.086 -17.580 1.446 15 2HB GLU 2 HB1 GLU 2 15.581 -18.461 1.259 16 1HG GLU 2 HG2 GLU 2 17.421 -20.016 1.159 17 2HG GLU 2 HG1 GLU 2 16.658 -19.915 -0.422 18 H MET 3 HN MET 3 13.620 -17.541 0.139 19 HA MET 3 HA MET 3 12.697 -14.936 -0.137 20 1HB MET 3 HB2 MET 3 11.413 -17.254 1.291 21 2HB MET 3 HB1 MET 3 10.619 -15.702 1.071 22 1HG MET 3 HG2 MET 3 10.872 -15.978 -1.378 23 2HG MET 3 HG1 MET 3 11.528 -17.584 -1.097 24 1HE MET 3 HE3 MET 3 10.100 -19.529 0.136 25 2HE MET 3 HE2 MET 3 9.610 -18.450 1.442 26 3HE MET 3 HE1 MET 3 8.394 -19.370 0.560 27 H GLY 4 HN GLY 4 14.218 -16.394 2.555 28 1HA GLY 4 HA1 GLY 4 14.739 -15.536 4.657 29 2HA GLY 4 HA2 GLY 4 13.233 -14.630 4.576 30 H GLN 5 HN GLN 5 16.100 -14.585 2.549 31 HA GLN 5 HA GLN 5 17.194 -12.119 3.472 32 1HB GLN 5 HB2 GLN 5 17.538 -13.494 0.803 33 2HB GLN 5 HB1 GLN 5 18.549 -12.222 1.478 34 1HG GLN 5 HG2 GLN 5 19.463 -13.639 3.092 35 2HG GLN 5 HG1 GLN 5 18.210 -14.859 2.851 36 1HE2 GLN 5 1HE2 GLN 5 21.134 -15.006 2.679 37 2HE2 GLN 5 2HE2 GLN 5 21.473 -15.640 1.114 38 H LEU 6 HN LEU 6 15.066 -13.092 0.908 39 HA LEU 6 HA LEU 6 14.861 -10.630 -0.422 40 1HB LEU 6 HB2 LEU 6 14.289 -12.817 -1.414 41 2HB LEU 6 HB1 LEU 6 12.977 -12.982 -0.280 42 HG LEU 6 HG LEU 6 12.417 -12.421 -2.697 43 1HD1 LEU 6 HD1 LEU 6 11.320 -10.700 -0.507 44 2HD1 LEU 6 HD1 LEU 6 10.584 -10.952 -2.088 45 3HD1 LEU 6 HD1 LEU 6 10.768 -12.310 -0.968 46 1HD2 LEU 6 HD2 LEU 6 13.333 -9.694 -1.804 47 2HD2 LEU 6 HD2 LEU 6 14.053 -10.682 -3.076 48 3HD2 LEU 6 HD2 LEU 6 12.420 -10.035 -3.269 49 H LYS 7 HN LYS 7 12.854 -12.133 2.083 50 HA LYS 7 HA LYS 7 11.010 -10.057 2.423 51 1HB LYS 7 HB2 LYS 7 11.696 -12.501 3.759 52 2HB LYS 7 HB1 LYS 7 11.404 -11.239 4.947 53 1HG LYS 7 HG2 LYS 7 9.523 -11.835 2.697 54 2HG LYS 7 HG1 LYS 7 9.415 -12.629 4.266 55 1HD LYS 7 HD2 LYS 7 9.397 -9.632 3.939 56 2HD LYS 7 HD1 LYS 7 7.905 -10.573 3.939 57 1HE LYS 7 HE2 LYS 7 8.667 -11.472 6.192 58 2HE LYS 7 HE1 LYS 7 9.927 -10.242 6.151 59 1HZ LYS 7 HZ3 LYS 7 8.176 -8.525 6.042 60 2HZ LYS 7 HZ2 LYS 7 7.006 -9.732 6.072 61 3HZ LYS 7 HZ1 LYS 7 8.011 -9.526 7.394 62 H ASN 8 HN ASN 8 14.156 -10.599 3.802 63 HA ASN 8 HA ASN 8 14.218 -8.580 5.723 64 1HB ASN 8 HB2 ASN 8 15.952 -10.388 5.357 65 2HB ASN 8 HB1 ASN 8 16.512 -9.496 3.956 66 1HD2 ASN 8 HD2 ASN 8 18.010 -10.275 6.221 67 2HD2 ASN 8 HD2 ASN 8 18.610 -8.851 6.979 68 H LYS 9 HN LYS 9 15.033 -8.533 2.268 69 HA LYS 9 HA LYS 9 15.686 -5.777 2.127 70 1HB LYS 9 HB2 LYS 9 14.743 -7.646 -0.052 71 2HB LYS 9 HB1 LYS 9 15.347 -6.022 -0.325 72 1HG LYS 9 HG2 LYS 9 16.899 -8.338 0.813 73 2HG LYS 9 HG1 LYS 9 17.041 -7.666 -0.815 74 1HD LYS 9 HD2 LYS 9 17.726 -5.499 0.214 75 2HD LYS 9 HD1 LYS 9 17.729 -6.302 1.784 76 1HE LYS 9 HE2 LYS 9 19.433 -7.033 -0.598 77 2HE LYS 9 HE1 LYS 9 19.977 -6.194 0.848 78 1HZ LYS 9 HZ1 LYS 9 19.407 -8.213 2.133 79 2HZ LYS 9 HZ3 LYS 9 19.009 -9.001 0.686 80 3HZ LYS 9 HZ2 LYS 9 20.580 -8.468 0.979 81 H ILE 10 HN ILE 10 12.687 -7.563 1.580 82 HA ILE 10 HA ILE 10 11.089 -5.459 0.689 83 HB ILE 10 HB ILE 10 10.353 -7.938 2.266 84 1HG1 ILE 10 2HG1 ILE 10 9.976 -7.176 -0.630 85 2HG1 ILE 10 1HG1 ILE 10 11.142 -8.335 -0.004 86 1HG2 ILE 10 1HG2 ILE 10 8.664 -6.265 2.785 87 2HG2 ILE 10 3HG2 ILE 10 8.426 -5.948 1.064 88 3HG2 ILE 10 2HG2 ILE 10 7.990 -7.518 1.741 89 1HD1 ILE 10 HD1 ILE 10 9.296 -9.767 0.717 90 2HD1 ILE 10 HD1 ILE 10 8.140 -8.604 0.049 91 3HD1 ILE 10 HD1 ILE 10 9.265 -9.449 -1.019 92 H GLU 11 HN GLU 11 11.600 -6.621 3.997 93 HA GLU 11 HA GLU 11 10.002 -4.778 5.317 94 1HB GLU 11 HB2 GLU 11 12.549 -6.095 6.245 95 2HB GLU 11 HB1 GLU 11 11.485 -5.160 7.287 96 1HG GLU 11 HG2 GLU 11 10.787 -7.688 5.825 97 2HG GLU 11 HG1 GLU 11 11.065 -7.499 7.557 98 H ASN 12 HN ASN 12 13.493 -4.534 4.610 99 HA ASN 12 HA ASN 12 13.908 -2.090 5.808 100 1HB ASN 12 HB2 ASN 12 15.271 -3.731 3.764 101 2HB ASN 12 HB1 ASN 12 15.779 -2.072 3.976 102 1HD2 ASN 12 HD2 ASN 12 15.621 -5.252 5.408 103 2HD2 ASN 12 HD2 ASN 12 16.707 -4.903 6.698 104 H LYS 13 HN LYS 13 13.025 -2.881 2.484 105 HA LYS 13 HA LYS 13 13.258 -0.199 1.553 106 1HB LYS 13 HB2 LYS 13 13.388 -2.415 0.227 107 2HB LYS 13 HB1 LYS 13 11.642 -2.398 0.273 108 1HG LYS 13 HG2 LYS 13 12.499 -1.529 -1.842 109 2HG LYS 13 HG1 LYS 13 11.589 -0.306 -0.957 110 1HD LYS 13 HD2 LYS 13 13.605 0.654 -1.907 111 2HD LYS 13 HD1 LYS 13 13.697 0.682 -0.157 112 1HE LYS 13 HE2 LYS 13 15.812 0.057 -0.873 113 2HE LYS 13 HE1 LYS 13 15.075 -1.457 -0.374 114 1HZ LYS 13 HZ2 LYS 13 14.598 -1.921 -2.753 115 2HZ LYS 13 HZ1 LYS 13 15.354 -0.464 -3.166 116 3HZ LYS 13 HZ3 LYS 13 16.235 -1.708 -2.462 117 H LYS 14 HN LYS 14 10.594 -2.200 2.670 118 HA LYS 14 HA LYS 14 8.418 -0.490 2.223 119 1HB LYS 14 HB2 LYS 14 8.241 -2.841 2.854 120 2HB LYS 14 HB1 LYS 14 8.972 -2.488 4.406 121 1HG LYS 14 HG2 LYS 14 6.997 -1.077 4.938 122 2HG LYS 14 HG1 LYS 14 6.256 -1.612 3.424 123 1HD LYS 14 HD2 LYS 14 5.393 -3.036 5.132 124 2HD LYS 14 HD1 LYS 14 6.590 -3.975 4.238 125 1HE LYS 14 HE2 LYS 14 8.262 -3.328 6.016 126 2HE LYS 14 HE1 LYS 14 6.894 -2.648 6.897 127 1HZ LYS 14 HZ2 LYS 14 5.906 -4.975 6.893 128 2HZ LYS 14 HZ1 LYS 14 7.311 -5.506 6.156 129 3HZ LYS 14 HZ3 LYS 14 7.382 -4.853 7.673 130 H LYS 15 HN LYS 15 10.531 -0.912 4.975 131 HA LYS 15 HA LYS 15 9.390 1.025 6.657 132 1HB LYS 15 HB2 LYS 15 12.141 -0.201 6.650 133 2HB LYS 15 HB1 LYS 15 11.575 0.904 7.901 134 1HG LYS 15 HG2 LYS 15 9.859 -0.601 8.576 135 2HG LYS 15 HG1 LYS 15 10.138 -1.635 7.181 136 1HD LYS 15 HD2 LYS 15 11.051 -2.638 9.161 137 2HD LYS 15 HD1 LYS 15 12.357 -2.205 8.062 138 1HE LYS 15 HE2 LYS 15 12.840 -0.208 9.379 139 2HE LYS 15 HE1 LYS 15 11.499 -0.576 10.460 140 1HZ LYS 15 HZ3 LYS 15 12.644 -2.620 11.099 141 2HZ LYS 15 HZ2 LYS 15 13.925 -2.251 10.072 142 3HZ LYS 15 HZ1 LYS 15 13.610 -1.268 11.399 143 H GLU 16 HN GLU 16 12.065 1.266 4.345 144 HA GLU 16 HA GLU 16 12.738 3.940 4.835 145 1HB GLU 16 HB2 GLU 16 12.789 2.360 2.259 146 2HB GLU 16 HB1 GLU 16 13.455 3.976 2.372 147 1HG GLU 16 HG2 GLU 16 15.015 3.046 4.113 148 2HG GLU 16 HG1 GLU 16 14.391 1.448 3.703 149 H LEU 17 HN LEU 17 10.167 2.502 2.940 150 HA LEU 17 HA LEU 17 9.188 4.889 1.735 151 1HB LEU 17 HB2 LEU 17 8.583 2.809 0.760 152 2HB LEU 17 HB1 LEU 17 7.897 2.232 2.275 153 HG LEU 17 HG LEU 17 6.332 4.339 1.940 154 1HD1 LEU 17 HD1 LEU 17 7.219 3.987 -0.789 155 2HD1 LEU 17 HD1 LEU 17 5.722 4.778 -0.222 156 3HD1 LEU 17 HD1 LEU 17 7.283 5.389 0.294 157 1HD2 LEU 17 HD2 LEU 17 5.692 2.069 2.113 158 2HD2 LEU 17 HD2 LEU 17 4.718 3.047 1.019 159 3HD2 LEU 17 HD2 LEU 17 5.903 1.847 0.362 160 H ILE 18 HN ILE 18 8.174 2.978 4.526 161 HA ILE 18 HA ILE 18 5.988 4.481 5.283 162 HB ILE 18 HB ILE 18 7.905 3.022 7.136 163 1HG1 ILE 18 2HG1 ILE 18 5.247 2.092 6.042 164 2HG1 ILE 18 1HG1 ILE 18 6.789 1.699 5.289 165 1HG2 ILE 18 3HG2 ILE 18 5.061 3.960 7.685 166 2HG2 ILE 18 2HG2 ILE 18 6.015 2.960 8.765 167 3HG2 ILE 18 1HG2 ILE 18 6.518 4.607 8.420 168 1HD1 ILE 18 HD1 ILE 18 5.965 0.968 8.081 169 2HD1 ILE 18 HD1 ILE 18 5.962 -0.112 6.676 170 3HD1 ILE 18 HD1 ILE 18 7.484 0.559 7.284 171 H GLN 19 HN GLN 19 9.380 4.935 6.099 172 HA GLN 19 HA GLN 19 9.137 7.125 7.814 173 1HB GLN 19 HB2 GLN 19 11.316 6.553 5.811 174 2HB GLN 19 HB1 GLN 19 11.426 7.723 7.115 175 1HG GLN 19 HG2 GLN 19 11.153 5.899 8.731 176 2HG GLN 19 HG1 GLN 19 11.130 4.750 7.391 177 1HE2 GLN 19 1HE2 GLN 19 13.032 6.859 9.306 178 2HE2 GLN 19 2HE2 GLN 19 14.577 6.344 8.746 179 H LEU 20 HN LEU 20 9.306 6.991 4.296 180 HA LEU 20 HA LEU 20 9.335 9.777 3.866 181 1HB LEU 20 HB2 LEU 20 8.483 7.539 2.033 182 2HB LEU 20 HB1 LEU 20 8.688 9.212 1.551 183 HG LEU 20 HG LEU 20 10.918 7.485 2.621 184 1HD1 LEU 20 HD1 LEU 20 10.249 8.263 -0.209 185 2HD1 LEU 20 HD1 LEU 20 11.698 7.410 0.312 186 3HD1 LEU 20 HD1 LEU 20 10.120 6.643 0.481 187 1HD2 LEU 20 HD2 LEU 20 10.898 10.202 1.307 188 2HD2 LEU 20 HD2 LEU 20 11.278 9.860 2.997 189 3HD2 LEU 20 HD2 LEU 20 12.338 9.273 1.719 190 H VAL 21 HN VAL 21 6.627 7.384 3.709 191 HA VAL 21 HA VAL 21 4.638 9.294 3.183 192 HB VAL 21 HB VAL 21 4.264 6.703 4.707 193 1HG1 VAL 21 2HG1 VAL 21 2.302 8.139 4.619 194 2HG1 VAL 21 1HG1 VAL 21 2.450 8.209 2.855 195 3HG1 VAL 21 3HG1 VAL 21 2.090 6.667 3.633 196 1HG2 VAL 21 2HG2 VAL 21 4.414 7.108 1.729 197 2HG2 VAL 21 1HG2 VAL 21 5.577 6.247 2.744 198 3HG2 VAL 21 3HG2 VAL 21 3.943 5.611 2.543 199 H ALA 22 HN ALA 22 6.047 8.142 6.183 200 HA ALA 22 HA ALA 22 4.194 9.297 7.956 201 1HB ALA 22 HB2 ALA 22 7.087 8.623 8.441 202 2HB ALA 22 HB1 ALA 22 5.861 8.899 9.690 203 3HB ALA 22 HB3 ALA 22 5.727 7.516 8.601 204 H ARG 23 HN ARG 23 7.389 10.394 6.838 205 HA ARG 23 HA ARG 23 7.326 12.803 8.280 206 1HB ARG 23 HB2 ARG 23 9.274 13.512 6.997 207 2HB ARG 23 HB1 ARG 23 9.459 11.851 7.527 208 1HG ARG 23 HG2 ARG 23 8.834 11.089 5.284 209 2HG ARG 23 HG1 ARG 23 8.706 12.767 4.758 210 1HD ARG 23 HD2 ARG 23 11.214 11.455 5.828 211 2HD ARG 23 HD1 ARG 23 10.870 11.755 4.126 212 HE ARG 23 HE ARG 23 10.607 14.181 5.316 213 1HH1 ARG 23 1HH1 ARG 23 13.285 11.838 5.141 214 2HH1 ARG 23 2HH1 ARG 23 14.480 13.027 5.309 215 1HH2 ARG 23 1HH2 ARG 23 12.269 15.778 5.502 216 2HH2 ARG 23 2HH2 ARG 23 13.916 15.299 5.512 217 H HIS 24 HN HIS 24 5.813 11.903 5.369 218 HA HIS 24 HA HIS 24 5.435 14.367 4.125 219 1HB HIS 24 HB2 HIS 24 4.684 12.341 3.043 220 2HB HIS 24 HB1 HIS 24 3.548 11.974 4.328 221 HD1 HIS 24 HD1 HIS 24 1.167 13.105 4.093 222 HD2 HIS 24 HD2 HIS 24 3.983 14.500 1.383 223 HE1 HIS 24 HE1 HIS 24 -0.064 14.598 2.530 224 H GLY 25 HN GLY 25 3.443 12.767 6.564 225 1HA GLY 25 HA1 GLY 25 1.777 15.067 6.930 226 2HA GLY 25 HA2 GLY 25 2.980 14.903 8.201 227 H LEU 26 HN LEU 26 3.017 12.060 8.397 228 HA LEU 26 HA LEU 26 0.260 11.547 9.244 229 1HB LEU 26 HB2 LEU 26 2.580 9.680 8.966 230 2HB LEU 26 HB1 LEU 26 1.054 9.191 9.620 231 HG LEU 26 HG LEU 26 1.736 10.066 6.932 232 1HD1 LEU 26 HD1 LEU 26 0.621 7.461 7.951 233 2HD1 LEU 26 HD1 LEU 26 0.808 7.848 6.242 234 3HD1 LEU 26 HD1 LEU 26 2.229 7.761 7.282 235 1HD2 LEU 26 HD2 LEU 26 -1.069 9.662 7.947 236 2HD2 LEU 26 HD2 LEU 26 -0.337 11.119 7.275 237 3HD2 LEU 26 HD2 LEU 26 -0.637 9.735 6.240 238 H ASP 27 HN ASP 27 -0.238 11.059 11.202 239 HA ASP 27 HA ASP 27 1.654 11.857 13.268 240 1HB ASP 27 HB2 ASP 27 -0.149 11.866 14.853 241 2HB ASP 27 HB1 ASP 27 -0.838 12.515 13.368 242 H HIS 28 HN HIS 28 1.362 10.327 15.348 243 HA HIS 28 HA HIS 28 2.855 8.063 14.688 244 1HB HIS 28 HB2 HIS 28 2.814 9.231 16.898 245 2HB HIS 28 HB1 HIS 28 1.250 8.511 17.203 246 HD1 HIS 28 HD1 HIS 28 4.845 7.416 16.620 247 HD2 HIS 28 HD2 HIS 28 1.316 6.044 18.330 248 HE1 HIS 28 HE1 HIS 28 5.441 5.295 17.864 249 H ASP 29 HN ASP 29 -0.591 8.527 15.166 250 HA ASP 29 HA ASP 29 -1.259 5.747 15.283 251 1HB ASP 29 HB2 ASP 29 -2.841 7.252 16.227 252 2HB ASP 29 HB1 ASP 29 -2.868 8.245 14.782 253 H LYS 30 HN LYS 30 -1.042 8.142 12.772 254 HA LYS 30 HA LYS 30 -2.157 6.459 10.756 255 1HB LYS 30 HB2 LYS 30 -0.459 8.872 10.613 256 2HB LYS 30 HB1 LYS 30 -1.085 8.172 9.141 257 1HG LYS 30 HG2 LYS 30 -2.475 9.480 11.468 258 2HG LYS 30 HG1 LYS 30 -2.474 10.014 9.789 259 1HD LYS 30 HD2 LYS 30 -4.022 8.331 9.180 260 2HD LYS 30 HD1 LYS 30 -3.763 7.424 10.668 261 1HE LYS 30 HE2 LYS 30 -5.006 10.157 10.479 262 2HE LYS 30 HE1 LYS 30 -5.872 8.643 10.733 263 1HZ LYS 30 HZ1 LYS 30 -3.820 9.767 12.600 264 2HZ LYS 30 HZ3 LYS 30 -5.488 9.836 12.819 265 3HZ LYS 30 HZ2 LYS 30 -4.702 8.347 12.848 266 H VAL 31 HN VAL 31 1.191 7.142 11.664 267 HA VAL 31 HA VAL 31 2.377 5.590 9.672 268 HB VAL 31 HB VAL 31 3.414 6.010 12.497 269 1HG1 VAL 31 3HG1 VAL 31 4.886 5.395 9.957 270 2HG1 VAL 31 2HG1 VAL 31 5.621 5.746 11.522 271 3HG1 VAL 31 1HG1 VAL 31 4.632 4.301 11.315 272 1HG2 VAL 31 3HG2 VAL 31 2.808 8.124 11.443 273 2HG2 VAL 31 2HG2 VAL 31 4.561 7.977 11.627 274 3HG2 VAL 31 1HG2 VAL 31 3.801 7.717 10.052 275 H LEU 32 HN LEU 32 1.098 4.744 12.858 276 HA LEU 32 HA LEU 32 1.913 2.042 12.841 277 1HB LEU 32 HB2 LEU 32 -0.497 3.251 14.185 278 2HB LEU 32 HB1 LEU 32 0.192 1.682 14.536 279 HG LEU 32 HG LEU 32 1.424 4.367 15.069 280 1HD1 LEU 32 HD1 LEU 32 -0.315 3.754 16.586 281 2HD1 LEU 32 HD1 LEU 32 0.464 2.202 16.902 282 3HD1 LEU 32 HD1 LEU 32 1.258 3.707 17.389 283 1HD2 LEU 32 HD2 LEU 32 2.597 1.616 15.504 284 2HD2 LEU 32 HD2 LEU 32 3.175 2.868 14.393 285 3HD2 LEU 32 HD2 LEU 32 3.259 3.127 16.136 286 H LEU 33 HN LEU 33 -1.196 3.522 11.995 287 HA LEU 33 HA LEU 33 -2.465 1.134 11.193 288 1HB LEU 33 HB2 LEU 33 -2.978 3.923 10.226 289 2HB LEU 33 HB1 LEU 33 -4.061 2.558 10.045 290 HG LEU 33 HG LEU 33 -3.249 3.837 12.640 291 1HD1 LEU 33 HD1 LEU 33 -5.827 3.819 11.133 292 2HD1 LEU 33 HD1 LEU 33 -5.567 4.508 12.735 293 3HD1 LEU 33 HD1 LEU 33 -4.729 5.206 11.348 294 1HD2 LEU 33 HD2 LEU 33 -5.147 1.558 12.090 295 2HD2 LEU 33 HD2 LEU 33 -3.608 1.466 12.954 296 3HD2 LEU 33 HD2 LEU 33 -4.945 2.376 13.638 297 H PHE 34 HN PHE 34 -0.641 3.490 9.353 298 HA PHE 34 HA PHE 34 -1.080 2.323 6.859 299 1HB PHE 34 HB2 PHE 34 -0.329 4.566 7.027 300 2HB PHE 34 HB1 PHE 34 1.151 4.101 7.868 301 HD1 PHE 34 HD1 PHE 34 -0.679 3.811 4.666 302 HD2 PHE 34 HD2 PHE 34 3.074 3.613 6.654 303 HE1 PHE 34 HE1 PHE 34 0.451 3.633 2.505 304 HE2 PHE 34 HE2 PHE 34 4.216 3.441 4.488 305 HZ PHE 34 HZ PHE 34 2.912 3.417 2.423 306 H SER 35 HN SER 35 1.593 1.875 9.198 307 HA SER 35 HA SER 35 2.925 0.039 7.526 308 1HB SER 35 HB2 SER 35 4.234 -0.571 9.600 309 2HB SER 35 HB1 SER 35 4.216 1.149 9.229 310 HG SER 35 HG SER 35 2.830 1.513 10.835 311 H ARG 36 HN ARG 36 0.438 -0.316 9.927 312 HA ARG 36 HA ARG 36 0.420 -3.130 10.166 313 1HB ARG 36 HB2 ARG 36 -1.796 -1.094 10.409 314 2HB ARG 36 HB1 ARG 36 -2.041 -2.795 10.733 315 1HG ARG 36 HG2 ARG 36 -0.615 -2.720 12.615 316 2HG ARG 36 HG1 ARG 36 -0.027 -1.111 12.159 317 1HD ARG 36 HD2 ARG 36 -2.132 -0.132 12.596 318 2HD ARG 36 HD1 ARG 36 -2.945 -1.641 12.924 319 HE ARG 36 HE ARG 36 -0.663 -1.160 14.574 320 1HH1 ARG 36 1HH1 ARG 36 -4.157 -0.466 14.304 321 2HH1 ARG 36 2HH1 ARG 36 -4.306 0.041 15.906 322 1HH2 ARG 36 1HH2 ARG 36 -0.887 -0.502 16.748 323 2HH2 ARG 36 2HH2 ARG 36 -2.390 0.013 17.363 324 H ASP 37 HN ASP 37 -1.536 -0.994 8.137 325 HA ASP 37 HA ASP 37 -2.877 -3.214 6.970 326 1HB ASP 37 HB2 ASP 37 -3.743 -0.827 7.383 327 2HB ASP 37 HB1 ASP 37 -2.983 -0.449 5.847 328 H LEU 38 HN LEU 38 -0.231 -1.175 5.974 329 HA LEU 38 HA LEU 38 -0.174 -2.218 3.333 330 1HB LEU 38 HB2 LEU 38 0.783 -0.004 3.944 331 2HB LEU 38 HB1 LEU 38 2.006 -0.808 4.894 332 HG LEU 38 HG LEU 38 1.849 -1.328 1.915 333 1HD1 LEU 38 HD1 LEU 38 1.960 1.136 2.344 334 2HD1 LEU 38 HD1 LEU 38 3.398 0.803 3.329 335 3HD1 LEU 38 HD1 LEU 38 3.427 0.465 1.607 336 1HD2 LEU 38 HD2 LEU 38 3.281 -2.677 3.382 337 2HD2 LEU 38 HD2 LEU 38 4.166 -1.696 2.171 338 3HD2 LEU 38 HD2 LEU 38 4.078 -1.146 3.842 339 H ASP 39 HN ASP 39 1.342 -3.167 6.389 340 HA ASP 39 HA ASP 39 3.081 -5.080 5.223 341 1HB ASP 39 HB2 ASP 39 3.225 -4.212 7.611 342 2HB ASP 39 HB1 ASP 39 1.837 -5.218 7.966 343 H LYS 40 HN LYS 40 -0.168 -5.206 6.499 344 HA LYS 40 HA LYS 40 -0.819 -7.908 6.118 345 1HB LYS 40 HB2 LYS 40 -2.460 -5.402 5.905 346 2HB LYS 40 HB1 LYS 40 -3.144 -7.003 5.700 347 1HG LYS 40 HG2 LYS 40 -2.772 -7.556 7.952 348 2HG LYS 40 HG1 LYS 40 -1.662 -6.199 8.180 349 1HD LYS 40 HD2 LYS 40 -3.918 -5.855 9.171 350 2HD LYS 40 HD1 LYS 40 -3.467 -4.608 8.033 351 1HE LYS 40 HE2 LYS 40 -4.801 -5.900 6.292 352 2HE LYS 40 HE1 LYS 40 -5.390 -6.902 7.620 353 1HZ LYS 40 HZ3 LYS 40 -6.205 -4.816 8.656 354 2HZ LYS 40 HZ2 LYS 40 -5.746 -3.991 7.254 355 3HZ LYS 40 HZ1 LYS 40 -6.952 -5.164 7.166 356 H LEU 41 HN LEU 41 -1.002 -5.151 3.952 357 HA LEU 41 HA LEU 41 -2.199 -6.452 1.800 358 1HB LEU 41 HB2 LEU 41 -2.247 -4.060 2.041 359 2HB LEU 41 HB1 LEU 41 -0.505 -3.976 1.933 360 HG LEU 41 HG LEU 41 -0.543 -4.443 -0.409 361 1HD1 LEU 41 HD1 LEU 41 -3.498 -4.921 -0.072 362 2HD1 LEU 41 HD1 LEU 41 -2.615 -4.917 -1.598 363 3HD1 LEU 41 HD1 LEU 41 -2.288 -6.164 -0.392 364 1HD2 LEU 41 HD2 LEU 41 -2.769 -2.587 0.344 365 2HD2 LEU 41 HD2 LEU 41 -1.058 -2.177 0.230 366 3HD2 LEU 41 HD2 LEU 41 -1.958 -2.637 -1.218 367 H ILE 42 HN ILE 42 1.195 -5.834 2.514 368 HA ILE 42 HA ILE 42 2.235 -7.075 0.201 369 HB ILE 42 HB ILE 42 3.466 -6.879 2.977 370 1HG1 ILE 42 2HG1 ILE 42 3.858 -5.210 0.503 371 2HG1 ILE 42 1HG1 ILE 42 3.000 -4.706 1.957 372 1HG2 ILE 42 1HG2 ILE 42 4.778 -7.576 0.348 373 2HG2 ILE 42 3HG2 ILE 42 5.624 -7.290 1.865 374 3HG2 ILE 42 2HG2 ILE 42 4.536 -8.670 1.711 375 1HD1 ILE 42 HD1 ILE 42 5.923 -5.363 1.744 376 2HD1 ILE 42 HD1 ILE 42 5.219 -3.747 1.856 377 3HD1 ILE 42 HD1 ILE 42 5.070 -4.866 3.212 378 H ASN 43 HN ASN 43 1.668 -8.408 3.420 379 HA ASN 43 HA ASN 43 2.370 -11.042 2.832 380 1HB ASN 43 HB2 ASN 43 0.522 -9.913 4.908 381 2HB ASN 43 HB1 ASN 43 0.710 -11.650 4.719 382 1HD2 ASN 43 HD2 ASN 43 2.240 -8.708 5.754 383 2HD2 ASN 43 HD2 ASN 43 3.572 -9.468 6.526 384 H LYS 44 HN LYS 44 -0.673 -9.403 2.338 385 HA LYS 44 HA LYS 44 -2.421 -11.491 1.757 386 1HB LYS 44 HB2 LYS 44 -3.035 -9.072 1.939 387 2HB LYS 44 HB1 LYS 44 -2.229 -8.769 0.414 388 1HG LYS 44 HG2 LYS 44 -3.897 -10.451 -0.590 389 2HG LYS 44 HG1 LYS 44 -4.791 -10.259 0.914 390 1HD LYS 44 HD2 LYS 44 -4.074 -8.033 -1.024 391 2HD LYS 44 HD1 LYS 44 -5.663 -8.770 -0.867 392 1HE LYS 44 HE2 LYS 44 -5.775 -7.912 1.462 393 2HE LYS 44 HE1 LYS 44 -4.211 -7.140 1.233 394 1HZ LYS 44 HZ3 LYS 44 -5.269 -5.733 -0.577 395 2HZ LYS 44 HZ2 LYS 44 -6.727 -6.485 -0.251 396 3HZ LYS 44 HZ1 LYS 44 -6.008 -5.555 0.916 397 H PHE 45 HN PHE 45 -0.165 -9.734 -0.269 398 HA PHE 45 HA PHE 45 -0.746 -11.413 -2.514 399 1HB PHE 45 HB2 PHE 45 0.846 -8.929 -2.147 400 2HB PHE 45 HB1 PHE 45 1.075 -9.898 -3.591 401 HD1 PHE 45 HD1 PHE 45 -1.317 -7.848 -1.681 402 HD2 PHE 45 HD2 PHE 45 -0.559 -9.965 -5.264 403 HE1 PHE 45 HE1 PHE 45 -3.286 -6.781 -2.713 404 HE2 PHE 45 HE2 PHE 45 -2.531 -8.909 -6.321 405 HZ PHE 45 HZ PHE 45 -3.893 -7.314 -5.034 406 H MET 46 HN MET 46 1.681 -11.226 -0.144 407 HA MET 46 HA MET 46 3.745 -12.560 -1.518 408 1HB MET 46 HB2 MET 46 3.098 -12.670 1.421 409 2HB MET 46 HB1 MET 46 4.577 -13.267 0.685 410 1HG MET 46 HG2 MET 46 5.066 -10.974 -0.087 411 2HG MET 46 HG1 MET 46 3.618 -10.426 0.749 412 1HE MET 46 HE1 MET 46 6.371 -13.035 1.675 413 2HE MET 46 HE3 MET 46 7.220 -11.644 1.002 414 3HE MET 46 HE2 MET 46 7.414 -12.067 2.709 415 H ASN 47 HN ASN 47 1.211 -13.829 0.571 416 HA ASN 47 HA ASN 47 0.549 -16.096 -0.758 417 1HB ASN 47 HB2 ASN 47 3.009 -16.509 -0.520 418 2HB ASN 47 HB1 ASN 47 2.716 -16.942 1.152 419 1HD2 ASN 47 HD2 ASN 47 3.349 -19.117 0.864 420 2HD2 ASN 47 HD2 ASN 47 2.370 -20.265 0.028 421 H VAL 48 HN VAL 48 -0.093 -14.241 1.676 422 HA VAL 48 HA VAL 48 -0.930 -16.443 3.352 423 HB VAL 48 HB VAL 48 -1.428 -15.039 5.137 424 1HG1 VAL 48 3HG1 VAL 48 1.163 -14.110 3.984 425 2HG1 VAL 48 2HG1 VAL 48 0.668 -13.874 5.662 426 3HG1 VAL 48 1HG1 VAL 48 0.877 -15.505 5.023 427 1HG2 VAL 48 3HG2 VAL 48 -2.535 -13.179 4.057 428 2HG2 VAL 48 2HG2 VAL 48 -1.297 -12.571 5.156 429 3HG2 VAL 48 1HG2 VAL 48 -1.000 -12.600 3.415 430 H LYS 49 HN LYS 49 -2.775 -17.242 3.270 431 HA LYS 49 HA LYS 49 -4.824 -15.647 1.993 432 1HB LYS 49 HB2 LYS 49 -4.519 -18.661 1.916 433 2HB LYS 49 HB1 LYS 49 -5.832 -17.746 1.187 434 1HG LYS 49 HG2 LYS 49 -4.217 -16.612 -0.278 435 2HG LYS 49 HG1 LYS 49 -2.924 -17.574 0.428 436 1HD LYS 49 HD2 LYS 49 -4.046 -19.618 -0.368 437 2HD LYS 49 HD1 LYS 49 -5.292 -18.612 -1.112 438 1HE LYS 49 HE2 LYS 49 -3.585 -17.536 -2.502 439 2HE LYS 49 HE1 LYS 49 -2.350 -18.559 -1.773 440 1HZ LYS 49 HZ2 LYS 49 -3.551 -20.495 -2.662 441 2HZ LYS 49 HZ1 LYS 49 -4.633 -19.465 -3.429 442 3HZ LYS 49 HZ3 LYS 49 -3.001 -19.458 -3.872 443 H ASP 50 HN ASP 50 -5.602 -14.792 3.714 444 HA ASP 50 HA ASP 50 -6.663 -16.522 5.834 445 1HB ASP 50 HB2 ASP 50 -5.527 -13.718 6.016 446 2HB ASP 50 HB1 ASP 50 -6.388 -14.520 7.319 447 H LYS 51 HN LYS 51 -8.764 -16.024 6.442 448 HA LYS 51 HA LYS 51 -10.050 -14.166 4.619 449 1HB LYS 51 HB2 LYS 51 -12.158 -15.277 5.134 450 2HB LYS 51 HB1 LYS 51 -10.956 -16.411 4.566 451 1HG LYS 51 HG2 LYS 51 -10.596 -17.176 6.854 452 2HG LYS 51 HG1 LYS 51 -11.803 -16.021 7.429 453 1HD LYS 51 HD2 LYS 51 -12.397 -18.175 5.394 454 2HD LYS 51 HD1 LYS 51 -12.588 -18.399 7.124 455 1HE LYS 51 HE2 LYS 51 -14.740 -17.885 6.072 456 2HE LYS 51 HE1 LYS 51 -14.280 -16.609 7.177 457 1HZ LYS 51 HZ1 LYS 51 -13.855 -16.432 4.231 458 2HZ LYS 51 HZ3 LYS 51 -15.259 -15.952 4.978 459 3HZ LYS 51 HZ2 LYS 51 -13.859 -15.148 5.356 460 H VAL 52 HN VAL 52 -8.511 -13.492 6.926 461 HA VAL 52 HA VAL 52 -10.293 -12.372 8.880 462 HB VAL 52 HB VAL 52 -8.338 -11.231 9.800 463 1HG1 VAL 52 1HG1 VAL 52 -7.707 -14.065 9.008 464 2HG1 VAL 52 3HG1 VAL 52 -6.916 -13.167 10.302 465 3HG1 VAL 52 2HG1 VAL 52 -8.632 -13.548 10.419 466 1HG2 VAL 52 3HG2 VAL 52 -6.846 -12.238 7.365 467 2HG2 VAL 52 2HG2 VAL 52 -7.220 -10.557 7.743 468 3HG2 VAL 52 1HG2 VAL 52 -6.101 -11.459 8.764 469 H HIS 53 HN HIS 53 -9.724 -11.612 5.771 470 HA HIS 53 HA HIS 53 -9.874 -8.754 6.037 471 1HB HIS 53 HB2 HIS 53 -10.097 -10.507 3.556 472 2HB HIS 53 HB1 HIS 53 -10.004 -8.751 3.548 473 HD1 HIS 53 HD1 HIS 53 -7.631 -7.707 3.726 474 HD2 HIS 53 HD2 HIS 53 -7.691 -11.838 4.179 475 HE1 HIS 53 HE1 HIS 53 -5.228 -8.454 3.684 476 H LYS 54 HN LYS 54 -11.727 -7.550 5.565 477 HA LYS 54 HA LYS 54 -14.147 -8.924 6.300 478 1HB LYS 54 HB2 LYS 54 -13.528 -6.790 7.336 479 2HB LYS 54 HB1 LYS 54 -13.605 -6.006 5.769 480 1HG LYS 54 HG2 LYS 54 -15.590 -5.479 7.030 481 2HG LYS 54 HG1 LYS 54 -16.023 -6.516 5.672 482 1HD LYS 54 HD2 LYS 54 -16.148 -8.445 7.137 483 2HD LYS 54 HD1 LYS 54 -15.584 -7.473 8.499 484 1HE LYS 54 HE2 LYS 54 -17.600 -6.075 8.312 485 2HE LYS 54 HE1 LYS 54 -18.152 -7.058 6.959 486 1HZ LYS 54 HZ3 LYS 54 -18.244 -8.977 8.487 487 2HZ LYS 54 HZ2 LYS 54 -17.775 -7.975 9.766 488 3HZ LYS 54 HZ1 LYS 54 -19.227 -7.708 8.988 489 H LEU 55 HN LEU 55 -15.643 -9.608 4.947 490 HA LEU 55 HA LEU 55 -15.816 -8.440 2.265 491 1HB LEU 55 HB2 LEU 55 -16.840 -11.077 3.353 492 2HB LEU 55 HB1 LEU 55 -17.174 -10.473 1.747 493 HG LEU 55 HG LEU 55 -14.431 -11.204 2.782 494 1HD1 LEU 55 HD1 LEU 55 -15.870 -13.158 2.512 495 2HD1 LEU 55 HD1 LEU 55 -16.266 -12.648 0.871 496 3HD1 LEU 55 HD1 LEU 55 -14.616 -13.118 1.274 497 1HD2 LEU 55 HD2 LEU 55 -15.389 -10.403 0.030 498 2HD2 LEU 55 HD2 LEU 55 -14.338 -9.458 1.088 499 3HD2 LEU 55 HD2 LEU 55 -13.773 -10.989 0.423 500 H GLU 56 HN GLU 56 -18.045 -8.046 1.536 501 HA GLU 56 HA GLU 56 -19.565 -6.897 3.717 502 1HB GLU 56 HB2 GLU 56 -19.108 -6.119 1.132 503 2HB GLU 56 HB1 GLU 56 -20.681 -6.895 0.997 504 1HG GLU 56 HG2 GLU 56 -19.984 -4.581 2.808 505 2HG GLU 56 HG1 GLU 56 -20.883 -4.483 1.303 506 H HIS 57 HN HIS 57 -21.868 -7.302 3.870 507 HA HIS 57 HA HIS 57 -22.567 -10.050 4.094 508 1HB HIS 57 HB2 HIS 57 -24.346 -7.601 4.166 509 2HB HIS 57 HB1 HIS 57 -24.774 -9.199 4.751 510 HD1 HIS 57 HD1 HIS 57 -22.687 -6.189 5.610 511 HD2 HIS 57 HD2 HIS 57 -23.829 -9.820 7.275 512 HE1 HIS 57 HE1 HIS 57 -22.074 -6.067 8.062 513 H HIS 58 HN HIS 58 -23.519 -7.434 1.923 514 HA HIS 58 HA HIS 58 -24.393 -9.410 -0.055 515 1HB HIS 58 HB2 HIS 58 -26.409 -8.761 1.253 516 2HB HIS 58 HB1 HIS 58 -26.101 -7.078 0.864 517 HD1 HIS 58 HD1 HIS 58 -27.800 -10.070 -0.372 518 HD2 HIS 58 HD2 HIS 58 -26.488 -6.448 -1.903 519 HE1 HIS 58 HE1 HIS 58 -29.034 -9.740 -2.557 520 H HIS 59 HN HIS 59 -24.116 -5.953 0.633 521 HA HIS 59 HA HIS 59 -23.188 -4.216 -0.367 522 1HB HIS 59 HB2 HIS 59 -21.170 -5.704 -0.490 523 2HB HIS 59 HB1 HIS 59 -21.648 -6.156 -2.115 524 HD1 HIS 59 HD1 HIS 59 -20.532 -3.047 -0.161 525 HD2 HIS 59 HD2 HIS 59 -20.737 -4.507 -4.053 526 HE1 HIS 59 HE1 HIS 59 -19.330 -1.388 -1.591 527 H HIS 60 HN HIS 60 -23.456 -2.781 -2.016 528 HA HIS 60 HA HIS 60 -25.658 -3.339 -3.751 529 1HB HIS 60 HB2 HIS 60 -23.951 -0.884 -3.378 530 2HB HIS 60 HB1 HIS 60 -25.256 -0.973 -4.551 531 HD1 HIS 60 HD1 HIS 60 -27.681 -1.077 -3.591 532 HD2 HIS 60 HD2 HIS 60 -24.689 -0.526 -0.769 533 HE1 HIS 60 HE1 HIS 60 -28.843 -0.317 -1.485 534 H HIS 61 HN HIS 61 -25.392 -4.410 -5.546 535 HA HIS 61 HA HIS 61 -22.903 -4.196 -7.006 536 1HB HIS 61 HB2 HIS 61 -24.142 -6.401 -6.710 537 2HB HIS 61 HB1 HIS 61 -25.395 -5.752 -7.755 538 HD1 HIS 61 HD1 HIS 61 -21.656 -6.502 -7.932 539 HD2 HIS 61 HD2 HIS 61 -25.004 -6.220 -10.377 540 HE1 HIS 61 HE1 HIS 61 -20.916 -7.254 -10.205 541 H HIS 62 HN HIS 62 -22.728 -3.095 -8.930 542 HA HIS 62 HA HIS 62 -24.830 -1.170 -9.352 543 1HB HIS 62 HB2 HIS 62 -22.360 -0.558 -9.184 544 2HB HIS 62 HB1 HIS 62 -22.152 -1.336 -10.748 545 HD1 HIS 62 HD1 HIS 62 -22.721 0.067 -12.794 546 HD2 HIS 62 HD2 HIS 62 -24.015 1.752 -9.233 547 HE1 HIS 62 HE1 HIS 62 -23.511 2.372 -13.375 548 H1 MET 101 HT1 MET 101 13.261 20.022 -0.196 549 H2 MET 101 HT3 MET 101 13.406 21.291 -1.296 550 H3 MET 101 HT2 MET 101 14.188 21.360 0.199 551 HA MET 101 HA MET 101 12.066 21.383 1.351 552 1HB MET 101 HB2 MET 101 12.294 23.519 -0.788 553 2HB MET 101 HB1 MET 101 11.265 23.628 0.622 554 1HG MET 101 HG2 MET 101 13.210 24.934 1.019 555 2HG MET 101 HG1 MET 101 13.296 23.514 2.052 556 1HE MET 101 HE3 MET 101 14.749 25.407 -1.037 557 2HE MET 101 HE2 MET 101 15.856 24.222 -1.730 558 3HE MET 101 HE1 MET 101 14.114 23.954 -1.809 559 H GLU 102 HN GLU 102 11.855 20.920 -2.064 560 HA GLU 102 HA GLU 102 9.174 21.267 -2.557 561 1HB GLU 102 HB2 GLU 102 10.823 19.120 -3.867 562 2HB GLU 102 HB1 GLU 102 9.510 20.044 -4.557 563 1HG GLU 102 HG2 GLU 102 11.381 20.914 -5.591 564 2HG GLU 102 HG1 GLU 102 11.093 22.067 -4.292 565 H MET 103 HN MET 103 7.446 20.231 -1.789 566 HA MET 103 HA MET 103 7.713 17.693 -0.480 567 1HB MET 103 HB2 MET 103 5.324 17.775 -0.086 568 2HB MET 103 HB1 MET 103 6.075 19.289 0.376 569 1HG MET 103 HG2 MET 103 4.615 18.837 -2.212 570 2HG MET 103 HG1 MET 103 3.918 19.440 -0.708 571 1HE MET 103 HE3 MET 103 4.289 21.796 0.285 572 2HE MET 103 HE2 MET 103 5.997 21.422 0.512 573 3HE MET 103 HE1 MET 103 5.526 22.932 -0.256 574 H GLY 104 HN GLY 104 7.035 18.829 -3.603 575 1HA GLY 104 HA1 GLY 104 6.658 17.765 -5.594 576 2HA GLY 104 HA2 GLY 104 5.695 16.599 -4.685 577 H GLN 105 HN GLN 105 9.106 17.372 -4.256 578 HA GLN 105 HA GLN 105 10.041 15.059 -5.611 579 1HB GLN 105 HB2 GLN 105 11.415 16.887 -3.646 580 2HB GLN 105 HB1 GLN 105 12.215 15.521 -4.401 581 1HG GLN 105 HG2 GLN 105 11.024 17.887 -5.827 582 2HG GLN 105 HG1 GLN 105 12.739 17.605 -5.557 583 1HE2 GLN 105 1HE2 GLN 105 13.754 15.893 -6.693 584 2HE2 GLN 105 2HE2 GLN 105 13.071 15.290 -8.156 585 H LEU 106 HN LEU 106 9.238 15.809 -2.315 586 HA LEU 106 HA LEU 106 10.145 13.448 -1.103 587 1HB LEU 106 HB2 LEU 106 9.515 15.436 0.181 588 2HB LEU 106 HB1 LEU 106 7.876 15.335 -0.397 589 HG LEU 106 HG LEU 106 8.280 14.707 2.025 590 1HD1 LEU 106 HD1 LEU 106 6.914 12.673 0.289 591 2HD1 LEU 106 HD1 LEU 106 6.731 12.820 2.034 592 3HD1 LEU 106 HD1 LEU 106 6.205 14.129 0.971 593 1HD2 LEU 106 HD2 LEU 106 9.475 12.229 0.784 594 2HD2 LEU 106 HD2 LEU 106 10.330 13.429 1.752 595 3HD2 LEU 106 HD2 LEU 106 9.071 12.439 2.490 596 H LYS 107 HN LYS 107 6.995 14.323 -2.472 597 HA LYS 107 HA LYS 107 5.732 11.877 -2.067 598 1HB LYS 107 HB2 LYS 107 4.892 14.280 -2.741 599 2HB LYS 107 HB1 LYS 107 5.099 13.681 -4.375 600 1HG LYS 107 HG2 LYS 107 3.570 12.191 -2.351 601 2HG LYS 107 HG1 LYS 107 2.792 13.517 -3.207 602 1HD LYS 107 HD2 LYS 107 4.009 11.055 -4.518 603 2HD LYS 107 HD1 LYS 107 2.285 11.276 -4.219 604 1HE LYS 107 HE2 LYS 107 2.435 13.384 -5.633 605 2HE LYS 107 HE1 LYS 107 4.084 12.861 -6.009 606 1HZ LYS 107 HZ2 LYS 107 1.717 11.170 -6.602 607 2HZ LYS 107 HZ1 LYS 107 2.414 12.241 -7.698 608 3HZ LYS 107 HZ3 LYS 107 3.329 10.989 -7.101 609 H ASN 108 HN ASN 108 7.735 13.105 -4.668 610 HA ASN 108 HA ASN 108 7.381 11.008 -6.516 611 1HB ASN 108 HB2 ASN 108 8.401 13.251 -7.018 612 2HB ASN 108 HB1 ASN 108 9.831 12.750 -6.132 613 1HD2 ASN 108 HD2 ASN 108 11.179 12.901 -7.879 614 2HD2 ASN 108 HD2 ASN 108 11.116 11.823 -9.220 615 H LYS 109 HN LYS 109 9.686 11.504 -3.856 616 HA LYS 109 HA LYS 109 11.217 9.150 -4.257 617 1HB LYS 109 HB2 LYS 109 10.703 10.703 -1.713 618 2HB LYS 109 HB1 LYS 109 11.878 9.412 -1.862 619 1HG LYS 109 HG2 LYS 109 13.114 10.734 -3.494 620 2HG LYS 109 HG1 LYS 109 11.927 12.033 -3.331 621 1HD LYS 109 HD2 LYS 109 12.458 12.208 -0.944 622 2HD LYS 109 HD1 LYS 109 13.658 10.926 -1.122 623 1HE LYS 109 HE2 LYS 109 14.892 12.324 -2.715 624 2HE LYS 109 HE1 LYS 109 13.706 13.608 -2.495 625 1HZ LYS 109 HZ1 LYS 109 15.435 12.481 -0.364 626 2HZ LYS 109 HZ3 LYS 109 15.685 13.952 -1.161 627 3HZ LYS 109 HZ2 LYS 109 14.334 13.753 -0.177 628 H ILE 110 HN ILE 110 8.312 9.859 -2.379 629 HA ILE 110 HA ILE 110 7.999 7.401 -1.092 630 HB ILE 110 HB ILE 110 5.890 9.324 -2.133 631 1HG1 ILE 110 2HG1 ILE 110 6.962 8.819 0.636 632 2HG1 ILE 110 1HG1 ILE 110 7.372 10.201 -0.381 633 1HG2 ILE 110 3HG2 ILE 110 4.879 7.104 -1.937 634 2HG2 ILE 110 2HG2 ILE 110 5.475 6.974 -0.281 635 3HG2 ILE 110 1HG2 ILE 110 4.265 8.187 -0.685 636 1HD1 ILE 110 HD1 ILE 110 5.034 10.926 -0.261 637 2HD1 ILE 110 HD1 ILE 110 4.674 9.548 0.778 638 3HD1 ILE 110 HD1 ILE 110 5.782 10.804 1.330 639 H GLU 111 HN GLU 111 6.816 8.460 -4.237 640 HA GLU 111 HA GLU 111 5.718 5.986 -5.006 641 1HB GLU 111 HB2 GLU 111 6.893 8.134 -6.773 642 2HB GLU 111 HB1 GLU 111 5.825 6.835 -7.289 643 1HG GLU 111 HG2 GLU 111 4.076 7.766 -5.763 644 2HG GLU 111 HG1 GLU 111 5.146 9.132 -5.464 645 H ASN 112 HN ASN 112 8.905 7.337 -5.428 646 HA ASN 112 HA ASN 112 10.123 5.420 -7.009 647 1HB ASN 112 HB2 ASN 112 11.136 7.586 -6.412 648 2HB ASN 112 HB1 ASN 112 11.291 7.052 -4.751 649 1HD2 ASN 112 HD2 ASN 112 12.599 6.975 -7.869 650 2HD2 ASN 112 HD2 ASN 112 14.053 6.117 -7.511 651 H LYS 113 HN LYS 113 10.122 5.667 -3.511 652 HA LYS 113 HA LYS 113 11.590 3.336 -2.970 653 1HB LYS 113 HB2 LYS 113 11.317 5.321 -1.485 654 2HB LYS 113 HB1 LYS 113 9.662 4.824 -1.203 655 1HG LYS 113 HG2 LYS 113 11.131 4.188 0.627 656 2HG LYS 113 HG1 LYS 113 10.407 2.786 -0.162 657 1HD LYS 113 HD2 LYS 113 12.747 2.415 0.322 658 2HD LYS 113 HD1 LYS 113 12.447 2.408 -1.404 659 1HE LYS 113 HE2 LYS 113 13.284 4.676 -1.568 660 2HE LYS 113 HE1 LYS 113 13.586 4.715 0.181 661 1HZ LYS 113 HZ3 LYS 113 15.065 2.774 -0.182 662 2HZ LYS 113 HZ2 LYS 113 14.834 2.993 -1.859 663 3HZ LYS 113 HZ1 LYS 113 15.608 4.187 -0.966 664 H LYS 114 HN LYS 114 8.127 4.001 -2.870 665 HA LYS 114 HA LYS 114 7.177 1.531 -2.110 666 1HB LYS 114 HB2 LYS 114 5.796 3.407 -2.134 667 2HB LYS 114 HB1 LYS 114 6.079 3.735 -3.849 668 1HG LYS 114 HG2 LYS 114 4.959 1.370 -4.144 669 2HG LYS 114 HG1 LYS 114 4.319 1.709 -2.534 670 1HD LYS 114 HD2 LYS 114 2.658 2.512 -4.085 671 2HD LYS 114 HD1 LYS 114 3.517 3.925 -3.460 672 1HE LYS 114 HE2 LYS 114 4.936 3.947 -5.470 673 2HE LYS 114 HE1 LYS 114 4.029 2.551 -6.058 674 1HZ LYS 114 HZ3 LYS 114 2.845 5.210 -5.474 675 2HZ LYS 114 HZ2 LYS 114 3.254 4.649 -7.009 676 3HZ LYS 114 HZ1 LYS 114 2.035 3.902 -6.149 677 H LYS 115 HN LYS 115 7.964 2.814 -5.340 678 HA LYS 115 HA LYS 115 7.208 0.516 -6.776 679 1HB LYS 115 HB2 LYS 115 9.047 2.797 -7.472 680 2HB LYS 115 HB1 LYS 115 8.713 1.484 -8.598 681 1HG LYS 115 HG2 LYS 115 6.404 2.031 -8.693 682 2HG LYS 115 HG1 LYS 115 6.543 3.128 -7.328 683 1HD LYS 115 HD2 LYS 115 6.342 4.476 -9.268 684 2HD LYS 115 HD1 LYS 115 8.013 4.571 -8.764 685 1HE LYS 115 HE2 LYS 115 7.081 2.692 -10.935 686 2HE LYS 115 HE1 LYS 115 7.573 4.345 -11.267 687 1HZ LYS 115 HZ1 LYS 115 9.766 3.753 -10.278 688 2HZ LYS 115 HZ3 LYS 115 9.275 2.122 -10.240 689 3HZ LYS 115 HZ2 LYS 115 9.367 2.976 -11.695 690 H GLU 116 HN GLU 116 10.262 1.418 -5.282 691 HA GLU 116 HA GLU 116 11.786 -0.763 -6.208 692 1HB GLU 116 HB2 GLU 116 11.899 0.698 -3.568 693 2HB GLU 116 HB1 GLU 116 13.064 -0.514 -4.031 694 1HG GLU 116 HG2 GLU 116 13.506 1.034 -6.043 695 2HG GLU 116 HG1 GLU 116 12.659 2.246 -5.069 696 H LEU 117 HN LEU 117 9.598 -0.387 -3.523 697 HA LEU 117 HA LEU 117 10.012 -2.906 -2.343 698 1HB LEU 117 HB2 LEU 117 9.162 -1.187 -0.974 699 2HB LEU 117 HB1 LEU 117 7.892 -0.794 -2.101 700 HG LEU 117 HG LEU 117 7.097 -1.860 0.028 701 1HD1 LEU 117 HD1 LEU 117 5.725 -1.731 -1.779 702 2HD1 LEU 117 HD1 LEU 117 6.321 -3.264 -2.402 703 3HD1 LEU 117 HD1 LEU 117 5.458 -3.219 -0.850 704 1HD2 LEU 117 HD2 LEU 117 8.419 -4.317 -1.072 705 2HD2 LEU 117 HD2 LEU 117 8.920 -3.432 0.370 706 3HD2 LEU 117 HD2 LEU 117 7.350 -4.239 0.334 707 H ILE 118 HN ILE 118 7.558 -1.697 -4.556 708 HA ILE 118 HA ILE 118 5.945 -3.908 -4.673 709 HB ILE 118 HB ILE 118 6.621 -1.980 -6.920 710 1HG1 ILE 118 2HG1 ILE 118 4.201 -2.048 -5.110 711 2HG1 ILE 118 1HG1 ILE 118 5.631 -1.086 -4.779 712 1HG2 ILE 118 2HG2 ILE 118 5.643 -4.039 -7.858 713 2HG2 ILE 118 1HG2 ILE 118 4.282 -3.911 -6.758 714 3HG2 ILE 118 3HG2 ILE 118 4.528 -2.687 -8.003 715 1HD1 ILE 118 HD1 ILE 118 5.287 0.132 -6.848 716 2HD1 ILE 118 HD1 ILE 118 3.842 -0.816 -7.180 717 3HD1 ILE 118 HD1 ILE 118 3.893 0.255 -5.776 718 H GLN 119 HN GLN 119 8.844 -3.196 -6.476 719 HA GLN 119 HA GLN 119 8.913 -5.453 -8.159 720 1HB GLN 119 HB2 GLN 119 11.189 -3.798 -7.073 721 2HB GLN 119 HB1 GLN 119 11.316 -4.925 -8.410 722 1HG GLN 119 HG2 GLN 119 9.759 -3.581 -9.708 723 2HG GLN 119 HG1 GLN 119 9.579 -2.467 -8.356 724 1HE2 GLN 119 1HE2 GLN 119 10.336 -0.728 -9.508 725 2HE2 GLN 119 2HE2 GLN 119 11.993 -0.546 -9.962 726 H LEU 120 HN LEU 120 10.016 -4.924 -4.886 727 HA LEU 120 HA LEU 120 11.433 -7.387 -4.673 728 1HB LEU 120 HB2 LEU 120 10.453 -5.493 -2.543 729 2HB LEU 120 HB1 LEU 120 11.412 -6.924 -2.217 730 HG LEU 120 HG LEU 120 12.322 -4.574 -3.875 731 1HD1 LEU 120 HD1 LEU 120 13.044 -5.425 -1.081 732 2HD1 LEU 120 HD1 LEU 120 13.808 -4.119 -1.988 733 3HD1 LEU 120 HD1 LEU 120 12.109 -4.002 -1.529 734 1HD2 LEU 120 HD2 LEU 120 13.767 -7.050 -2.938 735 2HD2 LEU 120 HD2 LEU 120 13.369 -6.640 -4.603 736 3HD2 LEU 120 HD2 LEU 120 14.536 -5.666 -3.708 737 H VAL 121 HN VAL 121 8.234 -6.309 -3.380 738 HA VAL 121 HA VAL 121 7.439 -8.824 -2.444 739 HB VAL 121 HB VAL 121 5.606 -6.824 -3.797 740 1HG1 VAL 121 3HG1 VAL 121 5.091 -8.852 -1.625 741 2HG1 VAL 121 2HG1 VAL 121 3.912 -7.686 -2.226 742 3HG1 VAL 121 1HG1 VAL 121 4.536 -8.943 -3.296 743 1HG2 VAL 121 3HG2 VAL 121 6.620 -6.850 -0.965 744 2HG2 VAL 121 2HG2 VAL 121 6.943 -5.648 -2.223 745 3HG2 VAL 121 1HG2 VAL 121 5.317 -5.818 -1.571 746 H ALA 122 HN ALA 122 7.271 -7.449 -5.686 747 HA ALA 122 HA ALA 122 5.797 -9.353 -7.014 748 1HB ALA 122 HB2 ALA 122 8.155 -7.810 -8.050 749 2HB ALA 122 HB1 ALA 122 6.895 -8.563 -9.038 750 3HB ALA 122 HB3 ALA 122 6.497 -7.219 -7.960 751 H ARG 123 HN ARG 123 9.325 -9.179 -6.716 752 HA ARG 123 HA ARG 123 9.762 -11.653 -8.046 753 1HB ARG 123 HB2 ARG 123 12.110 -11.374 -7.490 754 2HB ARG 123 HB1 ARG 123 11.430 -9.873 -8.101 755 1HG ARG 123 HG2 ARG 123 11.177 -9.125 -5.754 756 2HG ARG 123 HG1 ARG 123 12.067 -10.547 -5.236 757 1HD ARG 123 HD2 ARG 123 13.605 -8.697 -5.402 758 2HD ARG 123 HD1 ARG 123 13.945 -9.814 -6.720 759 HE ARG 123 HE ARG 123 12.160 -8.024 -7.761 760 1HH1 ARG 123 1HH1 ARG 123 15.382 -7.717 -6.296 761 2HH1 ARG 123 2HH1 ARG 123 15.789 -6.332 -7.165 762 1HH2 ARG 123 1HH2 ARG 123 12.730 -6.168 -8.966 763 2HH2 ARG 123 2HH2 ARG 123 14.223 -5.387 -8.719 764 H HIS 124 HN HIS 124 8.655 -11.086 -4.989 765 HA HIS 124 HA HIS 124 9.825 -13.214 -3.560 766 1HB HIS 124 HB2 HIS 124 8.620 -11.575 -2.307 767 2HB HIS 124 HB1 HIS 124 7.163 -11.766 -3.246 768 HD1 HIS 124 HD1 HIS 124 5.639 -13.873 -2.586 769 HD2 HIS 124 HD2 HIS 124 9.069 -13.409 -0.299 770 HE1 HIS 124 HE1 HIS 124 5.408 -15.444 -0.656 771 H GLY 125 HN GLY 125 7.192 -13.007 -5.859 772 1HA GLY 125 HA1 GLY 125 6.427 -15.781 -5.357 773 2HA GLY 125 HA2 GLY 125 7.187 -15.432 -6.908 774 H LEU 126 HN LEU 126 5.536 -12.666 -6.303 775 HA LEU 126 HA LEU 126 2.930 -13.255 -6.816 776 1HB LEU 126 HB2 LEU 126 4.747 -10.971 -7.051 777 2HB LEU 126 HB1 LEU 126 3.203 -10.862 -7.865 778 HG LEU 126 HG LEU 126 2.119 -11.350 -5.738 779 1HD1 LEU 126 HD1 LEU 126 4.805 -11.051 -4.487 780 2HD1 LEU 126 HD1 LEU 126 3.228 -11.056 -3.662 781 3HD1 LEU 126 HD1 LEU 126 3.753 -12.486 -4.544 782 1HD2 LEU 126 HD2 LEU 126 3.846 -8.898 -5.828 783 2HD2 LEU 126 HD2 LEU 126 2.235 -9.092 -6.514 784 3HD2 LEU 126 HD2 LEU 126 2.453 -9.088 -4.765 785 H ASP 127 HN ASP 127 1.767 -13.199 -8.583 786 HA ASP 127 HA ASP 127 2.823 -13.834 -11.193 787 1HB ASP 127 HB2 ASP 127 0.053 -12.827 -10.432 788 2HB ASP 127 HB1 ASP 127 0.508 -13.495 -11.983 789 H HIS 128 HN HIS 128 2.388 -12.323 -13.040 790 HA HIS 128 HA HIS 128 3.256 -9.718 -12.345 791 1HB HIS 128 HB2 HIS 128 2.433 -10.906 -14.982 792 2HB HIS 128 HB1 HIS 128 2.771 -9.183 -14.815 793 HD1 HIS 128 HD1 HIS 128 5.154 -8.558 -15.242 794 HD2 HIS 128 HD2 HIS 128 4.766 -12.511 -14.003 795 HE1 HIS 128 HE1 HIS 128 7.468 -9.527 -15.267 796 H ASP 129 HN ASP 129 0.127 -11.061 -12.954 797 HA ASP 129 HA ASP 129 -1.284 -8.586 -12.995 798 1HB ASP 129 HB2 ASP 129 -2.158 -11.406 -12.367 799 2HB ASP 129 HB1 ASP 129 -3.259 -10.051 -12.185 800 H LYS 130 HN LYS 130 -0.122 -10.698 -10.521 801 HA LYS 130 HA LYS 130 -1.457 -9.596 -8.295 802 1HB LYS 130 HB2 LYS 130 1.141 -11.061 -8.611 803 2HB LYS 130 HB1 LYS 130 0.570 -10.533 -7.042 804 1HG LYS 130 HG2 LYS 130 -1.350 -12.078 -8.639 805 2HG LYS 130 HG1 LYS 130 0.083 -12.966 -8.121 806 1HD LYS 130 HD2 LYS 130 -0.342 -12.411 -5.844 807 2HD LYS 130 HD1 LYS 130 -1.692 -11.377 -6.268 808 1HE LYS 130 HE2 LYS 130 -2.455 -13.556 -5.453 809 2HE LYS 130 HE1 LYS 130 -2.895 -13.350 -7.144 810 1HZ LYS 130 HZ2 LYS 130 -0.545 -14.910 -6.168 811 2HZ LYS 130 HZ1 LYS 130 -2.012 -15.562 -6.664 812 3HZ LYS 130 HZ3 LYS 130 -1.025 -14.772 -7.777 813 H VAL 131 HN VAL 131 1.615 -8.851 -9.868 814 HA VAL 131 HA VAL 131 2.552 -6.894 -8.097 815 HB VAL 131 HB VAL 131 2.974 -7.011 -11.099 816 1HG1 VAL 131 3HG1 VAL 131 3.736 -4.921 -10.122 817 2HG1 VAL 131 2HG1 VAL 131 4.692 -5.810 -8.936 818 3HG1 VAL 131 1HG1 VAL 131 5.105 -5.903 -10.645 819 1HG2 VAL 131 2HG2 VAL 131 3.480 -9.161 -10.082 820 2HG2 VAL 131 1HG2 VAL 131 4.960 -8.362 -10.623 821 3HG2 VAL 131 3HG2 VAL 131 4.531 -8.374 -8.912 822 H LEU 132 HN LEU 132 0.514 -6.725 -10.953 823 HA LEU 132 HA LEU 132 0.207 -3.910 -11.069 824 1HB LEU 132 HB2 LEU 132 -1.640 -6.060 -12.063 825 2HB LEU 132 HB1 LEU 132 -1.656 -4.378 -12.548 826 HG LEU 132 HG LEU 132 0.544 -6.360 -13.103 827 1HD1 LEU 132 HD1 LEU 132 -1.474 -5.076 -14.899 828 2HD1 LEU 132 HD1 LEU 132 -0.140 -6.111 -15.419 829 3HD1 LEU 132 HD1 LEU 132 -1.427 -6.773 -14.401 830 1HD2 LEU 132 HD2 LEU 132 0.280 -3.462 -13.909 831 2HD2 LEU 132 HD2 LEU 132 1.477 -4.146 -12.805 832 3HD2 LEU 132 HD2 LEU 132 1.503 -4.587 -14.506 833 H LEU 133 HN LEU 133 -1.796 -6.432 -9.639 834 HA LEU 133 HA LEU 133 -3.725 -4.557 -8.750 835 1HB LEU 133 HB2 LEU 133 -3.215 -7.344 -7.734 836 2HB LEU 133 HB1 LEU 133 -4.673 -6.403 -7.483 837 HG LEU 133 HG LEU 133 -3.670 -7.456 -10.124 838 1HD1 LEU 133 HD1 LEU 133 -4.591 -9.173 -8.708 839 2HD1 LEU 133 HD1 LEU 133 -6.061 -8.202 -8.503 840 3HD1 LEU 133 HD1 LEU 133 -5.631 -8.831 -10.096 841 1HD2 LEU 133 HD2 LEU 133 -6.132 -5.840 -9.493 842 2HD2 LEU 133 HD2 LEU 133 -4.757 -5.322 -10.465 843 3HD2 LEU 133 HD2 LEU 133 -5.800 -6.625 -11.040 844 H PHE 134 HN PHE 134 -0.925 -6.061 -7.228 845 HA PHE 134 HA PHE 134 -1.309 -5.085 -4.642 846 1HB PHE 134 HB2 PHE 134 0.333 -6.819 -5.062 847 2HB PHE 134 HB1 PHE 134 1.248 -5.755 -6.121 848 HD1 PHE 134 HD1 PHE 134 0.126 -6.151 -2.608 849 HD2 PHE 134 HD2 PHE 134 2.976 -4.447 -5.267 850 HE1 PHE 134 HE1 PHE 134 1.458 -5.377 -0.692 851 HE2 PHE 134 HE2 PHE 134 4.312 -3.677 -3.313 852 HZ PHE 134 HZ PHE 134 3.546 -4.116 -1.091 853 H SER 135 HN SER 135 0.489 -3.692 -7.375 854 HA SER 135 HA SER 135 1.419 -1.460 -5.986 855 1HB SER 135 HB2 SER 135 1.759 -0.486 -8.310 856 2HB SER 135 HB1 SER 135 2.493 -2.062 -8.018 857 HG SER 135 HG SER 135 1.098 -3.004 -9.279 858 H ARG 136 HN ARG 136 -1.550 -2.012 -7.704 859 HA ARG 136 HA ARG 136 -2.548 0.655 -7.611 860 1HB ARG 136 HB2 ARG 136 -3.924 -1.999 -7.905 861 2HB ARG 136 HB1 ARG 136 -4.755 -0.452 -8.077 862 1HG ARG 136 HG2 ARG 136 -3.379 0.097 -9.961 863 2HG ARG 136 HG1 ARG 136 -2.409 -1.357 -9.658 864 1HD ARG 136 HD2 ARG 136 -4.213 -2.776 -10.188 865 2HD ARG 136 HD1 ARG 136 -5.352 -1.450 -10.394 866 HE ARG 136 HE ARG 136 -3.181 -1.041 -12.086 867 1HH1 ARG 136 1HH1 ARG 136 -5.935 -3.251 -11.771 868 2HH1 ARG 136 2HH1 ARG 136 -5.906 -3.762 -13.382 869 1HH2 ARG 136 1HH2 ARG 136 -3.126 -1.763 -14.337 870 2HH2 ARG 136 2HH2 ARG 136 -4.281 -2.881 -14.891 871 H ASP 137 HN ASP 137 -3.205 -2.222 -5.653 872 HA ASP 137 HA ASP 137 -5.106 -1.005 -3.962 873 1HB ASP 137 HB2 ASP 137 -4.735 -3.471 -4.417 874 2HB ASP 137 HB1 ASP 137 -3.386 -3.398 -3.311 875 H LEU 138 HN LEU 138 -1.624 -1.383 -3.745 876 HA LEU 138 HA LEU 138 -1.482 -0.260 -1.112 877 1HB LEU 138 HB2 LEU 138 0.166 -1.927 -1.983 878 2HB LEU 138 HB1 LEU 138 0.736 -0.736 -3.122 879 HG LEU 138 HG LEU 138 0.926 -0.154 -0.163 880 1HD1 LEU 138 HD1 LEU 138 1.943 -2.377 -0.564 881 2HD1 LEU 138 HD1 LEU 138 2.907 -1.649 -1.855 882 3HD1 LEU 138 HD1 LEU 138 3.141 -1.127 -0.193 883 1HD2 LEU 138 HD2 LEU 138 1.410 1.578 -1.841 884 2HD2 LEU 138 HD2 LEU 138 2.820 1.109 -0.862 885 3HD2 LEU 138 HD2 LEU 138 2.646 0.483 -2.496 886 H ASP 139 HN ASP 139 -1.323 0.958 -4.361 887 HA ASP 139 HA ASP 139 -0.223 3.508 -3.751 888 1HB ASP 139 HB2 ASP 139 -0.430 2.486 -6.050 889 2HB ASP 139 HB1 ASP 139 -2.141 2.849 -5.989 890 H LYS 140 HN LYS 140 -3.492 2.255 -3.989 891 HA LYS 140 HA LYS 140 -4.909 4.609 -3.387 892 1HB LYS 140 HB2 LYS 140 -5.582 1.740 -2.738 893 2HB LYS 140 HB1 LYS 140 -6.687 3.098 -2.581 894 1HG LYS 140 HG2 LYS 140 -6.559 3.478 -4.993 895 2HG LYS 140 HG1 LYS 140 -5.419 2.147 -5.149 896 1HD LYS 140 HD2 LYS 140 -7.635 1.388 -5.789 897 2HD LYS 140 HD1 LYS 140 -7.147 0.593 -4.298 898 1HE LYS 140 HE2 LYS 140 -9.469 1.272 -4.142 899 2HE LYS 140 HE1 LYS 140 -8.515 2.228 -3.018 900 1HZ LYS 140 HZ3 LYS 140 -8.514 4.023 -4.732 901 2HZ LYS 140 HZ2 LYS 140 -9.530 3.071 -5.664 902 3HZ LYS 140 HZ1 LYS 140 -10.066 3.627 -4.174 903 H LEU 141 HN LEU 141 -3.569 2.093 -1.335 904 HA LEU 141 HA LEU 141 -4.452 3.003 1.148 905 1HB LEU 141 HB2 LEU 141 -3.528 0.783 0.807 906 2HB LEU 141 HB1 LEU 141 -1.986 1.458 0.349 907 HG LEU 141 HG LEU 141 -1.506 2.093 2.633 908 1HD1 LEU 141 HD1 LEU 141 -4.272 1.032 3.287 909 2HD1 LEU 141 HD1 LEU 141 -3.071 1.595 4.449 910 3HD1 LEU 141 HD1 LEU 141 -3.797 2.732 3.317 911 1HD2 LEU 141 HD2 LEU 141 -2.635 -0.681 2.426 912 2HD2 LEU 141 HD2 LEU 141 -0.997 -0.164 2.011 913 3HD2 LEU 141 HD2 LEU 141 -1.553 -0.103 3.685 914 H ILE 142 HN ILE 142 -1.530 3.739 -0.653 915 HA ILE 142 HA ILE 142 -0.505 5.488 1.316 916 HB ILE 142 HB ILE 142 0.198 5.212 -1.615 917 1HG1 ILE 142 2HG1 ILE 142 1.610 4.470 0.940 918 2HG1 ILE 142 1HG1 ILE 142 0.853 3.357 -0.194 919 1HG2 ILE 142 1HG2 ILE 142 1.547 7.006 0.414 920 2HG2 ILE 142 3HG2 ILE 142 2.140 6.661 -1.212 921 3HG2 ILE 142 2HG2 ILE 142 0.623 7.533 -0.990 922 1HD1 ILE 142 HD1 ILE 142 2.475 4.003 -1.870 923 2HD1 ILE 142 HD1 ILE 142 3.256 5.089 -0.715 924 3HD1 ILE 142 HD1 ILE 142 3.256 3.342 -0.437 925 H ASN 143 HN ASN 143 -2.249 6.165 -1.700 926 HA ASN 143 HA ASN 143 -2.302 8.959 -1.417 927 1HB ASN 143 HB2 ASN 143 -4.125 7.089 -2.908 928 2HB ASN 143 HB1 ASN 143 -4.473 8.810 -2.839 929 1HD2 ASN 143 HD2 ASN 143 -2.326 6.379 -4.059 930 2HD2 ASN 143 HD2 ASN 143 -1.531 7.366 -5.206 931 H LYS 144 HN LYS 144 -4.315 6.540 0.018 932 HA LYS 144 HA LYS 144 -6.341 8.189 1.032 933 1HB LYS 144 HB2 LYS 144 -6.430 5.716 0.956 934 2HB LYS 144 HB1 LYS 144 -5.206 5.645 2.210 935 1HG LYS 144 HG2 LYS 144 -6.791 6.834 3.744 936 2HG LYS 144 HG1 LYS 144 -8.003 6.716 2.462 937 1HD LYS 144 HD2 LYS 144 -6.634 4.363 3.733 938 2HD LYS 144 HD1 LYS 144 -8.244 4.948 4.152 939 1HE LYS 144 HE2 LYS 144 -7.376 3.895 1.449 940 2HE LYS 144 HE1 LYS 144 -8.356 3.059 2.647 941 1HZ LYS 144 HZ2 LYS 144 -10.078 4.771 2.370 942 2HZ LYS 144 HZ1 LYS 144 -9.142 5.550 1.218 943 3HZ LYS 144 HZ3 LYS 144 -9.745 4.023 0.916 944 H PHE 145 HN PHE 145 -3.325 7.028 2.520 945 HA PHE 145 HA PHE 145 -3.696 8.576 4.882 946 1HB PHE 145 HB2 PHE 145 -1.472 6.838 3.889 947 2HB PHE 145 HB1 PHE 145 -1.220 7.872 5.289 948 HD1 PHE 145 HD1 PHE 145 -3.342 5.111 3.968 949 HD2 PHE 145 HD2 PHE 145 -2.039 7.283 7.385 950 HE1 PHE 145 HE1 PHE 145 -4.403 3.449 5.433 951 HE2 PHE 145 HE2 PHE 145 -3.100 5.623 8.849 952 HZ PHE 145 HZ PHE 145 -4.282 3.702 7.872 953 H MET 146 HN MET 146 -1.959 9.074 1.934 954 HA MET 146 HA MET 146 -0.453 11.429 2.645 955 1HB MET 146 HB2 MET 146 -1.623 10.555 0.000 956 2HB MET 146 HB1 MET 146 -0.471 11.862 0.193 957 1HG MET 146 HG2 MET 146 0.067 9.010 0.964 958 2HG MET 146 HG1 MET 146 0.470 9.699 -0.604 959 1HE MET 146 HE3 MET 146 2.276 11.315 -1.075 960 2HE MET 146 HE2 MET 146 1.493 12.528 -0.053 961 3HE MET 146 HE1 MET 146 3.214 12.203 0.131 962 H ASN 147 HN ASN 147 -3.678 10.722 1.867 963 HA ASN 147 HA ASN 147 -5.591 11.798 1.624 964 1HB ASN 147 HB2 ASN 147 -5.001 12.539 3.977 965 2HB ASN 147 HB1 ASN 147 -4.387 14.035 3.270 966 1HD2 ASN 147 HD2 ASN 147 -5.890 15.294 4.310 967 2HD2 ASN 147 HD2 ASN 147 -7.571 15.289 3.887 968 H VAL 148 HN VAL 148 -4.870 11.889 -0.520 969 HA VAL 148 HA VAL 148 -3.911 14.372 -1.564 970 HB VAL 148 HB VAL 148 -4.039 13.310 -3.779 971 1HG1 VAL 148 1HG1 VAL 148 -2.675 11.622 -1.693 972 2HG1 VAL 148 3HG1 VAL 148 -2.326 11.577 -3.418 973 3HG1 VAL 148 2HG1 VAL 148 -2.011 13.047 -2.497 974 1HG2 VAL 148 3HG2 VAL 148 -5.078 10.889 -2.295 975 2HG2 VAL 148 2HG2 VAL 148 -5.984 11.869 -3.448 976 3HG2 VAL 148 1HG2 VAL 148 -4.603 10.916 -3.995 977 H LYS 149 HN LYS 149 -4.953 15.779 -2.627 978 HA LYS 149 HA LYS 149 -7.813 15.584 -2.279 979 1HB LYS 149 HB2 LYS 149 -6.078 18.021 -2.528 980 2HB LYS 149 HB1 LYS 149 -7.795 17.986 -2.129 981 1HG LYS 149 HG2 LYS 149 -7.334 16.771 -0.096 982 2HG LYS 149 HG1 LYS 149 -5.633 16.707 -0.455 983 1HD LYS 149 HD2 LYS 149 -5.604 19.220 -0.493 984 2HD LYS 149 HD1 LYS 149 -7.286 19.203 0.025 985 1HE LYS 149 HE2 LYS 149 -4.953 18.061 1.562 986 2HE LYS 149 HE1 LYS 149 -5.742 19.598 1.890 987 1HZ LYS 149 HZ2 LYS 149 -7.104 16.950 2.052 988 2HZ LYS 149 HZ1 LYS 149 -6.519 17.850 3.361 989 3HZ LYS 149 HZ3 LYS 149 -7.762 18.434 2.418 990 H ASP 150 HN ASP 150 -8.457 14.733 -4.007 991 HA ASP 150 HA ASP 150 -7.526 15.136 -6.585 992 1HB ASP 150 HB2 ASP 150 -9.747 14.125 -7.288 993 2HB ASP 150 HB1 ASP 150 -8.758 13.155 -6.207 994 H LYS 151 HN LYS 151 -7.750 16.605 -7.962 995 HA LYS 151 HA LYS 151 -9.289 18.971 -7.266 996 1HB LYS 151 HB2 LYS 151 -7.907 20.077 -9.040 997 2HB LYS 151 HB1 LYS 151 -6.999 19.432 -7.682 998 1HG LYS 151 HG2 LYS 151 -6.280 17.542 -9.000 999 2HG LYS 151 HG1 LYS 151 -7.291 18.062 -10.353 1000 1HD LYS 151 HD2 LYS 151 -5.980 20.076 -10.609 1001 2HD LYS 151 HD1 LYS 151 -5.033 19.675 -9.178 1002 1HE LYS 151 HE2 LYS 151 -5.139 17.933 -11.633 1003 2HE LYS 151 HE1 LYS 151 -3.930 19.196 -11.399 1004 1HZ LYS 151 HZ1 LYS 151 -4.325 16.846 -9.597 1005 2HZ LYS 151 HZ3 LYS 151 -3.123 17.021 -10.758 1006 3HZ LYS 151 HZ2 LYS 151 -3.161 18.041 -9.427 1007 H VAL 152 HN VAL 152 -10.448 16.545 -8.463 1008 HA VAL 152 HA VAL 152 -11.279 17.363 -11.100 1009 HB VAL 152 HB VAL 152 -12.788 15.400 -11.043 1010 1HG1 VAL 152 1HG1 VAL 152 -9.984 14.825 -10.115 1011 2HG1 VAL 152 3HG1 VAL 152 -11.064 13.656 -10.868 1012 3HG1 VAL 152 2HG1 VAL 152 -10.517 15.059 -11.781 1013 1HG2 VAL 152 3HG2 VAL 152 -13.358 15.461 -8.672 1014 2HG2 VAL 152 2HG2 VAL 152 -12.763 13.873 -9.152 1015 3HG2 VAL 152 1HG2 VAL 152 -11.714 14.980 -8.258 1016 H HIS 153 HN HIS 153 -13.732 17.424 -11.523 1017 HA HIS 153 HA HIS 153 -14.855 19.281 -9.562 1018 1HB HIS 153 HB2 HIS 153 -15.501 18.854 -12.482 1019 2HB HIS 153 HB1 HIS 153 -16.378 19.956 -11.422 1020 HD1 HIS 153 HD1 HIS 153 -13.664 19.942 -13.784 1021 HD2 HIS 153 HD2 HIS 153 -14.544 21.976 -10.273 1022 HE1 HIS 153 HE1 HIS 153 -12.221 21.988 -13.789 1023 H LYS 154 HN LYS 154 -14.835 16.428 -9.372 1024 HA LYS 154 HA LYS 154 -17.669 16.067 -8.878 1025 1HB LYS 154 HB2 LYS 154 -17.020 14.714 -10.885 1026 2HB LYS 154 HB1 LYS 154 -15.768 13.937 -9.943 1027 1HG LYS 154 HG2 LYS 154 -18.657 13.712 -9.133 1028 2HG LYS 154 HG1 LYS 154 -17.994 12.685 -10.392 1029 1HD LYS 154 HD2 LYS 154 -16.302 11.850 -8.794 1030 2HD LYS 154 HD1 LYS 154 -17.000 12.873 -7.540 1031 1HE LYS 154 HE2 LYS 154 -19.088 11.662 -7.662 1032 2HE LYS 154 HE1 LYS 154 -18.491 10.747 -9.040 1033 1HZ LYS 154 HZ2 LYS 154 -16.784 9.794 -7.590 1034 2HZ LYS 154 HZ1 LYS 154 -17.403 10.594 -6.264 1035 3HZ LYS 154 HZ3 LYS 154 -18.316 9.412 -7.052 1036 H LEU 155 HN LEU 155 -17.388 16.687 -6.824 1037 HA LEU 155 HA LEU 155 -15.316 15.528 -5.223 1038 1HB LEU 155 HB2 LEU 155 -17.499 17.514 -4.601 1039 2HB LEU 155 HB1 LEU 155 -16.308 16.975 -3.447 1040 HG LEU 155 HG LEU 155 -15.703 19.123 -4.169 1041 1HD1 LEU 155 HD1 LEU 155 -13.853 17.660 -3.841 1042 2HD1 LEU 155 HD1 LEU 155 -13.898 17.164 -5.534 1043 3HD1 LEU 155 HD1 LEU 155 -13.492 18.827 -5.110 1044 1HD2 LEU 155 HD2 LEU 155 -15.831 18.169 -7.028 1045 2HD2 LEU 155 HD2 LEU 155 -16.924 19.317 -6.250 1046 3HD2 LEU 155 HD2 LEU 155 -15.232 19.745 -6.509 1047 H GLU 156 HN GLU 156 -15.808 14.415 -3.289 1048 HA GLU 156 HA GLU 156 -18.098 12.659 -3.499 1049 1HB GLU 156 HB2 GLU 156 -16.023 12.896 -1.305 1050 2HB GLU 156 HB1 GLU 156 -17.210 11.616 -1.465 1051 1HG GLU 156 HG2 GLU 156 -15.039 12.205 -3.442 1052 2HG GLU 156 HG1 GLU 156 -14.970 10.957 -2.198 1053 H HIS 157 HN HIS 157 -16.764 14.727 -1.007 1054 HA HIS 157 HA HIS 157 -17.544 15.880 0.727 1055 1HB HIS 157 HB2 HIS 157 -18.627 17.227 -1.162 1056 2HB HIS 157 HB1 HIS 157 -20.079 16.265 -0.866 1057 HD1 HIS 157 HD1 HIS 157 -18.190 19.212 0.474 1058 HD2 HIS 157 HD2 HIS 157 -21.422 16.822 1.548 1059 HE1 HIS 157 HE1 HIS 157 -19.349 20.405 2.349 1060 H HIS 158 HN HIS 158 -20.685 14.675 -0.272 1061 HA HIS 158 HA HIS 158 -20.674 12.957 2.045 1062 1HB HIS 158 HB2 HIS 158 -22.030 15.003 2.577 1063 2HB HIS 158 HB1 HIS 158 -23.041 14.670 1.178 1064 HD1 HIS 158 HD1 HIS 158 -22.892 14.105 4.780 1065 HD2 HIS 158 HD2 HIS 158 -24.514 12.104 1.513 1066 HE1 HIS 158 HE1 HIS 158 -24.606 12.554 5.702 1067 H HIS 159 HN HIS 159 -20.163 11.310 0.557 1068 HA HIS 159 HA HIS 159 -22.310 10.723 -1.330 1069 1HB HIS 159 HB2 HIS 159 -19.982 10.985 -2.307 1070 2HB HIS 159 HB1 HIS 159 -19.499 9.575 -1.373 1071 HD1 HIS 159 HD1 HIS 159 -19.687 7.396 -2.631 1072 HD2 HIS 159 HD2 HIS 159 -22.179 10.341 -4.174 1073 HE1 HIS 159 HE1 HIS 159 -20.768 6.394 -4.678 1074 H HIS 160 HN HIS 160 -23.443 10.116 0.557 1075 HA HIS 160 HA HIS 160 -23.077 7.314 1.245 1076 1HB HIS 160 HB2 HIS 160 -23.599 9.473 3.335 1077 2HB HIS 160 HB1 HIS 160 -23.447 7.748 3.632 1078 HD1 HIS 160 HD1 HIS 160 -20.907 6.785 3.397 1079 HD2 HIS 160 HD2 HIS 160 -21.323 10.919 3.425 1080 HE1 HIS 160 HE1 HIS 160 -18.612 7.721 3.865 1081 H HIS 161 HN HIS 161 -24.968 6.604 0.413 1082 HA HIS 161 HA HIS 161 -27.401 7.841 1.329 1083 1HB HIS 161 HB2 HIS 161 -28.322 7.937 -1.045 1084 2HB HIS 161 HB1 HIS 161 -27.159 9.178 -0.610 1085 HD1 HIS 161 HD1 HIS 161 -25.072 9.340 -2.018 1086 HD2 HIS 161 HD2 HIS 161 -27.283 5.918 -2.807 1087 HE1 HIS 161 HE1 HIS 161 -23.987 8.253 -4.009 1088 H HIS 162 HN HIS 162 -29.039 6.523 1.518 1089 HA HIS 162 HA HIS 162 -29.421 4.175 0.022 1090 1HB HIS 162 HB2 HIS 162 -27.700 3.374 1.713 1091 2HB HIS 162 HB1 HIS 162 -28.815 3.848 2.989 1092 HD1 HIS 162 HD1 HIS 162 -28.162 1.125 0.499 1093 HD2 HIS 162 HD2 HIS 162 -31.077 2.155 3.279 1094 HE1 HIS 162 HE1 HIS 162 -29.569 -0.923 0.834 No H/Q in entry = 1094 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 16.220 -20.132 -3.042 2 H2 MET 1 HT3 MET 1 17.298 -20.064 -4.355 3 H3 MET 1 HT2 MET 1 17.866 -20.140 -2.746 4 HA MET 1 HA MET 1 18.079 -17.930 -3.530 5 1HB MET 1 HB2 MET 1 16.232 -17.983 -5.190 6 2HB MET 1 HB1 MET 1 15.067 -18.080 -3.882 7 1HG MET 1 HG2 MET 1 15.207 -15.827 -4.790 8 2HG MET 1 HG1 MET 1 15.714 -15.876 -3.105 9 1HE MET 1 HE2 MET 1 16.848 -15.545 -6.843 10 2HE MET 1 HE1 MET 1 18.605 -15.461 -6.699 11 3HE MET 1 HE3 MET 1 17.762 -16.966 -6.337 12 H GLU 2 HN GLU 2 18.298 -16.600 -1.848 13 HA GLU 2 HA GLU 2 17.219 -17.451 0.643 14 1HB GLU 2 HB2 GLU 2 19.509 -16.562 0.493 15 2HB GLU 2 HB1 GLU 2 18.864 -15.021 -0.057 16 1HG GLU 2 HG2 GLU 2 19.483 -14.969 2.319 17 2HG GLU 2 HG1 GLU 2 17.765 -14.681 2.054 18 H MET 3 HN MET 3 15.091 -17.187 0.646 19 HA MET 3 HA MET 3 14.009 -14.661 -0.205 20 1HB MET 3 HB2 MET 3 11.787 -15.633 0.143 21 2HB MET 3 HB1 MET 3 12.783 -16.619 -0.910 22 1HG MET 3 HG2 MET 3 13.234 -18.128 0.988 23 2HG MET 3 HG1 MET 3 12.153 -17.152 1.984 24 1HE MET 3 HE1 MET 3 9.536 -16.925 1.555 25 2HE MET 3 HE3 MET 3 9.816 -16.401 -0.108 26 3HE MET 3 HE2 MET 3 8.692 -17.714 0.226 27 H GLY 4 HN GLY 4 15.114 -16.028 2.669 28 1HA GLY 4 HA1 GLY 4 14.988 -15.387 4.845 29 2HA GLY 4 HA2 GLY 4 13.386 -14.735 4.508 30 H GLN 5 HN GLN 5 16.613 -14.014 3.320 31 HA GLN 5 HA GLN 5 16.684 -11.481 4.598 32 1HB GLN 5 HB2 GLN 5 18.428 -12.606 2.407 33 2HB GLN 5 HB1 GLN 5 18.702 -11.038 3.154 34 1HG GLN 5 HG2 GLN 5 18.663 -13.659 4.647 35 2HG GLN 5 HG1 GLN 5 20.121 -12.846 4.087 36 1HE2 GLN 5 1HE2 GLN 5 20.859 -12.709 6.236 37 2HE2 GLN 5 2HE2 GLN 5 20.194 -11.548 7.335 38 H LEU 6 HN LEU 6 15.638 -12.583 1.496 39 HA LEU 6 HA LEU 6 15.267 -10.126 0.201 40 1HB LEU 6 HB2 LEU 6 15.171 -12.307 -0.950 41 2HB LEU 6 HB1 LEU 6 13.791 -12.749 0.017 42 HG LEU 6 HG LEU 6 13.392 -12.218 -2.441 43 1HD1 LEU 6 HD1 LEU 6 11.564 -12.441 -0.875 44 2HD1 LEU 6 HD1 LEU 6 11.744 -10.766 -0.386 45 3HD1 LEU 6 HD1 LEU 6 11.234 -11.147 -2.032 46 1HD2 LEU 6 HD2 LEU 6 14.745 -10.198 -2.607 47 2HD2 LEU 6 HD2 LEU 6 13.064 -9.859 -3.021 48 3HD2 LEU 6 HD2 LEU 6 13.696 -9.384 -1.445 49 H LYS 7 HN LYS 7 13.118 -12.010 2.299 50 HA LYS 7 HA LYS 7 10.919 -10.279 2.326 51 1HB LYS 7 HB2 LYS 7 11.762 -12.618 3.655 52 2HB LYS 7 HB1 LYS 7 11.352 -11.440 4.896 53 1HG LYS 7 HG2 LYS 7 9.538 -12.182 2.611 54 2HG LYS 7 HG1 LYS 7 9.482 -12.992 4.163 55 1HD LYS 7 HD2 LYS 7 9.023 -10.019 3.722 56 2HD LYS 7 HD1 LYS 7 7.739 -11.212 3.897 57 1HE LYS 7 HE2 LYS 7 8.666 -11.752 6.162 58 2HE LYS 7 HE1 LYS 7 9.790 -10.411 5.962 59 1HZ LYS 7 HZ2 LYS 7 6.823 -10.185 5.981 60 2HZ LYS 7 HZ1 LYS 7 7.848 -9.785 7.233 61 3HZ LYS 7 HZ3 LYS 7 7.867 -8.882 5.819 62 H ASN 8 HN ASN 8 13.818 -10.418 4.276 63 HA ASN 8 HA ASN 8 13.148 -8.294 5.992 64 1HB ASN 8 HB2 ASN 8 15.839 -9.476 5.287 65 2HB ASN 8 HB1 ASN 8 15.604 -8.195 6.475 66 1HD2 ASN 8 HD2 ASN 8 16.661 -10.903 6.838 67 2HD2 ASN 8 HD2 ASN 8 15.673 -11.614 8.046 68 H LYS 9 HN LYS 9 14.801 -8.373 2.878 69 HA LYS 9 HA LYS 9 15.505 -5.629 2.673 70 1HB LYS 9 HB2 LYS 9 14.731 -7.655 0.550 71 2HB LYS 9 HB1 LYS 9 15.278 -6.039 0.170 72 1HG LYS 9 HG2 LYS 9 17.069 -7.713 1.850 73 2HG LYS 9 HG1 LYS 9 16.873 -8.180 0.167 74 1HD LYS 9 HD2 LYS 9 18.799 -6.737 0.350 75 2HD LYS 9 HD1 LYS 9 17.530 -5.881 -0.511 76 1HE LYS 9 HE2 LYS 9 18.598 -4.373 1.005 77 2HE LYS 9 HE1 LYS 9 16.980 -4.694 1.611 78 1HZ LYS 9 HZ3 LYS 9 19.494 -5.935 2.573 79 2HZ LYS 9 HZ2 LYS 9 18.653 -4.738 3.376 80 3HZ LYS 9 HZ1 LYS 9 17.976 -6.273 3.211 81 H ILE 10 HN ILE 10 12.620 -7.427 1.752 82 HA ILE 10 HA ILE 10 11.090 -5.321 0.766 83 HB ILE 10 HB ILE 10 10.289 -7.930 2.070 84 1HG1 ILE 10 2HG1 ILE 10 10.251 -6.955 -0.776 85 2HG1 ILE 10 1HG1 ILE 10 11.446 -8.044 -0.081 86 1HG2 ILE 10 2HG2 ILE 10 8.450 -6.360 2.447 87 2HG2 ILE 10 1HG2 ILE 10 8.435 -5.964 0.729 88 3HG2 ILE 10 3HG2 ILE 10 8.001 -7.587 1.263 89 1HD1 ILE 10 HD1 ILE 10 8.514 -8.596 -0.447 90 2HD1 ILE 10 HD1 ILE 10 9.830 -9.228 -1.437 91 3HD1 ILE 10 HD1 ILE 10 9.690 -9.705 0.255 92 H GLU 11 HN GLU 11 11.168 -6.664 4.044 93 HA GLU 11 HA GLU 11 9.450 -4.915 5.320 94 1HB GLU 11 HB2 GLU 11 12.000 -6.151 6.348 95 2HB GLU 11 HB1 GLU 11 10.868 -5.271 7.360 96 1HG GLU 11 HG2 GLU 11 10.289 -7.789 5.826 97 2HG GLU 11 HG1 GLU 11 10.568 -7.667 7.562 98 H ASN 12 HN ASN 12 12.914 -4.606 4.896 99 HA ASN 12 HA ASN 12 13.249 -2.139 6.148 100 1HB ASN 12 HB2 ASN 12 15.063 -3.752 5.593 101 2HB ASN 12 HB1 ASN 12 14.897 -3.302 3.904 102 1HD2 ASN 12 HD2 ASN 12 15.691 -1.347 3.221 103 2HD2 ASN 12 HD2 ASN 12 16.689 -0.356 4.214 104 H LYS 13 HN LYS 13 12.651 -2.908 2.732 105 HA LYS 13 HA LYS 13 12.925 -0.241 1.792 106 1HB LYS 13 HB2 LYS 13 13.061 -2.358 0.396 107 2HB LYS 13 HB1 LYS 13 11.317 -2.456 0.515 108 1HG LYS 13 HG2 LYS 13 11.963 -1.467 -1.632 109 2HG LYS 13 HG1 LYS 13 11.101 -0.304 -0.630 110 1HD LYS 13 HD2 LYS 13 13.034 0.694 -1.746 111 2HD LYS 13 HD1 LYS 13 13.199 0.746 0.004 112 1HE LYS 13 HE2 LYS 13 14.677 -1.183 -0.086 113 2HE LYS 13 HE1 LYS 13 14.507 -1.254 -1.845 114 1HZ LYS 13 HZ3 LYS 13 15.674 0.993 -0.283 115 2HZ LYS 13 HZ2 LYS 13 16.534 -0.135 -1.197 116 3HZ LYS 13 HZ1 LYS 13 15.492 0.939 -1.980 117 H LYS 14 HN LYS 14 10.161 -2.202 2.730 118 HA LYS 14 HA LYS 14 8.032 -0.507 2.325 119 1HB LYS 14 HB2 LYS 14 7.926 -2.873 2.990 120 2HB LYS 14 HB1 LYS 14 8.620 -2.463 4.545 121 1HG LYS 14 HG2 LYS 14 6.604 -1.152 5.063 122 2HG LYS 14 HG1 LYS 14 5.916 -1.645 3.511 123 1HD LYS 14 HD2 LYS 14 5.019 -3.121 5.181 124 2HD LYS 14 HD1 LYS 14 6.206 -4.026 4.238 125 1HE LYS 14 HE2 LYS 14 7.877 -3.571 6.026 126 2HE LYS 14 HE1 LYS 14 6.575 -2.821 6.951 127 1HZ LYS 14 HZ2 LYS 14 5.422 -5.050 6.935 128 2HZ LYS 14 HZ1 LYS 14 6.724 -5.683 6.102 129 3HZ LYS 14 HZ3 LYS 14 6.933 -5.108 7.634 130 H LYS 15 HN LYS 15 10.163 -0.914 5.103 131 HA LYS 15 HA LYS 15 9.038 1.130 6.675 132 1HB LYS 15 HB2 LYS 15 11.626 -0.392 6.822 133 2HB LYS 15 HB1 LYS 15 11.172 0.818 8.026 134 1HG LYS 15 HG2 LYS 15 9.368 -0.409 8.790 135 2HG LYS 15 HG1 LYS 15 9.263 -1.370 7.320 136 1HD LYS 15 HD2 LYS 15 11.199 -2.590 7.907 137 2HD LYS 15 HD1 LYS 15 11.531 -1.566 9.308 138 1HE LYS 15 HE2 LYS 15 9.382 -2.352 10.301 139 2HE LYS 15 HE1 LYS 15 9.089 -3.329 8.871 140 1HZ LYS 15 HZ1 LYS 15 11.074 -4.657 9.457 141 2HZ LYS 15 HZ3 LYS 15 11.310 -3.718 10.822 142 3HZ LYS 15 HZ2 LYS 15 9.946 -4.673 10.692 143 H GLU 16 HN GLU 16 11.757 1.151 4.465 144 HA GLU 16 HA GLU 16 12.543 3.845 4.733 145 1HB GLU 16 HB2 GLU 16 12.382 2.151 2.217 146 2HB GLU 16 HB1 GLU 16 13.068 3.764 2.241 147 1HG GLU 16 HG2 GLU 16 14.788 2.955 3.809 148 2HG GLU 16 HG1 GLU 16 14.097 1.335 3.694 149 H LEU 17 HN LEU 17 9.959 2.449 2.817 150 HA LEU 17 HA LEU 17 9.059 4.872 1.701 151 1HB LEU 17 HB2 LEU 17 8.540 2.942 0.508 152 2HB LEU 17 HB1 LEU 17 7.916 2.103 1.910 153 HG LEU 17 HG LEU 17 6.204 2.690 0.178 154 1HD1 LEU 17 HD1 LEU 17 5.551 2.114 2.278 155 2HD1 LEU 17 HD1 LEU 17 5.673 3.784 2.834 156 3HD1 LEU 17 HD1 LEU 17 4.490 3.351 1.582 157 1HD2 LEU 17 HD2 LEU 17 6.746 5.514 1.039 158 2HD2 LEU 17 HD2 LEU 17 7.091 4.833 -0.553 159 3HD2 LEU 17 HD2 LEU 17 5.421 4.983 0.000 160 H ILE 18 HN ILE 18 7.970 3.008 4.463 161 HA ILE 18 HA ILE 18 5.734 4.467 5.091 162 HB ILE 18 HB ILE 18 7.645 3.092 7.002 163 1HG1 ILE 18 2HG1 ILE 18 4.978 2.151 5.960 164 2HG1 ILE 18 1HG1 ILE 18 6.511 1.737 5.201 165 1HG2 ILE 18 3HG2 ILE 18 4.817 4.037 7.504 166 2HG2 ILE 18 2HG2 ILE 18 5.776 3.059 8.611 167 3HG2 ILE 18 1HG2 ILE 18 6.277 4.707 8.230 168 1HD1 ILE 18 HD1 ILE 18 5.736 1.097 8.026 169 2HD1 ILE 18 HD1 ILE 18 5.693 -0.030 6.663 170 3HD1 ILE 18 HD1 ILE 18 7.233 0.648 7.205 171 H GLN 19 HN GLN 19 9.074 5.035 5.966 172 HA GLN 19 HA GLN 19 8.710 7.275 7.648 173 1HB GLN 19 HB2 GLN 19 11.059 6.472 5.936 174 2HB GLN 19 HB1 GLN 19 11.096 7.771 7.116 175 1HG GLN 19 HG2 GLN 19 10.726 6.236 8.913 176 2HG GLN 19 HG1 GLN 19 10.450 4.913 7.778 177 1HE2 GLN 19 1HE2 GLN 19 12.159 4.006 6.742 178 2HE2 GLN 19 2HE2 GLN 19 13.807 4.250 7.198 179 H LEU 20 HN LEU 20 8.938 6.963 4.164 180 HA LEU 20 HA LEU 20 9.183 9.758 3.679 181 1HB LEU 20 HB2 LEU 20 8.404 7.517 1.815 182 2HB LEU 20 HB1 LEU 20 8.747 9.161 1.319 183 HG LEU 20 HG LEU 20 10.735 7.262 2.569 184 1HD1 LEU 20 HD1 LEU 20 10.458 8.263 -0.256 185 2HD1 LEU 20 HD1 LEU 20 11.777 7.271 0.365 186 3HD1 LEU 20 HD1 LEU 20 10.138 6.623 0.306 187 1HD2 LEU 20 HD2 LEU 20 11.097 10.050 1.465 188 2HD2 LEU 20 HD2 LEU 20 11.224 9.580 3.158 189 3HD2 LEU 20 HD2 LEU 20 12.394 8.976 1.988 190 H VAL 21 HN VAL 21 6.446 7.425 3.367 191 HA VAL 21 HA VAL 21 4.515 9.380 2.778 192 HB VAL 21 HB VAL 21 3.979 6.919 4.461 193 1HG1 VAL 21 3HG1 VAL 21 2.234 8.447 2.535 194 2HG1 VAL 21 2HG1 VAL 21 1.769 6.967 3.375 195 3HG1 VAL 21 1HG1 VAL 21 2.098 8.442 4.292 196 1HG2 VAL 21 2HG2 VAL 21 4.190 7.123 1.470 197 2HG2 VAL 21 1HG2 VAL 21 5.252 6.233 2.566 198 3HG2 VAL 21 3HG2 VAL 21 3.578 5.720 2.361 199 H ALA 22 HN ALA 22 5.789 8.256 5.860 200 HA ALA 22 HA ALA 22 4.040 9.464 7.615 201 1HB ALA 22 HB2 ALA 22 6.993 9.030 8.005 202 2HB ALA 22 HB1 ALA 22 5.798 9.277 9.290 203 3HB ALA 22 HB3 ALA 22 5.719 7.841 8.273 204 H ARG 23 HN ARG 23 7.094 10.726 6.372 205 HA ARG 23 HA ARG 23 6.903 13.209 7.714 206 1HB ARG 23 HB2 ARG 23 8.821 13.925 6.388 207 2HB ARG 23 HB1 ARG 23 9.073 12.332 7.079 208 1HG ARG 23 HG2 ARG 23 8.405 11.387 4.866 209 2HG ARG 23 HG1 ARG 23 8.442 13.039 4.242 210 1HD ARG 23 HD2 ARG 23 10.545 11.906 3.786 211 2HD ARG 23 HD1 ARG 23 10.789 13.234 4.924 212 HE ARG 23 HE ARG 23 10.346 10.975 6.439 213 1HH1 ARG 23 1HH1 ARG 23 12.774 11.966 4.058 214 2HH1 ARG 23 2HH1 ARG 23 14.036 11.081 4.741 215 1HH2 ARG 23 1HH2 ARG 23 12.057 9.768 7.418 216 2HH2 ARG 23 2HH2 ARG 23 13.614 9.772 6.716 217 H HIS 24 HN HIS 24 5.443 12.101 4.872 218 HA HIS 24 HA HIS 24 5.034 14.492 3.486 219 1HB HIS 24 HB2 HIS 24 4.479 12.388 2.455 220 2HB HIS 24 HB1 HIS 24 3.280 11.998 3.663 221 HD1 HIS 24 HD1 HIS 24 0.903 13.262 3.393 222 HD2 HIS 24 HD2 HIS 24 3.721 14.179 0.477 223 HE1 HIS 24 HE1 HIS 24 -0.322 14.522 1.610 224 H GLY 25 HN GLY 25 3.515 13.249 6.405 225 1HA GLY 25 HA1 GLY 25 1.371 15.209 6.225 226 2HA GLY 25 HA2 GLY 25 2.597 15.558 7.429 227 H LEU 26 HN LEU 26 2.118 12.220 7.007 228 HA LEU 26 HA LEU 26 -0.041 11.723 8.639 229 1HB LEU 26 HB2 LEU 26 2.388 10.250 7.866 230 2HB LEU 26 HB1 LEU 26 1.282 9.545 9.027 231 HG LEU 26 HG LEU 26 -0.485 9.732 7.280 232 1HD1 LEU 26 HD1 LEU 26 0.477 11.427 5.916 233 2HD1 LEU 26 HD1 LEU 26 1.802 10.351 5.459 234 3HD1 LEU 26 HD1 LEU 26 0.139 9.973 4.969 235 1HD2 LEU 26 HD2 LEU 26 1.934 8.081 6.688 236 2HD2 LEU 26 HD2 LEU 26 0.614 7.675 7.789 237 3HD2 LEU 26 HD2 LEU 26 0.321 7.760 6.044 238 H ASP 27 HN ASP 27 -0.198 11.191 10.698 239 HA ASP 27 HA ASP 27 1.917 12.129 12.516 240 1HB ASP 27 HB2 ASP 27 -0.644 12.742 12.869 241 2HB ASP 27 HB1 ASP 27 -0.773 11.091 13.412 242 H HIS 28 HN HIS 28 1.770 10.608 14.623 243 HA HIS 28 HA HIS 28 3.226 8.314 13.988 244 1HB HIS 28 HB2 HIS 28 1.708 8.928 16.530 245 2HB HIS 28 HB1 HIS 28 3.053 7.803 16.353 246 HD1 HIS 28 HD1 HIS 28 2.266 11.466 16.629 247 HD2 HIS 28 HD2 HIS 28 5.561 8.957 16.239 248 HE1 HIS 28 HE1 HIS 28 4.292 12.902 17.054 249 H ASP 29 HN ASP 29 -0.181 8.840 14.752 250 HA ASP 29 HA ASP 29 -0.677 6.031 14.906 251 1HB ASP 29 HB2 ASP 29 -2.520 8.398 15.001 252 2HB ASP 29 HB1 ASP 29 -3.127 6.742 14.963 253 H LYS 30 HN LYS 30 -0.961 8.468 12.489 254 HA LYS 30 HA LYS 30 -2.370 6.863 10.619 255 1HB LYS 30 HB2 LYS 30 -0.476 9.164 10.210 256 2HB LYS 30 HB1 LYS 30 -1.238 8.334 8.871 257 1HG LYS 30 HG2 LYS 30 -2.617 9.868 11.060 258 2HG LYS 30 HG1 LYS 30 -2.373 10.399 9.397 259 1HD LYS 30 HD2 LYS 30 -3.734 8.442 8.641 260 2HD LYS 30 HD1 LYS 30 -4.079 8.082 10.331 261 1HE LYS 30 HE2 LYS 30 -4.998 10.426 10.527 262 2HE LYS 30 HE1 LYS 30 -4.842 10.549 8.781 263 1HZ LYS 30 HZ3 LYS 30 -6.371 8.608 8.603 264 2HZ LYS 30 HZ2 LYS 30 -6.542 8.646 10.285 265 3HZ LYS 30 HZ1 LYS 30 -7.061 9.937 9.373 266 H VAL 31 HN VAL 31 1.016 7.274 11.429 267 HA VAL 31 HA VAL 31 2.063 5.693 9.358 268 HB VAL 31 HB VAL 31 3.233 6.352 12.094 269 1HG1 VAL 31 3HG1 VAL 31 4.291 4.365 11.174 270 2HG1 VAL 31 2HG1 VAL 31 4.609 5.229 9.670 271 3HG1 VAL 31 1HG1 VAL 31 5.391 5.746 11.165 272 1HG2 VAL 31 3HG2 VAL 31 2.788 8.293 10.716 273 2HG2 VAL 31 2HG2 VAL 31 4.526 8.011 10.874 274 3HG2 VAL 31 1HG2 VAL 31 3.688 7.570 9.386 275 H LEU 32 HN LEU 32 1.103 4.958 12.672 276 HA LEU 32 HA LEU 32 1.757 2.213 12.691 277 1HB LEU 32 HB2 LEU 32 -0.498 3.605 14.128 278 2HB LEU 32 HB1 LEU 32 0.144 2.024 14.517 279 HG LEU 32 HG LEU 32 1.560 4.664 14.798 280 1HD1 LEU 32 HD1 LEU 32 0.563 2.694 16.816 281 2HD1 LEU 32 HD1 LEU 32 1.569 4.097 17.177 282 3HD1 LEU 32 HD1 LEU 32 -0.048 4.328 16.510 283 1HD2 LEU 32 HD2 LEU 32 2.577 1.877 15.330 284 2HD2 LEU 32 HD2 LEU 32 3.162 3.020 14.111 285 3HD2 LEU 32 HD2 LEU 32 3.388 3.371 15.821 286 H LEU 33 HN LEU 33 -1.346 3.757 11.967 287 HA LEU 33 HA LEU 33 -2.694 1.389 11.310 288 1HB LEU 33 HB2 LEU 33 -3.179 4.192 10.321 289 2HB LEU 33 HB1 LEU 33 -4.320 2.863 10.192 290 HG LEU 33 HG LEU 33 -3.323 4.058 12.776 291 1HD1 LEU 33 HD1 LEU 33 -5.966 4.356 11.381 292 2HD1 LEU 33 HD1 LEU 33 -5.580 4.941 13.002 293 3HD1 LEU 33 HD1 LEU 33 -4.731 5.606 11.607 294 1HD2 LEU 33 HD2 LEU 33 -5.438 1.970 12.249 295 2HD2 LEU 33 HD2 LEU 33 -3.878 1.704 13.035 296 3HD2 LEU 33 HD2 LEU 33 -5.092 2.713 13.810 297 H PHE 34 HN PHE 34 -0.965 3.703 9.256 298 HA PHE 34 HA PHE 34 -1.463 2.497 6.798 299 1HB PHE 34 HB2 PHE 34 -0.557 4.744 6.929 300 2HB PHE 34 HB1 PHE 34 0.901 4.152 7.707 301 HD1 PHE 34 HD1 PHE 34 2.768 3.622 6.420 302 HD2 PHE 34 HD2 PHE 34 -1.042 3.915 4.548 303 HE1 PHE 34 HE1 PHE 34 3.834 3.384 4.185 304 HE2 PHE 34 HE2 PHE 34 0.030 3.677 2.343 305 HZ PHE 34 HZ PHE 34 2.473 3.408 2.192 306 H SER 35 HN SER 35 1.329 2.081 8.975 307 HA SER 35 HA SER 35 2.635 0.254 7.312 308 1HB SER 35 HB2 SER 35 3.960 -0.346 9.384 309 2HB SER 35 HB1 SER 35 3.931 1.368 8.966 310 HG SER 35 HG SER 35 2.475 1.741 10.553 311 H ARG 36 HN ARG 36 0.246 -0.266 9.824 312 HA ARG 36 HA ARG 36 0.454 -3.081 9.903 313 1HB ARG 36 HB2 ARG 36 -1.934 -1.327 10.489 314 2HB ARG 36 HB1 ARG 36 -1.816 -3.037 10.896 315 1HG ARG 36 HG2 ARG 36 0.084 -2.532 12.346 316 2HG ARG 36 HG1 ARG 36 -0.086 -0.830 11.883 317 1HD ARG 36 HD2 ARG 36 -1.091 -1.181 14.042 318 2HD ARG 36 HD1 ARG 36 -2.331 -0.787 12.863 319 HE ARG 36 HE ARG 36 -2.207 -3.549 12.903 320 1HH1 ARG 36 1HH1 ARG 36 -3.054 -1.024 15.264 321 2HH1 ARG 36 2HH1 ARG 36 -4.090 -2.054 16.149 322 1HH2 ARG 36 1HH2 ARG 36 -3.582 -4.888 14.132 323 2HH2 ARG 36 2HH2 ARG 36 -4.414 -4.295 15.491 324 H ASP 37 HN ASP 37 -1.735 -0.933 8.106 325 HA ASP 37 HA ASP 37 -3.100 -3.082 6.835 326 1HB ASP 37 HB2 ASP 37 -3.964 -0.724 7.187 327 2HB ASP 37 HB1 ASP 37 -2.965 -0.250 5.830 328 H LEU 38 HN LEU 38 -0.406 -1.075 5.982 329 HA LEU 38 HA LEU 38 0.014 -1.899 3.341 330 1HB LEU 38 HB2 LEU 38 1.125 0.032 4.167 331 2HB LEU 38 HB1 LEU 38 1.829 -0.854 5.495 332 HG LEU 38 HG LEU 38 3.376 -1.962 3.977 333 1HD1 LEU 38 HD1 LEU 38 2.074 -0.330 1.812 334 2HD1 LEU 38 HD1 LEU 38 3.531 -1.330 1.663 335 3HD1 LEU 38 HD1 LEU 38 1.976 -2.088 2.007 336 1HD2 LEU 38 HD2 LEU 38 3.250 1.018 3.617 337 2HD2 LEU 38 HD2 LEU 38 4.024 0.147 4.940 338 3HD2 LEU 38 HD2 LEU 38 4.661 0.011 3.302 339 H ASP 39 HN ASP 39 1.362 -3.123 6.392 340 HA ASP 39 HA ASP 39 2.928 -5.159 5.213 341 1HB ASP 39 HB2 ASP 39 3.268 -4.337 7.521 342 2HB ASP 39 HB1 ASP 39 1.736 -5.061 7.995 343 H LYS 40 HN LYS 40 -0.338 -5.110 6.523 344 HA LYS 40 HA LYS 40 -1.105 -7.711 6.238 345 1HB LYS 40 HB2 LYS 40 -2.217 -6.208 7.523 346 2HB LYS 40 HB1 LYS 40 -2.272 -4.995 6.283 347 1HG LYS 40 HG2 LYS 40 -3.933 -6.180 5.117 348 2HG LYS 40 HG1 LYS 40 -3.879 -7.505 6.310 349 1HD LYS 40 HD2 LYS 40 -4.758 -6.154 8.035 350 2HD LYS 40 HD1 LYS 40 -4.376 -4.665 7.188 351 1HE LYS 40 HE2 LYS 40 -6.485 -6.622 6.292 352 2HE LYS 40 HE1 LYS 40 -6.806 -5.218 7.306 353 1HZ LYS 40 HZ2 LYS 40 -5.975 -3.784 5.509 354 2HZ LYS 40 HZ1 LYS 40 -5.699 -5.134 4.543 355 3HZ LYS 40 HZ3 LYS 40 -7.258 -4.741 5.000 356 H LEU 41 HN LEU 41 -1.090 -5.025 3.917 357 HA LEU 41 HA LEU 41 -2.394 -6.408 1.815 358 1HB LEU 41 HB2 LEU 41 -2.278 -3.956 1.870 359 2HB LEU 41 HB1 LEU 41 -0.538 -4.027 1.773 360 HG LEU 41 HG LEU 41 -0.666 -4.905 -0.499 361 1HD1 LEU 41 HD1 LEU 41 -3.637 -4.662 -0.152 362 2HD1 LEU 41 HD1 LEU 41 -2.800 -5.005 -1.664 363 3HD1 LEU 41 HD1 LEU 41 -2.716 -6.158 -0.332 364 1HD2 LEU 41 HD2 LEU 41 -2.348 -2.441 -0.072 365 2HD2 LEU 41 HD2 LEU 41 -0.590 -2.497 -0.207 366 3HD2 LEU 41 HD2 LEU 41 -1.600 -2.918 -1.593 367 H ILE 42 HN ILE 42 0.857 -5.981 2.824 368 HA ILE 42 HA ILE 42 2.011 -7.083 0.459 369 HB ILE 42 HB ILE 42 3.272 -6.541 3.172 370 1HG1 ILE 42 2HG1 ILE 42 3.461 -5.174 0.498 371 2HG1 ILE 42 1HG1 ILE 42 2.555 -4.586 1.885 372 1HG2 ILE 42 1HG2 ILE 42 4.622 -7.400 0.603 373 2HG2 ILE 42 3HG2 ILE 42 5.445 -6.881 2.072 374 3HG2 ILE 42 2HG2 ILE 42 4.496 -8.365 2.077 375 1HD1 ILE 42 HD1 ILE 42 5.542 -4.937 1.763 376 2HD1 ILE 42 HD1 ILE 42 4.670 -3.408 1.576 377 3HD1 ILE 42 HD1 ILE 42 4.598 -4.278 3.104 378 H ASN 43 HN ASN 43 1.693 -8.447 3.710 379 HA ASN 43 HA ASN 43 2.582 -11.038 3.158 380 1HB ASN 43 HB2 ASN 43 0.418 -10.204 5.113 381 2HB ASN 43 HB1 ASN 43 1.017 -11.847 4.967 382 1HD2 ASN 43 HD2 ASN 43 1.717 -8.641 6.015 383 2HD2 ASN 43 HD2 ASN 43 3.076 -9.020 6.988 384 H LYS 44 HN LYS 44 -0.536 -9.588 2.556 385 HA LYS 44 HA LYS 44 -2.074 -11.817 1.892 386 1HB LYS 44 HB2 LYS 44 -2.941 -9.515 2.153 387 2HB LYS 44 HB1 LYS 44 -2.143 -9.055 0.661 388 1HG LYS 44 HG2 LYS 44 -3.560 -10.822 -0.481 389 2HG LYS 44 HG1 LYS 44 -4.485 -10.905 1.017 390 1HD LYS 44 HD2 LYS 44 -4.095 -8.472 -0.733 391 2HD LYS 44 HD1 LYS 44 -5.578 -9.407 -0.552 392 1HE LYS 44 HE2 LYS 44 -5.646 -8.763 1.832 393 2HE LYS 44 HE1 LYS 44 -4.207 -7.779 1.589 394 1HZ LYS 44 HZ1 LYS 44 -5.478 -6.488 -0.082 395 2HZ LYS 44 HZ3 LYS 44 -6.849 -7.386 0.299 396 3HZ LYS 44 HZ2 LYS 44 -6.136 -6.384 1.452 397 H PHE 45 HN PHE 45 -0.019 -9.789 -0.141 398 HA PHE 45 HA PHE 45 -0.549 -11.431 -2.428 399 1HB PHE 45 HB2 PHE 45 0.924 -8.886 -1.997 400 2HB PHE 45 HB1 PHE 45 1.216 -9.802 -3.472 401 HD1 PHE 45 HD1 PHE 45 -1.272 -7.916 -1.531 402 HD2 PHE 45 HD2 PHE 45 -0.475 -10.034 -5.132 403 HE1 PHE 45 HE1 PHE 45 -3.324 -7.016 -2.512 404 HE2 PHE 45 HE2 PHE 45 -2.534 -9.140 -6.115 405 HZ PHE 45 HZ PHE 45 -3.965 -7.623 -4.804 406 H MET 46 HN MET 46 1.972 -11.095 -0.121 407 HA MET 46 HA MET 46 3.995 -12.489 -1.631 408 1HB MET 46 HB2 MET 46 3.704 -12.455 1.369 409 2HB MET 46 HB1 MET 46 5.162 -12.798 0.453 410 1HG MET 46 HG2 MET 46 4.922 -10.368 -0.393 411 2HG MET 46 HG1 MET 46 3.761 -10.214 0.902 412 1HE MET 46 HE3 MET 46 7.333 -10.630 -0.125 413 2HE MET 46 HE2 MET 46 8.221 -10.982 1.362 414 3HE MET 46 HE1 MET 46 7.140 -12.195 0.660 415 H ASN 47 HN ASN 47 1.457 -13.309 0.559 416 HA ASN 47 HA ASN 47 0.488 -15.097 1.333 417 1HB ASN 47 HB2 ASN 47 0.240 -15.785 -1.104 418 2HB ASN 47 HB1 ASN 47 1.713 -16.732 -0.926 419 1HD2 ASN 47 HD2 ASN 47 1.615 -18.646 0.316 420 2HD2 ASN 47 HD2 ASN 47 0.101 -19.372 0.720 421 H VAL 48 HN VAL 48 2.074 -14.527 2.941 422 HA VAL 48 HA VAL 48 3.603 -16.841 3.696 423 HB VAL 48 HB VAL 48 5.259 -15.371 4.749 424 1HG1 VAL 48 1HG1 VAL 48 5.070 -14.796 1.800 425 2HG1 VAL 48 3HG1 VAL 48 6.509 -14.567 2.795 426 3HG1 VAL 48 2HG1 VAL 48 5.851 -16.185 2.554 427 1HG2 VAL 48 1HG2 VAL 48 3.867 -13.084 3.352 428 2HG2 VAL 48 3HG2 VAL 48 3.910 -13.392 5.087 429 3HG2 VAL 48 2HG2 VAL 48 5.392 -12.960 4.230 430 H LYS 49 HN LYS 49 3.599 -17.117 5.844 431 HA LYS 49 HA LYS 49 2.437 -17.498 7.658 432 1HB LYS 49 HB2 LYS 49 1.215 -14.840 7.123 433 2HB LYS 49 HB1 LYS 49 1.253 -15.684 8.681 434 1HG LYS 49 HG2 LYS 49 3.676 -14.607 7.230 435 2HG LYS 49 HG1 LYS 49 2.794 -13.641 8.383 436 1HD LYS 49 HD2 LYS 49 4.631 -14.468 9.603 437 2HD LYS 49 HD1 LYS 49 3.317 -15.541 10.064 438 1HE LYS 49 HE2 LYS 49 4.150 -17.219 8.472 439 2HE LYS 49 HE1 LYS 49 5.433 -16.115 7.985 440 1HZ LYS 49 HZ3 LYS 49 5.059 -17.227 10.702 441 2HZ LYS 49 HZ2 LYS 49 6.195 -17.771 9.594 442 3HZ LYS 49 HZ1 LYS 49 6.319 -16.224 10.237 443 H ASP 50 HN ASP 50 1.484 -17.757 4.847 444 HA ASP 50 HA ASP 50 -0.168 -18.298 3.446 445 1HB ASP 50 HB2 ASP 50 -0.372 -20.096 5.404 446 2HB ASP 50 HB1 ASP 50 -1.926 -19.303 5.661 447 H LYS 51 HN LYS 51 -2.809 -18.287 3.443 448 HA LYS 51 HA LYS 51 -3.372 -15.412 3.576 449 1HB LYS 51 HB2 LYS 51 -5.137 -15.877 1.995 450 2HB LYS 51 HB1 LYS 51 -3.652 -16.645 1.449 451 1HG LYS 51 HG2 LYS 51 -4.521 -18.771 2.536 452 2HG LYS 51 HG1 LYS 51 -6.065 -17.942 2.694 453 1HD LYS 51 HD2 LYS 51 -6.151 -19.234 0.711 454 2HD LYS 51 HD1 LYS 51 -5.994 -17.547 0.221 455 1HE LYS 51 HE2 LYS 51 -4.529 -18.974 -1.112 456 2HE LYS 51 HE1 LYS 51 -3.581 -17.874 -0.127 457 1HZ LYS 51 HZ2 LYS 51 -3.222 -19.747 1.472 458 2HZ LYS 51 HZ1 LYS 51 -4.110 -20.735 0.435 459 3HZ LYS 51 HZ3 LYS 51 -2.658 -20.086 -0.084 460 H VAL 52 HN VAL 52 -3.505 -17.605 5.652 461 HA VAL 52 HA VAL 52 -6.271 -17.723 6.418 462 HB VAL 52 HB VAL 52 -5.543 -19.020 8.349 463 1HG1 VAL 52 2HG1 VAL 52 -4.167 -19.857 5.808 464 2HG1 VAL 52 1HG1 VAL 52 -4.457 -20.904 7.198 465 3HG1 VAL 52 3HG1 VAL 52 -5.818 -20.238 6.298 466 1HG2 VAL 52 3HG2 VAL 52 -2.713 -18.407 7.456 467 2HG2 VAL 52 2HG2 VAL 52 -3.493 -17.841 8.931 468 3HG2 VAL 52 1HG2 VAL 52 -3.156 -19.558 8.721 469 H HIS 53 HN HIS 53 -7.010 -16.970 8.509 470 HA HIS 53 HA HIS 53 -5.698 -14.473 9.137 471 1HB HIS 53 HB2 HIS 53 -7.833 -13.874 10.385 472 2HB HIS 53 HB1 HIS 53 -7.967 -13.977 8.643 473 HD1 HIS 53 HD1 HIS 53 -9.660 -15.675 7.728 474 HD2 HIS 53 HD2 HIS 53 -9.139 -15.918 11.837 475 HE1 HIS 53 HE1 HIS 53 -11.470 -17.197 8.571 476 H LYS 54 HN LYS 54 -4.101 -14.999 10.380 477 HA LYS 54 HA LYS 54 -4.742 -16.375 12.866 478 1HB LYS 54 HB2 LYS 54 -2.751 -17.205 11.652 479 2HB LYS 54 HB1 LYS 54 -2.050 -15.592 11.743 480 1HG LYS 54 HG2 LYS 54 -2.093 -15.751 14.221 481 2HG LYS 54 HG1 LYS 54 -2.690 -17.399 14.080 482 1HD LYS 54 HD2 LYS 54 -0.290 -17.379 14.504 483 2HD LYS 54 HD1 LYS 54 -0.627 -18.032 12.901 484 1HE LYS 54 HE2 LYS 54 1.286 -16.486 12.873 485 2HE LYS 54 HE1 LYS 54 -0.061 -15.912 11.890 486 1HZ LYS 54 HZ3 LYS 54 0.579 -14.905 14.646 487 2HZ LYS 54 HZ2 LYS 54 0.916 -14.133 13.201 488 3HZ LYS 54 HZ1 LYS 54 -0.666 -14.384 13.631 489 H LEU 55 HN LEU 55 -5.572 -14.953 14.245 490 HA LEU 55 HA LEU 55 -4.668 -12.278 14.329 491 1HB LEU 55 HB2 LEU 55 -6.052 -11.979 16.306 492 2HB LEU 55 HB1 LEU 55 -6.947 -12.886 15.125 493 HG LEU 55 HG LEU 55 -7.562 -13.777 17.166 494 1HD1 LEU 55 HD1 LEU 55 -5.517 -15.675 16.149 495 2HD1 LEU 55 HD1 LEU 55 -6.778 -16.055 17.322 496 3HD1 LEU 55 HD1 LEU 55 -7.215 -15.550 15.688 497 1HD2 LEU 55 HD2 LEU 55 -5.925 -12.756 18.608 498 2HD2 LEU 55 HD2 LEU 55 -6.054 -14.478 18.973 499 3HD2 LEU 55 HD2 LEU 55 -4.683 -13.874 18.039 500 H GLU 56 HN GLU 56 -3.178 -11.380 15.645 501 HA GLU 56 HA GLU 56 -1.256 -13.341 16.492 502 1HB GLU 56 HB2 GLU 56 -0.710 -11.288 15.071 503 2HB GLU 56 HB1 GLU 56 -0.881 -10.351 16.551 504 1HG GLU 56 HG2 GLU 56 1.410 -10.837 16.142 505 2HG GLU 56 HG1 GLU 56 0.877 -11.706 17.589 506 H HIS 57 HN HIS 57 -1.674 -14.159 18.364 507 HA HIS 57 HA HIS 57 -3.026 -12.897 20.514 508 1HB HIS 57 HB2 HIS 57 -1.150 -15.280 20.597 509 2HB HIS 57 HB1 HIS 57 -2.249 -14.804 21.873 510 HD1 HIS 57 HD1 HIS 57 -4.582 -15.809 21.772 511 HD2 HIS 57 HD2 HIS 57 -2.444 -16.267 18.241 512 HE1 HIS 57 HE1 HIS 57 -5.918 -17.406 20.347 513 H HIS 58 HN HIS 58 0.276 -13.615 19.760 514 HA HIS 58 HA HIS 58 1.305 -11.417 21.236 515 1HB HIS 58 HB2 HIS 58 2.895 -12.852 22.542 516 2HB HIS 58 HB1 HIS 58 1.231 -13.085 23.041 517 HD1 HIS 58 HD1 HIS 58 0.292 -15.487 22.855 518 HD2 HIS 58 HD2 HIS 58 4.035 -15.027 21.101 519 HE1 HIS 58 HE1 HIS 58 1.066 -17.799 22.230 520 H HIS 59 HN HIS 59 3.441 -10.997 20.487 521 HA HIS 59 HA HIS 59 4.171 -12.579 18.165 522 1HB HIS 59 HB2 HIS 59 4.795 -10.438 16.956 523 2HB HIS 59 HB1 HIS 59 3.083 -10.771 17.121 524 HD1 HIS 59 HD1 HIS 59 5.565 -8.138 17.682 525 HD2 HIS 59 HD2 HIS 59 1.833 -9.149 19.201 526 HE1 HIS 59 HE1 HIS 59 4.657 -6.065 18.726 527 H HIS 60 HN HIS 60 6.326 -11.727 17.274 528 HA HIS 60 HA HIS 60 8.520 -11.678 17.421 529 1HB HIS 60 HB2 HIS 60 8.150 -9.673 18.985 530 2HB HIS 60 HB1 HIS 60 8.368 -10.793 20.324 531 HD1 HIS 60 HD1 HIS 60 10.824 -10.944 21.154 532 HD2 HIS 60 HD2 HIS 60 10.491 -9.662 17.201 533 HE1 HIS 60 HE1 HIS 60 13.122 -10.403 20.401 534 H HIS 61 HN HIS 61 7.132 -12.917 20.407 535 HA HIS 61 HA HIS 61 7.232 -14.872 21.515 536 1HB HIS 61 HB2 HIS 61 6.682 -15.779 19.179 537 2HB HIS 61 HB1 HIS 61 8.395 -16.110 18.992 538 HD1 HIS 61 HD1 HIS 61 9.099 -18.442 19.718 539 HD2 HIS 61 HD2 HIS 61 5.531 -17.236 21.466 540 HE1 HIS 61 HE1 HIS 61 8.248 -20.430 20.993 541 H HIS 62 HN HIS 62 9.240 -13.073 21.755 542 HA HIS 62 HA HIS 62 11.292 -14.647 22.948 543 1HB HIS 62 HB2 HIS 62 12.117 -14.405 20.586 544 2HB HIS 62 HB1 HIS 62 11.983 -12.661 20.743 545 HD1 HIS 62 HD1 HIS 62 14.256 -15.499 21.410 546 HD2 HIS 62 HD2 HIS 62 13.958 -11.496 22.469 547 HE1 HIS 62 HE1 HIS 62 16.532 -14.834 22.252 548 H1 MET 101 HT3 MET 101 6.479 23.823 -0.490 549 H2 MET 101 HT2 MET 101 6.826 25.179 0.471 550 H3 MET 101 HT1 MET 101 7.641 24.908 -0.976 551 HA MET 101 HA MET 101 9.091 24.277 0.780 552 1HB MET 101 HB2 MET 101 6.933 22.251 1.475 553 2HB MET 101 HB1 MET 101 8.524 22.329 2.190 554 1HG MET 101 HG2 MET 101 7.969 24.528 3.145 555 2HG MET 101 HG1 MET 101 6.349 24.387 2.468 556 1HE MET 101 HE2 MET 101 4.571 22.540 3.228 557 2HE MET 101 HE1 MET 101 5.720 21.240 2.921 558 3HE MET 101 HE3 MET 101 4.885 21.329 4.470 559 H GLU 102 HN GLU 102 10.409 22.320 0.588 560 HA GLU 102 HA GLU 102 10.370 21.286 -2.063 561 1HB GLU 102 HB2 GLU 102 11.957 20.213 0.278 562 2HB GLU 102 HB1 GLU 102 12.305 19.984 -1.421 563 1HG GLU 102 HG2 GLU 102 13.854 21.522 -0.788 564 2HG GLU 102 HG1 GLU 102 12.601 22.546 -1.468 565 H MET 103 HN MET 103 8.781 19.996 -2.531 566 HA MET 103 HA MET 103 8.455 17.564 -0.951 567 1HB MET 103 HB2 MET 103 5.992 17.697 -0.882 568 2HB MET 103 HB1 MET 103 6.758 18.998 0.011 569 1HG MET 103 HG2 MET 103 6.351 20.520 -1.875 570 2HG MET 103 HG1 MET 103 5.548 19.214 -2.740 571 1HE MET 103 HE3 MET 103 3.227 18.145 -1.987 572 2HE MET 103 HE2 MET 103 3.906 17.757 -0.405 573 3HE MET 103 HE1 MET 103 2.368 18.608 -0.520 574 H GLY 104 HN GLY 104 8.569 19.003 -3.948 575 1HA GLY 104 HA1 GLY 104 8.446 18.140 -6.058 576 2HA GLY 104 HA2 GLY 104 7.119 17.128 -5.482 577 H GLN 105 HN GLN 105 10.420 17.345 -4.363 578 HA GLN 105 HA GLN 105 11.324 14.934 -5.555 579 1HB GLN 105 HB2 GLN 105 13.324 15.230 -4.215 580 2HB GLN 105 HB1 GLN 105 12.794 16.779 -4.866 581 1HG GLN 105 HG2 GLN 105 11.868 17.383 -2.715 582 2HG GLN 105 HG1 GLN 105 12.365 15.825 -2.054 583 1HE2 GLN 105 1HE2 GLN 105 14.567 15.425 -1.769 584 2HE2 GLN 105 2HE2 GLN 105 15.716 16.708 -1.691 585 H LEU 106 HN LEU 106 9.731 15.715 -2.628 586 HA LEU 106 HA LEU 106 10.289 13.331 -1.202 587 1HB LEU 106 HB2 LEU 106 9.659 15.422 -0.071 588 2HB LEU 106 HB1 LEU 106 8.117 15.413 -0.882 589 HG LEU 106 HG LEU 106 8.182 14.816 1.607 590 1HD1 LEU 106 HD1 LEU 106 6.193 14.496 0.275 591 2HD1 LEU 106 HD1 LEU 106 6.793 12.936 -0.281 592 3HD1 LEU 106 HD1 LEU 106 6.398 13.171 1.419 593 1HD2 LEU 106 HD2 LEU 106 9.176 12.198 0.486 594 2HD2 LEU 106 HD2 LEU 106 10.055 13.283 1.563 595 3HD2 LEU 106 HD2 LEU 106 8.605 12.458 2.134 596 H LYS 107 HN LYS 107 7.534 14.464 -3.114 597 HA LYS 107 HA LYS 107 6.068 12.059 -2.819 598 1HB LYS 107 HB2 LYS 107 5.521 14.573 -3.834 599 2HB LYS 107 HB1 LYS 107 5.556 13.561 -5.272 600 1HG LYS 107 HG2 LYS 107 3.883 12.991 -2.854 601 2HG LYS 107 HG1 LYS 107 3.289 13.825 -4.285 602 1HD LYS 107 HD2 LYS 107 4.434 11.029 -4.272 603 2HD LYS 107 HD1 LYS 107 2.713 11.392 -4.183 604 1HE LYS 107 HE2 LYS 107 4.559 12.190 -6.418 605 2HE LYS 107 HE1 LYS 107 3.457 10.819 -6.463 606 1HZ LYS 107 HZ2 LYS 107 1.623 12.440 -6.129 607 2HZ LYS 107 HZ1 LYS 107 2.729 13.699 -6.287 608 3HZ LYS 107 HZ3 LYS 107 2.437 12.644 -7.572 609 H ASN 108 HN ASN 108 8.484 13.195 -5.065 610 HA ASN 108 HA ASN 108 8.285 11.198 -7.032 611 1HB ASN 108 HB2 ASN 108 9.653 13.274 -7.292 612 2HB ASN 108 HB1 ASN 108 10.758 12.689 -6.064 613 1HD2 ASN 108 HD2 ASN 108 11.237 13.454 -8.864 614 2HD2 ASN 108 HD2 ASN 108 11.957 12.079 -9.605 615 H LYS 109 HN LYS 109 10.163 11.390 -4.027 616 HA LYS 109 HA LYS 109 11.238 8.806 -4.383 617 1HB LYS 109 HB2 LYS 109 11.229 10.598 -1.969 618 2HB LYS 109 HB1 LYS 109 11.986 9.011 -1.977 619 1HG LYS 109 HG2 LYS 109 12.710 11.334 -3.761 620 2HG LYS 109 HG1 LYS 109 13.630 10.755 -2.369 621 1HD LYS 109 HD2 LYS 109 13.979 8.601 -3.503 622 2HD LYS 109 HD1 LYS 109 13.059 9.179 -4.890 623 1HE LYS 109 HE2 LYS 109 14.699 10.956 -5.233 624 2HE LYS 109 HE1 LYS 109 15.641 10.349 -3.870 625 1HZ LYS 109 HZ1 LYS 109 15.881 8.252 -5.078 626 2HZ LYS 109 HZ3 LYS 109 15.064 8.911 -6.406 627 3HZ LYS 109 HZ2 LYS 109 16.557 9.543 -5.901 628 H ILE 110 HN ILE 110 8.360 9.910 -2.743 629 HA ILE 110 HA ILE 110 7.797 7.490 -1.407 630 HB ILE 110 HB ILE 110 5.859 9.522 -2.575 631 1HG1 ILE 110 2HG1 ILE 110 6.809 9.038 0.257 632 2HG1 ILE 110 1HG1 ILE 110 7.265 10.389 -0.773 633 1HG2 ILE 110 3HG2 ILE 110 5.239 7.219 -0.718 634 2HG2 ILE 110 2HG2 ILE 110 4.112 8.496 -1.175 635 3HG2 ILE 110 1HG2 ILE 110 4.717 7.378 -2.397 636 1HD1 ILE 110 HD1 ILE 110 4.498 9.817 0.274 637 2HD1 ILE 110 HD1 ILE 110 5.619 11.031 0.892 638 3HD1 ILE 110 HD1 ILE 110 4.962 11.191 -0.737 639 H GLU 111 HN GLU 111 6.777 8.582 -4.621 640 HA GLU 111 HA GLU 111 5.538 6.210 -5.480 641 1HB GLU 111 HB2 GLU 111 6.951 8.402 -6.981 642 2HB GLU 111 HB1 GLU 111 6.153 7.062 -7.790 643 1HG GLU 111 HG2 GLU 111 4.800 8.986 -5.919 644 2HG GLU 111 HG1 GLU 111 4.788 9.113 -7.680 645 H ASN 112 HN ASN 112 8.830 7.329 -5.871 646 HA ASN 112 HA ASN 112 9.850 5.175 -7.307 647 1HB ASN 112 HB2 ASN 112 11.067 7.264 -7.077 648 2HB ASN 112 HB1 ASN 112 11.230 7.003 -5.346 649 1HD2 ASN 112 HD2 ASN 112 12.755 5.561 -4.600 650 2HD2 ASN 112 HD2 ASN 112 13.968 4.885 -5.592 651 H LYS 113 HN LYS 113 9.745 5.662 -3.778 652 HA LYS 113 HA LYS 113 11.213 3.324 -3.138 653 1HB LYS 113 HB2 LYS 113 10.763 5.403 -1.675 654 2HB LYS 113 HB1 LYS 113 9.217 4.664 -1.335 655 1HG LYS 113 HG2 LYS 113 10.780 4.157 0.464 656 2HG LYS 113 HG1 LYS 113 10.346 2.692 -0.422 657 1HD LYS 113 HD2 LYS 113 12.729 2.807 0.098 658 2HD LYS 113 HD1 LYS 113 12.433 2.761 -1.637 659 1HE LYS 113 HE2 LYS 113 12.745 5.161 -1.748 660 2HE LYS 113 HE1 LYS 113 13.048 5.225 -0.001 661 1HZ LYS 113 HZ2 LYS 113 14.942 3.745 -0.398 662 2HZ LYS 113 HZ1 LYS 113 14.626 3.844 -2.082 663 3HZ LYS 113 HZ3 LYS 113 15.093 5.220 -1.208 664 H LYS 114 HN LYS 114 7.793 4.074 -3.316 665 HA LYS 114 HA LYS 114 6.579 1.745 -2.530 666 1HB LYS 114 HB2 LYS 114 5.511 3.915 -3.154 667 2HB LYS 114 HB1 LYS 114 5.884 3.577 -4.830 668 1HG LYS 114 HG2 LYS 114 4.412 1.582 -4.689 669 2HG LYS 114 HG1 LYS 114 3.981 2.068 -3.048 670 1HD LYS 114 HD2 LYS 114 2.248 2.907 -4.478 671 2HD LYS 114 HD1 LYS 114 3.249 4.291 -4.028 672 1HE LYS 114 HE2 LYS 114 4.487 4.012 -6.175 673 2HE LYS 114 HE1 LYS 114 3.337 2.727 -6.559 674 1HZ LYS 114 HZ1 LYS 114 1.528 4.436 -6.568 675 2HZ LYS 114 HZ3 LYS 114 2.676 5.612 -6.161 676 3HZ LYS 114 HZ2 LYS 114 2.775 4.821 -7.601 677 H LYS 115 HN LYS 115 7.706 2.745 -5.732 678 HA LYS 115 HA LYS 115 7.130 0.310 -7.048 679 1HB LYS 115 HB2 LYS 115 9.041 2.511 -7.829 680 2HB LYS 115 HB1 LYS 115 8.509 1.196 -8.876 681 1HG LYS 115 HG2 LYS 115 6.254 1.976 -8.831 682 2HG LYS 115 HG1 LYS 115 6.642 3.171 -7.603 683 1HD LYS 115 HD2 LYS 115 6.541 4.418 -9.558 684 2HD LYS 115 HD1 LYS 115 8.260 4.147 -9.334 685 1HE LYS 115 HE2 LYS 115 6.484 2.543 -11.181 686 2HE LYS 115 HE1 LYS 115 7.484 3.891 -11.689 687 1HZ LYS 115 HZ3 LYS 115 9.452 2.588 -11.043 688 2HZ LYS 115 HZ2 LYS 115 8.475 1.289 -10.610 689 3HZ LYS 115 HZ1 LYS 115 8.525 1.805 -12.190 690 H GLU 116 HN GLU 116 10.084 1.514 -5.511 691 HA GLU 116 HA GLU 116 11.834 -0.571 -6.167 692 1HB GLU 116 HB2 GLU 116 11.627 0.990 -3.576 693 2HB GLU 116 HB1 GLU 116 12.896 -0.172 -3.905 694 1HG GLU 116 HG2 GLU 116 13.520 1.286 -5.865 695 2HG GLU 116 HG1 GLU 116 12.389 2.475 -5.212 696 H LEU 117 HN LEU 117 9.492 -0.295 -3.615 697 HA LEU 117 HA LEU 117 10.036 -2.801 -2.455 698 1HB LEU 117 HB2 LEU 117 9.139 -1.155 -1.050 699 2HB LEU 117 HB1 LEU 117 7.870 -0.754 -2.173 700 HG LEU 117 HG LEU 117 7.120 -1.892 -0.058 701 1HD1 LEU 117 HD1 LEU 117 5.721 -1.692 -1.856 702 2HD1 LEU 117 HD1 LEU 117 6.326 -3.188 -2.562 703 3HD1 LEU 117 HD1 LEU 117 5.469 -3.227 -1.007 704 1HD2 LEU 117 HD2 LEU 117 8.406 -4.300 -1.291 705 2HD2 LEU 117 HD2 LEU 117 8.921 -3.492 0.192 706 3HD2 LEU 117 HD2 LEU 117 7.346 -4.286 0.126 707 H ILE 118 HN ILE 118 7.592 -1.670 -4.732 708 HA ILE 118 HA ILE 118 6.107 -3.981 -4.780 709 HB ILE 118 HB ILE 118 6.564 -2.084 -7.109 710 1HG1 ILE 118 2HG1 ILE 118 4.184 -2.255 -5.269 711 2HG1 ILE 118 1HG1 ILE 118 5.556 -1.215 -4.914 712 1HG2 ILE 118 2HG2 ILE 118 4.441 -4.218 -6.702 713 2HG2 ILE 118 1HG2 ILE 118 4.447 -3.033 -8.020 714 3HG2 ILE 118 3HG2 ILE 118 5.719 -4.247 -7.894 715 1HD1 ILE 118 HD1 ILE 118 3.856 -1.053 -7.391 716 2HD1 ILE 118 HD1 ILE 118 3.714 -0.016 -5.963 717 3HD1 ILE 118 HD1 ILE 118 5.179 0.017 -6.934 718 H GLN 119 HN GLN 119 8.947 -3.081 -6.692 719 HA GLN 119 HA GLN 119 9.059 -5.406 -8.265 720 1HB GLN 119 HB2 GLN 119 11.282 -3.605 -7.334 721 2HB GLN 119 HB1 GLN 119 11.459 -4.876 -8.534 722 1HG GLN 119 HG2 GLN 119 9.834 -3.727 -9.966 723 2HG GLN 119 HG1 GLN 119 9.703 -2.445 -8.762 724 1HE2 GLN 119 1HE2 GLN 119 12.702 -4.078 -9.555 725 2HE2 GLN 119 2HE2 GLN 119 13.473 -2.720 -10.244 726 H LEU 120 HN LEU 120 10.079 -4.766 -4.997 727 HA LEU 120 HA LEU 120 11.634 -7.127 -4.769 728 1HB LEU 120 HB2 LEU 120 10.475 -5.362 -2.614 729 2HB LEU 120 HB1 LEU 120 11.529 -6.731 -2.321 730 HG LEU 120 HG LEU 120 12.294 -4.236 -3.837 731 1HD1 LEU 120 HD1 LEU 120 12.007 -3.844 -1.454 732 2HD1 LEU 120 HD1 LEU 120 13.066 -5.207 -1.090 733 3HD1 LEU 120 HD1 LEU 120 13.710 -3.783 -1.907 734 1HD2 LEU 120 HD2 LEU 120 13.928 -6.645 -3.020 735 2HD2 LEU 120 HD2 LEU 120 13.499 -6.175 -4.667 736 3HD2 LEU 120 HD2 LEU 120 14.570 -5.156 -3.715 737 H VAL 121 HN VAL 121 8.252 -6.321 -3.543 738 HA VAL 121 HA VAL 121 7.832 -8.959 -2.775 739 HB VAL 121 HB VAL 121 5.650 -8.450 -2.476 740 1HG1 VAL 121 2HG1 VAL 121 6.919 -7.087 -1.064 741 2HG1 VAL 121 1HG1 VAL 121 6.985 -5.822 -2.299 742 3HG1 VAL 121 3HG1 VAL 121 5.445 -6.227 -1.542 743 1HG2 VAL 121 3HG2 VAL 121 5.018 -7.957 -4.683 744 2HG2 VAL 121 2HG2 VAL 121 4.321 -6.755 -3.587 745 3HG2 VAL 121 1HG2 VAL 121 5.730 -6.339 -4.603 746 H ALA 122 HN ALA 122 7.706 -7.474 -5.911 747 HA ALA 122 HA ALA 122 6.173 -9.447 -7.211 748 1HB ALA 122 HB1 ALA 122 8.232 -7.603 -8.393 749 2HB ALA 122 HB3 ALA 122 6.926 -8.416 -9.278 750 3HB ALA 122 HB2 ALA 122 6.560 -7.185 -8.061 751 H ARG 123 HN ARG 123 9.669 -8.949 -6.913 752 HA ARG 123 HA ARG 123 10.337 -11.292 -8.382 753 1HB ARG 123 HB2 ARG 123 12.624 -10.892 -7.737 754 2HB ARG 123 HB1 ARG 123 11.878 -9.361 -8.174 755 1HG ARG 123 HG2 ARG 123 11.532 -8.984 -5.705 756 2HG ARG 123 HG1 ARG 123 12.563 -10.392 -5.443 757 1HD ARG 123 HD2 ARG 123 13.326 -7.852 -6.883 758 2HD ARG 123 HD1 ARG 123 13.872 -8.355 -5.287 759 HE ARG 123 HE ARG 123 14.533 -10.346 -7.143 760 1HH1 ARG 123 1HH1 ARG 123 15.469 -7.024 -6.347 761 2HH1 ARG 123 2HH1 ARG 123 17.060 -7.190 -6.897 762 1HH2 ARG 123 1HH2 ARG 123 16.701 -10.568 -7.935 763 2HH2 ARG 123 2HH2 ARG 123 17.796 -9.275 -7.831 764 H HIS 124 HN HIS 124 9.181 -10.868 -5.275 765 HA HIS 124 HA HIS 124 10.247 -13.102 -3.926 766 1HB HIS 124 HB2 HIS 124 8.908 -11.449 -2.721 767 2HB HIS 124 HB1 HIS 124 7.515 -11.774 -3.738 768 HD1 HIS 124 HD1 HIS 124 6.029 -13.817 -3.071 769 HD2 HIS 124 HD2 HIS 124 9.411 -13.325 -0.727 770 HE1 HIS 124 HE1 HIS 124 5.762 -15.371 -1.124 771 H GLY 125 HN GLY 125 7.729 -12.706 -6.309 772 1HA GLY 125 HA1 GLY 125 7.196 -15.580 -6.231 773 2HA GLY 125 HA2 GLY 125 7.782 -14.853 -7.720 774 H LEU 126 HN LEU 126 6.287 -12.414 -7.646 775 HA LEU 126 HA LEU 126 3.549 -13.395 -7.637 776 1HB LEU 126 HB2 LEU 126 4.659 -10.633 -7.974 777 2HB LEU 126 HB1 LEU 126 2.980 -11.002 -8.225 778 HG LEU 126 HG LEU 126 4.547 -11.165 -5.753 779 1HD1 LEU 126 HD1 LEU 126 3.859 -8.941 -6.281 780 2HD1 LEU 126 HD1 LEU 126 2.190 -9.460 -6.487 781 3HD1 LEU 126 HD1 LEU 126 2.939 -9.517 -4.889 782 1HD2 LEU 126 HD2 LEU 126 1.763 -12.188 -6.213 783 2HD2 LEU 126 HD2 LEU 126 3.178 -13.054 -5.618 784 3HD2 LEU 126 HD2 LEU 126 2.425 -11.836 -4.612 785 H ASP 127 HN ASP 127 2.292 -13.399 -9.279 786 HA ASP 127 HA ASP 127 3.272 -13.553 -11.981 787 1HB ASP 127 HB2 ASP 127 1.234 -14.799 -11.198 788 2HB ASP 127 HB1 ASP 127 0.437 -13.264 -10.915 789 H HIS 128 HN HIS 128 2.534 -11.986 -13.669 790 HA HIS 128 HA HIS 128 3.033 -9.332 -12.997 791 1HB HIS 128 HB2 HIS 128 1.675 -10.515 -15.414 792 2HB HIS 128 HB1 HIS 128 1.908 -8.784 -15.230 793 HD1 HIS 128 HD1 HIS 128 4.004 -7.942 -16.279 794 HD2 HIS 128 HD2 HIS 128 4.292 -11.936 -15.177 795 HE1 HIS 128 HE1 HIS 128 6.282 -8.715 -17.040 796 H ASP 129 HN ASP 129 -0.026 -11.100 -13.040 797 HA ASP 129 HA ASP 129 -1.616 -8.730 -12.943 798 1HB ASP 129 HB2 ASP 129 -2.518 -10.895 -13.742 799 2HB ASP 129 HB1 ASP 129 -2.357 -11.544 -12.114 800 H LYS 130 HN LYS 130 -0.151 -10.819 -10.618 801 HA LYS 130 HA LYS 130 -1.410 -9.812 -8.280 802 1HB LYS 130 HB2 LYS 130 1.201 -11.212 -8.751 803 2HB LYS 130 HB1 LYS 130 0.746 -10.766 -7.143 804 1HG LYS 130 HG2 LYS 130 -0.767 -12.619 -8.995 805 2HG LYS 130 HG1 LYS 130 0.256 -13.094 -7.642 806 1HD LYS 130 HD2 LYS 130 -1.262 -11.977 -6.085 807 2HD LYS 130 HD1 LYS 130 -2.291 -11.480 -7.426 808 1HE LYS 130 HE2 LYS 130 -2.660 -13.857 -7.980 809 2HE LYS 130 HE1 LYS 130 -1.667 -14.308 -6.603 810 1HZ LYS 130 HZ3 LYS 130 -4.223 -12.782 -6.424 811 2HZ LYS 130 HZ2 LYS 130 -4.020 -14.406 -6.065 812 3HZ LYS 130 HZ1 LYS 130 -3.251 -13.270 -5.131 813 H VAL 131 HN VAL 131 1.598 -9.008 -9.949 814 HA VAL 131 HA VAL 131 2.501 -7.007 -8.222 815 HB VAL 131 HB VAL 131 2.886 -7.081 -11.236 816 1HG1 VAL 131 2HG1 VAL 131 4.575 -5.840 -9.090 817 2HG1 VAL 131 1HG1 VAL 131 4.977 -5.920 -10.806 818 3HG1 VAL 131 3HG1 VAL 131 3.578 -4.988 -10.270 819 1HG2 VAL 131 3HG2 VAL 131 4.505 -8.433 -9.089 820 2HG2 VAL 131 2HG2 VAL 131 3.473 -9.222 -10.279 821 3HG2 VAL 131 1HG2 VAL 131 4.924 -8.362 -10.805 822 H LEU 132 HN LEU 132 0.351 -6.864 -11.022 823 HA LEU 132 HA LEU 132 -0.034 -4.070 -11.070 824 1HB LEU 132 HB2 LEU 132 -1.925 -6.231 -11.926 825 2HB LEU 132 HB1 LEU 132 -2.013 -4.548 -12.404 826 HG LEU 132 HG LEU 132 0.124 -6.526 -13.138 827 1HD1 LEU 132 HD1 LEU 132 -1.938 -6.877 -14.290 828 2HD1 LEU 132 HD1 LEU 132 -1.986 -5.179 -14.774 829 3HD1 LEU 132 HD1 LEU 132 -0.706 -6.244 -15.381 830 1HD2 LEU 132 HD2 LEU 132 -0.127 -3.609 -13.852 831 2HD2 LEU 132 HD2 LEU 132 1.127 -4.360 -12.863 832 3HD2 LEU 132 HD2 LEU 132 1.018 -4.746 -14.581 833 H LEU 133 HN LEU 133 -1.937 -6.647 -9.555 834 HA LEU 133 HA LEU 133 -3.944 -5.015 -8.450 835 1HB LEU 133 HB2 LEU 133 -2.804 -7.633 -7.530 836 2HB LEU 133 HB1 LEU 133 -4.210 -6.886 -6.801 837 HG LEU 133 HG LEU 133 -4.051 -7.728 -9.686 838 1HD1 LEU 133 HD1 LEU 133 -5.248 -9.124 -7.299 839 2HD1 LEU 133 HD1 LEU 133 -5.441 -9.609 -8.988 840 3HD1 LEU 133 HD1 LEU 133 -3.848 -9.649 -8.242 841 1HD2 LEU 133 HD2 LEU 133 -6.355 -6.920 -7.916 842 2HD2 LEU 133 HD2 LEU 133 -5.669 -5.966 -9.230 843 3HD2 LEU 133 HD2 LEU 133 -6.485 -7.482 -9.583 844 H PHE 134 HN PHE 134 -0.943 -6.227 -7.069 845 HA PHE 134 HA PHE 134 -1.242 -5.042 -4.566 846 1HB PHE 134 HB2 PHE 134 0.356 -6.833 -4.941 847 2HB PHE 134 HB1 PHE 134 1.280 -5.822 -6.042 848 HD1 PHE 134 HD1 PHE 134 0.199 -6.162 -2.522 849 HD2 PHE 134 HD2 PHE 134 2.932 -4.380 -5.243 850 HE1 PHE 134 HE1 PHE 134 1.529 -5.320 -0.638 851 HE2 PHE 134 HE2 PHE 134 4.265 -3.542 -3.352 852 HZ PHE 134 HZ PHE 134 3.569 -4.001 -1.074 853 H SER 135 HN SER 135 0.545 -3.895 -7.431 854 HA SER 135 HA SER 135 1.543 -1.598 -6.233 855 1HB SER 135 HB2 SER 135 1.905 -0.770 -8.569 856 2HB SER 135 HB1 SER 135 2.511 -2.398 -8.272 857 HG SER 135 HG SER 135 0.959 -3.243 -9.427 858 H ARG 136 HN ARG 136 -1.509 -2.081 -7.949 859 HA ARG 136 HA ARG 136 -2.121 0.691 -7.856 860 1HB ARG 136 HB2 ARG 136 -4.300 0.127 -8.751 861 2HB ARG 136 HB1 ARG 136 -3.049 -0.739 -9.619 862 1HG ARG 136 HG2 ARG 136 -3.591 -2.736 -8.192 863 2HG ARG 136 HG1 ARG 136 -4.977 -1.830 -7.588 864 1HD ARG 136 HD2 ARG 136 -4.427 -2.575 -10.456 865 2HD ARG 136 HD1 ARG 136 -5.638 -3.290 -9.398 866 HE ARG 136 HE ARG 136 -6.196 -0.615 -9.415 867 1HH1 ARG 136 1HH1 ARG 136 -6.130 -3.204 -11.839 868 2HH1 ARG 136 2HH1 ARG 136 -7.155 -2.413 -12.927 869 1HH2 ARG 136 1HH2 ARG 136 -7.638 0.443 -10.862 870 2HH2 ARG 136 2HH2 ARG 136 -8.063 -0.287 -12.351 871 H ASP 137 HN ASP 137 -3.002 -2.065 -5.807 872 HA ASP 137 HA ASP 137 -4.880 -0.546 -4.276 873 1HB ASP 137 HB2 ASP 137 -4.839 -3.084 -4.500 874 2HB ASP 137 HB1 ASP 137 -3.465 -3.071 -3.416 875 H LEU 138 HN LEU 138 -1.496 -1.225 -4.074 876 HA LEU 138 HA LEU 138 -0.986 -0.067 -1.536 877 1HB LEU 138 HB2 LEU 138 0.629 -1.553 -2.489 878 2HB LEU 138 HB1 LEU 138 0.720 -0.614 -3.956 879 HG LEU 138 HG LEU 138 1.927 1.151 -2.785 880 1HD1 LEU 138 HD1 LEU 138 1.713 -0.622 -0.377 881 2HD1 LEU 138 HD1 LEU 138 2.687 0.845 -0.523 882 3HD1 LEU 138 HD1 LEU 138 0.926 0.952 -0.604 883 1HD2 LEU 138 HD2 LEU 138 3.058 -1.589 -2.298 884 2HD2 LEU 138 HD2 LEU 138 3.191 -0.652 -3.785 885 3HD2 LEU 138 HD2 LEU 138 3.975 -0.085 -2.309 886 H ASP 139 HN ASP 139 -0.899 1.146 -4.838 887 HA ASP 139 HA ASP 139 -0.005 3.761 -4.412 888 1HB ASP 139 HB2 ASP 139 -0.326 2.675 -6.631 889 2HB ASP 139 HB1 ASP 139 -2.064 2.794 -6.410 890 H LYS 140 HN LYS 140 -3.241 2.422 -4.462 891 HA LYS 140 HA LYS 140 -4.701 4.721 -3.822 892 1HB LYS 140 HB2 LYS 140 -5.303 1.827 -3.267 893 2HB LYS 140 HB1 LYS 140 -6.447 3.153 -3.107 894 1HG LYS 140 HG2 LYS 140 -6.386 3.573 -5.469 895 2HG LYS 140 HG1 LYS 140 -5.043 2.453 -5.683 896 1HD LYS 140 HD2 LYS 140 -7.081 1.397 -6.417 897 2HD LYS 140 HD1 LYS 140 -6.526 0.606 -4.947 898 1HE LYS 140 HE2 LYS 140 -8.902 0.922 -4.868 899 2HE LYS 140 HE1 LYS 140 -8.127 1.940 -3.656 900 1HZ LYS 140 HZ2 LYS 140 -9.104 2.849 -6.315 901 2HZ LYS 140 HZ1 LYS 140 -9.867 3.120 -4.841 902 3HZ LYS 140 HZ3 LYS 140 -8.382 3.838 -5.161 903 H LEU 141 HN LEU 141 -3.272 2.216 -1.739 904 HA LEU 141 HA LEU 141 -4.369 3.118 0.683 905 1HB LEU 141 HB2 LEU 141 -3.394 0.889 0.472 906 2HB LEU 141 HB1 LEU 141 -1.817 1.585 0.177 907 HG LEU 141 HG LEU 141 -1.745 2.447 2.467 908 1HD1 LEU 141 HD1 LEU 141 -4.114 2.811 2.836 909 2HD1 LEU 141 HD1 LEU 141 -4.389 1.069 2.815 910 3HD1 LEU 141 HD1 LEU 141 -3.429 1.793 4.102 911 1HD2 LEU 141 HD2 LEU 141 -2.418 -0.479 2.283 912 2HD2 LEU 141 HD2 LEU 141 -0.821 0.244 2.059 913 3HD2 LEU 141 HD2 LEU 141 -1.609 0.285 3.643 914 H ILE 142 HN ILE 142 -1.386 3.885 -0.955 915 HA ILE 142 HA ILE 142 -0.374 5.507 1.140 916 HB ILE 142 HB ILE 142 0.381 5.463 -1.802 917 1HG1 ILE 142 2HG1 ILE 142 1.666 4.298 0.661 918 2HG1 ILE 142 1HG1 ILE 142 0.835 3.389 -0.592 919 1HG2 ILE 142 1HG2 ILE 142 1.775 6.833 0.508 920 2HG2 ILE 142 3HG2 ILE 142 2.409 6.690 -1.131 921 3HG2 ILE 142 2HG2 ILE 142 0.953 7.639 -0.831 922 1HD1 ILE 142 HD1 ILE 142 3.373 4.963 -0.948 923 2HD1 ILE 142 HD1 ILE 142 3.255 3.211 -0.774 924 3HD1 ILE 142 HD1 ILE 142 2.551 3.999 -2.182 925 H ASN 143 HN ASN 143 -1.861 6.375 -1.939 926 HA ASN 143 HA ASN 143 -2.058 9.120 -1.519 927 1HB ASN 143 HB2 ASN 143 -3.779 7.273 -3.160 928 2HB ASN 143 HB1 ASN 143 -3.987 9.018 -3.173 929 1HD2 ASN 143 HD2 ASN 143 -3.148 7.148 -5.304 930 2HD2 ASN 143 HD2 ASN 143 -1.642 7.736 -5.860 931 H LYS 144 HN LYS 144 -4.040 6.575 -0.301 932 HA LYS 144 HA LYS 144 -6.239 8.059 0.629 933 1HB LYS 144 HB2 LYS 144 -6.165 5.605 0.554 934 2HB LYS 144 HB1 LYS 144 -4.940 5.593 1.809 935 1HG LYS 144 HG2 LYS 144 -6.610 6.709 3.327 936 2HG LYS 144 HG1 LYS 144 -7.818 6.442 2.075 937 1HD LYS 144 HD2 LYS 144 -6.208 4.291 3.466 938 2HD LYS 144 HD1 LYS 144 -7.894 4.687 3.786 939 1HE LYS 144 HE2 LYS 144 -8.446 4.072 1.465 940 2HE LYS 144 HE1 LYS 144 -6.763 3.639 1.193 941 1HZ LYS 144 HZ2 LYS 144 -8.531 2.345 3.205 942 2HZ LYS 144 HZ1 LYS 144 -8.145 1.696 1.710 943 3HZ LYS 144 HZ3 LYS 144 -6.956 1.909 2.870 944 H PHE 145 HN PHE 145 -3.242 7.048 2.261 945 HA PHE 145 HA PHE 145 -3.842 8.591 4.580 946 1HB PHE 145 HB2 PHE 145 -1.521 6.887 3.775 947 2HB PHE 145 HB1 PHE 145 -1.412 7.953 5.173 948 HD1 PHE 145 HD1 PHE 145 -3.472 5.175 3.742 949 HD2 PHE 145 HD2 PHE 145 -2.248 7.321 7.205 950 HE1 PHE 145 HE1 PHE 145 -4.596 3.517 5.165 951 HE2 PHE 145 HE2 PHE 145 -3.371 5.661 8.636 952 HZ PHE 145 HZ PHE 145 -4.548 3.755 7.611 953 H MET 146 HN MET 146 -2.004 9.149 1.717 954 HA MET 146 HA MET 146 -0.655 11.534 2.572 955 1HB MET 146 HB2 MET 146 -1.675 10.925 -0.218 956 2HB MET 146 HB1 MET 146 -0.445 12.098 0.215 957 1HG MET 146 HG2 MET 146 0.979 10.157 0.993 958 2HG MET 146 HG1 MET 146 -0.266 9.114 0.346 959 1HE MET 146 HE1 MET 146 2.525 11.654 -0.443 960 2HE MET 146 HE3 MET 146 2.359 11.895 -2.180 961 3HE MET 146 HE2 MET 146 1.122 12.513 -1.085 962 H ASN 147 HN ASN 147 -3.827 10.679 1.812 963 HA ASN 147 HA ASN 147 -5.796 11.642 1.670 964 1HB ASN 147 HB2 ASN 147 -5.178 12.432 3.956 965 2HB ASN 147 HB1 ASN 147 -4.543 13.905 3.242 966 1HD2 ASN 147 HD2 ASN 147 -7.491 12.183 2.347 967 2HD2 ASN 147 HD2 ASN 147 -8.565 13.468 2.789 968 H VAL 148 HN VAL 148 -5.365 11.742 -0.512 969 HA VAL 148 HA VAL 148 -4.410 14.149 -1.660 970 HB VAL 148 HB VAL 148 -4.898 13.087 -3.879 971 1HG1 VAL 148 3HG1 VAL 148 -2.709 12.908 -2.848 972 2HG1 VAL 148 2HG1 VAL 148 -3.226 11.480 -1.952 973 3HG1 VAL 148 1HG1 VAL 148 -3.103 11.421 -3.710 974 1HG2 VAL 148 1HG2 VAL 148 -6.741 11.635 -3.195 975 2HG2 VAL 148 3HG2 VAL 148 -5.451 10.694 -3.950 976 3HG2 VAL 148 2HG2 VAL 148 -5.639 10.686 -2.192 977 H LYS 149 HN LYS 149 -5.455 15.793 -1.886 978 HA LYS 149 HA LYS 149 -8.353 15.659 -2.162 979 1HB LYS 149 HB2 LYS 149 -6.601 17.979 -1.347 980 2HB LYS 149 HB1 LYS 149 -8.361 17.978 -1.383 981 1HG LYS 149 HG2 LYS 149 -8.401 16.255 0.335 982 2HG LYS 149 HG1 LYS 149 -6.652 16.223 0.375 983 1HD LYS 149 HD2 LYS 149 -6.626 18.596 1.076 984 2HD LYS 149 HD1 LYS 149 -8.386 18.627 1.003 985 1HE LYS 149 HE2 LYS 149 -8.502 16.924 2.727 986 2HE LYS 149 HE1 LYS 149 -6.749 16.860 2.800 987 1HZ LYS 149 HZ3 LYS 149 -8.379 19.261 3.467 988 2HZ LYS 149 HZ2 LYS 149 -7.654 18.236 4.590 989 3HZ LYS 149 HZ1 LYS 149 -6.706 19.132 3.546 990 H ASP 150 HN ASP 150 -7.854 14.986 -4.272 991 HA ASP 150 HA ASP 150 -7.251 17.170 -6.168 992 1HB ASP 150 HB2 ASP 150 -5.368 15.439 -5.816 993 2HB ASP 150 HB1 ASP 150 -6.470 14.263 -6.518 994 H LYS 151 HN LYS 151 -7.866 15.866 -8.421 995 HA LYS 151 HA LYS 151 -10.730 15.994 -8.361 996 1HB LYS 151 HB2 LYS 151 -10.578 15.650 -10.797 997 2HB LYS 151 HB1 LYS 151 -9.518 16.932 -10.235 998 1HG LYS 151 HG2 LYS 151 -7.601 15.470 -10.427 999 2HG LYS 151 HG1 LYS 151 -8.645 14.118 -10.855 1000 1HD LYS 151 HD2 LYS 151 -9.359 15.324 -12.870 1001 2HD LYS 151 HD1 LYS 151 -8.283 16.658 -12.447 1002 1HE LYS 151 HE2 LYS 151 -6.367 15.163 -12.594 1003 2HE LYS 151 HE1 LYS 151 -7.434 13.814 -12.979 1004 1HZ LYS 151 HZ3 LYS 151 -7.078 16.252 -14.637 1005 2HZ LYS 151 HZ2 LYS 151 -6.411 14.740 -14.955 1006 3HZ LYS 151 HZ1 LYS 151 -8.080 14.957 -15.011 1007 H VAL 152 HN VAL 152 -9.774 13.779 -6.872 1008 HA VAL 152 HA VAL 152 -10.670 11.465 -8.435 1009 HB VAL 152 HB VAL 152 -9.701 10.060 -6.616 1010 1HG1 VAL 152 3HG1 VAL 152 -8.341 10.553 -8.569 1011 2HG1 VAL 152 2HG1 VAL 152 -7.757 12.031 -7.808 1012 3HG1 VAL 152 1HG1 VAL 152 -7.336 10.460 -7.123 1013 1HG2 VAL 152 2HG2 VAL 152 -9.895 11.653 -4.756 1014 2HG2 VAL 152 1HG2 VAL 152 -8.235 11.078 -4.919 1015 3HG2 VAL 152 3HG2 VAL 152 -8.676 12.682 -5.505 1016 H HIS 153 HN HIS 153 -11.847 9.833 -6.843 1017 HA HIS 153 HA HIS 153 -14.105 11.275 -5.810 1018 1HB HIS 153 HB2 HIS 153 -14.235 8.961 -6.933 1019 2HB HIS 153 HB1 HIS 153 -13.531 8.313 -5.455 1020 HD1 HIS 153 HD1 HIS 153 -16.771 9.486 -6.907 1021 HD2 HIS 153 HD2 HIS 153 -15.240 8.466 -3.168 1022 HE1 HIS 153 HE1 HIS 153 -18.741 9.229 -5.396 1023 H LYS 154 HN LYS 154 -14.414 11.843 -3.733 1024 HA LYS 154 HA LYS 154 -12.143 11.921 -2.093 1025 1HB LYS 154 HB2 LYS 154 -15.000 12.660 -1.488 1026 2HB LYS 154 HB1 LYS 154 -13.651 12.912 -0.391 1027 1HG LYS 154 HG2 LYS 154 -12.588 14.383 -2.048 1028 2HG LYS 154 HG1 LYS 154 -13.963 14.148 -3.126 1029 1HD LYS 154 HD2 LYS 154 -14.143 16.268 -1.898 1030 2HD LYS 154 HD1 LYS 154 -15.448 15.169 -1.461 1031 1HE LYS 154 HE2 LYS 154 -14.280 14.562 0.589 1032 2HE LYS 154 HE1 LYS 154 -12.917 15.586 0.139 1033 1HZ LYS 154 HZ2 LYS 154 -15.678 16.523 0.700 1034 2HZ LYS 154 HZ1 LYS 154 -14.378 16.608 1.753 1035 3HZ LYS 154 HZ3 LYS 154 -14.350 17.503 0.339 1036 H LEU 155 HN LEU 155 -11.364 10.430 -0.940 1037 HA LEU 155 HA LEU 155 -12.841 8.153 0.076 1038 1HB LEU 155 HB2 LEU 155 -10.000 9.060 0.486 1039 2HB LEU 155 HB1 LEU 155 -10.647 7.512 0.990 1040 HG LEU 155 HG LEU 155 -10.468 8.430 -1.873 1041 1HD1 LEU 155 HD1 LEU 155 -8.328 8.173 -0.832 1042 2HD1 LEU 155 HD1 LEU 155 -8.763 6.556 -0.279 1043 3HD1 LEU 155 HD1 LEU 155 -8.608 6.882 -2.019 1044 1HD2 LEU 155 HD2 LEU 155 -11.129 5.746 -0.643 1045 2HD2 LEU 155 HD2 LEU 155 -12.254 6.806 -1.493 1046 3HD2 LEU 155 HD2 LEU 155 -10.918 6.065 -2.363 1047 H GLU 156 HN GLU 156 -13.551 10.629 0.879 1048 HA GLU 156 HA GLU 156 -12.802 11.696 3.351 1049 1HB GLU 156 HB2 GLU 156 -14.284 12.828 1.827 1050 2HB GLU 156 HB1 GLU 156 -15.492 11.573 2.007 1051 1HG GLU 156 HG2 GLU 156 -15.753 12.223 4.371 1052 2HG GLU 156 HG1 GLU 156 -14.613 13.543 4.103 1053 H HIS 157 HN HIS 157 -14.790 8.953 2.580 1054 HA HIS 157 HA HIS 157 -16.095 8.654 5.051 1055 1HB HIS 157 HB2 HIS 157 -15.523 6.536 2.973 1056 2HB HIS 157 HB1 HIS 157 -16.724 6.437 4.258 1057 HD1 HIS 157 HD1 HIS 157 -16.801 6.830 0.835 1058 HD2 HIS 157 HD2 HIS 157 -18.374 9.102 3.927 1059 HE1 HIS 157 HE1 HIS 157 -18.619 8.219 -0.185 1060 H HIS 158 HN HIS 158 -12.880 7.875 4.090 1061 HA HIS 158 HA HIS 158 -12.550 6.171 6.457 1062 1HB HIS 158 HB2 HIS 158 -10.711 6.614 4.091 1063 2HB HIS 158 HB1 HIS 158 -10.254 5.702 5.523 1064 HD1 HIS 158 HD1 HIS 158 -12.198 3.643 6.003 1065 HD2 HIS 158 HD2 HIS 158 -11.574 5.030 2.134 1066 HE1 HIS 158 HE1 HIS 158 -13.034 1.846 4.490 1067 H HIS 159 HN HIS 159 -12.702 9.223 6.011 1068 HA HIS 159 HA HIS 159 -10.437 9.841 7.746 1069 1HB HIS 159 HB2 HIS 159 -11.543 11.477 5.453 1070 2HB HIS 159 HB1 HIS 159 -10.459 12.140 6.672 1071 HD1 HIS 159 HD1 HIS 159 -10.501 9.696 3.760 1072 HD2 HIS 159 HD2 HIS 159 -7.809 11.478 6.379 1073 HE1 HIS 159 HE1 HIS 159 -8.212 9.154 2.891 1074 H HIS 160 HN HIS 160 -10.942 12.060 8.779 1075 HA HIS 160 HA HIS 160 -13.236 11.640 10.396 1076 1HB HIS 160 HB2 HIS 160 -11.253 13.912 10.265 1077 2HB HIS 160 HB1 HIS 160 -12.555 13.832 11.441 1078 HD1 HIS 160 HD1 HIS 160 -11.518 13.233 13.611 1079 HD2 HIS 160 HD2 HIS 160 -9.823 11.108 10.479 1080 HE1 HIS 160 HE1 HIS 160 -9.852 11.661 14.655 1081 H HIS 161 HN HIS 161 -15.209 11.993 9.626 1082 HA HIS 161 HA HIS 161 -15.791 14.570 8.366 1083 1HB HIS 161 HB2 HIS 161 -17.308 13.455 6.759 1084 2HB HIS 161 HB1 HIS 161 -15.659 12.894 6.560 1085 HD1 HIS 161 HD1 HIS 161 -15.181 10.383 7.385 1086 HD2 HIS 161 HD2 HIS 161 -19.171 11.537 7.349 1087 HE1 HIS 161 HE1 HIS 161 -16.528 8.260 7.552 1088 H HIS 162 HN HIS 162 -18.267 14.942 8.379 1089 HA HIS 162 HA HIS 162 -19.765 13.526 10.261 1090 1HB HIS 162 HB2 HIS 162 -20.231 15.512 11.820 1091 2HB HIS 162 HB1 HIS 162 -18.701 14.690 12.031 1092 HD1 HIS 162 HD1 HIS 162 -16.685 16.185 12.127 1093 HD2 HIS 162 HD2 HIS 162 -19.962 18.092 10.434 1094 HE1 HIS 162 HE1 HIS 162 -16.011 18.594 11.828 No H/Q in entry = 1094 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 21.615 -12.550 -1.239 2 H2 MET 1 HT3 MET 1 21.453 -12.041 -2.838 3 H3 MET 1 HT2 MET 1 20.263 -11.645 -1.695 4 HA MET 1 HA MET 1 19.456 -13.398 -3.014 5 1HB MET 1 HB2 MET 1 22.049 -14.748 -2.217 6 2HB MET 1 HB1 MET 1 20.682 -15.635 -2.866 7 1HG MET 1 HG2 MET 1 22.296 -15.228 -4.600 8 2HG MET 1 HG1 MET 1 20.827 -14.314 -4.925 9 1HE MET 1 HE3 MET 1 23.497 -13.758 -6.471 10 2HE MET 1 HE2 MET 1 22.036 -12.801 -6.710 11 3HE MET 1 HE1 MET 1 23.573 -11.997 -6.424 12 H GLU 2 HN GLU 2 19.089 -15.873 -1.887 13 HA GLU 2 HA GLU 2 18.161 -17.029 -0.205 14 1HB GLU 2 HB2 GLU 2 20.251 -16.069 1.059 15 2HB GLU 2 HB1 GLU 2 19.126 -14.949 1.788 16 1HG GLU 2 HG2 GLU 2 18.942 -17.949 2.028 17 2HG GLU 2 HG1 GLU 2 19.729 -16.907 3.202 18 H MET 3 HN MET 3 16.145 -17.171 0.668 19 HA MET 3 HA MET 3 14.404 -15.056 -0.247 20 1HB MET 3 HB2 MET 3 12.541 -16.605 0.152 21 2HB MET 3 HB1 MET 3 13.801 -17.317 -0.840 22 1HG MET 3 HG2 MET 3 14.622 -18.561 1.097 23 2HG MET 3 HG1 MET 3 13.357 -17.840 2.092 24 1HE MET 3 HE1 MET 3 14.172 -20.272 -0.882 25 2HE MET 3 HE3 MET 3 12.564 -20.784 -1.391 26 3HE MET 3 HE2 MET 3 13.086 -19.123 -1.659 27 H GLY 4 HN GLY 4 15.522 -16.200 2.817 28 1HA GLY 4 HA1 GLY 4 15.060 -15.492 4.956 29 2HA GLY 4 HA2 GLY 4 13.477 -14.942 4.390 30 H GLN 5 HN GLN 5 16.738 -14.158 3.411 31 HA GLN 5 HA GLN 5 16.774 -11.523 4.400 32 1HB GLN 5 HB2 GLN 5 18.366 -12.816 2.193 33 2HB GLN 5 HB1 GLN 5 18.640 -11.165 2.736 34 1HG GLN 5 HG2 GLN 5 18.829 -13.617 4.470 35 2HG GLN 5 HG1 GLN 5 20.195 -12.751 3.769 36 1HE2 GLN 5 1HE2 GLN 5 20.740 -10.733 4.574 37 2HE2 GLN 5 2HE2 GLN 5 20.154 -10.156 6.090 38 H LEU 6 HN LEU 6 15.372 -12.875 1.603 39 HA LEU 6 HA LEU 6 14.971 -10.489 0.128 40 1HB LEU 6 HB2 LEU 6 14.802 -12.784 -0.843 41 2HB LEU 6 HB1 LEU 6 13.408 -13.095 0.144 42 HG LEU 6 HG LEU 6 12.961 -12.722 -2.299 43 1HD1 LEU 6 HD1 LEU 6 11.179 -12.537 -0.714 44 2HD1 LEU 6 HD1 LEU 6 11.575 -10.842 -0.437 45 3HD1 LEU 6 HD1 LEU 6 10.986 -11.364 -2.019 46 1HD2 LEU 6 HD2 LEU 6 14.556 -10.936 -2.716 47 2HD2 LEU 6 HD2 LEU 6 12.920 -10.449 -3.154 48 3HD2 LEU 6 HD2 LEU 6 13.646 -9.857 -1.657 49 H LYS 7 HN LYS 7 12.969 -12.289 2.447 50 HA LYS 7 HA LYS 7 10.861 -10.401 2.574 51 1HB LYS 7 HB2 LYS 7 11.571 -12.832 3.942 52 2HB LYS 7 HB1 LYS 7 11.014 -11.631 5.103 53 1HG LYS 7 HG2 LYS 7 9.514 -12.364 2.618 54 2HG LYS 7 HG1 LYS 7 9.255 -13.167 4.156 55 1HD LYS 7 HD2 LYS 7 9.039 -10.165 3.939 56 2HD LYS 7 HD1 LYS 7 7.650 -11.181 3.540 57 1HE LYS 7 HE2 LYS 7 7.920 -12.198 5.832 58 2HE LYS 7 HE1 LYS 7 9.098 -10.934 6.164 59 1HZ LYS 7 HZ3 LYS 7 6.277 -10.373 5.352 60 2HZ LYS 7 HZ2 LYS 7 6.782 -10.529 6.922 61 3HZ LYS 7 HZ1 LYS 7 7.404 -9.262 5.964 62 H ASN 8 HN ASN 8 13.840 -10.755 4.311 63 HA ASN 8 HA ASN 8 13.532 -8.813 6.286 64 1HB ASN 8 HB2 ASN 8 15.435 -10.469 6.075 65 2HB ASN 8 HB1 ASN 8 16.080 -9.484 4.777 66 1HD2 ASN 8 HD2 ASN 8 17.405 -10.219 7.199 67 2HD2 ASN 8 HD2 ASN 8 17.741 -8.779 8.069 68 H LYS 9 HN LYS 9 14.791 -8.548 2.965 69 HA LYS 9 HA LYS 9 15.172 -5.752 3.066 70 1HB LYS 9 HB2 LYS 9 14.972 -7.635 0.726 71 2HB LYS 9 HB1 LYS 9 15.267 -5.910 0.547 72 1HG LYS 9 HG2 LYS 9 17.300 -6.150 1.926 73 2HG LYS 9 HG1 LYS 9 17.008 -7.888 2.000 74 1HD LYS 9 HD2 LYS 9 17.195 -8.051 -0.405 75 2HD LYS 9 HD1 LYS 9 17.398 -6.307 -0.536 76 1HE LYS 9 HE2 LYS 9 19.553 -7.402 -0.707 77 2HE LYS 9 HE1 LYS 9 19.468 -6.466 0.783 78 1HZ LYS 9 HZ2 LYS 9 19.112 -9.417 0.569 79 2HZ LYS 9 HZ1 LYS 9 20.465 -8.623 1.133 80 3HZ LYS 9 HZ3 LYS 9 19.037 -8.499 2.002 81 H ILE 10 HN ILE 10 12.465 -7.749 2.020 82 HA ILE 10 HA ILE 10 10.864 -5.705 0.986 83 HB ILE 10 HB ILE 10 10.063 -8.263 2.403 84 1HG1 ILE 10 2HG1 ILE 10 10.015 -7.437 -0.500 85 2HG1 ILE 10 1HG1 ILE 10 11.169 -8.539 0.243 86 1HG2 ILE 10 1HG2 ILE 10 8.245 -6.661 2.721 87 2HG2 ILE 10 3HG2 ILE 10 8.217 -6.340 0.985 88 3HG2 ILE 10 2HG2 ILE 10 7.770 -7.934 1.596 89 1HD1 ILE 10 HD1 ILE 10 9.343 -10.103 0.698 90 2HD1 ILE 10 HD1 ILE 10 8.212 -8.996 -0.083 91 3HD1 ILE 10 HD1 ILE 10 9.507 -9.750 -1.019 92 H GLU 11 HN GLU 11 11.063 -6.926 4.294 93 HA GLU 11 HA GLU 11 9.292 -5.171 5.529 94 1HB GLU 11 HB2 GLU 11 11.843 -6.371 6.612 95 2HB GLU 11 HB1 GLU 11 10.658 -5.531 7.598 96 1HG GLU 11 HG2 GLU 11 10.204 -8.076 6.049 97 2HG GLU 11 HG1 GLU 11 10.404 -7.935 7.796 98 H ASN 12 HN ASN 12 12.785 -4.796 5.062 99 HA ASN 12 HA ASN 12 13.053 -2.318 6.214 100 1HB ASN 12 HB2 ASN 12 14.631 -4.033 4.422 101 2HB ASN 12 HB1 ASN 12 15.086 -2.344 4.528 102 1HD2 ASN 12 HD2 ASN 12 14.811 -5.359 6.242 103 2HD2 ASN 12 HD2 ASN 12 15.727 -4.868 7.619 104 H LYS 13 HN LYS 13 12.540 -3.168 2.785 105 HA LYS 13 HA LYS 13 12.839 -0.509 1.881 106 1HB LYS 13 HB2 LYS 13 13.064 -2.672 0.520 107 2HB LYS 13 HB1 LYS 13 11.317 -2.708 0.475 108 1HG LYS 13 HG2 LYS 13 12.236 -1.773 -1.598 109 2HG LYS 13 HG1 LYS 13 11.273 -0.585 -0.726 110 1HD LYS 13 HD2 LYS 13 13.302 0.428 -1.584 111 2HD LYS 13 HD1 LYS 13 13.330 0.432 0.173 112 1HE LYS 13 HE2 LYS 13 15.506 -0.161 -0.557 113 2HE LYS 13 HE1 LYS 13 14.775 -1.652 0.011 114 1HZ LYS 13 HZ1 LYS 13 14.300 -2.206 -2.362 115 2HZ LYS 13 HZ3 LYS 13 15.104 -0.784 -2.813 116 3HZ LYS 13 HZ2 LYS 13 15.913 -2.033 -2.026 117 H LYS 14 HN LYS 14 10.049 -2.453 2.775 118 HA LYS 14 HA LYS 14 7.929 -0.772 2.246 119 1HB LYS 14 HB2 LYS 14 7.784 -3.103 2.989 120 2HB LYS 14 HB1 LYS 14 8.490 -2.653 4.526 121 1HG LYS 14 HG2 LYS 14 6.475 -1.342 5.041 122 2HG LYS 14 HG1 LYS 14 5.781 -1.837 3.492 123 1HD LYS 14 HD2 LYS 14 4.890 -3.295 5.209 124 2HD LYS 14 HD1 LYS 14 6.018 -4.210 4.209 125 1HE LYS 14 HE2 LYS 14 7.777 -3.813 5.929 126 2HE LYS 14 HE1 LYS 14 6.532 -3.047 6.913 127 1HZ LYS 14 HZ1 LYS 14 6.469 -5.877 5.971 128 2HZ LYS 14 HZ3 LYS 14 6.969 -5.416 7.471 129 3HZ LYS 14 HZ2 LYS 14 5.371 -5.216 7.071 130 H LYS 15 HN LYS 15 9.916 -1.128 5.164 131 HA LYS 15 HA LYS 15 8.837 1.004 6.626 132 1HB LYS 15 HB2 LYS 15 11.438 -0.472 6.778 133 2HB LYS 15 HB1 LYS 15 11.064 0.852 7.875 134 1HG LYS 15 HG2 LYS 15 9.301 -0.306 8.872 135 2HG LYS 15 HG1 LYS 15 9.189 -1.459 7.538 136 1HD LYS 15 HD2 LYS 15 11.081 -2.558 8.163 137 2HD LYS 15 HD1 LYS 15 11.673 -1.301 9.242 138 1HE LYS 15 HE2 LYS 15 9.287 -3.131 9.588 139 2HE LYS 15 HE1 LYS 15 10.789 -3.212 10.492 140 1HZ LYS 15 HZ3 LYS 15 10.239 -0.985 11.432 141 2HZ LYS 15 HZ2 LYS 15 8.750 -1.035 10.647 142 3HZ LYS 15 HZ1 LYS 15 9.106 -2.162 11.820 143 H GLU 16 HN GLU 16 11.544 0.939 4.378 144 HA GLU 16 HA GLU 16 12.457 3.545 4.730 145 1HB GLU 16 HB2 GLU 16 12.368 1.809 2.267 146 2HB GLU 16 HB1 GLU 16 13.137 3.387 2.290 147 1HG GLU 16 HG2 GLU 16 13.885 1.099 4.082 148 2HG GLU 16 HG1 GLU 16 14.708 1.510 2.577 149 H LEU 17 HN LEU 17 9.839 2.287 2.760 150 HA LEU 17 HA LEU 17 9.136 4.774 1.640 151 1HB LEU 17 HB2 LEU 17 8.393 2.982 0.364 152 2HB LEU 17 HB1 LEU 17 7.909 2.057 1.755 153 HG LEU 17 HG LEU 17 6.034 2.782 0.207 154 1HD1 LEU 17 HD1 LEU 17 5.607 1.925 2.299 155 2HD1 LEU 17 HD1 LEU 17 5.740 3.522 3.029 156 3HD1 LEU 17 HD1 LEU 17 4.450 3.188 1.856 157 1HD2 LEU 17 HD2 LEU 17 6.571 5.483 1.394 158 2HD2 LEU 17 HD2 LEU 17 6.753 5.043 -0.303 159 3HD2 LEU 17 HD2 LEU 17 5.151 5.032 0.446 160 H ILE 18 HN ILE 18 7.979 2.946 4.413 161 HA ILE 18 HA ILE 18 5.851 4.610 5.064 162 HB ILE 18 HB ILE 18 7.561 3.104 7.080 163 1HG1 ILE 18 2HG1 ILE 18 5.007 2.202 5.738 164 2HG1 ILE 18 1HG1 ILE 18 6.599 1.742 5.153 165 1HG2 ILE 18 1HG2 ILE 18 4.725 4.145 7.144 166 2HG2 ILE 18 3HG2 ILE 18 5.455 3.160 8.420 167 3HG2 ILE 18 2HG2 ILE 18 6.077 4.779 8.066 168 1HD1 ILE 18 HD1 ILE 18 5.493 1.122 7.879 169 2HD1 ILE 18 HD1 ILE 18 5.570 0.010 6.511 170 3HD1 ILE 18 HD1 ILE 18 7.058 0.612 7.240 171 H GLN 19 HN GLN 19 9.228 4.787 6.008 172 HA GLN 19 HA GLN 19 9.128 7.022 7.691 173 1HB GLN 19 HB2 GLN 19 11.289 6.118 5.797 174 2HB GLN 19 HB1 GLN 19 11.519 7.328 7.052 175 1HG GLN 19 HG2 GLN 19 11.184 5.748 8.780 176 2HG GLN 19 HG1 GLN 19 10.574 4.542 7.651 177 1HE2 GLN 19 1HE2 GLN 19 12.708 5.124 5.710 178 2HE2 GLN 19 2HE2 GLN 19 14.101 4.339 6.324 179 H LEU 20 HN LEU 20 9.329 6.803 4.182 180 HA LEU 20 HA LEU 20 9.675 9.584 3.729 181 1HB LEU 20 HB2 LEU 20 8.772 7.403 1.854 182 2HB LEU 20 HB1 LEU 20 9.153 9.042 1.364 183 HG LEU 20 HG LEU 20 11.108 7.086 2.581 184 1HD1 LEU 20 HD1 LEU 20 10.790 8.061 -0.246 185 2HD1 LEU 20 HD1 LEU 20 12.108 7.054 0.354 186 3HD1 LEU 20 HD1 LEU 20 10.456 6.435 0.350 187 1HD2 LEU 20 HD2 LEU 20 11.527 9.858 1.451 188 2HD2 LEU 20 HD2 LEU 20 11.688 9.381 3.146 189 3HD2 LEU 20 HD2 LEU 20 12.804 8.747 1.945 190 H VAL 21 HN VAL 21 6.765 7.459 3.418 191 HA VAL 21 HA VAL 21 5.159 9.738 2.998 192 HB VAL 21 HB VAL 21 4.268 7.738 2.166 193 1HG1 VAL 21 3HG1 VAL 21 4.540 6.516 4.836 194 2HG1 VAL 21 2HG1 VAL 21 3.647 5.828 3.450 195 3HG1 VAL 21 1HG1 VAL 21 5.377 6.159 3.309 196 1HG2 VAL 21 1HG2 VAL 21 2.525 9.183 2.995 197 2HG2 VAL 21 3HG2 VAL 21 2.060 7.490 3.168 198 3HG2 VAL 21 2HG2 VAL 21 2.606 8.405 4.579 199 H ALA 22 HN ALA 22 6.179 8.230 5.898 200 HA ALA 22 HA ALA 22 4.459 9.518 7.688 201 1HB ALA 22 HB3 ALA 22 7.335 8.771 8.169 202 2HB ALA 22 HB2 ALA 22 6.116 9.083 9.423 203 3HB ALA 22 HB1 ALA 22 5.951 7.695 8.361 204 H ARG 23 HN ARG 23 7.720 10.561 6.580 205 HA ARG 23 HA ARG 23 7.760 13.001 7.977 206 1HB ARG 23 HB2 ARG 23 9.569 13.712 6.422 207 2HB ARG 23 HB1 ARG 23 9.850 12.135 7.135 208 1HG ARG 23 HG2 ARG 23 9.260 11.039 5.111 209 2HG ARG 23 HG1 ARG 23 8.700 12.541 4.390 210 1HD ARG 23 HD2 ARG 23 11.555 12.083 5.241 211 2HD ARG 23 HD1 ARG 23 10.967 11.726 3.618 212 HE ARG 23 HE ARG 23 10.493 14.410 4.619 213 1HH1 ARG 23 1HH1 ARG 23 12.710 12.398 2.720 214 2HH1 ARG 23 2HH1 ARG 23 13.245 13.680 1.732 215 1HH2 ARG 23 1HH2 ARG 23 11.209 16.126 3.263 216 2HH2 ARG 23 2HH2 ARG 23 12.371 15.845 2.040 217 H HIS 24 HN HIS 24 6.080 12.122 5.174 218 HA HIS 24 HA HIS 24 5.681 14.556 3.896 219 1HB HIS 24 HB2 HIS 24 4.920 12.534 2.851 220 2HB HIS 24 HB1 HIS 24 3.868 12.136 4.184 221 HD1 HIS 24 HD1 HIS 24 1.493 13.167 4.120 222 HD2 HIS 24 HD2 HIS 24 4.010 14.642 1.181 223 HE1 HIS 24 HE1 HIS 24 0.075 14.574 2.627 224 H GLY 25 HN GLY 25 4.306 13.334 6.891 225 1HA GLY 25 HA1 GLY 25 2.407 15.560 6.910 226 2HA GLY 25 HA2 GLY 25 3.642 15.512 8.161 227 H LEU 26 HN LEU 26 2.839 12.344 7.485 228 HA LEU 26 HA LEU 26 0.483 12.011 8.857 229 1HB LEU 26 HB2 LEU 26 2.790 10.324 8.141 230 2HB LEU 26 HB1 LEU 26 1.605 9.687 9.261 231 HG LEU 26 HG LEU 26 -0.108 10.165 7.537 232 1HD1 LEU 26 HD1 LEU 26 0.992 11.756 6.177 233 2HD1 LEU 26 HD1 LEU 26 2.185 10.535 5.669 234 3HD1 LEU 26 HD1 LEU 26 0.478 10.343 5.251 235 1HD2 LEU 26 HD2 LEU 26 2.050 8.176 6.976 236 2HD2 LEU 26 HD2 LEU 26 0.564 7.947 7.911 237 3HD2 LEU 26 HD2 LEU 26 0.504 8.176 6.150 238 H ASP 27 HN ASP 27 0.045 11.403 10.852 239 HA ASP 27 HA ASP 27 1.819 12.282 13.003 240 1HB ASP 27 HB2 ASP 27 -0.844 10.878 13.316 241 2HB ASP 27 HB1 ASP 27 -0.002 11.870 14.481 242 H HIS 28 HN HIS 28 1.775 10.607 14.978 243 HA HIS 28 HA HIS 28 3.092 8.292 14.022 244 1HB HIS 28 HB2 HIS 28 2.204 9.055 16.803 245 2HB HIS 28 HB1 HIS 28 2.971 7.511 16.461 246 HD1 HIS 28 HD1 HIS 28 5.534 7.514 16.179 247 HD2 HIS 28 HD2 HIS 28 3.878 11.323 16.446 248 HE1 HIS 28 HE1 HIS 28 7.460 9.092 16.455 249 H ASP 29 HN ASP 29 -0.180 8.862 15.199 250 HA ASP 29 HA ASP 29 -0.970 6.158 15.270 251 1HB ASP 29 HB2 ASP 29 -3.241 6.915 15.358 252 2HB ASP 29 HB1 ASP 29 -2.302 8.120 16.226 253 H LYS 30 HN LYS 30 -0.891 8.529 12.763 254 HA LYS 30 HA LYS 30 -2.253 7.126 10.737 255 1HB LYS 30 HB2 LYS 30 -0.030 9.118 10.445 256 2HB LYS 30 HB1 LYS 30 -1.123 8.626 9.164 257 1HG LYS 30 HG2 LYS 30 -1.879 10.032 11.700 258 2HG LYS 30 HG1 LYS 30 -1.695 10.793 10.106 259 1HD LYS 30 HD2 LYS 30 -3.520 9.431 9.290 260 2HD LYS 30 HD1 LYS 30 -3.679 8.662 10.876 261 1HE LYS 30 HE2 LYS 30 -4.128 11.569 10.204 262 2HE LYS 30 HE1 LYS 30 -5.334 10.402 10.729 263 1HZ LYS 30 HZ1 LYS 30 -3.983 10.245 12.884 264 2HZ LYS 30 HZ3 LYS 30 -3.138 11.602 12.325 265 3HZ LYS 30 HZ2 LYS 30 -4.773 11.703 12.615 266 H VAL 31 HN VAL 31 1.162 7.313 11.618 267 HA VAL 31 HA VAL 31 2.108 5.752 9.488 268 HB VAL 31 HB VAL 31 3.387 6.290 12.211 269 1HG1 VAL 31 3HG1 VAL 31 4.359 4.316 11.164 270 2HG1 VAL 31 2HG1 VAL 31 4.648 5.246 9.694 271 3HG1 VAL 31 1HG1 VAL 31 5.488 5.673 11.183 272 1HG2 VAL 31 2HG2 VAL 31 3.759 7.620 9.540 273 2HG2 VAL 31 1HG2 VAL 31 2.936 8.301 10.940 274 3HG2 VAL 31 3HG2 VAL 31 4.669 7.978 11.012 275 H LEU 32 HN LEU 32 1.103 4.968 12.766 276 HA LEU 32 HA LEU 32 1.687 2.177 12.736 277 1HB LEU 32 HB2 LEU 32 -0.505 3.635 14.185 278 2HB LEU 32 HB1 LEU 32 0.073 2.021 14.537 279 HG LEU 32 HG LEU 32 1.615 4.585 14.880 280 1HD1 LEU 32 HD1 LEU 32 0.475 2.663 16.872 281 2HD1 LEU 32 HD1 LEU 32 1.501 4.055 17.238 282 3HD1 LEU 32 HD1 LEU 32 -0.100 4.299 16.524 283 1HD2 LEU 32 HD2 LEU 32 2.445 1.736 15.453 284 2HD2 LEU 32 HD2 LEU 32 3.128 2.814 14.231 285 3HD2 LEU 32 HD2 LEU 32 3.332 3.186 15.938 286 H LEU 33 HN LEU 33 -1.300 3.888 11.973 287 HA LEU 33 HA LEU 33 -2.779 1.571 11.352 288 1HB LEU 33 HB2 LEU 33 -3.162 4.322 10.213 289 2HB LEU 33 HB1 LEU 33 -4.326 3.008 10.286 290 HG LEU 33 HG LEU 33 -3.180 4.450 12.673 291 1HD1 LEU 33 HD1 LEU 33 -5.854 4.748 11.343 292 2HD1 LEU 33 HD1 LEU 33 -5.403 5.438 12.902 293 3HD1 LEU 33 HD1 LEU 33 -4.561 5.953 11.444 294 1HD2 LEU 33 HD2 LEU 33 -5.386 2.404 12.471 295 2HD2 LEU 33 HD2 LEU 33 -3.805 2.180 13.219 296 3HD2 LEU 33 HD2 LEU 33 -4.957 3.306 13.926 297 H PHE 34 HN PHE 34 -0.944 3.785 9.332 298 HA PHE 34 HA PHE 34 -1.552 2.602 6.878 299 1HB PHE 34 HB2 PHE 34 -0.652 4.809 6.942 300 2HB PHE 34 HB1 PHE 34 0.807 4.273 7.766 301 HD1 PHE 34 HD1 PHE 34 2.685 3.599 6.531 302 HD2 PHE 34 HD2 PHE 34 -1.065 4.055 4.580 303 HE1 PHE 34 HE1 PHE 34 3.788 3.331 4.323 304 HE2 PHE 34 HE2 PHE 34 0.045 3.779 2.396 305 HZ PHE 34 HZ PHE 34 2.487 3.417 2.305 306 H SER 35 HN SER 35 1.297 2.183 8.983 307 HA SER 35 HA SER 35 2.570 0.370 7.297 308 1HB SER 35 HB2 SER 35 3.956 -0.201 9.317 309 2HB SER 35 HB1 SER 35 3.847 1.522 8.943 310 HG SER 35 HG SER 35 2.545 1.842 10.595 311 H ARG 36 HN ARG 36 0.329 -0.228 9.975 312 HA ARG 36 HA ARG 36 0.726 -3.028 9.877 313 1HB ARG 36 HB2 ARG 36 -1.255 -3.226 11.309 314 2HB ARG 36 HB1 ARG 36 -0.115 -2.032 11.904 315 1HG ARG 36 HG2 ARG 36 -1.548 -0.259 10.951 316 2HG ARG 36 HG1 ARG 36 -2.712 -1.497 10.475 317 1HD ARG 36 HD2 ARG 36 -1.750 -0.959 13.258 318 2HD ARG 36 HD1 ARG 36 -3.289 -0.412 12.600 319 HE ARG 36 HE ARG 36 -3.667 -2.897 12.139 320 1HH1 ARG 36 1HH1 ARG 36 -2.031 -1.719 15.052 321 2HH1 ARG 36 2HH1 ARG 36 -2.515 -3.056 15.999 322 1HH2 ARG 36 1HH2 ARG 36 -4.346 -4.634 13.439 323 2HH2 ARG 36 2HH2 ARG 36 -3.865 -4.757 15.069 324 H ASP 37 HN ASP 37 -1.581 -0.902 8.239 325 HA ASP 37 HA ASP 37 -3.072 -3.120 7.191 326 1HB ASP 37 HB2 ASP 37 -3.934 -0.724 7.501 327 2HB ASP 37 HB1 ASP 37 -3.055 -0.333 6.035 328 H LEU 38 HN LEU 38 -0.522 -1.050 6.059 329 HA LEU 38 HA LEU 38 -0.162 -1.946 3.439 330 1HB LEU 38 HB2 LEU 38 0.945 0.002 4.192 331 2HB LEU 38 HB1 LEU 38 1.646 -0.826 5.555 332 HG LEU 38 HG LEU 38 3.186 -2.002 4.037 333 1HD1 LEU 38 HD1 LEU 38 1.976 -0.277 1.898 334 2HD1 LEU 38 HD1 LEU 38 3.410 -1.301 1.767 335 3HD1 LEU 38 HD1 LEU 38 1.832 -2.042 2.041 336 1HD2 LEU 38 HD2 LEU 38 3.157 0.985 3.757 337 2HD2 LEU 38 HD2 LEU 38 3.868 0.062 5.079 338 3HD2 LEU 38 HD2 LEU 38 4.537 -0.058 3.449 339 H ASP 39 HN ASP 39 1.202 -3.056 6.472 340 HA ASP 39 HA ASP 39 2.943 -5.020 5.593 341 1HB ASP 39 HB2 ASP 39 2.826 -4.105 7.871 342 2HB ASP 39 HB1 ASP 39 1.305 -4.951 8.119 343 H LYS 40 HN LYS 40 -0.475 -5.252 6.436 344 HA LYS 40 HA LYS 40 -0.701 -8.038 6.057 345 1HB LYS 40 HB2 LYS 40 -2.810 -5.891 5.908 346 2HB LYS 40 HB1 LYS 40 -3.173 -7.608 5.824 347 1HG LYS 40 HG2 LYS 40 -2.165 -7.846 8.092 348 2HG LYS 40 HG1 LYS 40 -1.976 -6.096 8.131 349 1HD LYS 40 HD2 LYS 40 -4.633 -7.520 7.830 350 2HD LYS 40 HD1 LYS 40 -3.994 -6.937 9.358 351 1HE LYS 40 HE2 LYS 40 -5.496 -5.278 8.697 352 2HE LYS 40 HE1 LYS 40 -3.934 -4.624 8.240 353 1HZ LYS 40 HZ3 LYS 40 -4.486 -5.456 5.883 354 2HZ LYS 40 HZ2 LYS 40 -6.036 -5.759 6.452 355 3HZ LYS 40 HZ1 LYS 40 -5.434 -4.208 6.482 356 H LEU 41 HN LEU 41 -1.222 -5.287 3.920 357 HA LEU 41 HA LEU 41 -2.372 -6.636 1.760 358 1HB LEU 41 HB2 LEU 41 -2.465 -4.225 1.978 359 2HB LEU 41 HB1 LEU 41 -0.726 -4.109 1.866 360 HG LEU 41 HG LEU 41 -0.779 -4.666 -0.487 361 1HD1 LEU 41 HD1 LEU 41 -3.767 -4.974 -0.121 362 2HD1 LEU 41 HD1 LEU 41 -2.906 -5.027 -1.661 363 3HD1 LEU 41 HD1 LEU 41 -2.627 -6.278 -0.454 364 1HD2 LEU 41 HD2 LEU 41 -2.874 -2.628 0.232 365 2HD2 LEU 41 HD2 LEU 41 -1.136 -2.350 0.093 366 3HD2 LEU 41 HD2 LEU 41 -2.080 -2.779 -1.333 367 H ILE 42 HN ILE 42 0.971 -6.004 2.544 368 HA ILE 42 HA ILE 42 2.015 -7.071 0.133 369 HB ILE 42 HB ILE 42 3.374 -6.651 2.809 370 1HG1 ILE 42 2HG1 ILE 42 3.329 -5.041 0.266 371 2HG1 ILE 42 1HG1 ILE 42 2.520 -4.613 1.766 372 1HG2 ILE 42 3HG2 ILE 42 4.603 -7.244 0.104 373 2HG2 ILE 42 2HG2 ILE 42 5.496 -6.834 1.568 374 3HG2 ILE 42 1HG2 ILE 42 4.579 -8.336 1.491 375 1HD1 ILE 42 HD1 ILE 42 5.495 -4.830 1.381 376 2HD1 ILE 42 HD1 ILE 42 4.557 -3.330 1.406 377 3HD1 ILE 42 HD1 ILE 42 4.645 -4.334 2.849 378 H ASN 43 HN ASN 43 1.956 -8.437 3.403 379 HA ASN 43 HA ASN 43 2.919 -10.975 2.769 380 1HB ASN 43 HB2 ASN 43 1.086 -10.102 5.005 381 2HB ASN 43 HB1 ASN 43 1.720 -11.734 4.882 382 1HD2 ASN 43 HD2 ASN 43 2.100 -9.619 6.917 383 2HD2 ASN 43 HD2 ASN 43 3.789 -9.399 7.047 384 H LYS 44 HN LYS 44 -0.285 -9.687 2.447 385 HA LYS 44 HA LYS 44 -1.741 -12.060 2.058 386 1HB LYS 44 HB2 LYS 44 -2.728 -9.818 2.424 387 2HB LYS 44 HB1 LYS 44 -2.185 -9.337 0.831 388 1HG LYS 44 HG2 LYS 44 -3.645 -11.105 -0.156 389 2HG LYS 44 HG1 LYS 44 -4.236 -11.440 1.472 390 1HD LYS 44 HD2 LYS 44 -4.446 -8.772 0.105 391 2HD LYS 44 HD1 LYS 44 -5.738 -9.962 0.192 392 1HE LYS 44 HE2 LYS 44 -4.420 -8.595 2.550 393 2HE LYS 44 HE1 LYS 44 -5.995 -8.227 1.864 394 1HZ LYS 44 HZ3 LYS 44 -6.737 -10.472 2.486 395 2HZ LYS 44 HZ2 LYS 44 -5.229 -10.780 3.172 396 3HZ LYS 44 HZ1 LYS 44 -6.203 -9.590 3.822 397 H PHE 45 HN PHE 45 -0.181 -9.855 -0.254 398 HA PHE 45 HA PHE 45 -0.824 -11.477 -2.501 399 1HB PHE 45 HB2 PHE 45 0.751 -8.978 -2.133 400 2HB PHE 45 HB1 PHE 45 0.978 -9.922 -3.603 401 HD1 PHE 45 HD1 PHE 45 -1.615 -8.210 -1.553 402 HD2 PHE 45 HD2 PHE 45 -0.520 -9.794 -5.349 403 HE1 PHE 45 HE1 PHE 45 -3.621 -7.203 -2.551 404 HE2 PHE 45 HE2 PHE 45 -2.534 -8.795 -6.352 405 HZ PHE 45 HZ PHE 45 -4.087 -7.496 -4.947 406 H MET 46 HN MET 46 1.936 -11.178 -0.449 407 HA MET 46 HA MET 46 3.864 -12.682 -1.923 408 1HB MET 46 HB2 MET 46 3.402 -12.655 1.051 409 2HB MET 46 HB1 MET 46 4.871 -13.170 0.227 410 1HG MET 46 HG2 MET 46 5.032 -10.758 -0.619 411 2HG MET 46 HG1 MET 46 3.719 -10.415 0.475 412 1HE MET 46 HE2 MET 46 7.270 -11.724 0.097 413 2HE MET 46 HE1 MET 46 7.864 -11.842 1.749 414 3HE MET 46 HE3 MET 46 6.647 -12.969 1.174 415 H ASN 47 HN ASN 47 1.114 -13.567 -0.017 416 HA ASN 47 HA ASN 47 0.068 -15.437 0.545 417 1HB ASN 47 HB2 ASN 47 -0.107 -15.840 -1.914 418 2HB ASN 47 HB1 ASN 47 1.412 -16.731 -1.866 419 1HD2 ASN 47 HD2 ASN 47 0.465 -18.653 -2.580 420 2HD2 ASN 47 HD2 ASN 47 -0.583 -19.594 -1.601 421 H VAL 48 HN VAL 48 1.525 -15.160 2.335 422 HA VAL 48 HA VAL 48 2.861 -17.604 2.925 423 HB VAL 48 HB VAL 48 4.708 -16.371 4.031 424 1HG1 VAL 48 3HG1 VAL 48 4.610 -15.990 1.049 425 2HG1 VAL 48 2HG1 VAL 48 6.072 -15.882 2.025 426 3HG1 VAL 48 1HG1 VAL 48 5.193 -17.411 1.912 427 1HG2 VAL 48 1HG2 VAL 48 3.698 -13.988 2.493 428 2HG2 VAL 48 3HG2 VAL 48 3.741 -14.172 4.246 429 3HG2 VAL 48 2HG2 VAL 48 5.248 -14.050 3.331 430 H LYS 49 HN LYS 49 3.324 -17.515 5.281 431 HA LYS 49 HA LYS 49 1.133 -16.121 6.664 432 1HB LYS 49 HB2 LYS 49 2.599 -18.636 7.493 433 2HB LYS 49 HB1 LYS 49 1.071 -18.019 8.116 434 1HG LYS 49 HG2 LYS 49 -0.004 -18.434 5.983 435 2HG LYS 49 HG1 LYS 49 1.501 -19.011 5.308 436 1HD LYS 49 HD2 LYS 49 0.240 -20.956 5.905 437 2HD LYS 49 HD1 LYS 49 1.519 -20.793 7.101 438 1HE LYS 49 HE2 LYS 49 -0.579 -21.349 8.197 439 2HE LYS 49 HE1 LYS 49 -0.075 -19.721 8.644 440 1HZ LYS 49 HZ3 LYS 49 -2.078 -20.350 6.547 441 2HZ LYS 49 HZ2 LYS 49 -2.456 -19.853 8.114 442 3HZ LYS 49 HZ1 LYS 49 -1.645 -18.818 7.073 443 H ASP 50 HN ASP 50 3.771 -15.345 5.873 444 HA ASP 50 HA ASP 50 5.595 -14.266 6.393 445 1HB ASP 50 HB2 ASP 50 4.198 -12.912 7.841 446 2HB ASP 50 HB1 ASP 50 4.485 -14.016 9.187 447 H LYS 51 HN LYS 51 7.563 -14.855 6.600 448 HA LYS 51 HA LYS 51 8.007 -17.226 8.219 449 1HB LYS 51 HB2 LYS 51 9.636 -17.945 6.496 450 2HB LYS 51 HB1 LYS 51 7.971 -17.891 5.943 451 1HG LYS 51 HG2 LYS 51 8.490 -15.650 4.928 452 2HG LYS 51 HG1 LYS 51 10.189 -15.951 5.298 453 1HD LYS 51 HD2 LYS 51 8.403 -17.674 3.578 454 2HD LYS 51 HD1 LYS 51 9.641 -16.568 2.995 455 1HE LYS 51 HE2 LYS 51 11.384 -17.907 3.963 456 2HE LYS 51 HE1 LYS 51 10.215 -18.926 4.799 457 1HZ LYS 51 HZ1 LYS 51 9.401 -19.657 2.656 458 2HZ LYS 51 HZ3 LYS 51 10.554 -18.721 1.857 459 3HZ LYS 51 HZ2 LYS 51 11.025 -20.020 2.837 460 H VAL 52 HN VAL 52 8.524 -14.267 8.673 461 HA VAL 52 HA VAL 52 11.298 -14.690 9.430 462 HB VAL 52 HB VAL 52 11.542 -12.250 9.746 463 1HG1 VAL 52 2HG1 VAL 52 12.276 -13.220 7.662 464 2HG1 VAL 52 1HG1 VAL 52 10.657 -13.040 6.982 465 3HG1 VAL 52 3HG1 VAL 52 11.613 -11.610 7.368 466 1HG2 VAL 52 3HG2 VAL 52 9.216 -11.652 10.137 467 2HG2 VAL 52 2HG2 VAL 52 9.889 -10.679 8.827 468 3HG2 VAL 52 1HG2 VAL 52 8.817 -12.037 8.468 469 H HIS 53 HN HIS 53 8.102 -13.986 10.462 470 HA HIS 53 HA HIS 53 8.972 -14.358 13.206 471 1HB HIS 53 HB2 HIS 53 7.426 -12.458 12.843 472 2HB HIS 53 HB1 HIS 53 6.283 -13.523 12.040 473 HD1 HIS 53 HD1 HIS 53 4.333 -13.895 13.555 474 HD2 HIS 53 HD2 HIS 53 7.908 -13.692 15.658 475 HE1 HIS 53 HE1 HIS 53 3.742 -14.269 15.968 476 H LYS 54 HN LYS 54 9.538 -16.500 12.893 477 HA LYS 54 HA LYS 54 7.312 -18.355 12.818 478 1HB LYS 54 HB2 LYS 54 8.254 -18.391 10.531 479 2HB LYS 54 HB1 LYS 54 9.868 -18.627 11.185 480 1HG LYS 54 HG2 LYS 54 9.172 -20.817 12.087 481 2HG LYS 54 HG1 LYS 54 7.572 -20.575 11.407 482 1HD LYS 54 HD2 LYS 54 10.117 -20.677 9.789 483 2HD LYS 54 HD1 LYS 54 9.054 -22.056 10.060 484 1HE LYS 54 HE2 LYS 54 7.214 -20.815 8.998 485 2HE LYS 54 HE1 LYS 54 8.317 -19.481 8.659 486 1HZ LYS 54 HZ3 LYS 54 8.601 -22.255 7.621 487 2HZ LYS 54 HZ2 LYS 54 8.035 -20.948 6.733 488 3HZ LYS 54 HZ1 LYS 54 9.634 -20.967 7.285 489 H LEU 55 HN LEU 55 7.731 -20.168 14.077 490 HA LEU 55 HA LEU 55 9.795 -19.762 16.051 491 1HB LEU 55 HB2 LEU 55 7.576 -21.805 15.840 492 2HB LEU 55 HB1 LEU 55 8.789 -21.856 17.093 493 HG LEU 55 HG LEU 55 7.955 -19.579 17.848 494 1HD1 LEU 55 HD1 LEU 55 6.828 -18.878 15.819 495 2HD1 LEU 55 HD1 LEU 55 5.658 -20.183 16.012 496 3HD1 LEU 55 HD1 LEU 55 5.728 -18.884 17.199 497 1HD2 LEU 55 HD2 LEU 55 6.022 -21.885 17.924 498 2HD2 LEU 55 HD2 LEU 55 7.375 -21.616 19.023 499 3HD2 LEU 55 HD2 LEU 55 6.012 -20.496 19.012 500 H GLU 56 HN GLU 56 11.545 -21.041 16.337 501 HA GLU 56 HA GLU 56 12.394 -22.662 14.132 502 1HB GLU 56 HB2 GLU 56 13.902 -21.236 15.586 503 2HB GLU 56 HB1 GLU 56 13.631 -22.385 16.887 504 1HG GLU 56 HG2 GLU 56 15.742 -22.818 15.828 505 2HG GLU 56 HG1 GLU 56 14.625 -24.144 15.512 506 H HIS 57 HN HIS 57 12.639 -24.978 14.226 507 HA HIS 57 HA HIS 57 11.079 -26.227 16.393 508 1HB HIS 57 HB2 HIS 57 10.995 -26.906 13.459 509 2HB HIS 57 HB1 HIS 57 10.258 -27.884 14.721 510 HD1 HIS 57 HD1 HIS 57 9.673 -24.816 12.652 511 HD2 HIS 57 HD2 HIS 57 7.999 -26.677 15.975 512 HE1 HIS 57 HE1 HIS 57 7.410 -23.797 12.951 513 H HIS 58 HN HIS 58 11.806 -28.166 17.197 514 HA HIS 58 HA HIS 58 14.530 -28.782 16.418 515 1HB HIS 58 HB2 HIS 58 14.788 -29.937 18.540 516 2HB HIS 58 HB1 HIS 58 14.064 -28.369 18.832 517 HD1 HIS 58 HD1 HIS 58 11.906 -28.391 20.236 518 HD2 HIS 58 HD2 HIS 58 12.912 -32.146 18.765 519 HE1 HIS 58 HE1 HIS 58 10.334 -30.011 21.324 520 H HIS 59 HN HIS 59 11.448 -29.986 15.886 521 HA HIS 59 HA HIS 59 12.034 -32.761 15.893 522 1HB HIS 59 HB2 HIS 59 9.858 -33.110 14.800 523 2HB HIS 59 HB1 HIS 59 9.730 -32.022 16.171 524 HD1 HIS 59 HD1 HIS 59 8.432 -29.892 15.707 525 HD2 HIS 59 HD2 HIS 59 9.836 -31.689 12.242 526 HE1 HIS 59 HE1 HIS 59 7.442 -28.593 13.801 527 H HIS 60 HN HIS 60 13.150 -30.511 13.792 528 HA HIS 60 HA HIS 60 13.674 -32.582 11.833 529 1HB HIS 60 HB2 HIS 60 13.310 -31.082 9.940 530 2HB HIS 60 HB1 HIS 60 11.842 -31.145 10.897 531 HD1 HIS 60 HD1 HIS 60 13.798 -28.747 9.097 532 HD2 HIS 60 HD2 HIS 60 11.884 -28.749 12.800 533 HE1 HIS 60 HE1 HIS 60 13.521 -26.355 9.738 534 H HIS 61 HN HIS 61 15.686 -32.461 10.975 535 HA HIS 61 HA HIS 61 17.509 -30.591 12.273 536 1HB HIS 61 HB2 HIS 61 18.045 -32.920 10.407 537 2HB HIS 61 HB1 HIS 61 19.307 -31.874 11.043 538 HD1 HIS 61 HD1 HIS 61 19.794 -32.096 13.654 539 HD2 HIS 61 HD2 HIS 61 17.164 -34.900 12.080 540 HE1 HIS 61 HE1 HIS 61 19.657 -33.953 15.350 541 H HIS 62 HN HIS 62 16.236 -31.472 9.194 542 HA HIS 62 HA HIS 62 16.896 -28.872 8.162 543 1HB HIS 62 HB2 HIS 62 17.427 -29.897 5.929 544 2HB HIS 62 HB1 HIS 62 18.605 -30.312 7.161 545 HD1 HIS 62 HD1 HIS 62 18.683 -32.872 7.891 546 HD2 HIS 62 HD2 HIS 62 16.036 -31.999 4.814 547 HE1 HIS 62 HE1 HIS 62 18.020 -35.077 6.896 548 H1 MET 101 HT3 MET 101 10.328 20.381 1.464 549 H2 MET 101 HT2 MET 101 10.120 20.943 3.049 550 H3 MET 101 HT1 MET 101 8.997 19.895 2.376 551 HA MET 101 HA MET 101 8.105 22.049 2.438 552 1HB MET 101 HB2 MET 101 10.249 23.298 2.409 553 2HB MET 101 HB1 MET 101 10.494 22.852 0.734 554 1HG MET 101 HG2 MET 101 8.153 24.509 1.669 555 2HG MET 101 HG1 MET 101 9.694 25.204 1.190 556 1HE MET 101 HE2 MET 101 6.787 25.916 -0.053 557 2HE MET 101 HE1 MET 101 8.279 26.728 -0.528 558 3HE MET 101 HE3 MET 101 7.203 26.066 -1.759 559 H GLU 102 HN GLU 102 9.830 21.135 -0.582 560 HA GLU 102 HA GLU 102 7.397 21.446 -2.069 561 1HB GLU 102 HB2 GLU 102 9.904 21.868 -2.759 562 2HB GLU 102 HB1 GLU 102 9.934 20.147 -3.071 563 1HG GLU 102 HG2 GLU 102 8.077 22.130 -4.388 564 2HG GLU 102 HG1 GLU 102 9.562 21.505 -5.088 565 H MET 103 HN MET 103 6.256 19.698 -3.028 566 HA MET 103 HA MET 103 6.629 17.262 -1.439 567 1HB MET 103 HB2 MET 103 4.237 16.842 -1.531 568 2HB MET 103 HB1 MET 103 4.556 18.422 -0.830 569 1HG MET 103 HG2 MET 103 3.950 19.513 -2.905 570 2HG MET 103 HG1 MET 103 3.748 17.956 -3.701 571 1HE MET 103 HE1 MET 103 1.823 16.239 -3.097 572 2HE MET 103 HE3 MET 103 2.226 16.275 -1.376 573 3HE MET 103 HE2 MET 103 0.566 16.544 -1.906 574 H GLY 104 HN GLY 104 6.529 18.414 -4.648 575 1HA GLY 104 HA1 GLY 104 6.671 17.269 -6.635 576 2HA GLY 104 HA2 GLY 104 5.655 16.029 -5.898 577 H GLN 105 HN GLN 105 8.800 17.302 -5.070 578 HA GLN 105 HA GLN 105 10.367 15.122 -5.826 579 1HB GLN 105 HB2 GLN 105 11.974 15.915 -4.045 580 2HB GLN 105 HB1 GLN 105 11.524 17.098 -5.279 581 1HG GLN 105 HG2 GLN 105 10.088 18.198 -3.718 582 2HG GLN 105 HG1 GLN 105 10.351 16.931 -2.524 583 1HE2 GLN 105 1HE2 GLN 105 11.845 19.602 -4.215 584 2HE2 GLN 105 2HE2 GLN 105 13.142 19.813 -3.105 585 H LEU 106 HN LEU 106 8.689 15.720 -2.849 586 HA LEU 106 HA LEU 106 9.736 13.509 -1.436 587 1HB LEU 106 HB2 LEU 106 8.883 15.511 -0.324 588 2HB LEU 106 HB1 LEU 106 7.302 15.253 -1.001 589 HG LEU 106 HG LEU 106 7.573 14.788 1.457 590 1HD1 LEU 106 HD1 LEU 106 6.574 12.544 -0.254 591 2HD1 LEU 106 HD1 LEU 106 6.192 12.790 1.451 592 3HD1 LEU 106 HD1 LEU 106 5.657 13.960 0.238 593 1HD2 LEU 106 HD2 LEU 106 9.735 13.676 1.401 594 2HD2 LEU 106 HD2 LEU 106 8.513 12.622 2.110 595 3HD2 LEU 106 HD2 LEU 106 9.047 12.359 0.452 596 H LYS 107 HN LYS 107 6.747 14.066 -3.207 597 HA LYS 107 HA LYS 107 5.531 11.571 -2.712 598 1HB LYS 107 HB2 LYS 107 4.829 13.944 -3.913 599 2HB LYS 107 HB1 LYS 107 4.930 12.864 -5.288 600 1HG LYS 107 HG2 LYS 107 3.306 12.229 -2.845 601 2HG LYS 107 HG1 LYS 107 2.662 13.170 -4.171 602 1HD LYS 107 HD2 LYS 107 3.733 10.343 -4.379 603 2HD LYS 107 HD1 LYS 107 2.027 10.767 -4.266 604 1HE LYS 107 HE2 LYS 107 2.421 12.185 -6.356 605 2HE LYS 107 HE1 LYS 107 3.958 11.343 -6.496 606 1HZ LYS 107 HZ3 LYS 107 2.702 9.220 -6.537 607 2HZ LYS 107 HZ2 LYS 107 1.272 10.113 -6.530 608 3HZ LYS 107 HZ1 LYS 107 2.309 10.245 -7.824 609 H ASN 108 HN ASN 108 7.772 12.727 -5.151 610 HA ASN 108 HA ASN 108 7.759 10.483 -6.832 611 1HB ASN 108 HB2 ASN 108 8.746 12.636 -7.494 612 2HB ASN 108 HB1 ASN 108 10.002 12.438 -6.280 613 1HD2 ASN 108 HD2 ASN 108 11.638 12.520 -7.779 614 2HD2 ASN 108 HD2 ASN 108 11.955 11.236 -8.893 615 H LYS 109 HN LYS 109 9.709 11.253 -3.951 616 HA LYS 109 HA LYS 109 11.397 8.959 -4.060 617 1HB LYS 109 HB2 LYS 109 10.462 10.338 -1.523 618 2HB LYS 109 HB1 LYS 109 11.902 9.367 -1.722 619 1HG LYS 109 HG2 LYS 109 11.395 12.071 -2.936 620 2HG LYS 109 HG1 LYS 109 12.436 11.717 -1.561 621 1HD LYS 109 HD2 LYS 109 13.895 10.389 -3.012 622 2HD LYS 109 HD1 LYS 109 12.826 10.715 -4.382 623 1HE LYS 109 HE2 LYS 109 13.225 13.122 -4.095 624 2HE LYS 109 HE1 LYS 109 14.332 12.770 -2.774 625 1HZ LYS 109 HZ1 LYS 109 14.696 11.888 -5.588 626 2HZ LYS 109 HZ3 LYS 109 15.438 13.206 -4.871 627 3HZ LYS 109 HZ2 LYS 109 15.796 11.653 -4.329 628 H ILE 110 HN ILE 110 8.279 9.581 -2.596 629 HA ILE 110 HA ILE 110 7.885 7.122 -1.278 630 HB ILE 110 HB ILE 110 6.001 9.204 -2.362 631 1HG1 ILE 110 2HG1 ILE 110 6.898 8.406 0.403 632 2HG1 ILE 110 1HG1 ILE 110 7.434 9.809 -0.504 633 1HG2 ILE 110 3HG2 ILE 110 4.801 7.062 -2.418 634 2HG2 ILE 110 2HG2 ILE 110 5.247 6.768 -0.735 635 3HG2 ILE 110 1HG2 ILE 110 4.179 8.111 -1.142 636 1HD1 ILE 110 HD1 ILE 110 5.183 10.685 -0.439 637 2HD1 ILE 110 HD1 ILE 110 4.666 9.289 0.506 638 3HD1 ILE 110 HD1 ILE 110 5.846 10.422 1.175 639 H GLU 111 HN GLU 111 6.929 8.199 -4.532 640 HA GLU 111 HA GLU 111 5.857 5.752 -5.436 641 1HB GLU 111 HB2 GLU 111 7.362 7.856 -7.003 642 2HB GLU 111 HB1 GLU 111 6.503 6.507 -7.723 643 1HG GLU 111 HG2 GLU 111 5.278 8.728 -6.114 644 2HG GLU 111 HG1 GLU 111 5.233 8.564 -7.867 645 H ASN 112 HN ASN 112 9.058 7.056 -5.635 646 HA ASN 112 HA ASN 112 10.447 5.153 -6.976 647 1HB ASN 112 HB2 ASN 112 11.386 7.289 -6.386 648 2HB ASN 112 HB1 ASN 112 11.257 6.921 -4.675 649 1HD2 ASN 112 HD2 ASN 112 13.063 6.597 -7.502 650 2HD2 ASN 112 HD2 ASN 112 14.451 5.804 -6.832 651 H LYS 113 HN LYS 113 10.019 5.362 -3.474 652 HA LYS 113 HA LYS 113 11.554 3.039 -2.959 653 1HB LYS 113 HB2 LYS 113 11.083 5.127 -1.482 654 2HB LYS 113 HB1 LYS 113 9.653 4.245 -0.994 655 1HG LYS 113 HG2 LYS 113 11.504 3.945 0.578 656 2HG LYS 113 HG1 LYS 113 11.003 2.423 -0.157 657 1HD LYS 113 HD2 LYS 113 13.474 2.688 -0.014 658 2HD LYS 113 HD1 LYS 113 12.906 2.447 -1.657 659 1HE LYS 113 HE2 LYS 113 13.050 4.864 -2.027 660 2HE LYS 113 HE1 LYS 113 13.691 5.083 -0.390 661 1HZ LYS 113 HZ3 LYS 113 15.567 3.622 -1.078 662 2HZ LYS 113 HZ2 LYS 113 14.918 3.571 -2.637 663 3HZ LYS 113 HZ1 LYS 113 15.457 5.035 -1.998 664 H LYS 114 HN LYS 114 8.080 3.728 -3.000 665 HA LYS 114 HA LYS 114 7.054 1.278 -2.263 666 1HB LYS 114 HB2 LYS 114 5.664 3.224 -2.541 667 2HB LYS 114 HB1 LYS 114 6.121 3.340 -4.234 668 1HG LYS 114 HG2 LYS 114 4.964 1.219 -4.671 669 2HG LYS 114 HG1 LYS 114 4.463 1.161 -2.982 670 1HD LYS 114 HD2 LYS 114 2.658 2.034 -4.383 671 2HD LYS 114 HD1 LYS 114 3.258 3.275 -3.284 672 1HE LYS 114 HE2 LYS 114 4.610 4.227 -5.110 673 2HE LYS 114 HE1 LYS 114 3.997 2.956 -6.170 674 1HZ LYS 114 HZ2 LYS 114 2.242 4.968 -4.847 675 2HZ LYS 114 HZ1 LYS 114 2.900 5.141 -6.385 676 3HZ LYS 114 HZ3 LYS 114 1.823 3.892 -6.079 677 H LYS 115 HN LYS 115 8.004 2.513 -5.440 678 HA LYS 115 HA LYS 115 7.347 0.193 -6.873 679 1HB LYS 115 HB2 LYS 115 9.075 2.569 -7.464 680 2HB LYS 115 HB1 LYS 115 8.949 1.232 -8.606 681 1HG LYS 115 HG2 LYS 115 6.682 1.625 -9.020 682 2HG LYS 115 HG1 LYS 115 6.480 2.563 -7.542 683 1HD LYS 115 HD2 LYS 115 7.564 4.410 -8.423 684 2HD LYS 115 HD1 LYS 115 8.273 3.520 -9.766 685 1HE LYS 115 HE2 LYS 115 6.431 4.940 -10.539 686 2HE LYS 115 HE1 LYS 115 6.009 3.250 -10.727 687 1HZ LYS 115 HZ2 LYS 115 4.991 5.007 -8.493 688 2HZ LYS 115 HZ1 LYS 115 4.192 4.588 -9.882 689 3HZ LYS 115 HZ3 LYS 115 4.584 3.379 -8.813 690 H GLU 116 HN GLU 116 10.355 1.164 -5.323 691 HA GLU 116 HA GLU 116 11.899 -1.045 -6.137 692 1HB GLU 116 HB2 GLU 116 11.977 0.608 -3.616 693 2HB GLU 116 HB1 GLU 116 13.097 -0.707 -3.903 694 1HG GLU 116 HG2 GLU 116 13.789 0.491 -5.979 695 2HG GLU 116 HG1 GLU 116 12.789 1.844 -5.436 696 H LEU 117 HN LEU 117 9.604 -0.646 -3.551 697 HA LEU 117 HA LEU 117 10.017 -3.187 -2.397 698 1HB LEU 117 HB2 LEU 117 9.111 -1.503 -1.009 699 2HB LEU 117 HB1 LEU 117 7.875 -1.095 -2.168 700 HG LEU 117 HG LEU 117 7.024 -2.242 -0.096 701 1HD1 LEU 117 HD1 LEU 117 5.700 -2.038 -1.912 702 2HD1 LEU 117 HD1 LEU 117 6.338 -3.529 -2.608 703 3HD1 LEU 117 HD1 LEU 117 5.448 -3.580 -1.073 704 1HD2 LEU 117 HD2 LEU 117 8.408 -4.637 -1.253 705 2HD2 LEU 117 HD2 LEU 117 8.844 -3.824 0.247 706 3HD2 LEU 117 HD2 LEU 117 7.282 -4.639 0.110 707 H ILE 118 HN ILE 118 7.643 -1.913 -4.671 708 HA ILE 118 HA ILE 118 6.082 -4.136 -4.927 709 HB ILE 118 HB ILE 118 6.812 -2.151 -7.115 710 1HG1 ILE 118 2HG1 ILE 118 4.327 -2.286 -5.403 711 2HG1 ILE 118 1HG1 ILE 118 5.725 -1.295 -5.005 712 1HG2 ILE 118 3HG2 ILE 118 4.511 -4.132 -7.057 713 2HG2 ILE 118 2HG2 ILE 118 4.746 -2.872 -8.264 714 3HG2 ILE 118 1HG2 ILE 118 5.903 -4.188 -8.131 715 1HD1 ILE 118 HD1 ILE 118 4.107 -1.046 -7.525 716 2HD1 ILE 118 HD1 ILE 118 3.927 -0.033 -6.082 717 3HD1 ILE 118 HD1 ILE 118 5.428 -0.006 -7.001 718 H GLN 119 HN GLN 119 9.049 -3.293 -6.607 719 HA GLN 119 HA GLN 119 9.330 -5.484 -8.310 720 1HB GLN 119 HB2 GLN 119 11.453 -3.883 -6.888 721 2HB GLN 119 HB1 GLN 119 11.783 -5.031 -8.169 722 1HG GLN 119 HG2 GLN 119 10.480 -3.678 -9.725 723 2HG GLN 119 HG1 GLN 119 10.121 -2.539 -8.429 724 1HE2 GLN 119 1HE2 GLN 119 11.513 -2.162 -10.951 725 2HE2 GLN 119 2HE2 GLN 119 13.063 -1.517 -10.577 726 H LEU 120 HN LEU 120 10.166 -5.131 -4.906 727 HA LEU 120 HA LEU 120 11.492 -7.637 -4.656 728 1HB LEU 120 HB2 LEU 120 10.246 -5.902 -2.529 729 2HB LEU 120 HB1 LEU 120 11.245 -7.307 -2.223 730 HG LEU 120 HG LEU 120 12.156 -4.769 -3.565 731 1HD1 LEU 120 HD1 LEU 120 11.702 -4.481 -1.195 732 2HD1 LEU 120 HD1 LEU 120 12.722 -5.872 -0.822 733 3HD1 LEU 120 HD1 LEU 120 13.433 -4.419 -1.523 734 1HD2 LEU 120 HD2 LEU 120 13.689 -7.249 -2.760 735 2HD2 LEU 120 HD2 LEU 120 13.390 -6.683 -4.407 736 3HD2 LEU 120 HD2 LEU 120 14.409 -5.742 -3.327 737 H VAL 121 HN VAL 121 8.209 -6.550 -3.682 738 HA VAL 121 HA VAL 121 7.292 -9.068 -2.885 739 HB VAL 121 HB VAL 121 5.606 -6.959 -4.270 740 1HG1 VAL 121 3HG1 VAL 121 4.452 -9.076 -3.904 741 2HG1 VAL 121 2HG1 VAL 121 4.875 -9.020 -2.194 742 3HG1 VAL 121 1HG1 VAL 121 3.789 -7.806 -2.876 743 1HG2 VAL 121 1HG2 VAL 121 6.429 -7.127 -1.382 744 2HG2 VAL 121 3HG2 VAL 121 6.894 -5.897 -2.562 745 3HG2 VAL 121 2HG2 VAL 121 5.213 -6.026 -2.045 746 H ALA 122 HN ALA 122 7.374 -7.596 -6.079 747 HA ALA 122 HA ALA 122 5.979 -9.524 -7.507 748 1HB ALA 122 HB1 ALA 122 8.234 -7.790 -8.470 749 2HB ALA 122 HB3 ALA 122 7.008 -8.569 -9.485 750 3HB ALA 122 HB2 ALA 122 6.545 -7.308 -8.343 751 H ARG 123 HN ARG 123 9.487 -9.283 -6.864 752 HA ARG 123 HA ARG 123 10.075 -11.643 -8.367 753 1HB ARG 123 HB2 ARG 123 12.356 -11.425 -7.565 754 2HB ARG 123 HB1 ARG 123 11.752 -9.873 -8.116 755 1HG ARG 123 HG2 ARG 123 11.293 -9.310 -5.727 756 2HG ARG 123 HG1 ARG 123 12.120 -10.802 -5.283 757 1HD ARG 123 HD2 ARG 123 13.335 -8.513 -6.841 758 2HD ARG 123 HD1 ARG 123 13.602 -8.846 -5.137 759 HE ARG 123 HE ARG 123 14.642 -10.958 -5.835 760 1HH1 ARG 123 1HH1 ARG 123 14.437 -8.374 -8.262 761 2HH1 ARG 123 2HH1 ARG 123 15.809 -8.893 -9.112 762 1HH2 ARG 123 1HH2 ARG 123 16.509 -11.628 -6.957 763 2HH2 ARG 123 2HH2 ARG 123 17.035 -10.790 -8.352 764 H HIS 124 HN HIS 124 8.668 -11.245 -5.425 765 HA HIS 124 HA HIS 124 9.776 -13.461 -4.053 766 1HB HIS 124 HB2 HIS 124 8.632 -11.752 -2.802 767 2HB HIS 124 HB1 HIS 124 7.124 -11.998 -3.657 768 HD1 HIS 124 HD1 HIS 124 5.651 -14.068 -2.790 769 HD2 HIS 124 HD2 HIS 124 9.304 -13.600 -0.906 770 HE1 HIS 124 HE1 HIS 124 5.635 -15.642 -0.849 771 H GLY 125 HN GLY 125 7.304 -13.092 -6.496 772 1HA GLY 125 HA1 GLY 125 6.293 -15.781 -5.991 773 2HA GLY 125 HA2 GLY 125 7.183 -15.560 -7.488 774 H LEU 126 HN LEU 126 5.426 -12.752 -6.662 775 HA LEU 126 HA LEU 126 2.914 -13.265 -7.458 776 1HB LEU 126 HB2 LEU 126 4.644 -10.891 -7.430 777 2HB LEU 126 HB1 LEU 126 3.096 -10.785 -8.246 778 HG LEU 126 HG LEU 126 2.013 -11.505 -6.186 779 1HD1 LEU 126 HD1 LEU 126 3.703 -12.697 -5.112 780 2HD1 LEU 126 HD1 LEU 126 4.679 -11.231 -4.886 781 3HD1 LEU 126 HD1 LEU 126 3.099 -11.400 -4.083 782 1HD2 LEU 126 HD2 LEU 126 3.687 -9.034 -6.026 783 2HD2 LEU 126 HD2 LEU 126 2.086 -9.183 -6.756 784 3HD2 LEU 126 HD2 LEU 126 2.285 -9.348 -5.005 785 H ASP 127 HN ASP 127 1.792 -13.204 -9.185 786 HA ASP 127 HA ASP 127 2.890 -13.757 -11.784 787 1HB ASP 127 HB2 ASP 127 0.039 -12.966 -11.068 788 2HB ASP 127 HB1 ASP 127 0.560 -13.639 -12.592 789 H HIS 128 HN HIS 128 2.060 -12.398 -13.661 790 HA HIS 128 HA HIS 128 3.082 -9.795 -13.649 791 1HB HIS 128 HB2 HIS 128 2.698 -11.210 -15.673 792 2HB HIS 128 HB1 HIS 128 0.973 -10.981 -15.490 793 HD1 HIS 128 HD1 HIS 128 3.645 -9.812 -17.493 794 HD2 HIS 128 HD2 HIS 128 0.416 -7.978 -15.628 795 HE1 HIS 128 HE1 HIS 128 3.284 -7.650 -18.700 796 H ASP 129 HN ASP 129 -0.283 -10.898 -13.558 797 HA ASP 129 HA ASP 129 -1.367 -8.293 -13.266 798 1HB ASP 129 HB2 ASP 129 -2.594 -11.011 -12.855 799 2HB ASP 129 HB1 ASP 129 -3.489 -9.520 -12.608 800 H LYS 130 HN LYS 130 -0.245 -10.640 -11.050 801 HA LYS 130 HA LYS 130 -1.451 -9.686 -8.684 802 1HB LYS 130 HB2 LYS 130 1.115 -11.141 -9.208 803 2HB LYS 130 HB1 LYS 130 0.603 -10.718 -7.582 804 1HG LYS 130 HG2 LYS 130 -1.340 -12.120 -9.296 805 2HG LYS 130 HG1 LYS 130 0.036 -13.064 -8.708 806 1HD LYS 130 HD2 LYS 130 -0.516 -12.591 -6.472 807 2HD LYS 130 HD1 LYS 130 -1.743 -11.419 -6.896 808 1HE LYS 130 HE2 LYS 130 -2.793 -13.528 -6.274 809 2HE LYS 130 HE1 LYS 130 -3.019 -13.257 -7.998 810 1HZ LYS 130 HZ2 LYS 130 -0.935 -15.044 -6.821 811 2HZ LYS 130 HZ1 LYS 130 -2.382 -15.546 -7.520 812 3HZ LYS 130 HZ3 LYS 130 -1.205 -14.813 -8.466 813 H VAL 131 HN VAL 131 1.567 -8.799 -10.318 814 HA VAL 131 HA VAL 131 2.475 -6.938 -8.425 815 HB VAL 131 HB VAL 131 2.949 -6.957 -11.433 816 1HG1 VAL 131 3HG1 VAL 131 3.610 -4.859 -10.410 817 2HG1 VAL 131 2HG1 VAL 131 4.593 -5.731 -9.237 818 3HG1 VAL 131 1HG1 VAL 131 5.014 -5.780 -10.950 819 1HG2 VAL 131 2HG2 VAL 131 4.506 -8.304 -9.238 820 2HG2 VAL 131 1HG2 VAL 131 3.523 -9.104 -10.458 821 3HG2 VAL 131 3HG2 VAL 131 4.978 -8.230 -10.939 822 H LEU 132 HN LEU 132 0.322 -6.738 -11.177 823 HA LEU 132 HA LEU 132 0.010 -3.936 -11.232 824 1HB LEU 132 HB2 LEU 132 -1.883 -6.076 -12.177 825 2HB LEU 132 HB1 LEU 132 -1.981 -4.376 -12.585 826 HG LEU 132 HG LEU 132 0.239 -6.258 -13.376 827 1HD1 LEU 132 HD1 LEU 132 -1.947 -4.967 -14.968 828 2HD1 LEU 132 HD1 LEU 132 -0.617 -5.919 -15.626 829 3HD1 LEU 132 HD1 LEU 132 -1.812 -6.678 -14.566 830 1HD2 LEU 132 HD2 LEU 132 -0.184 -3.337 -14.025 831 2HD2 LEU 132 HD2 LEU 132 1.117 -4.023 -13.046 832 3HD2 LEU 132 HD2 LEU 132 1.021 -4.384 -14.769 833 H LEU 133 HN LEU 133 -2.134 -6.457 -9.853 834 HA LEU 133 HA LEU 133 -3.919 -4.616 -8.689 835 1HB LEU 133 HB2 LEU 133 -3.349 -7.492 -8.068 836 2HB LEU 133 HB1 LEU 133 -4.394 -6.565 -7.021 837 HG LEU 133 HG LEU 133 -5.766 -7.828 -8.438 838 1HD1 LEU 133 HD1 LEU 133 -6.565 -5.614 -8.023 839 2HD1 LEU 133 HD1 LEU 133 -5.775 -5.020 -9.487 840 3HD1 LEU 133 HD1 LEU 133 -7.080 -6.198 -9.600 841 1HD2 LEU 133 HD2 LEU 133 -4.231 -6.737 -10.790 842 2HD2 LEU 133 HD2 LEU 133 -4.222 -8.398 -10.194 843 3HD2 LEU 133 HD2 LEU 133 -5.694 -7.723 -10.892 844 H PHE 134 HN PHE 134 -1.060 -6.162 -7.349 845 HA PHE 134 HA PHE 134 -1.342 -5.197 -4.758 846 1HB PHE 134 HB2 PHE 134 0.253 -6.948 -5.197 847 2HB PHE 134 HB1 PHE 134 1.156 -5.918 -6.307 848 HD1 PHE 134 HD1 PHE 134 0.096 -6.188 -2.762 849 HD2 PHE 134 HD2 PHE 134 2.937 -4.654 -5.538 850 HE1 PHE 134 HE1 PHE 134 1.464 -5.347 -0.909 851 HE2 PHE 134 HE2 PHE 134 4.309 -3.821 -3.646 852 HZ PHE 134 HZ PHE 134 3.564 -4.132 -1.397 853 H SER 135 HN SER 135 0.466 -3.801 -7.483 854 HA SER 135 HA SER 135 1.532 -1.683 -6.030 855 1HB SER 135 HB2 SER 135 1.986 -0.664 -8.278 856 2HB SER 135 HB1 SER 135 2.550 -2.327 -8.087 857 HG SER 135 HG SER 135 1.031 -3.033 -9.381 858 H ARG 136 HN ARG 136 -1.399 -1.809 -8.005 859 HA ARG 136 HA ARG 136 -1.907 0.966 -7.624 860 1HB ARG 136 HB2 ARG 136 -4.007 0.596 -8.755 861 2HB ARG 136 HB1 ARG 136 -2.693 -0.185 -9.617 862 1HG ARG 136 HG2 ARG 136 -3.387 -2.340 -8.598 863 2HG ARG 136 HG1 ARG 136 -4.765 -1.514 -7.873 864 1HD ARG 136 HD2 ARG 136 -4.142 -1.799 -10.797 865 2HD ARG 136 HD1 ARG 136 -5.460 -2.578 -9.919 866 HE ARG 136 HE ARG 136 -5.702 0.163 -9.576 867 1HH1 ARG 136 1HH1 ARG 136 -5.902 -2.131 -12.265 868 2HH1 ARG 136 2HH1 ARG 136 -7.053 -1.215 -13.134 869 1HH2 ARG 136 1HH2 ARG 136 -7.192 1.440 -10.790 870 2HH2 ARG 136 2HH2 ARG 136 -7.812 0.857 -12.271 871 H ASP 137 HN ASP 137 -2.761 -1.880 -5.814 872 HA ASP 137 HA ASP 137 -4.898 -0.532 -4.426 873 1HB ASP 137 HB2 ASP 137 -4.723 -3.051 -4.735 874 2HB ASP 137 HB1 ASP 137 -3.489 -3.013 -3.484 875 H LEU 138 HN LEU 138 -1.564 -1.310 -3.820 876 HA LEU 138 HA LEU 138 -1.442 -0.242 -1.209 877 1HB LEU 138 HB2 LEU 138 0.169 -1.851 -2.276 878 2HB LEU 138 HB1 LEU 138 0.755 -0.544 -3.275 879 HG LEU 138 HG LEU 138 0.969 -0.422 -0.265 880 1HD1 LEU 138 HD1 LEU 138 2.077 -2.479 -1.099 881 2HD1 LEU 138 HD1 LEU 138 2.953 -1.483 -2.268 882 3HD1 LEU 138 HD1 LEU 138 3.243 -1.269 -0.547 883 1HD2 LEU 138 HD2 LEU 138 1.369 1.614 -1.504 884 2HD2 LEU 138 HD2 LEU 138 2.845 0.946 -0.761 885 3HD2 LEU 138 HD2 LEU 138 2.547 0.703 -2.484 886 H ASP 139 HN ASP 139 -1.067 1.052 -4.413 887 HA ASP 139 HA ASP 139 -0.067 3.592 -3.951 888 1HB ASP 139 HB2 ASP 139 -0.447 2.592 -6.200 889 2HB ASP 139 HB1 ASP 139 -2.170 2.771 -5.961 890 H LYS 140 HN LYS 140 -3.412 2.467 -3.979 891 HA LYS 140 HA LYS 140 -4.692 4.901 -3.432 892 1HB LYS 140 HB2 LYS 140 -5.593 2.121 -2.717 893 2HB LYS 140 HB1 LYS 140 -6.585 3.563 -2.623 894 1HG LYS 140 HG2 LYS 140 -6.201 3.819 -5.125 895 2HG LYS 140 HG1 LYS 140 -5.505 2.196 -5.083 896 1HD LYS 140 HD2 LYS 140 -8.296 2.922 -4.177 897 2HD LYS 140 HD1 LYS 140 -7.893 2.190 -5.726 898 1HE LYS 140 HE2 LYS 140 -7.268 0.901 -3.061 899 2HE LYS 140 HE1 LYS 140 -8.766 0.637 -3.942 900 1HZ LYS 140 HZ3 LYS 140 -6.180 0.179 -5.248 901 2HZ LYS 140 HZ2 LYS 140 -6.883 -1.033 -4.272 902 3HZ LYS 140 HZ1 LYS 140 -7.668 -0.454 -5.637 903 H LEU 141 HN LEU 141 -3.319 2.477 -1.307 904 HA LEU 141 HA LEU 141 -4.452 3.440 1.097 905 1HB LEU 141 HB2 LEU 141 -3.584 1.176 0.924 906 2HB LEU 141 HB1 LEU 141 -1.976 1.790 0.621 907 HG LEU 141 HG LEU 141 -1.927 2.737 2.904 908 1HD1 LEU 141 HD1 LEU 141 -4.559 1.325 3.242 909 2HD1 LEU 141 HD1 LEU 141 -3.590 2.020 4.542 910 3HD1 LEU 141 HD1 LEU 141 -4.265 3.069 3.296 911 1HD2 LEU 141 HD2 LEU 141 -2.494 -0.220 2.742 912 2HD2 LEU 141 HD2 LEU 141 -0.941 0.569 2.473 913 3HD2 LEU 141 HD2 LEU 141 -1.678 0.598 4.073 914 H ILE 142 HN ILE 142 -1.466 4.097 -0.564 915 HA ILE 142 HA ILE 142 -0.334 5.675 1.524 916 HB ILE 142 HB ILE 142 0.328 5.839 -1.434 917 1HG1 ILE 142 2HG1 ILE 142 1.530 4.170 0.768 918 2HG1 ILE 142 1HG1 ILE 142 0.621 3.574 -0.617 919 1HG2 ILE 142 1HG2 ILE 142 1.892 6.677 1.015 920 2HG2 ILE 142 3HG2 ILE 142 2.483 6.731 -0.644 921 3HG2 ILE 142 2HG2 ILE 142 1.141 7.764 -0.156 922 1HD1 ILE 142 HD1 ILE 142 2.366 4.462 -2.083 923 2HD1 ILE 142 HD1 ILE 142 3.317 4.903 -0.664 924 3HD1 ILE 142 HD1 ILE 142 2.943 3.202 -0.984 925 H ASN 143 HN ASN 143 -1.799 6.591 -1.545 926 HA ASN 143 HA ASN 143 -1.884 9.340 -1.206 927 1HB ASN 143 HB2 ASN 143 -3.763 7.511 -2.708 928 2HB ASN 143 HB1 ASN 143 -3.901 9.266 -2.759 929 1HD2 ASN 143 HD2 ASN 143 -3.236 7.225 -4.842 930 2HD2 ASN 143 HD2 ASN 143 -1.738 7.728 -5.517 931 H LYS 144 HN LYS 144 -4.056 6.921 0.036 932 HA LYS 144 HA LYS 144 -6.176 8.450 1.031 933 1HB LYS 144 HB2 LYS 144 -6.037 5.962 0.988 934 2HB LYS 144 HB1 LYS 144 -4.887 6.039 2.307 935 1HG LYS 144 HG2 LYS 144 -6.684 7.192 3.672 936 2HG LYS 144 HG1 LYS 144 -7.785 6.785 2.352 937 1HD LYS 144 HD2 LYS 144 -6.194 4.806 3.952 938 2HD LYS 144 HD1 LYS 144 -7.908 5.159 4.152 939 1HE LYS 144 HE2 LYS 144 -6.611 4.025 1.665 940 2HE LYS 144 HE1 LYS 144 -7.538 3.138 2.870 941 1HZ LYS 144 HZ3 LYS 144 -9.486 4.474 2.287 942 2HZ LYS 144 HZ2 LYS 144 -8.602 5.263 1.081 943 3HZ LYS 144 HZ1 LYS 144 -8.871 3.608 0.970 944 H PHE 145 HN PHE 145 -3.115 7.518 2.554 945 HA PHE 145 HA PHE 145 -3.725 8.970 4.933 946 1HB PHE 145 HB2 PHE 145 -1.473 7.231 4.081 947 2HB PHE 145 HB1 PHE 145 -1.264 8.324 5.448 948 HD1 PHE 145 HD1 PHE 145 -3.194 5.450 4.186 949 HD2 PHE 145 HD2 PHE 145 -2.296 7.968 7.463 950 HE1 PHE 145 HE1 PHE 145 -4.354 3.875 5.683 951 HE2 PHE 145 HE2 PHE 145 -3.459 6.399 8.999 952 HZ PHE 145 HZ PHE 145 -4.486 4.352 8.098 953 H MET 146 HN MET 146 -1.923 9.549 2.074 954 HA MET 146 HA MET 146 -0.352 11.769 3.068 955 1HB MET 146 HB2 MET 146 -1.188 11.293 0.214 956 2HB MET 146 HB1 MET 146 0.176 12.223 0.803 957 1HG MET 146 HG2 MET 146 1.097 10.035 1.684 958 2HG MET 146 HG1 MET 146 -0.186 9.264 0.775 959 1HE MET 146 HE1 MET 146 3.068 11.119 0.725 960 2HE MET 146 HE3 MET 146 3.314 11.629 -0.940 961 3HE MET 146 HE2 MET 146 2.043 12.388 0.037 962 H ASN 147 HN ASN 147 -3.584 11.311 2.086 963 HA ASN 147 HA ASN 147 -5.388 12.603 1.761 964 1HB ASN 147 HB2 ASN 147 -3.576 14.536 3.082 965 2HB ASN 147 HB1 ASN 147 -5.247 15.000 2.678 966 1HD2 ASN 147 HD2 ASN 147 -6.235 12.301 3.471 967 2HD2 ASN 147 HD2 ASN 147 -6.112 12.248 5.186 968 H VAL 148 HN VAL 148 -3.030 12.468 -0.061 969 HA VAL 148 HA VAL 148 -3.330 14.895 -1.636 970 HB VAL 148 HB VAL 148 -1.542 12.525 -2.109 971 1HG1 VAL 148 1HG1 VAL 148 -2.010 13.756 -4.160 972 2HG1 VAL 148 3HG1 VAL 148 -1.539 15.269 -3.384 973 3HG1 VAL 148 2HG1 VAL 148 -0.333 14.013 -3.682 974 1HG2 VAL 148 2HG2 VAL 148 -0.931 13.701 -0.053 975 2HG2 VAL 148 1HG2 VAL 148 0.306 13.929 -1.296 976 3HG2 VAL 148 3HG2 VAL 148 -0.846 15.217 -0.939 977 H LYS 149 HN LYS 149 -4.949 14.855 -2.803 978 HA LYS 149 HA LYS 149 -5.879 12.354 -3.951 979 1HB LYS 149 HB2 LYS 149 -7.354 14.946 -3.456 980 2HB LYS 149 HB1 LYS 149 -8.059 13.462 -4.091 981 1HG LYS 149 HG2 LYS 149 -6.823 13.768 -1.359 982 2HG LYS 149 HG1 LYS 149 -8.551 13.800 -1.706 983 1HD LYS 149 HD2 LYS 149 -8.477 11.517 -2.501 984 2HD LYS 149 HD1 LYS 149 -6.722 11.470 -2.316 985 1HE LYS 149 HE2 LYS 149 -7.847 10.333 -0.474 986 2HE LYS 149 HE1 LYS 149 -6.951 11.742 0.078 987 1HZ LYS 149 HZ2 LYS 149 -9.888 11.710 -0.409 988 2HZ LYS 149 HZ1 LYS 149 -9.147 11.538 1.092 989 3HZ LYS 149 HZ3 LYS 149 -8.983 12.977 0.243 990 H ASP 150 HN ASP 150 -3.755 13.614 -5.051 991 HA ASP 150 HA ASP 150 -4.496 15.404 -7.145 992 1HB ASP 150 HB2 ASP 150 -2.287 15.587 -6.119 993 2HB ASP 150 HB1 ASP 150 -1.888 13.956 -6.633 994 H LYS 151 HN LYS 151 -6.096 14.125 -7.935 995 HA LYS 151 HA LYS 151 -5.211 12.338 -10.105 996 1HB LYS 151 HB2 LYS 151 -7.396 11.175 -9.891 997 2HB LYS 151 HB1 LYS 151 -6.440 11.027 -8.426 998 1HG LYS 151 HG2 LYS 151 -7.758 12.748 -7.346 999 2HG LYS 151 HG1 LYS 151 -8.674 13.003 -8.832 1000 1HD LYS 151 HD2 LYS 151 -8.593 10.399 -7.310 1001 2HD LYS 151 HD1 LYS 151 -9.826 11.644 -7.103 1002 1HE LYS 151 HE2 LYS 151 -9.233 10.135 -9.659 1003 2HE LYS 151 HE1 LYS 151 -10.590 9.843 -8.580 1004 1HZ LYS 151 HZ2 LYS 151 -11.334 12.151 -9.035 1005 2HZ LYS 151 HZ1 LYS 151 -10.115 12.333 -10.151 1006 3HZ LYS 151 HZ3 LYS 151 -11.328 11.209 -10.410 1007 H VAL 152 HN VAL 152 -5.828 15.215 -9.520 1008 HA VAL 152 HA VAL 152 -8.181 15.823 -11.067 1009 HB VAL 152 HB VAL 152 -7.643 18.196 -10.566 1010 1HG1 VAL 152 1HG1 VAL 152 -7.579 16.371 -8.168 1011 2HG1 VAL 152 3HG1 VAL 152 -7.992 18.085 -8.140 1012 3HG1 VAL 152 2HG1 VAL 152 -9.024 16.948 -9.006 1013 1HG2 VAL 152 3HG2 VAL 152 -5.266 17.053 -9.073 1014 2HG2 VAL 152 2HG2 VAL 152 -5.196 18.045 -10.527 1015 3HG2 VAL 152 1HG2 VAL 152 -5.800 18.734 -9.021 1016 H HIS 153 HN HIS 153 -7.819 17.786 -12.624 1017 HA HIS 153 HA HIS 153 -6.069 16.781 -14.631 1018 1HB HIS 153 HB2 HIS 153 -7.013 18.576 -16.094 1019 2HB HIS 153 HB1 HIS 153 -8.250 17.587 -15.347 1020 HD1 HIS 153 HD1 HIS 153 -9.633 18.823 -13.316 1021 HD2 HIS 153 HD2 HIS 153 -7.267 21.226 -15.748 1022 HE1 HIS 153 HE1 HIS 153 -10.373 21.178 -12.903 1023 H LYS 154 HN LYS 154 -4.060 17.059 -14.449 1024 HA LYS 154 HA LYS 154 -2.892 19.344 -13.125 1025 1HB LYS 154 HB2 LYS 154 -1.614 16.933 -14.447 1026 2HB LYS 154 HB1 LYS 154 -0.812 18.074 -13.374 1027 1HG LYS 154 HG2 LYS 154 -2.057 17.324 -11.490 1028 2HG LYS 154 HG1 LYS 154 -3.166 16.407 -12.502 1029 1HD LYS 154 HD2 LYS 154 -1.688 14.848 -11.475 1030 2HD LYS 154 HD1 LYS 154 -1.216 14.965 -13.167 1031 1HE LYS 154 HE2 LYS 154 0.756 14.922 -11.781 1032 2HE LYS 154 HE1 LYS 154 0.590 16.527 -12.494 1033 1HZ LYS 154 HZ3 LYS 154 -0.334 15.815 -9.780 1034 2HZ LYS 154 HZ2 LYS 154 1.179 16.494 -10.088 1035 3HZ LYS 154 HZ1 LYS 154 -0.230 17.369 -10.423 1036 H LEU 155 HN LEU 155 -2.034 21.036 -14.214 1037 HA LEU 155 HA LEU 155 -2.498 21.175 -17.019 1038 1HB LEU 155 HB2 LEU 155 -1.748 23.440 -16.983 1039 2HB LEU 155 HB1 LEU 155 -2.743 23.183 -15.575 1040 HG LEU 155 HG LEU 155 0.282 23.269 -15.500 1041 1HD1 LEU 155 HD1 LEU 155 -0.622 25.401 -16.261 1042 2HD1 LEU 155 HD1 LEU 155 -1.721 25.433 -14.879 1043 3HD1 LEU 155 HD1 LEU 155 0.021 25.525 -14.625 1044 1HD2 LEU 155 HD2 LEU 155 -1.795 23.487 -13.324 1045 2HD2 LEU 155 HD2 LEU 155 -0.749 22.099 -13.605 1046 3HD2 LEU 155 HD2 LEU 155 -0.052 23.639 -13.099 1047 H GLU 156 HN GLU 156 -1.121 21.286 -18.662 1048 HA GLU 156 HA GLU 156 1.647 20.543 -18.120 1049 1HB GLU 156 HB2 GLU 156 -0.169 19.779 -20.421 1050 2HB GLU 156 HB1 GLU 156 1.573 19.580 -20.476 1051 1HG GLU 156 HG2 GLU 156 -0.230 18.277 -18.440 1052 2HG GLU 156 HG1 GLU 156 0.354 17.501 -19.911 1053 H HIS 157 HN HIS 157 3.172 21.632 -19.344 1054 HA HIS 157 HA HIS 157 2.349 24.337 -19.922 1055 1HB HIS 157 HB2 HIS 157 5.034 23.026 -19.887 1056 2HB HIS 157 HB1 HIS 157 4.774 24.735 -20.187 1057 HD1 HIS 157 HD1 HIS 157 4.022 26.210 -18.133 1058 HD2 HIS 157 HD2 HIS 157 4.764 22.230 -17.204 1059 HE1 HIS 157 HE1 HIS 157 4.083 26.077 -15.608 1060 H HIS 158 HN HIS 158 1.172 23.025 -21.744 1061 HA HIS 158 HA HIS 158 2.631 22.292 -23.985 1062 1HB HIS 158 HB2 HIS 158 0.430 22.306 -25.239 1063 2HB HIS 158 HB1 HIS 158 0.439 21.362 -23.760 1064 HD1 HIS 158 HD1 HIS 158 -1.793 21.615 -22.607 1065 HD2 HIS 158 HD2 HIS 158 -0.597 25.144 -24.459 1066 HE1 HIS 158 HE1 HIS 158 -3.576 23.304 -22.115 1067 H HIS 159 HN HIS 159 1.987 25.335 -22.878 1068 HA HIS 159 HA HIS 159 1.799 26.808 -25.280 1069 1HB HIS 159 HB2 HIS 159 2.390 28.794 -23.893 1070 2HB HIS 159 HB1 HIS 159 1.123 27.824 -23.161 1071 HD1 HIS 159 HD1 HIS 159 4.578 29.090 -22.575 1072 HD2 HIS 159 HD2 HIS 159 1.903 26.457 -20.806 1073 HE1 HIS 159 HE1 HIS 159 5.496 28.596 -20.274 1074 H HIS 160 HN HIS 160 4.485 25.503 -23.499 1075 HA HIS 160 HA HIS 160 6.307 26.614 -25.536 1076 1HB HIS 160 HB2 HIS 160 6.740 27.619 -23.317 1077 2HB HIS 160 HB1 HIS 160 6.954 26.016 -22.629 1078 HD1 HIS 160 HD1 HIS 160 9.440 25.711 -22.167 1079 HD2 HIS 160 HD2 HIS 160 8.717 27.741 -25.732 1080 HE1 HIS 160 HE1 HIS 160 11.681 26.087 -23.242 1081 H HIS 161 HN HIS 161 5.274 23.842 -23.723 1082 HA HIS 161 HA HIS 161 7.409 22.179 -24.657 1083 1HB HIS 161 HB2 HIS 161 4.901 21.539 -23.085 1084 2HB HIS 161 HB1 HIS 161 6.106 20.340 -23.527 1085 HD1 HIS 161 HD1 HIS 161 6.590 19.873 -20.985 1086 HD2 HIS 161 HD2 HIS 161 7.354 23.770 -22.192 1087 HE1 HIS 161 HE1 HIS 161 7.856 20.950 -19.103 1088 H HIS 162 HN HIS 162 7.418 21.746 -26.673 1089 HA HIS 162 HA HIS 162 5.085 20.504 -27.874 1090 1HB HIS 162 HB2 HIS 162 5.280 22.809 -28.799 1091 2HB HIS 162 HB1 HIS 162 6.959 22.498 -29.218 1092 HD1 HIS 162 HD1 HIS 162 7.235 21.949 -31.653 1093 HD2 HIS 162 HD2 HIS 162 3.522 20.790 -30.199 1094 HE1 HIS 162 HE1 HIS 162 5.993 20.995 -33.611 No H/Q in entry = 1094 Start of MODEL 5 1 H1 MET 1 HT3 MET 1 16.386 -14.258 -5.365 2 H2 MET 1 HT2 MET 1 17.765 -13.596 -6.127 3 H3 MET 1 HT1 MET 1 17.792 -15.151 -5.497 4 HA MET 1 HA MET 1 18.936 -13.803 -3.997 5 1HB MET 1 HB2 MET 1 16.323 -12.300 -3.663 6 2HB MET 1 HB1 MET 1 17.840 -11.965 -2.848 7 1HG MET 1 HG2 MET 1 17.211 -11.557 -5.765 8 2HG MET 1 HG1 MET 1 17.471 -10.315 -4.549 9 1HE MET 1 HE2 MET 1 19.980 -11.337 -2.939 10 2HE MET 1 HE1 MET 1 21.322 -10.641 -3.846 11 3HE MET 1 HE3 MET 1 19.871 -9.686 -3.550 12 H GLU 2 HN GLU 2 18.658 -14.257 -1.658 13 HA GLU 2 HA GLU 2 17.012 -16.579 -1.329 14 1HB GLU 2 HB2 GLU 2 18.604 -15.064 0.744 15 2HB GLU 2 HB1 GLU 2 17.928 -16.676 0.930 16 1HG GLU 2 HG2 GLU 2 19.369 -17.322 -1.073 17 2HG GLU 2 HG1 GLU 2 20.213 -15.801 -0.790 18 H MET 3 HN MET 3 15.003 -16.657 -0.634 19 HA MET 3 HA MET 3 13.501 -14.341 -0.546 20 1HB MET 3 HB2 MET 3 11.564 -15.641 0.005 21 2HB MET 3 HB1 MET 3 12.541 -16.490 -1.172 22 1HG MET 3 HG2 MET 3 13.372 -17.975 0.557 23 2HG MET 3 HG1 MET 3 12.450 -17.084 1.768 24 1HE MET 3 HE1 MET 3 11.363 -19.313 2.593 25 2HE MET 3 HE3 MET 3 10.473 -20.422 1.557 26 3HE MET 3 HE2 MET 3 12.218 -20.257 1.371 27 H GLY 4 HN GLY 4 14.985 -15.977 2.148 28 1HA GLY 4 HA1 GLY 4 15.027 -15.435 4.385 29 2HA GLY 4 HA2 GLY 4 13.418 -14.754 4.173 30 H GLN 5 HN GLN 5 16.615 -13.969 2.883 31 HA GLN 5 HA GLN 5 16.947 -11.499 4.226 32 1HB GLN 5 HB2 GLN 5 18.053 -12.366 1.559 33 2HB GLN 5 HB1 GLN 5 18.590 -10.964 2.462 34 1HG GLN 5 HG2 GLN 5 19.384 -12.433 4.243 35 2HG GLN 5 HG1 GLN 5 18.838 -13.835 3.317 36 1HE2 GLN 5 1HE2 GLN 5 20.873 -14.665 3.116 37 2HE2 GLN 5 2HE2 GLN 5 22.075 -13.995 2.092 38 H LEU 6 HN LEU 6 15.751 -12.327 1.048 39 HA LEU 6 HA LEU 6 15.246 -9.811 0.014 40 1HB LEU 6 HB2 LEU 6 15.306 -11.893 -1.284 41 2HB LEU 6 HB1 LEU 6 13.880 -12.450 -0.462 42 HG LEU 6 HG LEU 6 13.581 -11.759 -2.848 43 1HD1 LEU 6 HD1 LEU 6 11.880 -10.449 -0.770 44 2HD1 LEU 6 HD1 LEU 6 11.467 -10.575 -2.492 45 3HD1 LEU 6 HD1 LEU 6 11.680 -12.017 -1.514 46 1HD2 LEU 6 HD2 LEU 6 14.994 -9.786 -2.876 47 2HD2 LEU 6 HD2 LEU 6 13.338 -9.396 -3.352 48 3HD2 LEU 6 HD2 LEU 6 13.908 -8.984 -1.732 49 H LYS 7 HN LYS 7 13.155 -11.884 1.947 50 HA LYS 7 HA LYS 7 10.861 -10.241 1.932 51 1HB LYS 7 HB2 LYS 7 11.595 -12.672 3.030 52 2HB LYS 7 HB1 LYS 7 11.331 -11.608 4.417 53 1HG LYS 7 HG2 LYS 7 9.332 -11.823 2.202 54 2HG LYS 7 HG1 LYS 7 9.339 -13.022 3.466 55 1HD LYS 7 HD2 LYS 7 8.991 -10.022 3.834 56 2HD LYS 7 HD1 LYS 7 7.678 -11.195 3.825 57 1HE LYS 7 HE2 LYS 7 8.756 -12.293 5.819 58 2HE LYS 7 HE1 LYS 7 9.909 -10.967 5.858 59 1HZ LYS 7 HZ2 LYS 7 7.986 -9.429 6.146 60 2HZ LYS 7 HZ1 LYS 7 6.967 -10.746 6.203 61 3HZ LYS 7 HZ3 LYS 7 8.120 -10.539 7.408 62 H ASN 8 HN ASN 8 13.677 -10.384 3.975 63 HA ASN 8 HA ASN 8 12.853 -8.371 5.761 64 1HB ASN 8 HB2 ASN 8 15.505 -9.639 5.178 65 2HB ASN 8 HB1 ASN 8 15.416 -8.167 6.131 66 1HD2 ASN 8 HD2 ASN 8 14.713 -11.575 6.060 67 2HD2 ASN 8 HD2 ASN 8 14.312 -11.680 7.738 68 H LYS 9 HN LYS 9 14.558 -8.289 2.703 69 HA LYS 9 HA LYS 9 15.120 -5.504 2.729 70 1HB LYS 9 HB2 LYS 9 14.567 -7.213 0.283 71 2HB LYS 9 HB1 LYS 9 15.419 -5.679 0.312 72 1HG LYS 9 HG2 LYS 9 16.355 -8.285 1.491 73 2HG LYS 9 HG1 LYS 9 16.969 -7.500 0.038 74 1HD LYS 9 HD2 LYS 9 17.801 -5.644 1.371 75 2HD LYS 9 HD1 LYS 9 17.115 -6.364 2.832 76 1HE LYS 9 HE2 LYS 9 18.556 -8.336 2.491 77 2HE LYS 9 HE1 LYS 9 19.276 -7.545 1.091 78 1HZ LYS 9 HZ1 LYS 9 19.358 -6.543 3.878 79 2HZ LYS 9 HZ3 LYS 9 20.628 -7.303 3.081 80 3HZ LYS 9 HZ2 LYS 9 20.076 -5.784 2.574 81 H ILE 10 HN ILE 10 12.390 -7.427 1.647 82 HA ILE 10 HA ILE 10 10.746 -5.398 0.628 83 HB ILE 10 HB ILE 10 10.036 -8.001 2.014 84 1HG1 ILE 10 2HG1 ILE 10 9.938 -7.198 -0.889 85 2HG1 ILE 10 1HG1 ILE 10 11.216 -8.157 -0.148 86 1HG2 ILE 10 1HG2 ILE 10 8.145 -6.486 2.299 87 2HG2 ILE 10 3HG2 ILE 10 8.135 -6.160 0.564 88 3HG2 ILE 10 2HG2 ILE 10 7.750 -7.775 1.165 89 1HD1 ILE 10 HD1 ILE 10 9.558 -9.912 0.329 90 2HD1 ILE 10 HD1 ILE 10 8.323 -8.936 -0.470 91 3HD1 ILE 10 HD1 ILE 10 9.704 -9.551 -1.383 92 H GLU 11 HN GLU 11 10.961 -6.730 3.890 93 HA GLU 11 HA GLU 11 9.191 -5.030 5.231 94 1HB GLU 11 HB2 GLU 11 11.780 -6.245 6.211 95 2HB GLU 11 HB1 GLU 11 10.590 -5.478 7.243 96 1HG GLU 11 HG2 GLU 11 10.168 -7.958 5.590 97 2HG GLU 11 HG1 GLU 11 10.415 -7.886 7.335 98 H ASN 12 HN ASN 12 12.643 -4.690 4.676 99 HA ASN 12 HA ASN 12 13.011 -2.242 5.974 100 1HB ASN 12 HB2 ASN 12 14.824 -3.812 5.244 101 2HB ASN 12 HB1 ASN 12 14.572 -3.251 3.597 102 1HD2 ASN 12 HD2 ASN 12 16.583 -2.380 3.385 103 2HD2 ASN 12 HD2 ASN 12 17.123 -0.985 4.245 104 H LYS 13 HN LYS 13 12.298 -2.951 2.581 105 HA LYS 13 HA LYS 13 12.481 -0.301 1.641 106 1HB LYS 13 HB2 LYS 13 12.435 -2.530 0.320 107 2HB LYS 13 HB1 LYS 13 10.697 -2.393 0.448 108 1HG LYS 13 HG2 LYS 13 11.460 -1.524 -1.710 109 2HG LYS 13 HG1 LYS 13 10.754 -0.245 -0.720 110 1HD LYS 13 HD2 LYS 13 12.824 0.445 -1.867 111 2HD LYS 13 HD1 LYS 13 12.952 0.561 -0.117 112 1HE LYS 13 HE2 LYS 13 14.132 -1.538 -0.055 113 2HE LYS 13 HE1 LYS 13 14.019 -1.696 -1.824 114 1HZ LYS 13 HZ1 LYS 13 15.318 0.373 -1.956 115 2HZ LYS 13 HZ3 LYS 13 15.389 0.379 -0.249 116 3HZ LYS 13 HZ2 LYS 13 16.151 -0.861 -1.125 117 H LYS 14 HN LYS 14 9.753 -2.273 2.654 118 HA LYS 14 HA LYS 14 7.638 -0.541 2.374 119 1HB LYS 14 HB2 LYS 14 7.518 -2.930 2.986 120 2HB LYS 14 HB1 LYS 14 8.244 -2.558 4.535 121 1HG LYS 14 HG2 LYS 14 6.244 -1.272 5.146 122 2HG LYS 14 HG1 LYS 14 5.523 -1.668 3.581 123 1HD LYS 14 HD2 LYS 14 4.635 -3.226 5.213 124 2HD LYS 14 HD1 LYS 14 5.767 -4.095 4.176 125 1HE LYS 14 HE2 LYS 14 7.522 -3.763 5.909 126 2HE LYS 14 HE1 LYS 14 6.256 -3.040 6.909 127 1HZ LYS 14 HZ1 LYS 14 6.133 -5.828 5.846 128 2HZ LYS 14 HZ3 LYS 14 6.809 -5.486 7.294 129 3HZ LYS 14 HZ2 LYS 14 5.169 -5.247 7.095 130 H LYS 15 HN LYS 15 9.856 -1.047 5.097 131 HA LYS 15 HA LYS 15 8.802 0.943 6.752 132 1HB LYS 15 HB2 LYS 15 11.517 -0.381 6.768 133 2HB LYS 15 HB1 LYS 15 10.959 0.703 8.039 134 1HG LYS 15 HG2 LYS 15 9.176 -0.779 8.629 135 2HG LYS 15 HG1 LYS 15 9.476 -1.787 7.221 136 1HD LYS 15 HD2 LYS 15 10.338 -2.918 9.141 137 2HD LYS 15 HD1 LYS 15 11.691 -2.368 8.178 138 1HE LYS 15 HE2 LYS 15 12.078 -0.497 9.654 139 2HE LYS 15 HE1 LYS 15 10.654 -0.909 10.614 140 1HZ LYS 15 HZ3 LYS 15 13.040 -2.646 10.288 141 2HZ LYS 15 HZ2 LYS 15 12.748 -1.687 11.646 142 3HZ LYS 15 HZ1 LYS 15 11.717 -2.958 11.263 143 H GLU 16 HN GLU 16 11.443 1.037 4.385 144 HA GLU 16 HA GLU 16 12.348 3.663 4.761 145 1HB GLU 16 HB2 GLU 16 12.102 2.045 2.201 146 2HB GLU 16 HB1 GLU 16 12.821 3.644 2.251 147 1HG GLU 16 HG2 GLU 16 14.513 2.704 3.818 148 2HG GLU 16 HG1 GLU 16 13.803 1.110 3.536 149 H LEU 17 HN LEU 17 9.730 2.408 2.826 150 HA LEU 17 HA LEU 17 8.888 4.875 1.775 151 1HB LEU 17 HB2 LEU 17 8.334 2.920 0.581 152 2HB LEU 17 HB1 LEU 17 7.657 2.148 1.989 153 HG LEU 17 HG LEU 17 5.992 2.824 0.225 154 1HD1 LEU 17 HD1 LEU 17 5.347 2.220 2.332 155 2HD1 LEU 17 HD1 LEU 17 5.498 3.888 2.891 156 3HD1 LEU 17 HD1 LEU 17 4.321 3.478 1.619 157 1HD2 LEU 17 HD2 LEU 17 6.632 5.581 1.186 158 2HD2 LEU 17 HD2 LEU 17 6.953 4.952 -0.430 159 3HD2 LEU 17 HD2 LEU 17 5.287 5.126 0.132 160 H ILE 18 HN ILE 18 7.799 2.970 4.518 161 HA ILE 18 HA ILE 18 5.634 4.529 5.178 162 HB ILE 18 HB ILE 18 7.406 2.904 7.030 163 1HG1 ILE 18 2HG1 ILE 18 4.644 2.244 6.035 164 2HG1 ILE 18 1HG1 ILE 18 6.064 1.775 5.120 165 1HG2 ILE 18 2HG2 ILE 18 4.697 4.134 7.549 166 2HG2 ILE 18 1HG2 ILE 18 5.502 2.973 8.621 167 3HG2 ILE 18 3HG2 ILE 18 6.208 4.566 8.335 168 1HD1 ILE 18 HD1 ILE 18 5.481 0.988 7.956 169 2HD1 ILE 18 HD1 ILE 18 5.204 -0.023 6.534 170 3HD1 ILE 18 HD1 ILE 18 6.847 0.476 6.977 171 H GLN 19 HN GLN 19 8.988 4.828 6.134 172 HA GLN 19 HA GLN 19 8.752 7.055 7.831 173 1HB GLN 19 HB2 GLN 19 11.026 6.195 6.060 174 2HB GLN 19 HB1 GLN 19 11.135 7.471 7.265 175 1HG GLN 19 HG2 GLN 19 10.699 5.917 9.027 176 2HG GLN 19 HG1 GLN 19 10.387 4.631 7.863 177 1HE2 GLN 19 1HE2 GLN 19 12.045 3.723 6.798 178 2HE2 GLN 19 2HE2 GLN 19 13.698 3.876 7.278 179 H LEU 20 HN LEU 20 9.108 6.812 4.341 180 HA LEU 20 HA LEU 20 9.428 9.563 3.873 181 1HB LEU 20 HB2 LEU 20 8.449 7.391 2.029 182 2HB LEU 20 HB1 LEU 20 8.767 9.041 1.530 183 HG LEU 20 HG LEU 20 10.829 7.121 2.608 184 1HD1 LEU 20 HD1 LEU 20 10.340 8.157 -0.174 185 2HD1 LEU 20 HD1 LEU 20 11.696 7.149 0.328 186 3HD1 LEU 20 HD1 LEU 20 10.052 6.511 0.390 187 1HD2 LEU 20 HD2 LEU 20 11.078 9.933 1.537 188 2HD2 LEU 20 HD2 LEU 20 11.395 9.401 3.189 189 3HD2 LEU 20 HD2 LEU 20 12.430 8.853 1.878 190 H VAL 21 HN VAL 21 6.384 7.515 3.519 191 HA VAL 21 HA VAL 21 4.799 9.711 3.047 192 HB VAL 21 HB VAL 21 2.957 8.346 3.552 193 1HG1 VAL 21 3HG1 VAL 21 4.077 7.746 1.530 194 2HG1 VAL 21 2HG1 VAL 21 5.114 6.638 2.452 195 3HG1 VAL 21 1HG1 VAL 21 3.384 6.312 2.309 196 1HG2 VAL 21 3HG2 VAL 21 3.599 7.495 5.690 197 2HG2 VAL 21 2HG2 VAL 21 3.054 6.200 4.609 198 3HG2 VAL 21 1HG2 VAL 21 4.788 6.435 4.922 199 H ALA 22 HN ALA 22 5.973 8.405 6.071 200 HA ALA 22 HA ALA 22 4.263 9.690 7.858 201 1HB ALA 22 HB2 ALA 22 7.118 8.862 8.233 202 2HB ALA 22 HB1 ALA 22 5.943 9.161 9.532 203 3HB ALA 22 HB3 ALA 22 5.704 7.827 8.392 204 H ARG 23 HN ARG 23 7.490 10.565 6.739 205 HA ARG 23 HA ARG 23 7.549 13.007 8.153 206 1HB ARG 23 HB2 ARG 23 9.623 13.499 6.939 207 2HB ARG 23 HB1 ARG 23 9.625 11.877 7.611 208 1HG ARG 23 HG2 ARG 23 9.003 11.037 5.345 209 2HG ARG 23 HG1 ARG 23 9.242 12.683 4.751 210 1HD ARG 23 HD2 ARG 23 11.330 10.995 6.141 211 2HD ARG 23 HD1 ARG 23 11.252 11.298 4.407 212 HE ARG 23 HE ARG 23 11.340 13.766 5.323 213 1HH1 ARG 23 1HH1 ARG 23 13.399 10.983 6.130 214 2HH1 ARG 23 2HH1 ARG 23 14.722 11.917 6.623 215 1HH2 ARG 23 1HH2 ARG 23 13.108 15.042 5.998 216 2HH2 ARG 23 2HH2 ARG 23 14.558 14.332 6.560 217 H HIS 24 HN HIS 24 6.108 12.158 5.224 218 HA HIS 24 HA HIS 24 6.160 14.641 3.920 219 1HB HIS 24 HB2 HIS 24 5.457 12.553 2.803 220 2HB HIS 24 HB1 HIS 24 4.005 12.493 3.779 221 HD1 HIS 24 HD1 HIS 24 5.352 13.963 0.618 222 HD2 HIS 24 HD2 HIS 24 2.151 14.585 3.162 223 HE1 HIS 24 HE1 HIS 24 3.708 15.330 -0.686 224 H GLY 25 HN GLY 25 4.044 13.354 6.452 225 1HA GLY 25 HA1 GLY 25 2.151 15.489 6.195 226 2HA GLY 25 HA2 GLY 25 3.310 15.801 7.469 227 H LEU 26 HN LEU 26 2.483 12.460 6.977 228 HA LEU 26 HA LEU 26 0.227 12.141 8.383 229 1HB LEU 26 HB2 LEU 26 2.586 10.550 7.746 230 2HB LEU 26 HB1 LEU 26 1.468 9.896 8.929 231 HG LEU 26 HG LEU 26 -0.310 10.072 7.282 232 1HD1 LEU 26 HD1 LEU 26 0.467 11.856 5.918 233 2HD1 LEU 26 HD1 LEU 26 1.790 10.837 5.299 234 3HD1 LEU 26 HD1 LEU 26 0.089 10.399 4.996 235 1HD2 LEU 26 HD2 LEU 26 2.094 8.573 6.424 236 2HD2 LEU 26 HD2 LEU 26 0.844 8.000 7.549 237 3HD2 LEU 26 HD2 LEU 26 0.473 8.249 5.826 238 H ASP 27 HN ASP 27 -0.337 11.718 10.336 239 HA ASP 27 HA ASP 27 1.106 12.667 12.632 240 1HB ASP 27 HB2 ASP 27 -1.348 10.874 12.613 241 2HB ASP 27 HB1 ASP 27 -0.786 11.891 13.916 242 H HIS 28 HN HIS 28 1.352 11.094 14.566 243 HA HIS 28 HA HIS 28 2.992 8.907 13.808 244 1HB HIS 28 HB2 HIS 28 1.714 9.485 16.498 245 2HB HIS 28 HB1 HIS 28 2.964 8.289 16.213 246 HD1 HIS 28 HD1 HIS 28 2.527 11.758 17.196 247 HD2 HIS 28 HD2 HIS 28 5.463 9.524 15.287 248 HE1 HIS 28 HE1 HIS 28 4.648 13.062 17.426 249 H ASP 29 HN ASP 29 -0.307 9.170 14.967 250 HA ASP 29 HA ASP 29 -0.894 6.427 15.112 251 1HB ASP 29 HB2 ASP 29 -2.739 8.785 14.656 252 2HB ASP 29 HB1 ASP 29 -3.298 7.140 14.945 253 H LYS 30 HN LYS 30 -0.955 8.706 12.497 254 HA LYS 30 HA LYS 30 -2.310 7.145 10.581 255 1HB LYS 30 HB2 LYS 30 -0.203 9.265 10.259 256 2HB LYS 30 HB1 LYS 30 -1.083 8.561 8.917 257 1HG LYS 30 HG2 LYS 30 -2.456 9.921 11.203 258 2HG LYS 30 HG1 LYS 30 -1.855 10.801 9.797 259 1HD LYS 30 HD2 LYS 30 -3.293 9.448 8.356 260 2HD LYS 30 HD1 LYS 30 -3.876 8.565 9.769 261 1HE LYS 30 HE2 LYS 30 -5.423 10.370 9.042 262 2HE LYS 30 HE1 LYS 30 -4.839 10.553 10.694 263 1HZ LYS 30 HZ3 LYS 30 -3.701 12.015 8.360 264 2HZ LYS 30 HZ2 LYS 30 -4.824 12.662 9.438 265 3HZ LYS 30 HZ1 LYS 30 -3.310 12.246 9.987 266 H VAL 31 HN VAL 31 1.105 7.509 11.443 267 HA VAL 31 HA VAL 31 2.211 5.861 9.455 268 HB VAL 31 HB VAL 31 3.277 6.383 12.253 269 1HG1 VAL 31 3HG1 VAL 31 4.421 4.542 11.168 270 2HG1 VAL 31 2HG1 VAL 31 4.721 5.547 9.750 271 3HG1 VAL 31 1HG1 VAL 31 5.478 5.951 11.294 272 1HG2 VAL 31 2HG2 VAL 31 2.817 8.465 11.099 273 2HG2 VAL 31 1HG2 VAL 31 4.556 8.201 11.240 274 3HG2 VAL 31 3HG2 VAL 31 3.740 7.916 9.704 275 H LEU 32 HN LEU 32 1.139 5.215 12.730 276 HA LEU 32 HA LEU 32 1.767 2.444 12.860 277 1HB LEU 32 HB2 LEU 32 -0.476 3.902 14.233 278 2HB LEU 32 HB1 LEU 32 0.202 2.356 14.697 279 HG LEU 32 HG LEU 32 1.589 5.030 14.837 280 1HD1 LEU 32 HD1 LEU 32 0.623 3.165 16.963 281 2HD1 LEU 32 HD1 LEU 32 1.544 4.650 17.235 282 3HD1 LEU 32 HD1 LEU 32 -0.076 4.730 16.536 283 1HD2 LEU 32 HD2 LEU 32 2.608 2.288 15.587 284 2HD2 LEU 32 HD2 LEU 32 3.190 3.294 14.262 285 3HD2 LEU 32 HD2 LEU 32 3.424 3.816 15.929 286 H LEU 33 HN LEU 33 -1.303 4.012 12.061 287 HA LEU 33 HA LEU 33 -2.643 1.596 11.503 288 1HB LEU 33 HB2 LEU 33 -3.197 4.365 10.444 289 2HB LEU 33 HB1 LEU 33 -4.309 3.015 10.370 290 HG LEU 33 HG LEU 33 -3.319 4.279 12.927 291 1HD1 LEU 33 HD1 LEU 33 -5.957 4.600 11.509 292 2HD1 LEU 33 HD1 LEU 33 -5.556 5.225 13.112 293 3HD1 LEU 33 HD1 LEU 33 -4.702 5.828 11.697 294 1HD2 LEU 33 HD2 LEU 33 -5.477 2.223 12.424 295 2HD2 LEU 33 HD2 LEU 33 -3.928 1.938 13.224 296 3HD2 LEU 33 HD2 LEU 33 -5.128 2.989 13.971 297 H PHE 34 HN PHE 34 -0.897 3.840 9.414 298 HA PHE 34 HA PHE 34 -1.455 2.662 6.947 299 1HB PHE 34 HB2 PHE 34 -0.525 4.879 7.073 300 2HB PHE 34 HB1 PHE 34 0.917 4.279 7.876 301 HD1 PHE 34 HD1 PHE 34 2.812 3.891 6.604 302 HD2 PHE 34 HD2 PHE 34 -0.977 3.901 4.658 303 HE1 PHE 34 HE1 PHE 34 3.905 3.696 4.387 304 HE2 PHE 34 HE2 PHE 34 0.130 3.741 2.515 305 HZ PHE 34 HZ PHE 34 2.564 3.636 2.384 306 H SER 35 HN SER 35 1.319 2.190 9.116 307 HA SER 35 HA SER 35 2.645 0.407 7.425 308 1HB SER 35 HB2 SER 35 3.974 -0.219 9.474 309 2HB SER 35 HB1 SER 35 3.878 1.513 9.159 310 HG SER 35 HG SER 35 2.475 1.765 10.768 311 H ARG 36 HN ARG 36 0.208 -0.105 9.838 312 HA ARG 36 HA ARG 36 0.382 -2.925 9.976 313 1HB ARG 36 HB2 ARG 36 -1.883 -1.041 10.539 314 2HB ARG 36 HB1 ARG 36 -1.902 -2.762 10.927 315 1HG ARG 36 HG2 ARG 36 -0.011 -2.432 12.411 316 2HG ARG 36 HG1 ARG 36 0.023 -0.726 11.928 317 1HD ARG 36 HD2 ARG 36 -1.080 -1.021 14.082 318 2HD ARG 36 HD1 ARG 36 -2.136 -0.347 12.860 319 HE ARG 36 HE ARG 36 -2.571 -3.030 12.672 320 1HH1 ARG 36 1HH1 ARG 36 -2.846 -0.743 15.369 321 2HH1 ARG 36 2HH1 ARG 36 -4.214 -1.483 16.030 322 1HH2 ARG 36 1HH2 ARG 36 -4.480 -4.040 13.583 323 2HH2 ARG 36 2HH2 ARG 36 -5.155 -3.404 15.004 324 H ASP 37 HN ASP 37 -1.784 -0.767 8.210 325 HA ASP 37 HA ASP 37 -3.288 -2.824 6.970 326 1HB ASP 37 HB2 ASP 37 -3.949 -0.397 7.287 327 2HB ASP 37 HB1 ASP 37 -2.861 0.000 5.984 328 H LEU 38 HN LEU 38 -0.512 -0.956 6.026 329 HA LEU 38 HA LEU 38 -0.214 -1.965 3.416 330 1HB LEU 38 HB2 LEU 38 0.779 0.087 4.010 331 2HB LEU 38 HB1 LEU 38 1.619 -0.622 5.359 332 HG LEU 38 HG LEU 38 3.257 -1.619 3.917 333 1HD1 LEU 38 HD1 LEU 38 1.752 -2.310 2.106 334 2HD1 LEU 38 HD1 LEU 38 1.623 -0.612 1.590 335 3HD1 LEU 38 HD1 LEU 38 3.190 -1.444 1.556 336 1HD2 LEU 38 HD2 LEU 38 2.497 1.102 3.038 337 2HD2 LEU 38 HD2 LEU 38 3.497 0.718 4.436 338 3HD2 LEU 38 HD2 LEU 38 4.096 0.372 2.796 339 H ASP 39 HN ASP 39 1.178 -2.948 6.506 340 HA ASP 39 HA ASP 39 2.844 -4.985 5.559 341 1HB ASP 39 HB2 ASP 39 2.890 -4.159 7.880 342 2HB ASP 39 HB1 ASP 39 1.298 -4.852 8.159 343 H LYS 40 HN LYS 40 -0.518 -5.043 6.607 344 HA LYS 40 HA LYS 40 -0.874 -7.774 6.067 345 1HB LYS 40 HB2 LYS 40 -2.735 -5.550 6.777 346 2HB LYS 40 HB1 LYS 40 -3.407 -7.056 6.163 347 1HG LYS 40 HG2 LYS 40 -3.335 -6.967 8.620 348 2HG LYS 40 HG1 LYS 40 -2.377 -8.306 7.967 349 1HD LYS 40 HD2 LYS 40 -0.418 -6.585 8.150 350 2HD LYS 40 HD1 LYS 40 -1.497 -5.751 9.243 351 1HE LYS 40 HE2 LYS 40 -1.619 -7.623 10.728 352 2HE LYS 40 HE1 LYS 40 -0.740 -8.645 9.592 353 1HZ LYS 40 HZ1 LYS 40 1.192 -7.214 9.855 354 2HZ LYS 40 HZ3 LYS 40 0.381 -6.263 10.985 355 3HZ LYS 40 HZ2 LYS 40 0.746 -7.869 11.334 356 H LEU 41 HN LEU 41 -1.462 -4.935 4.070 357 HA LEU 41 HA LEU 41 -2.700 -6.302 1.951 358 1HB LEU 41 HB2 LEU 41 -2.646 -3.872 1.986 359 2HB LEU 41 HB1 LEU 41 -0.896 -3.877 1.878 360 HG LEU 41 HG LEU 41 -1.043 -4.866 -0.379 361 1HD1 LEU 41 HD1 LEU 41 -4.002 -4.496 -0.046 362 2HD1 LEU 41 HD1 LEU 41 -3.179 -4.898 -1.550 363 3HD1 LEU 41 HD1 LEU 41 -3.140 -6.029 -0.195 364 1HD2 LEU 41 HD2 LEU 41 -2.597 -2.315 -0.013 365 2HD2 LEU 41 HD2 LEU 41 -0.848 -2.468 -0.176 366 3HD2 LEU 41 HD2 LEU 41 -1.905 -2.880 -1.531 367 H ILE 42 HN ILE 42 0.673 -5.725 2.706 368 HA ILE 42 HA ILE 42 1.672 -7.030 0.421 369 HB ILE 42 HB ILE 42 2.984 -6.362 3.074 370 1HG1 ILE 42 2HG1 ILE 42 3.255 -5.236 0.295 371 2HG1 ILE 42 1HG1 ILE 42 2.371 -4.493 1.619 372 1HG2 ILE 42 2HG2 ILE 42 4.320 -7.530 0.621 373 2HG2 ILE 42 1HG2 ILE 42 5.146 -6.919 2.053 374 3HG2 ILE 42 3HG2 ILE 42 4.110 -8.340 2.175 375 1HD1 ILE 42 HD1 ILE 42 5.338 -4.990 1.570 376 2HD1 ILE 42 HD1 ILE 42 4.545 -3.458 1.199 377 3HD1 ILE 42 HD1 ILE 42 4.412 -4.132 2.817 378 H ASN 43 HN ASN 43 1.228 -8.195 3.748 379 HA ASN 43 HA ASN 43 2.097 -10.832 3.340 380 1HB ASN 43 HB2 ASN 43 -0.148 -9.957 5.176 381 2HB ASN 43 HB1 ASN 43 0.706 -11.487 5.254 382 1HD2 ASN 43 HD2 ASN 43 0.374 -9.489 7.247 383 2HD2 ASN 43 HD2 ASN 43 1.909 -8.860 7.724 384 H LYS 44 HN LYS 44 -0.948 -9.327 2.604 385 HA LYS 44 HA LYS 44 -2.577 -11.533 2.043 386 1HB LYS 44 HB2 LYS 44 -3.334 -9.215 2.256 387 2HB LYS 44 HB1 LYS 44 -2.529 -8.800 0.758 388 1HG LYS 44 HG2 LYS 44 -4.074 -10.520 -0.365 389 2HG LYS 44 HG1 LYS 44 -4.970 -10.495 1.159 390 1HD LYS 44 HD2 LYS 44 -4.421 -8.091 -0.551 391 2HD LYS 44 HD1 LYS 44 -5.941 -8.978 -0.471 392 1HE LYS 44 HE2 LYS 44 -4.631 -7.571 1.868 393 2HE LYS 44 HE1 LYS 44 -5.927 -6.928 0.870 394 1HZ LYS 44 HZ3 LYS 44 -6.135 -9.373 2.552 395 2HZ LYS 44 HZ2 LYS 44 -6.748 -7.850 2.917 396 3HZ LYS 44 HZ1 LYS 44 -7.362 -8.691 1.601 397 H PHE 45 HN PHE 45 -0.518 -9.604 -0.127 398 HA PHE 45 HA PHE 45 -1.027 -11.362 -2.360 399 1HB PHE 45 HB2 PHE 45 0.581 -8.880 -1.986 400 2HB PHE 45 HB1 PHE 45 0.847 -9.871 -3.411 401 HD1 PHE 45 HD1 PHE 45 -0.830 -10.112 -5.085 402 HD2 PHE 45 HD2 PHE 45 -1.522 -7.717 -1.642 403 HE1 PHE 45 HE1 PHE 45 -2.798 -9.138 -6.166 404 HE2 PHE 45 HE2 PHE 45 -3.493 -6.722 -2.726 405 HZ PHE 45 HZ PHE 45 -4.133 -7.436 -4.993 406 H MET 46 HN MET 46 1.426 -10.923 -0.039 407 HA MET 46 HA MET 46 3.387 -12.451 -1.388 408 1HB MET 46 HB2 MET 46 3.159 -11.533 1.458 409 2HB MET 46 HB1 MET 46 4.555 -12.402 0.830 410 1HG MET 46 HG2 MET 46 3.516 -9.794 -0.248 411 2HG MET 46 HG1 MET 46 4.855 -9.962 0.885 412 1HE MET 46 HE1 MET 46 7.080 -10.906 0.386 413 2HE MET 46 HE3 MET 46 6.385 -12.470 -0.072 414 3HE MET 46 HE2 MET 46 7.550 -11.668 -1.127 415 H ASN 47 HN ASN 47 0.556 -13.336 0.157 416 HA ASN 47 HA ASN 47 -0.397 -15.176 0.939 417 1HB ASN 47 HB2 ASN 47 1.821 -16.294 -0.686 418 2HB ASN 47 HB1 ASN 47 0.714 -17.396 0.168 419 1HD2 ASN 47 HD2 ASN 47 1.127 -17.049 -2.732 420 2HD2 ASN 47 HD2 ASN 47 -0.397 -16.550 -3.357 421 H VAL 48 HN VAL 48 1.399 -13.817 2.578 422 HA VAL 48 HA VAL 48 2.760 -15.867 4.141 423 HB VAL 48 HB VAL 48 2.572 -12.904 4.624 424 1HG1 VAL 48 1HG1 VAL 48 2.993 -14.163 6.664 425 2HG1 VAL 48 3HG1 VAL 48 4.368 -14.969 5.903 426 3HG1 VAL 48 2HG1 VAL 48 4.412 -13.230 6.199 427 1HG2 VAL 48 1HG2 VAL 48 3.807 -13.369 2.578 428 2HG2 VAL 48 3HG2 VAL 48 4.890 -12.771 3.835 429 3HG2 VAL 48 2HG2 VAL 48 4.849 -14.496 3.449 430 H LYS 49 HN LYS 49 1.585 -16.935 5.261 431 HA LYS 49 HA LYS 49 -0.420 -15.653 6.944 432 1HB LYS 49 HB2 LYS 49 -0.236 -18.581 6.158 433 2HB LYS 49 HB1 LYS 49 -1.522 -17.825 7.085 434 1HG LYS 49 HG2 LYS 49 -2.122 -16.467 5.120 435 2HG LYS 49 HG1 LYS 49 -0.856 -17.269 4.201 436 1HD LYS 49 HD2 LYS 49 -2.937 -18.300 3.640 437 2HD LYS 49 HD1 LYS 49 -2.029 -19.439 4.630 438 1HE LYS 49 HE2 LYS 49 -3.361 -18.857 6.565 439 2HE LYS 49 HE1 LYS 49 -4.194 -17.607 5.641 440 1HZ LYS 49 HZ2 LYS 49 -5.088 -19.362 4.195 441 2HZ LYS 49 HZ1 LYS 49 -4.308 -20.528 5.109 442 3HZ LYS 49 HZ3 LYS 49 -5.539 -19.605 5.795 443 H ASP 50 HN ASP 50 0.628 -15.242 8.771 444 HA ASP 50 HA ASP 50 3.001 -16.616 9.446 445 1HB ASP 50 HB2 ASP 50 1.468 -14.533 11.011 446 2HB ASP 50 HB1 ASP 50 3.010 -15.206 11.520 447 H LYS 51 HN LYS 51 2.707 -18.625 9.814 448 HA LYS 51 HA LYS 51 0.931 -19.471 11.983 449 1HB LYS 51 HB2 LYS 51 1.302 -21.785 11.060 450 2HB LYS 51 HB1 LYS 51 0.496 -20.684 9.952 451 1HG LYS 51 HG2 LYS 51 2.616 -20.304 8.800 452 2HG LYS 51 HG1 LYS 51 3.409 -21.443 9.889 453 1HD LYS 51 HD2 LYS 51 2.006 -23.234 9.059 454 2HD LYS 51 HD1 LYS 51 1.109 -22.098 8.047 455 1HE LYS 51 HE2 LYS 51 3.157 -21.567 6.830 456 2HE LYS 51 HE1 LYS 51 4.051 -22.715 7.820 457 1HZ LYS 51 HZ1 LYS 51 1.796 -23.396 6.013 458 2HZ LYS 51 HZ3 LYS 51 3.425 -23.617 5.662 459 3HZ LYS 51 HZ2 LYS 51 2.721 -24.497 6.913 460 H VAL 52 HN VAL 52 3.850 -18.564 11.534 461 HA VAL 52 HA VAL 52 5.089 -20.448 13.406 462 HB VAL 52 HB VAL 52 7.256 -19.494 12.827 463 1HG1 VAL 52 3HG1 VAL 52 5.638 -20.243 10.413 464 2HG1 VAL 52 2HG1 VAL 52 7.402 -20.194 10.466 465 3HG1 VAL 52 1HG1 VAL 52 6.513 -21.330 11.484 466 1HG2 VAL 52 3HG2 VAL 52 5.734 -17.651 10.978 467 2HG2 VAL 52 2HG2 VAL 52 6.662 -17.199 12.404 468 3HG2 VAL 52 1HG2 VAL 52 7.491 -17.847 10.993 469 H HIS 53 HN HIS 53 6.645 -19.335 14.969 470 HA HIS 53 HA HIS 53 5.044 -17.459 16.455 471 1HB HIS 53 HB2 HIS 53 7.768 -18.652 17.101 472 2HB HIS 53 HB1 HIS 53 6.782 -17.704 18.203 473 HD1 HIS 53 HD1 HIS 53 7.344 -21.171 17.069 474 HD2 HIS 53 HD2 HIS 53 4.354 -19.019 19.000 475 HE1 HIS 53 HE1 HIS 53 5.791 -22.876 18.076 476 H LYS 54 HN LYS 54 5.083 -15.470 15.653 477 HA LYS 54 HA LYS 54 7.518 -14.413 14.527 478 1HB LYS 54 HB2 LYS 54 4.873 -13.009 14.958 479 2HB LYS 54 HB1 LYS 54 6.222 -12.398 14.015 480 1HG LYS 54 HG2 LYS 54 4.691 -14.895 13.436 481 2HG LYS 54 HG1 LYS 54 4.432 -13.345 12.611 482 1HD LYS 54 HD2 LYS 54 7.009 -14.946 12.604 483 2HD LYS 54 HD1 LYS 54 5.806 -14.992 11.326 484 1HE LYS 54 HE2 LYS 54 7.354 -12.538 12.181 485 2HE LYS 54 HE1 LYS 54 7.690 -13.556 10.781 486 1HZ LYS 54 HZ1 LYS 54 5.396 -13.020 10.015 487 2HZ LYS 54 HZ3 LYS 54 5.320 -11.786 11.167 488 3HZ LYS 54 HZ2 LYS 54 6.484 -11.763 9.957 489 H LEU 55 HN LEU 55 8.848 -14.320 16.032 490 HA LEU 55 HA LEU 55 8.464 -13.274 18.623 491 1HB LEU 55 HB2 LEU 55 11.026 -13.523 17.054 492 2HB LEU 55 HB1 LEU 55 10.913 -13.221 18.774 493 HG LEU 55 HG LEU 55 10.067 -15.743 17.347 494 1HD1 LEU 55 HD1 LEU 55 12.469 -15.470 17.502 495 2HD1 LEU 55 HD1 LEU 55 12.332 -15.177 19.234 496 3HD1 LEU 55 HD1 LEU 55 11.915 -16.761 18.573 497 1HD2 LEU 55 HD2 LEU 55 10.003 -15.059 20.293 498 2HD2 LEU 55 HD2 LEU 55 8.601 -15.309 19.254 499 3HD2 LEU 55 HD2 LEU 55 9.690 -16.652 19.603 500 H GLU 56 HN GLU 56 7.939 -11.346 19.024 501 HA GLU 56 HA GLU 56 9.437 -9.135 17.957 502 1HB GLU 56 HB2 GLU 56 7.528 -9.370 16.384 503 2HB GLU 56 HB1 GLU 56 6.418 -9.254 17.742 504 1HG GLU 56 HG2 GLU 56 7.246 -6.982 18.193 505 2HG GLU 56 HG1 GLU 56 8.290 -7.104 16.776 506 H HIS 57 HN HIS 57 10.181 -9.192 20.090 507 HA HIS 57 HA HIS 57 8.255 -8.646 22.197 508 1HB HIS 57 HB2 HIS 57 10.339 -10.124 22.511 509 2HB HIS 57 HB1 HIS 57 11.253 -8.611 22.423 510 HD1 HIS 57 HD1 HIS 57 11.622 -7.480 24.649 511 HD2 HIS 57 HD2 HIS 57 8.389 -10.075 24.661 512 HE1 HIS 57 HE1 HIS 57 10.777 -7.533 27.025 513 H HIS 58 HN HIS 58 11.153 -7.214 20.787 514 HA HIS 58 HA HIS 58 9.957 -4.626 20.983 515 1HB HIS 58 HB2 HIS 58 11.114 -4.736 23.127 516 2HB HIS 58 HB1 HIS 58 12.580 -5.307 22.346 517 HD1 HIS 58 HD1 HIS 58 10.830 -2.179 23.331 518 HD2 HIS 58 HD2 HIS 58 13.959 -3.295 20.833 519 HE1 HIS 58 HE1 HIS 58 12.084 -0.063 22.765 520 H HIS 59 HN HIS 59 10.089 -4.067 18.915 521 HA HIS 59 HA HIS 59 12.711 -4.160 17.654 522 1HB HIS 59 HB2 HIS 59 10.010 -4.531 16.306 523 2HB HIS 59 HB1 HIS 59 11.493 -4.217 15.424 524 HD1 HIS 59 HD1 HIS 59 9.560 -6.896 15.412 525 HD2 HIS 59 HD2 HIS 59 13.365 -6.445 17.030 526 HE1 HIS 59 HE1 HIS 59 10.531 -9.194 15.544 527 H HIS 60 HN HIS 60 13.405 -2.200 17.802 528 HA HIS 60 HA HIS 60 11.573 0.043 17.897 529 1HB HIS 60 HB2 HIS 60 13.399 0.008 19.527 530 2HB HIS 60 HB1 HIS 60 14.581 -0.108 18.231 531 HD1 HIS 60 HD1 HIS 60 15.790 2.080 18.150 532 HD2 HIS 60 HD2 HIS 60 11.723 2.577 18.825 533 HE1 HIS 60 HE1 HIS 60 15.382 4.568 18.169 534 H HIS 61 HN HIS 61 11.160 1.288 16.216 535 HA HIS 61 HA HIS 61 12.464 0.659 13.769 536 1HB HIS 61 HB2 HIS 61 10.872 2.251 12.687 537 2HB HIS 61 HB1 HIS 61 10.075 0.999 13.617 538 HD1 HIS 61 HD1 HIS 61 8.949 1.848 15.962 539 HD2 HIS 61 HD2 HIS 61 10.274 4.798 13.343 540 HE1 HIS 61 HE1 HIS 61 7.876 3.979 16.713 541 H HIS 62 HN HIS 62 14.431 1.198 13.867 542 HA HIS 62 HA HIS 62 15.100 3.989 14.186 543 1HB HIS 62 HB2 HIS 62 17.536 3.115 14.215 544 2HB HIS 62 HB1 HIS 62 16.545 2.783 15.619 545 HD1 HIS 62 HD1 HIS 62 16.740 0.408 16.443 546 HD2 HIS 62 HD2 HIS 62 17.664 0.724 12.399 547 HE1 HIS 62 HE1 HIS 62 17.466 -1.876 15.711 548 H1 MET 101 HT1 MET 101 14.043 20.682 1.059 549 H2 MET 101 HT3 MET 101 14.334 20.871 2.711 550 H3 MET 101 HT2 MET 101 13.277 19.677 2.179 551 HA MET 101 HA MET 101 12.046 21.466 3.094 552 1HB MET 101 HB2 MET 101 13.485 23.099 0.999 553 2HB MET 101 HB1 MET 101 12.012 23.633 1.787 554 1HG MET 101 HG2 MET 101 13.146 23.624 3.932 555 2HG MET 101 HG1 MET 101 14.618 23.031 3.175 556 1HE MET 101 HE2 MET 101 12.076 26.041 3.432 557 2HE MET 101 HE1 MET 101 12.802 27.216 2.336 558 3HE MET 101 HE3 MET 101 12.096 25.734 1.695 559 H GLU 102 HN GLU 102 12.439 19.696 0.314 560 HA GLU 102 HA GLU 102 10.150 20.868 -1.007 561 1HB GLU 102 HB2 GLU 102 12.138 20.488 -2.361 562 2HB GLU 102 HB1 GLU 102 12.137 18.790 -1.905 563 1HG GLU 102 HG2 GLU 102 11.278 19.129 -4.155 564 2HG GLU 102 HG1 GLU 102 10.074 18.453 -3.053 565 H MET 103 HN MET 103 8.328 19.816 -1.365 566 HA MET 103 HA MET 103 7.911 17.331 0.127 567 1HB MET 103 HB2 MET 103 5.507 17.918 0.229 568 2HB MET 103 HB1 MET 103 6.516 19.149 0.967 569 1HG MET 103 HG2 MET 103 6.273 20.548 -1.030 570 2HG MET 103 HG1 MET 103 5.279 19.303 -1.782 571 1HE MET 103 HE2 MET 103 5.565 21.904 1.148 572 2HE MET 103 HE1 MET 103 4.007 21.731 1.959 573 3HE MET 103 HE3 MET 103 5.197 20.434 2.043 574 H GLY 104 HN GLY 104 7.706 18.843 -3.010 575 1HA GLY 104 HA1 GLY 104 7.229 17.983 -5.080 576 2HA GLY 104 HA2 GLY 104 6.119 16.868 -4.294 577 H GLN 105 HN GLN 105 9.601 17.387 -4.228 578 HA GLN 105 HA GLN 105 10.312 14.967 -5.478 579 1HB GLN 105 HB2 GLN 105 11.902 16.748 -3.638 580 2HB GLN 105 HB1 GLN 105 12.588 15.346 -4.430 581 1HG GLN 105 HG2 GLN 105 12.112 16.346 -6.611 582 2HG GLN 105 HG1 GLN 105 11.409 17.749 -5.806 583 1HE2 GLN 105 1HE2 GLN 105 14.331 16.054 -6.556 584 2HE2 GLN 105 2HE2 GLN 105 15.429 17.291 -6.124 585 H LEU 106 HN LEU 106 9.366 15.662 -2.265 586 HA LEU 106 HA LEU 106 10.439 13.313 -1.082 587 1HB LEU 106 HB2 LEU 106 9.854 15.345 0.233 588 2HB LEU 106 HB1 LEU 106 8.183 15.132 -0.196 589 HG LEU 106 HG LEU 106 8.845 14.514 2.172 590 1HD1 LEU 106 HD1 LEU 106 7.380 12.556 0.457 591 2HD1 LEU 106 HD1 LEU 106 7.493 12.457 2.229 592 3HD1 LEU 106 HD1 LEU 106 6.755 13.847 1.466 593 1HD2 LEU 106 HD2 LEU 106 10.933 13.361 1.677 594 2HD2 LEU 106 HD2 LEU 106 9.792 12.319 2.540 595 3HD2 LEU 106 HD2 LEU 106 10.031 12.115 0.804 596 H LYS 107 HN LYS 107 7.285 14.273 -2.348 597 HA LYS 107 HA LYS 107 5.986 11.798 -1.903 598 1HB LYS 107 HB2 LYS 107 5.244 14.311 -2.745 599 2HB LYS 107 HB1 LYS 107 5.093 13.324 -4.200 600 1HG LYS 107 HG2 LYS 107 3.852 12.534 -1.579 601 2HG LYS 107 HG1 LYS 107 3.014 13.590 -2.689 602 1HD LYS 107 HD2 LYS 107 3.974 10.775 -3.337 603 2HD LYS 107 HD1 LYS 107 2.327 11.177 -2.834 604 1HE LYS 107 HE2 LYS 107 2.218 12.686 -4.857 605 2HE LYS 107 HE1 LYS 107 3.765 11.995 -5.354 606 1HZ LYS 107 HZ1 LYS 107 2.656 9.758 -5.357 607 2HZ LYS 107 HZ3 LYS 107 1.205 10.532 -4.998 608 3HZ LYS 107 HZ2 LYS 107 1.967 10.835 -6.439 609 H ASN 108 HN ASN 108 7.826 13.126 -4.551 610 HA ASN 108 HA ASN 108 7.304 10.973 -6.295 611 1HB ASN 108 HB2 ASN 108 9.538 13.011 -6.350 612 2HB ASN 108 HB1 ASN 108 9.250 11.792 -7.588 613 1HD2 ASN 108 HD2 ASN 108 9.151 14.722 -7.799 614 2HD2 ASN 108 HD2 ASN 108 7.585 15.096 -8.370 615 H LYS 109 HN LYS 109 9.758 11.487 -3.833 616 HA LYS 109 HA LYS 109 11.151 9.096 -4.471 617 1HB LYS 109 HB2 LYS 109 11.094 10.790 -1.986 618 2HB LYS 109 HB1 LYS 109 11.924 9.245 -1.996 619 1HG LYS 109 HG2 LYS 109 13.282 10.071 -3.922 620 2HG LYS 109 HG1 LYS 109 12.520 11.645 -3.708 621 1HD LYS 109 HD2 LYS 109 13.994 10.236 -1.493 622 2HD LYS 109 HD1 LYS 109 14.787 11.336 -2.618 623 1HE LYS 109 HE2 LYS 109 12.427 12.086 -0.881 624 2HE LYS 109 HE1 LYS 109 14.106 12.372 -0.435 625 1HZ LYS 109 HZ2 LYS 109 14.353 13.725 -2.421 626 2HZ LYS 109 HZ1 LYS 109 12.753 13.492 -2.830 627 3HZ LYS 109 HZ3 LYS 109 13.162 14.360 -1.439 628 H ILE 110 HN ILE 110 8.419 9.854 -2.473 629 HA ILE 110 HA ILE 110 7.992 7.371 -1.267 630 HB ILE 110 HB ILE 110 6.049 9.498 -2.199 631 1HG1 ILE 110 2HG1 ILE 110 7.021 8.702 0.537 632 2HG1 ILE 110 1HG1 ILE 110 7.597 10.084 -0.384 633 1HG2 ILE 110 2HG2 ILE 110 4.836 7.387 -2.195 634 2HG2 ILE 110 1HG2 ILE 110 5.366 7.073 -0.544 635 3HG2 ILE 110 3HG2 ILE 110 4.286 8.430 -0.879 636 1HD1 ILE 110 HD1 ILE 110 5.329 11.053 -0.236 637 2HD1 ILE 110 HD1 ILE 110 4.843 9.677 0.754 638 3HD1 ILE 110 HD1 ILE 110 6.088 10.789 1.326 639 H GLU 111 HN GLU 111 6.811 8.624 -4.348 640 HA GLU 111 HA GLU 111 5.560 6.367 -5.430 641 1HB GLU 111 HB2 GLU 111 7.258 8.434 -6.828 642 2HB GLU 111 HB1 GLU 111 6.196 7.284 -7.628 643 1HG GLU 111 HG2 GLU 111 5.328 9.401 -5.691 644 2HG GLU 111 HG1 GLU 111 5.208 9.534 -7.442 645 H ASN 112 HN ASN 112 8.895 7.359 -5.738 646 HA ASN 112 HA ASN 112 9.774 5.175 -7.228 647 1HB ASN 112 HB2 ASN 112 11.052 7.216 -7.161 648 2HB ASN 112 HB1 ASN 112 11.272 7.068 -5.426 649 1HD2 ASN 112 HD2 ASN 112 12.894 5.823 -4.659 650 2HD2 ASN 112 HD2 ASN 112 14.032 5.033 -5.676 651 H LYS 113 HN LYS 113 9.705 5.640 -3.731 652 HA LYS 113 HA LYS 113 11.171 3.288 -3.108 653 1HB LYS 113 HB2 LYS 113 10.763 5.336 -1.631 654 2HB LYS 113 HB1 LYS 113 9.178 4.664 -1.323 655 1HG LYS 113 HG2 LYS 113 10.678 4.105 0.495 656 2HG LYS 113 HG1 LYS 113 10.201 2.652 -0.383 657 1HD LYS 113 HD2 LYS 113 12.592 2.662 0.179 658 2HD LYS 113 HD1 LYS 113 12.328 2.620 -1.558 659 1HE LYS 113 HE2 LYS 113 12.771 4.991 -1.693 660 2HE LYS 113 HE1 LYS 113 13.008 5.081 0.064 661 1HZ LYS 113 HZ1 LYS 113 14.599 3.534 -1.891 662 2HZ LYS 113 HZ3 LYS 113 15.099 4.957 -1.125 663 3HZ LYS 113 HZ2 LYS 113 14.885 3.577 -0.194 664 H LYS 114 HN LYS 114 7.732 4.060 -3.198 665 HA LYS 114 HA LYS 114 6.506 1.705 -2.534 666 1HB LYS 114 HB2 LYS 114 5.380 3.840 -2.972 667 2HB LYS 114 HB1 LYS 114 5.869 3.761 -4.649 668 1HG LYS 114 HG2 LYS 114 4.385 1.846 -4.992 669 2HG LYS 114 HG1 LYS 114 3.914 1.904 -3.294 670 1HD LYS 114 HD2 LYS 114 2.196 3.031 -4.591 671 2HD LYS 114 HD1 LYS 114 3.087 4.246 -3.670 672 1HE LYS 114 HE2 LYS 114 4.457 4.684 -5.703 673 2HE LYS 114 HE1 LYS 114 3.405 3.529 -6.530 674 1HZ LYS 114 HZ2 LYS 114 2.401 6.037 -5.229 675 2HZ LYS 114 HZ1 LYS 114 2.788 5.974 -6.837 676 3HZ LYS 114 HZ3 LYS 114 1.515 5.053 -6.238 677 H LYS 115 HN LYS 115 7.656 2.840 -5.660 678 HA LYS 115 HA LYS 115 7.017 0.540 -7.106 679 1HB LYS 115 HB2 LYS 115 8.991 2.736 -7.711 680 2HB LYS 115 HB1 LYS 115 8.538 1.488 -8.869 681 1HG LYS 115 HG2 LYS 115 6.250 2.221 -8.869 682 2HG LYS 115 HG1 LYS 115 6.559 3.336 -7.546 683 1HD LYS 115 HD2 LYS 115 6.422 4.588 -9.576 684 2HD LYS 115 HD1 LYS 115 8.084 4.595 -9.020 685 1HE LYS 115 HE2 LYS 115 8.002 4.252 -11.442 686 2HE LYS 115 HE1 LYS 115 8.675 2.853 -10.625 687 1HZ LYS 115 HZ2 LYS 115 5.845 3.042 -11.570 688 2HZ LYS 115 HZ1 LYS 115 7.108 2.285 -12.376 689 3HZ LYS 115 HZ3 LYS 115 6.603 1.689 -10.897 690 H GLU 116 HN GLU 116 10.058 1.525 -5.535 691 HA GLU 116 HA GLU 116 11.728 -0.614 -6.236 692 1HB GLU 116 HB2 GLU 116 11.562 0.898 -3.618 693 2HB GLU 116 HB1 GLU 116 12.765 -0.334 -3.941 694 1HG GLU 116 HG2 GLU 116 13.552 1.117 -5.836 695 2HG GLU 116 HG1 GLU 116 12.445 2.356 -5.225 696 H LEU 117 HN LEU 117 9.301 -0.369 -3.763 697 HA LEU 117 HA LEU 117 9.851 -2.887 -2.599 698 1HB LEU 117 HB2 LEU 117 8.933 -1.270 -1.165 699 2HB LEU 117 HB1 LEU 117 7.680 -0.849 -2.300 700 HG LEU 117 HG LEU 117 6.924 -2.039 -0.202 701 1HD1 LEU 117 HD1 LEU 117 5.551 -1.745 -2.005 702 2HD1 LEU 117 HD1 LEU 117 6.141 -3.233 -2.743 703 3HD1 LEU 117 HD1 LEU 117 5.261 -3.299 -1.198 704 1HD2 LEU 117 HD2 LEU 117 8.181 -4.414 -1.523 705 2HD2 LEU 117 HD2 LEU 117 8.710 -3.672 -0.011 706 3HD2 LEU 117 HD2 LEU 117 7.121 -4.440 -0.106 707 H ILE 118 HN ILE 118 7.489 -1.745 -4.942 708 HA ILE 118 HA ILE 118 5.970 -4.029 -4.998 709 HB ILE 118 HB ILE 118 6.564 -2.214 -7.368 710 1HG1 ILE 118 2HG1 ILE 118 4.175 -2.226 -5.527 711 2HG1 ILE 118 1HG1 ILE 118 5.574 -1.191 -5.267 712 1HG2 ILE 118 3HG2 ILE 118 5.635 -4.388 -8.071 713 2HG2 ILE 118 2HG2 ILE 118 4.309 -4.198 -6.943 714 3HG2 ILE 118 1HG2 ILE 118 4.458 -3.099 -8.321 715 1HD1 ILE 118 HD1 ILE 118 5.164 -0.118 -7.411 716 2HD1 ILE 118 HD1 ILE 118 3.751 -1.143 -7.656 717 3HD1 ILE 118 HD1 ILE 118 3.784 0.021 -6.324 718 H GLN 119 HN GLN 119 8.864 -3.134 -6.795 719 HA GLN 119 HA GLN 119 9.096 -5.445 -8.369 720 1HB GLN 119 HB2 GLN 119 11.168 -3.501 -7.396 721 2HB GLN 119 HB1 GLN 119 11.491 -4.749 -8.593 722 1HG GLN 119 HG2 GLN 119 9.881 -3.714 -10.090 723 2HG GLN 119 HG1 GLN 119 9.505 -2.501 -8.869 724 1HE2 GLN 119 1HE2 GLN 119 10.548 -2.181 -11.555 725 2HE2 GLN 119 2HE2 GLN 119 12.043 -1.327 -11.397 726 H LEU 120 HN LEU 120 9.834 -4.880 -5.023 727 HA LEU 120 HA LEU 120 11.578 -7.135 -4.807 728 1HB LEU 120 HB2 LEU 120 10.295 -5.436 -2.676 729 2HB LEU 120 HB1 LEU 120 11.332 -6.805 -2.333 730 HG LEU 120 HG LEU 120 12.183 -4.311 -3.806 731 1HD1 LEU 120 HD1 LEU 120 12.762 -5.279 -1.015 732 2HD1 LEU 120 HD1 LEU 120 13.491 -3.872 -1.790 733 3HD1 LEU 120 HD1 LEU 120 11.761 -3.895 -1.459 734 1HD2 LEU 120 HD2 LEU 120 13.769 -6.707 -2.867 735 2HD2 LEU 120 HD2 LEU 120 13.437 -6.279 -4.548 736 3HD2 LEU 120 HD2 LEU 120 14.445 -5.232 -3.552 737 H VAL 121 HN VAL 121 8.177 -6.537 -3.550 738 HA VAL 121 HA VAL 121 7.782 -9.163 -2.838 739 HB VAL 121 HB VAL 121 5.448 -8.708 -2.937 740 1HG1 VAL 121 3HG1 VAL 121 6.975 -6.342 -2.014 741 2HG1 VAL 121 2HG1 VAL 121 5.279 -6.670 -1.612 742 3HG1 VAL 121 1HG1 VAL 121 6.554 -7.786 -1.076 743 1HG2 VAL 121 2HG2 VAL 121 5.267 -7.636 -5.049 744 2HG2 VAL 121 1HG2 VAL 121 4.488 -6.658 -3.791 745 3HG2 VAL 121 3HG2 VAL 121 6.079 -6.193 -4.426 746 H ALA 122 HN ALA 122 7.569 -7.626 -5.952 747 HA ALA 122 HA ALA 122 6.235 -9.634 -7.347 748 1HB ALA 122 HB1 ALA 122 8.217 -7.637 -8.362 749 2HB ALA 122 HB2 ALA 122 6.515 -7.336 -8.061 750 3HB ALA 122 HB3 ALA 122 6.994 -8.487 -9.329 751 H ARG 123 HN ARG 123 9.696 -9.022 -6.831 752 HA ARG 123 HA ARG 123 10.428 -11.247 -8.478 753 1HB ARG 123 HB2 ARG 123 12.707 -10.736 -7.957 754 2HB ARG 123 HB1 ARG 123 11.869 -9.225 -8.252 755 1HG ARG 123 HG2 ARG 123 11.705 -8.865 -5.826 756 2HG ARG 123 HG1 ARG 123 12.607 -10.350 -5.551 757 1HD ARG 123 HD2 ARG 123 14.177 -8.556 -5.424 758 2HD ARG 123 HD1 ARG 123 14.459 -9.381 -6.953 759 HE ARG 123 HE ARG 123 12.799 -6.979 -6.822 760 1HH1 ARG 123 1HH1 ARG 123 15.595 -8.657 -8.276 761 2HH1 ARG 123 2HH1 ARG 123 16.063 -7.326 -9.213 762 1HH2 ARG 123 1HH2 ARG 123 13.530 -5.133 -8.072 763 2HH2 ARG 123 2HH2 ARG 123 14.860 -5.268 -9.103 764 H HIS 124 HN HIS 124 9.343 -10.957 -5.341 765 HA HIS 124 HA HIS 124 10.813 -13.052 -4.148 766 1HB HIS 124 HB2 HIS 124 9.502 -11.389 -2.858 767 2HB HIS 124 HB1 HIS 124 7.997 -12.084 -3.425 768 HD1 HIS 124 HD1 HIS 124 10.242 -12.210 -0.587 769 HD2 HIS 124 HD2 HIS 124 7.934 -15.010 -2.586 770 HE1 HIS 124 HE1 HIS 124 9.973 -14.132 0.998 771 H GLY 125 HN GLY 125 7.649 -12.873 -5.706 772 1HA GLY 125 HA1 GLY 125 7.245 -15.694 -5.614 773 2HA GLY 125 HA2 GLY 125 7.856 -15.182 -7.173 774 H LEU 126 HN LEU 126 6.399 -12.607 -7.189 775 HA LEU 126 HA LEU 126 3.675 -13.570 -7.063 776 1HB LEU 126 HB2 LEU 126 4.697 -10.793 -7.575 777 2HB LEU 126 HB1 LEU 126 3.014 -11.217 -7.657 778 HG LEU 126 HG LEU 126 4.803 -11.256 -5.395 779 1HD1 LEU 126 HD1 LEU 126 3.979 -9.098 -5.836 780 2HD1 LEU 126 HD1 LEU 126 2.295 -9.669 -5.776 781 3HD1 LEU 126 HD1 LEU 126 3.315 -9.711 -4.328 782 1HD2 LEU 126 HD2 LEU 126 2.051 -12.395 -5.462 783 2HD2 LEU 126 HD2 LEU 126 3.568 -13.200 -5.032 784 3HD2 LEU 126 HD2 LEU 126 2.890 -11.975 -3.970 785 H ASP 127 HN ASP 127 2.343 -13.687 -8.602 786 HA ASP 127 HA ASP 127 3.245 -14.263 -11.225 787 1HB ASP 127 HB2 ASP 127 0.399 -13.575 -10.416 788 2HB ASP 127 HB1 ASP 127 0.927 -14.620 -11.714 789 H HIS 128 HN HIS 128 2.548 -12.902 -13.113 790 HA HIS 128 HA HIS 128 3.201 -10.193 -12.744 791 1HB HIS 128 HB2 HIS 128 1.867 -11.540 -15.105 792 2HB HIS 128 HB1 HIS 128 2.355 -9.849 -15.101 793 HD1 HIS 128 HD1 HIS 128 3.640 -13.148 -15.948 794 HD2 HIS 128 HD2 HIS 128 5.231 -9.562 -14.571 795 HE1 HIS 128 HE1 HIS 128 6.109 -13.265 -16.383 796 H ASP 129 HN ASP 129 0.135 -11.794 -12.873 797 HA ASP 129 HA ASP 129 -1.508 -9.492 -12.898 798 1HB ASP 129 HB2 ASP 129 -2.050 -12.287 -11.878 799 2HB ASP 129 HB1 ASP 129 -3.277 -11.031 -11.982 800 H LYS 130 HN LYS 130 0.093 -11.262 -10.366 801 HA LYS 130 HA LYS 130 -1.241 -10.119 -8.123 802 1HB LYS 130 HB2 LYS 130 1.433 -11.407 -8.454 803 2HB LYS 130 HB1 LYS 130 0.950 -10.978 -6.863 804 1HG LYS 130 HG2 LYS 130 -0.406 -12.889 -8.774 805 2HG LYS 130 HG1 LYS 130 0.552 -13.318 -7.360 806 1HD LYS 130 HD2 LYS 130 -1.150 -12.471 -5.902 807 2HD LYS 130 HD1 LYS 130 -2.036 -11.771 -7.260 808 1HE LYS 130 HE2 LYS 130 -3.015 -13.907 -6.458 809 2HE LYS 130 HE1 LYS 130 -2.535 -13.946 -8.150 810 1HZ LYS 130 HZ1 LYS 130 -0.510 -15.167 -7.491 811 2HZ LYS 130 HZ3 LYS 130 -1.027 -15.117 -5.870 812 3HZ LYS 130 HZ2 LYS 130 -1.918 -15.958 -7.011 813 H VAL 131 HN VAL 131 1.797 -9.404 -9.744 814 HA VAL 131 HA VAL 131 2.605 -7.209 -8.257 815 HB VAL 131 HB VAL 131 2.934 -7.472 -11.254 816 1HG1 VAL 131 3HG1 VAL 131 4.649 -6.129 -9.185 817 2HG1 VAL 131 2HG1 VAL 131 5.044 -6.287 -10.893 818 3HG1 VAL 131 1HG1 VAL 131 3.642 -5.335 -10.397 819 1HG2 VAL 131 2HG2 VAL 131 3.552 -9.580 -10.193 820 2HG2 VAL 131 1HG2 VAL 131 4.985 -8.744 -10.801 821 3HG2 VAL 131 3HG2 VAL 131 4.608 -8.721 -9.080 822 H LEU 132 HN LEU 132 0.427 -7.358 -11.054 823 HA LEU 132 HA LEU 132 -0.074 -4.538 -11.302 824 1HB LEU 132 HB2 LEU 132 -1.881 -6.809 -12.086 825 2HB LEU 132 HB1 LEU 132 -1.921 -5.166 -12.692 826 HG LEU 132 HG LEU 132 0.194 -7.237 -13.217 827 1HD1 LEU 132 HD1 LEU 132 -1.779 -5.886 -15.009 828 2HD1 LEU 132 HD1 LEU 132 -0.497 -6.982 -15.531 829 3HD1 LEU 132 HD1 LEU 132 -1.790 -7.573 -14.484 830 1HD2 LEU 132 HD2 LEU 132 0.127 -4.336 -14.056 831 2HD2 LEU 132 HD2 LEU 132 1.282 -5.112 -12.967 832 3HD2 LEU 132 HD2 LEU 132 1.252 -5.553 -14.674 833 H LEU 133 HN LEU 133 -1.967 -7.082 -9.771 834 HA LEU 133 HA LEU 133 -3.933 -5.325 -8.797 835 1HB LEU 133 HB2 LEU 133 -3.058 -8.028 -7.837 836 2HB LEU 133 HB1 LEU 133 -4.480 -7.184 -7.241 837 HG LEU 133 HG LEU 133 -4.075 -8.010 -10.119 838 1HD1 LEU 133 HD1 LEU 133 -5.654 -9.368 -7.938 839 2HD1 LEU 133 HD1 LEU 133 -5.664 -9.803 -9.649 840 3HD1 LEU 133 HD1 LEU 133 -4.185 -9.976 -8.709 841 1HD2 LEU 133 HD2 LEU 133 -6.502 -7.035 -8.609 842 2HD2 LEU 133 HD2 LEU 133 -5.605 -6.140 -9.841 843 3HD2 LEU 133 HD2 LEU 133 -6.487 -7.602 -10.278 844 H PHE 134 HN PHE 134 -0.917 -6.466 -7.385 845 HA PHE 134 HA PHE 134 -1.365 -5.310 -4.866 846 1HB PHE 134 HB2 PHE 134 0.272 -7.074 -5.090 847 2HB PHE 134 HB1 PHE 134 1.217 -6.109 -6.222 848 HD1 PHE 134 HD1 PHE 134 -0.005 -6.193 -2.722 849 HD2 PHE 134 HD2 PHE 134 2.894 -4.707 -5.449 850 HE1 PHE 134 HE1 PHE 134 1.273 -5.247 -0.852 851 HE2 PHE 134 HE2 PHE 134 4.176 -3.764 -3.570 852 HZ PHE 134 HZ PHE 134 3.374 -4.025 -1.303 853 H SER 135 HN SER 135 0.509 -4.159 -7.683 854 HA SER 135 HA SER 135 1.484 -1.856 -6.477 855 1HB SER 135 HB2 SER 135 1.834 -1.031 -8.835 856 2HB SER 135 HB1 SER 135 2.479 -2.639 -8.508 857 HG SER 135 HG SER 135 0.935 -3.540 -9.658 858 H ARG 136 HN ARG 136 -1.548 -2.394 -8.133 859 HA ARG 136 HA ARG 136 -2.238 0.372 -8.034 860 1HB ARG 136 HB2 ARG 136 -4.417 -0.308 -8.910 861 2HB ARG 136 HB1 ARG 136 -3.092 -0.995 -9.831 862 1HG ARG 136 HG2 ARG 136 -3.407 -3.127 -8.686 863 2HG ARG 136 HG1 ARG 136 -4.756 -2.433 -7.788 864 1HD ARG 136 HD2 ARG 136 -4.544 -2.745 -10.765 865 2HD ARG 136 HD1 ARG 136 -5.523 -3.734 -9.694 866 HE ARG 136 HE ARG 136 -6.026 -0.858 -9.638 867 1HH1 ARG 136 1HH1 ARG 136 -7.180 -3.995 -10.862 868 2HH1 ARG 136 2HH1 ARG 136 -8.789 -3.451 -11.033 869 1HH2 ARG 136 1HH2 ARG 136 -8.189 -0.146 -9.932 870 2HH2 ARG 136 2HH2 ARG 136 -9.383 -1.199 -10.510 871 H ASP 137 HN ASP 137 -2.935 -2.434 -5.975 872 HA ASP 137 HA ASP 137 -4.879 -0.931 -4.471 873 1HB ASP 137 HB2 ASP 137 -4.688 -3.560 -4.758 874 2HB ASP 137 HB1 ASP 137 -3.604 -3.417 -3.390 875 H LEU 138 HN LEU 138 -1.522 -1.604 -4.311 876 HA LEU 138 HA LEU 138 -0.939 -0.552 -1.761 877 1HB LEU 138 HB2 LEU 138 0.703 -1.877 -2.855 878 2HB LEU 138 HB1 LEU 138 0.639 -0.892 -4.296 879 HG LEU 138 HG LEU 138 1.808 0.917 -3.139 880 1HD1 LEU 138 HD1 LEU 138 1.942 -0.958 -0.792 881 2HD1 LEU 138 HD1 LEU 138 2.774 0.594 -0.984 882 3HD1 LEU 138 HD1 LEU 138 1.012 0.553 -0.902 883 1HD2 LEU 138 HD2 LEU 138 3.139 -1.754 -2.889 884 2HD2 LEU 138 HD2 LEU 138 3.093 -0.728 -4.322 885 3HD2 LEU 138 HD2 LEU 138 3.960 -0.193 -2.884 886 H ASP 139 HN ASP 139 -1.100 0.871 -4.984 887 HA ASP 139 HA ASP 139 -0.283 3.461 -4.276 888 1HB ASP 139 HB2 ASP 139 -0.469 2.605 -6.626 889 2HB ASP 139 HB1 ASP 139 -2.218 2.696 -6.477 890 H LYS 140 HN LYS 140 -3.475 1.974 -4.459 891 HA LYS 140 HA LYS 140 -5.102 4.070 -3.618 892 1HB LYS 140 HB2 LYS 140 -5.289 1.106 -3.102 893 2HB LYS 140 HB1 LYS 140 -6.516 2.237 -2.566 894 1HG LYS 140 HG2 LYS 140 -7.123 2.770 -4.802 895 2HG LYS 140 HG1 LYS 140 -5.698 1.952 -5.447 896 1HD LYS 140 HD2 LYS 140 -7.807 0.646 -5.702 897 2HD LYS 140 HD1 LYS 140 -6.579 -0.217 -4.801 898 1HE LYS 140 HE2 LYS 140 -7.743 0.602 -2.693 899 2HE LYS 140 HE1 LYS 140 -9.049 1.151 -3.743 900 1HZ LYS 140 HZ3 LYS 140 -9.258 -1.149 -4.535 901 2HZ LYS 140 HZ2 LYS 140 -8.043 -1.625 -3.492 902 3HZ LYS 140 HZ1 LYS 140 -9.507 -1.064 -2.872 903 H LEU 141 HN LEU 141 -3.373 1.685 -1.634 904 HA LEU 141 HA LEU 141 -4.332 2.521 0.882 905 1HB LEU 141 HB2 LEU 141 -3.099 0.349 0.208 906 2HB LEU 141 HB1 LEU 141 -1.634 1.270 0.398 907 HG LEU 141 HG LEU 141 -3.599 0.764 2.659 908 1HD1 LEU 141 HD1 LEU 141 -1.042 -0.571 2.017 909 2HD1 LEU 141 HD1 LEU 141 -1.995 -0.737 3.488 910 3HD1 LEU 141 HD1 LEU 141 -2.668 -1.296 1.942 911 1HD2 LEU 141 HD2 LEU 141 -2.206 2.731 2.970 912 2HD2 LEU 141 HD2 LEU 141 -1.841 1.426 4.102 913 3HD2 LEU 141 HD2 LEU 141 -0.779 1.721 2.731 914 H ILE 142 HN ILE 142 -1.400 3.320 -0.895 915 HA ILE 142 HA ILE 142 -0.445 5.059 1.098 916 HB ILE 142 HB ILE 142 0.331 4.825 -1.829 917 1HG1 ILE 142 2HG1 ILE 142 1.591 3.919 0.753 918 2HG1 ILE 142 1HG1 ILE 142 0.817 2.889 -0.441 919 1HG2 ILE 142 3HG2 ILE 142 0.822 7.111 -1.032 920 2HG2 ILE 142 2HG2 ILE 142 1.685 6.440 0.352 921 3HG2 ILE 142 1HG2 ILE 142 2.306 6.188 -1.278 922 1HD1 ILE 142 HD1 ILE 142 3.312 4.502 -0.903 923 2HD1 ILE 142 HD1 ILE 142 3.267 2.784 -0.496 924 3HD1 ILE 142 HD1 ILE 142 2.568 3.355 -2.013 925 H ASN 143 HN ASN 143 -2.229 5.726 -1.897 926 HA ASN 143 HA ASN 143 -2.363 8.505 -1.579 927 1HB ASN 143 HB2 ASN 143 -4.371 6.646 -2.864 928 2HB ASN 143 HB1 ASN 143 -4.484 8.401 -2.923 929 1HD2 ASN 143 HD2 ASN 143 -4.190 6.469 -5.090 930 2HD2 ASN 143 HD2 ASN 143 -2.742 6.840 -5.917 931 H LYS 144 HN LYS 144 -4.282 5.980 -0.164 932 HA LYS 144 HA LYS 144 -6.360 7.349 1.049 933 1HB LYS 144 HB2 LYS 144 -6.165 4.931 1.030 934 2HB LYS 144 HB1 LYS 144 -4.736 5.000 2.039 935 1HG LYS 144 HG2 LYS 144 -6.265 6.085 3.805 936 2HG LYS 144 HG1 LYS 144 -7.598 5.510 2.805 937 1HD LYS 144 HD2 LYS 144 -5.427 3.795 4.046 938 2HD LYS 144 HD1 LYS 144 -7.094 3.913 4.595 939 1HE LYS 144 HE2 LYS 144 -7.854 2.962 2.472 940 2HE LYS 144 HE1 LYS 144 -6.185 2.893 1.912 941 1HZ LYS 144 HZ3 LYS 144 -5.722 1.197 3.678 942 2HZ LYS 144 HZ2 LYS 144 -7.319 1.335 4.198 943 3HZ LYS 144 HZ1 LYS 144 -6.995 0.764 2.677 944 H PHE 145 HN PHE 145 -3.207 6.544 2.439 945 HA PHE 145 HA PHE 145 -3.727 8.154 4.734 946 1HB PHE 145 HB2 PHE 145 -1.554 6.334 3.929 947 2HB PHE 145 HB1 PHE 145 -1.209 7.558 5.154 948 HD1 PHE 145 HD1 PHE 145 -2.260 7.576 7.201 949 HD2 PHE 145 HD2 PHE 145 -3.166 4.580 4.363 950 HE1 PHE 145 HE1 PHE 145 -3.418 6.254 8.972 951 HE2 PHE 145 HE2 PHE 145 -4.309 3.246 6.084 952 HZ PHE 145 HZ PHE 145 -4.439 4.088 8.397 953 H MET 146 HN MET 146 -2.003 8.578 1.822 954 HA MET 146 HA MET 146 -0.509 10.849 2.690 955 1HB MET 146 HB2 MET 146 -1.361 10.010 -0.081 956 2HB MET 146 HB1 MET 146 -0.241 11.329 0.243 957 1HG MET 146 HG2 MET 146 0.156 8.432 0.945 958 2HG MET 146 HG1 MET 146 0.953 9.289 -0.367 959 1HE MET 146 HE2 MET 146 2.687 11.140 -0.049 960 2HE MET 146 HE1 MET 146 1.567 12.074 0.957 961 3HE MET 146 HE3 MET 146 3.208 11.752 1.523 962 H ASN 147 HN ASN 147 -3.647 10.252 1.464 963 HA ASN 147 HA ASN 147 -5.570 11.330 1.505 964 1HB ASN 147 HB2 ASN 147 -4.727 12.045 3.807 965 2HB ASN 147 HB1 ASN 147 -4.227 13.558 3.079 966 1HD2 ASN 147 HD2 ASN 147 -6.896 11.608 4.085 967 2HD2 ASN 147 HD2 ASN 147 -8.107 12.826 3.983 968 H VAL 148 HN VAL 148 -3.136 12.133 -0.178 969 HA VAL 148 HA VAL 148 -3.912 14.639 -1.326 970 HB VAL 148 HB VAL 148 -2.202 14.175 -3.084 971 1HG1 VAL 148 3HG1 VAL 148 -1.254 13.846 -0.232 972 2HG1 VAL 148 2HG1 VAL 148 -0.237 14.340 -1.586 973 3HG1 VAL 148 1HG1 VAL 148 -1.566 15.371 -1.059 974 1HG2 VAL 148 1HG2 VAL 148 -1.684 11.649 -1.504 975 2HG2 VAL 148 3HG2 VAL 148 -2.299 11.742 -3.154 976 3HG2 VAL 148 2HG2 VAL 148 -0.654 12.267 -2.796 977 H LYS 149 HN LYS 149 -5.247 14.988 -2.920 978 HA LYS 149 HA LYS 149 -6.490 12.628 -4.118 979 1HB LYS 149 HB2 LYS 149 -7.770 15.326 -3.662 980 2HB LYS 149 HB1 LYS 149 -8.570 13.813 -4.071 981 1HG LYS 149 HG2 LYS 149 -8.119 12.897 -1.923 982 2HG LYS 149 HG1 LYS 149 -7.065 14.238 -1.505 983 1HD LYS 149 HD2 LYS 149 -9.083 15.744 -1.746 984 2HD LYS 149 HD1 LYS 149 -10.054 14.273 -1.859 985 1HE LYS 149 HE2 LYS 149 -10.041 15.093 0.429 986 2HE LYS 149 HE1 LYS 149 -9.194 13.550 0.326 987 1HZ LYS 149 HZ1 LYS 149 -7.066 14.774 0.338 988 2HZ LYS 149 HZ3 LYS 149 -7.892 16.234 0.461 989 3HZ LYS 149 HZ2 LYS 149 -7.952 15.112 1.700 990 H ASP 150 HN ASP 150 -5.054 12.688 -5.874 991 HA ASP 150 HA ASP 150 -5.209 15.096 -7.508 992 1HB ASP 150 HB2 ASP 150 -3.119 14.501 -8.559 993 2HB ASP 150 HB1 ASP 150 -2.897 14.492 -6.822 994 H LYS 151 HN LYS 151 -5.370 14.851 -9.720 995 HA LYS 151 HA LYS 151 -6.656 12.337 -10.557 996 1HB LYS 151 HB2 LYS 151 -8.229 13.673 -11.869 997 2HB LYS 151 HB1 LYS 151 -8.321 14.104 -10.168 998 1HG LYS 151 HG2 LYS 151 -6.753 16.026 -10.737 999 2HG LYS 151 HG1 LYS 151 -7.099 15.666 -12.423 1000 1HD LYS 151 HD2 LYS 151 -9.097 16.432 -10.291 1001 2HD LYS 151 HD1 LYS 151 -8.522 17.423 -11.628 1002 1HE LYS 151 HE2 LYS 151 -10.079 14.856 -11.922 1003 2HE LYS 151 HE1 LYS 151 -10.767 16.475 -11.999 1004 1HZ LYS 151 HZ1 LYS 151 -9.367 16.906 -13.938 1005 2HZ LYS 151 HZ3 LYS 151 -8.772 15.324 -13.865 1006 3HZ LYS 151 HZ2 LYS 151 -10.388 15.578 -14.176 1007 H VAL 152 HN VAL 152 -3.935 13.549 -10.749 1008 HA VAL 152 HA VAL 152 -3.683 14.025 -13.633 1009 HB VAL 152 HB VAL 152 -1.461 14.979 -13.140 1010 1HG1 VAL 152 3HG1 VAL 152 -3.418 16.441 -13.155 1011 2HG1 VAL 152 2HG1 VAL 152 -3.654 16.142 -11.435 1012 3HG1 VAL 152 1HG1 VAL 152 -2.217 17.000 -11.990 1013 1HG2 VAL 152 1HG2 VAL 152 -2.168 14.454 -10.254 1014 2HG2 VAL 152 3HG2 VAL 152 -0.872 13.674 -11.161 1015 3HG2 VAL 152 2HG2 VAL 152 -0.788 15.402 -10.803 1016 H HIS 153 HN HIS 153 -3.892 11.495 -12.076 1017 HA HIS 153 HA HIS 153 -1.418 10.134 -12.694 1018 1HB HIS 153 HB2 HIS 153 -2.543 8.120 -11.758 1019 2HB HIS 153 HB1 HIS 153 -2.573 9.470 -10.639 1020 HD1 HIS 153 HD1 HIS 153 -4.729 6.986 -12.152 1021 HD2 HIS 153 HD2 HIS 153 -5.177 10.788 -10.576 1022 HE1 HIS 153 HE1 HIS 153 -7.194 7.257 -11.682 1023 H LYS 154 HN LYS 154 -1.560 8.076 -14.046 1024 HA LYS 154 HA LYS 154 -3.272 8.725 -16.342 1025 1HB LYS 154 HB2 LYS 154 -0.795 8.886 -16.733 1026 2HB LYS 154 HB1 LYS 154 -0.696 7.163 -16.405 1027 1HG LYS 154 HG2 LYS 154 -2.356 6.801 -18.242 1028 2HG LYS 154 HG1 LYS 154 -2.166 8.502 -18.651 1029 1HD LYS 154 HD2 LYS 154 0.226 8.126 -19.013 1030 2HD LYS 154 HD1 LYS 154 0.008 6.419 -18.625 1031 1HE LYS 154 HE2 LYS 154 -1.706 6.336 -20.476 1032 2HE LYS 154 HE1 LYS 154 -1.143 7.941 -20.944 1033 1HZ LYS 154 HZ2 LYS 154 1.078 7.008 -21.232 1034 2HZ LYS 154 HZ1 LYS 154 0.479 5.483 -20.797 1035 3HZ LYS 154 HZ3 LYS 154 -0.036 6.234 -22.228 1036 H LEU 155 HN LEU 155 -4.701 7.289 -16.973 1037 HA LEU 155 HA LEU 155 -4.480 4.554 -15.952 1038 1HB LEU 155 HB2 LEU 155 -6.908 6.085 -16.917 1039 2HB LEU 155 HB1 LEU 155 -6.916 4.421 -16.380 1040 HG LEU 155 HG LEU 155 -6.284 6.805 -14.638 1041 1HD1 LEU 155 HD1 LEU 155 -8.624 6.719 -15.293 1042 2HD1 LEU 155 HD1 LEU 155 -8.725 5.043 -14.750 1043 3HD1 LEU 155 HD1 LEU 155 -8.423 6.333 -13.585 1044 1HD2 LEU 155 HD2 LEU 155 -6.596 3.880 -13.954 1045 2HD2 LEU 155 HD2 LEU 155 -5.096 4.802 -13.914 1046 3HD2 LEU 155 HD2 LEU 155 -6.399 5.195 -12.793 1047 H GLU 156 HN GLU 156 -4.382 2.930 -17.455 1048 HA GLU 156 HA GLU 156 -5.148 3.316 -20.149 1049 1HB GLU 156 HB2 GLU 156 -2.913 2.928 -21.143 1050 2HB GLU 156 HB1 GLU 156 -2.971 4.442 -20.258 1051 1HG GLU 156 HG2 GLU 156 -1.810 3.362 -18.378 1052 2HG GLU 156 HG1 GLU 156 -1.742 1.864 -19.302 1053 H HIS 157 HN HIS 157 -4.594 1.234 -21.384 1054 HA HIS 157 HA HIS 157 -5.291 -0.899 -19.588 1055 1HB HIS 157 HB2 HIS 157 -5.622 -2.298 -21.590 1056 2HB HIS 157 HB1 HIS 157 -6.499 -0.784 -21.720 1057 HD1 HIS 157 HD1 HIS 157 -5.920 0.700 -23.742 1058 HD2 HIS 157 HD2 HIS 157 -3.394 -2.567 -23.312 1059 HE1 HIS 157 HE1 HIS 157 -4.503 0.633 -25.817 1060 H HIS 158 HN HIS 158 -4.257 -2.785 -19.313 1061 HA HIS 158 HA HIS 158 -1.892 -3.723 -20.368 1062 1HB HIS 158 HB2 HIS 158 -0.871 -1.685 -19.216 1063 2HB HIS 158 HB1 HIS 158 -1.460 -2.319 -17.690 1064 HD1 HIS 158 HD1 HIS 158 1.205 -2.916 -20.309 1065 HD2 HIS 158 HD2 HIS 158 0.020 -4.404 -16.608 1066 HE1 HIS 158 HE1 HIS 158 3.093 -4.365 -19.503 1067 H HIS 159 HN HIS 159 -3.543 -3.151 -17.333 1068 HA HIS 159 HA HIS 159 -3.695 -5.987 -16.743 1069 1HB HIS 159 HB2 HIS 159 -3.277 -4.440 -14.856 1070 2HB HIS 159 HB1 HIS 159 -4.700 -3.513 -15.286 1071 HD1 HIS 159 HD1 HIS 159 -4.087 -7.212 -14.311 1072 HD2 HIS 159 HD2 HIS 159 -6.751 -4.076 -13.668 1073 HE1 HIS 159 HE1 HIS 159 -5.771 -8.056 -12.669 1074 H HIS 160 HN HIS 160 -5.334 -7.119 -17.504 1075 HA HIS 160 HA HIS 160 -7.414 -5.724 -18.901 1076 1HB HIS 160 HB2 HIS 160 -6.707 -8.639 -18.727 1077 2HB HIS 160 HB1 HIS 160 -8.193 -8.093 -19.496 1078 HD1 HIS 160 HD1 HIS 160 -7.992 -7.490 -21.919 1079 HD2 HIS 160 HD2 HIS 160 -4.329 -7.454 -19.966 1080 HE1 HIS 160 HE1 HIS 160 -6.249 -7.055 -23.691 1081 H HIS 161 HN HIS 161 -9.355 -5.415 -18.366 1082 HA HIS 161 HA HIS 161 -10.249 -5.893 -15.701 1083 1HB HIS 161 HB2 HIS 161 -11.773 -4.866 -18.106 1084 2HB HIS 161 HB1 HIS 161 -12.357 -4.826 -16.452 1085 HD1 HIS 161 HD1 HIS 161 -10.987 -2.606 -18.842 1086 HD2 HIS 161 HD2 HIS 161 -10.264 -3.308 -14.807 1087 HE1 HIS 161 HE1 HIS 161 -9.888 -0.522 -17.952 1088 H HIS 162 HN HIS 162 -11.235 -7.039 -18.905 1089 HA HIS 162 HA HIS 162 -12.244 -9.462 -17.672 1090 1HB HIS 162 HB2 HIS 162 -13.787 -7.773 -19.674 1091 2HB HIS 162 HB1 HIS 162 -14.209 -9.430 -19.256 1092 HD1 HIS 162 HD1 HIS 162 -14.776 -5.969 -18.217 1093 HD2 HIS 162 HD2 HIS 162 -14.974 -9.732 -16.474 1094 HE1 HIS 162 HE1 HIS 162 -16.120 -5.691 -16.103 No H/Q in entry = 1094 Start of MODEL 6 1 H1 MET 1 HT2 MET 1 17.957 -15.179 -3.256 2 H2 MET 1 HT1 MET 1 19.404 -14.443 -2.864 3 H3 MET 1 HT3 MET 1 19.287 -15.428 -4.232 4 HA MET 1 HA MET 1 18.831 -17.346 -2.818 5 1HB MET 1 HB2 MET 1 21.274 -15.807 -1.886 6 2HB MET 1 HB1 MET 1 21.000 -17.523 -1.631 7 1HG MET 1 HG2 MET 1 21.034 -17.878 -4.048 8 2HG MET 1 HG1 MET 1 21.333 -16.157 -4.292 9 1HE MET 1 HE2 MET 1 23.178 -18.328 -5.596 10 2HE MET 1 HE1 MET 1 23.503 -16.605 -5.722 11 3HE MET 1 HE3 MET 1 24.792 -17.709 -5.239 12 H GLU 2 HN GLU 2 17.920 -18.051 -1.021 13 HA GLU 2 HA GLU 2 16.915 -18.162 0.951 14 1HB GLU 2 HB2 GLU 2 19.053 -17.639 2.008 15 2HB GLU 2 HB1 GLU 2 18.776 -15.919 1.790 16 1HG GLU 2 HG2 GLU 2 18.401 -16.693 4.109 17 2HG GLU 2 HG1 GLU 2 16.980 -15.953 3.387 18 H MET 3 HN MET 3 14.925 -17.761 1.035 19 HA MET 3 HA MET 3 13.786 -15.372 0.022 20 1HB MET 3 HB2 MET 3 12.524 -17.648 1.542 21 2HB MET 3 HB1 MET 3 11.630 -16.342 0.787 22 1HG MET 3 HG2 MET 3 12.436 -17.033 -1.394 23 2HG MET 3 HG1 MET 3 13.385 -18.315 -0.651 24 1HE MET 3 HE1 MET 3 11.274 -18.738 -3.018 25 2HE MET 3 HE3 MET 3 12.236 -20.043 -2.324 26 3HE MET 3 HE2 MET 3 10.491 -20.228 -2.491 27 H GLY 4 HN GLY 4 14.696 -16.494 3.181 28 1HA GLY 4 HA1 GLY 4 14.663 -15.479 5.226 29 2HA GLY 4 HA2 GLY 4 13.123 -14.775 4.752 30 H GLN 5 HN GLN 5 16.269 -14.345 3.238 31 HA GLN 5 HA GLN 5 16.501 -11.711 4.369 32 1HB GLN 5 HB2 GLN 5 18.304 -13.050 2.358 33 2HB GLN 5 HB1 GLN 5 18.594 -11.538 3.239 34 1HG GLN 5 HG2 GLN 5 18.669 -12.717 5.337 35 2HG GLN 5 HG1 GLN 5 18.303 -14.238 4.526 36 1HE2 GLN 5 1HE2 GLN 5 20.609 -13.484 6.136 37 2HE2 GLN 5 2HE2 GLN 5 21.982 -13.712 5.104 38 H LEU 6 HN LEU 6 15.208 -13.123 1.609 39 HA LEU 6 HA LEU 6 15.237 -10.830 -0.097 40 1HB LEU 6 HB2 LEU 6 14.902 -13.108 -0.997 41 2HB LEU 6 HB1 LEU 6 13.494 -13.314 0.005 42 HG LEU 6 HG LEU 6 13.076 -13.017 -2.473 43 1HD1 LEU 6 HD1 LEU 6 11.279 -12.773 -0.888 44 2HD1 LEU 6 HD1 LEU 6 11.701 -11.090 -0.641 45 3HD1 LEU 6 HD1 LEU 6 11.112 -11.624 -2.217 46 1HD2 LEU 6 HD2 LEU 6 14.702 -11.259 -2.918 47 2HD2 LEU 6 HD2 LEU 6 13.076 -10.736 -3.363 48 3HD2 LEU 6 HD2 LEU 6 13.813 -10.154 -1.871 49 H LYS 7 HN LYS 7 12.999 -12.309 2.152 50 HA LYS 7 HA LYS 7 10.985 -10.344 2.037 51 1HB LYS 7 HB2 LYS 7 11.242 -12.833 3.138 52 2HB LYS 7 HB1 LYS 7 11.369 -11.822 4.567 53 1HG LYS 7 HG2 LYS 7 9.112 -11.680 2.602 54 2HG LYS 7 HG1 LYS 7 9.069 -12.658 4.056 55 1HD LYS 7 HD2 LYS 7 9.412 -9.653 3.935 56 2HD LYS 7 HD1 LYS 7 7.895 -10.476 4.275 57 1HE LYS 7 HE2 LYS 7 10.410 -10.649 5.926 58 2HE LYS 7 HE1 LYS 7 9.007 -9.661 6.306 59 1HZ LYS 7 HZ3 LYS 7 7.700 -11.762 6.419 60 2HZ LYS 7 HZ2 LYS 7 9.136 -12.630 6.239 61 3HZ LYS 7 HZ1 LYS 7 8.918 -11.659 7.573 62 H ASN 8 HN ASN 8 13.937 -10.717 3.815 63 HA ASN 8 HA ASN 8 13.756 -8.700 5.740 64 1HB ASN 8 HB2 ASN 8 15.581 -10.313 5.674 65 2HB ASN 8 HB1 ASN 8 16.129 -9.655 4.136 66 1HD2 ASN 8 HD2 ASN 8 16.068 -9.318 7.497 67 2HD2 ASN 8 HD2 ASN 8 17.183 -8.007 7.636 68 H LYS 9 HN LYS 9 14.979 -8.563 2.388 69 HA LYS 9 HA LYS 9 15.476 -5.797 2.342 70 1HB LYS 9 HB2 LYS 9 14.795 -7.668 0.069 71 2HB LYS 9 HB1 LYS 9 15.342 -6.012 -0.139 72 1HG LYS 9 HG2 LYS 9 17.455 -6.588 0.954 73 2HG LYS 9 HG1 LYS 9 16.907 -8.260 1.107 74 1HD LYS 9 HD2 LYS 9 16.715 -8.431 -1.320 75 2HD LYS 9 HD1 LYS 9 17.213 -6.748 -1.487 76 1HE LYS 9 HE2 LYS 9 19.377 -7.306 -0.462 77 2HE LYS 9 HE1 LYS 9 18.874 -8.992 -0.348 78 1HZ LYS 9 HZ1 LYS 9 19.134 -7.451 -2.866 79 2HZ LYS 9 HZ3 LYS 9 20.259 -8.561 -2.298 80 3HZ LYS 9 HZ2 LYS 9 18.724 -9.084 -2.747 81 H ILE 10 HN ILE 10 12.644 -7.702 1.510 82 HA ILE 10 HA ILE 10 10.975 -5.661 0.594 83 HB ILE 10 HB ILE 10 10.264 -8.205 2.091 84 1HG1 ILE 10 2HG1 ILE 10 10.148 -7.501 -0.845 85 2HG1 ILE 10 1HG1 ILE 10 11.362 -8.520 -0.082 86 1HG2 ILE 10 3HG2 ILE 10 8.437 -6.606 2.365 87 2HG2 ILE 10 2HG2 ILE 10 8.391 -6.345 0.621 88 3HG2 ILE 10 1HG2 ILE 10 7.960 -7.921 1.286 89 1HD1 ILE 10 HD1 ILE 10 9.611 -10.149 0.461 90 2HD1 ILE 10 HD1 ILE 10 8.418 -9.119 -0.334 91 3HD1 ILE 10 HD1 ILE 10 9.728 -9.846 -1.267 92 H GLU 11 HN GLU 11 11.349 -6.904 3.910 93 HA GLU 11 HA GLU 11 9.645 -5.093 5.167 94 1HB GLU 11 HB2 GLU 11 12.108 -6.495 6.179 95 2HB GLU 11 HB1 GLU 11 11.141 -5.438 7.194 96 1HG GLU 11 HG2 GLU 11 10.180 -7.916 5.815 97 2HG GLU 11 HG1 GLU 11 10.593 -7.778 7.529 98 H ASN 12 HN ASN 12 13.126 -4.901 4.671 99 HA ASN 12 HA ASN 12 13.536 -2.446 5.911 100 1HB ASN 12 HB2 ASN 12 15.396 -3.907 5.406 101 2HB ASN 12 HB1 ASN 12 15.088 -3.768 3.682 102 1HD2 ASN 12 HD2 ASN 12 15.933 -2.045 2.571 103 2HD2 ASN 12 HD2 ASN 12 16.909 -0.836 3.288 104 H LYS 13 HN LYS 13 12.798 -3.133 2.534 105 HA LYS 13 HA LYS 13 13.107 -0.461 1.646 106 1HB LYS 13 HB2 LYS 13 13.141 -2.586 0.249 107 2HB LYS 13 HB1 LYS 13 11.395 -2.571 0.367 108 1HG LYS 13 HG2 LYS 13 12.107 -1.607 -1.731 109 2HG LYS 13 HG1 LYS 13 11.317 -0.394 -0.721 110 1HD LYS 13 HD2 LYS 13 13.353 0.474 -1.826 111 2HD LYS 13 HD1 LYS 13 13.473 0.524 -0.075 112 1HE LYS 13 HE2 LYS 13 14.793 -1.427 -0.048 113 2HE LYS 13 HE1 LYS 13 14.636 -1.661 -1.805 114 1HZ LYS 13 HZ3 LYS 13 15.813 0.497 -2.038 115 2HZ LYS 13 HZ2 LYS 13 15.991 0.508 -0.325 116 3HZ LYS 13 HZ1 LYS 13 16.730 -0.686 -1.240 117 H LYS 14 HN LYS 14 10.263 -2.401 2.446 118 HA LYS 14 HA LYS 14 8.270 -0.527 2.082 119 1HB LYS 14 HB2 LYS 14 7.794 -2.837 2.391 120 2HB LYS 14 HB1 LYS 14 8.624 -2.851 3.943 121 1HG LYS 14 HG2 LYS 14 6.853 -1.329 4.839 122 2HG LYS 14 HG1 LYS 14 5.993 -1.512 3.309 123 1HD LYS 14 HD2 LYS 14 5.048 -3.066 4.895 124 2HD LYS 14 HD1 LYS 14 5.982 -3.955 3.683 125 1HE LYS 14 HE2 LYS 14 7.883 -4.033 5.289 126 2HE LYS 14 HE1 LYS 14 6.816 -3.275 6.468 127 1HZ LYS 14 HZ3 LYS 14 6.154 -5.797 5.099 128 2HZ LYS 14 HZ2 LYS 14 7.003 -5.795 6.510 129 3HZ LYS 14 HZ1 LYS 14 5.416 -5.241 6.488 130 H LYS 15 HN LYS 15 10.326 -1.234 4.874 131 HA LYS 15 HA LYS 15 9.142 0.661 6.584 132 1HB LYS 15 HB2 LYS 15 11.703 -0.877 6.628 133 2HB LYS 15 HB1 LYS 15 11.420 0.391 7.811 134 1HG LYS 15 HG2 LYS 15 9.593 -0.749 8.770 135 2HG LYS 15 HG1 LYS 15 9.432 -1.822 7.378 136 1HD LYS 15 HD2 LYS 15 11.301 -3.044 7.940 137 2HD LYS 15 HD1 LYS 15 11.921 -1.822 9.062 138 1HE LYS 15 HE2 LYS 15 11.034 -3.771 10.246 139 2HE LYS 15 HE1 LYS 15 10.080 -2.336 10.592 140 1HZ LYS 15 HZ3 LYS 15 9.273 -4.547 8.719 141 2HZ LYS 15 HZ2 LYS 15 8.719 -4.262 10.263 142 3HZ LYS 15 HZ1 LYS 15 8.374 -3.149 9.069 143 H GLU 16 HN GLU 16 11.926 0.887 4.399 144 HA GLU 16 HA GLU 16 12.699 3.527 4.923 145 1HB GLU 16 HB2 GLU 16 12.596 2.015 2.289 146 2HB GLU 16 HB1 GLU 16 13.283 3.624 2.446 147 1HG GLU 16 HG2 GLU 16 14.962 2.650 3.984 148 2HG GLU 16 HG1 GLU 16 14.258 1.059 3.667 149 H LEU 17 HN LEU 17 10.119 2.224 3.008 150 HA LEU 17 HA LEU 17 9.237 4.651 1.889 151 1HB LEU 17 HB2 LEU 17 8.725 2.664 0.720 152 2HB LEU 17 HB1 LEU 17 8.046 1.907 2.135 153 HG LEU 17 HG LEU 17 6.404 2.519 0.339 154 1HD1 LEU 17 HD1 LEU 17 5.673 1.958 2.429 155 2HD1 LEU 17 HD1 LEU 17 5.843 3.620 2.989 156 3HD1 LEU 17 HD1 LEU 17 4.672 3.235 1.714 157 1HD2 LEU 17 HD2 LEU 17 6.991 5.321 1.219 158 2HD2 LEU 17 HD2 LEU 17 7.322 4.625 -0.371 159 3HD2 LEU 17 HD2 LEU 17 5.653 4.802 0.184 160 H ILE 18 HN ILE 18 8.113 2.763 4.652 161 HA ILE 18 HA ILE 18 5.893 4.286 5.257 162 HB ILE 18 HB ILE 18 7.703 2.878 7.260 163 1HG1 ILE 18 2HG1 ILE 18 5.132 1.891 6.022 164 2HG1 ILE 18 1HG1 ILE 18 6.714 1.529 5.348 165 1HG2 ILE 18 2HG2 ILE 18 6.170 4.508 8.365 166 2HG2 ILE 18 1HG2 ILE 18 4.797 3.754 7.588 167 3HG2 ILE 18 3HG2 ILE 18 5.745 2.853 8.769 168 1HD1 ILE 18 HD1 ILE 18 5.754 0.757 8.094 169 2HD1 ILE 18 HD1 ILE 18 5.875 -0.299 6.676 170 3HD1 ILE 18 HD1 ILE 18 7.328 0.385 7.393 171 H GLN 19 HN GLN 19 9.250 4.671 6.218 172 HA GLN 19 HA GLN 19 9.001 6.865 7.942 173 1HB GLN 19 HB2 GLN 19 11.295 6.022 6.170 174 2HB GLN 19 HB1 GLN 19 11.409 7.207 7.465 175 1HG GLN 19 HG2 GLN 19 10.940 5.552 9.124 176 2HG GLN 19 HG1 GLN 19 10.561 4.353 7.889 177 1HE2 GLN 19 1HE2 GLN 19 12.111 2.941 8.700 178 2HE2 GLN 19 2HE2 GLN 19 13.798 3.203 8.474 179 H LEU 20 HN LEU 20 9.387 6.664 4.437 180 HA LEU 20 HA LEU 20 9.628 9.463 4.007 181 1HB LEU 20 HB2 LEU 20 8.803 7.270 2.102 182 2HB LEU 20 HB1 LEU 20 9.103 8.930 1.634 183 HG LEU 20 HG LEU 20 11.148 7.028 2.775 184 1HD1 LEU 20 HD1 LEU 20 10.767 8.101 -0.011 185 2HD1 LEU 20 HD1 LEU 20 12.118 7.108 0.534 186 3HD1 LEU 20 HD1 LEU 20 10.486 6.442 0.518 187 1HD2 LEU 20 HD2 LEU 20 11.425 9.855 1.752 188 2HD2 LEU 20 HD2 LEU 20 11.646 9.318 3.417 189 3HD2 LEU 20 HD2 LEU 20 12.763 8.783 2.161 190 H VAL 21 HN VAL 21 6.853 7.202 3.651 191 HA VAL 21 HA VAL 21 4.890 9.064 3.097 192 HB VAL 21 HB VAL 21 4.705 6.556 4.800 193 1HG1 VAL 21 2HG1 VAL 21 2.753 8.035 5.093 194 2HG1 VAL 21 1HG1 VAL 21 2.505 8.017 3.354 195 3HG1 VAL 21 3HG1 VAL 21 2.338 6.524 4.275 196 1HG2 VAL 21 3HG2 VAL 21 4.249 7.012 1.871 197 2HG2 VAL 21 2HG2 VAL 21 5.589 6.148 2.641 198 3HG2 VAL 21 1HG2 VAL 21 3.948 5.507 2.755 199 H ALA 22 HN ALA 22 6.175 8.059 6.213 200 HA ALA 22 HA ALA 22 4.468 9.392 7.922 201 1HB ALA 22 HB1 ALA 22 7.395 8.844 8.310 202 2HB ALA 22 HB3 ALA 22 6.194 9.094 9.594 203 3HB ALA 22 HB2 ALA 22 6.092 7.686 8.527 204 H ARG 23 HN ARG 23 7.606 10.525 6.641 205 HA ARG 23 HA ARG 23 7.467 13.027 7.944 206 1HB ARG 23 HB2 ARG 23 9.356 13.729 6.526 207 2HB ARG 23 HB1 ARG 23 9.632 12.200 7.338 208 1HG ARG 23 HG2 ARG 23 9.191 11.003 5.290 209 2HG ARG 23 HG1 ARG 23 8.796 12.511 4.467 210 1HD ARG 23 HD2 ARG 23 11.473 11.903 5.715 211 2HD ARG 23 HD1 ARG 23 11.102 11.679 4.006 212 HE ARG 23 HE ARG 23 10.434 14.288 4.582 213 1HH1 ARG 23 1HH1 ARG 23 13.411 12.371 4.771 214 2HH1 ARG 23 2HH1 ARG 23 14.435 13.683 4.401 215 1HH2 ARG 23 1HH2 ARG 23 11.850 16.084 4.102 216 2HH2 ARG 23 2HH2 ARG 23 13.530 15.832 4.021 217 H HIS 24 HN HIS 24 5.964 11.935 5.109 218 HA HIS 24 HA HIS 24 5.742 14.324 3.684 219 1HB HIS 24 HB2 HIS 24 5.189 12.183 2.708 220 2HB HIS 24 HB1 HIS 24 3.843 11.925 3.774 221 HD1 HIS 24 HD1 HIS 24 4.701 13.250 0.451 222 HD2 HIS 24 HD2 HIS 24 1.722 13.921 3.241 223 HE1 HIS 24 HE1 HIS 24 2.863 14.422 -0.784 224 H GLY 25 HN GLY 25 4.030 13.191 6.494 225 1HA GLY 25 HA1 GLY 25 2.127 15.414 6.289 226 2HA GLY 25 HA2 GLY 25 3.285 15.474 7.611 227 H LEU 26 HN LEU 26 2.838 12.297 7.411 228 HA LEU 26 HA LEU 26 0.340 12.033 8.578 229 1HB LEU 26 HB2 LEU 26 2.689 10.303 8.122 230 2HB LEU 26 HB1 LEU 26 1.390 9.755 9.155 231 HG LEU 26 HG LEU 26 -0.155 10.189 7.281 232 1HD1 LEU 26 HD1 LEU 26 1.070 11.686 5.942 233 2HD1 LEU 26 HD1 LEU 26 2.307 10.464 5.613 234 3HD1 LEU 26 HD1 LEU 26 0.655 10.246 5.013 235 1HD2 LEU 26 HD2 LEU 26 1.992 8.149 7.003 236 2HD2 LEU 26 HD2 LEU 26 0.421 7.970 7.802 237 3HD2 LEU 26 HD2 LEU 26 0.534 8.136 6.032 238 H ASP 27 HN ASP 27 -0.165 11.467 10.549 239 HA ASP 27 HA ASP 27 1.380 12.557 12.756 240 1HB ASP 27 HB2 ASP 27 -1.272 11.083 12.826 241 2HB ASP 27 HB1 ASP 27 -0.616 12.152 14.052 242 H HIS 28 HN HIS 28 1.435 11.044 14.756 243 HA HIS 28 HA HIS 28 2.918 8.763 14.171 244 1HB HIS 28 HB2 HIS 28 2.653 8.097 16.541 245 2HB HIS 28 HB1 HIS 28 3.143 9.784 16.345 246 HD1 HIS 28 HD1 HIS 28 1.457 11.563 17.276 247 HD2 HIS 28 HD2 HIS 28 0.197 7.628 17.699 248 HE1 HIS 28 HE1 HIS 28 -0.496 11.608 18.870 249 H ASP 29 HN ASP 29 -0.440 8.932 15.110 250 HA ASP 29 HA ASP 29 -1.002 6.173 15.018 251 1HB ASP 29 HB2 ASP 29 -3.371 6.797 14.969 252 2HB ASP 29 HB1 ASP 29 -2.502 7.757 16.156 253 H LYS 30 HN LYS 30 -1.136 8.660 12.619 254 HA LYS 30 HA LYS 30 -2.322 7.251 10.508 255 1HB LYS 30 HB2 LYS 30 -0.237 9.414 10.455 256 2HB LYS 30 HB1 LYS 30 -1.072 8.824 9.031 257 1HG LYS 30 HG2 LYS 30 -2.518 9.965 11.391 258 2HG LYS 30 HG1 LYS 30 -1.900 10.957 10.074 259 1HD LYS 30 HD2 LYS 30 -3.260 9.687 8.490 260 2HD LYS 30 HD1 LYS 30 -3.879 8.703 9.817 261 1HE LYS 30 HE2 LYS 30 -5.404 10.516 9.139 262 2HE LYS 30 HE1 LYS 30 -4.906 10.616 10.834 263 1HZ LYS 30 HZ2 LYS 30 -3.778 12.263 8.602 264 2HZ LYS 30 HZ1 LYS 30 -4.879 12.779 9.771 265 3HZ LYS 30 HZ3 LYS 30 -3.324 12.350 10.225 266 H VAL 31 HN VAL 31 1.132 7.575 11.422 267 HA VAL 31 HA VAL 31 2.195 6.027 9.363 268 HB VAL 31 HB VAL 31 3.282 6.426 12.180 269 1HG1 VAL 31 3HG1 VAL 31 4.390 4.591 11.044 270 2HG1 VAL 31 2HG1 VAL 31 4.720 5.634 9.663 271 3HG1 VAL 31 1HG1 VAL 31 5.474 5.974 11.221 272 1HG2 VAL 31 1HG2 VAL 31 2.857 8.552 11.072 273 2HG2 VAL 31 3HG2 VAL 31 4.588 8.255 11.234 274 3HG2 VAL 31 2HG2 VAL 31 3.790 8.017 9.678 275 H LEU 32 HN LEU 32 1.069 5.218 12.597 276 HA LEU 32 HA LEU 32 1.768 2.465 12.593 277 1HB LEU 32 HB2 LEU 32 -0.481 3.819 14.063 278 2HB LEU 32 HB1 LEU 32 0.198 2.248 14.432 279 HG LEU 32 HG LEU 32 1.576 4.909 14.709 280 1HD1 LEU 32 HD1 LEU 32 0.662 2.910 16.748 281 2HD1 LEU 32 HD1 LEU 32 1.591 4.373 17.081 282 3HD1 LEU 32 HD1 LEU 32 -0.046 4.496 16.424 283 1HD2 LEU 32 HD2 LEU 32 2.643 2.130 15.237 284 2HD2 LEU 32 HD2 LEU 32 3.192 3.255 13.992 285 3HD2 LEU 32 HD2 LEU 32 3.439 3.638 15.692 286 H LEU 33 HN LEU 33 -1.305 4.050 11.840 287 HA LEU 33 HA LEU 33 -2.662 1.686 11.159 288 1HB LEU 33 HB2 LEU 33 -3.148 4.515 10.248 289 2HB LEU 33 HB1 LEU 33 -4.262 3.183 10.008 290 HG LEU 33 HG LEU 33 -3.401 4.250 12.697 291 1HD1 LEU 33 HD1 LEU 33 -4.747 5.854 11.491 292 2HD1 LEU 33 HD1 LEU 33 -5.980 4.624 11.191 293 3HD1 LEU 33 HD1 LEU 33 -5.635 5.153 12.841 294 1HD2 LEU 33 HD2 LEU 33 -5.503 2.223 11.935 295 2HD2 LEU 33 HD2 LEU 33 -3.991 1.886 12.783 296 3HD2 LEU 33 HD2 LEU 33 -5.239 2.869 13.554 297 H PHE 34 HN PHE 34 -0.851 3.999 9.197 298 HA PHE 34 HA PHE 34 -1.372 2.822 6.719 299 1HB PHE 34 HB2 PHE 34 -0.425 5.047 6.843 300 2HB PHE 34 HB1 PHE 34 1.010 4.433 7.654 301 HD1 PHE 34 HD1 PHE 34 2.872 3.769 6.423 302 HD2 PHE 34 HD2 PHE 34 -0.875 4.245 4.466 303 HE1 PHE 34 HE1 PHE 34 3.965 3.433 4.233 304 HE2 PHE 34 HE2 PHE 34 0.220 3.910 2.290 305 HZ PHE 34 HZ PHE 34 2.661 3.504 2.202 306 H SER 35 HN SER 35 1.412 2.396 8.888 307 HA SER 35 HA SER 35 2.767 0.601 7.255 308 1HB SER 35 HB2 SER 35 4.022 -0.006 9.362 309 2HB SER 35 HB1 SER 35 3.977 1.708 8.950 310 HG SER 35 HG SER 35 2.538 2.081 10.507 311 H ARG 36 HN ARG 36 0.409 -0.066 9.801 312 HA ARG 36 HA ARG 36 0.846 -2.873 9.580 313 1HB ARG 36 HB2 ARG 36 -1.029 -3.171 11.097 314 2HB ARG 36 HB1 ARG 36 0.082 -1.947 11.684 315 1HG ARG 36 HG2 ARG 36 -1.490 -0.225 10.809 316 2HG ARG 36 HG1 ARG 36 -2.624 -1.530 10.451 317 1HD ARG 36 HD2 ARG 36 -1.475 -0.810 13.137 318 2HD ARG 36 HD1 ARG 36 -3.133 -0.546 12.603 319 HE ARG 36 HE ARG 36 -2.750 -3.218 12.276 320 1HH1 ARG 36 1HH1 ARG 36 -2.460 -1.045 15.046 321 2HH1 ARG 36 2HH1 ARG 36 -2.892 -2.190 16.216 322 1HH2 ARG 36 1HH2 ARG 36 -3.357 -4.860 13.903 323 2HH2 ARG 36 2HH2 ARG 36 -3.447 -4.394 15.545 324 H ASP 37 HN ASP 37 -1.457 -0.660 8.092 325 HA ASP 37 HA ASP 37 -3.001 -2.811 6.974 326 1HB ASP 37 HB2 ASP 37 -3.870 -0.434 7.343 327 2HB ASP 37 HB1 ASP 37 -2.898 0.040 5.963 328 H LEU 38 HN LEU 38 -0.316 -0.859 6.050 329 HA LEU 38 HA LEU 38 0.046 -1.699 3.398 330 1HB LEU 38 HB2 LEU 38 1.195 0.217 4.216 331 2HB LEU 38 HB1 LEU 38 1.907 -0.687 5.526 332 HG LEU 38 HG LEU 38 3.368 -1.854 3.943 333 1HD1 LEU 38 HD1 LEU 38 2.101 -0.087 1.873 334 2HD1 LEU 38 HD1 LEU 38 3.515 -1.121 1.653 335 3HD1 LEU 38 HD1 LEU 38 1.942 -1.845 1.997 336 1HD2 LEU 38 HD2 LEU 38 3.377 1.136 3.722 337 2HD2 LEU 38 HD2 LEU 38 4.148 0.169 4.973 338 3HD2 LEU 38 HD2 LEU 38 4.730 0.088 3.308 339 H ASP 39 HN ASP 39 1.351 -2.918 6.460 340 HA ASP 39 HA ASP 39 2.903 -4.995 5.400 341 1HB ASP 39 HB2 ASP 39 2.915 -4.112 7.786 342 2HB ASP 39 HB1 ASP 39 1.460 -5.064 8.056 343 H LYS 40 HN LYS 40 -0.463 -4.868 6.467 344 HA LYS 40 HA LYS 40 -1.218 -7.474 6.053 345 1HB LYS 40 HB2 LYS 40 -2.534 -6.269 7.340 346 2HB LYS 40 HB1 LYS 40 -2.393 -4.804 6.400 347 1HG LYS 40 HG2 LYS 40 -3.907 -5.628 4.790 348 2HG LYS 40 HG1 LYS 40 -4.047 -7.182 5.637 349 1HD LYS 40 HD2 LYS 40 -5.123 -6.156 7.506 350 2HD LYS 40 HD1 LYS 40 -4.689 -4.541 6.955 351 1HE LYS 40 HE2 LYS 40 -6.597 -6.383 5.516 352 2HE LYS 40 HE1 LYS 40 -7.089 -5.114 6.643 353 1HZ LYS 40 HZ3 LYS 40 -5.920 -3.510 5.174 354 2HZ LYS 40 HZ2 LYS 40 -5.685 -4.728 4.047 355 3HZ LYS 40 HZ1 LYS 40 -7.238 -4.241 4.419 356 H LEU 41 HN LEU 41 -1.320 -4.652 3.900 357 HA LEU 41 HA LEU 41 -2.568 -5.804 1.674 358 1HB LEU 41 HB2 LEU 41 -2.107 -3.364 2.067 359 2HB LEU 41 HB1 LEU 41 -0.421 -3.669 1.753 360 HG LEU 41 HG LEU 41 -2.613 -3.975 -0.339 361 1HD1 LEU 41 HD1 LEU 41 -2.420 -1.691 0.375 362 2HD1 LEU 41 HD1 LEU 41 -0.662 -1.783 0.100 363 3HD1 LEU 41 HD1 LEU 41 -1.771 -1.987 -1.257 364 1HD2 LEU 41 HD2 LEU 41 -0.602 -5.275 -0.816 365 2HD2 LEU 41 HD2 LEU 41 -0.834 -3.938 -1.938 366 3HD2 LEU 41 HD2 LEU 41 0.358 -3.801 -0.646 367 H ILE 42 HN ILE 42 0.692 -5.696 2.752 368 HA ILE 42 HA ILE 42 1.708 -6.916 0.362 369 HB ILE 42 HB ILE 42 3.072 -6.299 2.994 370 1HG1 ILE 42 2HG1 ILE 42 3.330 -5.114 0.241 371 2HG1 ILE 42 1HG1 ILE 42 2.343 -4.435 1.533 372 1HG2 ILE 42 3HG2 ILE 42 4.296 -7.387 0.448 373 2HG2 ILE 42 2HG2 ILE 42 5.196 -6.826 1.859 374 3HG2 ILE 42 1HG2 ILE 42 4.159 -8.252 1.978 375 1HD1 ILE 42 HD1 ILE 42 5.319 -4.795 1.577 376 2HD1 ILE 42 HD1 ILE 42 4.438 -3.285 1.273 377 3HD1 ILE 42 HD1 ILE 42 4.291 -4.076 2.831 378 H ASN 43 HN ASN 43 1.100 -8.032 3.624 379 HA ASN 43 HA ASN 43 1.830 -10.707 3.292 380 1HB ASN 43 HB2 ASN 43 -0.337 -9.495 5.030 381 2HB ASN 43 HB1 ASN 43 0.124 -11.188 5.114 382 1HD2 ASN 43 HD2 ASN 43 0.318 -9.073 7.177 383 2HD2 ASN 43 HD2 ASN 43 1.982 -8.941 7.577 384 H LYS 44 HN LYS 44 -0.952 -8.997 2.234 385 HA LYS 44 HA LYS 44 -2.689 -11.080 1.497 386 1HB LYS 44 HB2 LYS 44 -3.348 -8.718 1.617 387 2HB LYS 44 HB1 LYS 44 -2.267 -8.329 0.301 388 1HG LYS 44 HG2 LYS 44 -3.705 -9.916 -1.108 389 2HG LYS 44 HG1 LYS 44 -4.873 -9.814 0.206 390 1HD LYS 44 HD2 LYS 44 -3.793 -7.486 -1.419 391 2HD LYS 44 HD1 LYS 44 -5.396 -8.189 -1.564 392 1HE LYS 44 HE2 LYS 44 -5.896 -7.465 0.740 393 2HE LYS 44 HE1 LYS 44 -4.294 -6.743 0.854 394 1HZ LYS 44 HZ1 LYS 44 -6.347 -5.921 -1.151 395 2HZ LYS 44 HZ3 LYS 44 -6.124 -5.146 0.300 396 3HZ LYS 44 HZ2 LYS 44 -4.917 -5.096 -0.852 397 H PHE 45 HN PHE 45 -0.199 -9.356 -0.343 398 HA PHE 45 HA PHE 45 -0.637 -11.044 -2.617 399 1HB PHE 45 HB2 PHE 45 1.137 -8.688 -2.140 400 2HB PHE 45 HB1 PHE 45 1.281 -9.672 -3.593 401 HD1 PHE 45 HD1 PHE 45 -0.880 -7.350 -1.738 402 HD2 PHE 45 HD2 PHE 45 -0.409 -9.665 -5.278 403 HE1 PHE 45 HE1 PHE 45 -2.747 -6.137 -2.769 404 HE2 PHE 45 HE2 PHE 45 -2.284 -8.469 -6.310 405 HZ PHE 45 HZ PHE 45 -3.458 -6.694 -5.056 406 H MET 46 HN MET 46 1.640 -10.829 -0.075 407 HA MET 46 HA MET 46 3.719 -12.529 -1.173 408 1HB MET 46 HB2 MET 46 2.934 -11.823 1.650 409 2HB MET 46 HB1 MET 46 4.363 -12.769 1.251 410 1HG MET 46 HG2 MET 46 3.860 -9.973 0.261 411 2HG MET 46 HG1 MET 46 4.714 -10.339 1.757 412 1HE MET 46 HE2 MET 46 7.024 -11.312 1.946 413 2HE MET 46 HE1 MET 46 6.460 -12.798 1.182 414 3HE MET 46 HE3 MET 46 7.938 -12.022 0.614 415 H ASN 47 HN ASN 47 0.675 -12.959 0.249 416 HA ASN 47 HA ASN 47 -0.650 -14.627 0.826 417 1HB ASN 47 HB2 ASN 47 0.071 -15.707 -1.379 418 2HB ASN 47 HB1 ASN 47 1.278 -16.599 -0.464 419 1HD2 ASN 47 HD2 ASN 47 -0.875 -17.660 -2.018 420 2HD2 ASN 47 HD2 ASN 47 -1.894 -18.572 -0.947 421 H VAL 48 HN VAL 48 0.242 -13.791 2.749 422 HA VAL 48 HA VAL 48 1.655 -15.839 4.346 423 HB VAL 48 HB VAL 48 1.208 -12.937 4.950 424 1HG1 VAL 48 1HG1 VAL 48 1.418 -14.368 6.936 425 2HG1 VAL 48 3HG1 VAL 48 2.965 -14.974 6.332 426 3HG1 VAL 48 2HG1 VAL 48 2.798 -13.283 6.788 427 1HG2 VAL 48 1HG2 VAL 48 2.762 -13.178 3.091 428 2HG2 VAL 48 3HG2 VAL 48 3.589 -12.577 4.526 429 3HG2 VAL 48 2HG2 VAL 48 3.755 -14.270 4.053 430 H LYS 49 HN LYS 49 0.322 -17.031 5.145 431 HA LYS 49 HA LYS 49 -2.172 -15.964 6.090 432 1HB LYS 49 HB2 LYS 49 -1.137 -18.808 6.168 433 2HB LYS 49 HB1 LYS 49 -2.782 -18.285 6.517 434 1HG LYS 49 HG2 LYS 49 -2.946 -17.418 4.205 435 2HG LYS 49 HG1 LYS 49 -1.370 -18.110 3.869 436 1HD LYS 49 HD2 LYS 49 -3.086 -19.600 3.062 437 2HD LYS 49 HD1 LYS 49 -2.294 -20.347 4.453 438 1HE LYS 49 HE2 LYS 49 -4.106 -19.743 5.886 439 2HE LYS 49 HE1 LYS 49 -4.855 -18.779 4.617 440 1HZ LYS 49 HZ1 LYS 49 -5.177 -20.820 3.356 441 2HZ LYS 49 HZ3 LYS 49 -4.521 -21.730 4.628 442 3HZ LYS 49 HZ2 LYS 49 -5.957 -20.851 4.849 443 H ASP 50 HN ASP 50 -2.110 -15.060 7.877 444 HA ASP 50 HA ASP 50 -0.068 -14.753 9.595 445 1HB ASP 50 HB2 ASP 50 -1.958 -13.308 9.744 446 2HB ASP 50 HB1 ASP 50 -2.966 -14.622 10.360 447 H LYS 51 HN LYS 51 0.877 -15.617 11.210 448 HA LYS 51 HA LYS 51 -0.293 -17.979 12.439 449 1HB LYS 51 HB2 LYS 51 1.998 -18.883 12.678 450 2HB LYS 51 HB1 LYS 51 1.473 -18.711 11.006 451 1HG LYS 51 HG2 LYS 51 2.806 -16.732 10.731 452 2HG LYS 51 HG1 LYS 51 3.224 -16.728 12.443 453 1HD LYS 51 HD2 LYS 51 5.052 -17.594 11.100 454 2HD LYS 51 HD1 LYS 51 4.407 -18.849 12.156 455 1HE LYS 51 HE2 LYS 51 3.154 -19.785 10.276 456 2HE LYS 51 HE1 LYS 51 3.765 -18.506 9.232 457 1HZ LYS 51 HZ3 LYS 51 5.999 -19.332 9.624 458 2HZ LYS 51 HZ2 LYS 51 5.381 -20.576 10.594 459 3HZ LYS 51 HZ1 LYS 51 5.010 -20.521 8.949 460 H VAL 52 HN VAL 52 -0.058 -14.998 13.189 461 HA VAL 52 HA VAL 52 1.282 -15.461 15.731 462 HB VAL 52 HB VAL 52 1.311 -13.148 16.214 463 1HG1 VAL 52 1HG1 VAL 52 2.167 -13.564 13.380 464 2HG1 VAL 52 3HG1 VAL 52 2.648 -12.193 14.380 465 3HG1 VAL 52 2HG1 VAL 52 3.113 -13.829 14.847 466 1HG2 VAL 52 3HG2 VAL 52 -0.854 -12.415 15.391 467 2HG2 VAL 52 2HG2 VAL 52 0.414 -11.375 14.737 468 3HG2 VAL 52 1HG2 VAL 52 -0.313 -12.621 13.726 469 H HIS 53 HN HIS 53 -1.815 -14.742 14.387 470 HA HIS 53 HA HIS 53 -2.865 -15.688 16.909 471 1HB HIS 53 HB2 HIS 53 -4.821 -14.150 16.848 472 2HB HIS 53 HB1 HIS 53 -3.304 -13.311 17.058 473 HD1 HIS 53 HD1 HIS 53 -3.150 -13.531 13.556 474 HD2 HIS 53 HD2 HIS 53 -5.776 -11.589 16.143 475 HE1 HIS 53 HE1 HIS 53 -4.200 -11.718 12.243 476 H LYS 54 HN LYS 54 -2.405 -16.417 13.971 477 HA LYS 54 HA LYS 54 -3.052 -18.124 12.648 478 1HB LYS 54 HB2 LYS 54 -4.671 -18.920 15.066 479 2HB LYS 54 HB1 LYS 54 -4.448 -19.936 13.654 480 1HG LYS 54 HG2 LYS 54 -2.234 -18.884 15.360 481 2HG LYS 54 HG1 LYS 54 -2.960 -20.486 15.578 482 1HD LYS 54 HD2 LYS 54 -2.280 -21.023 13.237 483 2HD LYS 54 HD1 LYS 54 -1.480 -19.458 13.138 484 1HE LYS 54 HE2 LYS 54 0.151 -21.175 13.638 485 2HE LYS 54 HE1 LYS 54 -0.027 -20.108 15.025 486 1HZ LYS 54 HZ2 LYS 54 -1.474 -21.794 16.055 487 2HZ LYS 54 HZ1 LYS 54 -1.284 -22.786 14.725 488 3HZ LYS 54 HZ3 LYS 54 0.038 -22.436 15.691 489 H LEU 55 HN LEU 55 -4.432 -15.770 12.412 490 HA LEU 55 HA LEU 55 -7.075 -16.734 11.540 491 1HB LEU 55 HB2 LEU 55 -6.138 -13.881 11.870 492 2HB LEU 55 HB1 LEU 55 -7.709 -14.346 11.248 493 HG LEU 55 HG LEU 55 -6.683 -14.767 14.058 494 1HD1 LEU 55 HD1 LEU 55 -8.917 -13.076 12.964 495 2HD1 LEU 55 HD1 LEU 55 -8.520 -13.278 14.670 496 3HD1 LEU 55 HD1 LEU 55 -7.373 -12.494 13.585 497 1HD2 LEU 55 HD2 LEU 55 -9.310 -15.621 12.832 498 2HD2 LEU 55 HD2 LEU 55 -8.037 -16.695 13.415 499 3HD2 LEU 55 HD2 LEU 55 -8.919 -15.677 14.547 500 H GLU 56 HN GLU 56 -7.482 -17.043 9.501 501 HA GLU 56 HA GLU 56 -5.362 -16.742 7.601 502 1HB GLU 56 HB2 GLU 56 -8.230 -17.626 7.227 503 2HB GLU 56 HB1 GLU 56 -6.988 -17.697 5.992 504 1HG GLU 56 HG2 GLU 56 -5.719 -19.274 7.348 505 2HG GLU 56 HG1 GLU 56 -6.959 -19.194 8.597 506 H HIS 57 HN HIS 57 -8.682 -15.548 7.743 507 HA HIS 57 HA HIS 57 -7.857 -13.338 5.979 508 1HB HIS 57 HB2 HIS 57 -9.718 -14.932 5.181 509 2HB HIS 57 HB1 HIS 57 -10.638 -14.252 6.538 510 HD1 HIS 57 HD1 HIS 57 -12.165 -12.395 5.847 511 HD2 HIS 57 HD2 HIS 57 -8.766 -12.623 3.470 512 HE1 HIS 57 HE1 HIS 57 -12.360 -10.534 4.169 513 H HIS 58 HN HIS 58 -8.462 -11.259 6.567 514 HA HIS 58 HA HIS 58 -9.250 -11.044 9.352 515 1HB HIS 58 HB2 HIS 58 -7.849 -9.014 7.579 516 2HB HIS 58 HB1 HIS 58 -8.275 -8.746 9.258 517 HD1 HIS 58 HD1 HIS 58 -6.339 -9.093 10.818 518 HD2 HIS 58 HD2 HIS 58 -5.942 -11.293 7.316 519 HE1 HIS 58 HE1 HIS 58 -4.052 -10.139 10.905 520 H HIS 59 HN HIS 59 -11.431 -10.679 9.452 521 HA HIS 59 HA HIS 59 -12.797 -9.432 7.269 522 1HB HIS 59 HB2 HIS 59 -14.867 -9.690 8.572 523 2HB HIS 59 HB1 HIS 59 -13.959 -11.182 8.620 524 HD1 HIS 59 HD1 HIS 59 -13.030 -11.914 11.000 525 HD2 HIS 59 HD2 HIS 59 -15.240 -8.391 10.999 526 HE1 HIS 59 HE1 HIS 59 -13.573 -11.420 13.409 527 H HIS 60 HN HIS 60 -13.027 -7.366 6.920 528 HA HIS 60 HA HIS 60 -13.063 -5.116 7.152 529 1HB HIS 60 HB2 HIS 60 -13.848 -5.762 10.016 530 2HB HIS 60 HB1 HIS 60 -13.879 -4.145 9.332 531 HD1 HIS 60 HD1 HIS 60 -16.125 -3.466 8.466 532 HD2 HIS 60 HD2 HIS 60 -15.661 -7.593 8.527 533 HE1 HIS 60 HE1 HIS 60 -18.350 -4.435 7.746 534 H HIS 61 HN HIS 61 -12.156 -3.287 8.864 535 HA HIS 61 HA HIS 61 -9.683 -4.149 10.045 536 1HB HIS 61 HB2 HIS 61 -9.138 -3.608 7.630 537 2HB HIS 61 HB1 HIS 61 -9.731 -1.980 7.922 538 HD1 HIS 61 HD1 HIS 61 -7.820 -0.405 8.258 539 HD2 HIS 61 HD2 HIS 61 -6.991 -4.197 9.717 540 HE1 HIS 61 HE1 HIS 61 -5.485 -0.299 9.179 541 H HIS 62 HN HIS 62 -9.523 -3.063 11.932 542 HA HIS 62 HA HIS 62 -11.245 -0.704 12.215 543 1HB HIS 62 HB2 HIS 62 -10.557 -2.621 14.460 544 2HB HIS 62 HB1 HIS 62 -11.806 -1.392 14.433 545 HD1 HIS 62 HD1 HIS 62 -14.041 -2.036 13.027 546 HD2 HIS 62 HD2 HIS 62 -11.245 -5.069 13.516 547 HE1 HIS 62 HE1 HIS 62 -15.200 -4.180 12.399 548 H1 MET 101 HT3 MET 101 8.305 23.144 -3.503 549 H2 MET 101 HT2 MET 101 6.974 24.196 -3.569 550 H3 MET 101 HT1 MET 101 7.203 23.184 -2.248 551 HA MET 101 HA MET 101 5.528 22.157 -3.537 552 1HB MET 101 HB2 MET 101 7.440 22.426 -5.887 553 2HB MET 101 HB1 MET 101 5.890 21.616 -5.932 554 1HG MET 101 HG2 MET 101 5.649 23.734 -6.970 555 2HG MET 101 HG1 MET 101 4.802 23.809 -5.428 556 1HE MET 101 HE2 MET 101 7.875 24.950 -7.533 557 2HE MET 101 HE1 MET 101 8.840 25.856 -6.363 558 3HE MET 101 HE3 MET 101 8.703 24.105 -6.228 559 H GLU 102 HN GLU 102 7.968 21.498 -1.964 560 HA GLU 102 HA GLU 102 9.241 19.386 -3.343 561 1HB GLU 102 HB2 GLU 102 9.515 20.361 -0.530 562 2HB GLU 102 HB1 GLU 102 10.488 19.079 -1.231 563 1HG GLU 102 HG2 GLU 102 11.751 21.134 -1.242 564 2HG GLU 102 HG1 GLU 102 11.365 20.691 -2.903 565 H MET 103 HN MET 103 6.472 19.531 -1.644 566 HA MET 103 HA MET 103 6.472 16.972 -0.403 567 1HB MET 103 HB2 MET 103 4.038 18.445 -1.469 568 2HB MET 103 HB1 MET 103 4.021 17.076 -0.373 569 1HG MET 103 HG2 MET 103 3.612 18.997 0.942 570 2HG MET 103 HG1 MET 103 5.271 18.505 1.275 571 1HE MET 103 HE3 MET 103 2.912 21.129 -0.397 572 2HE MET 103 HE2 MET 103 4.035 22.165 -1.272 573 3HE MET 103 HE1 MET 103 3.751 20.514 -1.820 574 H GLY 104 HN GLY 104 5.964 18.075 -3.627 575 1HA GLY 104 HA1 GLY 104 5.501 16.950 -5.599 576 2HA GLY 104 HA2 GLY 104 4.859 15.627 -4.632 577 H GLN 105 HN GLN 105 8.046 17.048 -4.402 578 HA GLN 105 HA GLN 105 9.422 15.012 -5.828 579 1HB GLN 105 HB2 GLN 105 10.502 16.870 -3.689 580 2HB GLN 105 HB1 GLN 105 11.460 15.911 -4.811 581 1HG GLN 105 HG2 GLN 105 9.565 18.104 -5.631 582 2HG GLN 105 HG1 GLN 105 11.299 18.298 -5.418 583 1HE2 GLN 105 1HE2 GLN 105 11.501 18.925 -7.569 584 2HE2 GLN 105 2HE2 GLN 105 11.420 17.792 -8.869 585 H LEU 106 HN LEU 106 8.796 15.622 -2.425 586 HA LEU 106 HA LEU 106 10.011 13.367 -1.341 587 1HB LEU 106 HB2 LEU 106 9.222 15.278 -0.006 588 2HB LEU 106 HB1 LEU 106 7.573 14.922 -0.436 589 HG LEU 106 HG LEU 106 8.287 14.362 1.935 590 1HD1 LEU 106 HD1 LEU 106 7.025 12.229 0.258 591 2HD1 LEU 106 HD1 LEU 106 7.070 12.203 2.015 592 3HD1 LEU 106 HD1 LEU 106 6.230 13.494 1.176 593 1HD2 LEU 106 HD2 LEU 106 9.703 12.091 0.553 594 2HD2 LEU 106 HD2 LEU 106 10.468 13.399 1.461 595 3HD2 LEU 106 HD2 LEU 106 9.436 12.229 2.289 596 H LYS 107 HN LYS 107 6.761 13.852 -2.591 597 HA LYS 107 HA LYS 107 5.836 11.245 -2.075 598 1HB LYS 107 HB2 LYS 107 4.717 13.590 -2.987 599 2HB LYS 107 HB1 LYS 107 4.639 12.560 -4.405 600 1HG LYS 107 HG2 LYS 107 3.604 11.737 -1.709 601 2HG LYS 107 HG1 LYS 107 2.614 12.560 -2.898 602 1HD LYS 107 HD2 LYS 107 4.007 9.909 -3.372 603 2HD LYS 107 HD1 LYS 107 2.329 10.061 -2.836 604 1HE LYS 107 HE2 LYS 107 1.957 11.450 -4.916 605 2HE LYS 107 HE1 LYS 107 3.558 10.935 -5.440 606 1HZ LYS 107 HZ1 LYS 107 1.294 9.121 -4.811 607 2HZ LYS 107 HZ3 LYS 107 1.784 9.543 -6.352 608 3HZ LYS 107 HZ2 LYS 107 2.781 8.605 -5.362 609 H ASN 108 HN ASN 108 7.732 12.608 -4.675 610 HA ASN 108 HA ASN 108 7.413 10.368 -6.427 611 1HB ASN 108 HB2 ASN 108 8.177 12.645 -7.218 612 2HB ASN 108 HB1 ASN 108 9.717 12.335 -6.412 613 1HD2 ASN 108 HD2 ASN 108 10.947 12.281 -8.244 614 2HD2 ASN 108 HD2 ASN 108 10.822 11.042 -9.439 615 H LYS 109 HN LYS 109 9.645 11.304 -3.906 616 HA LYS 109 HA LYS 109 11.468 9.154 -4.215 617 1HB LYS 109 HB2 LYS 109 10.712 10.432 -1.570 618 2HB LYS 109 HB1 LYS 109 12.195 9.578 -1.960 619 1HG LYS 109 HG2 LYS 109 11.329 12.279 -2.999 620 2HG LYS 109 HG1 LYS 109 12.600 11.967 -1.828 621 1HD LYS 109 HD2 LYS 109 12.616 11.062 -4.713 622 2HD LYS 109 HD1 LYS 109 13.456 12.475 -4.092 623 1HE LYS 109 HE2 LYS 109 14.764 11.003 -2.604 624 2HE LYS 109 HE1 LYS 109 13.949 9.605 -3.305 625 1HZ LYS 109 HZ1 LYS 109 14.866 10.287 -5.481 626 2HZ LYS 109 HZ3 LYS 109 15.731 11.514 -4.698 627 3HZ LYS 109 HZ2 LYS 109 16.035 9.885 -4.349 628 H ILE 110 HN ILE 110 8.495 9.614 -2.448 629 HA ILE 110 HA ILE 110 8.228 7.101 -1.260 630 HB ILE 110 HB ILE 110 6.169 9.101 -2.211 631 1HG1 ILE 110 2HG1 ILE 110 7.150 8.348 0.543 632 2HG1 ILE 110 1HG1 ILE 110 7.566 9.806 -0.347 633 1HG2 ILE 110 2HG2 ILE 110 5.093 6.920 -2.278 634 2HG2 ILE 110 1HG2 ILE 110 5.601 6.610 -0.617 635 3HG2 ILE 110 3HG2 ILE 110 4.447 7.900 -0.960 636 1HD1 ILE 110 HD1 ILE 110 5.227 10.526 -0.225 637 2HD1 ILE 110 HD1 ILE 110 4.839 9.065 0.682 638 3HD1 ILE 110 HD1 ILE 110 5.939 10.267 1.365 639 H GLU 111 HN GLU 111 7.001 8.274 -4.392 640 HA GLU 111 HA GLU 111 5.895 5.968 -5.444 641 1HB GLU 111 HB2 GLU 111 7.531 8.081 -6.849 642 2HB GLU 111 HB1 GLU 111 6.585 6.852 -7.672 643 1HG GLU 111 HG2 GLU 111 5.443 8.856 -5.764 644 2HG GLU 111 HG1 GLU 111 5.481 9.083 -7.504 645 H ASN 112 HN ASN 112 9.188 7.095 -5.800 646 HA ASN 112 HA ASN 112 10.252 4.913 -7.121 647 1HB ASN 112 HB2 ASN 112 11.560 6.849 -7.108 648 2HB ASN 112 HB1 ASN 112 11.454 7.018 -5.361 649 1HD2 ASN 112 HD2 ASN 112 12.876 5.972 -4.094 650 2HD2 ASN 112 HD2 ASN 112 14.230 5.090 -4.685 651 H LYS 113 HN LYS 113 10.117 5.497 -3.614 652 HA LYS 113 HA LYS 113 11.570 3.170 -2.930 653 1HB LYS 113 HB2 LYS 113 11.131 5.261 -1.513 654 2HB LYS 113 HB1 LYS 113 9.559 4.566 -1.182 655 1HG LYS 113 HG2 LYS 113 11.080 4.080 0.649 656 2HG LYS 113 HG1 LYS 113 10.626 2.599 -0.190 657 1HD LYS 113 HD2 LYS 113 13.020 2.660 0.357 658 2HD LYS 113 HD1 LYS 113 12.747 2.582 -1.377 659 1HE LYS 113 HE2 LYS 113 13.159 4.937 -1.580 660 2HE LYS 113 HE1 LYS 113 13.371 5.103 0.176 661 1HZ LYS 113 HZ2 LYS 113 15.023 3.516 -1.696 662 2HZ LYS 113 HZ1 LYS 113 15.482 4.984 -0.987 663 3HZ LYS 113 HZ3 LYS 113 15.271 3.619 -0.003 664 H LYS 114 HN LYS 114 8.162 3.917 -3.212 665 HA LYS 114 HA LYS 114 6.931 1.564 -2.384 666 1HB LYS 114 HB2 LYS 114 5.816 3.709 -2.990 667 2HB LYS 114 HB1 LYS 114 6.226 3.418 -4.666 668 1HG LYS 114 HG2 LYS 114 4.753 1.432 -4.642 669 2HG LYS 114 HG1 LYS 114 4.314 1.813 -2.973 670 1HD LYS 114 HD2 LYS 114 2.572 2.738 -4.351 671 2HD LYS 114 HD1 LYS 114 3.571 4.086 -3.806 672 1HE LYS 114 HE2 LYS 114 4.789 3.985 -5.985 673 2HE LYS 114 HE1 LYS 114 3.640 2.740 -6.479 674 1HZ LYS 114 HZ3 LYS 114 1.829 4.472 -6.165 675 2HZ LYS 114 HZ2 LYS 114 3.055 5.610 -5.899 676 3HZ LYS 114 HZ1 LYS 114 2.960 4.815 -7.346 677 H LYS 115 HN LYS 115 8.138 2.565 -5.480 678 HA LYS 115 HA LYS 115 7.546 0.198 -6.917 679 1HB LYS 115 HB2 LYS 115 9.445 2.453 -7.547 680 2HB LYS 115 HB1 LYS 115 9.086 1.134 -8.654 681 1HG LYS 115 HG2 LYS 115 6.770 1.783 -8.762 682 2HG LYS 115 HG1 LYS 115 7.005 2.978 -7.500 683 1HD LYS 115 HD2 LYS 115 6.906 4.194 -9.525 684 2HD LYS 115 HD1 LYS 115 8.602 4.151 -9.078 685 1HE LYS 115 HE2 LYS 115 7.347 2.265 -11.083 686 2HE LYS 115 HE1 LYS 115 8.104 3.786 -11.522 687 1HZ LYS 115 HZ3 LYS 115 10.204 2.905 -10.573 688 2HZ LYS 115 HZ2 LYS 115 9.444 1.409 -10.325 689 3HZ LYS 115 HZ1 LYS 115 9.612 2.015 -11.863 690 H GLU 116 HN GLU 116 10.528 1.325 -5.361 691 HA GLU 116 HA GLU 116 12.186 -0.815 -6.031 692 1HB GLU 116 HB2 GLU 116 12.070 0.773 -3.443 693 2HB GLU 116 HB1 GLU 116 13.291 -0.443 -3.770 694 1HG GLU 116 HG2 GLU 116 13.995 0.959 -5.715 695 2HG GLU 116 HG1 GLU 116 12.865 2.192 -5.147 696 H LEU 117 HN LEU 117 9.805 -0.496 -3.483 697 HA LEU 117 HA LEU 117 10.243 -3.012 -2.267 698 1HB LEU 117 HB2 LEU 117 9.141 -1.322 -1.037 699 2HB LEU 117 HB1 LEU 117 7.894 -1.145 -2.268 700 HG LEU 117 HG LEU 117 7.434 -3.657 -1.709 701 1HD1 LEU 117 HD1 LEU 117 8.902 -2.944 0.689 702 2HD1 LEU 117 HD1 LEU 117 7.737 -4.282 0.495 703 3HD1 LEU 117 HD1 LEU 117 9.182 -4.209 -0.512 704 1HD2 LEU 117 HD2 LEU 117 5.967 -1.829 -1.435 705 2HD2 LEU 117 HD2 LEU 117 5.823 -3.112 -0.234 706 3HD2 LEU 117 HD2 LEU 117 6.595 -1.534 0.206 707 H ILE 118 HN ILE 118 7.897 -1.815 -4.616 708 HA ILE 118 HA ILE 118 6.381 -4.101 -4.921 709 HB ILE 118 HB ILE 118 7.033 -1.980 -6.994 710 1HG1 ILE 118 2HG1 ILE 118 4.439 -2.395 -5.518 711 2HG1 ILE 118 1HG1 ILE 118 5.685 -1.358 -4.859 712 1HG2 ILE 118 3HG2 ILE 118 4.931 -4.168 -7.192 713 2HG2 ILE 118 2HG2 ILE 118 5.058 -2.804 -8.284 714 3HG2 ILE 118 1HG2 ILE 118 6.358 -3.990 -8.198 715 1HD1 ILE 118 HD1 ILE 118 4.321 -1.019 -7.511 716 2HD1 ILE 118 HD1 ILE 118 3.992 -0.104 -6.031 717 3HD1 ILE 118 HD1 ILE 118 5.568 0.029 -6.821 718 H GLN 119 HN GLN 119 9.310 -3.189 -6.581 719 HA GLN 119 HA GLN 119 9.605 -5.365 -8.311 720 1HB GLN 119 HB2 GLN 119 11.709 -3.854 -6.790 721 2HB GLN 119 HB1 GLN 119 12.046 -4.951 -8.120 722 1HG GLN 119 HG2 GLN 119 10.812 -3.524 -9.634 723 2HG GLN 119 HG1 GLN 119 10.388 -2.449 -8.306 724 1HE2 GLN 119 1HE2 GLN 119 13.037 -2.705 -7.061 725 2HE2 GLN 119 2HE2 GLN 119 14.098 -1.746 -8.022 726 H LEU 120 HN LEU 120 10.506 -5.038 -4.927 727 HA LEU 120 HA LEU 120 11.751 -7.571 -4.713 728 1HB LEU 120 HB2 LEU 120 10.682 -5.714 -2.597 729 2HB LEU 120 HB1 LEU 120 11.621 -7.161 -2.274 730 HG LEU 120 HG LEU 120 12.632 -4.801 -3.859 731 1HD1 LEU 120 HD1 LEU 120 13.170 -5.608 -1.008 732 2HD1 LEU 120 HD1 LEU 120 13.987 -4.319 -1.888 733 3HD1 LEU 120 HD1 LEU 120 12.265 -4.188 -1.538 734 1HD2 LEU 120 HD2 LEU 120 14.004 -7.265 -2.784 735 2HD2 LEU 120 HD2 LEU 120 13.717 -6.882 -4.484 736 3HD2 LEU 120 HD2 LEU 120 14.811 -5.889 -3.525 737 H VAL 121 HN VAL 121 8.502 -6.410 -3.622 738 HA VAL 121 HA VAL 121 7.609 -8.914 -2.746 739 HB VAL 121 HB VAL 121 5.904 -6.735 -3.985 740 1HG1 VAL 121 1HG1 VAL 121 4.677 -8.788 -3.515 741 2HG1 VAL 121 3HG1 VAL 121 5.283 -8.757 -1.852 742 3HG1 VAL 121 2HG1 VAL 121 4.203 -7.482 -2.412 743 1HG2 VAL 121 3HG2 VAL 121 6.955 -6.933 -1.171 744 2HG2 VAL 121 2HG2 VAL 121 7.367 -5.724 -2.396 745 3HG2 VAL 121 1HG2 VAL 121 5.733 -5.777 -1.731 746 H ALA 122 HN ALA 122 7.605 -7.445 -5.931 747 HA ALA 122 HA ALA 122 5.995 -9.241 -7.308 748 1HB ALA 122 HB3 ALA 122 8.310 -7.626 -8.354 749 2HB ALA 122 HB2 ALA 122 7.029 -8.359 -9.334 750 3HB ALA 122 HB1 ALA 122 6.646 -7.075 -8.185 751 H ARG 123 HN ARG 123 9.528 -9.187 -6.891 752 HA ARG 123 HA ARG 123 9.879 -11.539 -8.445 753 1HB ARG 123 HB2 ARG 123 12.214 -11.524 -7.688 754 2HB ARG 123 HB1 ARG 123 11.706 -9.984 -8.355 755 1HG ARG 123 HG2 ARG 123 11.458 -9.108 -6.084 756 2HG ARG 123 HG1 ARG 123 12.019 -10.656 -5.441 757 1HD ARG 123 HD2 ARG 123 13.819 -8.978 -5.548 758 2HD ARG 123 HD1 ARG 123 14.148 -10.383 -6.558 759 HE ARG 123 HE ARG 123 12.863 -8.303 -8.020 760 1HH1 ARG 123 1HH1 ARG 123 16.018 -9.246 -6.708 761 2HH1 ARG 123 2HH1 ARG 123 16.921 -8.515 -7.946 762 1HH2 ARG 123 1HH2 ARG 123 14.094 -7.251 -9.706 763 2HH2 ARG 123 2HH2 ARG 123 15.802 -7.323 -9.683 764 H HIS 124 HN HIS 124 8.872 -11.094 -5.284 765 HA HIS 124 HA HIS 124 9.780 -13.427 -4.053 766 1HB HIS 124 HB2 HIS 124 8.699 -11.773 -2.711 767 2HB HIS 124 HB1 HIS 124 7.233 -11.812 -3.658 768 HD1 HIS 124 HD1 HIS 124 5.450 -13.577 -2.912 769 HD2 HIS 124 HD2 HIS 124 9.088 -13.960 -0.964 770 HE1 HIS 124 HE1 HIS 124 5.103 -15.293 -1.109 771 H GLY 125 HN GLY 125 7.287 -12.928 -6.450 772 1HA GLY 125 HA1 GLY 125 6.289 -15.634 -6.045 773 2HA GLY 125 HA2 GLY 125 7.184 -15.354 -7.532 774 H LEU 126 HN LEU 126 5.489 -12.548 -6.646 775 HA LEU 126 HA LEU 126 2.981 -13.028 -7.490 776 1HB LEU 126 HB2 LEU 126 4.765 -10.685 -7.414 777 2HB LEU 126 HB1 LEU 126 3.221 -10.544 -8.226 778 HG LEU 126 HG LEU 126 2.106 -11.213 -6.186 779 1HD1 LEU 126 HD1 LEU 126 3.722 -12.507 -5.150 780 2HD1 LEU 126 HD1 LEU 126 4.760 -11.099 -4.844 781 3HD1 LEU 126 HD1 LEU 126 3.153 -11.227 -4.076 782 1HD2 LEU 126 HD2 LEU 126 3.893 -8.815 -6.001 783 2HD2 LEU 126 HD2 LEU 126 2.286 -8.904 -6.716 784 3HD2 LEU 126 HD2 LEU 126 2.485 -9.075 -4.972 785 H ASP 127 HN ASP 127 2.005 -13.077 -9.268 786 HA ASP 127 HA ASP 127 3.297 -13.414 -11.816 787 1HB ASP 127 HB2 ASP 127 0.392 -13.032 -11.056 788 2HB ASP 127 HB1 ASP 127 0.911 -13.209 -12.722 789 H HIS 128 HN HIS 128 2.616 -11.966 -13.703 790 HA HIS 128 HA HIS 128 3.511 -9.351 -13.115 791 1HB HIS 128 HB2 HIS 128 2.136 -10.363 -15.628 792 2HB HIS 128 HB1 HIS 128 2.960 -8.816 -15.455 793 HD1 HIS 128 HD1 HIS 128 3.567 -12.170 -16.609 794 HD2 HIS 128 HD2 HIS 128 5.802 -9.202 -14.763 795 HE1 HIS 128 HE1 HIS 128 5.984 -12.770 -17.002 796 H ASP 129 HN ASP 129 0.376 -10.746 -13.605 797 HA ASP 129 HA ASP 129 -1.219 -8.421 -13.490 798 1HB ASP 129 HB2 ASP 129 -1.799 -11.272 -12.692 799 2HB ASP 129 HB1 ASP 129 -3.007 -10.004 -12.610 800 H LYS 130 HN LYS 130 0.035 -10.535 -11.041 801 HA LYS 130 HA LYS 130 -1.241 -9.437 -8.787 802 1HB LYS 130 HB2 LYS 130 1.251 -11.035 -9.191 803 2HB LYS 130 HB1 LYS 130 0.819 -10.433 -7.600 804 1HG LYS 130 HG2 LYS 130 -1.187 -11.969 -9.163 805 2HG LYS 130 HG1 LYS 130 0.130 -12.831 -8.364 806 1HD LYS 130 HD2 LYS 130 -0.465 -11.961 -6.259 807 2HD LYS 130 HD1 LYS 130 -1.645 -10.852 -6.916 808 1HE LYS 130 HE2 LYS 130 -2.785 -12.738 -5.947 809 2HE LYS 130 HE1 LYS 130 -2.940 -12.870 -7.694 810 1HZ LYS 130 HZ1 LYS 130 -0.986 -14.372 -6.015 811 2HZ LYS 130 HZ3 LYS 130 -2.389 -14.994 -6.674 812 3HZ LYS 130 HZ2 LYS 130 -1.135 -14.525 -7.681 813 H VAL 131 HN VAL 131 1.787 -8.630 -10.423 814 HA VAL 131 HA VAL 131 2.731 -6.787 -8.520 815 HB VAL 131 HB VAL 131 3.214 -6.770 -11.516 816 1HG1 VAL 131 3HG1 VAL 131 3.953 -4.732 -10.415 817 2HG1 VAL 131 2HG1 VAL 131 4.895 -5.687 -9.270 818 3HG1 VAL 131 1HG1 VAL 131 5.330 -5.682 -10.979 819 1HG2 VAL 131 3HG2 VAL 131 4.724 -8.246 -9.368 820 2HG2 VAL 131 2HG2 VAL 131 3.717 -8.961 -10.624 821 3HG2 VAL 131 1HG2 VAL 131 5.209 -8.126 -11.060 822 H LEU 132 HN LEU 132 0.708 -6.504 -11.394 823 HA LEU 132 HA LEU 132 0.311 -3.709 -11.451 824 1HB LEU 132 HB2 LEU 132 -1.585 -5.909 -12.251 825 2HB LEU 132 HB1 LEU 132 -1.730 -4.224 -12.707 826 HG LEU 132 HG LEU 132 0.514 -6.062 -13.539 827 1HD1 LEU 132 HD1 LEU 132 -1.605 -6.668 -14.533 828 2HD1 LEU 132 HD1 LEU 132 -1.844 -4.998 -15.052 829 3HD1 LEU 132 HD1 LEU 132 -0.521 -5.956 -15.736 830 1HD2 LEU 132 HD2 LEU 132 -0.157 -3.234 -14.359 831 2HD2 LEU 132 HD2 LEU 132 1.238 -3.756 -13.404 832 3HD2 LEU 132 HD2 LEU 132 1.094 -4.248 -15.086 833 H LEU 133 HN LEU 133 -1.671 -6.276 -10.066 834 HA LEU 133 HA LEU 133 -3.616 -4.711 -8.836 835 1HB LEU 133 HB2 LEU 133 -2.500 -7.373 -8.021 836 2HB LEU 133 HB1 LEU 133 -3.977 -6.682 -7.374 837 HG LEU 133 HG LEU 133 -3.534 -7.431 -10.263 838 1HD1 LEU 133 HD1 LEU 133 -3.555 -9.382 -8.817 839 2HD1 LEU 133 HD1 LEU 133 -5.068 -8.831 -8.093 840 3HD1 LEU 133 HD1 LEU 133 -5.015 -9.289 -9.797 841 1HD2 LEU 133 HD2 LEU 133 -6.010 -6.560 -8.769 842 2HD2 LEU 133 HD2 LEU 133 -5.167 -5.642 -10.019 843 3HD2 LEU 133 HD2 LEU 133 -5.974 -7.156 -10.422 844 H PHE 134 HN PHE 134 -0.559 -5.935 -7.560 845 HA PHE 134 HA PHE 134 -0.833 -4.952 -4.970 846 1HB PHE 134 HB2 PHE 134 0.828 -6.633 -5.571 847 2HB PHE 134 HB1 PHE 134 1.667 -5.470 -6.587 848 HD1 PHE 134 HD1 PHE 134 0.521 -5.829 -3.042 849 HD2 PHE 134 HD2 PHE 134 3.529 -4.462 -5.711 850 HE1 PHE 134 HE1 PHE 134 1.911 -5.251 -1.160 851 HE2 PHE 134 HE2 PHE 134 4.932 -3.838 -3.768 852 HZ PHE 134 HZ PHE 134 4.133 -4.240 -1.512 853 H SER 135 HN SER 135 0.772 -3.509 -7.809 854 HA SER 135 HA SER 135 1.620 -1.244 -6.455 855 1HB SER 135 HB2 SER 135 1.921 -0.240 -8.745 856 2HB SER 135 HB1 SER 135 2.681 -1.800 -8.501 857 HG SER 135 HG SER 135 0.159 -2.136 -9.475 858 H ARG 136 HN ARG 136 -1.453 -1.844 -8.062 859 HA ARG 136 HA ARG 136 -2.239 0.902 -7.826 860 1HB ARG 136 HB2 ARG 136 -4.473 0.124 -8.642 861 2HB ARG 136 HB1 ARG 136 -3.138 -0.318 -9.693 862 1HG ARG 136 HG2 ARG 136 -3.172 -2.572 -8.576 863 2HG ARG 136 HG1 ARG 136 -4.683 -2.082 -7.818 864 1HD ARG 136 HD2 ARG 136 -4.182 -2.154 -10.789 865 2HD ARG 136 HD1 ARG 136 -4.966 -3.431 -9.883 866 HE ARG 136 HE ARG 136 -6.367 -1.160 -9.301 867 1HH1 ARG 136 1HH1 ARG 136 -5.587 -2.984 -12.254 868 2HH1 ARG 136 2HH1 ARG 136 -7.035 -2.636 -13.052 869 1HH2 ARG 136 1HH2 ARG 136 -8.371 -0.619 -10.434 870 2HH2 ARG 136 2HH2 ARG 136 -8.666 -1.199 -11.999 871 H ASP 137 HN ASP 137 -2.851 -2.027 -5.978 872 HA ASP 137 HA ASP 137 -4.853 -1.032 -4.217 873 1HB ASP 137 HB2 ASP 137 -3.931 -3.491 -4.643 874 2HB ASP 137 HB1 ASP 137 -2.775 -3.065 -3.409 875 H LEU 138 HN LEU 138 -1.390 -1.267 -4.116 876 HA LEU 138 HA LEU 138 -0.950 -0.120 -1.577 877 1HB LEU 138 HB2 LEU 138 0.613 -1.622 -2.511 878 2HB LEU 138 HB1 LEU 138 0.756 -0.680 -3.968 879 HG LEU 138 HG LEU 138 2.136 0.948 -2.863 880 1HD1 LEU 138 HD1 LEU 138 1.605 -0.606 -0.342 881 2HD1 LEU 138 HD1 LEU 138 2.726 0.744 -0.542 882 3HD1 LEU 138 HD1 LEU 138 0.984 1.019 -0.707 883 1HD2 LEU 138 HD2 LEU 138 2.815 -1.836 -2.063 884 2HD2 LEU 138 HD2 LEU 138 3.168 -1.092 -3.623 885 3HD2 LEU 138 HD2 LEU 138 3.971 -0.501 -2.153 886 H ASP 139 HN ASP 139 -0.871 1.205 -4.856 887 HA ASP 139 HA ASP 139 0.053 3.753 -4.167 888 1HB ASP 139 HB2 ASP 139 -0.062 2.941 -6.500 889 2HB ASP 139 HB1 ASP 139 -1.819 3.018 -6.414 890 H LYS 140 HN LYS 140 -3.236 2.437 -4.307 891 HA LYS 140 HA LYS 140 -4.458 4.928 -3.726 892 1HB LYS 140 HB2 LYS 140 -5.540 2.146 -3.358 893 2HB LYS 140 HB1 LYS 140 -6.475 3.630 -3.185 894 1HG LYS 140 HG2 LYS 140 -5.916 4.159 -5.556 895 2HG LYS 140 HG1 LYS 140 -5.155 2.576 -5.679 896 1HD LYS 140 HD2 LYS 140 -7.349 2.373 -6.579 897 2HD LYS 140 HD1 LYS 140 -7.356 1.570 -5.014 898 1HE LYS 140 HE2 LYS 140 -9.379 2.908 -5.294 899 2HE LYS 140 HE1 LYS 140 -8.395 3.558 -3.992 900 1HZ LYS 140 HZ2 LYS 140 -8.461 4.653 -6.774 901 2HZ LYS 140 HZ1 LYS 140 -9.287 5.294 -5.464 902 3HZ LYS 140 HZ3 LYS 140 -7.618 5.297 -5.479 903 H LEU 141 HN LEU 141 -3.287 2.310 -1.713 904 HA LEU 141 HA LEU 141 -4.353 3.261 0.715 905 1HB LEU 141 HB2 LEU 141 -3.444 1.012 0.564 906 2HB LEU 141 HB1 LEU 141 -1.856 1.641 0.182 907 HG LEU 141 HG LEU 141 -1.635 2.547 2.438 908 1HD1 LEU 141 HD1 LEU 141 -4.380 1.408 2.904 909 2HD1 LEU 141 HD1 LEU 141 -3.309 2.066 4.146 910 3HD1 LEU 141 HD1 LEU 141 -3.933 3.113 2.879 911 1HD2 LEU 141 HD2 LEU 141 -2.539 -0.325 2.427 912 2HD2 LEU 141 HD2 LEU 141 -0.908 0.256 2.082 913 3HD2 LEU 141 HD2 LEU 141 -1.596 0.442 3.698 914 H ILE 142 HN ILE 142 -1.399 3.946 -1.003 915 HA ILE 142 HA ILE 142 -0.396 5.683 0.991 916 HB ILE 142 HB ILE 142 0.392 5.371 -1.925 917 1HG1 ILE 142 2HG1 ILE 142 1.671 4.491 0.660 918 2HG1 ILE 142 1HG1 ILE 142 0.837 3.450 -0.484 919 1HG2 ILE 142 3HG2 ILE 142 1.757 7.006 0.225 920 2HG2 ILE 142 2HG2 ILE 142 2.408 6.682 -1.383 921 3HG2 ILE 142 1HG2 ILE 142 0.946 7.648 -1.204 922 1HD1 ILE 142 HD1 ILE 142 3.383 4.966 -1.009 923 2HD1 ILE 142 HD1 ILE 142 3.257 3.247 -0.632 924 3HD1 ILE 142 HD1 ILE 142 2.558 3.870 -2.126 925 H ASN 143 HN ASN 143 -2.156 6.243 -2.026 926 HA ASN 143 HA ASN 143 -2.274 9.044 -1.955 927 1HB ASN 143 HB2 ASN 143 -4.343 7.096 -3.014 928 2HB ASN 143 HB1 ASN 143 -4.422 8.832 -3.268 929 1HD2 ASN 143 HD2 ASN 143 -4.196 6.642 -5.160 930 2HD2 ASN 143 HD2 ASN 143 -2.748 6.856 -6.066 931 H LYS 144 HN LYS 144 -4.202 6.677 -0.305 932 HA LYS 144 HA LYS 144 -6.209 8.278 0.794 933 1HB LYS 144 HB2 LYS 144 -6.136 5.798 0.857 934 2HB LYS 144 HB1 LYS 144 -4.829 5.877 2.024 935 1HG LYS 144 HG2 LYS 144 -6.400 7.082 3.562 936 2HG LYS 144 HG1 LYS 144 -7.685 6.745 2.402 937 1HD LYS 144 HD2 LYS 144 -6.013 4.706 3.892 938 2HD LYS 144 HD1 LYS 144 -7.708 5.087 4.176 939 1HE LYS 144 HE2 LYS 144 -8.213 4.301 1.867 940 2HE LYS 144 HE1 LYS 144 -6.526 3.830 1.697 941 1HZ LYS 144 HZ2 LYS 144 -6.846 2.320 3.623 942 2HZ LYS 144 HZ1 LYS 144 -8.469 2.729 3.650 943 3HZ LYS 144 HZ3 LYS 144 -7.829 1.911 2.323 944 H PHE 145 HN PHE 145 -3.092 7.287 2.200 945 HA PHE 145 HA PHE 145 -3.467 9.002 4.440 946 1HB PHE 145 HB2 PHE 145 -1.247 7.155 3.652 947 2HB PHE 145 HB1 PHE 145 -1.081 8.274 5.003 948 HD1 PHE 145 HD1 PHE 145 -3.065 5.409 3.730 949 HD2 PHE 145 HD2 PHE 145 -2.101 7.861 7.068 950 HE1 PHE 145 HE1 PHE 145 -4.232 3.839 5.217 951 HE2 PHE 145 HE2 PHE 145 -3.282 6.283 8.564 952 HZ PHE 145 HZ PHE 145 -4.344 4.280 7.631 953 H MET 146 HN MET 146 -1.833 9.334 1.431 954 HA MET 146 HA MET 146 -0.251 11.656 2.097 955 1HB MET 146 HB2 MET 146 -1.461 10.822 -0.538 956 2HB MET 146 HB1 MET 146 -0.297 12.117 -0.355 957 1HG MET 146 HG2 MET 146 0.246 9.213 0.202 958 2HG MET 146 HG1 MET 146 0.507 9.975 -1.355 959 1HE MET 146 HE2 MET 146 1.734 9.272 2.160 960 2HE MET 146 HE1 MET 146 3.143 10.354 2.352 961 3HE MET 146 HE3 MET 146 1.511 10.992 2.483 962 H ASN 147 HN ASN 147 -3.522 10.992 1.494 963 HA ASN 147 HA ASN 147 -5.418 12.113 1.339 964 1HB ASN 147 HB2 ASN 147 -4.669 13.375 3.364 965 2HB ASN 147 HB1 ASN 147 -3.876 14.543 2.316 966 1HD2 ASN 147 HD2 ASN 147 -5.092 16.254 3.023 967 2HD2 ASN 147 HD2 ASN 147 -6.785 16.420 2.700 968 H VAL 148 HN VAL 148 -4.804 11.584 -0.858 969 HA VAL 148 HA VAL 148 -4.592 13.993 -2.552 970 HB VAL 148 HB VAL 148 -3.988 11.150 -3.292 971 1HG1 VAL 148 3HG1 VAL 148 -4.756 12.490 -5.180 972 2HG1 VAL 148 2HG1 VAL 148 -3.549 13.725 -4.821 973 3HG1 VAL 148 1HG1 VAL 148 -3.037 12.133 -5.374 974 1HG2 VAL 148 2HG2 VAL 148 -2.308 12.081 -1.737 975 2HG2 VAL 148 1HG2 VAL 148 -1.623 11.735 -3.336 976 3HG2 VAL 148 3HG2 VAL 148 -2.015 13.388 -2.874 977 H LYS 149 HN LYS 149 -6.390 14.546 -3.172 978 HA LYS 149 HA LYS 149 -8.448 12.561 -3.503 979 1HB LYS 149 HB2 LYS 149 -8.600 15.557 -3.775 980 2HB LYS 149 HB1 LYS 149 -9.946 14.422 -3.768 981 1HG LYS 149 HG2 LYS 149 -9.310 13.778 -1.453 982 2HG LYS 149 HG1 LYS 149 -8.084 15.029 -1.486 983 1HD LYS 149 HD2 LYS 149 -10.100 15.884 -0.377 984 2HD LYS 149 HD1 LYS 149 -9.837 16.735 -1.899 985 1HE LYS 149 HE2 LYS 149 -11.478 15.280 -3.000 986 2HE LYS 149 HE1 LYS 149 -11.751 14.431 -1.480 987 1HZ LYS 149 HZ2 LYS 149 -12.327 17.279 -2.051 988 2HZ LYS 149 HZ1 LYS 149 -13.438 16.031 -1.964 989 3HZ LYS 149 HZ3 LYS 149 -12.623 16.499 -0.571 990 H ASP 150 HN ASP 150 -8.281 11.587 -5.325 991 HA ASP 150 HA ASP 150 -7.206 12.522 -7.730 992 1HB ASP 150 HB2 ASP 150 -9.341 10.400 -7.322 993 2HB ASP 150 HB1 ASP 150 -8.543 10.706 -8.855 994 H LYS 151 HN LYS 151 -7.876 14.361 -8.556 995 HA LYS 151 HA LYS 151 -10.707 14.967 -8.552 996 1HB LYS 151 HB2 LYS 151 -10.011 17.295 -9.170 997 2HB LYS 151 HB1 LYS 151 -9.421 16.733 -7.620 998 1HG LYS 151 HG2 LYS 151 -7.237 16.269 -8.668 999 2HG LYS 151 HG1 LYS 151 -7.851 16.965 -10.173 1000 1HD LYS 151 HD2 LYS 151 -8.247 19.084 -9.054 1001 2HD LYS 151 HD1 LYS 151 -7.711 18.402 -7.519 1002 1HE LYS 151 HE2 LYS 151 -5.492 17.997 -8.521 1003 2HE LYS 151 HE1 LYS 151 -6.044 18.768 -10.003 1004 1HZ LYS 151 HZ3 LYS 151 -6.395 20.817 -8.751 1005 2HZ LYS 151 HZ2 LYS 151 -5.837 20.080 -7.338 1006 3HZ LYS 151 HZ1 LYS 151 -4.800 20.316 -8.619 1007 H VAL 152 HN VAL 152 -9.145 13.194 -10.394 1008 HA VAL 152 HA VAL 152 -10.058 14.252 -12.925 1009 HB VAL 152 HB VAL 152 -9.507 11.981 -13.872 1010 1HG1 VAL 152 3HG1 VAL 152 -7.762 13.663 -13.832 1011 2HG1 VAL 152 2HG1 VAL 152 -7.291 13.160 -12.210 1012 3HG1 VAL 152 1HG1 VAL 152 -7.078 12.060 -13.571 1013 1HG2 VAL 152 3HG2 VAL 152 -10.010 10.613 -11.897 1014 2HG2 VAL 152 2HG2 VAL 152 -8.378 10.292 -12.482 1015 3HG2 VAL 152 1HG2 VAL 152 -8.621 11.307 -11.058 1016 H HIS 153 HN HIS 153 -12.027 13.652 -13.873 1017 HA HIS 153 HA HIS 153 -13.921 12.955 -11.849 1018 1HB HIS 153 HB2 HIS 153 -14.430 13.584 -14.762 1019 2HB HIS 153 HB1 HIS 153 -15.679 13.394 -13.536 1020 HD1 HIS 153 HD1 HIS 153 -14.608 16.083 -15.266 1021 HD2 HIS 153 HD2 HIS 153 -14.419 15.252 -11.196 1022 HE1 HIS 153 HE1 HIS 153 -14.394 18.293 -14.106 1023 H LYS 154 HN LYS 154 -12.447 11.337 -14.399 1024 HA LYS 154 HA LYS 154 -12.938 8.771 -13.402 1025 1HB LYS 154 HB2 LYS 154 -15.283 9.276 -14.262 1026 2HB LYS 154 HB1 LYS 154 -14.601 9.397 -15.872 1027 1HG LYS 154 HG2 LYS 154 -13.897 7.067 -15.760 1028 2HG LYS 154 HG1 LYS 154 -14.556 6.943 -14.127 1029 1HD LYS 154 HD2 LYS 154 -16.781 7.464 -15.011 1030 2HD LYS 154 HD1 LYS 154 -16.109 7.538 -16.642 1031 1HE LYS 154 HE2 LYS 154 -15.405 5.201 -16.459 1032 2HE LYS 154 HE1 LYS 154 -16.064 5.130 -14.828 1033 1HZ LYS 154 HZ3 LYS 154 -18.266 5.562 -15.755 1034 2HZ LYS 154 HZ2 LYS 154 -17.622 5.571 -17.321 1035 3HZ LYS 154 HZ1 LYS 154 -17.579 4.167 -16.400 1036 H LEU 155 HN LEU 155 -11.781 7.205 -14.691 1037 HA LEU 155 HA LEU 155 -10.170 8.395 -16.807 1038 1HB LEU 155 HB2 LEU 155 -9.974 5.679 -15.461 1039 2HB LEU 155 HB1 LEU 155 -8.874 6.263 -16.694 1040 HG LEU 155 HG LEU 155 -9.195 7.414 -13.915 1041 1HD1 LEU 155 HD1 LEU 155 -6.920 5.891 -15.164 1042 2HD1 LEU 155 HD1 LEU 155 -6.912 6.635 -13.567 1043 3HD1 LEU 155 HD1 LEU 155 -8.010 5.301 -13.906 1044 1HD2 LEU 155 HD2 LEU 155 -7.343 8.245 -16.154 1045 2HD2 LEU 155 HD2 LEU 155 -8.682 9.190 -15.497 1046 3HD2 LEU 155 HD2 LEU 155 -7.276 8.842 -14.497 1047 H GLU 156 HN GLU 156 -10.169 7.383 -18.933 1048 HA GLU 156 HA GLU 156 -11.354 6.858 -20.805 1049 1HB GLU 156 HB2 GLU 156 -12.999 5.087 -18.936 1050 2HB GLU 156 HB1 GLU 156 -13.116 5.055 -20.690 1051 1HG GLU 156 HG2 GLU 156 -10.673 4.336 -19.088 1052 2HG GLU 156 HG1 GLU 156 -11.814 3.186 -19.780 1053 H HIS 157 HN HIS 157 -11.675 9.053 -19.648 1054 HA HIS 157 HA HIS 157 -14.221 9.758 -18.620 1055 1HB HIS 157 HB2 HIS 157 -12.019 10.807 -18.014 1056 2HB HIS 157 HB1 HIS 157 -12.037 11.536 -19.622 1057 HD1 HIS 157 HD1 HIS 157 -13.498 13.610 -19.965 1058 HD2 HIS 157 HD2 HIS 157 -13.915 11.857 -16.233 1059 HE1 HIS 157 HE1 HIS 157 -14.827 15.225 -18.590 1060 H HIS 158 HN HIS 158 -15.917 10.149 -19.761 1061 HA HIS 158 HA HIS 158 -15.709 11.787 -22.132 1062 1HB HIS 158 HB2 HIS 158 -17.354 9.245 -21.955 1063 2HB HIS 158 HB1 HIS 158 -17.687 10.493 -23.140 1064 HD1 HIS 158 HD1 HIS 158 -16.160 10.528 -25.239 1065 HD2 HIS 158 HD2 HIS 158 -15.069 7.706 -22.378 1066 HE1 HIS 158 HE1 HIS 158 -14.513 9.015 -26.348 1067 H HIS 159 HN HIS 159 -18.059 10.081 -20.080 1068 HA HIS 159 HA HIS 159 -19.964 10.665 -19.058 1069 1HB HIS 159 HB2 HIS 159 -18.498 13.298 -18.737 1070 2HB HIS 159 HB1 HIS 159 -20.060 12.970 -17.993 1071 HD1 HIS 159 HD1 HIS 159 -16.775 13.173 -16.902 1072 HD2 HIS 159 HD2 HIS 159 -19.652 10.187 -16.591 1073 HE1 HIS 159 HE1 HIS 159 -16.105 11.755 -14.956 1074 H HIS 160 HN HIS 160 -19.865 10.781 -21.785 1075 HA HIS 160 HA HIS 160 -21.360 13.106 -22.626 1076 1HB HIS 160 HB2 HIS 160 -19.574 12.103 -24.070 1077 2HB HIS 160 HB1 HIS 160 -20.563 10.662 -24.217 1078 HD1 HIS 160 HD1 HIS 160 -22.168 10.630 -26.173 1079 HD2 HIS 160 HD2 HIS 160 -20.868 14.450 -25.202 1080 HE1 HIS 160 HE1 HIS 160 -23.063 12.145 -27.962 1081 H HIS 161 HN HIS 161 -23.332 13.054 -21.861 1082 HA HIS 161 HA HIS 161 -24.903 10.635 -21.914 1083 1HB HIS 161 HB2 HIS 161 -25.387 13.396 -20.801 1084 2HB HIS 161 HB1 HIS 161 -26.679 12.210 -20.919 1085 HD1 HIS 161 HD1 HIS 161 -26.898 10.644 -18.973 1086 HD2 HIS 161 HD2 HIS 161 -23.194 12.520 -19.053 1087 HE1 HIS 161 HE1 HIS 161 -25.750 10.008 -16.824 1088 H HIS 162 HN HIS 162 -26.303 10.184 -23.398 1089 HA HIS 162 HA HIS 162 -26.608 12.046 -25.625 1090 1HB HIS 162 HB2 HIS 162 -25.775 9.669 -25.954 1091 2HB HIS 162 HB1 HIS 162 -27.357 9.111 -25.443 1092 HD1 HIS 162 HD1 HIS 162 -25.475 9.787 -28.405 1093 HD2 HIS 162 HD2 HIS 162 -29.459 10.220 -27.305 1094 HE1 HIS 162 HE1 HIS 162 -26.788 9.851 -30.548 No H/Q in entry = 1094 Start of MODEL 7 1 H1 MET 1 HT2 MET 1 19.623 -18.421 -2.425 2 H2 MET 1 HT1 MET 1 18.530 -18.191 -3.656 3 H3 MET 1 HT3 MET 1 20.073 -17.517 -3.779 4 HA MET 1 HA MET 1 19.612 -16.084 -1.911 5 1HB MET 1 HB2 MET 1 19.018 -15.244 -4.165 6 2HB MET 1 HB1 MET 1 17.430 -15.980 -4.017 7 1HG MET 1 HG2 MET 1 16.845 -14.468 -2.240 8 2HG MET 1 HG1 MET 1 18.477 -13.806 -2.225 9 1HE MET 1 HE3 MET 1 15.873 -12.008 -2.394 10 2HE MET 1 HE2 MET 1 17.505 -11.339 -2.410 11 3HE MET 1 HE1 MET 1 16.335 -10.834 -3.628 12 H GLU 2 HN GLU 2 18.919 -16.444 0.045 13 HA GLU 2 HA GLU 2 16.695 -18.094 0.536 14 1HB GLU 2 HB2 GLU 2 17.104 -17.565 2.928 15 2HB GLU 2 HB1 GLU 2 18.506 -18.170 2.070 16 1HG GLU 2 HG2 GLU 2 19.329 -15.856 1.874 17 2HG GLU 2 HG1 GLU 2 17.965 -15.330 2.863 18 H MET 3 HN MET 3 14.682 -17.687 0.872 19 HA MET 3 HA MET 3 13.657 -15.199 0.138 20 1HB MET 3 HB2 MET 3 11.439 -16.134 0.572 21 2HB MET 3 HB1 MET 3 12.444 -17.161 -0.421 22 1HG MET 3 HG2 MET 3 11.954 -17.592 2.514 23 2HG MET 3 HG1 MET 3 11.052 -18.301 1.168 24 1HE MET 3 HE1 MET 3 11.507 -20.744 2.170 25 2HE MET 3 HE3 MET 3 13.114 -21.352 2.571 26 3HE MET 3 HE2 MET 3 12.411 -20.032 3.505 27 H GLY 4 HN GLY 4 14.528 -16.467 3.180 28 1HA GLY 4 HA1 GLY 4 14.545 -15.533 5.268 29 2HA GLY 4 HA2 GLY 4 12.978 -14.835 4.869 30 H GLN 5 HN GLN 5 16.152 -14.311 3.343 31 HA GLN 5 HA GLN 5 16.291 -11.701 4.523 32 1HB GLN 5 HB2 GLN 5 18.118 -13.060 2.546 33 2HB GLN 5 HB1 GLN 5 18.374 -11.419 3.123 34 1HG GLN 5 HG2 GLN 5 18.443 -12.305 5.448 35 2HG GLN 5 HG1 GLN 5 18.349 -13.929 4.781 36 1HE2 GLN 5 1HE2 GLN 5 20.336 -14.498 5.629 37 2HE2 GLN 5 2HE2 GLN 5 21.819 -13.875 5.002 38 H LEU 6 HN LEU 6 15.092 -13.043 1.642 39 HA LEU 6 HA LEU 6 14.863 -10.682 0.106 40 1HB LEU 6 HB2 LEU 6 14.512 -12.919 -0.876 41 2HB LEU 6 HB1 LEU 6 13.184 -13.195 0.220 42 HG LEU 6 HG LEU 6 12.639 -12.777 -2.246 43 1HD1 LEU 6 HD1 LEU 6 10.935 -12.833 -0.552 44 2HD1 LEU 6 HD1 LEU 6 11.205 -11.138 -0.172 45 3HD1 LEU 6 HD1 LEU 6 10.576 -11.615 -1.751 46 1HD2 LEU 6 HD2 LEU 6 13.177 -9.924 -1.419 47 2HD2 LEU 6 HD2 LEU 6 14.054 -10.842 -2.646 48 3HD2 LEU 6 HD2 LEU 6 12.360 -10.426 -2.900 49 H LYS 7 HN LYS 7 12.779 -12.222 2.500 50 HA LYS 7 HA LYS 7 10.694 -10.364 2.594 51 1HB LYS 7 HB2 LYS 7 11.673 -12.534 4.207 52 2HB LYS 7 HB1 LYS 7 11.159 -11.193 5.222 53 1HG LYS 7 HG2 LYS 7 9.466 -12.387 3.037 54 2HG LYS 7 HG1 LYS 7 9.396 -12.961 4.695 55 1HD LYS 7 HD2 LYS 7 8.871 -10.101 3.853 56 2HD LYS 7 HD1 LYS 7 7.601 -11.310 4.038 57 1HE LYS 7 HE2 LYS 7 8.270 -11.580 6.404 58 2HE LYS 7 HE1 LYS 7 9.460 -10.297 6.185 59 1HZ LYS 7 HZ2 LYS 7 6.520 -9.961 5.826 60 2HZ LYS 7 HZ1 LYS 7 7.373 -9.522 7.180 61 3HZ LYS 7 HZ3 LYS 7 7.694 -8.728 5.744 62 H ASN 8 HN ASN 8 13.720 -10.514 4.337 63 HA ASN 8 HA ASN 8 13.323 -8.228 5.885 64 1HB ASN 8 HB2 ASN 8 15.946 -9.458 5.012 65 2HB ASN 8 HB1 ASN 8 15.749 -8.189 6.221 66 1HD2 ASN 8 HD2 ASN 8 16.867 -10.858 6.523 67 2HD2 ASN 8 HD2 ASN 8 15.918 -11.657 7.715 68 H LYS 9 HN LYS 9 14.599 -8.552 2.623 69 HA LYS 9 HA LYS 9 15.424 -5.847 2.343 70 1HB LYS 9 HB2 LYS 9 14.511 -7.805 0.220 71 2HB LYS 9 HB1 LYS 9 15.215 -6.224 -0.099 72 1HG LYS 9 HG2 LYS 9 17.282 -6.920 0.985 73 2HG LYS 9 HG1 LYS 9 16.577 -8.500 1.320 74 1HD LYS 9 HD2 LYS 9 16.376 -8.933 -1.068 75 2HD LYS 9 HD1 LYS 9 16.998 -7.326 -1.430 76 1HE LYS 9 HE2 LYS 9 18.494 -9.544 -0.021 77 2HE LYS 9 HE1 LYS 9 18.739 -9.034 -1.686 78 1HZ LYS 9 HZ1 LYS 9 19.397 -6.826 -0.815 79 2HZ LYS 9 HZ3 LYS 9 19.320 -7.430 0.764 80 3HZ LYS 9 HZ2 LYS 9 20.431 -8.049 -0.328 81 H ILE 10 HN ILE 10 12.427 -7.542 1.682 82 HA ILE 10 HA ILE 10 10.936 -5.392 0.686 83 HB ILE 10 HB ILE 10 10.104 -7.904 2.163 84 1HG1 ILE 10 2HG1 ILE 10 9.979 -7.147 -0.759 85 2HG1 ILE 10 1HG1 ILE 10 11.145 -8.243 -0.029 86 1HG2 ILE 10 2HG2 ILE 10 8.371 -6.227 2.514 87 2HG2 ILE 10 1HG2 ILE 10 8.287 -5.933 0.778 88 3HG2 ILE 10 3HG2 ILE 10 7.805 -7.499 1.432 89 1HD1 ILE 10 HD1 ILE 10 8.170 -8.678 -0.202 90 2HD1 ILE 10 HD1 ILE 10 9.399 -9.439 -1.215 91 3HD1 ILE 10 HD1 ILE 10 9.343 -9.787 0.511 92 H GLU 11 HN GLU 11 11.339 -6.639 3.971 93 HA GLU 11 HA GLU 11 9.752 -4.829 5.369 94 1HB GLU 11 HB2 GLU 11 12.389 -6.011 6.253 95 2HB GLU 11 HB1 GLU 11 11.219 -5.228 7.303 96 1HG GLU 11 HG2 GLU 11 10.824 -7.770 5.759 97 2HG GLU 11 HG1 GLU 11 11.041 -7.612 7.502 98 H ASN 12 HN ASN 12 13.181 -4.597 4.640 99 HA ASN 12 HA ASN 12 13.671 -2.085 5.713 100 1HB ASN 12 HB2 ASN 12 15.532 -3.448 5.048 101 2HB ASN 12 HB1 ASN 12 14.980 -3.487 3.379 102 1HD2 ASN 12 HD2 ASN 12 15.428 -1.774 2.043 103 2HD2 ASN 12 HD2 ASN 12 16.417 -0.442 2.465 104 H LYS 13 HN LYS 13 12.689 -2.901 2.407 105 HA LYS 13 HA LYS 13 12.811 -0.234 1.472 106 1HB LYS 13 HB2 LYS 13 12.850 -2.395 0.122 107 2HB LYS 13 HB1 LYS 13 11.108 -2.409 0.307 108 1HG LYS 13 HG2 LYS 13 11.742 -1.463 -1.846 109 2HG LYS 13 HG1 LYS 13 10.948 -0.258 -0.828 110 1HD LYS 13 HD2 LYS 13 12.898 0.653 -1.998 111 2HD LYS 13 HD1 LYS 13 13.086 0.718 -0.254 112 1HE LYS 13 HE2 LYS 13 14.466 -1.251 -0.314 113 2HE LYS 13 HE1 LYS 13 14.295 -1.367 -2.079 114 1HZ LYS 13 HZ3 LYS 13 15.341 0.839 -2.198 115 2HZ LYS 13 HZ2 LYS 13 15.541 0.784 -0.485 116 3HZ LYS 13 HZ1 LYS 13 16.348 -0.319 -1.473 117 H LYS 14 HN LYS 14 10.140 -2.245 2.595 118 HA LYS 14 HA LYS 14 7.966 -0.601 2.334 119 1HB LYS 14 HB2 LYS 14 7.978 -2.975 3.015 120 2HB LYS 14 HB1 LYS 14 8.741 -2.525 4.524 121 1HG LYS 14 HG2 LYS 14 6.717 -1.321 5.181 122 2HG LYS 14 HG1 LYS 14 5.964 -1.759 3.646 123 1HD LYS 14 HD2 LYS 14 5.174 -3.330 5.297 124 2HD LYS 14 HD1 LYS 14 6.322 -4.163 4.247 125 1HE LYS 14 HE2 LYS 14 8.090 -3.746 5.975 126 2HE LYS 14 HE1 LYS 14 6.805 -3.074 6.970 127 1HZ LYS 14 HZ3 LYS 14 6.789 -5.864 5.913 128 2HZ LYS 14 HZ2 LYS 14 7.400 -5.530 7.378 129 3HZ LYS 14 HZ1 LYS 14 5.752 -5.307 7.100 130 H LYS 15 HN LYS 15 10.281 -0.928 4.995 131 HA LYS 15 HA LYS 15 9.144 1.027 6.613 132 1HB LYS 15 HB2 LYS 15 11.929 -0.122 6.621 133 2HB LYS 15 HB1 LYS 15 11.323 0.959 7.870 134 1HG LYS 15 HG2 LYS 15 9.553 -0.634 8.408 135 2HG LYS 15 HG1 LYS 15 10.123 -1.705 7.133 136 1HD LYS 15 HD2 LYS 15 10.939 -2.562 9.168 137 2HD LYS 15 HD1 LYS 15 12.304 -1.839 8.342 138 1HE LYS 15 HE2 LYS 15 12.330 -1.254 10.737 139 2HE LYS 15 HE1 LYS 15 12.154 0.175 9.727 140 1HZ LYS 15 HZ2 LYS 15 9.905 -1.199 11.140 141 2HZ LYS 15 HZ1 LYS 15 10.665 0.200 11.656 142 3HZ LYS 15 HZ3 LYS 15 9.796 0.208 10.226 143 H GLU 16 HN GLU 16 11.789 1.210 4.247 144 HA GLU 16 HA GLU 16 12.567 3.865 4.584 145 1HB GLU 16 HB2 GLU 16 12.363 2.236 2.019 146 2HB GLU 16 HB1 GLU 16 13.030 3.858 2.067 147 1HG GLU 16 HG2 GLU 16 14.775 2.978 3.620 148 2HG GLU 16 HG1 GLU 16 14.110 1.364 3.359 149 H LEU 17 HN LEU 17 9.892 2.518 2.786 150 HA LEU 17 HA LEU 17 8.981 4.987 1.739 151 1HB LEU 17 HB2 LEU 17 8.451 3.100 0.459 152 2HB LEU 17 HB1 LEU 17 7.885 2.202 1.841 153 HG LEU 17 HG LEU 17 6.106 2.854 0.190 154 1HD1 LEU 17 HD1 LEU 17 5.582 2.093 2.259 155 2HD1 LEU 17 HD1 LEU 17 5.651 3.720 2.932 156 3HD1 LEU 17 HD1 LEU 17 4.443 3.329 1.687 157 1HD2 LEU 17 HD2 LEU 17 6.596 5.621 1.241 158 2HD2 LEU 17 HD2 LEU 17 6.864 5.070 -0.420 159 3HD2 LEU 17 HD2 LEU 17 5.229 5.109 0.245 160 H ILE 18 HN ILE 18 8.021 3.027 4.502 161 HA ILE 18 HA ILE 18 5.773 4.475 5.175 162 HB ILE 18 HB ILE 18 7.677 3.109 7.126 163 1HG1 ILE 18 2HG1 ILE 18 5.087 2.062 5.987 164 2HG1 ILE 18 1HG1 ILE 18 6.650 1.724 5.251 165 1HG2 ILE 18 3HG2 ILE 18 4.800 3.986 7.452 166 2HG2 ILE 18 2HG2 ILE 18 5.700 3.024 8.632 167 3HG2 ILE 18 1HG2 ILE 18 6.195 4.677 8.266 168 1HD1 ILE 18 HD1 ILE 18 5.889 0.999 8.073 169 2HD1 ILE 18 HD1 ILE 18 5.846 -0.094 6.683 170 3HD1 ILE 18 HD1 ILE 18 7.372 0.575 7.233 171 H GLN 19 HN GLN 19 9.154 4.935 6.023 172 HA GLN 19 HA GLN 19 8.899 7.138 7.740 173 1HB GLN 19 HB2 GLN 19 11.195 6.283 5.955 174 2HB GLN 19 HB1 GLN 19 11.310 7.532 7.186 175 1HG GLN 19 HG2 GLN 19 10.887 5.956 8.936 176 2HG GLN 19 HG1 GLN 19 10.501 4.692 7.774 177 1HE2 GLN 19 1HE2 GLN 19 13.213 6.888 7.407 178 2HE2 GLN 19 2HE2 GLN 19 14.435 5.710 7.648 179 H LEU 20 HN LEU 20 8.983 6.883 4.254 180 HA LEU 20 HA LEU 20 9.270 9.657 3.751 181 1HB LEU 20 HB2 LEU 20 8.215 7.462 1.973 182 2HB LEU 20 HB1 LEU 20 8.504 9.106 1.445 183 HG LEU 20 HG LEU 20 10.619 7.188 2.433 184 1HD1 LEU 20 HD1 LEU 20 9.718 6.562 0.270 185 2HD1 LEU 20 HD1 LEU 20 9.996 8.198 -0.330 186 3HD1 LEU 20 HD1 LEU 20 11.363 7.178 0.120 187 1HD2 LEU 20 HD2 LEU 20 10.842 9.964 1.280 188 2HD2 LEU 20 HD2 LEU 20 11.200 9.500 2.945 189 3HD2 LEU 20 HD2 LEU 20 12.194 8.892 1.620 190 H VAL 21 HN VAL 21 6.270 7.518 3.563 191 HA VAL 21 HA VAL 21 4.617 9.716 3.281 192 HB VAL 21 HB VAL 21 2.828 8.378 3.699 193 1HG1 VAL 21 1HG1 VAL 21 4.920 6.610 2.620 194 2HG1 VAL 21 3HG1 VAL 21 3.183 6.283 2.537 195 3HG1 VAL 21 2HG1 VAL 21 3.835 7.720 1.738 196 1HG2 VAL 21 3HG2 VAL 21 4.517 6.488 5.296 197 2HG2 VAL 21 2HG2 VAL 21 3.217 7.581 5.833 198 3HG2 VAL 21 1HG2 VAL 21 2.831 6.205 4.795 199 H ALA 22 HN ALA 22 6.065 8.402 6.135 200 HA ALA 22 HA ALA 22 4.478 9.671 8.060 201 1HB ALA 22 HB2 ALA 22 7.362 8.868 8.198 202 2HB ALA 22 HB1 ALA 22 6.305 9.177 9.599 203 3HB ALA 22 HB3 ALA 22 5.980 7.830 8.497 204 H ARG 23 HN ARG 23 7.595 10.675 6.617 205 HA ARG 23 HA ARG 23 7.689 13.160 7.948 206 1HB ARG 23 HB2 ARG 23 9.468 13.800 6.383 207 2HB ARG 23 HB1 ARG 23 9.724 12.210 7.079 208 1HG ARG 23 HG2 ARG 23 8.968 11.172 5.026 209 2HG ARG 23 HG1 ARG 23 8.634 12.756 4.336 210 1HD ARG 23 HD2 ARG 23 10.800 11.793 3.590 211 2HD ARG 23 HD1 ARG 23 10.958 13.354 4.386 212 HE ARG 23 HE ARG 23 11.399 11.831 6.438 213 1HH1 ARG 23 1HH1 ARG 23 12.614 11.283 3.150 214 2HH1 ARG 23 2HH1 ARG 23 14.029 10.504 3.669 215 1HH2 ARG 23 1HH2 ARG 23 13.327 10.850 7.119 216 2HH2 ARG 23 2HH2 ARG 23 14.471 10.265 5.986 217 H HIS 24 HN HIS 24 5.956 12.161 5.227 218 HA HIS 24 HA HIS 24 5.344 14.554 3.965 219 1HB HIS 24 HB2 HIS 24 4.474 12.604 2.953 220 2HB HIS 24 HB1 HIS 24 3.809 12.017 4.465 221 HD1 HIS 24 HD1 HIS 24 1.360 12.306 4.728 222 HD2 HIS 24 HD2 HIS 24 2.939 14.891 1.899 223 HE1 HIS 24 HE1 HIS 24 -0.589 13.523 3.735 224 H GLY 25 HN GLY 25 4.116 13.222 6.977 225 1HA GLY 25 HA1 GLY 25 2.503 15.654 7.348 226 2HA GLY 25 HA2 GLY 25 3.691 15.214 8.564 227 H LEU 26 HN LEU 26 3.202 12.364 8.426 228 HA LEU 26 HA LEU 26 0.405 12.182 9.186 229 1HB LEU 26 HB2 LEU 26 2.518 10.075 8.882 230 2HB LEU 26 HB1 LEU 26 0.962 9.722 9.570 231 HG LEU 26 HG LEU 26 1.619 10.584 6.850 232 1HD1 LEU 26 HD1 LEU 26 1.981 8.248 7.300 233 2HD1 LEU 26 HD1 LEU 26 0.327 8.053 7.840 234 3HD1 LEU 26 HD1 LEU 26 0.658 8.448 6.149 235 1HD2 LEU 26 HD2 LEU 26 -1.122 10.345 8.059 236 2HD2 LEU 26 HD2 LEU 26 -0.374 11.766 7.324 237 3HD2 LEU 26 HD2 LEU 26 -0.815 10.396 6.321 238 H ASP 27 HN ASP 27 -0.291 11.485 11.082 239 HA ASP 27 HA ASP 27 1.232 12.149 13.425 240 1HB ASP 27 HB2 ASP 27 -1.424 10.711 13.083 241 2HB ASP 27 HB1 ASP 27 -0.754 11.231 14.617 242 H HIS 28 HN HIS 28 1.427 10.369 15.173 243 HA HIS 28 HA HIS 28 2.915 8.253 14.062 244 1HB HIS 28 HB2 HIS 28 1.864 8.647 16.863 245 2HB HIS 28 HB1 HIS 28 2.844 7.260 16.397 246 HD1 HIS 28 HD1 HIS 28 5.358 7.708 15.896 247 HD2 HIS 28 HD2 HIS 28 3.201 11.048 17.077 248 HE1 HIS 28 HE1 HIS 28 7.057 9.465 16.451 249 H ASP 29 HN ASP 29 -0.335 8.457 15.302 250 HA ASP 29 HA ASP 29 -1.008 5.755 15.111 251 1HB ASP 29 HB2 ASP 29 -2.804 8.169 14.734 252 2HB ASP 29 HB1 ASP 29 -3.386 6.524 14.890 253 H LYS 30 HN LYS 30 -1.078 8.326 12.755 254 HA LYS 30 HA LYS 30 -2.294 6.886 10.657 255 1HB LYS 30 HB2 LYS 30 -0.452 9.269 10.650 256 2HB LYS 30 HB1 LYS 30 -1.063 8.624 9.162 257 1HG LYS 30 HG2 LYS 30 -2.786 9.580 11.432 258 2HG LYS 30 HG1 LYS 30 -2.329 10.565 10.031 259 1HD LYS 30 HD2 LYS 30 -3.405 8.845 8.583 260 2HD LYS 30 HD1 LYS 30 -3.951 8.013 10.039 261 1HE LYS 30 HE2 LYS 30 -5.200 9.987 10.711 262 2HE LYS 30 HE1 LYS 30 -4.637 10.845 9.278 263 1HZ LYS 30 HZ3 LYS 30 -5.780 9.194 7.915 264 2HZ LYS 30 HZ2 LYS 30 -6.335 8.412 9.304 265 3HZ LYS 30 HZ1 LYS 30 -6.855 9.963 8.963 266 H VAL 31 HN VAL 31 1.118 7.460 11.417 267 HA VAL 31 HA VAL 31 2.261 5.992 9.335 268 HB VAL 31 HB VAL 31 3.337 6.416 12.150 269 1HG1 VAL 31 3HG1 VAL 31 4.546 4.655 11.003 270 2HG1 VAL 31 2HG1 VAL 31 4.814 5.726 9.626 271 3HG1 VAL 31 1HG1 VAL 31 5.551 6.096 11.183 272 1HG2 VAL 31 3HG2 VAL 31 2.801 8.521 11.063 273 2HG2 VAL 31 2HG2 VAL 31 4.548 8.313 11.204 274 3HG2 VAL 31 1HG2 VAL 31 3.749 8.050 9.655 275 H LEU 32 HN LEU 32 1.301 5.032 12.587 276 HA LEU 32 HA LEU 32 2.188 2.369 12.433 277 1HB LEU 32 HB2 LEU 32 0.029 3.548 14.163 278 2HB LEU 32 HB1 LEU 32 0.807 1.999 14.408 279 HG LEU 32 HG LEU 32 2.095 4.708 14.614 280 1HD1 LEU 32 HD1 LEU 32 1.481 2.651 16.697 281 2HD1 LEU 32 HD1 LEU 32 2.403 4.139 16.949 282 3HD1 LEU 32 HD1 LEU 32 0.704 4.219 16.475 283 1HD2 LEU 32 HD2 LEU 32 3.331 1.980 14.945 284 2HD2 LEU 32 HD2 LEU 32 3.678 3.180 13.690 285 3HD2 LEU 32 HD2 LEU 32 4.096 3.519 15.367 286 H LEU 33 HN LEU 33 -1.102 3.713 12.045 287 HA LEU 33 HA LEU 33 -2.304 1.241 11.480 288 1HB LEU 33 HB2 LEU 33 -3.128 3.999 10.582 289 2HB LEU 33 HB1 LEU 33 -4.132 2.569 10.451 290 HG LEU 33 HG LEU 33 -3.170 3.801 13.037 291 1HD1 LEU 33 HD1 LEU 33 -5.885 3.873 11.736 292 2HD1 LEU 33 HD1 LEU 33 -5.497 4.481 13.344 293 3HD1 LEU 33 HD1 LEU 33 -4.772 5.231 11.926 294 1HD2 LEU 33 HD2 LEU 33 -5.110 1.539 12.534 295 2HD2 LEU 33 HD2 LEU 33 -3.504 1.388 13.241 296 3HD2 LEU 33 HD2 LEU 33 -4.764 2.267 14.100 297 H PHE 34 HN PHE 34 -0.832 3.626 9.340 298 HA PHE 34 HA PHE 34 -1.467 2.402 6.908 299 1HB PHE 34 HB2 PHE 34 -0.672 4.638 6.883 300 2HB PHE 34 HB1 PHE 34 0.823 4.204 7.706 301 HD1 PHE 34 HD1 PHE 34 2.731 3.680 6.471 302 HD2 PHE 34 HD2 PHE 34 -1.057 3.715 4.537 303 HE1 PHE 34 HE1 PHE 34 3.840 3.393 4.280 304 HE2 PHE 34 HE2 PHE 34 0.063 3.429 2.361 305 HZ PHE 34 HZ PHE 34 2.529 3.268 2.267 306 H SER 35 HN SER 35 1.456 2.124 8.904 307 HA SER 35 HA SER 35 2.762 0.383 7.168 308 1HB SER 35 HB2 SER 35 4.230 -0.105 9.165 309 2HB SER 35 HB1 SER 35 4.051 1.595 8.718 310 HG SER 35 HG SER 35 2.798 1.953 10.407 311 H ARG 36 HN ARG 36 0.545 -0.257 9.784 312 HA ARG 36 HA ARG 36 0.971 -3.059 9.938 313 1HB ARG 36 HB2 ARG 36 -1.465 -1.420 10.648 314 2HB ARG 36 HB1 ARG 36 -1.235 -3.114 11.080 315 1HG ARG 36 HG2 ARG 36 0.680 -2.544 12.420 316 2HG ARG 36 HG1 ARG 36 0.553 -0.874 11.838 317 1HD ARG 36 HD2 ARG 36 -0.320 -1.056 14.092 318 2HD ARG 36 HD1 ARG 36 -1.578 -0.611 12.950 319 HE ARG 36 HE ARG 36 -1.492 -3.414 13.393 320 1HH1 ARG 36 1HH1 ARG 36 -2.471 -0.371 14.888 321 2HH1 ARG 36 2HH1 ARG 36 -3.746 -1.016 15.800 322 1HH2 ARG 36 1HH2 ARG 36 -3.233 -4.364 14.741 323 2HH2 ARG 36 2HH2 ARG 36 -4.193 -3.355 15.714 324 H ASP 37 HN ASP 37 -1.353 -1.087 8.150 325 HA ASP 37 HA ASP 37 -2.638 -3.389 7.033 326 1HB ASP 37 HB2 ASP 37 -3.600 -1.043 7.432 327 2HB ASP 37 HB1 ASP 37 -2.820 -0.606 5.933 328 H LEU 38 HN LEU 38 -0.122 -1.205 6.063 329 HA LEU 38 HA LEU 38 0.258 -2.040 3.407 330 1HB LEU 38 HB2 LEU 38 1.309 -0.046 4.142 331 2HB LEU 38 HB1 LEU 38 2.058 -0.852 5.497 332 HG LEU 38 HG LEU 38 3.637 -1.958 4.005 333 1HD1 LEU 38 HD1 LEU 38 2.294 -0.427 1.791 334 2HD1 LEU 38 HD1 LEU 38 3.788 -1.375 1.689 335 3HD1 LEU 38 HD1 LEU 38 2.263 -2.186 2.035 336 1HD2 LEU 38 HD2 LEU 38 3.433 1.008 3.577 337 2HD2 LEU 38 HD2 LEU 38 4.223 0.189 4.922 338 3HD2 LEU 38 HD2 LEU 38 4.866 0.027 3.289 339 H ASP 39 HN ASP 39 1.701 -3.115 6.434 340 HA ASP 39 HA ASP 39 3.416 -5.118 5.565 341 1HB ASP 39 HB2 ASP 39 3.173 -4.203 7.886 342 2HB ASP 39 HB1 ASP 39 1.676 -5.109 8.039 343 H LYS 40 HN LYS 40 0.077 -5.276 6.573 344 HA LYS 40 HA LYS 40 -0.465 -7.975 6.051 345 1HB LYS 40 HB2 LYS 40 -2.237 -5.557 6.219 346 2HB LYS 40 HB1 LYS 40 -2.849 -7.195 6.045 347 1HG LYS 40 HG2 LYS 40 -2.001 -7.836 8.174 348 2HG LYS 40 HG1 LYS 40 -1.020 -6.379 8.288 349 1HD LYS 40 HD2 LYS 40 -3.054 -6.330 9.724 350 2HD LYS 40 HD1 LYS 40 -2.972 -5.005 8.571 351 1HE LYS 40 HE2 LYS 40 -5.228 -5.938 8.733 352 2HE LYS 40 HE1 LYS 40 -4.548 -6.142 7.123 353 1HZ LYS 40 HZ2 LYS 40 -4.663 -8.240 9.225 354 2HZ LYS 40 HZ1 LYS 40 -5.701 -8.101 7.897 355 3HZ LYS 40 HZ3 LYS 40 -4.066 -8.450 7.659 356 H LEU 41 HN LEU 41 -0.821 -5.113 4.006 357 HA LEU 41 HA LEU 41 -2.138 -6.349 1.857 358 1HB LEU 41 HB2 LEU 41 -2.170 -3.964 2.039 359 2HB LEU 41 HB1 LEU 41 -0.420 -3.882 1.987 360 HG LEU 41 HG LEU 41 -0.439 -4.550 -0.366 361 1HD1 LEU 41 HD1 LEU 41 -3.439 -4.582 -0.126 362 2HD1 LEU 41 HD1 LEU 41 -2.518 -4.696 -1.622 363 3HD1 LEU 41 HD1 LEU 41 -2.384 -5.965 -0.406 364 1HD2 LEU 41 HD2 LEU 41 -2.291 -2.262 0.256 365 2HD2 LEU 41 HD2 LEU 41 -0.531 -2.189 0.135 366 3HD2 LEU 41 HD2 LEU 41 -1.508 -2.544 -1.296 367 H ILE 42 HN ILE 42 1.250 -5.918 2.555 368 HA ILE 42 HA ILE 42 2.129 -6.988 0.058 369 HB ILE 42 HB ILE 42 3.632 -6.813 2.704 370 1HG1 ILE 42 2HG1 ILE 42 3.651 -4.997 0.302 371 2HG1 ILE 42 1HG1 ILE 42 2.851 -4.640 1.828 372 1HG2 ILE 42 2HG2 ILE 42 4.645 -7.234 -0.107 373 2HG2 ILE 42 1HG2 ILE 42 5.653 -7.003 1.322 374 3HG2 ILE 42 3HG2 ILE 42 4.640 -8.441 1.182 375 1HD1 ILE 42 HD1 ILE 42 5.808 -5.033 1.446 376 2HD1 ILE 42 HD1 ILE 42 4.979 -3.476 1.613 377 3HD1 ILE 42 HD1 ILE 42 4.969 -4.626 2.946 378 H ASN 43 HN ASN 43 1.911 -8.360 3.281 379 HA ASN 43 HA ASN 43 2.561 -11.012 2.772 380 1HB ASN 43 HB2 ASN 43 0.469 -10.002 4.713 381 2HB ASN 43 HB1 ASN 43 1.168 -11.611 4.730 382 1HD2 ASN 43 HD2 ASN 43 1.160 -9.605 6.782 383 2HD2 ASN 43 HD2 ASN 43 2.799 -9.225 7.147 384 H LYS 44 HN LYS 44 -0.413 -9.337 2.245 385 HA LYS 44 HA LYS 44 -2.230 -11.382 1.700 386 1HB LYS 44 HB2 LYS 44 -2.812 -9.015 1.925 387 2HB LYS 44 HB1 LYS 44 -1.950 -8.644 0.448 388 1HG LYS 44 HG2 LYS 44 -3.579 -10.030 -0.799 389 2HG LYS 44 HG1 LYS 44 -4.486 -10.252 0.693 390 1HD LYS 44 HD2 LYS 44 -3.910 -7.595 -0.659 391 2HD LYS 44 HD1 LYS 44 -5.448 -8.449 -0.680 392 1HE LYS 44 HE2 LYS 44 -5.547 -8.233 1.784 393 2HE LYS 44 HE1 LYS 44 -4.060 -7.300 1.745 394 1HZ LYS 44 HZ3 LYS 44 -6.592 -6.515 0.402 395 2HZ LYS 44 HZ2 LYS 44 -6.043 -5.875 1.859 396 3HZ LYS 44 HZ1 LYS 44 -5.193 -5.581 0.437 397 H PHE 45 HN PHE 45 -0.014 -9.690 -0.427 398 HA PHE 45 HA PHE 45 -0.731 -11.330 -2.665 399 1HB PHE 45 HB2 PHE 45 1.022 -8.966 -2.243 400 2HB PHE 45 HB1 PHE 45 1.181 -9.892 -3.727 401 HD1 PHE 45 HD1 PHE 45 -0.480 -9.798 -5.405 402 HD2 PHE 45 HD2 PHE 45 -1.153 -7.853 -1.671 403 HE1 PHE 45 HE1 PHE 45 -2.442 -8.671 -6.341 404 HE2 PHE 45 HE2 PHE 45 -3.100 -6.712 -2.620 405 HZ PHE 45 HZ PHE 45 -3.757 -7.123 -4.945 406 H MET 46 HN MET 46 1.843 -11.131 -0.367 407 HA MET 46 HA MET 46 3.702 -12.801 -1.771 408 1HB MET 46 HB2 MET 46 3.488 -12.482 1.227 409 2HB MET 46 HB1 MET 46 4.882 -13.043 0.315 410 1HG MET 46 HG2 MET 46 5.060 -10.750 -0.678 411 2HG MET 46 HG1 MET 46 3.721 -10.289 0.338 412 1HE MET 46 HE2 MET 46 7.421 -11.433 0.244 413 2HE MET 46 HE1 MET 46 7.857 -11.480 1.951 414 3HE MET 46 HE3 MET 46 6.743 -12.673 1.295 415 H ASN 47 HN ASN 47 1.040 -13.328 0.367 416 HA ASN 47 HA ASN 47 -0.262 -15.005 0.866 417 1HB ASN 47 HB2 ASN 47 0.137 -15.979 -1.381 418 2HB ASN 47 HB1 ASN 47 1.509 -16.875 -0.747 419 1HD2 ASN 47 HD2 ASN 47 0.637 -18.883 -1.205 420 2HD2 ASN 47 HD2 ASN 47 -0.723 -19.535 -0.345 421 H VAL 48 HN VAL 48 2.764 -14.732 1.624 422 HA VAL 48 HA VAL 48 2.767 -16.773 3.684 423 HB VAL 48 HB VAL 48 4.974 -15.912 4.390 424 1HG1 VAL 48 2HG1 VAL 48 4.754 -16.449 1.429 425 2HG1 VAL 48 1HG1 VAL 48 6.241 -16.569 2.371 426 3HG1 VAL 48 3HG1 VAL 48 4.893 -17.656 2.707 427 1HG2 VAL 48 1HG2 VAL 48 4.656 -13.979 2.103 428 2HG2 VAL 48 3HG2 VAL 48 4.738 -13.561 3.814 429 3HG2 VAL 48 2HG2 VAL 48 6.151 -14.234 2.996 430 H LYS 49 HN LYS 49 2.202 -16.473 5.676 431 HA LYS 49 HA LYS 49 1.384 -13.753 6.461 432 1HB LYS 49 HB2 LYS 49 0.000 -16.363 7.153 433 2HB LYS 49 HB1 LYS 49 -0.583 -14.737 7.480 434 1HG LYS 49 HG2 LYS 49 -0.858 -14.321 5.101 435 2HG LYS 49 HG1 LYS 49 -0.196 -15.912 4.739 436 1HD LYS 49 HD2 LYS 49 -2.088 -16.901 6.029 437 2HD LYS 49 HD1 LYS 49 -2.771 -15.281 6.162 438 1HE LYS 49 HE2 LYS 49 -3.802 -16.449 4.310 439 2HE LYS 49 HE1 LYS 49 -2.809 -15.121 3.708 440 1HZ LYS 49 HZ3 LYS 49 -1.029 -16.818 3.222 441 2HZ LYS 49 HZ2 LYS 49 -2.082 -18.009 3.711 442 3HZ LYS 49 HZ1 LYS 49 -2.449 -17.098 2.368 443 H ASP 50 HN ASP 50 3.845 -15.059 6.864 444 HA ASP 50 HA ASP 50 4.026 -16.546 9.179 445 1HB ASP 50 HB2 ASP 50 6.465 -16.144 9.093 446 2HB ASP 50 HB1 ASP 50 5.803 -16.659 7.552 447 H LYS 51 HN LYS 51 3.571 -16.029 11.083 448 HA LYS 51 HA LYS 51 3.985 -13.278 11.982 449 1HB LYS 51 HB2 LYS 51 2.538 -13.850 13.896 450 2HB LYS 51 HB1 LYS 51 1.727 -14.101 12.361 451 1HG LYS 51 HG2 LYS 51 2.092 -16.491 12.508 452 2HG LYS 51 HG1 LYS 51 2.990 -16.285 14.007 453 1HD LYS 51 HD2 LYS 51 0.142 -15.349 13.754 454 2HD LYS 51 HD1 LYS 51 0.519 -17.028 14.106 455 1HE LYS 51 HE2 LYS 51 0.061 -15.856 16.186 456 2HE LYS 51 HE1 LYS 51 1.759 -16.290 16.135 457 1HZ LYS 51 HZ3 LYS 51 0.612 -13.597 15.617 458 2HZ LYS 51 HZ2 LYS 51 1.404 -14.110 17.005 459 3HZ LYS 51 HZ1 LYS 51 2.270 -13.970 15.588 460 H VAL 52 HN VAL 52 5.729 -15.747 11.726 461 HA VAL 52 HA VAL 52 6.768 -15.750 14.424 462 HB VAL 52 HB VAL 52 8.277 -17.669 13.665 463 1HG1 VAL 52 3HG1 VAL 52 6.251 -18.038 14.985 464 2HG1 VAL 52 2HG1 VAL 52 5.285 -18.067 13.511 465 3HG1 VAL 52 1HG1 VAL 52 6.476 -19.336 13.814 466 1HG2 VAL 52 1HG2 VAL 52 8.133 -17.297 11.238 467 2HG2 VAL 52 3HG2 VAL 52 7.573 -18.915 11.658 468 3HG2 VAL 52 2HG2 VAL 52 6.405 -17.649 11.282 469 H HIS 53 HN HIS 53 7.433 -13.640 14.216 470 HA HIS 53 HA HIS 53 9.835 -13.113 12.635 471 1HB HIS 53 HB2 HIS 53 8.460 -11.357 14.716 472 2HB HIS 53 HB1 HIS 53 9.731 -10.846 13.627 473 HD1 HIS 53 HD1 HIS 53 8.755 -9.363 11.809 474 HD2 HIS 53 HD2 HIS 53 6.108 -12.343 13.006 475 HE1 HIS 53 HE1 HIS 53 6.659 -9.005 10.500 476 H LYS 54 HN LYS 54 8.675 -13.616 15.737 477 HA LYS 54 HA LYS 54 11.353 -13.947 16.890 478 1HB LYS 54 HB2 LYS 54 10.135 -12.075 17.877 479 2HB LYS 54 HB1 LYS 54 8.755 -13.118 18.169 480 1HG LYS 54 HG2 LYS 54 10.063 -14.423 19.772 481 2HG LYS 54 HG1 LYS 54 11.469 -13.398 19.472 482 1HD LYS 54 HD2 LYS 54 10.420 -12.633 21.474 483 2HD LYS 54 HD1 LYS 54 10.105 -11.445 20.220 484 1HE LYS 54 HE2 LYS 54 8.067 -11.704 21.363 485 2HE LYS 54 HE1 LYS 54 7.876 -12.629 19.878 486 1HZ LYS 54 HZ1 LYS 54 8.547 -13.740 22.543 487 2HZ LYS 54 HZ3 LYS 54 7.053 -13.792 21.820 488 3HZ LYS 54 HZ2 LYS 54 8.289 -14.691 21.169 489 H LEU 55 HN LEU 55 11.682 -16.085 16.910 490 HA LEU 55 HA LEU 55 9.440 -17.856 17.413 491 1HB LEU 55 HB2 LEU 55 12.337 -18.414 16.739 492 2HB LEU 55 HB1 LEU 55 11.217 -19.676 17.184 493 HG LEU 55 HG LEU 55 9.840 -19.042 15.163 494 1HD1 LEU 55 HD1 LEU 55 10.669 -16.790 14.798 495 2HD1 LEU 55 HD1 LEU 55 12.269 -17.430 14.419 496 3HD1 LEU 55 HD1 LEU 55 10.899 -17.791 13.368 497 1HD2 LEU 55 HD2 LEU 55 12.665 -19.975 14.693 498 2HD2 LEU 55 HD2 LEU 55 11.292 -20.979 15.158 499 3HD2 LEU 55 HD2 LEU 55 11.311 -20.187 13.583 500 H GLU 56 HN GLU 56 9.162 -18.975 19.263 501 HA GLU 56 HA GLU 56 10.422 -17.976 21.624 502 1HB GLU 56 HB2 GLU 56 8.751 -20.485 21.319 503 2HB GLU 56 HB1 GLU 56 9.035 -19.580 22.801 504 1HG GLU 56 HG2 GLU 56 7.436 -18.657 20.415 505 2HG GLU 56 HG1 GLU 56 6.798 -19.177 21.971 506 H HIS 57 HN HIS 57 10.428 -20.981 19.822 507 HA HIS 57 HA HIS 57 13.209 -21.488 20.384 508 1HB HIS 57 HB2 HIS 57 11.092 -23.631 20.872 509 2HB HIS 57 HB1 HIS 57 12.825 -23.832 21.012 510 HD1 HIS 57 HD1 HIS 57 9.817 -23.013 22.903 511 HD2 HIS 57 HD2 HIS 57 13.915 -22.582 23.377 512 HE1 HIS 57 HE1 HIS 57 10.185 -22.529 25.348 513 H HIS 58 HN HIS 58 13.815 -23.307 18.847 514 HA HIS 58 HA HIS 58 12.334 -23.086 16.391 515 1HB HIS 58 HB2 HIS 58 14.714 -24.827 17.138 516 2HB HIS 58 HB1 HIS 58 14.003 -24.767 15.534 517 HD1 HIS 58 HD1 HIS 58 16.498 -23.104 17.661 518 HD2 HIS 58 HD2 HIS 58 14.323 -22.199 14.235 519 HE1 HIS 58 HE1 HIS 58 17.696 -21.195 16.554 520 H HIS 59 HN HIS 59 12.745 -25.252 19.044 521 HA HIS 59 HA HIS 59 11.603 -26.984 19.843 522 1HB HIS 59 HB2 HIS 59 9.531 -25.865 17.988 523 2HB HIS 59 HB1 HIS 59 9.215 -27.392 18.800 524 HD1 HIS 59 HD1 HIS 59 9.355 -27.253 21.493 525 HD2 HIS 59 HD2 HIS 59 8.978 -23.660 19.448 526 HE1 HIS 59 HE1 HIS 59 8.545 -25.571 23.191 527 H HIS 60 HN HIS 60 9.923 -28.861 18.531 528 HA HIS 60 HA HIS 60 9.858 -30.607 17.187 529 1HB HIS 60 HB2 HIS 60 12.249 -29.426 15.735 530 2HB HIS 60 HB1 HIS 60 11.418 -30.893 15.228 531 HD1 HIS 60 HD1 HIS 60 11.247 -27.194 14.972 532 HD2 HIS 60 HD2 HIS 60 8.740 -30.445 14.299 533 HE1 HIS 60 HE1 HIS 60 9.343 -26.337 13.585 534 H HIS 61 HN HIS 61 13.000 -29.774 18.447 535 HA HIS 61 HA HIS 61 13.833 -32.460 18.979 536 1HB HIS 61 HB2 HIS 61 14.441 -29.941 20.592 537 2HB HIS 61 HB1 HIS 61 15.272 -31.473 20.767 538 HD1 HIS 61 HD1 HIS 61 17.119 -32.005 19.026 539 HD2 HIS 61 HD2 HIS 61 15.126 -28.427 18.346 540 HE1 HIS 61 HE1 HIS 61 18.473 -30.775 17.292 541 H HIS 62 HN HIS 62 11.955 -30.045 20.612 542 HA HIS 62 HA HIS 62 10.366 -31.961 22.002 543 1HB HIS 62 HB2 HIS 62 11.774 -29.645 23.414 544 2HB HIS 62 HB1 HIS 62 10.416 -30.523 24.089 545 HD1 HIS 62 HD1 HIS 62 10.915 -33.005 24.887 546 HD2 HIS 62 HD2 HIS 62 14.220 -30.804 23.678 547 HE1 HIS 62 HE1 HIS 62 12.935 -34.279 25.685 548 H1 MET 101 HT2 MET 101 9.543 21.275 1.449 549 H2 MET 101 HT1 MET 101 10.847 20.851 0.485 550 H3 MET 101 HT3 MET 101 11.041 21.997 1.712 551 HA MET 101 HA MET 101 9.544 23.494 0.602 552 1HB MET 101 HB2 MET 101 11.934 23.623 -0.008 553 2HB MET 101 HB1 MET 101 11.676 22.447 -1.286 554 1HG MET 101 HG2 MET 101 10.097 24.030 -2.362 555 2HG MET 101 HG1 MET 101 10.517 25.221 -1.133 556 1HE MET 101 HE3 MET 101 13.668 24.663 -0.773 557 2HE MET 101 HE2 MET 101 14.344 25.818 -1.917 558 3HE MET 101 HE1 MET 101 12.989 26.288 -0.894 559 H GLU 102 HN GLU 102 10.187 20.724 -1.633 560 HA GLU 102 HA GLU 102 7.570 21.310 -2.787 561 1HB GLU 102 HB2 GLU 102 9.428 21.548 -4.361 562 2HB GLU 102 HB1 GLU 102 9.995 19.937 -3.970 563 1HG GLU 102 HG2 GLU 102 8.832 20.055 -6.135 564 2HG GLU 102 HG1 GLU 102 8.058 18.953 -5.002 565 H MET 103 HN MET 103 6.027 20.017 -2.044 566 HA MET 103 HA MET 103 6.644 17.475 -0.883 567 1HB MET 103 HB2 MET 103 3.957 18.727 -1.485 568 2HB MET 103 HB1 MET 103 4.180 17.223 -0.610 569 1HG MET 103 HG2 MET 103 5.458 18.473 1.113 570 2HG MET 103 HG1 MET 103 5.072 19.964 0.258 571 1HE MET 103 HE1 MET 103 2.573 20.832 -0.093 572 2HE MET 103 HE3 MET 103 2.015 19.271 -0.702 573 3HE MET 103 HE2 MET 103 1.150 20.067 0.610 574 H GLY 104 HN GLY 104 5.823 18.626 -4.009 575 1HA GLY 104 HA1 GLY 104 5.597 17.567 -5.993 576 2HA GLY 104 HA2 GLY 104 4.720 16.306 -5.126 577 H GLN 105 HN GLN 105 8.058 17.306 -4.582 578 HA GLN 105 HA GLN 105 9.074 15.005 -5.969 579 1HB GLN 105 HB2 GLN 105 10.528 17.096 -4.345 580 2HB GLN 105 HB1 GLN 105 11.275 15.716 -5.165 581 1HG GLN 105 HG2 GLN 105 9.654 17.769 -6.617 582 2HG GLN 105 HG1 GLN 105 11.390 17.917 -6.368 583 1HE2 GLN 105 1HE2 GLN 105 11.898 15.033 -6.668 584 2HE2 GLN 105 2HE2 GLN 105 11.711 14.708 -8.338 585 H LEU 106 HN LEU 106 8.158 15.818 -2.790 586 HA LEU 106 HA LEU 106 9.502 13.686 -1.474 587 1HB LEU 106 HB2 LEU 106 8.597 15.656 -0.277 588 2HB LEU 106 HB1 LEU 106 6.979 15.232 -0.762 589 HG LEU 106 HG LEU 106 7.583 14.803 1.665 590 1HD1 LEU 106 HD1 LEU 106 6.584 12.471 0.081 591 2HD1 LEU 106 HD1 LEU 106 6.425 12.677 1.822 592 3HD1 LEU 106 HD1 LEU 106 5.623 13.801 0.720 593 1HD2 LEU 106 HD2 LEU 106 9.827 13.921 1.335 594 2HD2 LEU 106 HD2 LEU 106 8.813 12.751 2.179 595 3HD2 LEU 106 HD2 LEU 106 9.163 12.535 0.467 596 H LYS 107 HN LYS 107 6.289 14.154 -2.861 597 HA LYS 107 HA LYS 107 5.352 11.529 -2.546 598 1HB LYS 107 HB2 LYS 107 4.448 13.951 -3.735 599 2HB LYS 107 HB1 LYS 107 4.279 12.680 -4.937 600 1HG LYS 107 HG2 LYS 107 3.259 12.401 -2.136 601 2HG LYS 107 HG1 LYS 107 2.288 13.104 -3.419 602 1HD LYS 107 HD2 LYS 107 3.547 10.374 -3.676 603 2HD LYS 107 HD1 LYS 107 1.947 10.599 -2.938 604 1HE LYS 107 HE2 LYS 107 1.250 11.700 -5.065 605 2HE LYS 107 HE1 LYS 107 2.822 11.292 -5.743 606 1HZ LYS 107 HZ3 LYS 107 0.836 9.316 -4.732 607 2HZ LYS 107 HZ2 LYS 107 1.101 9.695 -6.336 608 3HZ LYS 107 HZ1 LYS 107 2.298 8.928 -5.450 609 H ASN 108 HN ASN 108 7.293 13.069 -4.951 610 HA ASN 108 HA ASN 108 7.474 11.129 -6.961 611 1HB ASN 108 HB2 ASN 108 8.411 13.411 -7.099 612 2HB ASN 108 HB1 ASN 108 9.626 12.972 -5.904 613 1HD2 ASN 108 HD2 ASN 108 8.711 12.956 -9.130 614 2HD2 ASN 108 HD2 ASN 108 10.125 12.210 -9.785 615 H LYS 109 HN LYS 109 9.415 11.585 -4.017 616 HA LYS 109 HA LYS 109 11.029 9.291 -4.399 617 1HB LYS 109 HB2 LYS 109 10.423 10.799 -1.855 618 2HB LYS 109 HB1 LYS 109 11.683 9.592 -2.035 619 1HG LYS 109 HG2 LYS 109 11.533 12.263 -3.406 620 2HG LYS 109 HG1 LYS 109 12.647 11.779 -2.129 621 1HD LYS 109 HD2 LYS 109 13.567 10.053 -3.661 622 2HD LYS 109 HD1 LYS 109 12.527 10.687 -4.940 623 1HE LYS 109 HE2 LYS 109 13.601 12.892 -4.665 624 2HE LYS 109 HE1 LYS 109 14.696 12.186 -3.479 625 1HZ LYS 109 HZ3 LYS 109 15.396 10.613 -5.287 626 2HZ LYS 109 HZ2 LYS 109 14.512 11.562 -6.369 627 3HZ LYS 109 HZ1 LYS 109 15.809 12.230 -5.548 628 H ILE 110 HN ILE 110 8.016 9.882 -2.767 629 HA ILE 110 HA ILE 110 7.759 7.374 -1.553 630 HB ILE 110 HB ILE 110 5.711 9.396 -2.460 631 1HG1 ILE 110 2HG1 ILE 110 6.684 8.536 0.264 632 2HG1 ILE 110 1HG1 ILE 110 7.172 9.989 -0.591 633 1HG2 ILE 110 3HG2 ILE 110 4.615 7.218 -2.583 634 2HG2 ILE 110 2HG2 ILE 110 5.147 6.844 -0.944 635 3HG2 ILE 110 1HG2 ILE 110 3.991 8.151 -1.219 636 1HD1 ILE 110 HD1 ILE 110 4.407 9.353 0.397 637 2HD1 ILE 110 HD1 ILE 110 5.559 10.477 1.131 638 3HD1 ILE 110 HD1 ILE 110 4.895 10.812 -0.462 639 H GLU 111 HN GLU 111 6.629 8.557 -4.689 640 HA GLU 111 HA GLU 111 5.580 6.195 -5.744 641 1HB GLU 111 HB2 GLU 111 7.132 8.371 -7.172 642 2HB GLU 111 HB1 GLU 111 6.171 7.132 -7.964 643 1HG GLU 111 HG2 GLU 111 5.098 9.178 -6.052 644 2HG GLU 111 HG1 GLU 111 5.019 9.348 -7.792 645 H ASN 112 HN ASN 112 8.838 7.468 -5.896 646 HA ASN 112 HA ASN 112 10.117 5.443 -7.260 647 1HB ASN 112 HB2 ASN 112 11.294 7.490 -6.866 648 2HB ASN 112 HB1 ASN 112 11.132 7.312 -5.123 649 1HD2 ASN 112 HD2 ASN 112 12.563 6.058 -4.022 650 2HD2 ASN 112 HD2 ASN 112 13.914 5.265 -4.706 651 H LYS 113 HN LYS 113 9.757 5.752 -3.745 652 HA LYS 113 HA LYS 113 11.242 3.407 -3.170 653 1HB LYS 113 HB2 LYS 113 10.760 5.446 -1.670 654 2HB LYS 113 HB1 LYS 113 9.226 4.667 -1.348 655 1HG LYS 113 HG2 LYS 113 10.805 4.171 0.416 656 2HG LYS 113 HG1 LYS 113 10.378 2.704 -0.467 657 1HD LYS 113 HD2 LYS 113 12.782 2.819 0.017 658 2HD LYS 113 HD1 LYS 113 12.476 2.817 -1.712 659 1HE LYS 113 HE2 LYS 113 12.756 5.219 -1.761 660 2HE LYS 113 HE1 LYS 113 13.083 5.248 -0.018 661 1HZ LYS 113 HZ1 LYS 113 14.655 3.910 -2.140 662 2HZ LYS 113 HZ3 LYS 113 15.098 5.312 -1.311 663 3HZ LYS 113 HZ2 LYS 113 15.042 3.862 -0.461 664 H LYS 114 HN LYS 114 7.817 4.158 -3.345 665 HA LYS 114 HA LYS 114 6.615 1.805 -2.638 666 1HB LYS 114 HB2 LYS 114 5.519 3.951 -3.175 667 2HB LYS 114 HB1 LYS 114 5.929 3.738 -4.857 668 1HG LYS 114 HG2 LYS 114 4.448 1.761 -4.920 669 2HG LYS 114 HG1 LYS 114 4.019 2.064 -3.236 670 1HD LYS 114 HD2 LYS 114 2.281 3.049 -4.545 671 2HD LYS 114 HD1 LYS 114 3.288 4.383 -3.973 672 1HE LYS 114 HE2 LYS 114 4.495 4.302 -6.159 673 2HE LYS 114 HE1 LYS 114 3.315 3.077 -6.645 674 1HZ LYS 114 HZ2 LYS 114 1.533 4.849 -6.329 675 2HZ LYS 114 HZ1 LYS 114 2.739 5.944 -5.968 676 3HZ LYS 114 HZ3 LYS 114 2.667 5.259 -7.479 677 H LYS 115 HN LYS 115 7.779 2.891 -5.807 678 HA LYS 115 HA LYS 115 7.223 0.508 -7.174 679 1HB LYS 115 HB2 LYS 115 9.088 2.773 -7.855 680 2HB LYS 115 HB1 LYS 115 8.770 1.429 -8.943 681 1HG LYS 115 HG2 LYS 115 6.425 1.999 -9.042 682 2HG LYS 115 HG1 LYS 115 6.642 3.240 -7.819 683 1HD LYS 115 HD2 LYS 115 6.510 4.407 -9.838 684 2HD LYS 115 HD1 LYS 115 8.216 4.374 -9.464 685 1HE LYS 115 HE2 LYS 115 6.852 2.490 -11.408 686 2HE LYS 115 HE1 LYS 115 7.684 3.965 -11.866 687 1HZ LYS 115 HZ1 LYS 115 9.762 2.972 -10.981 688 2HZ LYS 115 HZ3 LYS 115 8.923 1.521 -10.684 689 3HZ LYS 115 HZ2 LYS 115 9.085 2.094 -12.239 690 H GLU 116 HN GLU 116 10.185 1.632 -5.573 691 HA GLU 116 HA GLU 116 11.883 -0.493 -6.297 692 1HB GLU 116 HB2 GLU 116 11.757 1.076 -3.707 693 2HB GLU 116 HB1 GLU 116 12.984 -0.131 -4.037 694 1HG GLU 116 HG2 GLU 116 13.706 1.282 -5.964 695 2HG GLU 116 HG1 GLU 116 12.540 2.497 -5.418 696 H LEU 117 HN LEU 117 9.497 -0.206 -3.772 697 HA LEU 117 HA LEU 117 10.027 -2.720 -2.592 698 1HB LEU 117 HB2 LEU 117 9.148 -1.108 -1.166 699 2HB LEU 117 HB1 LEU 117 7.890 -0.634 -2.286 700 HG LEU 117 HG LEU 117 7.105 -1.762 -0.212 701 1HD1 LEU 117 HD1 LEU 117 5.724 -1.603 -2.022 702 2HD1 LEU 117 HD1 LEU 117 6.340 -3.113 -2.688 703 3HD1 LEU 117 HD1 LEU 117 5.468 -3.120 -1.140 704 1HD2 LEU 117 HD2 LEU 117 8.432 -4.185 -1.370 705 2HD2 LEU 117 HD2 LEU 117 8.902 -3.354 0.114 706 3HD2 LEU 117 HD2 LEU 117 7.337 -4.166 0.017 707 H ILE 118 HN ILE 118 7.619 -1.553 -4.877 708 HA ILE 118 HA ILE 118 6.056 -3.792 -4.983 709 HB ILE 118 HB ILE 118 6.729 -1.889 -7.260 710 1HG1 ILE 118 2HG1 ILE 118 4.243 -2.042 -5.551 711 2HG1 ILE 118 1HG1 ILE 118 5.614 -1.002 -5.185 712 1HG2 ILE 118 1HG2 ILE 118 5.880 -3.988 -8.209 713 2HG2 ILE 118 3HG2 ILE 118 4.477 -3.920 -7.148 714 3HG2 ILE 118 2HG2 ILE 118 4.694 -2.701 -8.397 715 1HD1 ILE 118 HD1 ILE 118 3.981 -0.870 -7.707 716 2HD1 ILE 118 HD1 ILE 118 3.796 0.185 -6.295 717 3HD1 ILE 118 HD1 ILE 118 5.290 0.205 -7.223 718 H GLN 119 HN GLN 119 8.967 -2.995 -6.728 719 HA GLN 119 HA GLN 119 9.206 -5.266 -8.361 720 1HB GLN 119 HB2 GLN 119 11.341 -3.460 -7.225 721 2HB GLN 119 HB1 GLN 119 11.593 -4.618 -8.526 722 1HG GLN 119 HG2 GLN 119 10.071 -3.432 -9.948 723 2HG GLN 119 HG1 GLN 119 9.634 -2.343 -8.641 724 1HE2 GLN 119 1HE2 GLN 119 10.677 -1.743 -11.223 725 2HE2 GLN 119 2HE2 GLN 119 12.142 -0.857 -11.021 726 H LEU 120 HN LEU 120 10.163 -4.668 -5.038 727 HA LEU 120 HA LEU 120 11.624 -7.088 -4.779 728 1HB LEU 120 HB2 LEU 120 10.508 -5.259 -2.663 729 2HB LEU 120 HB1 LEU 120 11.516 -6.653 -2.323 730 HG LEU 120 HG LEU 120 12.347 -4.183 -3.857 731 1HD1 LEU 120 HD1 LEU 120 12.141 -3.822 -1.470 732 2HD1 LEU 120 HD1 LEU 120 13.164 -5.222 -1.155 733 3HD1 LEU 120 HD1 LEU 120 13.834 -3.813 -1.969 734 1HD2 LEU 120 HD2 LEU 120 13.929 -6.653 -3.138 735 2HD2 LEU 120 HD2 LEU 120 13.466 -6.138 -4.762 736 3HD2 LEU 120 HD2 LEU 120 14.595 -5.171 -3.823 737 H VAL 121 HN VAL 121 8.337 -6.110 -3.696 738 HA VAL 121 HA VAL 121 7.569 -8.637 -2.750 739 HB VAL 121 HB VAL 121 5.746 -6.706 -4.204 740 1HG1 VAL 121 1HG1 VAL 121 4.751 -8.885 -3.742 741 2HG1 VAL 121 3HG1 VAL 121 5.153 -8.720 -2.032 742 3HG1 VAL 121 2HG1 VAL 121 3.988 -7.622 -2.770 743 1HG2 VAL 121 2HG2 VAL 121 6.589 -6.705 -1.319 744 2HG2 VAL 121 1HG2 VAL 121 6.982 -5.505 -2.556 745 3HG2 VAL 121 3HG2 VAL 121 5.316 -5.695 -2.016 746 H ALA 122 HN ALA 122 7.576 -7.330 -5.996 747 HA ALA 122 HA ALA 122 6.181 -9.348 -7.305 748 1HB ALA 122 HB3 ALA 122 8.368 -7.583 -8.371 749 2HB ALA 122 HB2 ALA 122 7.205 -8.489 -9.356 750 3HB ALA 122 HB1 ALA 122 6.655 -7.186 -8.301 751 H ARG 123 HN ARG 123 9.677 -8.943 -6.792 752 HA ARG 123 HA ARG 123 10.344 -11.353 -8.164 753 1HB ARG 123 HB2 ARG 123 12.624 -10.988 -7.454 754 2HB ARG 123 HB1 ARG 123 11.934 -9.487 -8.057 755 1HG ARG 123 HG2 ARG 123 11.593 -8.737 -5.770 756 2HG ARG 123 HG1 ARG 123 12.279 -10.244 -5.162 757 1HD ARG 123 HD2 ARG 123 13.712 -8.200 -6.859 758 2HD ARG 123 HD1 ARG 123 13.946 -8.463 -5.130 759 HE ARG 123 HE ARG 123 14.450 -10.876 -6.045 760 1HH1 ARG 123 1HH1 ARG 123 15.627 -7.731 -7.194 761 2HH1 ARG 123 2HH1 ARG 123 17.025 -8.360 -7.915 762 1HH2 ARG 123 1HH2 ARG 123 16.380 -11.735 -7.037 763 2HH2 ARG 123 2HH2 ARG 123 17.468 -10.697 -7.818 764 H HIS 124 HN HIS 124 9.093 -10.823 -5.118 765 HA HIS 124 HA HIS 124 10.228 -12.967 -3.677 766 1HB HIS 124 HB2 HIS 124 8.861 -11.357 -2.448 767 2HB HIS 124 HB1 HIS 124 7.536 -11.593 -3.533 768 HD1 HIS 124 HD1 HIS 124 9.289 -13.570 -0.690 769 HD2 HIS 124 HD2 HIS 124 5.812 -13.399 -2.899 770 HE1 HIS 124 HE1 HIS 124 7.771 -15.255 0.336 771 H GLY 125 HN GLY 125 7.602 -12.713 -5.950 772 1HA GLY 125 HA1 GLY 125 7.094 -15.576 -5.810 773 2HA GLY 125 HA2 GLY 125 7.733 -14.952 -7.325 774 H LEU 126 HN LEU 126 6.378 -12.503 -7.474 775 HA LEU 126 HA LEU 126 3.600 -13.282 -7.340 776 1HB LEU 126 HB2 LEU 126 4.896 -10.657 -7.831 777 2HB LEU 126 HB1 LEU 126 3.210 -10.891 -8.144 778 HG LEU 126 HG LEU 126 4.666 -10.971 -5.599 779 1HD1 LEU 126 HD1 LEU 126 2.390 -9.288 -6.575 780 2HD1 LEU 126 HD1 LEU 126 2.962 -9.275 -4.914 781 3HD1 LEU 126 HD1 LEU 126 4.039 -8.776 -6.228 782 1HD2 LEU 126 HD2 LEU 126 1.867 -11.970 -6.049 783 2HD2 LEU 126 HD2 LEU 126 3.246 -12.841 -5.365 784 3HD2 LEU 126 HD2 LEU 126 2.503 -11.526 -4.471 785 H ASP 127 HN ASP 127 2.342 -13.427 -8.957 786 HA ASP 127 HA ASP 127 3.352 -13.838 -11.623 787 1HB ASP 127 HB2 ASP 127 0.459 -13.261 -10.879 788 2HB ASP 127 HB1 ASP 127 1.036 -14.004 -12.351 789 H HIS 128 HN HIS 128 2.608 -12.409 -13.458 790 HA HIS 128 HA HIS 128 3.237 -9.742 -12.890 791 1HB HIS 128 HB2 HIS 128 2.017 -10.955 -15.364 792 2HB HIS 128 HB1 HIS 128 2.339 -9.230 -15.233 793 HD1 HIS 128 HD1 HIS 128 4.917 -8.528 -15.055 794 HD2 HIS 128 HD2 HIS 128 4.194 -12.533 -15.911 795 HE1 HIS 128 HE1 HIS 128 7.088 -9.463 -15.869 796 H ASP 129 HN ASP 129 0.102 -11.317 -13.041 797 HA ASP 129 HA ASP 129 -1.446 -8.956 -13.016 798 1HB ASP 129 HB2 ASP 129 -3.319 -10.298 -12.318 799 2HB ASP 129 HB1 ASP 129 -2.390 -11.243 -13.481 800 H LYS 130 HN LYS 130 0.037 -10.853 -10.556 801 HA LYS 130 HA LYS 130 -1.170 -9.719 -8.283 802 1HB LYS 130 HB2 LYS 130 1.485 -10.967 -8.717 803 2HB LYS 130 HB1 LYS 130 0.917 -10.629 -7.100 804 1HG LYS 130 HG2 LYS 130 -0.283 -12.464 -9.164 805 2HG LYS 130 HG1 LYS 130 0.606 -12.961 -7.710 806 1HD LYS 130 HD2 LYS 130 -1.195 -12.039 -6.351 807 2HD LYS 130 HD1 LYS 130 -2.046 -11.508 -7.797 808 1HE LYS 130 HE2 LYS 130 -1.405 -14.329 -6.984 809 2HE LYS 130 HE1 LYS 130 -3.002 -13.585 -7.052 810 1HZ LYS 130 HZ3 LYS 130 -2.451 -13.287 -9.569 811 2HZ LYS 130 HZ2 LYS 130 -1.256 -14.459 -9.284 812 3HZ LYS 130 HZ1 LYS 130 -2.856 -14.836 -8.991 813 H VAL 131 HN VAL 131 1.835 -8.962 -9.960 814 HA VAL 131 HA VAL 131 2.663 -6.838 -8.356 815 HB VAL 131 HB VAL 131 3.079 -7.059 -11.346 816 1HG1 VAL 131 1HG1 VAL 131 3.803 -4.944 -10.425 817 2HG1 VAL 131 3HG1 VAL 131 4.769 -5.783 -9.214 818 3HG1 VAL 131 2HG1 VAL 131 5.191 -5.915 -10.919 819 1HG2 VAL 131 1HG2 VAL 131 4.633 -8.379 -9.131 820 2HG2 VAL 131 3HG2 VAL 131 3.626 -9.183 -10.334 821 3HG2 VAL 131 2HG2 VAL 131 5.096 -8.351 -10.835 822 H LEU 132 HN LEU 132 0.530 -6.918 -11.170 823 HA LEU 132 HA LEU 132 0.117 -4.134 -11.427 824 1HB LEU 132 HB2 LEU 132 -1.774 -6.364 -12.160 825 2HB LEU 132 HB1 LEU 132 -1.833 -4.722 -12.762 826 HG LEU 132 HG LEU 132 0.301 -6.767 -13.324 827 1HD1 LEU 132 HD1 LEU 132 -1.795 -5.533 -15.063 828 2HD1 LEU 132 HD1 LEU 132 -0.504 -6.609 -15.619 829 3HD1 LEU 132 HD1 LEU 132 -1.734 -7.202 -14.491 830 1HD2 LEU 132 HD2 LEU 132 0.084 -3.908 -14.265 831 2HD2 LEU 132 HD2 LEU 132 1.316 -4.587 -13.197 832 3HD2 LEU 132 HD2 LEU 132 1.232 -5.101 -14.880 833 H LEU 133 HN LEU 133 -1.794 -6.650 -9.833 834 HA LEU 133 HA LEU 133 -3.794 -4.942 -8.803 835 1HB LEU 133 HB2 LEU 133 -2.903 -7.712 -8.179 836 2HB LEU 133 HB1 LEU 133 -3.994 -6.889 -7.083 837 HG LEU 133 HG LEU 133 -5.718 -6.798 -8.790 838 1HD1 LEU 133 HD1 LEU 133 -3.718 -8.078 -10.631 839 2HD1 LEU 133 HD1 LEU 133 -5.427 -7.807 -10.975 840 3HD1 LEU 133 HD1 LEU 133 -4.340 -6.432 -10.764 841 1HD2 LEU 133 HD2 LEU 133 -5.531 -8.816 -7.474 842 2HD2 LEU 133 HD2 LEU 133 -6.087 -9.175 -9.112 843 3HD2 LEU 133 HD2 LEU 133 -4.414 -9.493 -8.658 844 H PHE 134 HN PHE 134 -0.739 -6.052 -7.489 845 HA PHE 134 HA PHE 134 -1.175 -5.036 -4.906 846 1HB PHE 134 HB2 PHE 134 0.491 -6.763 -5.268 847 2HB PHE 134 HB1 PHE 134 1.410 -5.704 -6.331 848 HD1 PHE 134 HD1 PHE 134 3.084 -4.357 -5.471 849 HD2 PHE 134 HD2 PHE 134 0.192 -6.026 -2.838 850 HE1 PHE 134 HE1 PHE 134 4.348 -3.507 -3.538 851 HE2 PHE 134 HE2 PHE 134 1.460 -5.181 -0.910 852 HZ PHE 134 HZ PHE 134 3.540 -3.912 -1.279 853 H SER 135 HN SER 135 0.547 -3.699 -7.723 854 HA SER 135 HA SER 135 1.479 -1.435 -6.415 855 1HB SER 135 HB2 SER 135 1.701 -0.484 -8.764 856 2HB SER 135 HB1 SER 135 2.486 -2.038 -8.474 857 HG SER 135 HG SER 135 1.096 -3.023 -9.697 858 H ARG 136 HN ARG 136 -1.538 -1.925 -8.164 859 HA ARG 136 HA ARG 136 -2.355 0.789 -7.828 860 1HB ARG 136 HB2 ARG 136 -4.525 0.073 -8.734 861 2HB ARG 136 HB1 ARG 136 -3.179 -0.479 -9.726 862 1HG ARG 136 HG2 ARG 136 -3.409 -2.685 -8.477 863 2HG ARG 136 HG1 ARG 136 -4.957 -2.060 -7.909 864 1HD ARG 136 HD2 ARG 136 -4.127 -2.401 -10.796 865 2HD ARG 136 HD1 ARG 136 -5.199 -3.462 -9.900 866 HE ARG 136 HE ARG 136 -6.643 -1.399 -9.674 867 1HH1 ARG 136 1HH1 ARG 136 -4.519 -1.854 -12.536 868 2HH1 ARG 136 2HH1 ARG 136 -5.625 -1.156 -13.592 869 1HH2 ARG 136 1HH2 ARG 136 -8.123 -0.440 -11.201 870 2HH2 ARG 136 2HH2 ARG 136 -7.703 -0.342 -12.849 871 H ASP 137 HN ASP 137 -2.690 -2.052 -5.855 872 HA ASP 137 HA ASP 137 -4.773 -0.904 -4.180 873 1HB ASP 137 HB2 ASP 137 -4.156 -3.407 -4.560 874 2HB ASP 137 HB1 ASP 137 -2.940 -3.123 -3.328 875 H LEU 138 HN LEU 138 -1.311 -1.398 -4.069 876 HA LEU 138 HA LEU 138 -0.769 -0.290 -1.566 877 1HB LEU 138 HB2 LEU 138 0.871 -1.610 -2.663 878 2HB LEU 138 HB1 LEU 138 0.843 -0.600 -4.086 879 HG LEU 138 HG LEU 138 2.026 1.165 -2.898 880 1HD1 LEU 138 HD1 LEU 138 2.008 -0.706 -0.544 881 2HD1 LEU 138 HD1 LEU 138 2.901 0.823 -0.693 882 3HD1 LEU 138 HD1 LEU 138 1.138 0.835 -0.681 883 1HD2 LEU 138 HD2 LEU 138 3.287 -1.539 -2.571 884 2HD2 LEU 138 HD2 LEU 138 3.315 -0.531 -4.020 885 3HD2 LEU 138 HD2 LEU 138 4.140 0.006 -2.556 886 H ASP 139 HN ASP 139 -0.871 1.163 -4.784 887 HA ASP 139 HA ASP 139 -0.112 3.762 -4.111 888 1HB ASP 139 HB2 ASP 139 -0.352 2.870 -6.424 889 2HB ASP 139 HB1 ASP 139 -2.102 2.937 -6.231 890 H LYS 140 HN LYS 140 -3.326 2.195 -4.107 891 HA LYS 140 HA LYS 140 -4.924 4.288 -3.492 892 1HB LYS 140 HB2 LYS 140 -5.529 2.152 -4.339 893 2HB LYS 140 HB1 LYS 140 -4.959 1.371 -2.890 894 1HG LYS 140 HG2 LYS 140 -6.535 2.576 -1.578 895 2HG LYS 140 HG1 LYS 140 -7.198 3.306 -3.053 896 1HD LYS 140 HD2 LYS 140 -7.075 0.321 -2.666 897 2HD LYS 140 HD1 LYS 140 -8.413 1.261 -2.028 898 1HE LYS 140 HE2 LYS 140 -9.055 0.323 -4.151 899 2HE LYS 140 HE1 LYS 140 -8.882 2.060 -4.341 900 1HZ LYS 140 HZ2 LYS 140 -6.854 0.041 -5.180 901 2HZ LYS 140 HZ1 LYS 140 -7.977 0.782 -6.168 902 3HZ LYS 140 HZ3 LYS 140 -6.794 1.722 -5.460 903 H LEU 141 HN LEU 141 -3.188 1.938 -1.470 904 HA LEU 141 HA LEU 141 -4.286 2.732 0.999 905 1HB LEU 141 HB2 LEU 141 -3.220 0.547 0.643 906 2HB LEU 141 HB1 LEU 141 -1.678 1.337 0.413 907 HG LEU 141 HG LEU 141 -1.697 2.085 2.744 908 1HD1 LEU 141 HD1 LEU 141 -4.268 0.536 2.935 909 2HD1 LEU 141 HD1 LEU 141 -3.376 1.226 4.293 910 3HD1 LEU 141 HD1 LEU 141 -4.085 2.285 3.073 911 1HD2 LEU 141 HD2 LEU 141 -2.192 -0.858 2.378 912 2HD2 LEU 141 HD2 LEU 141 -0.645 -0.023 2.208 913 3HD2 LEU 141 HD2 LEU 141 -1.434 -0.122 3.788 914 H ILE 142 HN ILE 142 -1.474 3.647 -0.776 915 HA ILE 142 HA ILE 142 -0.397 5.287 1.291 916 HB ILE 142 HB ILE 142 0.193 5.275 -1.689 917 1HG1 ILE 142 2HG1 ILE 142 1.717 4.230 0.695 918 2HG1 ILE 142 1HG1 ILE 142 0.838 3.249 -0.472 919 1HG2 ILE 142 3HG2 ILE 142 1.624 6.765 0.521 920 2HG2 ILE 142 2HG2 ILE 142 2.186 6.625 -1.146 921 3HG2 ILE 142 1HG2 ILE 142 0.688 7.490 -0.787 922 1HD1 ILE 142 HD1 ILE 142 3.249 4.951 -1.052 923 2HD1 ILE 142 HD1 ILE 142 3.241 3.194 -0.853 924 3HD1 ILE 142 HD1 ILE 142 2.386 3.938 -2.205 925 H ASN 143 HN ASN 143 -2.110 6.124 -1.693 926 HA ASN 143 HA ASN 143 -2.452 8.851 -1.225 927 1HB ASN 143 HB2 ASN 143 -4.264 6.925 -2.678 928 2HB ASN 143 HB1 ASN 143 -4.576 8.653 -2.601 929 1HD2 ASN 143 HD2 ASN 143 -4.000 6.866 -4.852 930 2HD2 ASN 143 HD2 ASN 143 -2.636 7.501 -5.662 931 H LYS 144 HN LYS 144 -4.252 6.166 0.054 932 HA LYS 144 HA LYS 144 -6.437 7.462 1.226 933 1HB LYS 144 HB2 LYS 144 -6.170 5.004 1.078 934 2HB LYS 144 HB1 LYS 144 -4.869 5.080 2.251 935 1HG LYS 144 HG2 LYS 144 -6.525 6.001 3.895 936 2HG LYS 144 HG1 LYS 144 -7.791 5.656 2.715 937 1HD LYS 144 HD2 LYS 144 -5.905 3.634 3.943 938 2HD LYS 144 HD1 LYS 144 -7.598 3.852 4.372 939 1HE LYS 144 HE2 LYS 144 -8.235 3.211 2.076 940 2HE LYS 144 HE1 LYS 144 -6.534 2.973 1.682 941 1HZ LYS 144 HZ3 LYS 144 -6.457 1.231 3.434 942 2HZ LYS 144 HZ2 LYS 144 -8.087 1.434 3.703 943 3HZ LYS 144 HZ1 LYS 144 -7.563 0.852 2.227 944 H PHE 145 HN PHE 145 -3.301 6.593 2.642 945 HA PHE 145 HA PHE 145 -3.883 8.065 5.003 946 1HB PHE 145 HB2 PHE 145 -1.587 6.400 4.127 947 2HB PHE 145 HB1 PHE 145 -1.374 7.479 5.502 948 HD1 PHE 145 HD1 PHE 145 -2.423 7.055 7.580 949 HD2 PHE 145 HD2 PHE 145 -3.283 4.583 4.220 950 HE1 PHE 145 HE1 PHE 145 -3.565 5.460 9.049 951 HE2 PHE 145 HE2 PHE 145 -4.417 2.979 5.688 952 HZ PHE 145 HZ PHE 145 -4.565 3.411 8.104 953 H MET 146 HN MET 146 -2.178 8.779 2.104 954 HA MET 146 HA MET 146 -0.872 11.080 3.152 955 1HB MET 146 HB2 MET 146 -1.732 10.649 0.282 956 2HB MET 146 HB1 MET 146 -0.526 11.796 0.841 957 1HG MET 146 HG2 MET 146 0.608 9.550 1.753 958 2HG MET 146 HG1 MET 146 -0.389 8.871 0.500 959 1HE MET 146 HE2 MET 146 2.554 11.118 1.361 960 2HE MET 146 HE1 MET 146 2.957 11.915 -0.158 961 3HE MET 146 HE3 MET 146 1.460 12.321 0.686 962 H ASN 147 HN ASN 147 -4.006 10.242 2.064 963 HA ASN 147 HA ASN 147 -6.039 11.133 2.025 964 1HB ASN 147 HB2 ASN 147 -5.210 12.318 4.198 965 2HB ASN 147 HB1 ASN 147 -4.993 13.740 3.188 966 1HD2 ASN 147 HD2 ASN 147 -6.824 14.874 2.525 967 2HD2 ASN 147 HD2 ASN 147 -8.393 14.535 3.147 968 H VAL 148 HN VAL 148 -4.069 11.362 0.012 969 HA VAL 148 HA VAL 148 -3.562 12.218 -1.999 970 HB VAL 148 HB VAL 148 -6.351 13.320 -2.006 971 1HG1 VAL 148 2HG1 VAL 148 -4.981 14.171 -3.816 972 2HG1 VAL 148 1HG1 VAL 148 -4.517 12.528 -4.267 973 3HG1 VAL 148 3HG1 VAL 148 -6.189 13.060 -4.470 974 1HG2 VAL 148 3HG2 VAL 148 -6.422 10.942 -1.454 975 2HG2 VAL 148 2HG2 VAL 148 -7.048 11.204 -3.084 976 3HG2 VAL 148 1HG2 VAL 148 -5.412 10.581 -2.852 977 H LYS 149 HN LYS 149 -2.135 13.582 -1.997 978 HA LYS 149 HA LYS 149 -2.831 16.319 -1.287 979 1HB LYS 149 HB2 LYS 149 -0.287 14.833 -0.743 980 2HB LYS 149 HB1 LYS 149 -0.387 16.587 -0.663 981 1HG LYS 149 HG2 LYS 149 -2.107 14.694 0.936 982 2HG LYS 149 HG1 LYS 149 -0.654 15.479 1.544 983 1HD LYS 149 HD2 LYS 149 -3.081 16.993 0.522 984 2HD LYS 149 HD1 LYS 149 -2.815 16.584 2.209 985 1HE LYS 149 HE2 LYS 149 -0.909 18.233 0.537 986 2HE LYS 149 HE1 LYS 149 -2.122 18.899 1.620 987 1HZ LYS 149 HZ2 LYS 149 -1.037 17.778 3.464 988 2HZ LYS 149 HZ1 LYS 149 0.150 17.145 2.463 989 3HZ LYS 149 HZ3 LYS 149 0.027 18.804 2.711 990 H ASP 150 HN ASP 150 -2.934 15.055 -3.812 991 HA ASP 150 HA ASP 150 -1.135 16.822 -5.299 992 1HB ASP 150 HB2 ASP 150 -2.985 14.607 -6.262 993 2HB ASP 150 HB1 ASP 150 -2.007 15.619 -7.315 994 H LYS 151 HN LYS 151 -2.009 18.792 -5.622 995 HA LYS 151 HA LYS 151 -4.880 18.988 -5.335 996 1HB LYS 151 HB2 LYS 151 -4.632 21.400 -5.157 997 2HB LYS 151 HB1 LYS 151 -3.566 20.582 -4.037 998 1HG LYS 151 HG2 LYS 151 -1.704 21.016 -5.642 999 2HG LYS 151 HG1 LYS 151 -2.829 21.993 -6.589 1000 1HD LYS 151 HD2 LYS 151 -3.293 23.311 -4.498 1001 2HD LYS 151 HD1 LYS 151 -1.971 22.438 -3.730 1002 1HE LYS 151 HE2 LYS 151 -1.104 24.524 -4.480 1003 2HE LYS 151 HE1 LYS 151 -0.484 23.280 -5.564 1004 1HZ LYS 151 HZ2 LYS 151 -2.239 23.877 -7.149 1005 2HZ LYS 151 HZ1 LYS 151 -2.756 25.105 -6.112 1006 3HZ LYS 151 HZ3 LYS 151 -1.235 25.175 -6.819 1007 H VAL 152 HN VAL 152 -3.152 18.214 -7.686 1008 HA VAL 152 HA VAL 152 -4.472 19.741 -9.746 1009 HB VAL 152 HB VAL 152 -3.334 18.119 -11.353 1010 1HG1 VAL 152 3HG1 VAL 152 -2.329 20.280 -10.802 1011 2HG1 VAL 152 2HG1 VAL 152 -1.549 19.563 -9.392 1012 3HG1 VAL 152 1HG1 VAL 152 -1.084 19.047 -11.013 1013 1HG2 VAL 152 2HG2 VAL 152 -3.097 16.223 -9.771 1014 2HG2 VAL 152 1HG2 VAL 152 -1.551 16.679 -10.496 1015 3HG2 VAL 152 3HG2 VAL 152 -1.932 17.167 -8.847 1016 H HIS 153 HN HIS 153 -6.359 19.212 -10.586 1017 HA HIS 153 HA HIS 153 -7.696 16.889 -9.427 1018 1HB HIS 153 HB2 HIS 153 -8.758 19.372 -10.764 1019 2HB HIS 153 HB1 HIS 153 -9.787 18.032 -10.274 1020 HD1 HIS 153 HD1 HIS 153 -7.768 20.881 -8.855 1021 HD2 HIS 153 HD2 HIS 153 -10.264 17.837 -7.538 1022 HE1 HIS 153 HE1 HIS 153 -8.306 21.409 -6.463 1023 H LYS 154 HN LYS 154 -5.850 16.519 -11.462 1024 HA LYS 154 HA LYS 154 -5.457 15.291 -13.280 1025 1HB LYS 154 HB2 LYS 154 -8.345 14.408 -13.042 1026 2HB LYS 154 HB1 LYS 154 -7.084 13.601 -13.965 1027 1HG LYS 154 HG2 LYS 154 -5.887 13.054 -11.933 1028 2HG LYS 154 HG1 LYS 154 -7.035 13.982 -10.972 1029 1HD LYS 154 HD2 LYS 154 -7.591 11.672 -10.747 1030 2HD LYS 154 HD1 LYS 154 -8.829 12.418 -11.752 1031 1HE LYS 154 HE2 LYS 154 -7.622 11.561 -13.764 1032 2HE LYS 154 HE1 LYS 154 -6.507 10.737 -12.686 1033 1HZ LYS 154 HZ3 LYS 154 -8.446 9.519 -11.761 1034 2HZ LYS 154 HZ2 LYS 154 -9.412 10.237 -12.951 1035 3HZ LYS 154 HZ1 LYS 154 -8.176 9.214 -13.393 1036 H LEU 155 HN LEU 155 -5.095 17.102 -14.484 1037 HA LEU 155 HA LEU 155 -7.146 18.264 -16.055 1038 1HB LEU 155 HB2 LEU 155 -5.424 19.557 -17.188 1039 2HB LEU 155 HB1 LEU 155 -5.187 19.622 -15.463 1040 HG LEU 155 HG LEU 155 -3.540 17.948 -17.373 1041 1HD1 LEU 155 HD1 LEU 155 -3.250 20.318 -17.783 1042 2HD1 LEU 155 HD1 LEU 155 -2.935 20.595 -16.069 1043 3HD1 LEU 155 HD1 LEU 155 -1.805 19.643 -17.032 1044 1HD2 LEU 155 HD2 LEU 155 -3.122 18.622 -14.447 1045 2HD2 LEU 155 HD2 LEU 155 -3.477 17.025 -15.115 1046 3HD2 LEU 155 HD2 LEU 155 -1.948 17.816 -15.479 1047 H GLU 156 HN GLU 156 -8.132 17.260 -17.517 1048 HA GLU 156 HA GLU 156 -6.905 15.050 -18.862 1049 1HB GLU 156 HB2 GLU 156 -9.240 14.965 -18.022 1050 2HB GLU 156 HB1 GLU 156 -9.665 16.196 -19.202 1051 1HG GLU 156 HG2 GLU 156 -9.030 14.682 -21.003 1052 2HG GLU 156 HG1 GLU 156 -8.608 13.455 -19.810 1053 H HIS 157 HN HIS 157 -5.408 15.938 -20.067 1054 HA HIS 157 HA HIS 157 -6.311 17.043 -22.604 1055 1HB HIS 157 HB2 HIS 157 -5.540 18.975 -21.216 1056 2HB HIS 157 HB1 HIS 157 -3.994 18.170 -20.987 1057 HD1 HIS 157 HD1 HIS 157 -2.290 19.312 -22.388 1058 HD2 HIS 157 HD2 HIS 157 -5.987 19.139 -24.261 1059 HE1 HIS 157 HE1 HIS 157 -1.997 20.451 -24.616 1060 H HIS 158 HN HIS 158 -3.419 16.224 -20.742 1061 HA HIS 158 HA HIS 158 -1.937 14.586 -20.809 1062 1HB HIS 158 HB2 HIS 158 -3.731 13.195 -22.811 1063 2HB HIS 158 HB1 HIS 158 -2.400 12.465 -21.934 1064 HD1 HIS 158 HD1 HIS 158 -5.938 12.675 -21.866 1065 HD2 HIS 158 HD2 HIS 158 -2.963 12.600 -18.975 1066 HE1 HIS 158 HE1 HIS 158 -7.080 12.024 -19.706 1067 H HIS 159 HN HIS 159 -0.540 13.343 -22.282 1068 HA HIS 159 HA HIS 159 -0.004 14.709 -24.844 1069 1HB HIS 159 HB2 HIS 159 2.099 13.587 -22.951 1070 2HB HIS 159 HB1 HIS 159 2.396 14.419 -24.466 1071 HD1 HIS 159 HD1 HIS 159 2.464 17.011 -24.362 1072 HD2 HIS 159 HD2 HIS 159 1.340 15.199 -20.801 1073 HE1 HIS 159 HE1 HIS 159 2.479 18.829 -22.597 1074 H HIS 160 HN HIS 160 0.021 11.919 -22.799 1075 HA HIS 160 HA HIS 160 0.041 9.766 -23.025 1076 1HB HIS 160 HB2 HIS 160 -0.664 10.283 -25.930 1077 2HB HIS 160 HB1 HIS 160 -0.536 8.664 -25.248 1078 HD1 HIS 160 HD1 HIS 160 -2.571 7.800 -23.971 1079 HD2 HIS 160 HD2 HIS 160 -2.801 11.848 -24.864 1080 HE1 HIS 160 HE1 HIS 160 -4.907 8.527 -23.364 1081 H HIS 161 HN HIS 161 2.050 9.944 -22.355 1082 HA HIS 161 HA HIS 161 4.279 10.004 -24.149 1083 1HB HIS 161 HB2 HIS 161 4.146 9.311 -21.201 1084 2HB HIS 161 HB1 HIS 161 5.627 9.538 -22.112 1085 HD1 HIS 161 HD1 HIS 161 6.114 12.074 -22.890 1086 HD2 HIS 161 HD2 HIS 161 2.968 11.571 -20.229 1087 HE1 HIS 161 HE1 HIS 161 5.649 14.348 -21.920 1088 H HIS 162 HN HIS 162 5.239 8.357 -25.082 1089 HA HIS 162 HA HIS 162 5.822 6.353 -25.768 1090 1HB HIS 162 HB2 HIS 162 4.818 5.273 -23.115 1091 2HB HIS 162 HB1 HIS 162 5.830 4.407 -24.264 1092 HD1 HIS 162 HD1 HIS 162 6.147 6.157 -21.209 1093 HD2 HIS 162 HD2 HIS 162 8.354 6.057 -24.723 1094 HE1 HIS 162 HE1 HIS 162 8.449 6.995 -20.608 No H/Q in entry = 1094 Start of MODEL 8 1 H1 MET 1 HT2 MET 1 19.827 -18.701 -3.465 2 H2 MET 1 HT1 MET 1 21.304 -17.836 -3.574 3 H3 MET 1 HT3 MET 1 20.937 -18.796 -2.228 4 HA MET 1 HA MET 1 20.640 -16.596 -1.618 5 1HB MET 1 HB2 MET 1 18.760 -16.464 -3.994 6 2HB MET 1 HB1 MET 1 18.726 -15.307 -2.681 7 1HG MET 1 HG2 MET 1 19.953 -14.377 -4.526 8 2HG MET 1 HG1 MET 1 21.056 -14.680 -3.191 9 1HE MET 1 HE1 MET 1 19.512 -17.080 -5.959 10 2HE MET 1 HE3 MET 1 19.983 -15.627 -6.838 11 3HE MET 1 HE2 MET 1 20.848 -17.138 -7.104 12 H GLU 2 HN GLU 2 18.432 -15.724 -0.730 13 HA GLU 2 HA GLU 2 16.864 -18.039 0.176 14 1HB GLU 2 HB2 GLU 2 17.873 -15.674 1.752 15 2HB GLU 2 HB1 GLU 2 16.773 -16.892 2.369 16 1HG GLU 2 HG2 GLU 2 18.474 -18.578 2.199 17 2HG GLU 2 HG1 GLU 2 19.565 -17.441 1.404 18 H MET 3 HN MET 3 14.680 -17.510 0.632 19 HA MET 3 HA MET 3 13.749 -15.131 -0.737 20 1HB MET 3 HB2 MET 3 12.207 -17.335 0.662 21 2HB MET 3 HB1 MET 3 11.448 -15.956 -0.116 22 1HG MET 3 HG2 MET 3 12.375 -16.669 -2.261 23 2HG MET 3 HG1 MET 3 13.120 -18.061 -1.468 24 1HE MET 3 HE3 MET 3 11.177 -18.218 -4.005 25 2HE MET 3 HE2 MET 3 11.915 -19.638 -3.267 26 3HE MET 3 HE1 MET 3 10.182 -19.612 -3.575 27 H GLY 4 HN GLY 4 14.338 -16.271 2.401 28 1HA GLY 4 HA1 GLY 4 14.337 -15.230 4.440 29 2HA GLY 4 HA2 GLY 4 12.848 -14.452 3.918 30 H GLN 5 HN GLN 5 15.964 -14.174 2.341 31 HA GLN 5 HA GLN 5 16.642 -11.692 3.567 32 1HB GLN 5 HB2 GLN 5 18.568 -11.666 2.161 33 2HB GLN 5 HB1 GLN 5 18.217 -13.364 2.479 34 1HG GLN 5 HG2 GLN 5 17.202 -13.598 0.305 35 2HG GLN 5 HG1 GLN 5 17.528 -11.901 -0.041 36 1HE2 GLN 5 1HE2 GLN 5 19.678 -11.251 -0.373 37 2HE2 GLN 5 2HE2 GLN 5 20.901 -12.380 -0.774 38 H LEU 6 HN LEU 6 14.888 -12.659 0.738 39 HA LEU 6 HA LEU 6 14.797 -10.091 -0.467 40 1HB LEU 6 HB2 LEU 6 14.556 -12.152 -1.781 41 2HB LEU 6 HB1 LEU 6 13.125 -12.587 -0.887 42 HG LEU 6 HG LEU 6 12.779 -11.749 -3.254 43 1HD1 LEU 6 HD1 LEU 6 11.329 -10.382 -1.021 44 2HD1 LEU 6 HD1 LEU 6 10.806 -10.370 -2.700 45 3HD1 LEU 6 HD1 LEU 6 10.897 -11.884 -1.815 46 1HD2 LEU 6 HD2 LEU 6 14.372 -9.907 -3.241 47 2HD2 LEU 6 HD2 LEU 6 12.735 -9.333 -3.592 48 3HD2 LEU 6 HD2 LEU 6 13.420 -9.098 -1.989 49 H LYS 7 HN LYS 7 12.642 -12.004 1.538 50 HA LYS 7 HA LYS 7 10.591 -10.077 1.707 51 1HB LYS 7 HB2 LYS 7 11.002 -12.676 2.660 52 2HB LYS 7 HB1 LYS 7 10.788 -11.697 4.103 53 1HG LYS 7 HG2 LYS 7 8.880 -11.694 1.771 54 2HG LYS 7 HG1 LYS 7 8.694 -12.741 3.161 55 1HD LYS 7 HD2 LYS 7 8.728 -9.703 3.253 56 2HD LYS 7 HD1 LYS 7 7.268 -10.688 3.243 57 1HE LYS 7 HE2 LYS 7 8.086 -11.771 5.355 58 2HE LYS 7 HE1 LYS 7 9.404 -10.603 5.380 59 1HZ LYS 7 HZ1 LYS 7 6.502 -9.932 5.500 60 2HZ LYS 7 HZ3 LYS 7 7.558 -9.928 6.793 61 3HZ LYS 7 HZ2 LYS 7 7.741 -8.796 5.572 62 H ASN 8 HN ASN 8 13.558 -10.578 3.503 63 HA ASN 8 HA ASN 8 13.096 -8.668 5.536 64 1HB ASN 8 HB2 ASN 8 14.971 -10.318 5.617 65 2HB ASN 8 HB1 ASN 8 15.758 -9.444 4.305 66 1HD2 ASN 8 HD2 ASN 8 17.560 -8.844 5.470 67 2HD2 ASN 8 HD2 ASN 8 17.494 -7.728 6.782 68 H LYS 9 HN LYS 9 14.610 -8.437 2.328 69 HA LYS 9 HA LYS 9 15.155 -5.692 2.385 70 1HB LYS 9 HB2 LYS 9 14.421 -7.438 0.033 71 2HB LYS 9 HB1 LYS 9 15.005 -5.787 -0.111 72 1HG LYS 9 HG2 LYS 9 17.084 -6.465 0.999 73 2HG LYS 9 HG1 LYS 9 16.487 -8.127 1.036 74 1HD LYS 9 HD2 LYS 9 16.356 -8.149 -1.390 75 2HD LYS 9 HD1 LYS 9 16.906 -6.470 -1.444 76 1HE LYS 9 HE2 LYS 9 18.456 -8.802 -0.340 77 2HE LYS 9 HE1 LYS 9 18.723 -8.044 -1.910 78 1HZ LYS 9 HZ2 LYS 9 19.025 -6.707 0.728 79 2HZ LYS 9 HZ1 LYS 9 20.284 -7.261 -0.239 80 3HZ LYS 9 HZ3 LYS 9 19.311 -5.986 -0.772 81 H ILE 10 HN ILE 10 12.295 -7.415 1.282 82 HA ILE 10 HA ILE 10 10.619 -5.310 0.665 83 HB ILE 10 HB ILE 10 9.966 -7.953 1.997 84 1HG1 ILE 10 2HG1 ILE 10 9.529 -6.985 -0.811 85 2HG1 ILE 10 1HG1 ILE 10 10.867 -8.028 -0.309 86 1HG2 ILE 10 2HG2 ILE 10 8.173 -6.414 2.589 87 2HG2 ILE 10 1HG2 ILE 10 7.982 -5.960 0.898 88 3HG2 ILE 10 3HG2 ILE 10 7.604 -7.603 1.415 89 1HD1 ILE 10 HD1 ILE 10 9.176 -9.744 0.298 90 2HD1 ILE 10 HD1 ILE 10 7.917 -8.681 -0.337 91 3HD1 ILE 10 HD1 ILE 10 9.175 -9.313 -1.406 92 H GLU 11 HN GLU 11 11.149 -6.751 3.877 93 HA GLU 11 HA GLU 11 9.452 -5.127 5.365 94 1HB GLU 11 HB2 GLU 11 12.093 -6.343 6.143 95 2HB GLU 11 HB1 GLU 11 11.001 -5.558 7.277 96 1HG GLU 11 HG2 GLU 11 10.387 -7.966 5.606 97 2HG GLU 11 HG1 GLU 11 10.743 -7.953 7.338 98 H ASN 12 HN ASN 12 12.919 -4.676 4.764 99 HA ASN 12 HA ASN 12 13.215 -2.275 6.025 100 1HB ASN 12 HB2 ASN 12 14.664 -3.692 3.839 101 2HB ASN 12 HB1 ASN 12 15.135 -2.082 4.330 102 1HD2 ASN 12 HD2 ASN 12 15.020 -5.445 5.220 103 2HD2 ASN 12 HD2 ASN 12 16.045 -5.330 6.593 104 H LYS 13 HN LYS 13 12.521 -2.981 2.623 105 HA LYS 13 HA LYS 13 12.646 -0.340 1.706 106 1HB LYS 13 HB2 LYS 13 12.636 -2.585 0.405 107 2HB LYS 13 HB1 LYS 13 10.894 -2.444 0.477 108 1HG LYS 13 HG2 LYS 13 11.726 -1.569 -1.667 109 2HG LYS 13 HG1 LYS 13 11.007 -0.301 -0.678 110 1HD LYS 13 HD2 LYS 13 13.107 0.379 -1.761 111 2HD LYS 13 HD1 LYS 13 13.149 0.492 -0.009 112 1HE LYS 13 HE2 LYS 13 14.377 -1.573 0.111 113 2HE LYS 13 HE1 LYS 13 14.340 -1.731 -1.657 114 1HZ LYS 13 HZ2 LYS 13 15.574 0.456 -0.090 115 2HZ LYS 13 HZ1 LYS 13 16.410 -0.794 -0.877 116 3HZ LYS 13 HZ3 LYS 13 15.537 0.344 -1.796 117 H LYS 14 HN LYS 14 9.918 -2.310 2.731 118 HA LYS 14 HA LYS 14 7.752 -0.657 2.424 119 1HB LYS 14 HB2 LYS 14 7.771 -3.033 3.087 120 2HB LYS 14 HB1 LYS 14 8.475 -2.580 4.621 121 1HG LYS 14 HG2 LYS 14 6.404 -1.411 5.204 122 2HG LYS 14 HG1 LYS 14 5.707 -1.891 3.653 123 1HD LYS 14 HD2 LYS 14 4.937 -3.469 5.323 124 2HD LYS 14 HD1 LYS 14 6.119 -4.279 4.293 125 1HE LYS 14 HE2 LYS 14 7.856 -3.838 5.992 126 2HE LYS 14 HE1 LYS 14 6.602 -3.103 6.991 127 1HZ LYS 14 HZ3 LYS 14 5.490 -5.395 7.008 128 2HZ LYS 14 HZ2 LYS 14 6.864 -5.975 6.204 129 3HZ LYS 14 HZ1 LYS 14 7.016 -5.354 7.703 130 H LYS 15 HN LYS 15 9.912 -1.062 5.192 131 HA LYS 15 HA LYS 15 8.818 0.965 6.821 132 1HB LYS 15 HB2 LYS 15 11.465 -0.477 6.856 133 2HB LYS 15 HB1 LYS 15 10.971 0.666 8.106 134 1HG LYS 15 HG2 LYS 15 9.251 -0.704 8.867 135 2HG LYS 15 HG1 LYS 15 9.199 -1.631 7.372 136 1HD LYS 15 HD2 LYS 15 11.222 -2.724 7.884 137 2HD LYS 15 HD1 LYS 15 11.540 -1.737 9.304 138 1HE LYS 15 HE2 LYS 15 9.442 -2.669 10.305 139 2HE LYS 15 HE1 LYS 15 9.253 -3.673 8.872 140 1HZ LYS 15 HZ1 LYS 15 11.525 -3.819 10.789 141 2HZ LYS 15 HZ3 LYS 15 10.230 -4.882 10.702 142 3HZ LYS 15 HZ2 LYS 15 11.320 -4.814 9.444 143 H GLU 16 HN GLU 16 11.513 0.978 4.572 144 HA GLU 16 HA GLU 16 12.448 3.581 4.919 145 1HB GLU 16 HB2 GLU 16 12.253 1.862 2.421 146 2HB GLU 16 HB1 GLU 16 13.064 3.414 2.444 147 1HG GLU 16 HG2 GLU 16 14.711 2.572 3.980 148 2HG GLU 16 HG1 GLU 16 13.809 1.074 4.178 149 H LEU 17 HN LEU 17 9.814 2.351 2.964 150 HA LEU 17 HA LEU 17 9.103 4.858 1.862 151 1HB LEU 17 HB2 LEU 17 8.531 3.026 0.551 152 2HB LEU 17 HB1 LEU 17 7.869 2.126 1.892 153 HG LEU 17 HG LEU 17 6.194 2.840 0.177 154 1HD1 LEU 17 HD1 LEU 17 5.527 2.174 2.271 155 2HD1 LEU 17 HD1 LEU 17 5.646 3.817 2.877 156 3HD1 LEU 17 HD1 LEU 17 4.471 3.435 1.602 157 1HD2 LEU 17 HD2 LEU 17 7.121 5.014 -0.406 158 2HD2 LEU 17 HD2 LEU 17 5.436 5.134 0.108 159 3HD2 LEU 17 HD2 LEU 17 6.735 5.601 1.213 160 H ILE 18 HN ILE 18 7.939 2.988 4.597 161 HA ILE 18 HA ILE 18 5.708 4.500 5.145 162 HB ILE 18 HB ILE 18 7.477 3.084 7.180 163 1HG1 ILE 18 2HG1 ILE 18 4.871 2.169 5.962 164 2HG1 ILE 18 1HG1 ILE 18 6.440 1.734 5.298 165 1HG2 ILE 18 2HG2 ILE 18 4.640 4.111 7.448 166 2HG2 ILE 18 1HG2 ILE 18 5.470 3.104 8.642 167 3HG2 ILE 18 3HG2 ILE 18 6.051 4.731 8.286 168 1HD1 ILE 18 HD1 ILE 18 5.495 1.094 8.083 169 2HD1 ILE 18 HD1 ILE 18 5.502 -0.022 6.701 170 3HD1 ILE 18 HD1 ILE 18 7.011 0.609 7.345 171 H GLN 19 HN GLN 19 9.052 4.915 6.199 172 HA GLN 19 HA GLN 19 8.671 7.191 7.786 173 1HB GLN 19 HB2 GLN 19 11.067 6.266 6.233 174 2HB GLN 19 HB1 GLN 19 11.093 7.634 7.337 175 1HG GLN 19 HG2 GLN 19 10.427 6.170 9.163 176 2HG GLN 19 HG1 GLN 19 10.403 4.801 8.056 177 1HE2 GLN 19 1HE2 GLN 19 11.967 5.298 10.438 178 2HE2 GLN 19 2HE2 GLN 19 13.624 5.143 9.965 179 H LEU 20 HN LEU 20 8.978 6.839 4.326 180 HA LEU 20 HA LEU 20 9.373 9.612 3.877 181 1HB LEU 20 HB2 LEU 20 8.486 7.487 1.930 182 2HB LEU 20 HB1 LEU 20 8.870 9.152 1.531 183 HG LEU 20 HG LEU 20 10.811 7.133 2.613 184 1HD1 LEU 20 HD1 LEU 20 10.511 8.350 -0.127 185 2HD1 LEU 20 HD1 LEU 20 11.818 7.283 0.386 186 3HD1 LEU 20 HD1 LEU 20 10.162 6.680 0.316 187 1HD2 LEU 20 HD2 LEU 20 11.207 9.996 1.731 188 2HD2 LEU 20 HD2 LEU 20 11.389 9.372 3.368 189 3HD2 LEU 20 HD2 LEU 20 12.505 8.864 2.102 190 H VAL 21 HN VAL 21 6.360 7.507 3.481 191 HA VAL 21 HA VAL 21 4.802 9.726 2.988 192 HB VAL 21 HB VAL 21 2.926 8.413 3.522 193 1HG1 VAL 21 2HG1 VAL 21 5.027 6.757 2.279 194 2HG1 VAL 21 1HG1 VAL 21 3.285 6.411 2.208 195 3HG1 VAL 21 3HG1 VAL 21 3.920 7.898 1.470 196 1HG2 VAL 21 3HG2 VAL 21 4.746 6.417 4.808 197 2HG2 VAL 21 2HG2 VAL 21 3.544 7.451 5.601 198 3HG2 VAL 21 1HG2 VAL 21 3.019 6.185 4.483 199 H ALA 22 HN ALA 22 5.979 8.429 5.993 200 HA ALA 22 HA ALA 22 4.274 9.724 7.761 201 1HB ALA 22 HB3 ALA 22 7.151 8.970 8.165 202 2HB ALA 22 HB2 ALA 22 5.930 9.226 9.442 203 3HB ALA 22 HB1 ALA 22 5.761 7.897 8.291 204 H ARG 23 HN ARG 23 7.491 10.707 6.604 205 HA ARG 23 HA ARG 23 7.503 13.195 7.925 206 1HB ARG 23 HB2 ARG 23 9.404 13.799 6.463 207 2HB ARG 23 HB1 ARG 23 9.601 12.225 7.211 208 1HG ARG 23 HG2 ARG 23 8.891 11.167 5.120 209 2HG ARG 23 HG1 ARG 23 8.747 12.757 4.377 210 1HD ARG 23 HD2 ARG 23 11.284 11.636 5.552 211 2HD ARG 23 HD1 ARG 23 10.874 11.585 3.841 212 HE ARG 23 HE ARG 23 10.659 14.171 4.320 213 1HH1 ARG 23 1HH1 ARG 23 13.213 11.987 5.413 214 2HH1 ARG 23 2HH1 ARG 23 14.467 13.135 5.235 215 1HH2 ARG 23 1HH2 ARG 23 12.354 15.750 4.099 216 2HH2 ARG 23 2HH2 ARG 23 13.964 15.339 4.464 217 H HIS 24 HN HIS 24 5.891 12.210 5.110 218 HA HIS 24 HA HIS 24 5.660 14.603 3.694 219 1HB HIS 24 HB2 HIS 24 4.902 12.524 2.702 220 2HB HIS 24 HB1 HIS 24 3.682 12.306 3.942 221 HD1 HIS 24 HD1 HIS 24 1.470 13.792 3.679 222 HD2 HIS 24 HD2 HIS 24 4.240 14.183 0.619 223 HE1 HIS 24 HE1 HIS 24 0.306 15.042 1.835 224 H GLY 25 HN GLY 25 4.002 13.480 6.607 225 1HA GLY 25 HA1 GLY 25 2.106 15.698 6.441 226 2HA GLY 25 HA2 GLY 25 3.293 15.744 7.741 227 H LEU 26 HN LEU 26 2.479 12.541 7.127 228 HA LEU 26 HA LEU 26 0.114 12.171 8.393 229 1HB LEU 26 HB2 LEU 26 2.542 10.590 7.922 230 2HB LEU 26 HB1 LEU 26 1.351 9.944 9.027 231 HG LEU 26 HG LEU 26 -0.314 10.177 7.226 232 1HD1 LEU 26 HD1 LEU 26 0.678 11.814 5.859 233 2HD1 LEU 26 HD1 LEU 26 2.007 10.723 5.429 234 3HD1 LEU 26 HD1 LEU 26 0.342 10.337 4.948 235 1HD2 LEU 26 HD2 LEU 26 2.042 8.384 6.792 236 2HD2 LEU 26 HD2 LEU 26 0.583 8.056 7.726 237 3HD2 LEU 26 HD2 LEU 26 0.492 8.177 5.968 238 H ASP 27 HN ASP 27 -0.493 11.726 10.362 239 HA ASP 27 HA ASP 27 1.029 12.743 12.631 240 1HB ASP 27 HB2 ASP 27 -1.496 11.078 12.809 241 2HB ASP 27 HB1 ASP 27 -0.879 12.211 13.989 242 H HIS 28 HN HIS 28 1.192 11.208 14.578 243 HA HIS 28 HA HIS 28 2.712 8.950 13.877 244 1HB HIS 28 HB2 HIS 28 2.917 10.139 16.063 245 2HB HIS 28 HB1 HIS 28 1.344 9.517 16.524 246 HD1 HIS 28 HD1 HIS 28 1.521 7.540 18.056 247 HD2 HIS 28 HD2 HIS 28 4.743 7.807 15.443 248 HE1 HIS 28 HE1 HIS 28 3.039 5.608 18.613 249 H ASP 29 HN ASP 29 -0.661 9.294 14.862 250 HA ASP 29 HA ASP 29 -1.481 6.615 14.937 251 1HB ASP 29 HB2 ASP 29 -2.986 9.075 14.058 252 2HB ASP 29 HB1 ASP 29 -3.729 7.495 14.184 253 H LYS 30 HN LYS 30 -1.213 8.861 12.276 254 HA LYS 30 HA LYS 30 -2.458 7.276 10.324 255 1HB LYS 30 HB2 LYS 30 -0.418 9.450 10.057 256 2HB LYS 30 HB1 LYS 30 -1.248 8.734 8.691 257 1HG LYS 30 HG2 LYS 30 -2.474 10.331 10.937 258 2HG LYS 30 HG1 LYS 30 -2.215 10.856 9.275 259 1HD LYS 30 HD2 LYS 30 -3.738 8.990 8.557 260 2HD LYS 30 HD1 LYS 30 -4.105 8.726 10.259 261 1HE LYS 30 HE2 LYS 30 -4.611 11.242 8.668 262 2HE LYS 30 HE1 LYS 30 -5.819 10.111 9.257 263 1HZ LYS 30 HZ1 LYS 30 -5.194 10.718 11.541 264 2HZ LYS 30 HZ3 LYS 30 -4.084 11.858 10.966 265 3HZ LYS 30 HZ2 LYS 30 -5.714 12.046 10.661 266 H VAL 31 HN VAL 31 0.913 7.650 11.286 267 HA VAL 31 HA VAL 31 2.053 6.033 9.292 268 HB VAL 31 HB VAL 31 3.079 6.585 12.105 269 1HG1 VAL 31 3HG1 VAL 31 4.240 4.715 11.085 270 2HG1 VAL 31 2HG1 VAL 31 4.576 5.693 9.657 271 3HG1 VAL 31 1HG1 VAL 31 5.290 6.126 11.209 272 1HG2 VAL 31 2HG2 VAL 31 2.627 8.631 10.891 273 2HG2 VAL 31 1HG2 VAL 31 4.365 8.384 11.075 274 3HG2 VAL 31 3HG2 VAL 31 3.582 8.049 9.529 275 H LEU 32 HN LEU 32 0.814 5.344 12.503 276 HA LEU 32 HA LEU 32 1.487 2.597 12.616 277 1HB LEU 32 HB2 LEU 32 -0.781 4.062 13.930 278 2HB LEU 32 HB1 LEU 32 -0.178 2.479 14.383 279 HG LEU 32 HG LEU 32 1.353 5.070 14.582 280 1HD1 LEU 32 HD1 LEU 32 -0.436 4.919 16.180 281 2HD1 LEU 32 HD1 LEU 32 0.135 3.324 16.681 282 3HD1 LEU 32 HD1 LEU 32 1.135 4.755 16.969 283 1HD2 LEU 32 HD2 LEU 32 2.109 2.269 15.422 284 2HD2 LEU 32 HD2 LEU 32 2.851 3.225 14.137 285 3HD2 LEU 32 HD2 LEU 32 3.011 3.738 15.813 286 H LEU 33 HN LEU 33 -1.561 4.202 11.766 287 HA LEU 33 HA LEU 33 -3.003 1.886 11.126 288 1HB LEU 33 HB2 LEU 33 -3.261 4.664 9.990 289 2HB LEU 33 HB1 LEU 33 -4.447 3.394 9.794 290 HG LEU 33 HG LEU 33 -3.666 4.605 12.445 291 1HD1 LEU 33 HD1 LEU 33 -4.762 6.241 11.000 292 2HD1 LEU 33 HD1 LEU 33 -6.085 5.111 10.707 293 3HD1 LEU 33 HD1 LEU 33 -5.817 5.758 12.325 294 1HD2 LEU 33 HD2 LEU 33 -5.911 2.756 11.646 295 2HD2 LEU 33 HD2 LEU 33 -4.510 2.328 12.630 296 3HD2 LEU 33 HD2 LEU 33 -5.697 3.484 13.234 297 H PHE 34 HN PHE 34 -1.036 3.993 9.093 298 HA PHE 34 HA PHE 34 -1.558 2.770 6.644 299 1HB PHE 34 HB2 PHE 34 -0.566 4.972 6.750 300 2HB PHE 34 HB1 PHE 34 0.848 4.344 7.585 301 HD1 PHE 34 HD1 PHE 34 2.716 3.638 6.378 302 HD2 PHE 34 HD2 PHE 34 -1.004 4.160 4.379 303 HE1 PHE 34 HE1 PHE 34 3.824 3.277 4.203 304 HE2 PHE 34 HE2 PHE 34 0.109 3.798 2.228 305 HZ PHE 34 HZ PHE 34 2.539 3.355 2.163 306 H SER 35 HN SER 35 1.138 2.257 8.918 307 HA SER 35 HA SER 35 2.420 0.362 7.296 308 1HB SER 35 HB2 SER 35 3.715 -0.185 9.392 309 2HB SER 35 HB1 SER 35 3.707 1.515 8.920 310 HG SER 35 HG SER 35 2.352 1.999 10.513 311 H ARG 36 HN ARG 36 0.012 0.038 9.799 312 HA ARG 36 HA ARG 36 0.022 -2.752 10.116 313 1HB ARG 36 HB2 ARG 36 -2.253 -0.775 10.306 314 2HB ARG 36 HB1 ARG 36 -2.382 -2.462 10.792 315 1HG ARG 36 HG2 ARG 36 -0.764 -2.138 12.525 316 2HG ARG 36 HG1 ARG 36 -0.415 -0.524 11.877 317 1HD ARG 36 HD2 ARG 36 -1.783 -0.419 13.904 318 2HD ARG 36 HD1 ARG 36 -2.551 0.286 12.504 319 HE ARG 36 HE ARG 36 -3.756 -1.958 12.349 320 1HH1 ARG 36 1HH1 ARG 36 -2.736 -0.610 15.469 321 2HH1 ARG 36 2HH1 ARG 36 -4.155 -1.044 16.300 322 1HH2 ARG 36 1HH2 ARG 36 -5.750 -2.539 13.510 323 2HH2 ARG 36 2HH2 ARG 36 -5.901 -2.152 15.163 324 H ASP 37 HN ASP 37 -1.947 -0.719 8.018 325 HA ASP 37 HA ASP 37 -3.352 -2.858 6.784 326 1HB ASP 37 HB2 ASP 37 -3.857 -0.307 6.949 327 2HB ASP 37 HB1 ASP 37 -2.911 -0.196 5.476 328 H LEU 38 HN LEU 38 -0.533 -0.955 5.914 329 HA LEU 38 HA LEU 38 0.002 -1.965 3.372 330 1HB LEU 38 HB2 LEU 38 1.076 0.016 4.112 331 2HB LEU 38 HB1 LEU 38 1.744 -0.785 5.509 332 HG LEU 38 HG LEU 38 3.336 -1.986 4.105 333 1HD1 LEU 38 HD1 LEU 38 2.005 -2.229 2.095 334 2HD1 LEU 38 HD1 LEU 38 2.118 -0.485 1.797 335 3HD1 LEU 38 HD1 LEU 38 3.572 -1.495 1.764 336 1HD2 LEU 38 HD2 LEU 38 3.240 0.972 3.577 337 2HD2 LEU 38 HD2 LEU 38 3.970 0.165 4.964 338 3HD2 LEU 38 HD2 LEU 38 4.652 -0.061 3.359 339 H ASP 39 HN ASP 39 1.185 -3.076 6.537 340 HA ASP 39 HA ASP 39 2.866 -5.103 5.545 341 1HB ASP 39 HB2 ASP 39 2.882 -4.258 7.905 342 2HB ASP 39 HB1 ASP 39 1.375 -5.123 8.174 343 H LYS 40 HN LYS 40 -0.446 -5.120 6.629 344 HA LYS 40 HA LYS 40 -1.047 -7.823 6.265 345 1HB LYS 40 HB2 LYS 40 -2.761 -5.350 6.226 346 2HB LYS 40 HB1 LYS 40 -3.409 -6.986 6.159 347 1HG LYS 40 HG2 LYS 40 -2.676 -7.485 8.341 348 2HG LYS 40 HG1 LYS 40 -1.553 -6.130 8.358 349 1HD LYS 40 HD2 LYS 40 -3.479 -5.696 9.796 350 2HD LYS 40 HD1 LYS 40 -3.426 -4.566 8.453 351 1HE LYS 40 HE2 LYS 40 -5.154 -5.845 7.301 352 2HE LYS 40 HE1 LYS 40 -5.174 -7.019 8.619 353 1HZ LYS 40 HZ2 LYS 40 -5.833 -4.130 8.939 354 2HZ LYS 40 HZ1 LYS 40 -6.963 -5.387 8.817 355 3HZ LYS 40 HZ3 LYS 40 -5.906 -5.328 10.114 356 H LEU 41 HN LEU 41 -1.151 -5.119 4.030 357 HA LEU 41 HA LEU 41 -2.464 -6.445 1.904 358 1HB LEU 41 HB2 LEU 41 -2.287 -4.017 1.975 359 2HB LEU 41 HB1 LEU 41 -0.542 -4.116 1.876 360 HG LEU 41 HG LEU 41 -0.721 -5.015 -0.404 361 1HD1 LEU 41 HD1 LEU 41 -3.673 -4.576 -0.039 362 2HD1 LEU 41 HD1 LEU 41 -2.878 -4.947 -1.571 363 3HD1 LEU 41 HD1 LEU 41 -2.857 -6.126 -0.261 364 1HD2 LEU 41 HD2 LEU 41 -2.218 -2.441 0.046 365 2HD2 LEU 41 HD2 LEU 41 -0.470 -2.622 -0.077 366 3HD2 LEU 41 HD2 LEU 41 -1.491 -2.954 -1.477 367 H ILE 42 HN ILE 42 0.883 -6.029 2.772 368 HA ILE 42 HA ILE 42 1.898 -7.356 0.484 369 HB ILE 42 HB ILE 42 3.234 -6.794 3.155 370 1HG1 ILE 42 2HG1 ILE 42 3.467 -5.484 0.443 371 2HG1 ILE 42 1HG1 ILE 42 2.585 -4.834 1.819 372 1HG2 ILE 42 1HG2 ILE 42 4.315 -8.729 2.070 373 2HG2 ILE 42 3HG2 ILE 42 4.497 -7.788 0.586 374 3HG2 ILE 42 2HG2 ILE 42 5.361 -7.310 2.047 375 1HD1 ILE 42 HD1 ILE 42 5.557 -5.296 1.681 376 2HD1 ILE 42 HD1 ILE 42 4.736 -3.741 1.515 377 3HD1 ILE 42 HD1 ILE 42 4.653 -4.615 3.043 378 H ASN 43 HN ASN 43 1.229 -8.436 3.770 379 HA ASN 43 HA ASN 43 2.082 -11.100 3.570 380 1HB ASN 43 HB2 ASN 43 -0.282 -10.025 5.137 381 2HB ASN 43 HB1 ASN 43 0.440 -11.611 5.375 382 1HD2 ASN 43 HD2 ASN 43 0.123 -9.366 7.224 383 2HD2 ASN 43 HD2 ASN 43 1.696 -8.924 7.758 384 H LYS 44 HN LYS 44 -0.873 -9.583 2.540 385 HA LYS 44 HA LYS 44 -2.422 -11.835 1.869 386 1HB LYS 44 HB2 LYS 44 -3.288 -9.527 2.061 387 2HB LYS 44 HB1 LYS 44 -2.394 -9.081 0.620 388 1HG LYS 44 HG2 LYS 44 -3.745 -10.731 -0.659 389 2HG LYS 44 HG1 LYS 44 -4.697 -11.014 0.796 390 1HD LYS 44 HD2 LYS 44 -4.438 -8.412 -0.727 391 2HD LYS 44 HD1 LYS 44 -5.865 -9.441 -0.629 392 1HE LYS 44 HE2 LYS 44 -5.819 -9.049 1.866 393 2HE LYS 44 HE1 LYS 44 -4.595 -7.825 1.569 394 1HZ LYS 44 HZ3 LYS 44 -6.209 -6.661 0.104 395 2HZ LYS 44 HZ2 LYS 44 -7.339 -7.836 0.480 396 3HZ LYS 44 HZ1 LYS 44 -6.771 -6.817 1.699 397 H PHE 45 HN PHE 45 -0.198 -9.837 -0.030 398 HA PHE 45 HA PHE 45 -0.618 -11.458 -2.326 399 1HB PHE 45 HB2 PHE 45 1.055 -9.032 -1.832 400 2HB PHE 45 HB1 PHE 45 1.277 -9.977 -3.304 401 HD1 PHE 45 HD1 PHE 45 -0.176 -9.756 -5.104 402 HD2 PHE 45 HD2 PHE 45 -1.325 -8.140 -1.331 403 HE1 PHE 45 HE1 PHE 45 -2.121 -8.678 -6.153 404 HE2 PHE 45 HE2 PHE 45 -3.255 -7.058 -2.388 405 HZ PHE 45 HZ PHE 45 -3.658 -7.325 -4.795 406 H MET 46 HN MET 46 1.709 -11.381 0.189 407 HA MET 46 HA MET 46 3.640 -13.169 -0.944 408 1HB MET 46 HB2 MET 46 2.805 -12.879 1.965 409 2HB MET 46 HB1 MET 46 4.261 -13.665 1.403 410 1HG MET 46 HG2 MET 46 3.758 -10.790 0.817 411 2HG MET 46 HG1 MET 46 4.381 -11.216 2.397 412 1HE MET 46 HE2 MET 46 5.060 -10.231 -1.142 413 2HE MET 46 HE1 MET 46 6.617 -10.977 -1.555 414 3HE MET 46 HE3 MET 46 5.153 -11.958 -1.517 415 H ASN 47 HN ASN 47 0.459 -13.466 0.124 416 HA ASN 47 HA ASN 47 -1.118 -14.996 0.326 417 1HB ASN 47 HB2 ASN 47 -0.159 -15.766 -1.935 418 2HB ASN 47 HB1 ASN 47 0.670 -17.032 -1.034 419 1HD2 ASN 47 HD2 ASN 47 -0.507 -18.672 -2.107 420 2HD2 ASN 47 HD2 ASN 47 -2.172 -18.976 -1.782 421 H VAL 48 HN VAL 48 0.724 -14.572 2.295 422 HA VAL 48 HA VAL 48 1.316 -15.200 4.355 423 HB VAL 48 HB VAL 48 -0.716 -17.365 4.072 424 1HG1 VAL 48 3HG1 VAL 48 0.392 -15.970 6.508 425 2HG1 VAL 48 2HG1 VAL 48 -0.927 -17.144 6.543 426 3HG1 VAL 48 1HG1 VAL 48 0.688 -17.640 6.023 427 1HG2 VAL 48 2HG2 VAL 48 -1.125 -14.512 4.976 428 2HG2 VAL 48 1HG2 VAL 48 -1.768 -15.248 3.508 429 3HG2 VAL 48 3HG2 VAL 48 -2.345 -15.783 5.089 430 H LYS 49 HN LYS 49 3.183 -15.756 4.382 431 HA LYS 49 HA LYS 49 3.783 -18.552 3.932 432 1HB LYS 49 HB2 LYS 49 5.600 -16.169 3.966 433 2HB LYS 49 HB1 LYS 49 6.218 -17.811 4.140 434 1HG LYS 49 HG2 LYS 49 5.087 -18.404 2.015 435 2HG LYS 49 HG1 LYS 49 4.649 -16.710 1.825 436 1HD LYS 49 HD2 LYS 49 6.961 -16.068 1.686 437 2HD LYS 49 HD1 LYS 49 7.487 -17.703 2.098 438 1HE LYS 49 HE2 LYS 49 7.694 -17.287 -0.300 439 2HE LYS 49 HE1 LYS 49 6.509 -18.546 0.029 440 1HZ LYS 49 HZ3 LYS 49 4.741 -16.881 -0.289 441 2HZ LYS 49 HZ2 LYS 49 5.940 -15.713 -0.640 442 3HZ LYS 49 HZ1 LYS 49 5.730 -17.027 -1.640 443 H ASP 50 HN ASP 50 3.514 -19.718 5.498 444 HA ASP 50 HA ASP 50 4.510 -19.221 8.168 445 1HB ASP 50 HB2 ASP 50 2.237 -17.936 7.744 446 2HB ASP 50 HB1 ASP 50 1.547 -19.548 7.749 447 H LYS 51 HN LYS 51 2.949 -21.070 9.336 448 HA LYS 51 HA LYS 51 3.687 -23.539 7.877 449 1HB LYS 51 HB2 LYS 51 3.604 -24.626 10.105 450 2HB LYS 51 HB1 LYS 51 4.798 -23.341 10.039 451 1HG LYS 51 HG2 LYS 51 3.324 -21.837 11.222 452 2HG LYS 51 HG1 LYS 51 2.040 -23.045 11.210 453 1HD LYS 51 HD2 LYS 51 4.721 -23.421 12.536 454 2HD LYS 51 HD1 LYS 51 3.257 -22.867 13.352 455 1HE LYS 51 HE2 LYS 51 2.129 -24.947 12.799 456 2HE LYS 51 HE1 LYS 51 3.538 -25.511 11.911 457 1HZ LYS 51 HZ3 LYS 51 3.463 -24.921 14.812 458 2HZ LYS 51 HZ2 LYS 51 3.411 -26.459 14.105 459 3HZ LYS 51 HZ1 LYS 51 4.795 -25.501 13.942 460 H VAL 52 HN VAL 52 1.448 -21.687 7.876 461 HA VAL 52 HA VAL 52 -0.842 -22.627 9.088 462 HB VAL 52 HB VAL 52 -0.325 -20.355 8.250 463 1HG1 VAL 52 3HG1 VAL 52 0.537 -20.802 6.065 464 2HG1 VAL 52 2HG1 VAL 52 -1.021 -21.445 5.546 465 3HG1 VAL 52 1HG1 VAL 52 -0.866 -19.735 5.952 466 1HG2 VAL 52 1HG2 VAL 52 -2.932 -21.559 7.422 467 2HG2 VAL 52 3HG2 VAL 52 -2.444 -20.917 9.000 468 3HG2 VAL 52 2HG2 VAL 52 -2.590 -19.820 7.614 469 H HIS 53 HN HIS 53 -2.534 -23.848 8.348 470 HA HIS 53 HA HIS 53 -2.007 -25.851 6.411 471 1HB HIS 53 HB2 HIS 53 -3.458 -26.177 8.437 472 2HB HIS 53 HB1 HIS 53 -4.634 -25.077 7.742 473 HD1 HIS 53 HD1 HIS 53 -4.187 -28.571 8.206 474 HD2 HIS 53 HD2 HIS 53 -5.451 -26.235 4.997 475 HE1 HIS 53 HE1 HIS 53 -5.520 -30.085 6.727 476 H LYS 54 HN LYS 54 -2.133 -25.520 4.289 477 HA LYS 54 HA LYS 54 -3.891 -23.410 3.320 478 1HB LYS 54 HB2 LYS 54 -1.439 -24.636 2.041 479 2HB LYS 54 HB1 LYS 54 -2.537 -23.550 1.194 480 1HG LYS 54 HG2 LYS 54 -2.079 -21.833 2.937 481 2HG LYS 54 HG1 LYS 54 -0.871 -22.919 3.618 482 1HD LYS 54 HD2 LYS 54 0.454 -22.799 1.637 483 2HD LYS 54 HD1 LYS 54 -0.803 -21.917 0.763 484 1HE LYS 54 HE2 LYS 54 -0.586 -20.087 2.427 485 2HE LYS 54 HE1 LYS 54 0.748 -20.961 3.167 486 1HZ LYS 54 HZ1 LYS 54 1.969 -20.756 1.084 487 2HZ LYS 54 HZ3 LYS 54 0.692 -19.867 0.398 488 3HZ LYS 54 HZ2 LYS 54 1.522 -19.263 1.728 489 H LEU 55 HN LEU 55 -5.170 -23.786 1.506 490 HA LEU 55 HA LEU 55 -6.611 -26.142 1.667 491 1HB LEU 55 HB2 LEU 55 -7.872 -25.443 -0.270 492 2HB LEU 55 HB1 LEU 55 -7.606 -24.082 0.788 493 HG LEU 55 HG LEU 55 -6.061 -24.565 -1.774 494 1HD1 LEU 55 HD1 LEU 55 -8.412 -24.210 -2.233 495 2HD1 LEU 55 HD1 LEU 55 -8.402 -22.754 -1.236 496 3HD1 LEU 55 HD1 LEU 55 -7.457 -22.811 -2.724 497 1HD2 LEU 55 HD2 LEU 55 -6.298 -22.116 -0.018 498 2HD2 LEU 55 HD2 LEU 55 -4.873 -23.141 -0.175 499 3HD2 LEU 55 HD2 LEU 55 -5.440 -22.203 -1.555 500 H GLU 56 HN GLU 56 -6.512 -28.014 0.782 501 HA GLU 56 HA GLU 56 -4.222 -28.648 -0.836 502 1HB GLU 56 HB2 GLU 56 -5.021 -31.028 -0.460 503 2HB GLU 56 HB1 GLU 56 -4.561 -30.137 0.982 504 1HG GLU 56 HG2 GLU 56 -6.970 -29.645 1.361 505 2HG GLU 56 HG1 GLU 56 -7.349 -30.702 0.003 506 H HIS 57 HN HIS 57 -4.251 -28.957 -2.901 507 HA HIS 57 HA HIS 57 -6.832 -29.225 -4.286 508 1HB HIS 57 HB2 HIS 57 -4.120 -28.358 -5.344 509 2HB HIS 57 HB1 HIS 57 -5.560 -28.544 -6.336 510 HD1 HIS 57 HD1 HIS 57 -3.708 -26.064 -4.400 511 HD2 HIS 57 HD2 HIS 57 -7.660 -26.648 -5.561 512 HE1 HIS 57 HE1 HIS 57 -4.842 -23.831 -4.187 513 H HIS 58 HN HIS 58 -3.735 -30.548 -3.668 514 HA HIS 58 HA HIS 58 -4.415 -33.033 -5.057 515 1HB HIS 58 HB2 HIS 58 -1.689 -31.737 -4.662 516 2HB HIS 58 HB1 HIS 58 -1.940 -33.343 -5.307 517 HD1 HIS 58 HD1 HIS 58 -1.092 -33.077 -7.668 518 HD2 HIS 58 HD2 HIS 58 -3.648 -29.996 -6.575 519 HE1 HIS 58 HE1 HIS 58 -1.446 -31.690 -9.742 520 H HIS 59 HN HIS 59 -3.406 -34.883 -3.903 521 HA HIS 59 HA HIS 59 -2.916 -36.152 -2.096 522 1HB HIS 59 HB2 HIS 59 -1.899 -33.585 -0.834 523 2HB HIS 59 HB1 HIS 59 -1.635 -35.201 -0.205 524 HD1 HIS 59 HD1 HIS 59 0.176 -36.675 -1.494 525 HD2 HIS 59 HD2 HIS 59 -0.271 -32.785 -2.863 526 HE1 HIS 59 HE1 HIS 59 2.197 -36.198 -2.903 527 H HIS 60 HN HIS 60 -5.479 -34.871 -2.394 528 HA HIS 60 HA HIS 60 -6.620 -33.830 -0.121 529 1HB HIS 60 HB2 HIS 60 -7.792 -35.367 -2.379 530 2HB HIS 60 HB1 HIS 60 -8.760 -35.080 -0.951 531 HD1 HIS 60 HD1 HIS 60 -7.612 -33.435 -4.046 532 HD2 HIS 60 HD2 HIS 60 -9.244 -32.359 -0.385 533 HE1 HIS 60 HE1 HIS 60 -8.587 -31.125 -4.351 534 H HIS 61 HN HIS 61 -7.362 -34.441 1.621 535 HA HIS 61 HA HIS 61 -6.963 -37.168 2.545 536 1HB HIS 61 HB2 HIS 61 -7.772 -34.624 3.987 537 2HB HIS 61 HB1 HIS 61 -7.526 -36.183 4.774 538 HD1 HIS 61 HD1 HIS 61 -5.622 -33.241 3.357 539 HD2 HIS 61 HD2 HIS 61 -4.858 -37.015 4.960 540 HE1 HIS 61 HE1 HIS 61 -3.177 -33.299 3.883 541 H HIS 62 HN HIS 62 -8.769 -38.173 3.800 542 HA HIS 62 HA HIS 62 -11.269 -37.604 2.386 543 1HB HIS 62 HB2 HIS 62 -10.305 -40.205 3.595 544 2HB HIS 62 HB1 HIS 62 -11.882 -39.973 2.849 545 HD1 HIS 62 HD1 HIS 62 -11.921 -39.757 0.232 546 HD2 HIS 62 HD2 HIS 62 -8.169 -40.493 1.855 547 HE1 HIS 62 HE1 HIS 62 -10.440 -40.405 -1.704 548 H1 MET 101 HT2 MET 101 13.289 21.028 -2.640 549 H2 MET 101 HT1 MET 101 14.689 20.200 -2.202 550 H3 MET 101 HT3 MET 101 13.309 19.332 -2.569 551 HA MET 101 HA MET 101 13.604 19.313 -0.212 552 1HB MET 101 HB2 MET 101 13.341 22.322 -0.470 553 2HB MET 101 HB1 MET 101 13.414 21.440 1.045 554 1HG MET 101 HG2 MET 101 15.692 20.718 0.503 555 2HG MET 101 HG1 MET 101 15.603 21.614 -1.009 556 1HE MET 101 HE2 MET 101 15.484 24.265 -1.164 557 2HE MET 101 HE1 MET 101 14.064 24.300 -0.119 558 3HE MET 101 HE3 MET 101 15.447 25.336 0.233 559 H GLU 102 HN GLU 102 11.634 20.280 -2.627 560 HA GLU 102 HA GLU 102 9.325 21.121 -1.166 561 1HB GLU 102 HB2 GLU 102 9.908 20.693 -4.102 562 2HB GLU 102 HB1 GLU 102 8.430 21.374 -3.457 563 1HG GLU 102 HG2 GLU 102 9.912 23.119 -4.353 564 2HG GLU 102 HG1 GLU 102 9.642 23.322 -2.630 565 H MET 103 HN MET 103 7.349 20.081 -1.256 566 HA MET 103 HA MET 103 7.540 17.361 -0.647 567 1HB MET 103 HB2 MET 103 5.129 17.309 -0.394 568 2HB MET 103 HB1 MET 103 5.786 18.764 0.327 569 1HG MET 103 HG2 MET 103 5.059 20.049 -1.623 570 2HG MET 103 HG1 MET 103 4.421 18.578 -2.349 571 1HE MET 103 HE3 MET 103 2.082 19.747 -2.697 572 2HE MET 103 HE2 MET 103 1.183 20.553 -1.413 573 3HE MET 103 HE1 MET 103 2.712 21.230 -1.979 574 H GLY 104 HN GLY 104 6.933 18.887 -3.668 575 1HA GLY 104 HA1 GLY 104 6.507 18.030 -5.772 576 2HA GLY 104 HA2 GLY 104 5.648 16.712 -4.987 577 H GLN 105 HN GLN 105 8.927 17.431 -4.275 578 HA GLN 105 HA GLN 105 10.038 15.429 -6.074 579 1HB GLN 105 HB2 GLN 105 11.310 17.135 -3.937 580 2HB GLN 105 HB1 GLN 105 12.149 16.182 -5.169 581 1HG GLN 105 HG2 GLN 105 11.603 17.636 -6.859 582 2HG GLN 105 HG1 GLN 105 10.182 18.245 -6.011 583 1HE2 GLN 105 1HE2 GLN 105 10.762 20.305 -6.318 584 2HE2 GLN 105 2HE2 GLN 105 12.025 21.062 -5.407 585 H LEU 106 HN LEU 106 9.407 16.013 -2.716 586 HA LEU 106 HA LEU 106 10.500 13.720 -1.552 587 1HB LEU 106 HB2 LEU 106 9.810 15.692 -0.287 588 2HB LEU 106 HB1 LEU 106 8.173 15.502 -0.842 589 HG LEU 106 HG LEU 106 8.652 15.001 1.600 590 1HD1 LEU 106 HD1 LEU 106 7.278 12.881 -0.013 591 2HD1 LEU 106 HD1 LEU 106 7.107 13.129 1.725 592 3HD1 LEU 106 HD1 LEU 106 6.568 14.372 0.593 593 1HD2 LEU 106 HD2 LEU 106 10.697 13.716 1.338 594 2HD2 LEU 106 HD2 LEU 106 9.445 12.774 2.150 595 3HD2 LEU 106 HD2 LEU 106 9.812 12.469 0.449 596 H LYS 107 HN LYS 107 7.298 14.382 -2.876 597 HA LYS 107 HA LYS 107 6.116 11.865 -2.391 598 1HB LYS 107 HB2 LYS 107 5.266 14.311 -3.227 599 2HB LYS 107 HB1 LYS 107 5.235 13.434 -4.742 600 1HG LYS 107 HG2 LYS 107 3.812 12.558 -2.242 601 2HG LYS 107 HG1 LYS 107 3.076 13.523 -3.496 602 1HD LYS 107 HD2 LYS 107 4.205 10.739 -3.911 603 2HD LYS 107 HD1 LYS 107 2.497 11.099 -3.644 604 1HE LYS 107 HE2 LYS 107 2.610 12.581 -5.665 605 2HE LYS 107 HE1 LYS 107 4.226 11.936 -5.961 606 1HZ LYS 107 HZ1 LYS 107 3.153 9.676 -6.068 607 2HZ LYS 107 HZ3 LYS 107 1.661 10.459 -5.946 608 3HZ LYS 107 HZ2 LYS 107 2.660 10.761 -7.260 609 H ASN 108 HN ASN 108 8.110 13.154 -4.924 610 HA ASN 108 HA ASN 108 7.724 11.132 -6.884 611 1HB ASN 108 HB2 ASN 108 8.727 13.438 -7.258 612 2HB ASN 108 HB1 ASN 108 10.175 12.871 -6.453 613 1HD2 ASN 108 HD2 ASN 108 9.784 13.902 -9.125 614 2HD2 ASN 108 HD2 ASN 108 10.338 12.691 -10.217 615 H LYS 109 HN LYS 109 10.070 11.632 -4.269 616 HA LYS 109 HA LYS 109 11.501 9.239 -4.795 617 1HB LYS 109 HB2 LYS 109 11.383 10.849 -2.241 618 2HB LYS 109 HB1 LYS 109 12.523 9.561 -2.574 619 1HG LYS 109 HG2 LYS 109 12.341 12.227 -3.970 620 2HG LYS 109 HG1 LYS 109 13.610 11.685 -2.879 621 1HD LYS 109 HD2 LYS 109 12.989 10.577 -5.633 622 2HD LYS 109 HD1 LYS 109 14.370 11.569 -5.195 623 1HE LYS 109 HE2 LYS 109 13.794 8.766 -4.224 624 2HE LYS 109 HE1 LYS 109 15.008 9.234 -5.404 625 1HZ LYS 109 HZ1 LYS 109 16.171 10.465 -3.669 626 2HZ LYS 109 HZ3 LYS 109 14.993 10.029 -2.543 627 3HZ LYS 109 HZ2 LYS 109 15.965 8.849 -3.232 628 H ILE 110 HN ILE 110 8.729 10.018 -2.828 629 HA ILE 110 HA ILE 110 8.460 7.580 -1.469 630 HB ILE 110 HB ILE 110 6.409 9.594 -2.408 631 1HG1 ILE 110 2HG1 ILE 110 7.452 8.850 0.296 632 2HG1 ILE 110 1HG1 ILE 110 7.971 10.261 -0.633 633 1HG2 ILE 110 3HG2 ILE 110 5.303 7.414 -2.330 634 2HG2 ILE 110 2HG2 ILE 110 5.866 7.182 -0.675 635 3HG2 ILE 110 1HG2 ILE 110 4.717 8.471 -1.039 636 1HD1 ILE 110 HD1 ILE 110 5.235 9.734 0.499 637 2HD1 ILE 110 HD1 ILE 110 6.435 10.862 1.137 638 3HD1 ILE 110 HD1 ILE 110 5.700 11.150 -0.442 639 H GLU 111 HN GLU 111 7.203 8.611 -4.606 640 HA GLU 111 HA GLU 111 5.999 6.255 -5.436 641 1HB GLU 111 HB2 GLU 111 7.582 8.249 -7.056 642 2HB GLU 111 HB1 GLU 111 6.651 6.936 -7.752 643 1HG GLU 111 HG2 GLU 111 5.537 9.160 -6.080 644 2HG GLU 111 HG1 GLU 111 5.476 9.079 -7.840 645 H ASN 112 HN ASN 112 9.297 7.319 -5.935 646 HA ASN 112 HA ASN 112 10.346 5.106 -7.212 647 1HB ASN 112 HB2 ASN 112 11.581 7.162 -7.130 648 2HB ASN 112 HB1 ASN 112 11.699 7.081 -5.378 649 1HD2 ASN 112 HD2 ASN 112 13.316 5.875 -4.448 650 2HD2 ASN 112 HD2 ASN 112 14.497 5.026 -5.357 651 H LYS 113 HN LYS 113 10.311 5.723 -3.708 652 HA LYS 113 HA LYS 113 11.714 3.340 -3.062 653 1HB LYS 113 HB2 LYS 113 11.564 5.397 -1.610 654 2HB LYS 113 HB1 LYS 113 9.900 4.972 -1.278 655 1HG LYS 113 HG2 LYS 113 11.432 4.325 0.540 656 2HG LYS 113 HG1 LYS 113 10.578 2.950 -0.157 657 1HD LYS 113 HD2 LYS 113 12.868 2.383 0.215 658 2HD LYS 113 HD1 LYS 113 12.581 2.431 -1.521 659 1HE LYS 113 HE2 LYS 113 14.631 3.475 -1.274 660 2HE LYS 113 HE1 LYS 113 13.526 4.842 -1.306 661 1HZ LYS 113 HZ1 LYS 113 13.606 4.852 1.157 662 2HZ LYS 113 HZ3 LYS 113 14.702 3.570 1.089 663 3HZ LYS 113 HZ2 LYS 113 15.128 5.073 0.482 664 H LYS 114 HN LYS 114 8.267 4.116 -3.184 665 HA LYS 114 HA LYS 114 7.165 1.726 -2.344 666 1HB LYS 114 HB2 LYS 114 5.880 3.743 -2.718 667 2HB LYS 114 HB1 LYS 114 6.328 3.738 -4.417 668 1HG LYS 114 HG2 LYS 114 5.054 1.617 -4.684 669 2HG LYS 114 HG1 LYS 114 4.533 1.785 -3.007 670 1HD LYS 114 HD2 LYS 114 2.795 2.637 -4.485 671 2HD LYS 114 HD1 LYS 114 3.521 3.958 -3.567 672 1HE LYS 114 HE2 LYS 114 4.907 4.546 -5.500 673 2HE LYS 114 HE1 LYS 114 4.189 3.203 -6.379 674 1HZ LYS 114 HZ2 LYS 114 2.589 5.444 -5.277 675 2HZ LYS 114 HZ1 LYS 114 3.257 5.481 -6.814 676 3HZ LYS 114 HZ3 LYS 114 2.093 4.323 -6.439 677 H LYS 115 HN LYS 115 8.239 2.834 -5.515 678 HA LYS 115 HA LYS 115 7.474 0.519 -6.927 679 1HB LYS 115 HB2 LYS 115 9.351 2.763 -7.618 680 2HB LYS 115 HB1 LYS 115 8.966 1.462 -8.741 681 1HG LYS 115 HG2 LYS 115 6.716 2.104 -8.907 682 2HG LYS 115 HG1 LYS 115 6.802 3.090 -7.448 683 1HD LYS 115 HD2 LYS 115 8.163 4.673 -8.514 684 2HD LYS 115 HD1 LYS 115 8.300 3.716 -10.000 685 1HE LYS 115 HE2 LYS 115 5.798 3.987 -10.225 686 2HE LYS 115 HE1 LYS 115 5.835 5.036 -8.811 687 1HZ LYS 115 HZ3 LYS 115 7.336 6.533 -10.066 688 2HZ LYS 115 HZ2 LYS 115 7.179 5.518 -11.405 689 3HZ LYS 115 HZ1 LYS 115 5.833 6.328 -10.821 690 H GLU 116 HN GLU 116 10.558 1.450 -5.486 691 HA GLU 116 HA GLU 116 12.094 -0.785 -6.200 692 1HB GLU 116 HB2 GLU 116 12.028 0.735 -3.586 693 2HB GLU 116 HB1 GLU 116 13.205 -0.515 -3.926 694 1HG GLU 116 HG2 GLU 116 14.057 0.852 -5.800 695 2HG GLU 116 HG1 GLU 116 12.893 2.107 -5.377 696 H LEU 117 HN LEU 117 9.715 -0.379 -3.680 697 HA LEU 117 HA LEU 117 10.055 -2.927 -2.521 698 1HB LEU 117 HB2 LEU 117 9.188 -1.251 -1.124 699 2HB LEU 117 HB1 LEU 117 7.987 -0.768 -2.291 700 HG LEU 117 HG LEU 117 7.095 -1.884 -0.229 701 1HD1 LEU 117 HD1 LEU 117 5.779 -1.605 -2.072 702 2HD1 LEU 117 HD1 LEU 117 6.349 -3.125 -2.763 703 3HD1 LEU 117 HD1 LEU 117 5.421 -3.134 -1.250 704 1HD2 LEU 117 HD2 LEU 117 8.356 -4.327 -1.413 705 2HD2 LEU 117 HD2 LEU 117 8.801 -3.560 0.110 706 3HD2 LEU 117 HD2 LEU 117 7.206 -4.299 -0.068 707 H ILE 118 HN ILE 118 7.780 -1.638 -4.868 708 HA ILE 118 HA ILE 118 6.125 -3.832 -5.017 709 HB ILE 118 HB ILE 118 6.876 -1.968 -7.304 710 1HG1 ILE 118 2HG1 ILE 118 4.448 -1.902 -5.510 711 2HG1 ILE 118 1HG1 ILE 118 5.900 -0.959 -5.201 712 1HG2 ILE 118 3HG2 ILE 118 5.826 -4.043 -8.163 713 2HG2 ILE 118 2HG2 ILE 118 4.473 -3.824 -7.072 714 3HG2 ILE 118 1HG2 ILE 118 4.749 -2.665 -8.360 715 1HD1 ILE 118 HD1 ILE 118 4.144 -0.754 -7.632 716 2HD1 ILE 118 HD1 ILE 118 4.195 0.376 -6.273 717 3HD1 ILE 118 HD1 ILE 118 5.603 0.184 -7.316 718 H GLN 119 HN GLN 119 9.134 -3.108 -6.642 719 HA GLN 119 HA GLN 119 9.271 -5.303 -8.402 720 1HB GLN 119 HB2 GLN 119 11.519 -3.763 -7.098 721 2HB GLN 119 HB1 GLN 119 11.701 -4.875 -8.441 722 1HG GLN 119 HG2 GLN 119 10.265 -3.427 -9.806 723 2HG GLN 119 HG1 GLN 119 10.152 -2.302 -8.454 724 1HE2 GLN 119 1HE2 GLN 119 12.183 -3.599 -10.912 725 2HE2 GLN 119 2HE2 GLN 119 13.445 -2.428 -10.784 726 H LEU 120 HN LEU 120 10.427 -4.820 -5.117 727 HA LEU 120 HA LEU 120 11.630 -7.313 -4.709 728 1HB LEU 120 HB2 LEU 120 10.576 -5.164 -2.962 729 2HB LEU 120 HB1 LEU 120 10.765 -6.748 -2.254 730 HG LEU 120 HG LEU 120 13.120 -6.702 -2.474 731 1HD1 LEU 120 HD1 LEU 120 12.828 -4.228 -4.146 732 2HD1 LEU 120 HD1 LEU 120 14.329 -4.999 -3.596 733 3HD1 LEU 120 HD1 LEU 120 13.283 -5.843 -4.746 734 1HD2 LEU 120 HD2 LEU 120 12.159 -3.955 -1.764 735 2HD2 LEU 120 HD2 LEU 120 12.306 -5.343 -0.682 736 3HD2 LEU 120 HD2 LEU 120 13.747 -4.619 -1.395 737 H VAL 121 HN VAL 121 8.311 -6.271 -3.738 738 HA VAL 121 HA VAL 121 7.408 -8.786 -2.948 739 HB VAL 121 HB VAL 121 5.777 -6.599 -4.285 740 1HG1 VAL 121 2HG1 VAL 121 4.618 -8.762 -4.076 741 2HG1 VAL 121 1HG1 VAL 121 4.903 -8.718 -2.340 742 3HG1 VAL 121 3HG1 VAL 121 3.876 -7.493 -3.090 743 1HG2 VAL 121 1HG2 VAL 121 6.457 -7.024 -1.391 744 2HG2 VAL 121 3HG2 VAL 121 7.054 -5.743 -2.460 745 3HG2 VAL 121 2HG2 VAL 121 5.338 -5.812 -2.036 746 H ALA 122 HN ALA 122 7.513 -7.371 -6.161 747 HA ALA 122 HA ALA 122 6.025 -9.262 -7.572 748 1HB ALA 122 HB1 ALA 122 8.276 -7.542 -8.554 749 2HB ALA 122 HB3 ALA 122 6.997 -8.266 -9.548 750 3HB ALA 122 HB2 ALA 122 6.611 -7.028 -8.338 751 H ARG 123 HN ARG 123 9.550 -8.974 -7.163 752 HA ARG 123 HA ARG 123 10.126 -11.351 -8.642 753 1HB ARG 123 HB2 ARG 123 12.447 -11.067 -7.846 754 2HB ARG 123 HB1 ARG 123 11.790 -9.591 -8.545 755 1HG ARG 123 HG2 ARG 123 11.407 -8.695 -6.330 756 2HG ARG 123 HG1 ARG 123 11.997 -10.185 -5.605 757 1HD ARG 123 HD2 ARG 123 13.636 -8.428 -7.417 758 2HD ARG 123 HD1 ARG 123 13.642 -8.300 -5.658 759 HE ARG 123 HE ARG 123 14.158 -10.953 -6.434 760 1HH1 ARG 123 1HH1 ARG 123 15.751 -7.791 -6.457 761 2HH1 ARG 123 2HH1 ARG 123 17.313 -8.407 -6.214 762 1HH2 ARG 123 1HH2 ARG 123 16.277 -11.821 -6.121 763 2HH2 ARG 123 2HH2 ARG 123 17.626 -10.796 -6.028 764 H HIS 124 HN HIS 124 9.018 -10.858 -5.529 765 HA HIS 124 HA HIS 124 10.277 -12.963 -4.149 766 1HB HIS 124 HB2 HIS 124 8.978 -11.202 -3.011 767 2HB HIS 124 HB1 HIS 124 7.493 -11.771 -3.726 768 HD1 HIS 124 HD1 HIS 124 9.555 -12.144 -0.732 769 HD2 HIS 124 HD2 HIS 124 6.838 -14.478 -2.801 770 HE1 HIS 124 HE1 HIS 124 8.822 -13.930 0.876 771 H GLY 125 HN GLY 125 7.096 -12.800 -5.675 772 1HA GLY 125 HA1 GLY 125 6.574 -15.546 -5.464 773 2HA GLY 125 HA2 GLY 125 7.316 -15.227 -7.026 774 H LEU 126 HN LEU 126 6.156 -12.597 -7.393 775 HA LEU 126 HA LEU 126 3.340 -13.345 -7.522 776 1HB LEU 126 HB2 LEU 126 4.640 -10.663 -7.847 777 2HB LEU 126 HB1 LEU 126 2.949 -10.950 -8.139 778 HG LEU 126 HG LEU 126 4.457 -11.017 -5.621 779 1HD1 LEU 126 HD1 LEU 126 2.155 -9.332 -6.504 780 2HD1 LEU 126 HD1 LEU 126 2.787 -9.388 -4.855 781 3HD1 LEU 126 HD1 LEU 126 3.822 -8.855 -6.179 782 1HD2 LEU 126 HD2 LEU 126 1.635 -12.010 -5.961 783 2HD2 LEU 126 HD2 LEU 126 3.053 -12.930 -5.442 784 3HD2 LEU 126 HD2 LEU 126 2.415 -11.668 -4.410 785 H ASP 127 HN ASP 127 2.249 -12.971 -9.326 786 HA ASP 127 HA ASP 127 3.810 -13.199 -11.783 787 1HB ASP 127 HB2 ASP 127 0.850 -13.637 -11.287 788 2HB ASP 127 HB1 ASP 127 1.647 -13.837 -12.838 789 H HIS 128 HN HIS 128 2.608 -11.972 -13.643 790 HA HIS 128 HA HIS 128 3.100 -9.288 -13.085 791 1HB HIS 128 HB2 HIS 128 3.191 -10.447 -15.339 792 2HB HIS 128 HB1 HIS 128 1.443 -10.280 -15.398 793 HD1 HIS 128 HD1 HIS 128 4.607 -8.241 -15.604 794 HD2 HIS 128 HD2 HIS 128 0.502 -7.742 -15.986 795 HE1 HIS 128 HE1 HIS 128 4.281 -5.961 -16.584 796 H ASP 129 HN ASP 129 0.045 -11.042 -13.154 797 HA ASP 129 HA ASP 129 -1.640 -8.793 -13.000 798 1HB ASP 129 HB2 ASP 129 -3.410 -10.303 -12.367 799 2HB ASP 129 HB1 ASP 129 -2.438 -11.065 -13.617 800 H LYS 130 HN LYS 130 -0.125 -10.750 -10.565 801 HA LYS 130 HA LYS 130 -1.398 -9.597 -8.326 802 1HB LYS 130 HB2 LYS 130 1.147 -11.137 -8.654 803 2HB LYS 130 HB1 LYS 130 0.710 -10.560 -7.084 804 1HG LYS 130 HG2 LYS 130 -0.938 -12.413 -8.824 805 2HG LYS 130 HG1 LYS 130 0.067 -12.900 -7.457 806 1HD LYS 130 HD2 LYS 130 -1.360 -11.603 -5.942 807 2HD LYS 130 HD1 LYS 130 -2.352 -11.080 -7.301 808 1HE LYS 130 HE2 LYS 130 -3.019 -13.361 -7.738 809 2HE LYS 130 HE1 LYS 130 -1.969 -13.956 -6.458 810 1HZ LYS 130 HZ3 LYS 130 -4.318 -12.168 -6.085 811 2HZ LYS 130 HZ2 LYS 130 -4.295 -13.809 -5.762 812 3HZ LYS 130 HZ1 LYS 130 -3.345 -12.770 -4.843 813 H VAL 131 HN VAL 131 1.659 -8.876 -9.935 814 HA VAL 131 HA VAL 131 2.559 -6.859 -8.265 815 HB VAL 131 HB VAL 131 2.862 -6.964 -11.276 816 1HG1 VAL 131 3HG1 VAL 131 4.620 -5.748 -9.162 817 2HG1 VAL 131 2HG1 VAL 131 4.991 -5.837 -10.886 818 3HG1 VAL 131 1HG1 VAL 131 3.623 -4.878 -10.327 819 1HG2 VAL 131 2HG2 VAL 131 3.430 -9.117 -10.310 820 2HG2 VAL 131 1HG2 VAL 131 4.884 -8.294 -10.886 821 3HG2 VAL 131 3HG2 VAL 131 4.510 -8.334 -9.160 822 H LEU 132 HN LEU 132 0.378 -6.732 -11.050 823 HA LEU 132 HA LEU 132 0.061 -3.912 -11.130 824 1HB LEU 132 HB2 LEU 132 -1.895 -6.008 -12.041 825 2HB LEU 132 HB1 LEU 132 -1.887 -4.324 -12.507 826 HG LEU 132 HG LEU 132 0.119 -6.432 -13.247 827 1HD1 LEU 132 HD1 LEU 132 -1.842 -4.837 -14.855 828 2HD1 LEU 132 HD1 LEU 132 -0.621 -5.923 -15.526 829 3HD1 LEU 132 HD1 LEU 132 -1.907 -6.563 -14.497 830 1HD2 LEU 132 HD2 LEU 132 0.177 -3.474 -13.865 831 2HD2 LEU 132 HD2 LEU 132 1.306 -4.373 -12.837 832 3HD2 LEU 132 HD2 LEU 132 1.235 -4.707 -14.564 833 H LEU 133 HN LEU 133 -1.924 -6.441 -9.681 834 HA LEU 133 HA LEU 133 -3.878 -4.666 -8.678 835 1HB LEU 133 HB2 LEU 133 -3.134 -7.425 -7.743 836 2HB LEU 133 HB1 LEU 133 -4.591 -6.541 -7.305 837 HG LEU 133 HG LEU 133 -3.876 -7.409 -10.108 838 1HD1 LEU 133 HD1 LEU 133 -5.788 -8.627 -8.134 839 2HD1 LEU 133 HD1 LEU 133 -5.666 -9.048 -9.847 840 3HD1 LEU 133 HD1 LEU 133 -4.299 -9.339 -8.779 841 1HD2 LEU 133 HD2 LEU 133 -6.412 -6.235 -8.971 842 2HD2 LEU 133 HD2 LEU 133 -5.297 -5.437 -10.077 843 3HD2 LEU 133 HD2 LEU 133 -6.213 -6.844 -10.615 844 H PHE 134 HN PHE 134 -0.982 -6.076 -7.268 845 HA PHE 134 HA PHE 134 -1.325 -5.099 -4.672 846 1HB PHE 134 HB2 PHE 134 0.279 -6.848 -5.108 847 2HB PHE 134 HB1 PHE 134 1.185 -5.810 -6.199 848 HD1 PHE 134 HD1 PHE 134 0.159 -6.183 -2.652 849 HD2 PHE 134 HD2 PHE 134 2.936 -4.499 -5.401 850 HE1 PHE 134 HE1 PHE 134 1.568 -5.443 -0.781 851 HE2 PHE 134 HE2 PHE 134 4.343 -3.756 -3.518 852 HZ PHE 134 HZ PHE 134 3.672 -4.225 -1.240 853 H SER 135 HN SER 135 0.574 -3.788 -7.388 854 HA SER 135 HA SER 135 1.603 -1.623 -6.002 855 1HB SER 135 HB2 SER 135 2.019 -0.642 -8.274 856 2HB SER 135 HB1 SER 135 2.619 -2.284 -8.042 857 HG SER 135 HG SER 135 1.070 -3.071 -9.284 858 H ARG 136 HN ARG 136 -1.400 -1.872 -7.812 859 HA ARG 136 HA ARG 136 -1.903 0.929 -7.506 860 1HB ARG 136 HB2 ARG 136 -4.004 0.557 -8.604 861 2HB ARG 136 HB1 ARG 136 -2.726 -0.292 -9.468 862 1HG ARG 136 HG2 ARG 136 -3.478 -2.375 -8.313 863 2HG ARG 136 HG1 ARG 136 -4.847 -1.454 -7.686 864 1HD ARG 136 HD2 ARG 136 -4.160 -1.999 -10.558 865 2HD ARG 136 HD1 ARG 136 -5.550 -2.597 -9.664 866 HE ARG 136 HE ARG 136 -5.211 0.288 -10.037 867 1HH1 ARG 136 1HH1 ARG 136 -7.200 -2.581 -10.510 868 2HH1 ARG 136 2HH1 ARG 136 -8.385 -1.754 -11.417 869 1HH2 ARG 136 1HH2 ARG 136 -6.853 1.402 -11.216 870 2HH2 ARG 136 2HH2 ARG 136 -8.195 0.548 -11.817 871 H ASP 137 HN ASP 137 -2.795 -1.960 -5.726 872 HA ASP 137 HA ASP 137 -4.811 -0.631 -4.174 873 1HB ASP 137 HB2 ASP 137 -4.499 -3.165 -4.543 874 2HB ASP 137 HB1 ASP 137 -3.270 -3.063 -3.285 875 H LEU 138 HN LEU 138 -1.450 -1.388 -3.875 876 HA LEU 138 HA LEU 138 -0.839 -0.299 -1.376 877 1HB LEU 138 HB2 LEU 138 0.742 -1.655 -2.478 878 2HB LEU 138 HB1 LEU 138 0.649 -0.722 -3.946 879 HG LEU 138 HG LEU 138 1.950 1.069 -2.899 880 1HD1 LEU 138 HD1 LEU 138 2.106 -0.763 -0.518 881 2HD1 LEU 138 HD1 LEU 138 3.022 0.727 -0.785 882 3HD1 LEU 138 HD1 LEU 138 1.267 0.802 -0.603 883 1HD2 LEU 138 HD2 LEU 138 3.146 -1.674 -2.681 884 2HD2 LEU 138 HD2 LEU 138 3.093 -0.650 -4.116 885 3HD2 LEU 138 HD2 LEU 138 4.057 -0.167 -2.722 886 H ASP 139 HN ASP 139 -0.814 1.108 -4.602 887 HA ASP 139 HA ASP 139 -0.031 3.697 -4.000 888 1HB ASP 139 HB2 ASP 139 -0.212 2.728 -6.284 889 2HB ASP 139 HB1 ASP 139 -1.962 2.819 -6.154 890 H LYS 140 HN LYS 140 -3.277 2.257 -3.984 891 HA LYS 140 HA LYS 140 -4.658 4.692 -3.560 892 1HB LYS 140 HB2 LYS 140 -6.578 3.521 -3.406 893 2HB LYS 140 HB1 LYS 140 -5.610 2.332 -4.284 894 1HG LYS 140 HG2 LYS 140 -5.201 1.225 -2.045 895 2HG LYS 140 HG1 LYS 140 -6.365 2.345 -1.350 896 1HD LYS 140 HD2 LYS 140 -8.015 1.440 -3.067 897 2HD LYS 140 HD1 LYS 140 -6.832 0.168 -3.368 898 1HE LYS 140 HE2 LYS 140 -8.179 0.793 -0.739 899 2HE LYS 140 HE1 LYS 140 -8.482 -0.609 -1.760 900 1HZ LYS 140 HZ1 LYS 140 -6.167 -1.366 -1.246 901 2HZ LYS 140 HZ3 LYS 140 -5.976 -0.007 -0.260 902 3HZ LYS 140 HZ2 LYS 140 -7.107 -1.159 0.115 903 H LEU 141 HN LEU 141 -3.346 2.286 -1.374 904 HA LEU 141 HA LEU 141 -4.447 3.264 1.028 905 1HB LEU 141 HB2 LEU 141 -3.531 1.033 0.868 906 2HB LEU 141 HB1 LEU 141 -1.956 1.667 0.447 907 HG LEU 141 HG LEU 141 -1.753 2.622 2.712 908 1HD1 LEU 141 HD1 LEU 141 -4.115 2.901 3.237 909 2HD1 LEU 141 HD1 LEU 141 -4.311 1.145 3.295 910 3HD1 LEU 141 HD1 LEU 141 -3.282 1.959 4.471 911 1HD2 LEU 141 HD2 LEU 141 -0.812 0.449 2.187 912 2HD2 LEU 141 HD2 LEU 141 -1.387 0.504 3.855 913 3HD2 LEU 141 HD2 LEU 141 -2.332 -0.330 2.620 914 H ILE 142 HN ILE 142 -1.639 3.954 -0.804 915 HA ILE 142 HA ILE 142 -0.412 5.575 1.197 916 HB ILE 142 HB ILE 142 0.211 5.330 -1.766 917 1HG1 ILE 142 2HG1 ILE 142 1.591 4.282 0.697 918 2HG1 ILE 142 1HG1 ILE 142 0.617 3.323 -0.414 919 1HG2 ILE 142 2HG2 ILE 142 1.744 6.784 0.406 920 2HG2 ILE 142 1HG2 ILE 142 2.328 6.491 -1.236 921 3HG2 ILE 142 3HG2 ILE 142 0.926 7.526 -0.968 922 1HD1 ILE 142 HD1 ILE 142 3.181 4.736 -1.109 923 2HD1 ILE 142 HD1 ILE 142 3.013 3.014 -0.749 924 3HD1 ILE 142 HD1 ILE 142 2.206 3.694 -2.155 925 H ASN 143 HN ASN 143 -2.025 6.325 -1.843 926 HA ASN 143 HA ASN 143 -2.054 9.109 -1.686 927 1HB ASN 143 HB2 ASN 143 -4.259 7.355 -2.804 928 2HB ASN 143 HB1 ASN 143 -4.047 9.078 -3.086 929 1HD2 ASN 143 HD2 ASN 143 -4.111 6.798 -4.913 930 2HD2 ASN 143 HD2 ASN 143 -2.633 6.809 -5.785 931 H LYS 144 HN LYS 144 -4.225 6.786 -0.242 932 HA LYS 144 HA LYS 144 -6.195 8.470 0.789 933 1HB LYS 144 HB2 LYS 144 -6.454 6.078 0.736 934 2HB LYS 144 HB1 LYS 144 -5.083 5.856 1.807 935 1HG LYS 144 HG2 LYS 144 -6.364 6.973 3.621 936 2HG LYS 144 HG1 LYS 144 -7.730 7.098 2.505 937 1HD LYS 144 HD2 LYS 144 -6.453 4.483 3.254 938 2HD LYS 144 HD1 LYS 144 -7.840 5.168 4.100 939 1HE LYS 144 HE2 LYS 144 -7.775 4.594 1.139 940 2HE LYS 144 HE1 LYS 144 -8.401 3.500 2.367 941 1HZ LYS 144 HZ2 LYS 144 -9.489 6.270 2.057 942 2HZ LYS 144 HZ1 LYS 144 -10.110 4.916 1.234 943 3HZ LYS 144 HZ3 LYS 144 -10.126 4.987 2.905 944 H PHE 145 HN PHE 145 -3.174 7.342 2.242 945 HA PHE 145 HA PHE 145 -3.658 8.863 4.597 946 1HB PHE 145 HB2 PHE 145 -1.495 7.016 3.740 947 2HB PHE 145 HB1 PHE 145 -1.240 8.106 5.110 948 HD1 PHE 145 HD1 PHE 145 -3.339 5.326 3.848 949 HD2 PHE 145 HD2 PHE 145 -2.274 7.795 7.121 950 HE1 PHE 145 HE1 PHE 145 -4.584 3.838 5.351 951 HE2 PHE 145 HE2 PHE 145 -3.531 6.308 8.654 952 HZ PHE 145 HZ PHE 145 -4.682 4.327 7.756 953 H MET 146 HN MET 146 -1.833 9.345 1.705 954 HA MET 146 HA MET 146 -0.198 11.496 2.633 955 1HB MET 146 HB2 MET 146 -1.227 11.116 -0.183 956 2HB MET 146 HB1 MET 146 0.183 12.046 0.314 957 1HG MET 146 HG2 MET 146 0.991 9.763 1.264 958 2HG MET 146 HG1 MET 146 -0.207 9.105 0.173 959 1HE MET 146 HE1 MET 146 3.060 10.710 0.724 960 2HE MET 146 HE3 MET 146 3.634 11.240 -0.846 961 3HE MET 146 HE2 MET 146 2.329 12.128 -0.039 962 H ASN 147 HN ASN 147 -3.446 11.135 1.851 963 HA ASN 147 HA ASN 147 -5.289 12.364 1.901 964 1HB ASN 147 HB2 ASN 147 -4.316 13.399 3.985 965 2HB ASN 147 HB1 ASN 147 -3.598 14.646 2.983 966 1HD2 ASN 147 HD2 ASN 147 -5.514 14.799 5.189 967 2HD2 ASN 147 HD2 ASN 147 -6.880 15.658 4.583 968 H VAL 148 HN VAL 148 -4.997 12.002 -0.297 969 HA VAL 148 HA VAL 148 -4.226 14.280 -1.852 970 HB VAL 148 HB VAL 148 -4.741 12.966 -3.861 971 1HG1 VAL 148 3HG1 VAL 148 -2.900 11.592 -1.907 972 2HG1 VAL 148 2HG1 VAL 148 -2.883 11.339 -3.651 973 3HG1 VAL 148 1HG1 VAL 148 -2.486 12.927 -2.985 974 1HG2 VAL 148 2HG2 VAL 148 -6.498 11.501 -2.958 975 2HG2 VAL 148 1HG2 VAL 148 -5.226 10.568 -3.744 976 3HG2 VAL 148 3HG2 VAL 148 -5.290 10.657 -1.983 977 H LYS 149 HN LYS 149 -5.456 15.739 -2.337 978 HA LYS 149 HA LYS 149 -8.277 15.384 -1.968 979 1HB LYS 149 HB2 LYS 149 -6.551 17.845 -2.229 980 2HB LYS 149 HB1 LYS 149 -8.292 17.872 -1.951 981 1HG LYS 149 HG2 LYS 149 -8.110 16.869 0.167 982 2HG LYS 149 HG1 LYS 149 -6.452 16.362 -0.122 983 1HD LYS 149 HD2 LYS 149 -7.301 19.250 0.050 984 2HD LYS 149 HD1 LYS 149 -6.779 18.324 1.451 985 1HE LYS 149 HE2 LYS 149 -5.115 18.729 -1.040 986 2HE LYS 149 HE1 LYS 149 -4.965 19.695 0.416 987 1HZ LYS 149 HZ1 LYS 149 -4.370 17.684 1.645 988 2HZ LYS 149 HZ3 LYS 149 -4.448 16.747 0.244 989 3HZ LYS 149 HZ2 LYS 149 -3.308 17.968 0.389 990 H ASP 150 HN ASP 150 -8.860 14.366 -3.654 991 HA ASP 150 HA ASP 150 -8.888 15.572 -6.313 992 1HB ASP 150 HB2 ASP 150 -6.756 14.006 -5.856 993 2HB ASP 150 HB1 ASP 150 -7.949 12.727 -5.988 994 H LYS 151 HN LYS 151 -9.842 13.307 -7.453 995 HA LYS 151 HA LYS 151 -12.512 13.172 -6.119 996 1HB LYS 151 HB2 LYS 151 -13.369 12.819 -8.450 997 2HB LYS 151 HB1 LYS 151 -12.588 14.382 -8.223 998 1HG LYS 151 HG2 LYS 151 -10.493 13.354 -9.109 999 2HG LYS 151 HG1 LYS 151 -11.455 11.944 -9.543 1000 1HD LYS 151 HD2 LYS 151 -12.712 13.187 -11.096 1001 2HD LYS 151 HD1 LYS 151 -12.085 14.721 -10.474 1002 1HE LYS 151 HE2 LYS 151 -10.461 12.574 -11.833 1003 2HE LYS 151 HE1 LYS 151 -10.967 14.109 -12.546 1004 1HZ LYS 151 HZ1 LYS 151 -9.166 13.870 -10.161 1005 2HZ LYS 151 HZ3 LYS 151 -8.676 14.197 -11.728 1006 3HZ LYS 151 HZ2 LYS 151 -9.629 15.292 -10.915 1007 H VAL 152 HN VAL 152 -9.957 11.608 -6.204 1008 HA VAL 152 HA VAL 152 -10.576 9.077 -7.352 1009 HB VAL 152 HB VAL 152 -8.285 9.978 -5.581 1010 1HG1 VAL 152 3HG1 VAL 152 -8.568 7.588 -5.698 1011 2HG1 VAL 152 2HG1 VAL 152 -8.564 7.736 -7.480 1012 3HG1 VAL 152 1HG1 VAL 152 -7.101 8.149 -6.550 1013 1HG2 VAL 152 2HG2 VAL 152 -8.465 11.309 -7.612 1014 2HG2 VAL 152 1HG2 VAL 152 -7.044 10.259 -7.628 1015 3HG2 VAL 152 3HG2 VAL 152 -8.465 9.831 -8.573 1016 H HIS 153 HN HIS 153 -11.088 10.642 -4.349 1017 HA HIS 153 HA HIS 153 -11.437 8.092 -3.007 1018 1HB HIS 153 HB2 HIS 153 -10.119 9.853 -1.836 1019 2HB HIS 153 HB1 HIS 153 -11.559 10.865 -1.798 1020 HD1 HIS 153 HD1 HIS 153 -12.952 10.621 0.318 1021 HD2 HIS 153 HD2 HIS 153 -10.524 7.317 -0.380 1022 HE1 HIS 153 HE1 HIS 153 -13.174 9.153 2.338 1023 H LYS 154 HN LYS 154 -13.175 7.535 -4.156 1024 HA LYS 154 HA LYS 154 -15.625 9.052 -3.948 1025 1HB LYS 154 HB2 LYS 154 -15.097 6.267 -5.038 1026 2HB LYS 154 HB1 LYS 154 -16.596 7.171 -5.213 1027 1HG LYS 154 HG2 LYS 154 -15.494 8.821 -6.588 1028 2HG LYS 154 HG1 LYS 154 -13.936 8.044 -6.326 1029 1HD LYS 154 HD2 LYS 154 -14.857 7.483 -8.525 1030 2HD LYS 154 HD1 LYS 154 -14.739 6.051 -7.504 1031 1HE LYS 154 HE2 LYS 154 -17.110 6.166 -7.019 1032 2HE LYS 154 HE1 LYS 154 -17.243 7.674 -7.920 1033 1HZ LYS 154 HZ1 LYS 154 -16.477 5.052 -9.094 1034 2HZ LYS 154 HZ3 LYS 154 -18.008 5.749 -9.162 1035 3HZ LYS 154 HZ2 LYS 154 -16.712 6.489 -9.937 1036 H LEU 155 HN LEU 155 -16.290 9.091 -1.770 1037 HA LEU 155 HA LEU 155 -15.633 6.926 -0.160 1038 1HB LEU 155 HB2 LEU 155 -15.339 9.079 0.640 1039 2HB LEU 155 HB1 LEU 155 -17.024 9.496 0.296 1040 HG LEU 155 HG LEU 155 -17.718 7.885 1.872 1041 1HD1 LEU 155 HD1 LEU 155 -14.770 7.632 2.559 1042 2HD1 LEU 155 HD1 LEU 155 -16.052 7.060 3.633 1043 3HD1 LEU 155 HD1 LEU 155 -15.869 6.360 2.030 1044 1HD2 LEU 155 HD2 LEU 155 -15.948 10.039 2.999 1045 2HD2 LEU 155 HD2 LEU 155 -17.668 10.141 2.602 1046 3HD2 LEU 155 HD2 LEU 155 -17.133 9.140 3.950 1047 H GLU 156 HN GLU 156 -16.662 5.406 -0.919 1048 HA GLU 156 HA GLU 156 -19.080 4.830 0.463 1049 1HB GLU 156 HB2 GLU 156 -19.920 5.673 -1.790 1050 2HB GLU 156 HB1 GLU 156 -19.080 4.319 -2.535 1051 1HG GLU 156 HG2 GLU 156 -20.467 2.751 -1.307 1052 2HG GLU 156 HG1 GLU 156 -21.270 4.081 -0.478 1053 H HIS 157 HN HIS 157 -17.629 3.664 1.554 1054 HA HIS 157 HA HIS 157 -16.601 1.253 0.231 1055 1HB HIS 157 HB2 HIS 157 -15.231 2.830 2.435 1056 2HB HIS 157 HB1 HIS 157 -14.655 1.318 1.754 1057 HD1 HIS 157 HD1 HIS 157 -13.303 1.497 -0.453 1058 HD2 HIS 157 HD2 HIS 157 -14.893 5.101 0.847 1059 HE1 HIS 157 HE1 HIS 157 -12.244 3.295 -1.869 1060 H HIS 158 HN HIS 158 -17.001 2.678 3.489 1061 HA HIS 158 HA HIS 158 -18.706 0.461 4.180 1062 1HB HIS 158 HB2 HIS 158 -16.232 1.212 5.758 1063 2HB HIS 158 HB1 HIS 158 -17.535 0.240 6.417 1064 HD1 HIS 158 HD1 HIS 158 -17.728 -2.202 5.548 1065 HD2 HIS 158 HD2 HIS 158 -14.547 -0.071 3.960 1066 HE1 HIS 158 HE1 HIS 158 -16.250 -3.900 4.439 1067 H HIS 159 HN HIS 159 -20.257 2.110 3.952 1068 HA HIS 159 HA HIS 159 -20.292 4.243 5.914 1069 1HB HIS 159 HB2 HIS 159 -21.135 4.677 3.621 1070 2HB HIS 159 HB1 HIS 159 -22.321 3.399 3.812 1071 HD1 HIS 159 HD1 HIS 159 -24.510 4.637 3.801 1072 HD2 HIS 159 HD2 HIS 159 -21.680 6.489 6.208 1073 HE1 HIS 159 HE1 HIS 159 -25.711 6.518 4.967 1074 H HIS 160 HN HIS 160 -21.420 4.151 7.812 1075 HA HIS 160 HA HIS 160 -22.603 1.580 8.438 1076 1HB HIS 160 HB2 HIS 160 -20.954 2.529 10.043 1077 2HB HIS 160 HB1 HIS 160 -22.006 3.916 10.286 1078 HD1 HIS 160 HD1 HIS 160 -23.729 3.692 12.168 1079 HD2 HIS 160 HD2 HIS 160 -22.121 0.039 10.992 1080 HE1 HIS 160 HE1 HIS 160 -24.621 2.000 13.772 1081 H HIS 161 HN HIS 161 -24.584 1.401 7.868 1082 HA HIS 161 HA HIS 161 -26.465 3.498 8.601 1083 1HB HIS 161 HB2 HIS 161 -27.799 2.994 6.537 1084 2HB HIS 161 HB1 HIS 161 -26.222 3.675 6.180 1085 HD1 HIS 161 HD1 HIS 161 -28.347 0.670 5.530 1086 HD2 HIS 161 HD2 HIS 161 -24.379 1.838 5.060 1087 HE1 HIS 161 HE1 HIS 161 -27.307 -0.989 3.969 1088 H HIS 162 HN HIS 162 -28.802 2.258 8.153 1089 HA HIS 162 HA HIS 162 -28.528 -0.262 9.614 1090 1HB HIS 162 HB2 HIS 162 -30.791 1.755 9.796 1091 2HB HIS 162 HB1 HIS 162 -30.737 0.209 10.633 1092 HD1 HIS 162 HD1 HIS 162 -30.234 3.650 11.302 1093 HD2 HIS 162 HD2 HIS 162 -28.207 0.174 12.335 1094 HE1 HIS 162 HE1 HIS 162 -28.833 4.228 13.294 No H/Q in entry = 1094 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 14.368 -19.759 -2.343 2 H2 MET 1 HT3 MET 1 15.947 -19.175 -2.328 3 H3 MET 1 HT2 MET 1 15.510 -20.464 -3.346 4 HA MET 1 HA MET 1 15.034 -21.853 -1.489 5 1HB MET 1 HB2 MET 1 17.364 -21.793 -2.415 6 2HB MET 1 HB1 MET 1 17.773 -20.571 -1.226 7 1HG MET 1 HG2 MET 1 18.590 -22.687 -0.476 8 2HG MET 1 HG1 MET 1 17.255 -22.195 0.564 9 1HE MET 1 HE1 MET 1 18.477 -24.588 -2.273 10 2HE MET 1 HE3 MET 1 17.018 -25.495 -2.655 11 3HE MET 1 HE2 MET 1 17.130 -23.792 -3.094 12 H GLU 2 HN GLU 2 16.924 -19.115 -0.144 13 HA GLU 2 HA GLU 2 15.486 -19.488 2.349 14 1HB GLU 2 HB2 GLU 2 18.084 -19.245 1.986 15 2HB GLU 2 HB1 GLU 2 17.727 -17.537 1.837 16 1HG GLU 2 HG2 GLU 2 17.175 -19.265 4.239 17 2HG GLU 2 HG1 GLU 2 18.485 -18.109 4.073 18 H MET 3 HN MET 3 13.672 -18.343 2.506 19 HA MET 3 HA MET 3 13.261 -16.016 0.792 20 1HB MET 3 HB2 MET 3 11.327 -17.482 2.573 21 2HB MET 3 HB1 MET 3 10.909 -16.119 1.556 22 1HG MET 3 HG2 MET 3 11.399 -17.390 -0.423 23 2HG MET 3 HG1 MET 3 11.969 -18.746 0.550 24 1HE MET 3 HE2 MET 3 9.773 -19.021 -1.735 25 2HE MET 3 HE1 MET 3 10.314 -20.386 -0.757 26 3HE MET 3 HE3 MET 3 8.589 -20.072 -0.956 27 H GLY 4 HN GLY 4 14.198 -16.543 3.997 28 1HA GLY 4 HA1 GLY 4 14.345 -15.185 5.795 29 2HA GLY 4 HA2 GLY 4 12.858 -14.415 5.250 30 H GLN 5 HN GLN 5 15.937 -14.703 3.641 31 HA GLN 5 HA GLN 5 16.856 -12.097 4.054 32 1HB GLN 5 HB2 GLN 5 18.471 -12.575 2.298 33 2HB GLN 5 HB1 GLN 5 18.212 -14.003 3.307 34 1HG GLN 5 HG2 GLN 5 16.790 -14.963 1.603 35 2HG GLN 5 HG1 GLN 5 17.053 -13.550 0.583 36 1HE2 GLN 5 1HE2 GLN 5 19.126 -13.210 -0.269 37 2HE2 GLN 5 2HE2 GLN 5 20.231 -14.532 -0.449 38 H LEU 6 HN LEU 6 14.786 -13.456 1.594 39 HA LEU 6 HA LEU 6 14.756 -11.160 -0.081 40 1HB LEU 6 HB2 LEU 6 14.278 -13.484 -0.868 41 2HB LEU 6 HB1 LEU 6 12.824 -13.501 0.091 42 HG LEU 6 HG LEU 6 12.509 -13.212 -2.402 43 1HD1 LEU 6 HD1 LEU 6 11.377 -11.071 -0.636 44 2HD1 LEU 6 HD1 LEU 6 10.803 -11.491 -2.243 45 3HD1 LEU 6 HD1 LEU 6 10.687 -12.668 -0.945 46 1HD2 LEU 6 HD2 LEU 6 14.380 -11.713 -2.830 47 2HD2 LEU 6 HD2 LEU 6 12.852 -11.002 -3.353 48 3HD2 LEU 6 HD2 LEU 6 13.609 -10.460 -1.858 49 H LYS 7 HN LYS 7 12.597 -12.509 2.343 50 HA LYS 7 HA LYS 7 10.688 -10.472 2.339 51 1HB LYS 7 HB2 LYS 7 11.363 -12.744 4.015 52 2HB LYS 7 HB1 LYS 7 10.704 -11.398 4.932 53 1HG LYS 7 HG2 LYS 7 9.403 -12.477 2.459 54 2HG LYS 7 HG1 LYS 7 9.045 -13.097 4.067 55 1HD LYS 7 HD2 LYS 7 8.903 -10.165 3.495 56 2HD LYS 7 HD1 LYS 7 7.511 -11.202 3.111 57 1HE LYS 7 HE2 LYS 7 7.569 -11.931 5.498 58 2HE LYS 7 HE1 LYS 7 8.823 -10.729 5.783 59 1HZ LYS 7 HZ1 LYS 7 6.091 -10.074 4.767 60 2HZ LYS 7 HZ3 LYS 7 6.569 -10.032 6.364 61 3HZ LYS 7 HZ2 LYS 7 7.281 -8.964 5.295 62 H ASN 8 HN ASN 8 13.728 -10.792 4.003 63 HA ASN 8 HA ASN 8 13.448 -8.681 5.763 64 1HB ASN 8 HB2 ASN 8 15.270 -10.254 6.012 65 2HB ASN 8 HB1 ASN 8 15.938 -9.795 4.453 66 1HD2 ASN 8 HD2 ASN 8 17.906 -9.290 5.342 67 2HD2 ASN 8 HD2 ASN 8 18.175 -7.880 6.298 68 H LYS 9 HN LYS 9 14.760 -8.744 2.468 69 HA LYS 9 HA LYS 9 15.431 -6.007 2.301 70 1HB LYS 9 HB2 LYS 9 14.531 -7.877 0.089 71 2HB LYS 9 HB1 LYS 9 15.281 -6.314 -0.158 72 1HG LYS 9 HG2 LYS 9 16.582 -8.674 1.181 73 2HG LYS 9 HG1 LYS 9 16.817 -8.205 -0.501 74 1HD LYS 9 HD2 LYS 9 17.700 -6.023 0.283 75 2HD LYS 9 HD1 LYS 9 17.546 -6.597 1.947 76 1HE LYS 9 HE2 LYS 9 19.067 -8.432 1.464 77 2HE LYS 9 HE1 LYS 9 19.211 -7.890 -0.208 78 1HZ LYS 9 HZ1 LYS 9 20.140 -5.793 0.653 79 2HZ LYS 9 HZ3 LYS 9 20.117 -6.437 2.214 80 3HZ LYS 9 HZ2 LYS 9 21.077 -7.132 1.003 81 H ILE 10 HN ILE 10 12.475 -7.785 1.572 82 HA ILE 10 HA ILE 10 10.951 -5.662 0.567 83 HB ILE 10 HB ILE 10 10.089 -8.201 1.979 84 1HG1 ILE 10 2HG1 ILE 10 10.085 -7.375 -0.925 85 2HG1 ILE 10 1HG1 ILE 10 11.180 -8.528 -0.171 86 1HG2 ILE 10 3HG2 ILE 10 8.327 -6.515 2.288 87 2HG2 ILE 10 2HG2 ILE 10 8.305 -6.231 0.547 88 3HG2 ILE 10 1HG2 ILE 10 7.806 -7.794 1.183 89 1HD1 ILE 10 HD1 ILE 10 9.289 -10.010 0.258 90 2HD1 ILE 10 HD1 ILE 10 8.210 -8.847 -0.516 91 3HD1 ILE 10 HD1 ILE 10 9.474 -9.645 -1.456 92 H GLU 11 HN GLU 11 11.083 -6.977 3.874 93 HA GLU 11 HA GLU 11 9.427 -5.115 5.151 94 1HB GLU 11 HB2 GLU 11 11.943 -6.401 6.238 95 2HB GLU 11 HB1 GLU 11 10.712 -5.608 7.201 96 1HG GLU 11 HG2 GLU 11 10.328 -8.109 5.564 97 2HG GLU 11 HG1 GLU 11 10.546 -8.034 7.308 98 H ASN 12 HN ASN 12 12.854 -5.048 4.589 99 HA ASN 12 HA ASN 12 13.617 -2.730 5.845 100 1HB ASN 12 HB2 ASN 12 15.048 -4.496 4.777 101 2HB ASN 12 HB1 ASN 12 14.685 -3.757 3.226 102 1HD2 ASN 12 HD2 ASN 12 16.511 -3.684 5.994 103 2HD2 ASN 12 HD2 ASN 12 17.480 -2.290 5.639 104 H LYS 13 HN LYS 13 12.667 -3.180 2.461 105 HA LYS 13 HA LYS 13 13.038 -0.458 1.700 106 1HB LYS 13 HB2 LYS 13 13.135 -2.525 0.237 107 2HB LYS 13 HB1 LYS 13 11.385 -2.536 0.301 108 1HG LYS 13 HG2 LYS 13 12.143 -1.511 -1.742 109 2HG LYS 13 HG1 LYS 13 11.324 -0.325 -0.727 110 1HD LYS 13 HD2 LYS 13 13.382 0.574 -1.762 111 2HD LYS 13 HD1 LYS 13 13.457 0.586 -0.005 112 1HE LYS 13 HE2 LYS 13 14.816 -1.327 0.018 113 2HE LYS 13 HE1 LYS 13 14.668 -1.569 -1.737 114 1HZ LYS 13 HZ3 LYS 13 15.949 0.697 -0.318 115 2HZ LYS 13 HZ2 LYS 13 16.765 -0.545 -1.120 116 3HZ LYS 13 HZ1 LYS 13 15.860 0.561 -2.011 117 H LYS 14 HN LYS 14 10.270 -2.423 2.506 118 HA LYS 14 HA LYS 14 8.185 -0.636 2.059 119 1HB LYS 14 HB2 LYS 14 7.763 -2.894 2.409 120 2HB LYS 14 HB1 LYS 14 8.627 -2.950 3.950 121 1HG LYS 14 HG2 LYS 14 6.748 -1.385 4.781 122 2HG LYS 14 HG1 LYS 14 5.885 -1.869 3.320 123 1HD LYS 14 HD2 LYS 14 5.136 -3.377 4.999 124 2HD LYS 14 HD1 LYS 14 6.328 -4.278 4.057 125 1HE LYS 14 HE2 LYS 14 8.046 -3.655 5.780 126 2HE LYS 14 HE1 LYS 14 6.721 -2.942 6.695 127 1HZ LYS 14 HZ1 LYS 14 5.690 -5.209 6.854 128 2HZ LYS 14 HZ3 LYS 14 7.014 -5.849 6.027 129 3HZ LYS 14 HZ2 LYS 14 7.212 -5.148 7.506 130 H LYS 15 HN LYS 15 10.187 -1.203 4.873 131 HA LYS 15 HA LYS 15 9.044 0.709 6.614 132 1HB LYS 15 HB2 LYS 15 11.765 -0.567 6.584 133 2HB LYS 15 HB1 LYS 15 11.222 0.521 7.856 134 1HG LYS 15 HG2 LYS 15 9.534 -0.981 8.552 135 2HG LYS 15 HG1 LYS 15 9.735 -1.980 7.113 136 1HD LYS 15 HD2 LYS 15 10.764 -3.061 9.007 137 2HD LYS 15 HD1 LYS 15 11.994 -2.571 7.854 138 1HE LYS 15 HE2 LYS 15 12.451 -0.567 9.208 139 2HE LYS 15 HE1 LYS 15 11.278 -1.122 10.403 140 1HZ LYS 15 HZ2 LYS 15 12.652 -3.104 10.725 141 2HZ LYS 15 HZ1 LYS 15 13.741 -2.548 9.594 142 3HZ LYS 15 HZ3 LYS 15 13.553 -1.702 11.035 143 H GLU 16 HN GLU 16 11.786 0.921 4.392 144 HA GLU 16 HA GLU 16 12.594 3.537 4.952 145 1HB GLU 16 HB2 GLU 16 12.552 2.046 2.325 146 2HB GLU 16 HB1 GLU 16 13.242 3.650 2.497 147 1HG GLU 16 HG2 GLU 16 14.838 2.608 4.149 148 2HG GLU 16 HG1 GLU 16 14.192 1.040 3.640 149 H LEU 17 HN LEU 17 10.070 2.306 2.859 150 HA LEU 17 HA LEU 17 9.237 4.735 1.700 151 1HB LEU 17 HB2 LEU 17 8.598 2.690 0.700 152 2HB LEU 17 HB1 LEU 17 7.800 2.150 2.172 153 HG LEU 17 HG LEU 17 6.341 4.282 1.810 154 1HD1 LEU 17 HD1 LEU 17 7.415 4.028 -0.877 155 2HD1 LEU 17 HD1 LEU 17 5.921 4.854 -0.402 156 3HD1 LEU 17 HD1 LEU 17 7.464 5.381 0.272 157 1HD2 LEU 17 HD2 LEU 17 5.611 2.019 1.778 158 2HD2 LEU 17 HD2 LEU 17 4.764 3.115 0.699 159 3HD2 LEU 17 HD2 LEU 17 5.942 1.929 0.022 160 H ILE 18 HN ILE 18 8.060 2.894 4.457 161 HA ILE 18 HA ILE 18 5.865 4.416 5.133 162 HB ILE 18 HB ILE 18 7.751 2.908 6.971 163 1HG1 ILE 18 2HG1 ILE 18 5.048 2.097 5.906 164 2HG1 ILE 18 1HG1 ILE 18 6.559 1.654 5.126 165 1HG2 ILE 18 2HG2 ILE 18 6.454 4.526 8.278 166 2HG2 ILE 18 1HG2 ILE 18 4.957 3.929 7.574 167 3HG2 ILE 18 3HG2 ILE 18 5.919 2.886 8.622 168 1HD1 ILE 18 HD1 ILE 18 7.225 0.462 7.142 169 2HD1 ILE 18 HD1 ILE 18 5.695 0.890 7.900 170 3HD1 ILE 18 HD1 ILE 18 5.720 -0.158 6.473 171 H GLN 19 HN GLN 19 9.206 4.819 6.075 172 HA GLN 19 HA GLN 19 8.936 7.041 7.769 173 1HB GLN 19 HB2 GLN 19 11.214 6.196 6.004 174 2HB GLN 19 HB1 GLN 19 11.336 7.468 7.205 175 1HG GLN 19 HG2 GLN 19 10.782 5.835 8.955 176 2HG GLN 19 HG1 GLN 19 10.705 4.577 7.723 177 1HE2 GLN 19 1HE2 GLN 19 12.766 6.721 9.484 178 2HE2 GLN 19 2HE2 GLN 19 14.249 5.937 9.064 179 H LEU 20 HN LEU 20 9.156 6.826 4.287 180 HA LEU 20 HA LEU 20 9.456 9.636 3.882 181 1HB LEU 20 HB2 LEU 20 8.717 7.448 1.946 182 2HB LEU 20 HB1 LEU 20 9.066 9.106 1.494 183 HG LEU 20 HG LEU 20 11.029 7.215 2.795 184 1HD1 LEU 20 HD1 LEU 20 10.825 8.188 -0.040 185 2HD1 LEU 20 HD1 LEU 20 12.145 7.226 0.623 186 3HD1 LEU 20 HD1 LEU 20 10.514 6.550 0.529 187 1HD2 LEU 20 HD2 LEU 20 11.393 10.005 1.694 188 2HD2 LEU 20 HD2 LEU 20 11.497 9.523 3.390 189 3HD2 LEU 20 HD2 LEU 20 12.692 8.941 2.237 190 H VAL 21 HN VAL 21 6.688 7.355 3.470 191 HA VAL 21 HA VAL 21 4.779 9.299 2.825 192 HB VAL 21 HB VAL 21 4.324 6.749 4.411 193 1HG1 VAL 21 3HG1 VAL 21 2.527 8.257 2.535 194 2HG1 VAL 21 2HG1 VAL 21 2.158 6.714 3.304 195 3HG1 VAL 21 1HG1 VAL 21 2.354 8.173 4.296 196 1HG2 VAL 21 2HG2 VAL 21 4.504 7.117 1.436 197 2HG2 VAL 21 1HG2 VAL 21 5.647 6.255 2.476 198 3HG2 VAL 21 3HG2 VAL 21 4.008 5.632 2.264 199 H ALA 22 HN ALA 22 6.046 8.207 5.912 200 HA ALA 22 HA ALA 22 4.233 9.403 7.632 201 1HB ALA 22 HB2 ALA 22 7.156 8.877 8.109 202 2HB ALA 22 HB1 ALA 22 5.927 9.128 9.358 203 3HB ALA 22 HB3 ALA 22 5.848 7.716 8.305 204 H ARG 23 HN ARG 23 7.374 10.599 6.497 205 HA ARG 23 HA ARG 23 7.198 13.062 7.847 206 1HB ARG 23 HB2 ARG 23 9.158 13.773 6.574 207 2HB ARG 23 HB1 ARG 23 9.366 12.162 7.231 208 1HG ARG 23 HG2 ARG 23 8.727 11.288 4.972 209 2HG ARG 23 HG1 ARG 23 8.829 12.959 4.405 210 1HD ARG 23 HD2 ARG 23 10.935 11.798 3.987 211 2HD ARG 23 HD1 ARG 23 11.152 13.074 5.189 212 HE ARG 23 HE ARG 23 10.566 10.535 6.344 213 1HH1 ARG 23 1HH1 ARG 23 13.232 12.524 5.069 214 2HH1 ARG 23 2HH1 ARG 23 14.421 11.743 6.010 215 1HH2 ARG 23 1HH2 ARG 23 12.265 9.514 7.664 216 2HH2 ARG 23 2HH2 ARG 23 13.875 10.052 7.472 217 H HIS 24 HN HIS 24 5.755 12.050 4.981 218 HA HIS 24 HA HIS 24 5.282 14.448 3.640 219 1HB HIS 24 HB2 HIS 24 4.626 12.388 2.607 220 2HB HIS 24 HB1 HIS 24 3.572 11.942 3.921 221 HD1 HIS 24 HD1 HIS 24 1.131 13.094 3.901 222 HD2 HIS 24 HD2 HIS 24 3.609 14.191 0.759 223 HE1 HIS 24 HE1 HIS 24 -0.319 14.307 2.260 224 H GLY 25 HN GLY 25 3.843 13.171 6.596 225 1HA GLY 25 HA1 GLY 25 1.753 15.176 6.560 226 2HA GLY 25 HA2 GLY 25 3.037 15.471 7.717 227 H LEU 26 HN LEU 26 2.341 12.136 7.163 228 HA LEU 26 HA LEU 26 0.221 11.653 8.813 229 1HB LEU 26 HB2 LEU 26 2.591 10.137 7.955 230 2HB LEU 26 HB1 LEU 26 1.506 9.423 9.127 231 HG LEU 26 HG LEU 26 -0.311 9.698 7.449 232 1HD1 LEU 26 HD1 LEU 26 0.580 11.421 6.081 233 2HD1 LEU 26 HD1 LEU 26 1.902 10.369 5.552 234 3HD1 LEU 26 HD1 LEU 26 0.226 9.982 5.123 235 1HD2 LEU 26 HD2 LEU 26 2.057 8.000 6.762 236 2HD2 LEU 26 HD2 LEU 26 0.713 7.590 7.821 237 3HD2 LEU 26 HD2 LEU 26 0.450 7.756 6.079 238 H ASP 27 HN ASP 27 0.031 11.004 10.831 239 HA ASP 27 HA ASP 27 2.029 11.963 12.781 240 1HB ASP 27 HB2 ASP 27 -0.511 12.523 12.903 241 2HB ASP 27 HB1 ASP 27 -0.717 10.851 13.373 242 H HIS 28 HN HIS 28 1.940 10.378 14.826 243 HA HIS 28 HA HIS 28 3.229 7.999 14.083 244 1HB HIS 28 HB2 HIS 28 3.546 9.155 16.249 245 2HB HIS 28 HB1 HIS 28 1.913 8.715 16.705 246 HD1 HIS 28 HD1 HIS 28 2.105 6.931 18.484 247 HD2 HIS 28 HD2 HIS 28 4.841 6.377 15.394 248 HE1 HIS 28 HE1 HIS 28 3.323 4.809 19.009 249 H ASP 29 HN ASP 29 -0.111 8.753 14.947 250 HA ASP 29 HA ASP 29 -0.969 6.064 15.170 251 1HB ASP 29 HB2 ASP 29 -3.232 6.845 15.110 252 2HB ASP 29 HB1 ASP 29 -2.303 7.995 16.049 253 H LYS 30 HN LYS 30 -0.746 8.267 12.565 254 HA LYS 30 HA LYS 30 -2.064 6.609 10.660 255 1HB LYS 30 HB2 LYS 30 -0.230 8.954 10.318 256 2HB LYS 30 HB1 LYS 30 -1.038 8.172 8.977 257 1HG LYS 30 HG2 LYS 30 -2.308 9.643 11.286 258 2HG LYS 30 HG1 LYS 30 -2.205 10.175 9.608 259 1HD LYS 30 HD2 LYS 30 -3.615 8.267 8.934 260 2HD LYS 30 HD1 LYS 30 -3.734 7.774 10.622 261 1HE LYS 30 HE2 LYS 30 -4.802 10.307 9.381 262 2HE LYS 30 HE1 LYS 30 -5.726 8.965 10.039 263 1HZ LYS 30 HZ2 LYS 30 -4.613 9.507 12.234 264 2HZ LYS 30 HZ1 LYS 30 -4.058 10.899 11.530 265 3HZ LYS 30 HZ3 LYS 30 -5.719 10.677 11.679 266 H VAL 31 HN VAL 31 1.267 7.113 11.619 267 HA VAL 31 HA VAL 31 2.392 5.584 9.535 268 HB VAL 31 HB VAL 31 3.543 6.237 12.282 269 1HG1 VAL 31 2HG1 VAL 31 4.945 5.257 9.806 270 2HG1 VAL 31 1HG1 VAL 31 5.722 5.769 11.305 271 3HG1 VAL 31 3HG1 VAL 31 4.695 4.334 11.287 272 1HG2 VAL 31 2HG2 VAL 31 2.974 8.194 10.961 273 2HG2 VAL 31 1HG2 VAL 31 4.727 8.014 11.117 274 3HG2 VAL 31 3HG2 VAL 31 3.914 7.565 9.617 275 H LEU 32 HN LEU 32 1.299 4.817 12.791 276 HA LEU 32 HA LEU 32 2.017 2.078 12.827 277 1HB LEU 32 HB2 LEU 32 -0.309 3.459 14.124 278 2HB LEU 32 HB1 LEU 32 0.275 1.855 14.520 279 HG LEU 32 HG LEU 32 1.778 4.429 14.907 280 1HD1 LEU 32 HD1 LEU 32 0.483 2.562 16.863 281 2HD1 LEU 32 HD1 LEU 32 1.479 3.971 17.266 282 3HD1 LEU 32 HD1 LEU 32 -0.056 4.187 16.425 283 1HD2 LEU 32 HD2 LEU 32 2.527 1.593 15.623 284 2HD2 LEU 32 HD2 LEU 32 3.287 2.621 14.397 285 3HD2 LEU 32 HD2 LEU 32 3.398 3.057 16.099 286 H LEU 33 HN LEU 33 -1.053 3.634 11.996 287 HA LEU 33 HA LEU 33 -2.341 1.259 11.270 288 1HB LEU 33 HB2 LEU 33 -2.858 4.087 10.389 289 2HB LEU 33 HB1 LEU 33 -3.953 2.750 10.101 290 HG LEU 33 HG LEU 33 -3.125 3.718 12.838 291 1HD1 LEU 33 HD1 LEU 33 -5.644 4.245 11.287 292 2HD1 LEU 33 HD1 LEU 33 -5.369 4.657 12.982 293 3HD1 LEU 33 HD1 LEU 33 -4.398 5.423 11.729 294 1HD2 LEU 33 HD2 LEU 33 -5.269 1.781 11.965 295 2HD2 LEU 33 HD2 LEU 33 -3.776 1.374 12.815 296 3HD2 LEU 33 HD2 LEU 33 -5.004 2.347 13.614 297 H PHE 34 HN PHE 34 -0.523 3.579 9.312 298 HA PHE 34 HA PHE 34 -1.001 2.337 6.851 299 1HB PHE 34 HB2 PHE 34 -0.183 4.634 6.981 300 2HB PHE 34 HB1 PHE 34 1.314 4.080 7.720 301 HD1 PHE 34 HD1 PHE 34 -0.711 3.770 4.612 302 HD2 PHE 34 HD2 PHE 34 3.153 3.619 6.386 303 HE1 PHE 34 HE1 PHE 34 0.307 3.585 2.379 304 HE2 PHE 34 HE2 PHE 34 4.172 3.432 4.158 305 HZ PHE 34 HZ PHE 34 2.758 3.406 2.159 306 H SER 35 HN SER 35 1.746 2.011 9.127 307 HA SER 35 HA SER 35 3.158 0.206 7.523 308 1HB SER 35 HB2 SER 35 4.420 -0.374 9.629 309 2HB SER 35 HB1 SER 35 4.326 1.352 9.287 310 HG SER 35 HG SER 35 2.852 1.612 10.821 311 H ARG 36 HN ARG 36 0.619 -0.339 9.863 312 HA ARG 36 HA ARG 36 0.845 -3.169 9.911 313 1HB ARG 36 HB2 ARG 36 -1.534 -1.406 10.461 314 2HB ARG 36 HB1 ARG 36 -1.438 -3.114 10.840 315 1HG ARG 36 HG2 ARG 36 0.419 -2.651 12.374 316 2HG ARG 36 HG1 ARG 36 0.274 -0.937 11.966 317 1HD ARG 36 HD2 ARG 36 -0.827 -1.377 14.039 318 2HD ARG 36 HD1 ARG 36 -2.008 -0.932 12.818 319 HE ARG 36 HE ARG 36 -1.700 -3.743 12.877 320 1HH1 ARG 36 1HH1 ARG 36 -3.281 -1.140 14.724 321 2HH1 ARG 36 2HH1 ARG 36 -4.512 -2.152 15.321 322 1HH2 ARG 36 1HH2 ARG 36 -3.368 -5.115 13.729 323 2HH2 ARG 36 2HH2 ARG 36 -4.555 -4.471 14.761 324 H ASP 37 HN ASP 37 -1.317 -0.959 8.186 325 HA ASP 37 HA ASP 37 -2.821 -2.941 6.854 326 1HB ASP 37 HB2 ASP 37 -3.218 -0.390 7.225 327 2HB ASP 37 HB1 ASP 37 -2.365 -0.215 5.698 328 H LEU 38 HN LEU 38 -0.030 -1.031 5.901 329 HA LEU 38 HA LEU 38 0.285 -1.957 3.284 330 1HB LEU 38 HB2 LEU 38 1.416 0.012 4.012 331 2HB LEU 38 HB1 LEU 38 2.206 -0.843 5.310 332 HG LEU 38 HG LEU 38 3.666 -1.974 3.730 333 1HD1 LEU 38 HD1 LEU 38 2.200 -0.425 1.624 334 2HD1 LEU 38 HD1 LEU 38 3.659 -1.395 1.393 335 3HD1 LEU 38 HD1 LEU 38 2.152 -2.184 1.866 336 1HD2 LEU 38 HD2 LEU 38 3.493 0.994 3.273 337 2HD2 LEU 38 HD2 LEU 38 4.359 0.183 4.579 338 3HD2 LEU 38 HD2 LEU 38 4.885 -0.018 2.906 339 H ASP 39 HN ASP 39 1.569 -3.133 6.338 340 HA ASP 39 HA ASP 39 3.279 -5.144 5.367 341 1HB ASP 39 HB2 ASP 39 3.181 -4.289 7.716 342 2HB ASP 39 HB1 ASP 39 1.671 -5.164 7.927 343 H LYS 40 HN LYS 40 -0.052 -5.180 6.401 344 HA LYS 40 HA LYS 40 -0.669 -7.860 5.976 345 1HB LYS 40 HB2 LYS 40 -2.390 -5.394 5.851 346 2HB LYS 40 HB1 LYS 40 -3.020 -7.029 5.776 347 1HG LYS 40 HG2 LYS 40 -2.386 -7.472 8.018 348 2HG LYS 40 HG1 LYS 40 -1.369 -6.031 8.083 349 1HD LYS 40 HD2 LYS 40 -3.499 -5.717 9.295 350 2HD LYS 40 HD1 LYS 40 -3.328 -4.596 7.953 351 1HE LYS 40 HE2 LYS 40 -4.758 -6.103 6.580 352 2HE LYS 40 HE1 LYS 40 -4.989 -7.113 8.006 353 1HZ LYS 40 HZ2 LYS 40 -5.788 -4.262 7.759 354 2HZ LYS 40 HZ1 LYS 40 -6.818 -5.583 7.680 355 3HZ LYS 40 HZ3 LYS 40 -6.032 -5.217 9.114 356 H LEU 41 HN LEU 41 -1.052 -5.059 3.807 357 HA LEU 41 HA LEU 41 -2.305 -6.379 1.694 358 1HB LEU 41 HB2 LEU 41 -2.249 -3.956 1.875 359 2HB LEU 41 HB1 LEU 41 -0.514 -3.951 1.651 360 HG LEU 41 HG LEU 41 -0.820 -4.778 -0.656 361 1HD1 LEU 41 HD1 LEU 41 -3.761 -4.470 -0.071 362 2HD1 LEU 41 HD1 LEU 41 -3.055 -4.687 -1.671 363 3HD1 LEU 41 HD1 LEU 41 -2.898 -5.963 -0.468 364 1HD2 LEU 41 HD2 LEU 41 -2.341 -2.260 0.004 365 2HD2 LEU 41 HD2 LEU 41 -0.604 -2.392 -0.265 366 3HD2 LEU 41 HD2 LEU 41 -1.728 -2.697 -1.591 367 H ILE 42 HN ILE 42 1.120 -5.861 2.310 368 HA ILE 42 HA ILE 42 2.052 -6.972 -0.135 369 HB ILE 42 HB ILE 42 3.490 -6.802 2.531 370 1HG1 ILE 42 2HG1 ILE 42 3.543 -4.951 0.160 371 2HG1 ILE 42 1HG1 ILE 42 2.711 -4.627 1.676 372 1HG2 ILE 42 3HG2 ILE 42 4.555 -8.398 1.014 373 2HG2 ILE 42 2HG2 ILE 42 4.582 -7.180 -0.261 374 3HG2 ILE 42 1HG2 ILE 42 5.551 -6.952 1.194 375 1HD1 ILE 42 HD1 ILE 42 4.846 -4.697 2.828 376 2HD1 ILE 42 HD1 ILE 42 5.671 -4.954 1.293 377 3HD1 ILE 42 HD1 ILE 42 4.798 -3.443 1.589 378 H ASN 43 HN ASN 43 2.000 -8.316 3.110 379 HA ASN 43 HA ASN 43 2.784 -10.908 2.494 380 1HB ASN 43 HB2 ASN 43 1.092 -9.902 4.774 381 2HB ASN 43 HB1 ASN 43 1.688 -11.550 4.676 382 1HD2 ASN 43 HD2 ASN 43 2.182 -9.454 6.592 383 2HD2 ASN 43 HD2 ASN 43 3.876 -9.208 6.683 384 H LYS 44 HN LYS 44 -0.321 -9.434 2.258 385 HA LYS 44 HA LYS 44 -1.990 -11.688 1.991 386 1HB LYS 44 HB2 LYS 44 -2.722 -9.328 2.294 387 2HB LYS 44 HB1 LYS 44 -2.217 -8.995 0.652 388 1HG LYS 44 HG2 LYS 44 -3.903 -10.669 -0.134 389 2HG LYS 44 HG1 LYS 44 -4.444 -10.793 1.543 390 1HD LYS 44 HD2 LYS 44 -4.438 -8.278 -0.093 391 2HD LYS 44 HD1 LYS 44 -5.849 -9.263 0.282 392 1HE LYS 44 HE2 LYS 44 -4.116 -7.764 2.267 393 2HE LYS 44 HE1 LYS 44 -5.739 -7.345 1.737 394 1HZ LYS 44 HZ1 LYS 44 -6.552 -9.401 2.750 395 2HZ LYS 44 HZ3 LYS 44 -5.004 -9.750 3.332 396 3HZ LYS 44 HZ2 LYS 44 -5.805 -8.384 3.871 397 H PHE 45 HN PHE 45 -0.179 -9.772 -0.365 398 HA PHE 45 HA PHE 45 -1.024 -11.383 -2.560 399 1HB PHE 45 HB2 PHE 45 0.753 -9.011 -2.270 400 2HB PHE 45 HB1 PHE 45 0.865 -9.973 -3.737 401 HD1 PHE 45 HD1 PHE 45 -0.787 -9.860 -5.394 402 HD2 PHE 45 HD2 PHE 45 -1.434 -7.947 -1.648 403 HE1 PHE 45 HE1 PHE 45 -2.762 -8.736 -6.315 404 HE2 PHE 45 HE2 PHE 45 -3.408 -6.812 -2.569 405 HZ PHE 45 HZ PHE 45 -4.077 -7.204 -4.903 406 H MET 46 HN MET 46 1.760 -11.164 -0.529 407 HA MET 46 HA MET 46 3.485 -12.878 -2.044 408 1HB MET 46 HB2 MET 46 3.455 -12.467 0.925 409 2HB MET 46 HB1 MET 46 4.813 -13.066 -0.022 410 1HG MET 46 HG2 MET 46 4.844 -10.717 -1.092 411 2HG MET 46 HG1 MET 46 3.649 -10.313 0.105 412 1HE MET 46 HE1 MET 46 7.233 -11.652 -0.416 413 2HE MET 46 HE3 MET 46 7.911 -11.616 1.199 414 3HE MET 46 HE2 MET 46 6.669 -12.798 0.808 415 H ASN 47 HN ASN 47 1.020 -13.307 0.319 416 HA ASN 47 HA ASN 47 -0.108 -14.943 1.199 417 1HB ASN 47 HB2 ASN 47 -0.134 -16.055 -1.049 418 2HB ASN 47 HB1 ASN 47 1.341 -16.907 -0.616 419 1HD2 ASN 47 HD2 ASN 47 0.342 -18.940 -0.828 420 2HD2 ASN 47 HD2 ASN 47 -0.827 -19.508 0.296 421 H VAL 48 HN VAL 48 1.443 -14.021 2.746 422 HA VAL 48 HA VAL 48 3.322 -16.029 3.856 423 HB VAL 48 HB VAL 48 2.793 -13.258 4.869 424 1HG1 VAL 48 3HG1 VAL 48 3.723 -14.774 6.532 425 2HG1 VAL 48 2HG1 VAL 48 5.038 -15.199 5.436 426 3HG1 VAL 48 1HG1 VAL 48 4.926 -13.563 6.086 427 1HG2 VAL 48 1HG2 VAL 48 5.025 -14.189 3.071 428 2HG2 VAL 48 3HG2 VAL 48 3.708 -13.093 2.658 429 3HG2 VAL 48 2HG2 VAL 48 4.926 -12.594 3.832 430 H LYS 49 HN LYS 49 2.344 -17.429 4.482 431 HA LYS 49 HA LYS 49 0.960 -16.989 6.986 432 1HB LYS 49 HB2 LYS 49 0.658 -19.289 5.034 433 2HB LYS 49 HB1 LYS 49 -0.061 -19.256 6.636 434 1HG LYS 49 HG2 LYS 49 -1.417 -17.314 5.968 435 2HG LYS 49 HG1 LYS 49 -0.703 -17.381 4.359 436 1HD LYS 49 HD2 LYS 49 -2.300 -19.602 5.644 437 2HD LYS 49 HD1 LYS 49 -2.935 -18.445 4.475 438 1HE LYS 49 HE2 LYS 49 -1.354 -19.252 2.802 439 2HE LYS 49 HE1 LYS 49 -0.666 -20.376 3.968 440 1HZ LYS 49 HZ1 LYS 49 -3.473 -20.424 3.020 441 2HZ LYS 49 HZ3 LYS 49 -2.226 -21.387 2.449 442 3HZ LYS 49 HZ2 LYS 49 -2.729 -21.567 4.043 443 H ASP 50 HN ASP 50 1.892 -17.998 8.561 444 HA ASP 50 HA ASP 50 4.531 -18.633 8.731 445 1HB ASP 50 HB2 ASP 50 3.211 -18.460 10.739 446 2HB ASP 50 HB1 ASP 50 2.327 -19.933 10.331 447 H LYS 51 HN LYS 51 5.869 -20.213 8.212 448 HA LYS 51 HA LYS 51 4.695 -22.480 6.767 449 1HB LYS 51 HB2 LYS 51 6.580 -22.389 5.255 450 2HB LYS 51 HB1 LYS 51 5.748 -20.841 5.283 451 1HG LYS 51 HG2 LYS 51 7.491 -19.934 6.746 452 2HG LYS 51 HG1 LYS 51 8.321 -21.490 6.726 453 1HD LYS 51 HD2 LYS 51 8.533 -21.266 4.251 454 2HD LYS 51 HD1 LYS 51 7.846 -19.644 4.384 455 1HE LYS 51 HE2 LYS 51 9.693 -19.066 5.958 456 2HE LYS 51 HE1 LYS 51 10.396 -20.642 5.635 457 1HZ LYS 51 HZ1 LYS 51 9.915 -18.545 3.597 458 2HZ LYS 51 HZ3 LYS 51 11.390 -18.898 4.315 459 3HZ LYS 51 HZ2 LYS 51 10.680 -20.044 3.320 460 H VAL 52 HN VAL 52 5.418 -22.591 9.637 461 HA VAL 52 HA VAL 52 7.971 -23.907 9.752 462 HB VAL 52 HB VAL 52 7.541 -24.484 12.058 463 1HG1 VAL 52 3HG1 VAL 52 8.278 -22.235 11.537 464 2HG1 VAL 52 2HG1 VAL 52 6.599 -21.703 11.455 465 3HG1 VAL 52 1HG1 VAL 52 7.266 -22.258 12.986 466 1HG2 VAL 52 1HG2 VAL 52 5.177 -25.110 11.889 467 2HG2 VAL 52 3HG2 VAL 52 5.437 -23.933 13.180 468 3HG2 VAL 52 2HG2 VAL 52 4.765 -23.406 11.642 469 H HIS 53 HN HIS 53 5.577 -24.935 8.210 470 HA HIS 53 HA HIS 53 5.466 -27.715 8.838 471 1HB HIS 53 HB2 HIS 53 5.039 -26.378 6.131 472 2HB HIS 53 HB1 HIS 53 4.484 -27.974 6.583 473 HD1 HIS 53 HD1 HIS 53 2.019 -28.028 7.105 474 HD2 HIS 53 HD2 HIS 53 3.712 -24.303 7.836 475 HE1 HIS 53 HE1 HIS 53 0.132 -26.503 7.722 476 H LYS 54 HN LYS 54 7.448 -25.521 7.258 477 HA LYS 54 HA LYS 54 9.470 -25.443 6.368 478 1HB LYS 54 HB2 LYS 54 9.751 -28.315 7.269 479 2HB LYS 54 HB1 LYS 54 11.063 -27.345 6.624 480 1HG LYS 54 HG2 LYS 54 10.760 -25.765 8.521 481 2HG LYS 54 HG1 LYS 54 9.523 -26.837 9.166 482 1HD LYS 54 HD2 LYS 54 12.409 -27.602 8.684 483 2HD LYS 54 HD1 LYS 54 11.723 -27.156 10.245 484 1HE LYS 54 HE2 LYS 54 10.194 -29.075 10.105 485 2HE LYS 54 HE1 LYS 54 10.900 -29.524 8.555 486 1HZ LYS 54 HZ1 LYS 54 12.354 -29.399 11.134 487 2HZ LYS 54 HZ3 LYS 54 11.797 -30.801 10.391 488 3HZ LYS 54 HZ2 LYS 54 13.014 -29.890 9.654 489 H LEU 55 HN LEU 55 10.878 -26.417 4.649 490 HA LEU 55 HA LEU 55 9.282 -27.787 2.623 491 1HB LEU 55 HB2 LEU 55 11.185 -25.456 2.233 492 2HB LEU 55 HB1 LEU 55 10.445 -26.354 0.935 493 HG LEU 55 HG LEU 55 8.987 -24.600 2.922 494 1HD1 LEU 55 HD1 LEU 55 10.340 -23.327 1.352 495 2HD1 LEU 55 HD1 LEU 55 9.609 -24.194 0.002 496 3HD1 LEU 55 HD1 LEU 55 8.624 -23.129 1.004 497 1HD2 LEU 55 HD2 LEU 55 7.956 -26.076 0.491 498 2HD2 LEU 55 HD2 LEU 55 7.582 -26.460 2.173 499 3HD2 LEU 55 HD2 LEU 55 7.034 -24.940 1.472 500 H GLU 56 HN GLU 56 10.798 -28.896 1.105 501 HA GLU 56 HA GLU 56 13.040 -29.799 2.670 502 1HB GLU 56 HB2 GLU 56 13.289 -31.580 0.854 503 2HB GLU 56 HB1 GLU 56 11.871 -31.671 1.879 504 1HG GLU 56 HG2 GLU 56 10.554 -30.599 0.104 505 2HG GLU 56 HG1 GLU 56 11.984 -30.606 -0.929 506 H HIS 57 HN HIS 57 14.076 -27.882 2.529 507 HA HIS 57 HA HIS 57 15.098 -26.731 0.139 508 1HB HIS 57 HB2 HIS 57 16.170 -26.479 2.968 509 2HB HIS 57 HB1 HIS 57 16.557 -25.425 1.619 510 HD1 HIS 57 HD1 HIS 57 14.241 -25.759 4.415 511 HD2 HIS 57 HD2 HIS 57 14.225 -23.915 0.689 512 HE1 HIS 57 HE1 HIS 57 12.406 -24.052 4.490 513 H HIS 58 HN HIS 58 16.063 -29.218 2.256 514 HA HIS 58 HA HIS 58 18.739 -29.473 1.477 515 1HB HIS 58 HB2 HIS 58 18.613 -31.798 2.432 516 2HB HIS 58 HB1 HIS 58 18.108 -30.514 3.513 517 HD1 HIS 58 HD1 HIS 58 15.822 -30.764 4.569 518 HD2 HIS 58 HD2 HIS 58 16.424 -33.379 1.399 519 HE1 HIS 58 HE1 HIS 58 13.867 -32.332 4.588 520 H HIS 59 HN HIS 59 15.873 -30.385 -0.210 521 HA HIS 59 HA HIS 59 17.420 -32.210 -1.777 522 1HB HIS 59 HB2 HIS 59 14.481 -31.673 -1.818 523 2HB HIS 59 HB1 HIS 59 15.265 -32.521 -3.152 524 HD1 HIS 59 HD1 HIS 59 13.207 -33.695 -0.909 525 HD2 HIS 59 HD2 HIS 59 17.292 -34.333 -1.274 526 HE1 HIS 59 HE1 HIS 59 13.705 -35.850 0.326 527 H HIS 60 HN HIS 60 18.800 -30.671 -2.277 528 HA HIS 60 HA HIS 60 18.194 -29.441 -4.883 529 1HB HIS 60 HB2 HIS 60 19.256 -27.910 -3.182 530 2HB HIS 60 HB1 HIS 60 20.599 -29.034 -3.048 531 HD1 HIS 60 HD1 HIS 60 19.250 -26.293 -5.251 532 HD2 HIS 60 HD2 HIS 60 22.384 -29.023 -5.209 533 HE1 HIS 60 HE1 HIS 60 20.887 -25.487 -6.956 534 H HIS 61 HN HIS 61 20.552 -31.287 -3.003 535 HA HIS 61 HA HIS 61 21.125 -32.946 -5.333 536 1HB HIS 61 HB2 HIS 61 23.055 -32.096 -3.922 537 2HB HIS 61 HB1 HIS 61 22.372 -32.960 -2.553 538 HD1 HIS 61 HD1 HIS 61 22.794 -35.546 -2.447 539 HD2 HIS 61 HD2 HIS 61 24.222 -33.715 -5.900 540 HE1 HIS 61 HE1 HIS 61 24.259 -37.232 -3.571 541 H HIS 62 HN HIS 62 20.036 -34.795 -5.453 542 HA HIS 62 HA HIS 62 18.281 -35.481 -3.235 543 1HB HIS 62 HB2 HIS 62 18.245 -36.263 -6.153 544 2HB HIS 62 HB1 HIS 62 17.196 -37.002 -4.953 545 HD1 HIS 62 HD1 HIS 62 14.925 -36.002 -5.045 546 HD2 HIS 62 HD2 HIS 62 17.883 -33.225 -5.939 547 HE1 HIS 62 HE1 HIS 62 13.739 -33.848 -5.503 548 H1 MET 101 HT2 MET 101 9.074 23.307 1.970 549 H2 MET 101 HT1 MET 101 9.727 21.759 1.975 550 H3 MET 101 HT3 MET 101 10.616 23.059 2.571 551 HA MET 101 HA MET 101 10.647 24.057 0.372 552 1HB MET 101 HB2 MET 101 12.536 22.537 0.997 553 2HB MET 101 HB1 MET 101 11.647 21.181 0.323 554 1HG MET 101 HG2 MET 101 11.707 22.331 -1.899 555 2HG MET 101 HG1 MET 101 12.723 23.562 -1.172 556 1HE MET 101 HE2 MET 101 15.194 23.153 -0.303 557 2HE MET 101 HE1 MET 101 14.641 21.867 0.765 558 3HE MET 101 HE3 MET 101 16.005 21.588 -0.322 559 H GLU 102 HN GLU 102 9.695 20.611 -0.112 560 HA GLU 102 HA GLU 102 7.603 21.486 -1.855 561 1HB GLU 102 HB2 GLU 102 8.499 20.033 -3.732 562 2HB GLU 102 HB1 GLU 102 9.304 21.569 -3.485 563 1HG GLU 102 HG2 GLU 102 10.923 19.834 -4.010 564 2HG GLU 102 HG1 GLU 102 11.166 20.404 -2.369 565 H MET 103 HN MET 103 6.572 19.463 -2.866 566 HA MET 103 HA MET 103 6.907 17.179 -1.089 567 1HB MET 103 HB2 MET 103 4.479 16.753 -1.065 568 2HB MET 103 HB1 MET 103 4.876 18.299 -0.338 569 1HG MET 103 HG2 MET 103 4.151 19.450 -2.359 570 2HG MET 103 HG1 MET 103 3.802 17.902 -3.127 571 1HE MET 103 HE3 MET 103 1.701 20.309 -2.918 572 2HE MET 103 HE2 MET 103 1.326 18.770 -3.692 573 3HE MET 103 HE1 MET 103 0.231 19.438 -2.482 574 H GLY 104 HN GLY 104 7.228 18.225 -4.122 575 1HA GLY 104 HA1 GLY 104 6.874 17.339 -6.249 576 2HA GLY 104 HA2 GLY 104 5.911 16.060 -5.529 577 H GLN 105 HN GLN 105 9.186 16.967 -4.595 578 HA GLN 105 HA GLN 105 10.281 14.666 -5.958 579 1HB GLN 105 HB2 GLN 105 11.575 16.651 -4.093 580 2HB GLN 105 HB1 GLN 105 12.427 15.380 -4.954 581 1HG GLN 105 HG2 GLN 105 11.674 16.466 -7.081 582 2HG GLN 105 HG1 GLN 105 11.081 17.808 -6.100 583 1HE2 GLN 105 1HE2 GLN 105 12.518 19.277 -6.915 584 2HE2 GLN 105 2HE2 GLN 105 14.210 19.220 -6.575 585 H LEU 106 HN LEU 106 9.305 15.790 -2.856 586 HA LEU 106 HA LEU 106 10.161 13.649 -1.271 587 1HB LEU 106 HB2 LEU 106 9.153 15.767 -0.398 588 2HB LEU 106 HB1 LEU 106 7.619 15.293 -1.078 589 HG LEU 106 HG LEU 106 7.856 15.086 1.447 590 1HD1 LEU 106 HD1 LEU 106 6.040 14.010 0.290 591 2HD1 LEU 106 HD1 LEU 106 7.059 12.619 -0.044 592 3HD1 LEU 106 HD1 LEU 106 6.629 13.015 1.621 593 1HD2 LEU 106 HD2 LEU 106 9.559 12.721 0.682 594 2HD2 LEU 106 HD2 LEU 106 10.106 14.167 1.532 595 3HD2 LEU 106 HD2 LEU 106 8.952 13.074 2.299 596 H LYS 107 HN LYS 107 7.165 14.124 -3.102 597 HA LYS 107 HA LYS 107 6.069 11.584 -2.759 598 1HB LYS 107 HB2 LYS 107 5.542 13.912 -4.333 599 2HB LYS 107 HB1 LYS 107 5.406 12.494 -5.361 600 1HG LYS 107 HG2 LYS 107 4.034 12.691 -2.705 601 2HG LYS 107 HG1 LYS 107 3.299 13.306 -4.182 602 1HD LYS 107 HD2 LYS 107 4.259 10.451 -3.865 603 2HD LYS 107 HD1 LYS 107 2.597 10.947 -3.523 604 1HE LYS 107 HE2 LYS 107 2.494 11.812 -5.875 605 2HE LYS 107 HE1 LYS 107 4.071 11.087 -6.152 606 1HZ LYS 107 HZ3 LYS 107 1.638 9.606 -5.324 607 2HZ LYS 107 HZ2 LYS 107 2.256 9.667 -6.883 608 3HZ LYS 107 HZ1 LYS 107 3.134 8.900 -5.671 609 H ASN 108 HN ASN 108 8.431 12.785 -5.023 610 HA ASN 108 HA ASN 108 8.574 10.515 -6.705 611 1HB ASN 108 HB2 ASN 108 9.461 12.775 -7.240 612 2HB ASN 108 HB1 ASN 108 10.730 12.543 -6.052 613 1HD2 ASN 108 HD2 ASN 108 10.823 13.100 -8.909 614 2HD2 ASN 108 HD2 ASN 108 11.806 11.867 -9.609 615 H LYS 109 HN LYS 109 10.247 11.388 -3.699 616 HA LYS 109 HA LYS 109 11.999 9.135 -3.579 617 1HB LYS 109 HB2 LYS 109 10.733 10.503 -1.188 618 2HB LYS 109 HB1 LYS 109 12.196 9.539 -1.221 619 1HG LYS 109 HG2 LYS 109 11.824 12.272 -2.443 620 2HG LYS 109 HG1 LYS 109 12.691 11.907 -0.958 621 1HD LYS 109 HD2 LYS 109 14.298 10.569 -2.261 622 2HD LYS 109 HD1 LYS 109 13.429 11.000 -3.739 623 1HE LYS 109 HE2 LYS 109 14.822 12.907 -1.854 624 2HE LYS 109 HE1 LYS 109 15.369 12.439 -3.462 625 1HZ LYS 109 HZ3 LYS 109 13.310 13.453 -4.344 626 2HZ LYS 109 HZ2 LYS 109 12.943 14.010 -2.788 627 3HZ LYS 109 HZ1 LYS 109 14.309 14.570 -3.562 628 H ILE 110 HN ILE 110 8.796 9.786 -2.262 629 HA ILE 110 HA ILE 110 8.262 7.327 -1.075 630 HB ILE 110 HB ILE 110 6.360 9.281 -2.412 631 1HG1 ILE 110 2HG1 ILE 110 7.029 8.815 0.505 632 2HG1 ILE 110 1HG1 ILE 110 7.572 10.173 -0.470 633 1HG2 ILE 110 3HG2 ILE 110 5.299 7.084 -2.357 634 2HG2 ILE 110 2HG2 ILE 110 5.636 6.958 -0.629 635 3HG2 ILE 110 1HG2 ILE 110 4.521 8.188 -1.219 636 1HD1 ILE 110 HD1 ILE 110 5.243 10.916 -0.691 637 2HD1 ILE 110 HD1 ILE 110 4.726 9.560 0.317 638 3HD1 ILE 110 HD1 ILE 110 5.767 10.822 0.984 639 H GLU 111 HN GLU 111 7.505 8.433 -4.351 640 HA GLU 111 HA GLU 111 6.397 6.134 -5.363 641 1HB GLU 111 HB2 GLU 111 8.067 8.228 -6.729 642 2HB GLU 111 HB1 GLU 111 7.289 6.908 -7.589 643 1HG GLU 111 HG2 GLU 111 5.921 9.000 -5.945 644 2HG GLU 111 HG1 GLU 111 5.953 8.925 -7.703 645 H ASN 112 HN ASN 112 9.750 7.133 -5.788 646 HA ASN 112 HA ASN 112 10.641 4.820 -7.002 647 1HB ASN 112 HB2 ASN 112 11.949 6.874 -6.981 648 2HB ASN 112 HB1 ASN 112 12.194 6.718 -5.247 649 1HD2 ASN 112 HD2 ASN 112 13.731 5.306 -4.490 650 2HD2 ASN 112 HD2 ASN 112 14.820 4.462 -5.522 651 H LYS 113 HN LYS 113 10.526 5.577 -3.528 652 HA LYS 113 HA LYS 113 11.913 3.265 -2.720 653 1HB LYS 113 HB2 LYS 113 11.413 5.366 -1.367 654 2HB LYS 113 HB1 LYS 113 9.820 4.685 -1.111 655 1HG LYS 113 HG2 LYS 113 11.300 4.227 0.775 656 2HG LYS 113 HG1 LYS 113 10.769 2.750 -0.027 657 1HD LYS 113 HD2 LYS 113 13.178 2.744 0.547 658 2HD LYS 113 HD1 LYS 113 12.878 2.545 -1.169 659 1HE LYS 113 HE2 LYS 113 13.365 4.851 -1.556 660 2HE LYS 113 HE1 LYS 113 13.609 5.144 0.178 661 1HZ LYS 113 HZ3 LYS 113 15.455 3.544 0.061 662 2HZ LYS 113 HZ2 LYS 113 15.161 3.385 -1.614 663 3HZ LYS 113 HZ1 LYS 113 15.682 4.859 -0.990 664 H LYS 114 HN LYS 114 8.486 4.009 -2.907 665 HA LYS 114 HA LYS 114 7.369 1.605 -2.071 666 1HB LYS 114 HB2 LYS 114 6.078 3.565 -2.297 667 2HB LYS 114 HB1 LYS 114 6.531 3.755 -3.986 668 1HG LYS 114 HG2 LYS 114 5.270 1.552 -4.369 669 2HG LYS 114 HG1 LYS 114 4.609 1.806 -2.752 670 1HD LYS 114 HD2 LYS 114 3.045 2.712 -4.367 671 2HD LYS 114 HD1 LYS 114 3.825 4.032 -3.489 672 1HE LYS 114 HE2 LYS 114 5.354 4.400 -5.334 673 2HE LYS 114 HE1 LYS 114 4.621 3.063 -6.212 674 1HZ LYS 114 HZ3 LYS 114 3.255 5.562 -5.378 675 2HZ LYS 114 HZ2 LYS 114 3.850 5.296 -6.879 676 3HZ LYS 114 HZ1 LYS 114 2.546 4.359 -6.322 677 H LYS 115 HN LYS 115 8.360 2.733 -5.223 678 HA LYS 115 HA LYS 115 7.593 0.450 -6.707 679 1HB LYS 115 HB2 LYS 115 9.531 2.674 -7.321 680 2HB LYS 115 HB1 LYS 115 9.119 1.413 -8.475 681 1HG LYS 115 HG2 LYS 115 6.853 2.121 -8.584 682 2HG LYS 115 HG1 LYS 115 7.049 3.170 -7.182 683 1HD LYS 115 HD2 LYS 115 8.519 4.598 -8.398 684 2HD LYS 115 HD1 LYS 115 8.471 3.565 -9.825 685 1HE LYS 115 HE2 LYS 115 6.024 4.021 -9.974 686 2HE LYS 115 HE1 LYS 115 6.165 5.088 -8.580 687 1HZ LYS 115 HZ1 LYS 115 7.703 6.470 -9.881 688 2HZ LYS 115 HZ3 LYS 115 7.482 5.467 -11.213 689 3HZ LYS 115 HZ2 LYS 115 6.196 6.371 -10.590 690 H GLU 116 HN GLU 116 10.685 1.406 -5.262 691 HA GLU 116 HA GLU 116 12.223 -0.777 -6.032 692 1HB GLU 116 HB2 GLU 116 12.221 0.734 -3.415 693 2HB GLU 116 HB1 GLU 116 13.391 -0.520 -3.780 694 1HG GLU 116 HG2 GLU 116 14.089 0.924 -5.732 695 2HG GLU 116 HG1 GLU 116 13.051 2.180 -5.048 696 H LEU 117 HN LEU 117 9.866 -0.448 -3.467 697 HA LEU 117 HA LEU 117 10.249 -2.992 -2.270 698 1HB LEU 117 HB2 LEU 117 9.154 -1.303 -1.015 699 2HB LEU 117 HB1 LEU 117 7.928 -1.088 -2.258 700 HG LEU 117 HG LEU 117 7.472 -3.637 -1.738 701 1HD1 LEU 117 HD1 LEU 117 8.798 -2.914 0.712 702 2HD1 LEU 117 HD1 LEU 117 7.632 -4.243 0.457 703 3HD1 LEU 117 HD1 LEU 117 9.127 -4.183 -0.474 704 1HD2 LEU 117 HD2 LEU 117 5.905 -1.906 -1.586 705 2HD2 LEU 117 HD2 LEU 117 5.785 -3.082 -0.272 706 3HD2 LEU 117 HD2 LEU 117 6.477 -1.462 0.049 707 H ILE 118 HN ILE 118 7.914 -1.722 -4.599 708 HA ILE 118 HA ILE 118 6.357 -3.981 -4.922 709 HB ILE 118 HB ILE 118 7.059 -1.934 -7.067 710 1HG1 ILE 118 2HG1 ILE 118 4.613 -2.070 -5.303 711 2HG1 ILE 118 1HG1 ILE 118 6.019 -1.082 -4.929 712 1HG2 ILE 118 2HG2 ILE 118 6.102 -3.974 -8.064 713 2HG2 ILE 118 1HG2 ILE 118 4.735 -3.887 -6.969 714 3HG2 ILE 118 3HG2 ILE 118 4.970 -2.630 -8.181 715 1HD1 ILE 118 HD1 ILE 118 4.272 -0.817 -7.365 716 2HD1 ILE 118 HD1 ILE 118 4.250 0.228 -5.940 717 3HD1 ILE 118 HD1 ILE 118 5.674 0.178 -6.977 718 H GLN 119 HN GLN 119 9.297 -3.042 -6.583 719 HA GLN 119 HA GLN 119 9.618 -5.162 -8.360 720 1HB GLN 119 HB2 GLN 119 11.692 -3.639 -6.802 721 2HB GLN 119 HB1 GLN 119 12.043 -4.701 -8.157 722 1HG GLN 119 HG2 GLN 119 10.797 -3.285 -9.636 723 2HG GLN 119 HG1 GLN 119 10.298 -2.273 -8.293 724 1HE2 GLN 119 1HE2 GLN 119 11.255 -0.438 -9.203 725 2HE2 GLN 119 2HE2 GLN 119 12.957 -0.175 -9.147 726 H LEU 120 HN LEU 120 10.404 -4.914 -4.949 727 HA LEU 120 HA LEU 120 11.770 -7.393 -4.793 728 1HB LEU 120 HB2 LEU 120 10.625 -5.666 -2.612 729 2HB LEU 120 HB1 LEU 120 11.661 -7.059 -2.356 730 HG LEU 120 HG LEU 120 12.448 -4.525 -3.783 731 1HD1 LEU 120 HD1 LEU 120 13.218 -5.596 -1.085 732 2HD1 LEU 120 HD1 LEU 120 13.886 -4.158 -1.858 733 3HD1 LEU 120 HD1 LEU 120 12.186 -4.203 -1.401 734 1HD2 LEU 120 HD2 LEU 120 14.063 -6.977 -3.082 735 2HD2 LEU 120 HD2 LEU 120 13.615 -6.448 -4.703 736 3HD2 LEU 120 HD2 LEU 120 14.710 -5.470 -3.734 737 H VAL 121 HN VAL 121 8.487 -6.323 -3.773 738 HA VAL 121 HA VAL 121 7.615 -8.824 -2.900 739 HB VAL 121 HB VAL 121 5.899 -6.721 -4.256 740 1HG1 VAL 121 2HG1 VAL 121 4.764 -8.815 -3.761 741 2HG1 VAL 121 1HG1 VAL 121 5.291 -8.672 -2.072 742 3HG1 VAL 121 3HG1 VAL 121 4.182 -7.473 -2.736 743 1HG2 VAL 121 3HG2 VAL 121 6.820 -6.801 -1.391 744 2HG2 VAL 121 2HG2 VAL 121 7.277 -5.616 -2.621 745 3HG2 VAL 121 1HG2 VAL 121 5.609 -5.697 -2.055 746 H ALA 122 HN ALA 122 7.713 -7.371 -6.096 747 HA ALA 122 HA ALA 122 6.260 -9.314 -7.489 748 1HB ALA 122 HB3 ALA 122 8.430 -7.491 -8.533 749 2HB ALA 122 HB2 ALA 122 7.222 -8.342 -9.511 750 3HB ALA 122 HB1 ALA 122 6.723 -7.090 -8.383 751 H ARG 123 HN ARG 123 9.768 -9.005 -6.901 752 HA ARG 123 HA ARG 123 10.393 -11.356 -8.410 753 1HB ARG 123 HB2 ARG 123 12.666 -11.145 -7.531 754 2HB ARG 123 HB1 ARG 123 12.089 -9.608 -8.177 755 1HG ARG 123 HG2 ARG 123 11.621 -8.872 -5.929 756 2HG ARG 123 HG1 ARG 123 12.201 -10.404 -5.287 757 1HD ARG 123 HD2 ARG 123 13.859 -8.439 -6.878 758 2HD ARG 123 HD1 ARG 123 13.906 -8.621 -5.123 759 HE ARG 123 HE ARG 123 14.438 -11.011 -6.659 760 1HH1 ARG 123 1HH1 ARG 123 15.890 -8.246 -4.909 761 2HH1 ARG 123 2HH1 ARG 123 17.408 -8.968 -4.787 762 1HH2 ARG 123 1HH2 ARG 123 16.509 -11.964 -6.463 763 2HH2 ARG 123 2HH2 ARG 123 17.774 -11.171 -5.648 764 H HIS 124 HN HIS 124 9.031 -10.975 -5.404 765 HA HIS 124 HA HIS 124 10.114 -13.261 -4.115 766 1HB HIS 124 HB2 HIS 124 8.938 -11.601 -2.783 767 2HB HIS 124 HB1 HIS 124 7.478 -11.806 -3.709 768 HD1 HIS 124 HD1 HIS 124 9.718 -14.071 -1.515 769 HD2 HIS 124 HD2 HIS 124 5.813 -13.498 -2.670 770 HE1 HIS 124 HE1 HIS 124 8.391 -15.727 -0.173 771 H GLY 125 HN GLY 125 7.514 -12.691 -6.324 772 1HA GLY 125 HA1 GLY 125 6.839 -15.530 -6.289 773 2HA GLY 125 HA2 GLY 125 7.443 -14.843 -7.793 774 H LEU 126 HN LEU 126 6.188 -12.343 -7.717 775 HA LEU 126 HA LEU 126 3.396 -13.127 -7.660 776 1HB LEU 126 HB2 LEU 126 4.673 -10.432 -7.804 777 2HB LEU 126 HB1 LEU 126 2.987 -10.650 -8.139 778 HG LEU 126 HG LEU 126 4.471 -11.021 -5.654 779 1HD1 LEU 126 HD1 LEU 126 2.155 -9.253 -6.351 780 2HD1 LEU 126 HD1 LEU 126 2.789 -9.455 -4.719 781 3HD1 LEU 126 HD1 LEU 126 3.817 -8.778 -5.980 782 1HD2 LEU 126 HD2 LEU 126 1.675 -11.990 -6.155 783 2HD2 LEU 126 HD2 LEU 126 3.082 -12.920 -5.639 784 3HD2 LEU 126 HD2 LEU 126 2.357 -11.750 -4.543 785 H ASP 127 HN ASP 127 2.192 -13.124 -9.270 786 HA ASP 127 HA ASP 127 3.119 -13.267 -11.980 787 1HB ASP 127 HB2 ASP 127 0.281 -12.629 -11.089 788 2HB ASP 127 HB1 ASP 127 0.788 -13.372 -12.586 789 H HIS 128 HN HIS 128 2.473 -11.570 -13.612 790 HA HIS 128 HA HIS 128 3.107 -9.025 -12.584 791 1HB HIS 128 HB2 HIS 128 2.151 -9.842 -15.326 792 2HB HIS 128 HB1 HIS 128 2.511 -8.167 -14.913 793 HD1 HIS 128 HD1 HIS 128 4.884 -7.493 -15.350 794 HD2 HIS 128 HD2 HIS 128 4.496 -11.572 -14.760 795 HE1 HIS 128 HE1 HIS 128 7.169 -8.465 -15.703 796 H ASP 129 HN ASP 129 0.102 -10.578 -13.214 797 HA ASP 129 HA ASP 129 -1.610 -8.377 -13.000 798 1HB ASP 129 HB2 ASP 129 -2.280 -10.627 -13.805 799 2HB ASP 129 HB1 ASP 129 -2.077 -11.250 -12.177 800 H LYS 130 HN LYS 130 -0.129 -10.475 -10.651 801 HA LYS 130 HA LYS 130 -1.412 -9.580 -8.303 802 1HB LYS 130 HB2 LYS 130 1.298 -10.708 -8.807 803 2HB LYS 130 HB1 LYS 130 0.724 -10.534 -7.176 804 1HG LYS 130 HG2 LYS 130 -0.528 -12.202 -9.358 805 2HG LYS 130 HG1 LYS 130 0.578 -12.799 -8.125 806 1HD LYS 130 HD2 LYS 130 -1.077 -12.251 -6.416 807 2HD LYS 130 HD1 LYS 130 -2.159 -11.620 -7.663 808 1HE LYS 130 HE2 LYS 130 -2.751 -13.940 -7.014 809 2HE LYS 130 HE1 LYS 130 -2.300 -13.805 -8.708 810 1HZ LYS 130 HZ2 LYS 130 -0.471 -14.796 -6.556 811 2HZ LYS 130 HZ1 LYS 130 -1.346 -15.754 -7.593 812 3HZ LYS 130 HZ3 LYS 130 -0.155 -14.769 -8.232 813 H VAL 131 HN VAL 131 1.677 -8.686 -9.871 814 HA VAL 131 HA VAL 131 2.528 -6.695 -8.146 815 HB VAL 131 HB VAL 131 2.961 -6.743 -11.153 816 1HG1 VAL 131 2HG1 VAL 131 3.727 -4.688 -10.130 817 2HG1 VAL 131 1HG1 VAL 131 4.672 -5.606 -8.960 818 3HG1 VAL 131 3HG1 VAL 131 5.094 -5.658 -10.667 819 1HG2 VAL 131 3HG2 VAL 131 4.473 -8.221 -9.010 820 2HG2 VAL 131 2HG2 VAL 131 3.468 -8.912 -10.286 821 3HG2 VAL 131 1HG2 VAL 131 4.968 -8.086 -10.705 822 H LEU 132 HN LEU 132 0.454 -6.506 -11.018 823 HA LEU 132 HA LEU 132 0.083 -3.700 -11.059 824 1HB LEU 132 HB2 LEU 132 -1.863 -5.816 -11.945 825 2HB LEU 132 HB1 LEU 132 -1.887 -4.126 -12.402 826 HG LEU 132 HG LEU 132 0.133 -6.201 -13.185 827 1HD1 LEU 132 HD1 LEU 132 -1.854 -4.623 -14.765 828 2HD1 LEU 132 HD1 LEU 132 -0.630 -5.710 -15.433 829 3HD1 LEU 132 HD1 LEU 132 -1.898 -6.354 -14.393 830 1HD2 LEU 132 HD2 LEU 132 0.153 -3.239 -13.767 831 2HD2 LEU 132 HD2 LEU 132 1.315 -4.151 -12.787 832 3HD2 LEU 132 HD2 LEU 132 1.196 -4.451 -14.518 833 H LEU 133 HN LEU 133 -1.993 -6.207 -9.674 834 HA LEU 133 HA LEU 133 -3.900 -4.452 -8.607 835 1HB LEU 133 HB2 LEU 133 -3.062 -7.171 -7.668 836 2HB LEU 133 HB1 LEU 133 -4.520 -6.327 -7.170 837 HG LEU 133 HG LEU 133 -3.921 -7.132 -10.011 838 1HD1 LEU 133 HD1 LEU 133 -5.633 -8.495 -7.948 839 2HD1 LEU 133 HD1 LEU 133 -5.542 -8.908 -9.662 840 3HD1 LEU 133 HD1 LEU 133 -4.120 -9.095 -8.646 841 1HD2 LEU 133 HD2 LEU 133 -6.452 -6.170 -8.677 842 2HD2 LEU 133 HD2 LEU 133 -5.456 -5.246 -9.803 843 3HD2 LEU 133 HD2 LEU 133 -6.301 -6.689 -10.353 844 H PHE 134 HN PHE 134 -1.004 -5.863 -7.220 845 HA PHE 134 HA PHE 134 -1.310 -4.785 -4.668 846 1HB PHE 134 HB2 PHE 134 0.169 -6.583 -4.944 847 2HB PHE 134 HB1 PHE 134 1.119 -5.753 -6.175 848 HD1 PHE 134 HD1 PHE 134 3.056 -4.645 -5.554 849 HD2 PHE 134 HD2 PHE 134 0.133 -5.541 -2.596 850 HE1 PHE 134 HE1 PHE 134 4.575 -3.824 -3.811 851 HE2 PHE 134 HE2 PHE 134 1.652 -4.721 -0.847 852 HZ PHE 134 HZ PHE 134 3.885 -3.855 -1.469 853 H SER 135 HN SER 135 0.643 -3.589 -7.423 854 HA SER 135 HA SER 135 1.595 -1.346 -6.078 855 1HB SER 135 HB2 SER 135 2.109 -0.434 -8.372 856 2HB SER 135 HB1 SER 135 2.725 -2.053 -8.054 857 HG SER 135 HG SER 135 1.129 -2.916 -9.261 858 H ARG 136 HN ARG 136 -1.322 -1.697 -8.038 859 HA ARG 136 HA ARG 136 -1.940 1.072 -7.919 860 1HB ARG 136 HB2 ARG 136 -4.145 0.497 -8.804 861 2HB ARG 136 HB1 ARG 136 -2.868 -0.307 -9.695 862 1HG ARG 136 HG2 ARG 136 -3.323 -2.363 -8.410 863 2HG ARG 136 HG1 ARG 136 -4.677 -1.538 -7.636 864 1HD ARG 136 HD2 ARG 136 -4.351 -1.959 -10.588 865 2HD ARG 136 HD1 ARG 136 -5.340 -2.960 -9.533 866 HE ARG 136 HE ARG 136 -6.200 -0.358 -9.141 867 1HH1 ARG 136 1HH1 ARG 136 -6.065 -2.583 -11.904 868 2HH1 ARG 136 2HH1 ARG 136 -7.472 -1.978 -12.620 869 1HH2 ARG 136 1HH2 ARG 136 -8.096 0.469 -10.137 870 2HH2 ARG 136 2HH2 ARG 136 -8.678 -0.201 -11.600 871 H ASP 137 HN ASP 137 -2.818 -1.649 -5.832 872 HA ASP 137 HA ASP 137 -4.639 0.048 -4.391 873 1HB ASP 137 HB2 ASP 137 -4.776 -2.556 -4.632 874 2HB ASP 137 HB1 ASP 137 -3.651 -2.558 -3.288 875 H LEU 138 HN LEU 138 -1.370 -1.039 -4.075 876 HA LEU 138 HA LEU 138 -0.769 -0.008 -1.540 877 1HB LEU 138 HB2 LEU 138 0.778 -1.470 -2.578 878 2HB LEU 138 HB1 LEU 138 0.844 -0.501 -4.027 879 HG LEU 138 HG LEU 138 2.199 1.170 -2.897 880 1HD1 LEU 138 HD1 LEU 138 1.245 0.986 -0.660 881 2HD1 LEU 138 HD1 LEU 138 2.006 -0.602 -0.480 882 3HD1 LEU 138 HD1 LEU 138 3.004 0.850 -0.659 883 1HD2 LEU 138 HD2 LEU 138 3.161 -1.643 -2.479 884 2HD2 LEU 138 HD2 LEU 138 3.329 -0.673 -3.940 885 3HD2 LEU 138 HD2 LEU 138 4.184 -0.209 -2.473 886 H ASP 139 HN ASP 139 -0.547 1.437 -4.758 887 HA ASP 139 HA ASP 139 0.372 3.973 -4.022 888 1HB ASP 139 HB2 ASP 139 0.235 3.050 -6.350 889 2HB ASP 139 HB1 ASP 139 -1.505 3.289 -6.300 890 H LYS 140 HN LYS 140 -2.946 2.652 -4.290 891 HA LYS 140 HA LYS 140 -4.438 4.866 -3.767 892 1HB LYS 140 HB2 LYS 140 -5.009 2.676 -4.665 893 2HB LYS 140 HB1 LYS 140 -4.799 1.991 -3.070 894 1HG LYS 140 HG2 LYS 140 -6.498 3.561 -2.258 895 2HG LYS 140 HG1 LYS 140 -6.800 3.969 -3.965 896 1HD LYS 140 HD2 LYS 140 -7.023 1.203 -2.753 897 2HD LYS 140 HD1 LYS 140 -8.381 2.251 -3.164 898 1HE LYS 140 HE2 LYS 140 -7.838 2.137 -5.503 899 2HE LYS 140 HE1 LYS 140 -6.342 1.275 -5.168 900 1HZ LYS 140 HZ1 LYS 140 -9.065 0.240 -4.635 901 2HZ LYS 140 HZ3 LYS 140 -8.061 -0.194 -5.917 902 3HZ LYS 140 HZ2 LYS 140 -7.603 -0.566 -4.333 903 H LEU 141 HN LEU 141 -3.116 2.304 -1.662 904 HA LEU 141 HA LEU 141 -4.178 3.127 0.769 905 1HB LEU 141 HB2 LEU 141 -3.182 0.930 0.415 906 2HB LEU 141 HB1 LEU 141 -1.612 1.656 0.183 907 HG LEU 141 HG LEU 141 -1.606 2.385 2.541 908 1HD1 LEU 141 HD1 LEU 141 -4.197 0.858 2.729 909 2HD1 LEU 141 HD1 LEU 141 -3.272 1.491 4.090 910 3HD1 LEU 141 HD1 LEU 141 -3.982 2.598 2.917 911 1HD2 LEU 141 HD2 LEU 141 -0.574 0.277 1.911 912 2HD2 LEU 141 HD2 LEU 141 -1.292 0.168 3.517 913 3HD2 LEU 141 HD2 LEU 141 -2.112 -0.559 2.134 914 H ILE 142 HN ILE 142 -1.216 4.005 -0.845 915 HA ILE 142 HA ILE 142 -0.253 5.607 1.279 916 HB ILE 142 HB ILE 142 0.448 5.703 -1.673 917 1HG1 ILE 142 2HG1 ILE 142 1.842 4.478 0.700 918 2HG1 ILE 142 1HG1 ILE 142 0.954 3.594 -0.536 919 1HG2 ILE 142 2HG2 ILE 142 1.857 6.993 0.679 920 2HG2 ILE 142 1HG2 ILE 142 2.448 6.958 -0.982 921 3HG2 ILE 142 3HG2 ILE 142 0.976 7.845 -0.591 922 1HD1 ILE 142 HD1 ILE 142 2.517 4.367 -2.188 923 2HD1 ILE 142 HD1 ILE 142 3.456 5.205 -0.954 924 3HD1 ILE 142 HD1 ILE 142 3.321 3.436 -0.921 925 H ASN 143 HN ASN 143 -1.810 6.501 -1.773 926 HA ASN 143 HA ASN 143 -2.232 9.215 -1.333 927 1HB ASN 143 HB2 ASN 143 -3.894 7.221 -2.858 928 2HB ASN 143 HB1 ASN 143 -4.426 8.886 -2.695 929 1HD2 ASN 143 HD2 ASN 143 -2.122 6.756 -4.162 930 2HD2 ASN 143 HD2 ASN 143 -1.532 7.881 -5.310 931 H LYS 144 HN LYS 144 -4.121 6.538 -0.154 932 HA LYS 144 HA LYS 144 -6.309 7.797 0.998 933 1HB LYS 144 HB2 LYS 144 -5.944 5.352 0.782 934 2HB LYS 144 HB1 LYS 144 -4.742 5.433 2.055 935 1HG LYS 144 HG2 LYS 144 -6.519 6.207 3.604 936 2HG LYS 144 HG1 LYS 144 -7.693 5.969 2.309 937 1HD LYS 144 HD2 LYS 144 -5.968 3.849 3.610 938 2HD LYS 144 HD1 LYS 144 -7.715 4.024 3.755 939 1HE LYS 144 HE2 LYS 144 -7.868 3.657 1.280 940 2HE LYS 144 HE1 LYS 144 -6.153 3.307 1.275 941 1HZ LYS 144 HZ3 LYS 144 -6.642 1.449 2.885 942 2HZ LYS 144 HZ2 LYS 144 -8.282 1.759 2.624 943 3HZ LYS 144 HZ1 LYS 144 -7.332 1.267 1.354 944 H PHE 145 HN PHE 145 -3.179 6.989 2.476 945 HA PHE 145 HA PHE 145 -3.787 8.405 4.859 946 1HB PHE 145 HB2 PHE 145 -1.369 6.939 3.899 947 2HB PHE 145 HB1 PHE 145 -1.309 7.965 5.333 948 HD1 PHE 145 HD1 PHE 145 -2.086 7.246 7.350 949 HD2 PHE 145 HD2 PHE 145 -3.105 5.038 3.864 950 HE1 PHE 145 HE1 PHE 145 -3.044 5.466 8.761 951 HE2 PHE 145 HE2 PHE 145 -4.042 3.261 5.252 952 HZ PHE 145 HZ PHE 145 -4.025 3.465 7.708 953 H MET 146 HN MET 146 -2.141 9.196 1.931 954 HA MET 146 HA MET 146 -0.881 11.636 2.821 955 1HB MET 146 HB2 MET 146 -1.844 10.977 0.024 956 2HB MET 146 HB1 MET 146 -0.661 12.192 0.470 957 1HG MET 146 HG2 MET 146 0.810 10.324 1.307 958 2HG MET 146 HG1 MET 146 -0.377 9.216 0.663 959 1HE MET 146 HE1 MET 146 1.003 12.589 -0.680 960 2HE MET 146 HE3 MET 146 2.413 11.709 -0.083 961 3HE MET 146 HE2 MET 146 2.240 12.033 -1.815 962 H ASN 147 HN ASN 147 -3.988 10.655 2.232 963 HA ASN 147 HA ASN 147 -6.041 11.507 2.375 964 1HB ASN 147 HB2 ASN 147 -5.203 12.561 4.471 965 2HB ASN 147 HB1 ASN 147 -4.762 13.992 3.549 966 1HD2 ASN 147 HD2 ASN 147 -6.137 15.333 4.679 967 2HD2 ASN 147 HD2 ASN 147 -7.851 15.243 4.561 968 H VAL 148 HN VAL 148 -6.238 11.460 0.222 969 HA VAL 148 HA VAL 148 -5.607 13.882 -1.181 970 HB VAL 148 HB VAL 148 -6.125 12.616 -3.282 971 1HG1 VAL 148 3HG1 VAL 148 -3.989 11.490 -1.478 972 2HG1 VAL 148 2HG1 VAL 148 -4.036 11.322 -3.232 973 3HG1 VAL 148 1HG1 VAL 148 -3.848 12.918 -2.502 974 1HG2 VAL 148 3HG2 VAL 148 -7.575 10.900 -2.295 975 2HG2 VAL 148 2HG2 VAL 148 -6.234 10.171 -3.183 976 3HG2 VAL 148 1HG2 VAL 148 -6.201 10.239 -1.414 977 H LYS 149 HN LYS 149 -6.881 15.302 -1.346 978 HA LYS 149 HA LYS 149 -9.743 14.824 -1.839 979 1HB LYS 149 HB2 LYS 149 -8.341 17.208 -0.584 980 2HB LYS 149 HB1 LYS 149 -10.063 17.109 -0.916 981 1HG LYS 149 HG2 LYS 149 -10.258 15.259 0.665 982 2HG LYS 149 HG1 LYS 149 -8.534 15.378 1.014 983 1HD LYS 149 HD2 LYS 149 -8.818 17.632 1.851 984 2HD LYS 149 HD1 LYS 149 -10.522 17.620 1.395 985 1HE LYS 149 HE2 LYS 149 -10.915 15.798 2.985 986 2HE LYS 149 HE1 LYS 149 -9.213 15.842 3.443 987 1HZ LYS 149 HZ2 LYS 149 -11.119 18.093 3.750 988 2HZ LYS 149 HZ1 LYS 149 -10.636 17.071 5.002 989 3HZ LYS 149 HZ3 LYS 149 -9.517 18.090 4.253 990 H ASP 150 HN ASP 150 -7.672 14.585 -3.573 991 HA ASP 150 HA ASP 150 -6.575 16.725 -4.874 992 1HB ASP 150 HB2 ASP 150 -5.852 14.375 -5.071 993 2HB ASP 150 HB1 ASP 150 -7.278 14.035 -6.040 994 H LYS 151 HN LYS 151 -7.240 18.150 -6.188 995 HA LYS 151 HA LYS 151 -10.056 18.375 -6.542 996 1HB LYS 151 HB2 LYS 151 -9.536 20.696 -7.297 997 2HB LYS 151 HB1 LYS 151 -8.983 20.274 -5.683 998 1HG LYS 151 HG2 LYS 151 -6.727 19.808 -6.707 999 2HG LYS 151 HG1 LYS 151 -7.344 20.547 -8.182 1000 1HD LYS 151 HD2 LYS 151 -7.751 22.613 -7.039 1001 2HD LYS 151 HD1 LYS 151 -7.314 21.888 -5.489 1002 1HE LYS 151 HE2 LYS 151 -5.037 21.490 -6.364 1003 2HE LYS 151 HE1 LYS 151 -5.496 22.315 -7.853 1004 1HZ LYS 151 HZ3 LYS 151 -5.931 24.302 -6.565 1005 2HZ LYS 151 HZ2 LYS 151 -5.465 23.501 -5.144 1006 3HZ LYS 151 HZ1 LYS 151 -4.338 23.779 -6.364 1007 H VAL 152 HN VAL 152 -8.274 16.706 -8.410 1008 HA VAL 152 HA VAL 152 -9.566 17.705 -10.834 1009 HB VAL 152 HB VAL 152 -8.275 16.128 -12.139 1010 1HG1 VAL 152 1HG1 VAL 152 -7.192 18.218 -11.662 1011 2HG1 VAL 152 3HG1 VAL 152 -6.510 17.562 -10.175 1012 3HG1 VAL 152 2HG1 VAL 152 -5.993 16.930 -11.741 1013 1HG2 VAL 152 1HG2 VAL 152 -8.211 14.237 -10.616 1014 2HG2 VAL 152 3HG2 VAL 152 -6.581 14.644 -11.154 1015 3HG2 VAL 152 2HG2 VAL 152 -7.125 15.114 -9.542 1016 H HIS 153 HN HIS 153 -10.085 15.707 -8.293 1017 HA HIS 153 HA HIS 153 -12.121 14.203 -9.748 1018 1HB HIS 153 HB2 HIS 153 -10.636 13.389 -7.230 1019 2HB HIS 153 HB1 HIS 153 -12.020 12.528 -7.885 1020 HD1 HIS 153 HD1 HIS 153 -11.586 11.274 -10.237 1021 HD2 HIS 153 HD2 HIS 153 -8.230 12.769 -8.301 1022 HE1 HIS 153 HE1 HIS 153 -9.597 10.141 -11.292 1023 H LYS 154 HN LYS 154 -13.867 15.384 -9.457 1024 HA LYS 154 HA LYS 154 -14.531 16.290 -6.734 1025 1HB LYS 154 HB2 LYS 154 -15.474 17.441 -9.376 1026 2HB LYS 154 HB1 LYS 154 -15.961 18.003 -7.787 1027 1HG LYS 154 HG2 LYS 154 -13.712 18.789 -7.342 1028 2HG LYS 154 HG1 LYS 154 -13.148 18.119 -8.873 1029 1HD LYS 154 HD2 LYS 154 -13.510 20.510 -9.123 1030 2HD LYS 154 HD1 LYS 154 -14.705 19.628 -10.073 1031 1HE LYS 154 HE2 LYS 154 -16.348 19.952 -8.232 1032 2HE LYS 154 HE1 LYS 154 -15.144 20.909 -7.371 1033 1HZ LYS 154 HZ2 LYS 154 -15.127 22.421 -9.302 1034 2HZ LYS 154 HZ1 LYS 154 -16.385 21.542 -9.988 1035 3HZ LYS 154 HZ3 LYS 154 -16.619 22.365 -8.530 1036 H LEU 155 HN LEU 155 -14.873 13.807 -8.029 1037 HA LEU 155 HA LEU 155 -16.253 12.228 -8.836 1038 1HB LEU 155 HB2 LEU 155 -17.597 13.373 -6.446 1039 2HB LEU 155 HB1 LEU 155 -18.102 11.846 -7.167 1040 HG LEU 155 HG LEU 155 -16.793 11.306 -5.356 1041 1HD1 LEU 155 HD1 LEU 155 -16.268 9.943 -7.233 1042 2HD1 LEU 155 HD1 LEU 155 -14.998 11.062 -7.731 1043 3HD1 LEU 155 HD1 LEU 155 -14.827 10.154 -6.239 1044 1HD2 LEU 155 HD2 LEU 155 -15.731 13.419 -4.831 1045 2HD2 LEU 155 HD2 LEU 155 -14.521 12.136 -4.860 1046 3HD2 LEU 155 HD2 LEU 155 -14.659 13.251 -6.219 1047 H GLU 156 HN GLU 156 -18.997 11.858 -8.766 1048 HA GLU 156 HA GLU 156 -19.861 13.290 -11.055 1049 1HB GLU 156 HB2 GLU 156 -20.649 11.011 -10.466 1050 2HB GLU 156 HB1 GLU 156 -21.448 11.659 -9.049 1051 1HG GLU 156 HG2 GLU 156 -22.911 12.980 -10.503 1052 2HG GLU 156 HG1 GLU 156 -22.130 12.252 -11.911 1053 H HIS 157 HN HIS 157 -20.065 13.698 -7.670 1054 HA HIS 157 HA HIS 157 -20.375 15.484 -6.344 1055 1HB HIS 157 HB2 HIS 157 -19.523 16.714 -8.544 1056 2HB HIS 157 HB1 HIS 157 -21.204 17.260 -8.585 1057 HD1 HIS 157 HD1 HIS 157 -18.071 17.544 -6.553 1058 HD2 HIS 157 HD2 HIS 157 -21.883 19.168 -6.709 1059 HE1 HIS 157 HE1 HIS 157 -18.062 19.511 -4.948 1060 H HIS 158 HN HIS 158 -22.388 13.665 -7.192 1061 HA HIS 158 HA HIS 158 -24.816 15.189 -7.098 1062 1HB HIS 158 HB2 HIS 158 -24.801 13.149 -8.452 1063 2HB HIS 158 HB1 HIS 158 -24.344 12.191 -7.055 1064 HD1 HIS 158 HD1 HIS 158 -26.266 10.967 -6.023 1065 HD2 HIS 158 HD2 HIS 158 -27.497 14.397 -8.015 1066 HE1 HIS 158 HE1 HIS 158 -28.781 11.007 -5.865 1067 H HIS 159 HN HIS 159 -24.419 16.238 -5.122 1068 HA HIS 159 HA HIS 159 -24.530 14.564 -2.735 1069 1HB HIS 159 HB2 HIS 159 -24.022 17.554 -3.005 1070 2HB HIS 159 HB1 HIS 159 -24.061 16.679 -1.481 1071 HD1 HIS 159 HD1 HIS 159 -21.489 18.203 -2.292 1072 HD2 HIS 159 HD2 HIS 159 -22.179 14.181 -3.093 1073 HE1 HIS 159 HE1 HIS 159 -19.229 17.155 -2.619 1074 H HIS 160 HN HIS 160 -26.376 14.210 -1.836 1075 HA HIS 160 HA HIS 160 -28.708 15.393 -3.029 1076 1HB HIS 160 HB2 HIS 160 -28.572 12.975 -2.819 1077 2HB HIS 160 HB1 HIS 160 -28.376 13.115 -1.079 1078 HD1 HIS 160 HD1 HIS 160 -30.475 12.795 0.204 1079 HD2 HIS 160 HD2 HIS 160 -31.199 14.021 -3.691 1080 HE1 HIS 160 HE1 HIS 160 -32.985 12.777 -0.080 1081 H HIS 161 HN HIS 161 -29.774 17.001 -2.191 1082 HA HIS 161 HA HIS 161 -30.120 17.161 0.692 1083 1HB HIS 161 HB2 HIS 161 -28.432 18.931 -0.105 1084 2HB HIS 161 HB1 HIS 161 -29.733 19.617 -1.070 1085 HD1 HIS 161 HD1 HIS 161 -28.196 19.931 2.190 1086 HD2 HIS 161 HD2 HIS 161 -32.035 20.395 0.683 1087 HE1 HIS 161 HE1 HIS 161 -29.453 21.301 3.882 1088 H HIS 162 HN HIS 162 -32.255 17.426 1.135 1089 HA HIS 162 HA HIS 162 -33.958 17.935 -1.163 1090 1HB HIS 162 HB2 HIS 162 -35.509 16.116 -0.372 1091 2HB HIS 162 HB1 HIS 162 -33.956 15.538 -0.933 1092 HD1 HIS 162 HD1 HIS 162 -36.190 14.472 1.405 1093 HD2 HIS 162 HD2 HIS 162 -32.214 15.596 1.777 1094 HE1 HIS 162 HE1 HIS 162 -35.334 13.365 3.501 No H/Q in entry = 1094 Start of MODEL 10 1 H1 MET 1 HT2 MET 1 15.663 -18.923 -3.689 2 H2 MET 1 HT1 MET 1 16.431 -17.451 -3.823 3 H3 MET 1 HT3 MET 1 17.018 -18.799 -4.671 4 HA MET 1 HA MET 1 17.558 -19.920 -2.638 5 1HB MET 1 HB2 MET 1 18.563 -17.054 -2.626 6 2HB MET 1 HB1 MET 1 19.287 -18.372 -1.722 7 1HG MET 1 HG2 MET 1 19.103 -18.212 -4.721 8 2HG MET 1 HG1 MET 1 20.539 -17.877 -3.757 9 1HE MET 1 HE1 MET 1 20.323 -19.935 -6.232 10 2HE MET 1 HE3 MET 1 21.827 -19.604 -5.371 11 3HE MET 1 HE2 MET 1 21.299 -21.266 -5.619 12 H GLU 2 HN GLU 2 18.244 -18.621 -0.180 13 HA GLU 2 HA GLU 2 15.859 -18.872 1.218 14 1HB GLU 2 HB2 GLU 2 18.013 -19.128 2.320 15 2HB GLU 2 HB1 GLU 2 18.419 -17.458 1.978 16 1HG GLU 2 HG2 GLU 2 17.793 -17.843 4.329 17 2HG GLU 2 HG1 GLU 2 16.755 -16.672 3.523 18 H MET 3 HN MET 3 14.197 -17.635 1.443 19 HA MET 3 HA MET 3 14.253 -14.979 0.312 20 1HB MET 3 HB2 MET 3 11.957 -16.580 1.461 21 2HB MET 3 HB1 MET 3 11.794 -14.984 0.765 22 1HG MET 3 HG2 MET 3 12.692 -17.456 -0.695 23 2HG MET 3 HG1 MET 3 11.083 -16.738 -0.773 24 1HE MET 3 HE3 MET 3 11.002 -16.505 -3.350 25 2HE MET 3 HE2 MET 3 12.333 -15.894 -4.330 26 3HE MET 3 HE1 MET 3 12.525 -17.393 -3.420 27 H GLY 4 HN GLY 4 14.886 -16.234 3.284 28 1HA GLY 4 HA1 GLY 4 15.432 -15.137 5.234 29 2HA GLY 4 HA2 GLY 4 13.837 -14.404 5.077 30 H GLN 5 HN GLN 5 16.679 -14.042 3.004 31 HA GLN 5 HA GLN 5 17.194 -11.379 3.957 32 1HB GLN 5 HB2 GLN 5 18.912 -11.272 2.262 33 2HB GLN 5 HB1 GLN 5 19.024 -12.736 3.233 34 1HG GLN 5 HG2 GLN 5 18.129 -14.072 1.458 35 2HG GLN 5 HG1 GLN 5 17.785 -12.634 0.496 36 1HE2 GLN 5 1HE2 GLN 5 20.263 -14.728 1.702 37 2HE2 GLN 5 2HE2 GLN 5 21.502 -14.218 0.612 38 H LEU 6 HN LEU 6 15.363 -12.785 1.454 39 HA LEU 6 HA LEU 6 15.145 -10.437 -0.155 40 1HB LEU 6 HB2 LEU 6 14.880 -12.694 -1.109 41 2HB LEU 6 HB1 LEU 6 13.532 -12.999 -0.049 42 HG LEU 6 HG LEU 6 13.027 -12.592 -2.507 43 1HD1 LEU 6 HD1 LEU 6 11.301 -12.573 -0.821 44 2HD1 LEU 6 HD1 LEU 6 11.620 -10.879 -0.486 45 3HD1 LEU 6 HD1 LEU 6 10.992 -11.357 -2.064 46 1HD2 LEU 6 HD2 LEU 6 13.603 -9.740 -1.714 47 2HD2 LEU 6 HD2 LEU 6 14.505 -10.701 -2.887 48 3HD2 LEU 6 HD2 LEU 6 12.828 -10.247 -3.208 49 H LYS 7 HN LYS 7 13.153 -12.061 2.233 50 HA LYS 7 HA LYS 7 11.060 -10.186 2.366 51 1HB LYS 7 HB2 LYS 7 11.723 -12.641 3.542 52 2HB LYS 7 HB1 LYS 7 11.617 -11.514 4.885 53 1HG LYS 7 HG2 LYS 7 9.507 -11.827 2.800 54 2HG LYS 7 HG1 LYS 7 9.498 -12.751 4.293 55 1HD LYS 7 HD2 LYS 7 9.486 -9.724 4.133 56 2HD LYS 7 HD1 LYS 7 8.028 -10.695 4.320 57 1HE LYS 7 HE2 LYS 7 10.354 -10.650 6.223 58 2HE LYS 7 HE1 LYS 7 8.836 -9.781 6.443 59 1HZ LYS 7 HZ2 LYS 7 7.694 -11.932 6.431 60 2HZ LYS 7 HZ1 LYS 7 9.145 -12.752 6.336 61 3HZ LYS 7 HZ3 LYS 7 8.789 -11.813 7.692 62 H ASN 8 HN ASN 8 14.177 -10.451 3.844 63 HA ASN 8 HA ASN 8 14.146 -8.445 5.787 64 1HB ASN 8 HB2 ASN 8 16.049 -9.888 5.595 65 2HB ASN 8 HB1 ASN 8 16.277 -9.459 3.908 66 1HD2 ASN 8 HD2 ASN 8 17.045 -8.729 7.125 67 2HD2 ASN 8 HD2 ASN 8 18.055 -7.368 6.798 68 H LYS 9 HN LYS 9 14.982 -8.280 2.334 69 HA LYS 9 HA LYS 9 15.350 -5.478 2.362 70 1HB LYS 9 HB2 LYS 9 14.978 -7.370 0.037 71 2HB LYS 9 HB1 LYS 9 15.408 -5.674 -0.124 72 1HG LYS 9 HG2 LYS 9 17.045 -7.767 1.300 73 2HG LYS 9 HG1 LYS 9 17.374 -7.119 -0.309 74 1HD LYS 9 HD2 LYS 9 17.720 -4.896 0.639 75 2HD LYS 9 HD1 LYS 9 17.308 -5.492 2.244 76 1HE LYS 9 HE2 LYS 9 19.671 -6.368 0.586 77 2HE LYS 9 HE1 LYS 9 19.712 -5.279 1.972 78 1HZ LYS 9 HZ3 LYS 9 18.853 -7.119 3.345 79 2HZ LYS 9 HZ2 LYS 9 18.974 -8.146 2.004 80 3HZ LYS 9 HZ1 LYS 9 20.347 -7.456 2.646 81 H ILE 10 HN ILE 10 12.610 -7.513 1.524 82 HA ILE 10 HA ILE 10 10.914 -5.489 0.588 83 HB ILE 10 HB ILE 10 10.189 -8.001 2.140 84 1HG1 ILE 10 2HG1 ILE 10 10.129 -7.383 -0.822 85 2HG1 ILE 10 1HG1 ILE 10 11.270 -8.445 -0.007 86 1HG2 ILE 10 3HG2 ILE 10 8.391 -6.360 2.353 87 2HG2 ILE 10 2HG2 ILE 10 8.354 -6.164 0.600 88 3HG2 ILE 10 1HG2 ILE 10 7.892 -7.703 1.321 89 1HD1 ILE 10 HD1 ILE 10 8.302 -8.886 -0.251 90 2HD1 ILE 10 HD1 ILE 10 9.563 -9.692 -1.183 91 3HD1 ILE 10 HD1 ILE 10 9.448 -9.966 0.553 92 H GLU 11 HN GLU 11 11.307 -6.715 3.916 93 HA GLU 11 HA GLU 11 9.535 -4.946 5.121 94 1HB GLU 11 HB2 GLU 11 12.041 -6.166 6.286 95 2HB GLU 11 HB1 GLU 11 10.845 -5.287 7.221 96 1HG GLU 11 HG2 GLU 11 10.437 -7.871 5.737 97 2HG GLU 11 HG1 GLU 11 10.514 -7.652 7.486 98 H ASN 12 HN ASN 12 13.063 -4.576 4.677 99 HA ASN 12 HA ASN 12 13.269 -2.144 5.949 100 1HB ASN 12 HB2 ASN 12 14.911 -3.681 4.015 101 2HB ASN 12 HB1 ASN 12 15.328 -2.017 4.360 102 1HD2 ASN 12 HD2 ASN 12 15.184 -5.259 5.578 103 2HD2 ASN 12 HD2 ASN 12 16.094 -4.985 7.016 104 H LYS 13 HN LYS 13 12.693 -2.895 2.524 105 HA LYS 13 HA LYS 13 13.002 -0.188 1.711 106 1HB LYS 13 HB2 LYS 13 13.222 -2.312 0.276 107 2HB LYS 13 HB1 LYS 13 11.475 -2.284 0.192 108 1HG LYS 13 HG2 LYS 13 12.465 -1.260 -1.788 109 2HG LYS 13 HG1 LYS 13 11.523 -0.093 -0.863 110 1HD LYS 13 HD2 LYS 13 13.651 0.861 -1.642 111 2HD LYS 13 HD1 LYS 13 13.566 0.830 0.112 112 1HE LYS 13 HE2 LYS 13 14.918 -1.248 0.085 113 2HE LYS 13 HE1 LYS 13 15.073 -1.090 -1.670 114 1HZ LYS 13 HZ2 LYS 13 16.124 1.104 -1.241 115 2HZ LYS 13 HZ1 LYS 13 16.072 0.766 0.421 116 3HZ LYS 13 HZ3 LYS 13 16.996 -0.183 -0.633 117 H LYS 14 HN LYS 14 10.246 -2.198 2.509 118 HA LYS 14 HA LYS 14 8.158 -0.423 1.943 119 1HB LYS 14 HB2 LYS 14 7.700 -2.696 2.378 120 2HB LYS 14 HB1 LYS 14 8.540 -2.647 3.929 121 1HG LYS 14 HG2 LYS 14 6.717 -1.121 4.755 122 2HG LYS 14 HG1 LYS 14 5.871 -1.415 3.234 123 1HD LYS 14 HD2 LYS 14 4.984 -2.931 4.933 124 2HD LYS 14 HD1 LYS 14 5.910 -3.823 3.719 125 1HE LYS 14 HE2 LYS 14 7.823 -3.939 5.215 126 2HE LYS 14 HE1 LYS 14 6.932 -2.991 6.408 127 1HZ LYS 14 HZ2 LYS 14 6.022 -5.635 5.411 128 2HZ LYS 14 HZ1 LYS 14 6.978 -5.458 6.773 129 3HZ LYS 14 HZ3 LYS 14 5.431 -4.800 6.748 130 H LYS 15 HN LYS 15 10.124 -0.906 4.803 131 HA LYS 15 HA LYS 15 8.827 1.062 6.380 132 1HB LYS 15 HB2 LYS 15 11.516 -0.274 6.742 133 2HB LYS 15 HB1 LYS 15 10.765 0.785 7.937 134 1HG LYS 15 HG2 LYS 15 8.925 -0.730 8.221 135 2HG LYS 15 HG1 LYS 15 9.481 -1.723 6.880 136 1HD LYS 15 HD2 LYS 15 10.091 -2.869 8.867 137 2HD LYS 15 HD1 LYS 15 11.563 -2.169 8.222 138 1HE LYS 15 HE2 LYS 15 11.438 -0.355 9.837 139 2HE LYS 15 HE1 LYS 15 9.912 -0.989 10.450 140 1HZ LYS 15 HZ2 LYS 15 12.517 -2.411 10.543 141 2HZ LYS 15 HZ1 LYS 15 11.773 -1.642 11.834 142 3HZ LYS 15 HZ3 LYS 15 11.046 -2.994 11.141 143 H GLU 16 HN GLU 16 11.644 1.133 4.291 144 HA GLU 16 HA GLU 16 12.451 3.767 4.748 145 1HB GLU 16 HB2 GLU 16 12.471 2.093 2.232 146 2HB GLU 16 HB1 GLU 16 13.084 3.737 2.255 147 1HG GLU 16 HG2 GLU 16 14.768 3.111 3.851 148 2HG GLU 16 HG1 GLU 16 14.118 1.469 3.937 149 H LEU 17 HN LEU 17 9.909 2.462 2.706 150 HA LEU 17 HA LEU 17 9.087 4.903 1.515 151 1HB LEU 17 HB2 LEU 17 8.434 2.958 0.444 152 2HB LEU 17 HB1 LEU 17 7.722 2.263 1.905 153 HG LEU 17 HG LEU 17 6.170 4.373 1.704 154 1HD1 LEU 17 HD1 LEU 17 7.123 4.216 -1.048 155 2HD1 LEU 17 HD1 LEU 17 5.641 5.003 -0.482 156 3HD1 LEU 17 HD1 LEU 17 7.206 5.548 0.120 157 1HD2 LEU 17 HD2 LEU 17 5.538 2.073 1.634 158 2HD2 LEU 17 HD2 LEU 17 4.595 3.179 0.649 159 3HD2 LEU 17 HD2 LEU 17 5.772 2.063 -0.140 160 H ILE 18 HN ILE 18 7.935 3.057 4.268 161 HA ILE 18 HA ILE 18 5.808 4.677 4.976 162 HB ILE 18 HB ILE 18 7.641 3.121 6.838 163 1HG1 ILE 18 2HG1 ILE 18 4.897 2.346 5.860 164 2HG1 ILE 18 1HG1 ILE 18 6.322 1.809 4.992 165 1HG2 ILE 18 3HG2 ILE 18 4.907 4.310 7.283 166 2HG2 ILE 18 2HG2 ILE 18 5.701 3.207 8.416 167 3HG2 ILE 18 1HG2 ILE 18 6.396 4.803 8.075 168 1HD1 ILE 18 HD1 ILE 18 7.076 0.719 7.056 169 2HD1 ILE 18 HD1 ILE 18 5.575 1.211 7.835 170 3HD1 ILE 18 HD1 ILE 18 5.535 0.094 6.460 171 H GLN 19 HN GLN 19 9.211 4.960 5.785 172 HA GLN 19 HA GLN 19 9.144 7.255 7.376 173 1HB GLN 19 HB2 GLN 19 11.187 6.440 5.329 174 2HB GLN 19 HB1 GLN 19 11.431 7.692 6.533 175 1HG GLN 19 HG2 GLN 19 11.272 6.057 8.303 176 2HG GLN 19 HG1 GLN 19 10.901 4.793 7.132 177 1HE2 GLN 19 1HE2 GLN 19 12.690 3.593 7.677 178 2HE2 GLN 19 2HE2 GLN 19 14.300 4.043 7.258 179 H LEU 20 HN LEU 20 9.247 6.989 3.801 180 HA LEU 20 HA LEU 20 9.318 9.769 3.334 181 1HB LEU 20 HB2 LEU 20 8.377 7.545 1.499 182 2HB LEU 20 HB1 LEU 20 8.216 9.238 1.107 183 HG LEU 20 HG LEU 20 9.999 8.538 -0.096 184 1HD1 LEU 20 HD1 LEU 20 10.419 10.623 0.859 185 2HD1 LEU 20 HD1 LEU 20 11.177 9.881 2.272 186 3HD1 LEU 20 HD1 LEU 20 11.921 9.717 0.682 187 1HD2 LEU 20 HD2 LEU 20 11.045 7.077 2.307 188 2HD2 LEU 20 HD2 LEU 20 10.523 6.450 0.728 189 3HD2 LEU 20 HD2 LEU 20 11.993 7.384 0.839 190 H VAL 21 HN VAL 21 6.402 7.518 3.316 191 HA VAL 21 HA VAL 21 4.702 9.663 2.893 192 HB VAL 21 HB VAL 21 2.986 8.217 3.080 193 1HG1 VAL 21 1HG1 VAL 21 4.305 7.403 1.349 194 2HG1 VAL 21 3HG1 VAL 21 5.231 6.399 2.474 195 3HG1 VAL 21 2HG1 VAL 21 3.528 6.048 2.189 196 1HG2 VAL 21 1HG2 VAL 21 4.474 6.544 5.052 197 2HG2 VAL 21 3HG2 VAL 21 3.119 7.656 5.339 198 3HG2 VAL 21 2HG2 VAL 21 2.867 6.193 4.372 199 H ALA 22 HN ALA 22 6.087 8.369 5.833 200 HA ALA 22 HA ALA 22 4.327 9.590 7.635 201 1HB ALA 22 HB1 ALA 22 7.197 8.805 8.107 202 2HB ALA 22 HB3 ALA 22 5.944 9.046 9.341 203 3HB ALA 22 HB2 ALA 22 5.809 7.729 8.186 204 H ARG 23 HN ARG 23 7.507 10.623 6.404 205 HA ARG 23 HA ARG 23 7.558 13.032 7.864 206 1HB ARG 23 HB2 ARG 23 9.418 13.728 6.453 207 2HB ARG 23 HB1 ARG 23 9.623 12.054 6.932 208 1HG ARG 23 HG2 ARG 23 8.762 11.378 4.704 209 2HG ARG 23 HG1 ARG 23 8.713 13.079 4.255 210 1HD ARG 23 HD2 ARG 23 10.752 12.051 3.411 211 2HD ARG 23 HD1 ARG 23 11.142 13.234 4.654 212 HE ARG 23 HE ARG 23 11.058 11.047 6.114 213 1HH1 ARG 23 1HH1 ARG 23 12.657 11.513 2.963 214 2HH1 ARG 23 2HH1 ARG 23 13.827 10.311 3.228 215 1HH2 ARG 23 1HH2 ARG 23 12.678 9.491 6.493 216 2HH2 ARG 23 2HH2 ARG 23 13.872 9.134 5.314 217 H HIS 24 HN HIS 24 5.885 12.146 5.080 218 HA HIS 24 HA HIS 24 5.376 14.529 3.755 219 1HB HIS 24 HB2 HIS 24 4.597 12.415 2.879 220 2HB HIS 24 HB1 HIS 24 3.556 12.146 4.263 221 HD1 HIS 24 HD1 HIS 24 1.302 13.712 4.333 222 HD2 HIS 24 HD2 HIS 24 3.540 13.828 0.831 223 HE1 HIS 24 HE1 HIS 24 -0.147 14.779 2.617 224 H GLY 25 HN GLY 25 3.884 13.228 6.714 225 1HA GLY 25 HA1 GLY 25 1.963 15.401 6.769 226 2HA GLY 25 HA2 GLY 25 3.216 15.483 7.999 227 H LEU 26 HN LEU 26 2.428 12.250 7.246 228 HA LEU 26 HA LEU 26 0.208 11.793 8.719 229 1HB LEU 26 HB2 LEU 26 2.562 10.221 7.938 230 2HB LEU 26 HB1 LEU 26 1.480 9.542 9.137 231 HG LEU 26 HG LEU 26 -0.348 9.887 7.520 232 1HD1 LEU 26 HD1 LEU 26 0.574 11.497 6.081 233 2HD1 LEU 26 HD1 LEU 26 1.806 10.357 5.511 234 3HD1 LEU 26 HD1 LEU 26 0.086 10.036 5.207 235 1HD2 LEU 26 HD2 LEU 26 1.894 8.024 6.962 236 2HD2 LEU 26 HD2 LEU 26 0.401 7.717 7.865 237 3HD2 LEU 26 HD2 LEU 26 0.378 7.924 6.097 238 H ASP 27 HN ASP 27 -0.228 11.339 10.676 239 HA ASP 27 HA ASP 27 1.469 12.220 12.867 240 1HB ASP 27 HB2 ASP 27 -1.061 10.558 13.127 241 2HB ASP 27 HB1 ASP 27 -0.361 11.637 14.318 242 H HIS 28 HN HIS 28 2.020 10.635 14.657 243 HA HIS 28 HA HIS 28 3.256 8.311 13.652 244 1HB HIS 28 HB2 HIS 28 2.452 8.949 16.493 245 2HB HIS 28 HB1 HIS 28 3.447 7.569 16.046 246 HD1 HIS 28 HD1 HIS 28 3.786 10.844 17.320 247 HD2 HIS 28 HD2 HIS 28 5.856 8.596 14.520 248 HE1 HIS 28 HE1 HIS 28 6.077 11.895 17.134 249 H ASP 29 HN ASP 29 0.145 8.876 15.056 250 HA ASP 29 HA ASP 29 -0.910 6.320 15.330 251 1HB ASP 29 HB2 ASP 29 -2.177 8.101 16.186 252 2HB ASP 29 HB1 ASP 29 -2.052 9.025 14.700 253 H LYS 30 HN LYS 30 -0.734 8.435 12.564 254 HA LYS 30 HA LYS 30 -2.228 6.770 10.825 255 1HB LYS 30 HB2 LYS 30 -0.262 8.954 10.256 256 2HB LYS 30 HB1 LYS 30 -1.288 8.225 9.030 257 1HG LYS 30 HG2 LYS 30 -2.158 9.815 11.435 258 2HG LYS 30 HG1 LYS 30 -2.180 10.337 9.748 259 1HD LYS 30 HD2 LYS 30 -3.836 8.706 9.210 260 2HD LYS 30 HD1 LYS 30 -3.757 8.012 10.832 261 1HE LYS 30 HE2 LYS 30 -4.679 10.795 10.121 262 2HE LYS 30 HE1 LYS 30 -5.703 9.469 10.659 263 1HZ LYS 30 HZ1 LYS 30 -4.373 9.475 12.784 264 2HZ LYS 30 HZ3 LYS 30 -3.650 10.924 12.250 265 3HZ LYS 30 HZ2 LYS 30 -5.294 10.844 12.512 266 H VAL 31 HN VAL 31 1.155 7.180 11.544 267 HA VAL 31 HA VAL 31 2.153 5.552 9.478 268 HB VAL 31 HB VAL 31 3.403 6.253 12.168 269 1HG1 VAL 31 2HG1 VAL 31 4.478 4.304 11.180 270 2HG1 VAL 31 1HG1 VAL 31 4.719 5.195 9.678 271 3HG1 VAL 31 3HG1 VAL 31 5.537 5.715 11.153 272 1HG2 VAL 31 3HG2 VAL 31 2.801 8.169 10.789 273 2HG2 VAL 31 2HG2 VAL 31 4.551 8.002 10.946 274 3HG2 VAL 31 1HG2 VAL 31 3.736 7.507 9.456 275 H LEU 32 HN LEU 32 1.156 4.912 12.771 276 HA LEU 32 HA LEU 32 1.823 2.168 12.910 277 1HB LEU 32 HB2 LEU 32 -0.385 3.689 14.267 278 2HB LEU 32 HB1 LEU 32 0.172 2.088 14.716 279 HG LEU 32 HG LEU 32 1.828 4.603 14.841 280 1HD1 LEU 32 HD1 LEU 32 0.503 3.011 16.999 281 2HD1 LEU 32 HD1 LEU 32 1.607 4.370 17.252 282 3HD1 LEU 32 HD1 LEU 32 0.053 4.632 16.453 283 1HD2 LEU 32 HD2 LEU 32 2.403 1.793 15.782 284 2HD2 LEU 32 HD2 LEU 32 3.191 2.641 14.445 285 3HD2 LEU 32 HD2 LEU 32 3.401 3.214 16.098 286 H LEU 33 HN LEU 33 -1.160 3.769 11.962 287 HA LEU 33 HA LEU 33 -2.580 1.363 11.424 288 1HB LEU 33 HB2 LEU 33 -3.052 4.086 10.263 289 2HB LEU 33 HB1 LEU 33 -4.194 2.758 10.363 290 HG LEU 33 HG LEU 33 -3.053 4.220 12.737 291 1HD1 LEU 33 HD1 LEU 33 -4.411 5.682 11.367 292 2HD1 LEU 33 HD1 LEU 33 -5.755 4.532 11.448 293 3HD1 LEU 33 HD1 LEU 33 -5.156 5.329 12.911 294 1HD2 LEU 33 HD2 LEU 33 -3.770 1.928 13.233 295 2HD2 LEU 33 HD2 LEU 33 -4.823 3.117 13.992 296 3HD2 LEU 33 HD2 LEU 33 -5.359 2.275 12.541 297 H PHE 34 HN PHE 34 -0.704 3.570 9.453 298 HA PHE 34 HA PHE 34 -1.277 2.452 6.948 299 1HB PHE 34 HB2 PHE 34 -0.352 4.674 7.136 300 2HB PHE 34 HB1 PHE 34 1.084 4.054 7.928 301 HD1 PHE 34 HD1 PHE 34 2.985 3.803 6.657 302 HD2 PHE 34 HD2 PHE 34 -0.798 3.657 4.714 303 HE1 PHE 34 HE1 PHE 34 4.095 3.644 4.473 304 HE2 PHE 34 HE2 PHE 34 0.298 3.515 2.572 305 HZ PHE 34 HZ PHE 34 2.771 3.507 2.433 306 H SER 35 HN SER 35 1.489 1.958 9.137 307 HA SER 35 HA SER 35 2.878 0.236 7.454 308 1HB SER 35 HB2 SER 35 4.120 -0.415 9.536 309 2HB SER 35 HB1 SER 35 4.016 1.319 9.249 310 HG SER 35 HG SER 35 2.672 1.572 10.838 311 H ARG 36 HN ARG 36 0.430 -0.482 9.892 312 HA ARG 36 HA ARG 36 0.841 -3.294 9.657 313 1HB ARG 36 HB2 ARG 36 -1.121 -3.542 11.099 314 2HB ARG 36 HB1 ARG 36 0.012 -2.364 11.733 315 1HG ARG 36 HG2 ARG 36 -1.450 -0.583 10.731 316 2HG ARG 36 HG1 ARG 36 -2.631 -1.857 10.420 317 1HD ARG 36 HD2 ARG 36 -1.489 -1.073 13.087 318 2HD ARG 36 HD1 ARG 36 -3.109 -0.713 12.505 319 HE ARG 36 HE ARG 36 -2.796 -3.467 12.356 320 1HH1 ARG 36 1HH1 ARG 36 -2.981 -1.002 14.876 321 2HH1 ARG 36 2HH1 ARG 36 -3.565 -2.089 16.059 322 1HH2 ARG 36 1HH2 ARG 36 -3.606 -4.919 13.979 323 2HH2 ARG 36 2HH2 ARG 36 -3.911 -4.329 15.560 324 H ASP 37 HN ASP 37 -1.435 -1.033 8.183 325 HA ASP 37 HA ASP 37 -3.052 -3.017 6.914 326 1HB ASP 37 HB2 ASP 37 -3.789 -0.691 7.288 327 2HB ASP 37 HB1 ASP 37 -2.558 -0.100 6.203 328 H LEU 38 HN LEU 38 -0.268 -1.178 6.020 329 HA LEU 38 HA LEU 38 -0.016 -2.093 3.381 330 1HB LEU 38 HB2 LEU 38 1.001 -0.088 4.121 331 2HB LEU 38 HB1 LEU 38 1.860 -0.910 5.390 332 HG LEU 38 HG LEU 38 3.493 -1.741 3.858 333 1HD1 LEU 38 HD1 LEU 38 1.727 -0.714 1.659 334 2HD1 LEU 38 HD1 LEU 38 3.330 -1.447 1.506 335 3HD1 LEU 38 HD1 LEU 38 1.963 -2.429 2.060 336 1HD2 LEU 38 HD2 LEU 38 2.581 0.961 3.091 337 2HD2 LEU 38 HD2 LEU 38 3.641 0.593 4.448 338 3HD2 LEU 38 HD2 LEU 38 4.209 0.328 2.780 339 H ASP 39 HN ASP 39 1.287 -3.227 6.442 340 HA ASP 39 HA ASP 39 2.943 -5.266 5.428 341 1HB ASP 39 HB2 ASP 39 2.960 -4.393 7.784 342 2HB ASP 39 HB1 ASP 39 1.466 -5.271 8.060 343 H LYS 40 HN LYS 40 -0.443 -5.217 6.409 344 HA LYS 40 HA LYS 40 -0.791 -7.999 6.073 345 1HB LYS 40 HB2 LYS 40 -3.073 -7.684 6.549 346 2HB LYS 40 HB1 LYS 40 -2.141 -6.508 7.513 347 1HG LYS 40 HG2 LYS 40 -2.833 -4.745 6.078 348 2HG LYS 40 HG1 LYS 40 -3.729 -5.882 5.068 349 1HD LYS 40 HD2 LYS 40 -5.178 -6.486 6.901 350 2HD LYS 40 HD1 LYS 40 -4.237 -5.507 8.018 351 1HE LYS 40 HE2 LYS 40 -6.370 -4.452 7.343 352 2HE LYS 40 HE1 LYS 40 -4.974 -3.478 6.933 353 1HZ LYS 40 HZ1 LYS 40 -6.316 -5.260 4.953 354 2HZ LYS 40 HZ3 LYS 40 -6.717 -3.653 5.242 355 3HZ LYS 40 HZ2 LYS 40 -5.202 -3.953 4.701 356 H LEU 41 HN LEU 41 -1.194 -5.286 3.970 357 HA LEU 41 HA LEU 41 -2.527 -6.650 1.884 358 1HB LEU 41 HB2 LEU 41 -2.519 -4.271 1.944 359 2HB LEU 41 HB1 LEU 41 -0.773 -4.209 1.890 360 HG LEU 41 HG LEU 41 -0.799 -5.120 -0.403 361 1HD1 LEU 41 HD1 LEU 41 -3.788 -4.924 -0.186 362 2HD1 LEU 41 HD1 LEU 41 -2.884 -5.206 -1.674 363 3HD1 LEU 41 HD1 LEU 41 -2.821 -6.391 -0.370 364 1HD2 LEU 41 HD2 LEU 41 -2.479 -2.648 -0.032 365 2HD2 LEU 41 HD2 LEU 41 -0.714 -2.724 -0.098 366 3HD2 LEU 41 HD2 LEU 41 -1.676 -3.123 -1.526 367 H ILE 42 HN ILE 42 0.770 -6.269 2.777 368 HA ILE 42 HA ILE 42 1.727 -7.307 0.275 369 HB ILE 42 HB ILE 42 3.292 -6.879 2.841 370 1HG1 ILE 42 2HG1 ILE 42 3.144 -5.284 0.289 371 2HG1 ILE 42 1HG1 ILE 42 2.371 -4.843 1.806 372 1HG2 ILE 42 2HG2 ILE 42 4.241 -7.519 0.035 373 2HG2 ILE 42 1HG2 ILE 42 5.292 -7.078 1.385 374 3HG2 ILE 42 3HG2 ILE 42 4.362 -8.572 1.443 375 1HD1 ILE 42 HD1 ILE 42 4.530 -4.702 2.845 376 2HD1 ILE 42 HD1 ILE 42 5.328 -5.077 1.316 377 3HD1 ILE 42 HD1 ILE 42 4.390 -3.582 1.482 378 H ASN 43 HN ASN 43 1.631 -8.607 3.545 379 HA ASN 43 HA ASN 43 2.488 -11.194 2.994 380 1HB ASN 43 HB2 ASN 43 0.588 -10.168 5.087 381 2HB ASN 43 HB1 ASN 43 0.971 -11.879 4.949 382 1HD2 ASN 43 HD2 ASN 43 2.249 -8.727 5.748 383 2HD2 ASN 43 HD2 ASN 43 3.688 -9.289 6.489 384 H LYS 44 HN LYS 44 -0.618 -9.763 2.486 385 HA LYS 44 HA LYS 44 -2.226 -11.963 1.933 386 1HB LYS 44 HB2 LYS 44 -3.043 -9.698 2.110 387 2HB LYS 44 HB1 LYS 44 -2.156 -9.228 0.675 388 1HG LYS 44 HG2 LYS 44 -3.554 -10.833 -0.637 389 2HG LYS 44 HG1 LYS 44 -4.519 -11.090 0.814 390 1HD LYS 44 HD2 LYS 44 -4.120 -8.456 -0.608 391 2HD LYS 44 HD1 LYS 44 -5.581 -9.442 -0.641 392 1HE LYS 44 HE2 LYS 44 -5.737 -9.191 1.805 393 2HE LYS 44 HE1 LYS 44 -4.360 -8.103 1.766 394 1HZ LYS 44 HZ1 LYS 44 -6.936 -7.636 0.371 395 2HZ LYS 44 HZ3 LYS 44 -6.451 -6.901 1.797 396 3HZ LYS 44 HZ2 LYS 44 -5.630 -6.587 0.372 397 H PHE 45 HN PHE 45 -0.151 -10.059 -0.210 398 HA PHE 45 HA PHE 45 -0.675 -11.750 -2.459 399 1HB PHE 45 HB2 PHE 45 0.986 -9.303 -2.038 400 2HB PHE 45 HB1 PHE 45 1.191 -10.297 -3.478 401 HD1 PHE 45 HD1 PHE 45 -0.217 -10.074 -5.288 402 HD2 PHE 45 HD2 PHE 45 -1.366 -8.367 -1.559 403 HE1 PHE 45 HE1 PHE 45 -2.095 -8.954 -6.385 404 HE2 PHE 45 HE2 PHE 45 -3.244 -7.239 -2.658 405 HZ PHE 45 HZ PHE 45 -3.612 -7.530 -5.080 406 H MET 46 HN MET 46 1.771 -11.454 -0.055 407 HA MET 46 HA MET 46 3.854 -12.921 -1.361 408 1HB MET 46 HB2 MET 46 3.353 -12.666 1.599 409 2HB MET 46 HB1 MET 46 4.840 -13.178 0.815 410 1HG MET 46 HG2 MET 46 5.003 -10.914 -0.219 411 2HG MET 46 HG1 MET 46 3.577 -10.471 0.694 412 1HE MET 46 HE1 MET 46 6.625 -12.705 1.696 413 2HE MET 46 HE3 MET 46 7.344 -11.346 0.828 414 3HE MET 46 HE2 MET 46 7.608 -11.536 2.563 415 H ASN 47 HN ASN 47 1.039 -13.867 0.543 416 HA ASN 47 HA ASN 47 0.122 -15.846 1.098 417 1HB ASN 47 HB2 ASN 47 1.647 -16.531 -1.362 418 2HB ASN 47 HB1 ASN 47 0.739 -17.799 -0.517 419 1HD2 ASN 47 HD2 ASN 47 -1.459 -15.954 0.150 420 2HD2 ASN 47 HD2 ASN 47 -2.279 -15.640 -1.325 421 H VAL 48 HN VAL 48 2.463 -15.049 2.412 422 HA VAL 48 HA VAL 48 4.102 -17.380 2.695 423 HB VAL 48 HB VAL 48 5.319 -16.091 4.520 424 1HG1 VAL 48 1HG1 VAL 48 5.166 -14.955 1.743 425 2HG1 VAL 48 3HG1 VAL 48 6.503 -14.720 2.873 426 3HG1 VAL 48 2HG1 VAL 48 6.134 -16.334 2.251 427 1HG2 VAL 48 3HG2 VAL 48 3.490 -14.546 4.986 428 2HG2 VAL 48 2HG2 VAL 48 4.979 -13.678 4.575 429 3HG2 VAL 48 1HG2 VAL 48 3.668 -13.838 3.388 430 H LYS 49 HN LYS 49 2.711 -18.710 3.166 431 HA LYS 49 HA LYS 49 2.323 -19.010 6.055 432 1HB LYS 49 HB2 LYS 49 0.798 -20.267 3.757 433 2HB LYS 49 HB1 LYS 49 0.582 -20.693 5.455 434 1HG LYS 49 HG2 LYS 49 -0.153 -18.450 5.972 435 2HG LYS 49 HG1 LYS 49 0.188 -17.935 4.325 436 1HD LYS 49 HD2 LYS 49 -1.569 -19.409 3.499 437 2HD LYS 49 HD1 LYS 49 -1.895 -19.955 5.147 438 1HE LYS 49 HE2 LYS 49 -3.485 -18.206 4.401 439 2HE LYS 49 HE1 LYS 49 -2.548 -17.713 5.810 440 1HZ LYS 49 HZ1 LYS 49 -1.990 -16.900 3.002 441 2HZ LYS 49 HZ3 LYS 49 -2.751 -15.950 4.145 442 3HZ LYS 49 HZ2 LYS 49 -1.152 -16.361 4.364 443 H ASP 50 HN ASP 50 4.414 -19.475 3.903 444 HA ASP 50 HA ASP 50 4.964 -22.292 3.989 445 1HB ASP 50 HB2 ASP 50 5.515 -21.213 1.941 446 2HB ASP 50 HB1 ASP 50 6.414 -19.945 2.763 447 H LYS 51 HN LYS 51 5.295 -22.796 6.017 448 HA LYS 51 HA LYS 51 7.844 -21.914 7.219 449 1HB LYS 51 HB2 LYS 51 6.822 -22.142 9.414 450 2HB LYS 51 HB1 LYS 51 5.892 -20.992 8.461 451 1HG LYS 51 HG2 LYS 51 4.278 -22.786 7.951 452 2HG LYS 51 HG1 LYS 51 5.186 -23.873 8.994 453 1HD LYS 51 HD2 LYS 51 3.337 -23.056 10.230 454 2HD LYS 51 HD1 LYS 51 4.780 -22.275 10.869 455 1HE LYS 51 HE2 LYS 51 2.914 -20.693 10.630 456 2HE LYS 51 HE1 LYS 51 4.269 -20.256 9.601 457 1HZ LYS 51 HZ2 LYS 51 1.853 -21.736 8.666 458 2HZ LYS 51 HZ1 LYS 51 2.129 -20.068 8.493 459 3HZ LYS 51 HZ3 LYS 51 3.121 -21.175 7.708 460 H VAL 52 HN VAL 52 6.710 -24.086 5.490 461 HA VAL 52 HA VAL 52 7.074 -26.438 7.200 462 HB VAL 52 HB VAL 52 5.734 -27.651 5.454 463 1HG1 VAL 52 3HG1 VAL 52 4.385 -25.301 6.788 464 2HG1 VAL 52 2HG1 VAL 52 3.560 -26.728 6.156 465 3HG1 VAL 52 1HG1 VAL 52 4.682 -26.882 7.510 466 1HG2 VAL 52 2HG2 VAL 52 5.214 -24.859 4.401 467 2HG2 VAL 52 1HG2 VAL 52 6.099 -26.134 3.561 468 3HG2 VAL 52 3HG2 VAL 52 4.374 -26.321 3.881 469 H HIS 53 HN HIS 53 9.274 -25.042 6.080 470 HA HIS 53 HA HIS 53 10.056 -26.546 3.751 471 1HB HIS 53 HB2 HIS 53 10.663 -24.156 3.853 472 2HB HIS 53 HB1 HIS 53 11.591 -24.446 5.315 473 HD1 HIS 53 HD1 HIS 53 13.972 -24.097 4.622 474 HD2 HIS 53 HD2 HIS 53 11.842 -26.343 1.854 475 HE1 HIS 53 HE1 HIS 53 15.646 -24.834 2.886 476 H LYS 54 HN LYS 54 9.717 -28.459 5.001 477 HA LYS 54 HA LYS 54 11.857 -30.073 5.127 478 1HB LYS 54 HB2 LYS 54 12.372 -30.517 7.445 479 2HB LYS 54 HB1 LYS 54 12.545 -28.782 7.253 480 1HG LYS 54 HG2 LYS 54 10.304 -28.483 8.269 481 2HG LYS 54 HG1 LYS 54 10.206 -30.226 8.503 482 1HD LYS 54 HD2 LYS 54 12.282 -28.394 9.724 483 2HD LYS 54 HD1 LYS 54 10.892 -29.068 10.564 484 1HE LYS 54 HE2 LYS 54 13.176 -30.672 9.366 485 2HE LYS 54 HE1 LYS 54 12.987 -30.277 11.065 486 1HZ LYS 54 HZ1 LYS 54 11.107 -31.980 9.483 487 2HZ LYS 54 HZ3 LYS 54 12.256 -32.503 10.575 488 3HZ LYS 54 HZ2 LYS 54 10.952 -31.618 11.123 489 H LEU 55 HN LEU 55 11.107 -32.224 5.914 490 HA LEU 55 HA LEU 55 8.192 -32.251 6.130 491 1HB LEU 55 HB2 LEU 55 10.125 -34.487 5.510 492 2HB LEU 55 HB1 LEU 55 8.381 -34.643 5.574 493 HG LEU 55 HG LEU 55 9.952 -33.037 3.563 494 1HD1 LEU 55 HD1 LEU 55 10.124 -35.439 3.282 495 2HD1 LEU 55 HD1 LEU 55 8.365 -35.575 3.275 496 3HD1 LEU 55 HD1 LEU 55 9.194 -34.696 1.984 497 1HD2 LEU 55 HD2 LEU 55 6.979 -33.515 3.790 498 2HD2 LEU 55 HD2 LEU 55 7.803 -31.977 4.045 499 3HD2 LEU 55 HD2 LEU 55 7.789 -32.716 2.443 500 H GLU 56 HN GLU 56 7.357 -33.889 7.702 501 HA GLU 56 HA GLU 56 9.265 -34.235 9.847 502 1HB GLU 56 HB2 GLU 56 7.529 -32.323 10.166 503 2HB GLU 56 HB1 GLU 56 6.398 -33.635 10.488 504 1HG GLU 56 HG2 GLU 56 7.373 -32.769 12.550 505 2HG GLU 56 HG1 GLU 56 7.832 -34.453 12.274 506 H HIS 57 HN HIS 57 9.564 -36.234 9.106 507 HA HIS 57 HA HIS 57 7.364 -38.097 9.574 508 1HB HIS 57 HB2 HIS 57 8.167 -39.511 7.694 509 2HB HIS 57 HB1 HIS 57 7.516 -37.958 7.180 510 HD1 HIS 57 HD1 HIS 57 9.929 -40.144 6.067 511 HD2 HIS 57 HD2 HIS 57 10.118 -36.128 7.110 512 HE1 HIS 57 HE1 HIS 57 11.929 -39.199 4.871 513 H HIS 58 HN HIS 58 10.751 -37.451 9.930 514 HA HIS 58 HA HIS 58 11.281 -40.129 10.783 515 1HB HIS 58 HB2 HIS 58 13.024 -37.670 10.686 516 2HB HIS 58 HB1 HIS 58 13.562 -39.168 11.421 517 HD1 HIS 58 HD1 HIS 58 14.234 -37.501 8.467 518 HD2 HIS 58 HD2 HIS 58 12.850 -41.346 9.271 519 HE1 HIS 58 HE1 HIS 58 14.820 -38.885 6.471 520 H HIS 59 HN HIS 59 10.511 -37.106 12.281 521 HA HIS 59 HA HIS 59 11.353 -37.969 14.889 522 1HB HIS 59 HB2 HIS 59 9.826 -35.526 13.999 523 2HB HIS 59 HB1 HIS 59 10.154 -35.879 15.687 524 HD1 HIS 59 HD1 HIS 59 11.521 -34.145 12.861 525 HD2 HIS 59 HD2 HIS 59 13.041 -36.071 16.187 526 HE1 HIS 59 HE1 HIS 59 13.900 -33.294 13.139 527 H HIS 60 HN HIS 60 10.269 -39.781 15.465 528 HA HIS 60 HA HIS 60 7.372 -39.524 15.768 529 1HB HIS 60 HB2 HIS 60 9.127 -41.970 15.558 530 2HB HIS 60 HB1 HIS 60 7.507 -42.062 16.226 531 HD1 HIS 60 HD1 HIS 60 5.525 -41.729 14.553 532 HD2 HIS 60 HD2 HIS 60 9.297 -41.737 12.813 533 HE1 HIS 60 HE1 HIS 60 5.149 -42.008 12.074 534 H HIS 61 HN HIS 61 6.659 -39.093 17.668 535 HA HIS 61 HA HIS 61 8.404 -39.025 19.954 536 1HB HIS 61 HB2 HIS 61 5.450 -38.442 19.684 537 2HB HIS 61 HB1 HIS 61 6.356 -38.255 21.175 538 HD1 HIS 61 HD1 HIS 61 7.244 -35.940 21.564 539 HD2 HIS 61 HD2 HIS 61 6.529 -36.711 17.546 540 HE1 HIS 61 HE1 HIS 61 7.617 -33.771 20.368 541 H HIS 62 HN HIS 62 8.144 -40.193 21.869 542 HA HIS 62 HA HIS 62 6.817 -42.759 21.485 543 1HB HIS 62 HB2 HIS 62 8.895 -41.892 23.520 544 2HB HIS 62 HB1 HIS 62 8.161 -43.489 23.458 545 HD1 HIS 62 HD1 HIS 62 9.311 -45.176 21.964 546 HD2 HIS 62 HD2 HIS 62 10.540 -41.285 21.231 547 HE1 HIS 62 HE1 HIS 62 11.258 -45.354 20.379 548 H1 MET 101 HT1 MET 101 9.324 21.622 2.378 549 H2 MET 101 HT3 MET 101 10.959 21.858 2.746 550 H3 MET 101 HT2 MET 101 10.225 22.767 1.536 551 HA MET 101 HA MET 101 11.581 21.209 0.540 552 1HB MET 101 HB2 MET 101 11.092 18.757 0.738 553 2HB MET 101 HB1 MET 101 11.743 19.460 2.199 554 1HG MET 101 HG2 MET 101 10.075 17.912 2.841 555 2HG MET 101 HG1 MET 101 9.404 19.515 3.104 556 1HE MET 101 HE1 MET 101 7.036 18.347 3.393 557 2HE MET 101 HE3 MET 101 6.289 17.310 2.179 558 3HE MET 101 HE2 MET 101 7.720 16.760 3.049 559 H GLU 102 HN GLU 102 11.047 20.190 -1.426 560 HA GLU 102 HA GLU 102 8.633 21.265 -2.466 561 1HB GLU 102 HB2 GLU 102 10.937 19.749 -3.680 562 2HB GLU 102 HB1 GLU 102 9.487 20.092 -4.607 563 1HG GLU 102 HG2 GLU 102 11.268 21.717 -5.054 564 2HG GLU 102 HG1 GLU 102 9.840 22.475 -4.377 565 H MET 103 HN MET 103 6.828 20.314 -2.084 566 HA MET 103 HA MET 103 6.611 17.687 -1.096 567 1HB MET 103 HB2 MET 103 4.399 19.502 -2.050 568 2HB MET 103 HB1 MET 103 4.140 17.965 -1.248 569 1HG MET 103 HG2 MET 103 5.383 18.841 0.716 570 2HG MET 103 HG1 MET 103 5.488 20.396 -0.103 571 1HE MET 103 HE2 MET 103 3.159 17.782 1.669 572 2HE MET 103 HE1 MET 103 1.558 18.470 1.406 573 3HE MET 103 HE3 MET 103 2.462 17.805 0.048 574 H GLY 104 HN GLY 104 6.147 18.931 -4.346 575 1HA GLY 104 HA1 GLY 104 5.786 17.827 -6.327 576 2HA GLY 104 HA2 GLY 104 4.879 16.632 -5.396 577 H GLN 105 HN GLN 105 8.226 17.580 -5.041 578 HA GLN 105 HA GLN 105 9.300 15.316 -6.375 579 1HB GLN 105 HB2 GLN 105 10.595 17.226 -4.420 580 2HB GLN 105 HB1 GLN 105 11.462 16.002 -5.338 581 1HG GLN 105 HG2 GLN 105 9.941 18.330 -6.484 582 2HG GLN 105 HG1 GLN 105 11.694 18.183 -6.368 583 1HE2 GLN 105 1HE2 GLN 105 12.759 16.764 -7.726 584 2HE2 GLN 105 2HE2 GLN 105 12.016 16.118 -9.150 585 H LEU 106 HN LEU 106 8.724 16.154 -3.011 586 HA LEU 106 HA LEU 106 9.698 13.866 -1.765 587 1HB LEU 106 HB2 LEU 106 9.062 15.872 -0.525 588 2HB LEU 106 HB1 LEU 106 7.415 15.725 -1.066 589 HG LEU 106 HG LEU 106 7.878 15.210 1.376 590 1HD1 LEU 106 HD1 LEU 106 5.788 14.585 0.356 591 2HD1 LEU 106 HD1 LEU 106 6.487 13.081 -0.216 592 3HD1 LEU 106 HD1 LEU 106 6.312 13.361 1.518 593 1HD2 LEU 106 HD2 LEU 106 9.045 12.681 0.219 594 2HD2 LEU 106 HD2 LEU 106 9.922 13.922 1.119 595 3HD2 LEU 106 HD2 LEU 106 8.677 12.959 1.919 596 H LYS 107 HN LYS 107 6.519 14.524 -3.119 597 HA LYS 107 HA LYS 107 5.262 12.108 -2.466 598 1HB LYS 107 HB2 LYS 107 4.545 14.456 -3.651 599 2HB LYS 107 HB1 LYS 107 4.550 13.347 -5.020 600 1HG LYS 107 HG2 LYS 107 3.042 12.834 -2.467 601 2HG LYS 107 HG1 LYS 107 2.335 13.694 -3.812 602 1HD LYS 107 HD2 LYS 107 3.414 10.861 -3.919 603 2HD LYS 107 HD1 LYS 107 1.714 11.275 -3.718 604 1HE LYS 107 HE2 LYS 107 1.832 12.484 -5.906 605 2HE LYS 107 HE1 LYS 107 3.476 11.877 -6.088 606 1HZ LYS 107 HZ2 LYS 107 2.528 9.602 -5.932 607 2HZ LYS 107 HZ1 LYS 107 0.996 10.267 -5.939 608 3HZ LYS 107 HZ3 LYS 107 1.990 10.464 -7.283 609 H ASN 108 HN ASN 108 7.272 13.078 -5.173 610 HA ASN 108 HA ASN 108 6.907 10.619 -6.571 611 1HB ASN 108 HB2 ASN 108 8.750 12.948 -7.030 612 2HB ASN 108 HB1 ASN 108 8.869 11.460 -7.962 613 1HD2 ASN 108 HD2 ASN 108 8.165 14.167 -8.807 614 2HD2 ASN 108 HD2 ASN 108 6.623 14.039 -9.555 615 H LYS 109 HN LYS 109 9.024 11.652 -4.089 616 HA LYS 109 HA LYS 109 10.938 9.532 -4.438 617 1HB LYS 109 HB2 LYS 109 10.263 11.138 -1.949 618 2HB LYS 109 HB1 LYS 109 11.638 10.062 -2.107 619 1HG LYS 109 HG2 LYS 109 11.178 12.553 -3.737 620 2HG LYS 109 HG1 LYS 109 12.242 12.437 -2.336 621 1HD LYS 109 HD2 LYS 109 13.626 10.798 -3.508 622 2HD LYS 109 HD1 LYS 109 12.540 10.853 -4.899 623 1HE LYS 109 HE2 LYS 109 14.531 12.222 -5.274 624 2HE LYS 109 HE1 LYS 109 13.072 13.206 -5.237 625 1HZ LYS 109 HZ3 LYS 109 13.607 13.818 -2.947 626 2HZ LYS 109 HZ2 LYS 109 14.996 12.894 -2.985 627 3HZ LYS 109 HZ1 LYS 109 14.855 14.239 -3.986 628 H ILE 110 HN ILE 110 7.995 10.060 -2.669 629 HA ILE 110 HA ILE 110 7.774 7.600 -1.320 630 HB ILE 110 HB ILE 110 5.686 9.525 -2.394 631 1HG1 ILE 110 2HG1 ILE 110 6.553 8.913 0.394 632 2HG1 ILE 110 1HG1 ILE 110 7.237 10.246 -0.556 633 1HG2 ILE 110 2HG2 ILE 110 4.662 7.306 -2.272 634 2HG2 ILE 110 1HG2 ILE 110 5.214 7.133 -0.607 635 3HG2 ILE 110 3HG2 ILE 110 4.016 8.364 -1.013 636 1HD1 ILE 110 HD1 ILE 110 4.953 11.209 -0.590 637 2HD1 ILE 110 HD1 ILE 110 4.431 9.881 0.447 638 3HD1 ILE 110 HD1 ILE 110 5.633 11.039 1.025 639 H GLU 111 HN GLU 111 6.579 8.625 -4.488 640 HA GLU 111 HA GLU 111 5.575 6.212 -5.399 641 1HB GLU 111 HB2 GLU 111 7.108 8.271 -6.998 642 2HB GLU 111 HB1 GLU 111 6.115 6.988 -7.674 643 1HG GLU 111 HG2 GLU 111 5.147 9.265 -5.966 644 2HG GLU 111 HG1 GLU 111 4.950 9.121 -7.711 645 H ASN 112 HN ASN 112 8.838 7.474 -5.703 646 HA ASN 112 HA ASN 112 10.041 5.399 -7.070 647 1HB ASN 112 HB2 ASN 112 11.083 7.592 -6.715 648 2HB ASN 112 HB1 ASN 112 11.290 7.218 -5.009 649 1HD2 ASN 112 HD2 ASN 112 12.982 5.798 -4.385 650 2HD2 ASN 112 HD2 ASN 112 14.186 5.314 -5.509 651 H LYS 113 HN LYS 113 9.988 5.888 -3.503 652 HA LYS 113 HA LYS 113 11.489 3.585 -2.949 653 1HB LYS 113 HB2 LYS 113 11.102 5.602 -1.470 654 2HB LYS 113 HB1 LYS 113 9.516 4.940 -1.136 655 1HG LYS 113 HG2 LYS 113 11.073 4.381 0.646 656 2HG LYS 113 HG1 LYS 113 10.514 2.936 -0.197 657 1HD LYS 113 HD2 LYS 113 12.906 2.866 0.273 658 2HD LYS 113 HD1 LYS 113 12.588 2.839 -1.453 659 1HE LYS 113 HE2 LYS 113 13.080 5.215 -1.574 660 2HE LYS 113 HE1 LYS 113 13.428 5.248 0.168 661 1HZ LYS 113 HZ2 LYS 113 15.173 3.634 -0.255 662 2HZ LYS 113 HZ1 LYS 113 14.798 3.701 -1.925 663 3HZ LYS 113 HZ3 LYS 113 15.436 5.065 -1.140 664 H LYS 114 HN LYS 114 8.040 4.215 -3.033 665 HA LYS 114 HA LYS 114 7.040 1.775 -2.155 666 1HB LYS 114 HB2 LYS 114 5.660 3.644 -2.367 667 2HB LYS 114 HB1 LYS 114 6.046 3.873 -4.073 668 1HG LYS 114 HG2 LYS 114 4.819 1.671 -4.468 669 2HG LYS 114 HG1 LYS 114 4.286 1.782 -2.790 670 1HD LYS 114 HD2 LYS 114 2.533 2.747 -4.107 671 2HD LYS 114 HD1 LYS 114 3.412 4.077 -3.341 672 1HE LYS 114 HE2 LYS 114 4.727 4.299 -5.486 673 2HE LYS 114 HE1 LYS 114 3.590 3.135 -6.158 674 1HZ LYS 114 HZ3 LYS 114 2.822 5.771 -5.021 675 2HZ LYS 114 HZ2 LYS 114 3.007 5.489 -6.613 676 3HZ LYS 114 HZ1 LYS 114 1.756 4.732 -5.794 677 H LYS 115 HN LYS 115 7.942 2.871 -5.361 678 HA LYS 115 HA LYS 115 7.309 0.491 -6.749 679 1HB LYS 115 HB2 LYS 115 9.186 2.736 -7.480 680 2HB LYS 115 HB1 LYS 115 8.766 1.417 -8.561 681 1HG LYS 115 HG2 LYS 115 6.466 2.088 -8.592 682 2HG LYS 115 HG1 LYS 115 6.753 3.282 -7.331 683 1HD LYS 115 HD2 LYS 115 6.597 4.396 -9.447 684 2HD LYS 115 HD1 LYS 115 8.256 4.494 -8.873 685 1HE LYS 115 HE2 LYS 115 8.920 2.722 -10.378 686 2HE LYS 115 HE1 LYS 115 7.248 2.498 -10.898 687 1HZ LYS 115 HZ1 LYS 115 8.885 4.942 -11.323 688 2HZ LYS 115 HZ3 LYS 115 8.502 3.790 -12.481 689 3HZ LYS 115 HZ2 LYS 115 7.287 4.736 -11.822 690 H GLU 116 HN GLU 116 10.302 1.606 -5.232 691 HA GLU 116 HA GLU 116 11.931 -0.527 -6.086 692 1HB GLU 116 HB2 GLU 116 12.080 1.054 -3.490 693 2HB GLU 116 HB1 GLU 116 13.312 -0.075 -4.026 694 1HG GLU 116 HG2 GLU 116 13.615 1.363 -6.042 695 2HG GLU 116 HG1 GLU 116 12.501 2.518 -5.310 696 H LEU 117 HN LEU 117 9.664 -0.218 -3.459 697 HA LEU 117 HA LEU 117 10.195 -2.719 -2.233 698 1HB LEU 117 HB2 LEU 117 9.084 -1.102 -0.951 699 2HB LEU 117 HB1 LEU 117 7.827 -0.875 -2.168 700 HG LEU 117 HG LEU 117 7.387 -3.407 -1.701 701 1HD1 LEU 117 HD1 LEU 117 8.836 -2.724 0.731 702 2HD1 LEU 117 HD1 LEU 117 7.695 -4.075 0.533 703 3HD1 LEU 117 HD1 LEU 117 9.144 -3.975 -0.471 704 1HD2 LEU 117 HD2 LEU 117 5.868 -1.620 -1.372 705 2HD2 LEU 117 HD2 LEU 117 5.766 -2.906 -0.147 706 3HD2 LEU 117 HD2 LEU 117 6.511 -1.334 0.263 707 H ILE 118 HN ILE 118 7.746 -1.568 -4.512 708 HA ILE 118 HA ILE 118 6.264 -3.883 -4.791 709 HB ILE 118 HB ILE 118 6.875 -1.837 -6.957 710 1HG1 ILE 118 2HG1 ILE 118 4.450 -2.070 -5.180 711 2HG1 ILE 118 1HG1 ILE 118 5.806 -0.998 -4.844 712 1HG2 ILE 118 1HG2 ILE 118 4.663 -3.896 -6.816 713 2HG2 ILE 118 3HG2 ILE 118 4.801 -2.630 -8.033 714 3HG2 ILE 118 2HG2 ILE 118 6.017 -3.906 -7.942 715 1HD1 ILE 118 HD1 ILE 118 4.073 -0.881 -7.302 716 2HD1 ILE 118 HD1 ILE 118 3.927 0.165 -5.877 717 3HD1 ILE 118 HD1 ILE 118 5.380 0.219 -6.867 718 H GLN 119 HN GLN 119 9.146 -2.885 -6.538 719 HA GLN 119 HA GLN 119 9.407 -5.069 -8.239 720 1HB GLN 119 HB2 GLN 119 11.512 -3.315 -6.986 721 2HB GLN 119 HB1 GLN 119 11.841 -4.477 -8.264 722 1HG GLN 119 HG2 GLN 119 10.343 -3.280 -9.761 723 2HG GLN 119 HG1 GLN 119 9.963 -2.138 -8.473 724 1HE2 GLN 119 1HE2 GLN 119 12.384 -3.258 -10.652 725 2HE2 GLN 119 2HE2 GLN 119 13.428 -1.896 -10.559 726 H LEU 120 HN LEU 120 10.241 -4.727 -4.860 727 HA LEU 120 HA LEU 120 11.720 -7.198 -4.726 728 1HB LEU 120 HB2 LEU 120 10.711 -5.391 -2.531 729 2HB LEU 120 HB1 LEU 120 11.746 -6.786 -2.281 730 HG LEU 120 HG LEU 120 12.486 -4.292 -3.819 731 1HD1 LEU 120 HD1 LEU 120 13.360 -5.273 -1.117 732 2HD1 LEU 120 HD1 LEU 120 14.009 -3.868 -1.963 733 3HD1 LEU 120 HD1 LEU 120 12.323 -3.886 -1.442 734 1HD2 LEU 120 HD2 LEU 120 14.100 -6.751 -3.129 735 2HD2 LEU 120 HD2 LEU 120 13.628 -6.187 -4.740 736 3HD2 LEU 120 HD2 LEU 120 14.764 -5.250 -3.787 737 H VAL 121 HN VAL 121 8.481 -6.106 -3.572 738 HA VAL 121 HA VAL 121 7.656 -8.600 -2.619 739 HB VAL 121 HB VAL 121 5.883 -6.549 -3.992 740 1HG1 VAL 121 3HG1 VAL 121 4.747 -8.641 -3.460 741 2HG1 VAL 121 2HG1 VAL 121 5.306 -8.505 -1.788 742 3HG1 VAL 121 1HG1 VAL 121 4.178 -7.314 -2.436 743 1HG2 VAL 121 3HG2 VAL 121 7.285 -5.436 -2.377 744 2HG2 VAL 121 2HG2 VAL 121 5.609 -5.486 -1.820 745 3HG2 VAL 121 1HG2 VAL 121 6.808 -6.590 -1.128 746 H ALA 122 HN ALA 122 7.672 -7.236 -5.857 747 HA ALA 122 HA ALA 122 6.232 -9.159 -7.233 748 1HB ALA 122 HB1 ALA 122 8.559 -7.530 -8.228 749 2HB ALA 122 HB3 ALA 122 7.329 -8.313 -9.235 750 3HB ALA 122 HB2 ALA 122 6.879 -6.999 -8.149 751 H ARG 123 HN ARG 123 9.753 -8.955 -6.698 752 HA ARG 123 HA ARG 123 10.243 -11.453 -8.011 753 1HB ARG 123 HB2 ARG 123 12.597 -11.158 -7.282 754 2HB ARG 123 HB1 ARG 123 11.961 -9.765 -8.139 755 1HG ARG 123 HG2 ARG 123 11.572 -8.660 -6.001 756 2HG ARG 123 HG1 ARG 123 12.291 -10.042 -5.171 757 1HD ARG 123 HD2 ARG 123 13.711 -8.394 -7.252 758 2HD ARG 123 HD1 ARG 123 13.829 -8.087 -5.521 759 HE ARG 123 HE ARG 123 14.503 -10.703 -5.806 760 1HH1 ARG 123 1HH1 ARG 123 15.689 -7.709 -7.324 761 2HH1 ARG 123 2HH1 ARG 123 17.319 -8.212 -7.331 762 1HH2 ARG 123 1HH2 ARG 123 16.763 -11.364 -5.805 763 2HH2 ARG 123 2HH2 ARG 123 17.938 -10.332 -6.486 764 H HIS 124 HN HIS 124 8.906 -10.895 -5.133 765 HA HIS 124 HA HIS 124 10.081 -12.993 -3.600 766 1HB HIS 124 HB2 HIS 124 8.846 -11.323 -2.408 767 2HB HIS 124 HB1 HIS 124 7.398 -11.557 -3.355 768 HD1 HIS 124 HD1 HIS 124 5.897 -13.683 -2.649 769 HD2 HIS 124 HD2 HIS 124 9.325 -13.130 -0.382 770 HE1 HIS 124 HE1 HIS 124 5.709 -15.246 -0.710 771 H GLY 125 HN GLY 125 7.729 -12.830 -6.126 772 1HA GLY 125 HA1 GLY 125 6.731 -15.521 -5.537 773 2HA GLY 125 HA2 GLY 125 7.607 -15.289 -7.047 774 H LEU 126 HN LEU 126 6.023 -12.444 -6.401 775 HA LEU 126 HA LEU 126 3.509 -13.011 -7.380 776 1HB LEU 126 HB2 LEU 126 5.162 -10.650 -6.858 777 2HB LEU 126 HB1 LEU 126 3.728 -10.453 -7.857 778 HG LEU 126 HG LEU 126 2.477 -11.494 -6.007 779 1HD1 LEU 126 HD1 LEU 126 4.174 -12.579 -4.846 780 2HD1 LEU 126 HD1 LEU 126 4.944 -11.047 -4.392 781 3HD1 LEU 126 HD1 LEU 126 3.322 -11.454 -3.783 782 1HD2 LEU 126 HD2 LEU 126 3.829 -8.858 -5.527 783 2HD2 LEU 126 HD2 LEU 126 2.362 -9.160 -6.453 784 3HD2 LEU 126 HD2 LEU 126 2.357 -9.388 -4.704 785 H ASP 127 HN ASP 127 2.777 -13.004 -9.257 786 HA ASP 127 HA ASP 127 4.468 -12.868 -11.625 787 1HB ASP 127 HB2 ASP 127 1.468 -13.203 -11.312 788 2HB ASP 127 HB1 ASP 127 2.270 -13.160 -12.872 789 H HIS 128 HN HIS 128 3.707 -11.314 -13.457 790 HA HIS 128 HA HIS 128 3.814 -8.751 -12.304 791 1HB HIS 128 HB2 HIS 128 3.424 -9.574 -15.179 792 2HB HIS 128 HB1 HIS 128 3.443 -7.892 -14.669 793 HD1 HIS 128 HD1 HIS 128 5.741 -6.864 -14.043 794 HD2 HIS 128 HD2 HIS 128 5.886 -10.906 -14.999 795 HE1 HIS 128 HE1 HIS 128 8.173 -7.429 -14.323 796 H ASP 129 HN ASP 129 1.166 -10.679 -13.284 797 HA ASP 129 HA ASP 129 -0.837 -8.687 -13.387 798 1HB ASP 129 HB2 ASP 129 -1.164 -11.527 -12.372 799 2HB ASP 129 HB1 ASP 129 -2.432 -10.488 -13.010 800 H LYS 130 HN LYS 130 0.466 -10.680 -10.848 801 HA LYS 130 HA LYS 130 -1.036 -9.782 -8.656 802 1HB LYS 130 HB2 LYS 130 1.739 -10.914 -8.913 803 2HB LYS 130 HB1 LYS 130 1.025 -10.516 -7.361 804 1HG LYS 130 HG2 LYS 130 -0.518 -12.281 -9.161 805 2HG LYS 130 HG1 LYS 130 0.928 -12.939 -8.390 806 1HD LYS 130 HD2 LYS 130 0.111 -12.405 -6.233 807 2HD LYS 130 HD1 LYS 130 -1.268 -11.529 -6.871 808 1HE LYS 130 HE2 LYS 130 -1.946 -13.730 -6.092 809 2HE LYS 130 HE1 LYS 130 -2.085 -13.668 -7.845 810 1HZ LYS 130 HZ1 LYS 130 0.184 -14.887 -6.360 811 2HZ LYS 130 HZ3 LYS 130 -1.089 -15.730 -7.065 812 3HZ LYS 130 HZ2 LYS 130 -0.003 -14.881 -8.028 813 H VAL 131 HN VAL 131 1.953 -8.646 -10.150 814 HA VAL 131 HA VAL 131 2.647 -6.698 -8.260 815 HB VAL 131 HB VAL 131 3.269 -6.754 -11.236 816 1HG1 VAL 131 2HG1 VAL 131 4.657 -5.297 -9.006 817 2HG1 VAL 131 1HG1 VAL 131 5.198 -5.385 -10.686 818 3HG1 VAL 131 3HG1 VAL 131 3.685 -4.569 -10.284 819 1HG2 VAL 131 3HG2 VAL 131 3.953 -8.778 -10.128 820 2HG2 VAL 131 2HG2 VAL 131 5.357 -7.807 -10.583 821 3HG2 VAL 131 1HG2 VAL 131 4.811 -7.844 -8.903 822 H LEU 132 HN LEU 132 0.750 -6.531 -11.226 823 HA LEU 132 HA LEU 132 0.117 -3.761 -11.172 824 1HB LEU 132 HB2 LEU 132 -1.519 -6.041 -12.257 825 2HB LEU 132 HB1 LEU 132 -1.697 -4.346 -12.663 826 HG LEU 132 HG LEU 132 0.661 -6.098 -13.325 827 1HD1 LEU 132 HD1 LEU 132 -1.471 -4.904 -15.049 828 2HD1 LEU 132 HD1 LEU 132 -0.047 -5.784 -15.624 829 3HD1 LEU 132 HD1 LEU 132 -1.253 -6.609 -14.634 830 1HD2 LEU 132 HD2 LEU 132 0.166 -3.189 -13.968 831 2HD2 LEU 132 HD2 LEU 132 1.410 -3.846 -12.896 832 3HD2 LEU 132 HD2 LEU 132 1.466 -4.180 -14.629 833 H LEU 133 HN LEU 133 -1.675 -6.533 -9.965 834 HA LEU 133 HA LEU 133 -3.800 -5.059 -8.859 835 1HB LEU 133 HB2 LEU 133 -2.678 -7.704 -7.972 836 2HB LEU 133 HB1 LEU 133 -4.238 -7.028 -7.521 837 HG LEU 133 HG LEU 133 -3.459 -7.714 -10.362 838 1HD1 LEU 133 HD1 LEU 133 -5.059 -9.347 -8.401 839 2HD1 LEU 133 HD1 LEU 133 -4.865 -9.691 -10.121 840 3HD1 LEU 133 HD1 LEU 133 -3.467 -9.743 -9.060 841 1HD2 LEU 133 HD2 LEU 133 -6.131 -7.094 -9.098 842 2HD2 LEU 133 HD2 LEU 133 -5.220 -6.048 -10.194 843 3HD2 LEU 133 HD2 LEU 133 -5.868 -7.576 -10.775 844 H PHE 134 HN PHE 134 -0.750 -6.122 -7.475 845 HA PHE 134 HA PHE 134 -1.257 -5.205 -4.876 846 1HB PHE 134 HB2 PHE 134 0.454 -6.849 -5.252 847 2HB PHE 134 HB1 PHE 134 1.337 -5.771 -6.323 848 HD1 PHE 134 HD1 PHE 134 0.121 -6.042 -2.816 849 HD2 PHE 134 HD2 PHE 134 3.085 -4.528 -5.466 850 HE1 PHE 134 HE1 PHE 134 1.430 -5.248 -0.898 851 HE2 PHE 134 HE2 PHE 134 4.401 -3.736 -3.552 852 HZ PHE 134 HZ PHE 134 3.583 -4.082 -1.275 853 H SER 135 HN SER 135 0.582 -3.722 -7.554 854 HA SER 135 HA SER 135 1.331 -1.450 -6.132 855 1HB SER 135 HB2 SER 135 1.745 -0.436 -8.408 856 2HB SER 135 HB1 SER 135 2.517 -2.000 -8.129 857 HG SER 135 HG SER 135 1.060 -2.972 -9.378 858 H ARG 136 HN ARG 136 -1.575 -2.047 -8.039 859 HA ARG 136 HA ARG 136 -2.437 0.645 -7.857 860 1HB ARG 136 HB2 ARG 136 -4.623 -0.164 -8.706 861 2HB ARG 136 HB1 ARG 136 -3.262 -0.694 -9.677 862 1HG ARG 136 HG2 ARG 136 -3.364 -2.886 -8.569 863 2HG ARG 136 HG1 ARG 136 -4.787 -2.344 -7.680 864 1HD ARG 136 HD2 ARG 136 -4.537 -2.477 -10.669 865 2HD ARG 136 HD1 ARG 136 -5.309 -3.702 -9.676 866 HE ARG 136 HE ARG 136 -6.454 -1.262 -9.021 867 1HH1 ARG 136 1HH1 ARG 136 -6.412 -3.460 -11.818 868 2HH1 ARG 136 2HH1 ARG 136 -7.947 -2.993 -12.376 869 1HH2 ARG 136 1HH2 ARG 136 -8.544 -0.625 -9.794 870 2HH2 ARG 136 2HH2 ARG 136 -9.205 -1.315 -11.202 871 H ASP 137 HN ASP 137 -3.170 -2.234 -5.861 872 HA ASP 137 HA ASP 137 -5.076 -0.793 -4.272 873 1HB ASP 137 HB2 ASP 137 -4.894 -3.365 -4.459 874 2HB ASP 137 HB1 ASP 137 -3.545 -3.227 -3.348 875 H LEU 138 HN LEU 138 -1.689 -1.510 -4.053 876 HA LEU 138 HA LEU 138 -1.100 -0.444 -1.536 877 1HB LEU 138 HB2 LEU 138 0.497 -1.818 -2.620 878 2HB LEU 138 HB1 LEU 138 0.522 -0.801 -4.039 879 HG LEU 138 HG LEU 138 1.717 0.935 -2.795 880 1HD1 LEU 138 HD1 LEU 138 1.673 -1.025 -0.524 881 2HD1 LEU 138 HD1 LEU 138 2.600 0.476 -0.592 882 3HD1 LEU 138 HD1 LEU 138 0.836 0.537 -0.589 883 1HD2 LEU 138 HD2 LEU 138 2.953 -1.796 -2.590 884 2HD2 LEU 138 HD2 LEU 138 2.988 -0.728 -3.990 885 3HD2 LEU 138 HD2 LEU 138 3.825 -0.267 -2.508 886 H ASP 139 HN ASP 139 -1.074 1.069 -4.747 887 HA ASP 139 HA ASP 139 -0.130 3.569 -3.913 888 1HB ASP 139 HB2 ASP 139 -0.235 2.849 -6.283 889 2HB ASP 139 HB1 ASP 139 -1.990 2.992 -6.226 890 H LYS 140 HN LYS 140 -3.375 2.255 -4.115 891 HA LYS 140 HA LYS 140 -4.615 4.675 -3.306 892 1HB LYS 140 HB2 LYS 140 -5.686 1.863 -3.239 893 2HB LYS 140 HB1 LYS 140 -6.617 3.322 -2.928 894 1HG LYS 140 HG2 LYS 140 -6.084 4.088 -5.241 895 2HG LYS 140 HG1 LYS 140 -5.274 2.545 -5.522 896 1HD LYS 140 HD2 LYS 140 -7.478 2.413 -6.446 897 2HD LYS 140 HD1 LYS 140 -7.433 1.402 -4.999 898 1HE LYS 140 HE2 LYS 140 -9.494 2.675 -5.073 899 2HE LYS 140 HE1 LYS 140 -8.499 3.225 -3.729 900 1HZ LYS 140 HZ3 LYS 140 -7.766 5.103 -5.216 901 2HZ LYS 140 HZ2 LYS 140 -8.871 4.551 -6.353 902 3HZ LYS 140 HZ1 LYS 140 -9.422 5.115 -4.890 903 H LEU 141 HN LEU 141 -3.318 1.910 -1.580 904 HA LEU 141 HA LEU 141 -4.417 2.442 0.973 905 1HB LEU 141 HB2 LEU 141 -3.109 0.350 0.227 906 2HB LEU 141 HB1 LEU 141 -1.665 1.305 0.413 907 HG LEU 141 HG LEU 141 -3.535 0.629 2.712 908 1HD1 LEU 141 HD1 LEU 141 -2.553 -1.373 1.842 909 2HD1 LEU 141 HD1 LEU 141 -0.951 -0.611 1.975 910 3HD1 LEU 141 HD1 LEU 141 -1.922 -0.907 3.427 911 1HD2 LEU 141 HD2 LEU 141 -2.204 2.617 3.123 912 2HD2 LEU 141 HD2 LEU 141 -1.738 1.265 4.148 913 3HD2 LEU 141 HD2 LEU 141 -0.744 1.690 2.759 914 H ILE 142 HN ILE 142 -1.555 3.477 -0.666 915 HA ILE 142 HA ILE 142 -0.570 5.012 1.484 916 HB ILE 142 HB ILE 142 0.142 5.108 -1.460 917 1HG1 ILE 142 2HG1 ILE 142 1.466 3.833 0.926 918 2HG1 ILE 142 1HG1 ILE 142 0.554 2.986 -0.314 919 1HG2 ILE 142 2HG2 ILE 142 1.543 6.353 0.916 920 2HG2 ILE 142 1HG2 ILE 142 2.183 6.285 -0.732 921 3HG2 ILE 142 3HG2 ILE 142 0.725 7.215 -0.388 922 1HD1 ILE 142 HD1 ILE 142 3.107 4.505 -0.723 923 2HD1 ILE 142 HD1 ILE 142 2.925 2.744 -0.629 924 3HD1 ILE 142 HD1 ILE 142 2.173 3.644 -1.947 925 H ASN 143 HN ASN 143 -2.244 5.997 -1.483 926 HA ASN 143 HA ASN 143 -2.508 8.717 -0.886 927 1HB ASN 143 HB2 ASN 143 -4.196 6.871 -2.520 928 2HB ASN 143 HB1 ASN 143 -4.738 8.514 -2.215 929 1HD2 ASN 143 HD2 ASN 143 -2.375 6.545 -3.819 930 2HD2 ASN 143 HD2 ASN 143 -1.735 7.773 -4.827 931 H LYS 144 HN LYS 144 -4.362 6.020 0.238 932 HA LYS 144 HA LYS 144 -6.550 7.205 1.461 933 1HB LYS 144 HB2 LYS 144 -6.168 4.774 1.219 934 2HB LYS 144 HB1 LYS 144 -4.872 4.857 2.386 935 1HG LYS 144 HG2 LYS 144 -6.661 5.648 4.051 936 2HG LYS 144 HG1 LYS 144 -7.834 5.090 2.855 937 1HD LYS 144 HD2 LYS 144 -5.682 3.408 4.184 938 2HD LYS 144 HD1 LYS 144 -7.404 3.331 4.521 939 1HE LYS 144 HE2 LYS 144 -7.828 2.523 2.266 940 2HE LYS 144 HE1 LYS 144 -6.124 2.673 1.858 941 1HZ LYS 144 HZ3 LYS 144 -5.712 0.925 3.699 942 2HZ LYS 144 HZ2 LYS 144 -7.362 0.769 3.783 943 3HZ LYS 144 HZ1 LYS 144 -6.595 0.371 2.376 944 H PHE 145 HN PHE 145 -3.255 6.846 2.544 945 HA PHE 145 HA PHE 145 -3.890 8.141 5.025 946 1HB PHE 145 HB2 PHE 145 -1.576 6.550 4.080 947 2HB PHE 145 HB1 PHE 145 -1.376 7.681 5.423 948 HD1 PHE 145 HD1 PHE 145 -3.101 4.635 4.305 949 HD2 PHE 145 HD2 PHE 145 -2.375 7.377 7.444 950 HE1 PHE 145 HE1 PHE 145 -4.138 3.065 5.880 951 HE2 PHE 145 HE2 PHE 145 -3.421 5.819 9.063 952 HZ PHE 145 HZ PHE 145 -4.300 3.658 8.270 953 H MET 146 HN MET 146 -2.255 8.777 2.086 954 HA MET 146 HA MET 146 -0.637 10.958 3.042 955 1HB MET 146 HB2 MET 146 -1.599 10.578 0.210 956 2HB MET 146 HB1 MET 146 -0.267 11.572 0.772 957 1HG MET 146 HG2 MET 146 0.823 9.451 1.573 958 2HG MET 146 HG1 MET 146 -0.450 8.602 0.712 959 1HE MET 146 HE2 MET 146 2.547 10.849 0.560 960 2HE MET 146 HE1 MET 146 2.761 11.233 -1.155 961 3HE MET 146 HE3 MET 146 1.419 11.935 -0.246 962 H ASN 147 HN ASN 147 -3.803 10.632 1.579 963 HA ASN 147 HA ASN 147 -5.544 11.906 1.306 964 1HB ASN 147 HB2 ASN 147 -4.212 13.280 3.555 965 2HB ASN 147 HB1 ASN 147 -5.696 13.982 2.881 966 1HD2 ASN 147 HD2 ASN 147 -4.270 11.391 4.742 967 2HD2 ASN 147 HD2 ASN 147 -5.762 10.720 5.269 968 H VAL 148 HN VAL 148 -2.834 12.643 0.048 969 HA VAL 148 HA VAL 148 -3.749 15.172 -1.021 970 HB VAL 148 HB VAL 148 -1.509 15.354 -2.174 971 1HG1 VAL 148 3HG1 VAL 148 -1.563 15.270 0.836 972 2HG1 VAL 148 2HG1 VAL 148 -0.337 16.101 -0.126 973 3HG1 VAL 148 1HG1 VAL 148 -2.024 16.625 -0.191 974 1HG2 VAL 148 3HG2 VAL 148 -0.896 13.009 -2.026 975 2HG2 VAL 148 2HG2 VAL 148 0.351 14.030 -1.281 976 3HG2 VAL 148 1HG2 VAL 148 -0.809 13.143 -0.274 977 H LYS 149 HN LYS 149 -5.139 14.775 -2.289 978 HA LYS 149 HA LYS 149 -4.718 12.903 -4.521 979 1HB LYS 149 HB2 LYS 149 -7.280 13.901 -3.249 980 2HB LYS 149 HB1 LYS 149 -7.179 12.789 -4.607 981 1HG LYS 149 HG2 LYS 149 -6.216 11.088 -3.252 982 2HG LYS 149 HG1 LYS 149 -5.971 12.204 -1.919 983 1HD LYS 149 HD2 LYS 149 -7.836 10.786 -1.381 984 2HD LYS 149 HD1 LYS 149 -8.446 12.403 -1.698 985 1HE LYS 149 HE2 LYS 149 -8.470 10.181 -3.744 986 2HE LYS 149 HE1 LYS 149 -9.803 10.477 -2.643 987 1HZ LYS 149 HZ1 LYS 149 -9.957 12.744 -3.638 988 2HZ LYS 149 HZ3 LYS 149 -8.807 12.282 -4.783 989 3HZ LYS 149 HZ2 LYS 149 -10.267 11.488 -4.696 990 H ASP 150 HN ASP 150 -3.580 15.375 -4.571 991 HA ASP 150 HA ASP 150 -5.294 17.410 -5.643 992 1HB ASP 150 HB2 ASP 150 -2.301 17.347 -5.309 993 2HB ASP 150 HB1 ASP 150 -3.201 18.737 -5.887 994 H LYS 151 HN LYS 151 -5.312 15.198 -7.176 995 HA LYS 151 HA LYS 151 -3.696 15.706 -9.521 996 1HB LYS 151 HB2 LYS 151 -4.828 13.793 -10.592 997 2HB LYS 151 HB1 LYS 151 -4.257 13.391 -8.977 998 1HG LYS 151 HG2 LYS 151 -6.475 13.629 -8.096 999 2HG LYS 151 HG1 LYS 151 -7.062 14.124 -9.683 1000 1HD LYS 151 HD2 LYS 151 -7.675 11.849 -9.379 1001 2HD LYS 151 HD1 LYS 151 -6.367 11.878 -10.549 1002 1HE LYS 151 HE2 LYS 151 -5.870 11.383 -7.623 1003 2HE LYS 151 HE1 LYS 151 -6.336 10.071 -8.698 1004 1HZ LYS 151 HZ2 LYS 151 -3.863 11.744 -9.080 1005 2HZ LYS 151 HZ1 LYS 151 -3.930 10.222 -8.364 1006 3HZ LYS 151 HZ3 LYS 151 -4.353 10.410 -9.962 1007 H VAL 152 HN VAL 152 -6.039 17.211 -8.264 1008 HA VAL 152 HA VAL 152 -7.704 17.933 -10.463 1009 HB VAL 152 HB VAL 152 -8.462 19.838 -9.008 1010 1HG1 VAL 152 1HG1 VAL 152 -8.387 17.160 -7.635 1011 2HG1 VAL 152 3HG1 VAL 152 -9.494 18.477 -7.253 1012 3HG1 VAL 152 2HG1 VAL 152 -9.575 17.688 -8.828 1013 1HG2 VAL 152 1HG2 VAL 152 -6.352 20.268 -7.831 1014 2HG2 VAL 152 3HG2 VAL 152 -7.666 19.985 -6.686 1015 3HG2 VAL 152 2HG2 VAL 152 -6.485 18.714 -7.015 1016 H HIS 153 HN HIS 153 -4.668 18.934 -9.183 1017 HA HIS 153 HA HIS 153 -4.410 21.004 -11.280 1018 1HB HIS 153 HB2 HIS 153 -4.425 21.840 -8.880 1019 2HB HIS 153 HB1 HIS 153 -2.963 20.910 -8.610 1020 HD1 HIS 153 HD1 HIS 153 -0.719 22.125 -9.187 1021 HD2 HIS 153 HD2 HIS 153 -4.102 24.010 -10.746 1022 HE1 HIS 153 HE1 HIS 153 0.035 24.336 -10.034 1023 H LYS 154 HN LYS 154 -3.465 18.088 -10.027 1024 HA LYS 154 HA LYS 154 -1.997 16.481 -10.529 1025 1HB LYS 154 HB2 LYS 154 -0.823 18.425 -12.538 1026 2HB LYS 154 HB1 LYS 154 -0.303 16.758 -12.357 1027 1HG LYS 154 HG2 LYS 154 -2.513 15.978 -13.020 1028 2HG LYS 154 HG1 LYS 154 -3.067 17.647 -13.151 1029 1HD LYS 154 HD2 LYS 154 -0.844 16.416 -14.784 1030 2HD LYS 154 HD1 LYS 154 -2.502 16.650 -15.335 1031 1HE LYS 154 HE2 LYS 154 -2.219 19.102 -14.970 1032 2HE LYS 154 HE1 LYS 154 -0.530 18.806 -14.568 1033 1HZ LYS 154 HZ3 LYS 154 -1.827 18.144 -17.137 1034 2HZ LYS 154 HZ2 LYS 154 -0.820 19.462 -16.894 1035 3HZ LYS 154 HZ1 LYS 154 -0.203 17.893 -16.785 1036 H LEU 155 HN LEU 155 0.659 16.248 -10.568 1037 HA LEU 155 HA LEU 155 1.379 17.559 -8.134 1038 1HB LEU 155 HB2 LEU 155 2.822 15.582 -9.898 1039 2HB LEU 155 HB1 LEU 155 3.530 16.280 -8.460 1040 HG LEU 155 HG LEU 155 2.822 14.110 -7.973 1041 1HD1 LEU 155 HD1 LEU 155 2.493 15.686 -6.184 1042 2HD1 LEU 155 HD1 LEU 155 0.865 16.049 -6.766 1043 3HD1 LEU 155 HD1 LEU 155 1.232 14.455 -6.129 1044 1HD2 LEU 155 HD2 LEU 155 1.204 13.718 -9.720 1045 2HD2 LEU 155 HD2 LEU 155 0.503 13.323 -8.154 1046 3HD2 LEU 155 HD2 LEU 155 0.069 14.833 -8.956 1047 H GLU 156 HN GLU 156 3.095 18.926 -7.890 1048 HA GLU 156 HA GLU 156 3.516 20.686 -10.086 1049 1HB GLU 156 HB2 GLU 156 4.925 20.617 -7.407 1050 2HB GLU 156 HB1 GLU 156 4.852 21.977 -8.517 1051 1HG GLU 156 HG2 GLU 156 2.571 20.804 -6.935 1052 2HG GLU 156 HG1 GLU 156 3.340 22.369 -6.691 1053 H HIS 157 HN HIS 157 5.325 20.845 -11.333 1054 HA HIS 157 HA HIS 157 6.861 18.413 -11.521 1055 1HB HIS 157 HB2 HIS 157 7.027 20.941 -13.147 1056 2HB HIS 157 HB1 HIS 157 7.878 19.450 -13.525 1057 HD1 HIS 157 HD1 HIS 157 5.117 21.156 -14.774 1058 HD2 HIS 157 HD2 HIS 157 5.661 17.241 -13.493 1059 HE1 HIS 157 HE1 HIS 157 3.254 19.814 -15.808 1060 H HIS 158 HN HIS 158 7.318 21.650 -10.523 1061 HA HIS 158 HA HIS 158 8.817 22.719 -9.390 1062 1HB HIS 158 HB2 HIS 158 9.922 19.985 -8.691 1063 2HB HIS 158 HB1 HIS 158 10.534 21.477 -7.990 1064 HD1 HIS 158 HD1 HIS 158 8.553 22.923 -6.645 1065 HD2 HIS 158 HD2 HIS 158 7.898 18.876 -7.336 1066 HE1 HIS 158 HE1 HIS 158 6.708 22.231 -5.081 1067 H HIS 159 HN HIS 159 9.127 22.436 -12.066 1068 HA HIS 159 HA HIS 159 11.985 22.289 -12.539 1069 1HB HIS 159 HB2 HIS 159 10.405 21.309 -14.225 1070 2HB HIS 159 HB1 HIS 159 9.725 22.909 -14.478 1071 HD1 HIS 159 HD1 HIS 159 10.832 24.313 -16.265 1072 HD2 HIS 159 HD2 HIS 159 13.175 21.106 -15.049 1073 HE1 HIS 159 HE1 HIS 159 12.812 24.245 -17.832 1074 H HIS 160 HN HIS 160 12.405 23.986 -11.114 1075 HA HIS 160 HA HIS 160 12.141 26.604 -12.339 1076 1HB HIS 160 HB2 HIS 160 11.521 27.685 -10.164 1077 2HB HIS 160 HB1 HIS 160 10.266 26.635 -10.794 1078 HD1 HIS 160 HD1 HIS 160 12.038 27.366 -7.650 1079 HD2 HIS 160 HD2 HIS 160 10.332 24.017 -9.414 1080 HE1 HIS 160 HE1 HIS 160 11.558 25.768 -5.794 1081 H HIS 161 HN HIS 161 13.820 27.919 -12.023 1082 HA HIS 161 HA HIS 161 16.098 26.722 -10.631 1083 1HB HIS 161 HB2 HIS 161 17.534 28.243 -11.966 1084 2HB HIS 161 HB1 HIS 161 16.497 27.280 -12.998 1085 HD1 HIS 161 HD1 HIS 161 14.780 28.589 -14.482 1086 HD2 HIS 161 HD2 HIS 161 17.060 30.981 -11.957 1087 HE1 HIS 161 HE1 HIS 161 14.437 30.958 -15.261 1088 H HIS 162 HN HIS 162 13.742 28.420 -9.781 1089 HA HIS 162 HA HIS 162 14.990 30.596 -8.313 1090 1HB HIS 162 HB2 HIS 162 12.858 31.066 -9.396 1091 2HB HIS 162 HB1 HIS 162 12.125 29.659 -8.650 1092 HD1 HIS 162 HD1 HIS 162 13.388 33.128 -7.709 1093 HD2 HIS 162 HD2 HIS 162 10.982 30.084 -6.232 1094 HE1 HIS 162 HE1 HIS 162 12.233 34.078 -5.694 No H/Q in entry = 1094 Start of MODEL 11 1 H1 MET 1 HT3 MET 1 19.026 -20.746 -1.917 2 H2 MET 1 HT2 MET 1 17.774 -20.838 -3.043 3 H3 MET 1 HT1 MET 1 19.206 -20.018 -3.430 4 HA MET 1 HA MET 1 18.745 -18.393 -1.750 5 1HB MET 1 HB2 MET 1 17.019 -18.871 -4.060 6 2HB MET 1 HB1 MET 1 16.304 -17.840 -2.833 7 1HG MET 1 HG2 MET 1 18.962 -17.392 -4.160 8 2HG MET 1 HG1 MET 1 17.458 -16.559 -4.554 9 1HE MET 1 HE2 MET 1 19.988 -14.912 -3.949 10 2HE MET 1 HE1 MET 1 18.411 -14.170 -4.203 11 3HE MET 1 HE3 MET 1 19.399 -13.699 -2.816 12 H GLU 2 HN GLU 2 17.849 -17.852 0.069 13 HA GLU 2 HA GLU 2 15.417 -19.242 0.867 14 1HB GLU 2 HB2 GLU 2 17.734 -18.240 2.535 15 2HB GLU 2 HB1 GLU 2 16.172 -18.664 3.224 16 1HG GLU 2 HG2 GLU 2 16.425 -20.948 2.437 17 2HG GLU 2 HG1 GLU 2 17.970 -20.534 1.698 18 H MET 3 HN MET 3 13.771 -17.948 1.548 19 HA MET 3 HA MET 3 13.937 -15.294 0.461 20 1HB MET 3 HB2 MET 3 11.624 -16.753 1.724 21 2HB MET 3 HB1 MET 3 11.511 -15.146 1.037 22 1HG MET 3 HG2 MET 3 12.033 -16.019 -1.156 23 2HG MET 3 HG1 MET 3 12.275 -17.631 -0.487 24 1HE MET 3 HE2 MET 3 10.321 -17.001 -2.934 25 2HE MET 3 HE1 MET 3 10.550 -18.621 -2.269 26 3HE MET 3 HE3 MET 3 8.920 -17.986 -2.509 27 H GLY 4 HN GLY 4 14.769 -16.354 3.417 28 1HA GLY 4 HA1 GLY 4 15.364 -15.154 5.297 29 2HA GLY 4 HA2 GLY 4 13.773 -14.407 5.148 30 H GLN 5 HN GLN 5 16.693 -14.302 3.136 31 HA GLN 5 HA GLN 5 17.319 -11.622 3.788 32 1HB GLN 5 HB2 GLN 5 18.939 -11.732 1.959 33 2HB GLN 5 HB1 GLN 5 18.987 -13.177 2.985 34 1HG GLN 5 HG2 GLN 5 17.882 -14.458 1.310 35 2HG GLN 5 HG1 GLN 5 17.630 -13.017 0.322 36 1HE2 GLN 5 1HE2 GLN 5 19.969 -15.314 1.468 37 2HE2 GLN 5 2HE2 GLN 5 21.204 -14.914 0.355 38 H LEU 6 HN LEU 6 15.412 -13.079 1.315 39 HA LEU 6 HA LEU 6 15.121 -10.817 -0.369 40 1HB LEU 6 HB2 LEU 6 14.784 -13.176 -1.076 41 2HB LEU 6 HB1 LEU 6 13.393 -13.280 -0.031 42 HG LEU 6 HG LEU 6 12.936 -13.108 -2.509 43 1HD1 LEU 6 HD1 LEU 6 11.690 -11.018 -0.764 44 2HD1 LEU 6 HD1 LEU 6 11.048 -11.599 -2.303 45 3HD1 LEU 6 HD1 LEU 6 11.181 -12.696 -0.928 46 1HD2 LEU 6 HD2 LEU 6 14.619 -11.451 -3.083 47 2HD2 LEU 6 HD2 LEU 6 13.010 -10.886 -3.530 48 3HD2 LEU 6 HD2 LEU 6 13.795 -10.251 -2.088 49 H LYS 7 HN LYS 7 13.167 -12.213 2.203 50 HA LYS 7 HA LYS 7 11.123 -10.284 2.141 51 1HB LYS 7 HB2 LYS 7 11.749 -12.621 3.627 52 2HB LYS 7 HB1 LYS 7 11.367 -11.343 4.768 53 1HG LYS 7 HG2 LYS 7 9.628 -12.115 2.441 54 2HG LYS 7 HG1 LYS 7 9.405 -12.735 4.072 55 1HD LYS 7 HD2 LYS 7 9.343 -9.814 3.305 56 2HD LYS 7 HD1 LYS 7 7.901 -10.813 3.504 57 1HE LYS 7 HE2 LYS 7 9.958 -10.165 5.603 58 2HE LYS 7 HE1 LYS 7 8.341 -9.477 5.482 59 1HZ LYS 7 HZ2 LYS 7 8.947 -12.347 5.945 60 2HZ LYS 7 HZ1 LYS 7 8.489 -11.261 7.125 61 3HZ LYS 7 HZ3 LYS 7 7.405 -11.661 5.904 62 H ASN 8 HN ASN 8 14.222 -10.406 3.713 63 HA ASN 8 HA ASN 8 13.854 -8.271 5.506 64 1HB ASN 8 HB2 ASN 8 15.795 -9.791 5.618 65 2HB ASN 8 HB1 ASN 8 16.383 -9.155 4.088 66 1HD2 ASN 8 HD2 ASN 8 18.306 -8.403 4.888 67 2HD2 ASN 8 HD2 ASN 8 18.446 -7.120 6.019 68 H LYS 9 HN LYS 9 14.922 -8.407 2.135 69 HA LYS 9 HA LYS 9 15.434 -5.668 1.722 70 1HB LYS 9 HB2 LYS 9 14.401 -7.739 -0.239 71 2HB LYS 9 HB1 LYS 9 14.965 -6.138 -0.668 72 1HG LYS 9 HG2 LYS 9 16.672 -8.259 0.606 73 2HG LYS 9 HG1 LYS 9 16.594 -7.910 -1.120 74 1HD LYS 9 HD2 LYS 9 17.268 -5.556 -0.579 75 2HD LYS 9 HD1 LYS 9 17.556 -6.090 1.078 76 1HE LYS 9 HE2 LYS 9 19.637 -6.086 -0.148 77 2HE LYS 9 HE1 LYS 9 19.176 -7.745 0.225 78 1HZ LYS 9 HZ1 LYS 9 18.755 -6.402 -2.404 79 2HZ LYS 9 HZ3 LYS 9 19.985 -7.494 -2.038 80 3HZ LYS 9 HZ2 LYS 9 18.383 -8.010 -2.037 81 H ILE 10 HN ILE 10 12.530 -7.603 1.295 82 HA ILE 10 HA ILE 10 10.771 -5.631 0.370 83 HB ILE 10 HB ILE 10 10.204 -8.118 2.007 84 1HG1 ILE 10 2HG1 ILE 10 10.000 -7.557 -0.948 85 2HG1 ILE 10 1HG1 ILE 10 11.278 -8.492 -0.174 86 1HG2 ILE 10 2HG2 ILE 10 8.329 -6.548 2.228 87 2HG2 ILE 10 1HG2 ILE 10 8.253 -6.381 0.478 88 3HG2 ILE 10 3HG2 ILE 10 7.876 -7.931 1.228 89 1HD1 ILE 10 HD1 ILE 10 9.600 -10.147 0.491 90 2HD1 ILE 10 HD1 ILE 10 8.365 -9.187 -0.329 91 3HD1 ILE 10 HD1 ILE 10 9.685 -9.912 -1.254 92 H GLU 11 HN GLU 11 11.260 -6.808 3.698 93 HA GLU 11 HA GLU 11 9.527 -5.067 5.008 94 1HB GLU 11 HB2 GLU 11 12.101 -6.321 5.941 95 2HB GLU 11 HB1 GLU 11 11.055 -5.382 6.994 96 1HG GLU 11 HG2 GLU 11 10.301 -7.894 5.540 97 2HG GLU 11 HG1 GLU 11 10.692 -7.766 7.259 98 H ASN 12 HN ASN 12 12.991 -4.746 4.529 99 HA ASN 12 HA ASN 12 13.336 -2.261 5.655 100 1HB ASN 12 HB2 ASN 12 15.246 -3.596 5.193 101 2HB ASN 12 HB1 ASN 12 14.876 -3.654 3.474 102 1HD2 ASN 12 HD2 ASN 12 15.401 -1.947 2.200 103 2HD2 ASN 12 HD2 ASN 12 16.278 -0.560 2.731 104 H LYS 13 HN LYS 13 12.662 -2.999 2.186 105 HA LYS 13 HA LYS 13 12.927 -0.279 1.479 106 1HB LYS 13 HB2 LYS 13 13.140 -2.382 -0.016 107 2HB LYS 13 HB1 LYS 13 11.391 -2.313 -0.117 108 1HG LYS 13 HG2 LYS 13 12.395 -1.252 -2.050 109 2HG LYS 13 HG1 LYS 13 11.518 -0.070 -1.079 110 1HD LYS 13 HD2 LYS 13 13.621 0.877 -1.801 111 2HD LYS 13 HD1 LYS 13 13.689 0.648 -0.062 112 1HE LYS 13 HE2 LYS 13 15.778 -0.033 -0.901 113 2HE LYS 13 HE1 LYS 13 14.918 -1.530 -0.572 114 1HZ LYS 13 HZ2 LYS 13 14.420 -1.692 -2.997 115 2HZ LYS 13 HZ1 LYS 13 15.250 -0.249 -3.246 116 3HZ LYS 13 HZ3 LYS 13 16.062 -1.598 -2.687 117 H LYS 14 HN LYS 14 10.219 -2.306 2.365 118 HA LYS 14 HA LYS 14 8.030 -0.624 1.941 119 1HB LYS 14 HB2 LYS 14 7.840 -2.966 2.612 120 2HB LYS 14 HB1 LYS 14 8.636 -2.613 4.132 121 1HG LYS 14 HG2 LYS 14 6.682 -1.176 4.733 122 2HG LYS 14 HG1 LYS 14 5.896 -1.733 3.253 123 1HD LYS 14 HD2 LYS 14 5.076 -3.128 5.040 124 2HD LYS 14 HD1 LYS 14 6.216 -4.080 4.083 125 1HE LYS 14 HE2 LYS 14 7.979 -3.586 5.751 126 2HE LYS 14 HE1 LYS 14 6.744 -2.733 6.685 127 1HZ LYS 14 HZ1 LYS 14 6.489 -5.578 5.922 128 2HZ LYS 14 HZ3 LYS 14 7.253 -5.146 7.312 129 3HZ LYS 14 HZ2 LYS 14 5.617 -4.821 7.137 130 H LYS 15 HN LYS 15 10.154 -1.030 4.666 131 HA LYS 15 HA LYS 15 8.974 0.903 6.360 132 1HB LYS 15 HB2 LYS 15 11.619 -0.525 6.472 133 2HB LYS 15 HB1 LYS 15 11.085 0.591 7.726 134 1HG LYS 15 HG2 LYS 15 9.268 -0.763 8.329 135 2HG LYS 15 HG1 LYS 15 9.378 -1.706 6.850 136 1HD LYS 15 HD2 LYS 15 11.366 -2.747 7.572 137 2HD LYS 15 HD1 LYS 15 11.517 -1.748 9.006 138 1HE LYS 15 HE2 LYS 15 9.301 -2.694 9.753 139 2HE LYS 15 HE1 LYS 15 9.336 -3.750 8.346 140 1HZ LYS 15 HZ1 LYS 15 11.408 -4.712 9.254 141 2HZ LYS 15 HZ3 LYS 15 11.226 -3.760 10.635 142 3HZ LYS 15 HZ2 LYS 15 10.075 -4.918 10.267 143 H GLU 16 HN GLU 16 11.813 1.063 4.266 144 HA GLU 16 HA GLU 16 12.537 3.701 4.809 145 1HB GLU 16 HB2 GLU 16 12.706 2.128 2.234 146 2HB GLU 16 HB1 GLU 16 13.342 3.759 2.379 147 1HG GLU 16 HG2 GLU 16 14.857 2.917 4.174 148 2HG GLU 16 HG1 GLU 16 14.254 1.289 3.857 149 H LEU 17 HN LEU 17 10.026 2.406 2.728 150 HA LEU 17 HA LEU 17 9.216 4.859 1.549 151 1HB LEU 17 HB2 LEU 17 8.542 2.840 0.517 152 2HB LEU 17 HB1 LEU 17 7.756 2.267 1.986 153 HG LEU 17 HG LEU 17 6.304 4.457 1.616 154 1HD1 LEU 17 HD1 LEU 17 7.287 4.097 -1.081 155 2HD1 LEU 17 HD1 LEU 17 5.855 5.008 -0.532 156 3HD1 LEU 17 HD1 LEU 17 7.464 5.461 0.035 157 1HD2 LEU 17 HD2 LEU 17 5.538 2.232 1.700 158 2HD2 LEU 17 HD2 LEU 17 4.710 3.261 0.531 159 3HD2 LEU 17 HD2 LEU 17 5.883 2.010 -0.031 160 H ILE 18 HN ILE 18 8.058 2.989 4.293 161 HA ILE 18 HA ILE 18 5.906 4.568 4.982 162 HB ILE 18 HB ILE 18 7.703 3.004 6.868 163 1HG1 ILE 18 2HG1 ILE 18 5.020 2.232 5.734 164 2HG1 ILE 18 1HG1 ILE 18 6.533 1.762 4.983 165 1HG2 ILE 18 3HG2 ILE 18 6.369 4.657 8.134 166 2HG2 ILE 18 2HG2 ILE 18 4.898 4.079 7.380 167 3HG2 ILE 18 1HG2 ILE 18 5.803 3.024 8.457 168 1HD1 ILE 18 HD1 ILE 18 5.632 1.037 7.757 169 2HD1 ILE 18 HD1 ILE 18 5.629 -0.023 6.343 170 3HD1 ILE 18 HD1 ILE 18 7.154 0.564 7.001 171 H GLN 19 HN GLN 19 9.273 4.840 5.962 172 HA GLN 19 HA GLN 19 9.088 7.025 7.689 173 1HB GLN 19 HB2 GLN 19 11.299 6.279 5.779 174 2HB GLN 19 HB1 GLN 19 11.452 7.474 7.060 175 1HG GLN 19 HG2 GLN 19 11.067 5.775 8.733 176 2HG GLN 19 HG1 GLN 19 10.797 4.569 7.475 177 1HE2 GLN 19 1HE2 GLN 19 13.152 6.515 9.107 178 2HE2 GLN 19 2HE2 GLN 19 14.531 5.623 8.558 179 H LEU 20 HN LEU 20 9.401 6.922 4.184 180 HA LEU 20 HA LEU 20 9.605 9.724 3.838 181 1HB LEU 20 HB2 LEU 20 8.796 7.592 1.865 182 2HB LEU 20 HB1 LEU 20 9.168 9.251 1.453 183 HG LEU 20 HG LEU 20 11.119 7.263 2.624 184 1HD1 LEU 20 HD1 LEU 20 10.863 8.367 -0.162 185 2HD1 LEU 20 HD1 LEU 20 12.166 7.334 0.422 186 3HD1 LEU 20 HD1 LEU 20 10.519 6.715 0.348 187 1HD2 LEU 20 HD2 LEU 20 11.525 10.088 1.635 188 2HD2 LEU 20 HD2 LEU 20 11.667 9.528 3.306 189 3HD2 LEU 20 HD2 LEU 20 12.811 8.972 2.093 190 H VAL 21 HN VAL 21 6.822 7.446 3.410 191 HA VAL 21 HA VAL 21 4.935 9.409 2.826 192 HB VAL 21 HB VAL 21 4.439 6.846 4.383 193 1HG1 VAL 21 1HG1 VAL 21 2.651 8.423 2.556 194 2HG1 VAL 21 3HG1 VAL 21 2.254 6.878 3.300 195 3HG1 VAL 21 2HG1 VAL 21 2.495 8.308 4.321 196 1HG2 VAL 21 3HG2 VAL 21 4.571 7.242 1.402 197 2HG2 VAL 21 2HG2 VAL 21 5.720 6.352 2.408 198 3HG2 VAL 21 1HG2 VAL 21 4.067 5.761 2.228 199 H ALA 22 HN ALA 22 6.129 8.216 5.909 200 HA ALA 22 HA ALA 22 4.291 9.377 7.634 201 1HB ALA 22 HB1 ALA 22 7.186 8.775 8.146 202 2HB ALA 22 HB3 ALA 22 5.935 8.991 9.375 203 3HB ALA 22 HB2 ALA 22 5.859 7.630 8.249 204 H ARG 23 HN ARG 23 7.489 10.549 6.654 205 HA ARG 23 HA ARG 23 7.388 12.912 8.191 206 1HB ARG 23 HB2 ARG 23 9.377 13.639 6.941 207 2HB ARG 23 HB1 ARG 23 9.519 12.000 7.550 208 1HG ARG 23 HG2 ARG 23 8.865 11.195 5.282 209 2HG ARG 23 HG1 ARG 23 8.974 12.865 4.730 210 1HD ARG 23 HD2 ARG 23 11.030 11.626 4.262 211 2HD ARG 23 HD1 ARG 23 11.319 12.942 5.405 212 HE ARG 23 HE ARG 23 10.783 10.761 6.953 213 1HH1 ARG 23 1HH1 ARG 23 13.159 11.422 4.438 214 2HH1 ARG 23 2HH1 ARG 23 14.398 10.494 5.117 215 1HH2 ARG 23 1HH2 ARG 23 12.421 9.492 7.929 216 2HH2 ARG 23 2HH2 ARG 23 13.955 9.326 7.181 217 H HIS 24 HN HIS 24 6.039 12.145 5.192 218 HA HIS 24 HA HIS 24 5.762 14.578 3.913 219 1HB HIS 24 HB2 HIS 24 5.037 12.617 2.776 220 2HB HIS 24 HB1 HIS 24 3.954 12.152 4.058 221 HD1 HIS 24 HD1 HIS 24 1.519 12.824 3.721 222 HD2 HIS 24 HD2 HIS 24 4.126 14.973 1.320 223 HE1 HIS 24 HE1 HIS 24 0.083 14.286 2.261 224 H GLY 25 HN GLY 25 4.096 13.355 6.736 225 1HA GLY 25 HA1 GLY 25 2.176 15.556 6.624 226 2HA GLY 25 HA2 GLY 25 3.344 15.587 7.937 227 H LEU 26 HN LEU 26 2.805 12.380 7.414 228 HA LEU 26 HA LEU 26 0.379 12.009 8.663 229 1HB LEU 26 HB2 LEU 26 2.770 10.385 8.095 230 2HB LEU 26 HB1 LEU 26 1.521 9.743 9.137 231 HG LEU 26 HG LEU 26 -0.083 10.118 7.314 232 1HD1 LEU 26 HD1 LEU 26 0.994 11.774 6.037 233 2HD1 LEU 26 HD1 LEU 26 2.310 10.669 5.622 234 3HD1 LEU 26 HD1 LEU 26 0.670 10.361 5.027 235 1HD2 LEU 26 HD2 LEU 26 2.212 8.254 6.831 236 2HD2 LEU 26 HD2 LEU 26 0.751 7.940 7.761 237 3HD2 LEU 26 HD2 LEU 26 0.662 8.129 6.004 238 H ASP 27 HN ASP 27 -0.083 11.505 10.619 239 HA ASP 27 HA ASP 27 1.673 12.408 12.743 240 1HB ASP 27 HB2 ASP 27 -1.178 11.421 12.741 241 2HB ASP 27 HB1 ASP 27 -0.296 11.720 14.227 242 H HIS 28 HN HIS 28 1.730 10.952 14.756 243 HA HIS 28 HA HIS 28 3.252 8.701 14.078 244 1HB HIS 28 HB2 HIS 28 1.904 9.320 16.722 245 2HB HIS 28 HB1 HIS 28 3.139 8.086 16.486 246 HD1 HIS 28 HD1 HIS 28 5.610 8.968 16.061 247 HD2 HIS 28 HD2 HIS 28 2.805 11.907 16.927 248 HE1 HIS 28 HE1 HIS 28 6.919 11.044 16.607 249 H ASP 29 HN ASP 29 -0.081 8.976 15.148 250 HA ASP 29 HA ASP 29 -0.717 6.249 15.194 251 1HB ASP 29 HB2 ASP 29 -2.106 7.915 16.271 252 2HB ASP 29 HB1 ASP 29 -2.459 8.665 14.720 253 H LYS 30 HN LYS 30 -0.750 8.633 12.656 254 HA LYS 30 HA LYS 30 -2.118 7.106 10.705 255 1HB LYS 30 HB2 LYS 30 -0.193 9.398 10.464 256 2HB LYS 30 HB1 LYS 30 -0.973 8.682 9.070 257 1HG LYS 30 HG2 LYS 30 -2.370 9.992 11.404 258 2HG LYS 30 HG1 LYS 30 -2.066 10.738 9.831 259 1HD LYS 30 HD2 LYS 30 -3.423 8.966 8.769 260 2HD LYS 30 HD1 LYS 30 -3.769 8.311 10.371 261 1HE LYS 30 HE2 LYS 30 -4.835 10.390 11.012 262 2HE LYS 30 HE1 LYS 30 -4.464 11.086 9.434 263 1HZ LYS 30 HZ1 LYS 30 -5.844 9.375 8.426 264 2HZ LYS 30 HZ3 LYS 30 -6.216 8.750 9.940 265 3HZ LYS 30 HZ2 LYS 30 -6.734 10.295 9.511 266 H VAL 31 HN VAL 31 1.313 7.516 11.475 267 HA VAL 31 HA VAL 31 2.367 5.961 9.405 268 HB VAL 31 HB VAL 31 3.481 6.290 12.207 269 1HG1 VAL 31 1HG1 VAL 31 4.851 5.635 9.612 270 2HG1 VAL 31 3HG1 VAL 31 5.664 5.952 11.143 271 3HG1 VAL 31 2HG1 VAL 31 4.611 4.545 10.982 272 1HG2 VAL 31 1HG2 VAL 31 2.984 8.459 11.214 273 2HG2 VAL 31 3HG2 VAL 31 4.726 8.200 11.321 274 3HG2 VAL 31 2HG2 VAL 31 3.894 8.017 9.775 275 H LEU 32 HN LEU 32 1.258 5.169 12.642 276 HA LEU 32 HA LEU 32 1.921 2.427 12.650 277 1HB LEU 32 HB2 LEU 32 -0.368 3.782 14.046 278 2HB LEU 32 HB1 LEU 32 0.316 2.217 14.445 279 HG LEU 32 HG LEU 32 1.683 4.883 14.719 280 1HD1 LEU 32 HD1 LEU 32 -0.037 4.515 16.357 281 2HD1 LEU 32 HD1 LEU 32 0.664 2.947 16.761 282 3HD1 LEU 32 HD1 LEU 32 1.568 4.427 17.089 283 1HD2 LEU 32 HD2 LEU 32 3.288 3.142 14.115 284 2HD2 LEU 32 HD2 LEU 32 3.494 3.642 15.790 285 3HD2 LEU 32 HD2 LEU 32 2.684 2.118 15.418 286 H LEU 33 HN LEU 33 -1.113 4.051 11.837 287 HA LEU 33 HA LEU 33 -2.586 1.770 11.111 288 1HB LEU 33 HB2 LEU 33 -2.771 4.527 9.908 289 2HB LEU 33 HB1 LEU 33 -3.987 3.272 9.817 290 HG LEU 33 HG LEU 33 -3.127 4.647 12.363 291 1HD1 LEU 33 HD1 LEU 33 -4.230 6.186 10.844 292 2HD1 LEU 33 HD1 LEU 33 -5.577 5.062 10.660 293 3HD1 LEU 33 HD1 LEU 33 -5.254 5.808 12.226 294 1HD2 LEU 33 HD2 LEU 33 -3.990 2.385 12.683 295 2HD2 LEU 33 HD2 LEU 33 -5.107 3.598 13.313 296 3HD2 LEU 33 HD2 LEU 33 -5.437 2.805 11.770 297 H PHE 34 HN PHE 34 -0.661 3.965 9.138 298 HA PHE 34 HA PHE 34 -1.110 2.693 6.703 299 1HB PHE 34 HB2 PHE 34 -0.267 4.946 6.812 300 2HB PHE 34 HB1 PHE 34 1.211 4.413 7.601 301 HD1 PHE 34 HD1 PHE 34 3.080 3.962 6.312 302 HD2 PHE 34 HD2 PHE 34 -0.755 3.978 4.483 303 HE1 PHE 34 HE1 PHE 34 4.135 3.671 4.111 304 HE2 PHE 34 HE2 PHE 34 0.288 3.690 2.282 305 HZ PHE 34 HZ PHE 34 2.749 3.536 2.098 306 H SER 35 HN SER 35 1.649 2.355 8.948 307 HA SER 35 HA SER 35 3.009 0.512 7.369 308 1HB SER 35 HB2 SER 35 4.295 -0.033 9.455 309 2HB SER 35 HB1 SER 35 4.187 1.692 9.105 310 HG SER 35 HG SER 35 2.693 1.927 10.677 311 H ARG 36 HN ARG 36 0.616 -0.048 9.937 312 HA ARG 36 HA ARG 36 1.056 -2.850 9.886 313 1HB ARG 36 HB2 ARG 36 -0.835 -3.049 11.411 314 2HB ARG 36 HB1 ARG 36 0.217 -1.739 11.904 315 1HG ARG 36 HG2 ARG 36 -1.365 -0.148 10.869 316 2HG ARG 36 HG1 ARG 36 -2.443 -1.502 10.524 317 1HD ARG 36 HD2 ARG 36 -1.476 -0.650 13.249 318 2HD ARG 36 HD1 ARG 36 -3.067 -0.324 12.567 319 HE ARG 36 HE ARG 36 -2.756 -3.050 12.430 320 1HH1 ARG 36 1HH1 ARG 36 -2.854 -0.654 15.066 321 2HH1 ARG 36 2HH1 ARG 36 -3.456 -1.738 16.208 322 1HH2 ARG 36 1HH2 ARG 36 -3.577 -4.520 14.011 323 2HH2 ARG 36 2HH2 ARG 36 -3.926 -3.992 15.602 324 H ASP 37 HN ASP 37 -1.160 -0.713 8.193 325 HA ASP 37 HA ASP 37 -2.719 -2.928 7.229 326 1HB ASP 37 HB2 ASP 37 -3.470 -0.440 7.547 327 2HB ASP 37 HB1 ASP 37 -2.762 -0.214 5.956 328 H LEU 38 HN LEU 38 -0.147 -0.917 6.040 329 HA LEU 38 HA LEU 38 0.094 -1.922 3.436 330 1HB LEU 38 HB2 LEU 38 1.206 0.090 4.037 331 2HB LEU 38 HB1 LEU 38 2.031 -0.675 5.369 332 HG LEU 38 HG LEU 38 3.499 -1.860 3.822 333 1HD1 LEU 38 HD1 LEU 38 2.013 -0.407 1.658 334 2HD1 LEU 38 HD1 LEU 38 3.486 -1.372 1.471 335 3HD1 LEU 38 HD1 LEU 38 1.982 -2.152 1.966 336 1HD2 LEU 38 HD2 LEU 38 3.289 1.087 3.271 337 2HD2 LEU 38 HD2 LEU 38 4.165 0.330 4.599 338 3HD2 LEU 38 HD2 LEU 38 4.697 0.086 2.935 339 H ASP 39 HN ASP 39 1.551 -2.975 6.491 340 HA ASP 39 HA ASP 39 3.214 -4.980 5.499 341 1HB ASP 39 HB2 ASP 39 3.270 -4.172 7.834 342 2HB ASP 39 HB1 ASP 39 1.729 -4.968 8.137 343 H LYS 40 HN LYS 40 -0.162 -5.140 6.518 344 HA LYS 40 HA LYS 40 -0.538 -7.889 6.016 345 1HB LYS 40 HB2 LYS 40 -2.525 -5.642 5.900 346 2HB LYS 40 HB1 LYS 40 -2.954 -7.340 5.814 347 1HG LYS 40 HG2 LYS 40 -2.061 -7.668 8.082 348 2HG LYS 40 HG1 LYS 40 -1.655 -5.948 8.146 349 1HD LYS 40 HD2 LYS 40 -4.445 -7.062 7.779 350 2HD LYS 40 HD1 LYS 40 -3.793 -6.449 9.300 351 1HE LYS 40 HE2 LYS 40 -3.508 -4.267 8.341 352 2HE LYS 40 HE1 LYS 40 -4.071 -4.823 6.761 353 1HZ LYS 40 HZ2 LYS 40 -6.224 -5.300 7.849 354 2HZ LYS 40 HZ1 LYS 40 -5.632 -4.576 9.263 355 3HZ LYS 40 HZ3 LYS 40 -5.777 -3.671 7.836 356 H LEU 41 HN LEU 41 -0.958 -5.020 3.992 357 HA LEU 41 HA LEU 41 -2.182 -6.211 1.792 358 1HB LEU 41 HB2 LEU 41 -2.067 -3.792 2.051 359 2HB LEU 41 HB1 LEU 41 -0.327 -3.844 1.896 360 HG LEU 41 HG LEU 41 -0.507 -4.500 -0.432 361 1HD1 LEU 41 HD1 LEU 41 -3.488 -4.388 0.000 362 2HD1 LEU 41 HD1 LEU 41 -2.680 -4.573 -1.559 363 3HD1 LEU 41 HD1 LEU 41 -2.525 -5.828 -0.334 364 1HD2 LEU 41 HD2 LEU 41 -2.244 -2.139 0.260 365 2HD2 LEU 41 HD2 LEU 41 -0.488 -2.136 0.069 366 3HD2 LEU 41 HD2 LEU 41 -1.529 -2.463 -1.320 367 H ILE 42 HN ILE 42 1.205 -5.788 2.516 368 HA ILE 42 HA ILE 42 2.100 -6.964 0.102 369 HB ILE 42 HB ILE 42 3.542 -6.634 2.752 370 1HG1 ILE 42 2HG1 ILE 42 3.627 -5.062 0.193 371 2HG1 ILE 42 1HG1 ILE 42 2.800 -4.559 1.662 372 1HG2 ILE 42 3HG2 ILE 42 4.568 -8.419 1.381 373 2HG2 ILE 42 2HG2 ILE 42 4.667 -7.299 0.022 374 3HG2 ILE 42 1HG2 ILE 42 5.609 -6.998 1.480 375 1HD1 ILE 42 HD1 ILE 42 5.760 -4.982 1.364 376 2HD1 ILE 42 HD1 ILE 42 4.921 -3.424 1.365 377 3HD1 ILE 42 HD1 ILE 42 4.891 -4.441 2.805 378 H ASN 43 HN ASN 43 1.832 -8.297 3.380 379 HA ASN 43 HA ASN 43 2.634 -10.906 2.745 380 1HB ASN 43 HB2 ASN 43 0.914 -9.853 4.977 381 2HB ASN 43 HB1 ASN 43 1.208 -11.578 4.794 382 1HD2 ASN 43 HD2 ASN 43 2.626 -8.498 5.599 383 2HD2 ASN 43 HD2 ASN 43 4.082 -9.131 6.258 384 H LYS 44 HN LYS 44 -0.429 -9.394 2.405 385 HA LYS 44 HA LYS 44 -2.180 -11.493 1.878 386 1HB LYS 44 HB2 LYS 44 -2.746 -9.145 2.150 387 2HB LYS 44 HB1 LYS 44 -1.980 -8.761 0.623 388 1HG LYS 44 HG2 LYS 44 -3.689 -10.211 -0.491 389 2HG LYS 44 HG1 LYS 44 -4.502 -10.362 1.066 390 1HD LYS 44 HD2 LYS 44 -3.996 -7.821 -0.499 391 2HD LYS 44 HD1 LYS 44 -5.555 -8.575 -0.174 392 1HE LYS 44 HE2 LYS 44 -5.316 -8.102 2.199 393 2HE LYS 44 HE1 LYS 44 -3.714 -7.437 1.947 394 1HZ LYS 44 HZ3 LYS 44 -4.899 -5.754 0.427 395 2HZ LYS 44 HZ2 LYS 44 -6.311 -6.334 1.142 396 3HZ LYS 44 HZ1 LYS 44 -5.183 -5.611 2.092 397 H PHE 45 HN PHE 45 -0.119 -9.648 -0.323 398 HA PHE 45 HA PHE 45 -0.833 -11.251 -2.553 399 1HB PHE 45 HB2 PHE 45 0.986 -8.929 -2.151 400 2HB PHE 45 HB1 PHE 45 1.078 -9.868 -3.638 401 HD1 PHE 45 HD1 PHE 45 -0.512 -9.692 -5.286 402 HD2 PHE 45 HD2 PHE 45 -1.194 -7.853 -1.526 403 HE1 PHE 45 HE1 PHE 45 -2.478 -8.560 -6.201 404 HE2 PHE 45 HE2 PHE 45 -3.155 -6.695 -2.430 405 HZ PHE 45 HZ PHE 45 -3.812 -7.048 -4.765 406 H MET 46 HN MET 46 1.676 -11.253 -0.254 407 HA MET 46 HA MET 46 3.533 -12.939 -1.692 408 1HB MET 46 HB2 MET 46 3.273 -12.744 1.300 409 2HB MET 46 HB1 MET 46 4.688 -13.177 0.358 410 1HG MET 46 HG2 MET 46 4.721 -10.876 -0.535 411 2HG MET 46 HG1 MET 46 3.402 -10.482 0.563 412 1HE MET 46 HE3 MET 46 6.677 -12.449 0.619 413 2HE MET 46 HE2 MET 46 7.003 -10.830 -0.006 414 3HE MET 46 HE1 MET 46 7.741 -11.343 1.517 415 H ASN 47 HN ASN 47 0.622 -13.366 -0.032 416 HA ASN 47 HA ASN 47 -0.764 -15.123 0.435 417 1HB ASN 47 HB2 ASN 47 -0.096 -15.974 -1.847 418 2HB ASN 47 HB1 ASN 47 1.251 -16.820 -1.112 419 1HD2 ASN 47 HD2 ASN 47 0.581 -18.800 -1.830 420 2HD2 ASN 47 HD2 ASN 47 -0.795 -19.630 -1.201 421 H VAL 48 HN VAL 48 1.569 -14.284 1.963 422 HA VAL 48 HA VAL 48 2.214 -16.716 3.467 423 HB VAL 48 HB VAL 48 3.577 -14.047 3.616 424 1HG1 VAL 48 1HG1 VAL 48 4.353 -16.716 4.799 425 2HG1 VAL 48 3HG1 VAL 48 5.371 -15.277 4.819 426 3HG1 VAL 48 2HG1 VAL 48 3.836 -15.273 5.678 427 1HG2 VAL 48 2HG2 VAL 48 3.991 -15.057 1.436 428 2HG2 VAL 48 1HG2 VAL 48 5.466 -15.075 2.406 429 3HG2 VAL 48 3HG2 VAL 48 4.518 -16.549 2.217 430 H LYS 49 HN LYS 49 0.851 -17.017 4.823 431 HA LYS 49 HA LYS 49 0.120 -14.898 6.694 432 1HB LYS 49 HB2 LYS 49 -1.282 -17.519 6.046 433 2HB LYS 49 HB1 LYS 49 -1.810 -16.379 7.275 434 1HG LYS 49 HG2 LYS 49 -2.165 -14.675 5.533 435 2HG LYS 49 HG1 LYS 49 -1.659 -15.848 4.315 436 1HD LYS 49 HD2 LYS 49 -3.527 -17.294 4.931 437 2HD LYS 49 HD1 LYS 49 -4.012 -16.133 6.163 438 1HE LYS 49 HE2 LYS 49 -5.405 -15.855 4.189 439 2HE LYS 49 HE1 LYS 49 -4.384 -14.440 4.405 440 1HZ LYS 49 HZ1 LYS 49 -3.876 -16.669 2.514 441 2HZ LYS 49 HZ3 LYS 49 -4.476 -15.150 2.091 442 3HZ LYS 49 HZ2 LYS 49 -2.907 -15.314 2.695 443 H ASP 50 HN ASP 50 2.477 -15.975 6.638 444 HA ASP 50 HA ASP 50 4.184 -16.945 7.605 445 1HB ASP 50 HB2 ASP 50 2.826 -16.196 9.707 446 2HB ASP 50 HB1 ASP 50 2.565 -17.928 9.933 447 H LYS 51 HN LYS 51 4.653 -19.209 8.842 448 HA LYS 51 HA LYS 51 3.873 -21.059 6.718 449 1HB LYS 51 HB2 LYS 51 5.913 -22.258 7.270 450 2HB LYS 51 HB1 LYS 51 6.256 -20.555 6.976 451 1HG LYS 51 HG2 LYS 51 6.036 -20.366 9.570 452 2HG LYS 51 HG1 LYS 51 6.354 -22.100 9.527 453 1HD LYS 51 HD2 LYS 51 8.469 -21.148 9.752 454 2HD LYS 51 HD1 LYS 51 8.345 -21.492 8.036 455 1HE LYS 51 HE2 LYS 51 9.279 -19.281 8.372 456 2HE LYS 51 HE1 LYS 51 7.699 -19.154 7.601 457 1HZ LYS 51 HZ1 LYS 51 6.752 -18.580 9.814 458 2HZ LYS 51 HZ3 LYS 51 8.298 -18.716 10.483 459 3HZ LYS 51 HZ2 LYS 51 7.966 -17.524 9.356 460 H VAL 52 HN VAL 52 2.753 -20.282 9.448 461 HA VAL 52 HA VAL 52 2.441 -22.839 10.762 462 HB VAL 52 HB VAL 52 0.867 -21.719 12.286 463 1HG1 VAL 52 1HG1 VAL 52 3.233 -21.488 12.755 464 2HG1 VAL 52 3HG1 VAL 52 3.309 -20.036 11.757 465 3HG1 VAL 52 2HG1 VAL 52 2.362 -20.036 13.246 466 1HG2 VAL 52 1HG2 VAL 52 1.179 -19.298 10.498 467 2HG2 VAL 52 3HG2 VAL 52 -0.288 -20.252 10.718 468 3HG2 VAL 52 2HG2 VAL 52 0.361 -19.308 12.058 469 H HIS 53 HN HIS 53 0.916 -21.057 8.303 470 HA HIS 53 HA HIS 53 -1.463 -22.690 8.335 471 1HB HIS 53 HB2 HIS 53 -1.649 -20.264 7.805 472 2HB HIS 53 HB1 HIS 53 -0.576 -20.482 6.431 473 HD1 HIS 53 HD1 HIS 53 -4.006 -21.845 7.564 474 HD2 HIS 53 HD2 HIS 53 -1.919 -20.792 4.119 475 HE1 HIS 53 HE1 HIS 53 -5.638 -22.032 5.681 476 H LYS 54 HN LYS 54 -1.135 -24.646 7.647 477 HA LYS 54 HA LYS 54 0.931 -25.168 5.700 478 1HB LYS 54 HB2 LYS 54 -0.702 -27.055 7.382 479 2HB LYS 54 HB1 LYS 54 0.526 -27.547 6.230 480 1HG LYS 54 HG2 LYS 54 0.993 -25.809 8.618 481 2HG LYS 54 HG1 LYS 54 1.328 -27.549 8.542 482 1HD LYS 54 HD2 LYS 54 2.917 -27.081 6.678 483 2HD LYS 54 HD1 LYS 54 2.619 -25.356 6.911 484 1HE LYS 54 HE2 LYS 54 4.654 -25.951 8.046 485 2HE LYS 54 HE1 LYS 54 3.412 -25.562 9.229 486 1HZ LYS 54 HZ3 LYS 54 3.034 -27.969 9.519 487 2HZ LYS 54 HZ2 LYS 54 4.266 -28.277 8.418 488 3HZ LYS 54 HZ1 LYS 54 4.624 -27.539 9.889 489 H LEU 55 HN LEU 55 0.281 -24.767 3.842 490 HA LEU 55 HA LEU 55 -2.139 -26.100 2.943 491 1HB LEU 55 HB2 LEU 55 -2.171 -24.676 0.943 492 2HB LEU 55 HB1 LEU 55 -2.236 -23.715 2.394 493 HG LEU 55 HG LEU 55 0.289 -24.066 0.752 494 1HD1 LEU 55 HD1 LEU 55 -1.781 -21.883 0.654 495 2HD1 LEU 55 HD1 LEU 55 -0.227 -21.864 -0.181 496 3HD1 LEU 55 HD1 LEU 55 -1.444 -23.067 -0.611 497 1HD2 LEU 55 HD2 LEU 55 -0.514 -22.005 2.819 498 2HD2 LEU 55 HD2 LEU 55 0.663 -23.296 3.060 499 3HD2 LEU 55 HD2 LEU 55 0.990 -22.014 1.900 500 H GLU 56 HN GLU 56 -1.670 -27.984 2.411 501 HA GLU 56 HA GLU 56 0.881 -28.739 1.231 502 1HB GLU 56 HB2 GLU 56 -0.314 -30.031 3.026 503 2HB GLU 56 HB1 GLU 56 -1.577 -30.379 1.862 504 1HG GLU 56 HG2 GLU 56 0.036 -31.603 0.496 505 2HG GLU 56 HG1 GLU 56 1.294 -31.238 1.680 506 H HIS 57 HN HIS 57 -2.503 -28.543 0.548 507 HA HIS 57 HA HIS 57 -1.998 -28.330 -2.310 508 1HB HIS 57 HB2 HIS 57 -4.241 -29.858 -0.932 509 2HB HIS 57 HB1 HIS 57 -4.297 -29.373 -2.614 510 HD1 HIS 57 HD1 HIS 57 -3.839 -31.351 -4.102 511 HD2 HIS 57 HD2 HIS 57 -1.764 -31.580 -0.510 512 HE1 HIS 57 HE1 HIS 57 -2.566 -33.509 -4.170 513 H HIS 58 HN HIS 58 -3.343 -26.667 -3.147 514 HA HIS 58 HA HIS 58 -4.314 -24.974 -1.022 515 1HB HIS 58 HB2 HIS 58 -2.889 -24.029 -2.874 516 2HB HIS 58 HB1 HIS 58 -4.213 -24.339 -3.989 517 HD1 HIS 58 HD1 HIS 58 -5.523 -22.266 -4.437 518 HD2 HIS 58 HD2 HIS 58 -3.935 -22.321 -0.602 519 HE1 HIS 58 HE1 HIS 58 -6.218 -20.087 -3.347 520 H HIS 59 HN HIS 59 -5.936 -26.657 -0.598 521 HA HIS 59 HA HIS 59 -8.194 -26.621 -2.417 522 1HB HIS 59 HB2 HIS 59 -7.818 -28.184 0.143 523 2HB HIS 59 HB1 HIS 59 -9.257 -28.253 -0.852 524 HD1 HIS 59 HD1 HIS 59 -7.053 -30.565 -0.144 525 HD2 HIS 59 HD2 HIS 59 -7.683 -28.623 -3.755 526 HE1 HIS 59 HE1 HIS 59 -6.266 -32.156 -1.948 527 H HIS 60 HN HIS 60 -8.352 -24.358 -2.018 528 HA HIS 60 HA HIS 60 -10.016 -23.797 0.348 529 1HB HIS 60 HB2 HIS 60 -7.892 -22.374 -0.206 530 2HB HIS 60 HB1 HIS 60 -8.848 -21.715 -1.525 531 HD1 HIS 60 HD1 HIS 60 -8.203 -21.320 2.087 532 HD2 HIS 60 HD2 HIS 60 -11.165 -20.203 -0.605 533 HE1 HIS 60 HE1 HIS 60 -9.545 -19.541 3.234 534 H HIS 61 HN HIS 61 -10.320 -25.028 -2.445 535 HA HIS 61 HA HIS 61 -12.478 -23.394 -3.478 536 1HB HIS 61 HB2 HIS 61 -11.048 -25.787 -4.668 537 2HB HIS 61 HB1 HIS 61 -12.395 -24.946 -5.425 538 HD1 HIS 61 HD1 HIS 61 -11.798 -22.978 -6.903 539 HD2 HIS 61 HD2 HIS 61 -8.681 -24.116 -4.401 540 HE1 HIS 61 HE1 HIS 61 -9.809 -21.631 -7.617 541 H HIS 62 HN HIS 62 -14.508 -24.085 -3.398 542 HA HIS 62 HA HIS 62 -15.020 -26.702 -2.183 543 1HB HIS 62 HB2 HIS 62 -16.440 -24.101 -1.530 544 2HB HIS 62 HB1 HIS 62 -16.855 -25.685 -0.889 545 HD1 HIS 62 HD1 HIS 62 -14.447 -22.870 -0.473 546 HD2 HIS 62 HD2 HIS 62 -15.158 -26.624 1.145 547 HE1 HIS 62 HE1 HIS 62 -13.102 -22.969 1.645 548 H1 MET 101 HT3 MET 101 10.976 20.444 4.683 549 H2 MET 101 HT2 MET 101 12.495 19.819 5.135 550 H3 MET 101 HT1 MET 101 12.363 20.944 3.886 551 HA MET 101 HA MET 101 12.700 18.823 2.943 552 1HB MET 101 HB2 MET 101 10.099 18.117 4.344 553 2HB MET 101 HB1 MET 101 10.897 17.120 3.146 554 1HG MET 101 HG2 MET 101 12.819 16.858 4.645 555 2HG MET 101 HG1 MET 101 12.006 17.862 5.843 556 1HE MET 101 HE1 MET 101 13.186 14.968 6.452 557 2HE MET 101 HE3 MET 101 12.375 15.963 7.662 558 3HE MET 101 HE2 MET 101 11.890 14.283 7.434 559 H GLU 102 HN GLU 102 12.006 18.688 0.886 560 HA GLU 102 HA GLU 102 9.921 20.581 0.109 561 1HB GLU 102 HB2 GLU 102 12.081 20.758 -1.048 562 2HB GLU 102 HB1 GLU 102 11.974 19.078 -1.534 563 1HG GLU 102 HG2 GLU 102 11.405 20.528 -3.387 564 2HG GLU 102 HG1 GLU 102 10.001 19.589 -2.893 565 H MET 103 HN MET 103 7.988 19.749 -0.033 566 HA MET 103 HA MET 103 7.405 17.034 0.085 567 1HB MET 103 HB2 MET 103 5.610 19.305 -0.771 568 2HB MET 103 HB1 MET 103 5.064 17.676 -0.387 569 1HG MET 103 HG2 MET 103 6.441 19.574 1.504 570 2HG MET 103 HG1 MET 103 4.727 19.163 1.500 571 1HE MET 103 HE2 MET 103 5.087 18.667 4.137 572 2HE MET 103 HE1 MET 103 6.228 17.468 4.749 573 3HE MET 103 HE3 MET 103 6.821 18.952 4.008 574 H GLY 104 HN GLY 104 7.687 19.152 -2.707 575 1HA GLY 104 HA1 GLY 104 7.800 18.659 -4.962 576 2HA GLY 104 HA2 GLY 104 6.623 17.395 -4.630 577 H GLN 105 HN GLN 105 9.822 17.659 -3.255 578 HA GLN 105 HA GLN 105 10.945 15.664 -5.019 579 1HB GLN 105 HB2 GLN 105 12.073 17.003 -2.561 580 2HB GLN 105 HB1 GLN 105 12.975 15.933 -3.625 581 1HG GLN 105 HG2 GLN 105 11.688 18.500 -4.519 582 2HG GLN 105 HG1 GLN 105 13.366 18.372 -4.006 583 1HE2 GLN 105 1HE2 GLN 105 14.099 19.016 -5.974 584 2HE2 GLN 105 2HE2 GLN 105 14.072 18.030 -7.383 585 H LEU 106 HN LEU 106 9.775 15.910 -1.770 586 HA LEU 106 HA LEU 106 10.560 13.418 -0.782 587 1HB LEU 106 HB2 LEU 106 9.836 15.324 0.597 588 2HB LEU 106 HB1 LEU 106 8.241 15.221 -0.087 589 HG LEU 106 HG LEU 106 8.552 14.429 2.302 590 1HD1 LEU 106 HD1 LEU 106 7.288 12.554 0.337 591 2HD1 LEU 106 HD1 LEU 106 7.007 12.571 2.075 592 3HD1 LEU 106 HD1 LEU 106 6.535 13.959 1.087 593 1HD2 LEU 106 HD2 LEU 106 9.783 12.061 0.903 594 2HD2 LEU 106 HD2 LEU 106 10.595 13.163 2.017 595 3HD2 LEU 106 HD2 LEU 106 9.303 12.115 2.600 596 H LYS 107 HN LYS 107 7.584 14.454 -2.405 597 HA LYS 107 HA LYS 107 6.264 11.970 -2.319 598 1HB LYS 107 HB2 LYS 107 5.734 14.543 -3.291 599 2HB LYS 107 HB1 LYS 107 5.604 13.479 -4.682 600 1HG LYS 107 HG2 LYS 107 4.181 12.994 -2.087 601 2HG LYS 107 HG1 LYS 107 3.485 13.908 -3.412 602 1HD LYS 107 HD2 LYS 107 4.440 11.048 -3.686 603 2HD LYS 107 HD1 LYS 107 2.779 11.477 -3.274 604 1HE LYS 107 HE2 LYS 107 2.779 12.843 -5.416 605 2HE LYS 107 HE1 LYS 107 4.298 12.040 -5.802 606 1HZ LYS 107 HZ1 LYS 107 1.739 10.680 -5.246 607 2HZ LYS 107 HZ3 LYS 107 2.359 10.942 -6.772 608 3HZ LYS 107 HZ2 LYS 107 3.136 9.877 -5.689 609 H ASN 108 HN ASN 108 8.531 13.365 -4.578 610 HA ASN 108 HA ASN 108 8.446 11.446 -6.626 611 1HB ASN 108 HB2 ASN 108 9.667 13.580 -6.837 612 2HB ASN 108 HB1 ASN 108 10.795 13.065 -5.592 613 1HD2 ASN 108 HD2 ASN 108 12.625 13.105 -6.818 614 2HD2 ASN 108 HD2 ASN 108 12.886 12.062 -8.157 615 H LYS 109 HN LYS 109 10.354 11.656 -3.663 616 HA LYS 109 HA LYS 109 11.795 9.255 -4.009 617 1HB LYS 109 HB2 LYS 109 11.104 10.672 -1.431 618 2HB LYS 109 HB1 LYS 109 12.335 9.434 -1.622 619 1HG LYS 109 HG2 LYS 109 12.361 12.165 -2.898 620 2HG LYS 109 HG1 LYS 109 13.310 11.662 -1.503 621 1HD LYS 109 HD2 LYS 109 14.443 9.976 -2.930 622 2HD LYS 109 HD1 LYS 109 13.523 10.567 -4.314 623 1HE LYS 109 HE2 LYS 109 14.515 12.796 -4.003 624 2HE LYS 109 HE1 LYS 109 15.427 12.186 -2.632 625 1HZ LYS 109 HZ3 LYS 109 15.694 11.227 -5.424 626 2HZ LYS 109 HZ2 LYS 109 16.772 12.264 -4.646 627 3HZ LYS 109 HZ1 LYS 109 16.587 10.675 -4.111 628 H ILE 110 HN ILE 110 8.744 9.998 -2.403 629 HA ILE 110 HA ILE 110 8.205 7.475 -1.315 630 HB ILE 110 HB ILE 110 6.289 9.577 -2.367 631 1HG1 ILE 110 2HG1 ILE 110 7.124 8.812 0.434 632 2HG1 ILE 110 1HG1 ILE 110 7.619 10.256 -0.437 633 1HG2 ILE 110 3HG2 ILE 110 5.150 7.411 -2.450 634 2HG2 ILE 110 2HG2 ILE 110 5.590 7.109 -0.768 635 3HG2 ILE 110 1HG2 ILE 110 4.482 8.421 -1.165 636 1HD1 ILE 110 HD1 ILE 110 4.818 9.589 0.425 637 2HD1 ILE 110 HD1 ILE 110 5.909 10.745 1.199 638 3HD1 ILE 110 HD1 ILE 110 5.317 11.046 -0.435 639 H GLU 111 HN GLU 111 7.314 8.763 -4.507 640 HA GLU 111 HA GLU 111 6.068 6.464 -5.500 641 1HB GLU 111 HB2 GLU 111 7.698 8.540 -6.967 642 2HB GLU 111 HB1 GLU 111 6.743 7.304 -7.766 643 1HG GLU 111 HG2 GLU 111 5.685 9.445 -5.949 644 2HG GLU 111 HG1 GLU 111 5.578 9.461 -7.703 645 H ASN 112 HN ASN 112 9.422 7.460 -5.747 646 HA ASN 112 HA ASN 112 10.386 5.269 -7.179 647 1HB ASN 112 HB2 ASN 112 11.670 7.348 -6.837 648 2HB ASN 112 HB1 ASN 112 11.864 6.941 -5.137 649 1HD2 ASN 112 HD2 ASN 112 13.368 5.325 -4.555 650 2HD2 ASN 112 HD2 ASN 112 14.486 4.693 -5.690 651 H LYS 113 HN LYS 113 10.186 5.750 -3.687 652 HA LYS 113 HA LYS 113 11.570 3.392 -2.985 653 1HB LYS 113 HB2 LYS 113 11.155 5.468 -1.570 654 2HB LYS 113 HB1 LYS 113 9.555 4.820 -1.285 655 1HG LYS 113 HG2 LYS 113 11.032 4.290 0.564 656 2HG LYS 113 HG1 LYS 113 10.508 2.827 -0.272 657 1HD LYS 113 HD2 LYS 113 12.887 2.770 0.295 658 2HD LYS 113 HD1 LYS 113 12.631 2.709 -1.441 659 1HE LYS 113 HE2 LYS 113 13.102 5.073 -1.600 660 2HE LYS 113 HE1 LYS 113 13.383 5.158 0.154 661 1HZ LYS 113 HZ3 LYS 113 14.861 3.576 -1.847 662 2HZ LYS 113 HZ2 LYS 113 15.415 4.995 -1.106 663 3HZ LYS 113 HZ1 LYS 113 15.198 3.581 -0.168 664 H LYS 114 HN LYS 114 8.133 4.187 -3.095 665 HA LYS 114 HA LYS 114 6.981 1.821 -2.334 666 1HB LYS 114 HB2 LYS 114 5.759 3.808 -2.523 667 2HB LYS 114 HB1 LYS 114 6.199 4.049 -4.212 668 1HG LYS 114 HG2 LYS 114 4.838 1.975 -4.731 669 2HG LYS 114 HG1 LYS 114 4.265 2.029 -3.065 670 1HD LYS 114 HD2 LYS 114 2.602 3.138 -4.404 671 2HD LYS 114 HD1 LYS 114 3.489 4.391 -3.531 672 1HE LYS 114 HE2 LYS 114 4.868 4.766 -5.581 673 2HE LYS 114 HE1 LYS 114 3.866 3.540 -6.353 674 1HZ LYS 114 HZ3 LYS 114 2.716 6.018 -5.191 675 2HZ LYS 114 HZ2 LYS 114 3.235 5.966 -6.753 676 3HZ LYS 114 HZ1 LYS 114 1.954 4.961 -6.250 677 H LYS 115 HN LYS 115 8.026 2.945 -5.528 678 HA LYS 115 HA LYS 115 7.278 0.611 -6.932 679 1HB LYS 115 HB2 LYS 115 9.256 2.778 -7.609 680 2HB LYS 115 HB1 LYS 115 8.804 1.487 -8.717 681 1HG LYS 115 HG2 LYS 115 6.516 2.236 -8.746 682 2HG LYS 115 HG1 LYS 115 6.857 3.423 -7.486 683 1HD LYS 115 HD2 LYS 115 6.761 4.546 -9.592 684 2HD LYS 115 HD1 LYS 115 8.416 4.541 -9.020 685 1HE LYS 115 HE2 LYS 115 8.330 4.036 -11.421 686 2HE LYS 115 HE1 LYS 115 8.987 2.687 -10.499 687 1HZ LYS 115 HZ2 LYS 115 6.196 2.901 -11.485 688 2HZ LYS 115 HZ1 LYS 115 7.409 1.963 -12.178 689 3HZ LYS 115 HZ3 LYS 115 6.837 1.593 -10.645 690 H GLU 116 HN GLU 116 10.345 1.623 -5.467 691 HA GLU 116 HA GLU 116 11.920 -0.537 -6.195 692 1HB GLU 116 HB2 GLU 116 11.916 1.016 -3.591 693 2HB GLU 116 HB1 GLU 116 13.091 -0.229 -3.958 694 1HG GLU 116 HG2 GLU 116 13.728 1.189 -5.954 695 2HG GLU 116 HG1 GLU 116 12.726 2.458 -5.234 696 H LEU 117 HN LEU 117 9.646 -0.228 -3.502 697 HA LEU 117 HA LEU 117 10.205 -2.740 -2.387 698 1HB LEU 117 HB2 LEU 117 9.219 -1.256 -0.896 699 2HB LEU 117 HB1 LEU 117 8.023 -0.727 -2.044 700 HG LEU 117 HG LEU 117 7.106 -2.010 -0.068 701 1HD1 LEU 117 HD1 LEU 117 5.865 -1.593 -1.939 702 2HD1 LEU 117 HD1 LEU 117 6.418 -3.084 -2.686 703 3HD1 LEU 117 HD1 LEU 117 5.461 -3.157 -1.189 704 1HD2 LEU 117 HD2 LEU 117 8.377 -4.370 -1.414 705 2HD2 LEU 117 HD2 LEU 117 8.850 -3.704 0.152 706 3HD2 LEU 117 HD2 LEU 117 7.249 -4.422 -0.057 707 H ILE 118 HN ILE 118 7.771 -1.675 -4.688 708 HA ILE 118 HA ILE 118 6.333 -4.050 -4.793 709 HB ILE 118 HB ILE 118 6.832 -2.194 -7.157 710 1HG1 ILE 118 2HG1 ILE 118 4.495 -2.185 -5.247 711 2HG1 ILE 118 1HG1 ILE 118 5.895 -1.147 -5.014 712 1HG2 ILE 118 2HG2 ILE 118 4.686 -4.233 -6.541 713 2HG2 ILE 118 1HG2 ILE 118 4.634 -3.126 -7.932 714 3HG2 ILE 118 3HG2 ILE 118 5.902 -4.350 -7.795 715 1HD1 ILE 118 HD1 ILE 118 5.461 -0.119 -7.170 716 2HD1 ILE 118 HD1 ILE 118 4.022 -1.127 -7.361 717 3HD1 ILE 118 HD1 ILE 118 4.112 0.059 -6.049 718 H GLN 119 HN GLN 119 9.243 -3.062 -6.425 719 HA GLN 119 HA GLN 119 9.584 -5.256 -8.111 720 1HB GLN 119 HB2 GLN 119 11.617 -3.433 -6.842 721 2HB GLN 119 HB1 GLN 119 11.989 -4.598 -8.110 722 1HG GLN 119 HG2 GLN 119 10.606 -3.492 -9.664 723 2HG GLN 119 HG1 GLN 119 9.900 -2.471 -8.416 724 1HE2 GLN 119 1HE2 GLN 119 10.418 -0.634 -9.462 725 2HE2 GLN 119 2HE2 GLN 119 12.010 -0.012 -9.609 726 H LEU 120 HN LEU 120 10.423 -4.884 -4.682 727 HA LEU 120 HA LEU 120 11.799 -7.409 -4.634 728 1HB LEU 120 HB2 LEU 120 10.828 -5.750 -2.298 729 2HB LEU 120 HB1 LEU 120 11.646 -7.279 -2.132 730 HG LEU 120 HG LEU 120 13.310 -5.897 -1.693 731 1HD1 LEU 120 HD1 LEU 120 14.127 -7.249 -3.433 732 2HD1 LEU 120 HD1 LEU 120 13.598 -6.090 -4.651 733 3HD1 LEU 120 HD1 LEU 120 14.881 -5.655 -3.521 734 1HD2 LEU 120 HD2 LEU 120 12.231 -3.878 -3.636 735 2HD2 LEU 120 HD2 LEU 120 12.243 -3.816 -1.866 736 3HD2 LEU 120 HD2 LEU 120 13.751 -3.701 -2.753 737 H VAL 121 HN VAL 121 8.553 -6.375 -3.456 738 HA VAL 121 HA VAL 121 7.963 -9.041 -2.761 739 HB VAL 121 HB VAL 121 6.739 -7.320 -1.655 740 1HG1 VAL 121 2HG1 VAL 121 5.757 -6.402 -4.288 741 2HG1 VAL 121 1HG1 VAL 121 5.100 -5.929 -2.699 742 3HG1 VAL 121 3HG1 VAL 121 6.776 -5.579 -3.073 743 1HG2 VAL 121 3HG2 VAL 121 4.853 -8.853 -3.423 744 2HG2 VAL 121 2HG2 VAL 121 5.494 -9.363 -1.860 745 3HG2 VAL 121 1HG2 VAL 121 4.389 -7.991 -1.952 746 H ALA 122 HN ALA 122 7.623 -7.382 -5.758 747 HA ALA 122 HA ALA 122 5.989 -9.191 -7.083 748 1HB ALA 122 HB2 ALA 122 8.202 -7.533 -8.284 749 2HB ALA 122 HB1 ALA 122 6.877 -8.291 -9.181 750 3HB ALA 122 HB3 ALA 122 6.540 -7.016 -8.016 751 H ARG 123 HN ARG 123 9.525 -9.129 -6.721 752 HA ARG 123 HA ARG 123 9.911 -11.448 -8.342 753 1HB ARG 123 HB2 ARG 123 12.266 -11.353 -7.641 754 2HB ARG 123 HB1 ARG 123 11.689 -9.802 -8.215 755 1HG ARG 123 HG2 ARG 123 11.411 -9.071 -5.886 756 2HG ARG 123 HG1 ARG 123 12.041 -10.624 -5.348 757 1HD ARG 123 HD2 ARG 123 13.543 -8.660 -7.071 758 2HD ARG 123 HD1 ARG 123 13.713 -8.787 -5.324 759 HE ARG 123 HE ARG 123 14.134 -11.272 -6.637 760 1HH1 ARG 123 1HH1 ARG 123 15.687 -8.204 -5.847 761 2HH1 ARG 123 2HH1 ARG 123 17.261 -8.817 -5.821 762 1HH2 ARG 123 1HH2 ARG 123 16.347 -12.155 -6.644 763 2HH2 ARG 123 2HH2 ARG 123 17.640 -11.101 -6.302 764 H HIS 124 HN HIS 124 8.924 -11.026 -5.158 765 HA HIS 124 HA HIS 124 9.907 -13.316 -3.885 766 1HB HIS 124 HB2 HIS 124 8.729 -11.732 -2.556 767 2HB HIS 124 HB1 HIS 124 7.301 -11.783 -3.553 768 HD1 HIS 124 HD1 HIS 124 5.688 -13.949 -3.151 769 HD2 HIS 124 HD2 HIS 124 8.916 -13.618 -0.560 770 HE1 HIS 124 HE1 HIS 124 5.248 -15.553 -1.283 771 H GLY 125 HN GLY 125 7.198 -12.888 -6.074 772 1HA GLY 125 HA1 GLY 125 6.166 -15.517 -5.674 773 2HA GLY 125 HA2 GLY 125 7.169 -15.422 -7.116 774 H LEU 126 HN LEU 126 5.473 -12.505 -6.255 775 HA LEU 126 HA LEU 126 3.019 -12.849 -7.313 776 1HB LEU 126 HB2 LEU 126 4.891 -10.618 -6.998 777 2HB LEU 126 HB1 LEU 126 3.405 -10.326 -7.895 778 HG LEU 126 HG LEU 126 2.161 -11.073 -5.893 779 1HD1 LEU 126 HD1 LEU 126 3.743 -12.432 -4.906 780 2HD1 LEU 126 HD1 LEU 126 4.769 -11.042 -4.468 781 3HD1 LEU 126 HD1 LEU 126 3.122 -11.206 -3.796 782 1HD2 LEU 126 HD2 LEU 126 4.002 -8.725 -5.557 783 2HD2 LEU 126 HD2 LEU 126 2.438 -8.742 -6.366 784 3HD2 LEU 126 HD2 LEU 126 2.543 -8.993 -4.616 785 H ASP 127 HN ASP 127 2.184 -12.851 -9.150 786 HA ASP 127 HA ASP 127 3.838 -13.163 -11.549 787 1HB ASP 127 HB2 ASP 127 1.653 -14.527 -10.859 788 2HB ASP 127 HB1 ASP 127 0.838 -13.158 -11.568 789 H HIS 128 HN HIS 128 2.464 -12.082 -13.545 790 HA HIS 128 HA HIS 128 3.079 -9.328 -13.350 791 1HB HIS 128 HB2 HIS 128 1.527 -10.878 -15.427 792 2HB HIS 128 HB1 HIS 128 1.846 -9.159 -15.572 793 HD1 HIS 128 HD1 HIS 128 3.451 -9.229 -17.557 794 HD2 HIS 128 HD2 HIS 128 4.551 -11.795 -14.488 795 HE1 HIS 128 HE1 HIS 128 5.717 -10.122 -18.182 796 H ASP 129 HN ASP 129 0.100 -11.131 -13.007 797 HA ASP 129 HA ASP 129 -1.580 -8.833 -12.990 798 1HB ASP 129 HB2 ASP 129 -3.352 -10.325 -12.213 799 2HB ASP 129 HB1 ASP 129 -2.463 -11.108 -13.511 800 H LYS 130 HN LYS 130 0.007 -10.749 -10.593 801 HA LYS 130 HA LYS 130 -1.178 -9.660 -8.310 802 1HB LYS 130 HB2 LYS 130 1.458 -11.001 -8.769 803 2HB LYS 130 HB1 LYS 130 0.913 -10.462 -7.186 804 1HG LYS 130 HG2 LYS 130 -0.728 -12.295 -8.892 805 2HG LYS 130 HG1 LYS 130 0.521 -12.905 -7.803 806 1HD LYS 130 HD2 LYS 130 -0.565 -12.121 -5.917 807 2HD LYS 130 HD1 LYS 130 -1.615 -11.036 -6.798 808 1HE LYS 130 HE2 LYS 130 -1.689 -14.073 -6.839 809 2HE LYS 130 HE1 LYS 130 -2.811 -13.005 -5.992 810 1HZ LYS 130 HZ2 LYS 130 -2.534 -12.853 -8.961 811 2HZ LYS 130 HZ1 LYS 130 -3.596 -13.906 -8.169 812 3HZ LYS 130 HZ3 LYS 130 -3.727 -12.270 -7.949 813 H VAL 131 HN VAL 131 1.623 -8.690 -10.179 814 HA VAL 131 HA VAL 131 2.455 -6.671 -8.380 815 HB VAL 131 HB VAL 131 2.961 -6.761 -11.382 816 1HG1 VAL 131 3HG1 VAL 131 3.509 -4.627 -10.399 817 2HG1 VAL 131 2HG1 VAL 131 4.515 -5.432 -9.195 818 3HG1 VAL 131 1HG1 VAL 131 4.962 -5.494 -10.902 819 1HG2 VAL 131 3HG2 VAL 131 4.521 -8.032 -9.149 820 2HG2 VAL 131 2HG2 VAL 131 3.582 -8.848 -10.398 821 3HG2 VAL 131 1HG2 VAL 131 5.030 -7.942 -10.845 822 H LEU 132 HN LEU 132 0.156 -6.796 -11.020 823 HA LEU 132 HA LEU 132 -0.316 -3.984 -11.199 824 1HB LEU 132 HB2 LEU 132 -2.055 -6.287 -12.047 825 2HB LEU 132 HB1 LEU 132 -2.293 -4.609 -12.495 826 HG LEU 132 HG LEU 132 0.045 -6.338 -13.290 827 1HD1 LEU 132 HD1 LEU 132 -2.000 -6.952 -14.406 828 2HD1 LEU 132 HD1 LEU 132 -2.264 -5.267 -14.874 829 3HD1 LEU 132 HD1 LEU 132 -0.889 -6.162 -15.528 830 1HD2 LEU 132 HD2 LEU 132 -0.625 -3.491 -14.034 831 2HD2 LEU 132 HD2 LEU 132 0.738 -4.024 -13.049 832 3HD2 LEU 132 HD2 LEU 132 0.661 -4.464 -14.756 833 H LEU 133 HN LEU 133 -2.155 -6.619 -9.641 834 HA LEU 133 HA LEU 133 -4.058 -4.871 -8.512 835 1HB LEU 133 HB2 LEU 133 -3.229 -7.650 -7.751 836 2HB LEU 133 HB1 LEU 133 -4.370 -6.763 -6.763 837 HG LEU 133 HG LEU 133 -5.613 -8.223 -8.048 838 1HD1 LEU 133 HD1 LEU 133 -6.637 -6.095 -7.959 839 2HD1 LEU 133 HD1 LEU 133 -5.799 -5.581 -9.430 840 3HD1 LEU 133 HD1 LEU 133 -6.996 -6.867 -9.502 841 1HD2 LEU 133 HD2 LEU 133 -4.080 -7.368 -10.490 842 2HD2 LEU 133 HD2 LEU 133 -4.022 -8.931 -9.673 843 3HD2 LEU 133 HD2 LEU 133 -5.496 -8.427 -10.500 844 H PHE 134 HN PHE 134 -1.001 -6.093 -7.237 845 HA PHE 134 HA PHE 134 -1.320 -5.029 -4.675 846 1HB PHE 134 HB2 PHE 134 0.346 -6.727 -5.077 847 2HB PHE 134 HB1 PHE 134 1.209 -5.680 -6.198 848 HD1 PHE 134 HD1 PHE 134 0.160 -5.973 -2.653 849 HD2 PHE 134 HD2 PHE 134 2.895 -4.274 -5.427 850 HE1 PHE 134 HE1 PHE 134 1.504 -5.090 -0.793 851 HE2 PHE 134 HE2 PHE 134 4.242 -3.391 -3.541 852 HZ PHE 134 HZ PHE 134 3.542 -3.791 -1.268 853 H SER 135 HN SER 135 0.362 -3.658 -7.501 854 HA SER 135 HA SER 135 1.354 -1.425 -6.169 855 1HB SER 135 HB2 SER 135 1.647 -0.480 -8.475 856 2HB SER 135 HB1 SER 135 2.317 -2.091 -8.239 857 HG SER 135 HG SER 135 0.838 -2.960 -9.433 858 H ARG 136 HN ARG 136 -1.747 -1.922 -7.725 859 HA ARG 136 HA ARG 136 -2.436 0.859 -7.572 860 1HB ARG 136 HB2 ARG 136 -4.637 0.197 -8.412 861 2HB ARG 136 HB1 ARG 136 -3.354 -0.535 -9.355 862 1HG ARG 136 HG2 ARG 136 -3.665 -2.615 -8.029 863 2HG ARG 136 HG1 ARG 136 -5.078 -1.860 -7.293 864 1HD ARG 136 HD2 ARG 136 -4.668 -2.342 -10.233 865 2HD ARG 136 HD1 ARG 136 -5.639 -3.343 -9.164 866 HE ARG 136 HE ARG 136 -6.638 -0.802 -8.883 867 1HH1 ARG 136 1HH1 ARG 136 -6.259 -3.115 -11.563 868 2HH1 ARG 136 2HH1 ARG 136 -7.625 -2.565 -12.411 869 1HH2 ARG 136 1HH2 ARG 136 -8.575 -0.086 -10.096 870 2HH2 ARG 136 2HH2 ARG 136 -8.953 -0.834 -11.565 871 H ASP 137 HN ASP 137 -3.022 -1.994 -5.591 872 HA ASP 137 HA ASP 137 -4.970 -0.687 -3.936 873 1HB ASP 137 HB2 ASP 137 -4.470 -3.277 -4.358 874 2HB ASP 137 HB1 ASP 137 -3.408 -3.057 -2.977 875 H LEU 138 HN LEU 138 -1.568 -1.236 -3.923 876 HA LEU 138 HA LEU 138 -0.895 -0.123 -1.421 877 1HB LEU 138 HB2 LEU 138 0.667 -1.490 -2.594 878 2HB LEU 138 HB1 LEU 138 0.562 -0.497 -4.022 879 HG LEU 138 HG LEU 138 1.840 1.267 -2.922 880 1HD1 LEU 138 HD1 LEU 138 1.110 0.927 -0.637 881 2HD1 LEU 138 HD1 LEU 138 1.991 -0.610 -0.581 882 3HD1 LEU 138 HD1 LEU 138 2.870 0.915 -0.792 883 1HD2 LEU 138 HD2 LEU 138 3.071 -1.461 -2.717 884 2HD2 LEU 138 HD2 LEU 138 3.036 -0.430 -4.146 885 3HD2 LEU 138 HD2 LEU 138 3.962 0.053 -2.721 886 H ASP 139 HN ASP 139 -1.063 1.216 -4.677 887 HA ASP 139 HA ASP 139 -0.171 3.802 -4.119 888 1HB ASP 139 HB2 ASP 139 -0.373 2.866 -6.399 889 2HB ASP 139 HB1 ASP 139 -2.124 2.946 -6.262 890 H LYS 140 HN LYS 140 -3.457 2.492 -4.122 891 HA LYS 140 HA LYS 140 -4.772 4.934 -3.603 892 1HB LYS 140 HB2 LYS 140 -6.712 3.725 -3.240 893 2HB LYS 140 HB1 LYS 140 -5.789 2.662 -4.324 894 1HG LYS 140 HG2 LYS 140 -5.092 1.361 -2.352 895 2HG LYS 140 HG1 LYS 140 -6.092 2.389 -1.341 896 1HD LYS 140 HD2 LYS 140 -8.051 1.629 -2.731 897 2HD LYS 140 HD1 LYS 140 -6.953 0.442 -3.456 898 1HE LYS 140 HE2 LYS 140 -6.389 -0.308 -1.126 899 2HE LYS 140 HE1 LYS 140 -7.704 0.709 -0.554 900 1HZ LYS 140 HZ2 LYS 140 -9.178 -0.662 -2.085 901 2HZ LYS 140 HZ1 LYS 140 -7.821 -1.650 -2.295 902 3HZ LYS 140 HZ3 LYS 140 -8.496 -1.488 -0.769 903 H LEU 141 HN LEU 141 -3.349 2.510 -1.477 904 HA LEU 141 HA LEU 141 -4.424 3.461 0.955 905 1HB LEU 141 HB2 LEU 141 -3.579 1.192 0.716 906 2HB LEU 141 HB1 LEU 141 -1.976 1.790 0.363 907 HG LEU 141 HG LEU 141 -1.809 2.666 2.660 908 1HD1 LEU 141 HD1 LEU 141 -4.483 1.341 3.052 909 2HD1 LEU 141 HD1 LEU 141 -3.441 1.953 4.341 910 3HD1 LEU 141 HD1 LEU 141 -4.114 3.072 3.155 911 1HD2 LEU 141 HD2 LEU 141 -2.511 -0.253 2.461 912 2HD2 LEU 141 HD2 LEU 141 -0.931 0.470 2.140 913 3HD2 LEU 141 HD2 LEU 141 -1.601 0.494 3.775 914 H ILE 142 HN ILE 142 -1.660 4.104 -0.908 915 HA ILE 142 HA ILE 142 -0.412 5.700 1.110 916 HB ILE 142 HB ILE 142 0.255 5.415 -1.832 917 1HG1 ILE 142 2HG1 ILE 142 1.557 4.419 0.694 918 2HG1 ILE 142 1HG1 ILE 142 0.630 3.448 -0.442 919 1HG2 ILE 142 3HG2 ILE 142 1.772 6.924 0.318 920 2HG2 ILE 142 2HG2 ILE 142 2.352 6.624 -1.320 921 3HG2 ILE 142 1HG2 ILE 142 0.945 7.652 -1.058 922 1HD1 ILE 142 HD1 ILE 142 3.229 4.836 -1.018 923 2HD1 ILE 142 HD1 ILE 142 3.011 3.116 -0.676 924 3HD1 ILE 142 HD1 ILE 142 2.292 3.811 -2.123 925 H ASN 143 HN ASN 143 -2.101 6.445 -1.913 926 HA ASN 143 HA ASN 143 -2.043 9.228 -1.664 927 1HB ASN 143 HB2 ASN 143 -4.193 7.511 -2.908 928 2HB ASN 143 HB1 ASN 143 -4.092 9.258 -3.077 929 1HD2 ASN 143 HD2 ASN 143 -4.039 7.251 -5.112 930 2HD2 ASN 143 HD2 ASN 143 -2.548 7.393 -5.950 931 H LYS 144 HN LYS 144 -4.219 6.885 -0.292 932 HA LYS 144 HA LYS 144 -6.160 8.484 0.885 933 1HB LYS 144 HB2 LYS 144 -6.215 6.031 0.851 934 2HB LYS 144 HB1 LYS 144 -4.879 5.973 1.987 935 1HG LYS 144 HG2 LYS 144 -6.361 7.168 3.649 936 2HG LYS 144 HG1 LYS 144 -7.675 6.955 2.485 937 1HD LYS 144 HD2 LYS 144 -6.078 4.693 3.657 938 2HD LYS 144 HD1 LYS 144 -7.648 5.235 4.247 939 1HE LYS 144 HE2 LYS 144 -7.090 4.203 1.460 940 2HE LYS 144 HE1 LYS 144 -7.817 3.288 2.775 941 1HZ LYS 144 HZ3 LYS 144 -8.975 5.742 1.572 942 2HZ LYS 144 HZ2 LYS 144 -9.491 4.169 1.258 943 3HZ LYS 144 HZ1 LYS 144 -9.664 4.830 2.794 944 H PHE 145 HN PHE 145 -3.059 7.383 2.284 945 HA PHE 145 HA PHE 145 -3.419 8.987 4.589 946 1HB PHE 145 HB2 PHE 145 -1.206 7.193 3.687 947 2HB PHE 145 HB1 PHE 145 -0.984 8.295 5.046 948 HD1 PHE 145 HD1 PHE 145 -2.020 7.922 7.123 949 HD2 PHE 145 HD2 PHE 145 -2.893 5.387 3.833 950 HE1 PHE 145 HE1 PHE 145 -3.137 6.349 8.644 951 HE2 PHE 145 HE2 PHE 145 -4.016 3.802 5.345 952 HZ PHE 145 HZ PHE 145 -4.139 4.284 7.752 953 H MET 146 HN MET 146 -1.889 9.435 1.572 954 HA MET 146 HA MET 146 -0.304 11.756 2.221 955 1HB MET 146 HB2 MET 146 -1.517 10.882 -0.405 956 2HB MET 146 HB1 MET 146 -0.321 12.154 -0.235 957 1HG MET 146 HG2 MET 146 0.094 9.254 0.454 958 2HG MET 146 HG1 MET 146 0.600 10.012 -1.046 959 1HE MET 146 HE1 MET 146 2.527 11.634 -1.291 960 2HE MET 146 HE3 MET 146 1.715 12.765 -0.207 961 3HE MET 146 HE2 MET 146 3.410 12.364 0.049 962 H ASN 147 HN ASN 147 -3.571 11.163 2.114 963 HA ASN 147 HA ASN 147 -5.414 12.355 2.430 964 1HB ASN 147 HB2 ASN 147 -3.994 13.653 4.056 965 2HB ASN 147 HB1 ASN 147 -3.605 14.781 2.768 966 1HD2 ASN 147 HD2 ASN 147 -6.110 13.588 4.871 967 2HD2 ASN 147 HD2 ASN 147 -7.173 14.935 4.731 968 H VAL 148 HN VAL 148 -4.135 12.019 -0.200 969 HA VAL 148 HA VAL 148 -5.603 14.122 -1.561 970 HB VAL 148 HB VAL 148 -4.151 13.729 -3.564 971 1HG1 VAL 148 3HG1 VAL 148 -3.778 15.630 -2.099 972 2HG1 VAL 148 2HG1 VAL 148 -2.738 14.652 -1.067 973 3HG1 VAL 148 1HG1 VAL 148 -2.239 15.025 -2.719 974 1HG2 VAL 148 1HG2 VAL 148 -3.327 11.522 -2.972 975 2HG2 VAL 148 3HG2 VAL 148 -1.983 12.629 -3.270 976 3HG2 VAL 148 2HG2 VAL 148 -2.437 12.212 -1.611 977 H LYS 149 HN LYS 149 -7.345 13.510 -2.129 978 HA LYS 149 HA LYS 149 -7.678 11.092 -3.661 979 1HB LYS 149 HB2 LYS 149 -9.720 10.508 -2.351 980 2HB LYS 149 HB1 LYS 149 -8.207 10.320 -1.473 981 1HG LYS 149 HG2 LYS 149 -8.600 12.350 -0.276 982 2HG LYS 149 HG1 LYS 149 -10.062 12.675 -1.204 983 1HD LYS 149 HD2 LYS 149 -10.659 11.767 0.958 984 2HD LYS 149 HD1 LYS 149 -11.069 10.604 -0.300 985 1HE LYS 149 HE2 LYS 149 -10.076 9.464 1.599 986 2HE LYS 149 HE1 LYS 149 -8.989 9.360 0.217 987 1HZ LYS 149 HZ1 LYS 149 -8.764 11.287 2.446 988 2HZ LYS 149 HZ3 LYS 149 -7.835 9.901 2.321 989 3HZ LYS 149 HZ2 LYS 149 -7.679 11.182 1.205 990 H ASP 150 HN ASP 150 -7.469 13.580 -4.567 991 HA ASP 150 HA ASP 150 -9.955 14.903 -4.833 992 1HB ASP 150 HB2 ASP 150 -8.777 16.330 -6.521 993 2HB ASP 150 HB1 ASP 150 -7.927 16.229 -4.990 994 H LYS 151 HN LYS 151 -11.220 13.224 -5.420 995 HA LYS 151 HA LYS 151 -11.040 12.414 -8.230 996 1HB LYS 151 HB2 LYS 151 -12.453 10.475 -7.547 997 2HB LYS 151 HB1 LYS 151 -10.873 10.515 -6.781 998 1HG LYS 151 HG2 LYS 151 -11.919 11.462 -4.754 999 2HG LYS 151 HG1 LYS 151 -13.497 11.299 -5.533 1000 1HD LYS 151 HD2 LYS 151 -13.166 8.896 -5.716 1001 2HD LYS 151 HD1 LYS 151 -11.565 9.053 -4.995 1002 1HE LYS 151 HE2 LYS 151 -13.189 8.290 -3.346 1003 2HE LYS 151 HE1 LYS 151 -12.565 9.885 -2.934 1004 1HZ LYS 151 HZ1 LYS 151 -15.159 9.378 -4.287 1005 2HZ LYS 151 HZ3 LYS 151 -14.962 9.689 -2.643 1006 3HZ LYS 151 HZ2 LYS 151 -14.577 10.876 -3.767 1007 H VAL 152 HN VAL 152 -12.193 14.804 -6.903 1008 HA VAL 152 HA VAL 152 -14.980 14.736 -7.127 1009 HB VAL 152 HB VAL 152 -14.831 17.264 -7.269 1010 1HG1 VAL 152 2HG1 VAL 152 -13.212 15.925 -5.107 1011 2HG1 VAL 152 1HG1 VAL 152 -13.914 17.539 -5.004 1012 3HG1 VAL 152 3HG1 VAL 152 -14.964 16.127 -5.121 1013 1HG2 VAL 152 1HG2 VAL 152 -12.679 17.427 -8.452 1014 2HG2 VAL 152 3HG2 VAL 152 -12.645 18.324 -6.935 1015 3HG2 VAL 152 2HG2 VAL 152 -11.854 16.752 -7.048 1016 H HIS 153 HN HIS 153 -16.078 14.313 -8.792 1017 HA HIS 153 HA HIS 153 -14.877 14.616 -11.403 1018 1HB HIS 153 HB2 HIS 153 -16.630 12.989 -12.139 1019 2HB HIS 153 HB1 HIS 153 -15.514 12.363 -10.934 1020 HD1 HIS 153 HD1 HIS 153 -16.529 11.771 -8.572 1021 HD2 HIS 153 HD2 HIS 153 -19.285 13.242 -11.325 1022 HE1 HIS 153 HE1 HIS 153 -18.800 11.351 -7.585 1023 H LYS 154 HN LYS 154 -15.791 15.641 -13.037 1024 HA LYS 154 HA LYS 154 -17.931 17.521 -12.482 1025 1HB LYS 154 HB2 LYS 154 -16.253 17.041 -14.950 1026 2HB LYS 154 HB1 LYS 154 -17.496 18.267 -14.809 1027 1HG LYS 154 HG2 LYS 154 -16.196 19.395 -13.070 1028 2HG LYS 154 HG1 LYS 154 -14.969 18.134 -13.167 1029 1HD LYS 154 HD2 LYS 154 -14.318 20.150 -14.439 1030 2HD LYS 154 HD1 LYS 154 -14.486 18.741 -15.484 1031 1HE LYS 154 HE2 LYS 154 -16.745 19.519 -16.130 1032 2HE LYS 154 HE1 LYS 154 -16.538 20.931 -15.101 1033 1HZ LYS 154 HZ3 LYS 154 -14.770 20.291 -17.401 1034 2HZ LYS 154 HZ2 LYS 154 -16.125 21.237 -17.547 1035 3HZ LYS 154 HZ1 LYS 154 -14.835 21.731 -16.556 1036 H LEU 155 HN LEU 155 -19.756 17.650 -14.061 1037 HA LEU 155 HA LEU 155 -20.544 14.953 -14.889 1038 1HB LEU 155 HB2 LEU 155 -22.261 17.355 -14.293 1039 2HB LEU 155 HB1 LEU 155 -22.849 15.775 -14.764 1040 HG LEU 155 HG LEU 155 -21.394 16.414 -12.194 1041 1HD1 LEU 155 HD1 LEU 155 -23.652 17.315 -12.258 1042 2HD1 LEU 155 HD1 LEU 155 -24.282 15.730 -12.703 1043 3HD1 LEU 155 HD1 LEU 155 -23.530 15.970 -11.126 1044 1HD2 LEU 155 HD2 LEU 155 -22.624 13.832 -13.165 1045 2HD2 LEU 155 HD2 LEU 155 -20.902 14.151 -12.955 1046 3HD2 LEU 155 HD2 LEU 155 -21.970 14.119 -11.553 1047 H GLU 156 HN GLU 156 -21.310 14.607 -16.916 1048 HA GLU 156 HA GLU 156 -21.021 16.805 -18.848 1049 1HB GLU 156 HB2 GLU 156 -19.374 14.816 -18.957 1050 2HB GLU 156 HB1 GLU 156 -20.744 13.824 -19.397 1051 1HG GLU 156 HG2 GLU 156 -19.760 16.187 -21.004 1052 2HG GLU 156 HG1 GLU 156 -19.305 14.521 -21.300 1053 H HIS 157 HN HIS 157 -22.902 17.369 -19.705 1054 HA HIS 157 HA HIS 157 -25.101 15.427 -19.780 1055 1HB HIS 157 HB2 HIS 157 -25.349 18.312 -18.935 1056 2HB HIS 157 HB1 HIS 157 -26.694 17.252 -19.326 1057 HD1 HIS 157 HD1 HIS 157 -24.771 18.414 -16.516 1058 HD2 HIS 157 HD2 HIS 157 -26.780 14.931 -17.520 1059 HE1 HIS 157 HE1 HIS 157 -25.218 17.222 -14.342 1060 H HIS 158 HN HIS 158 -26.256 15.388 -21.520 1061 HA HIS 158 HA HIS 158 -27.091 15.734 -23.500 1062 1HB HIS 158 HB2 HIS 158 -26.617 18.638 -22.858 1063 2HB HIS 158 HB1 HIS 158 -27.455 18.109 -24.315 1064 HD1 HIS 158 HD1 HIS 158 -29.810 16.916 -23.942 1065 HD2 HIS 158 HD2 HIS 158 -28.070 18.524 -20.529 1066 HE1 HIS 158 HE1 HIS 158 -31.616 16.953 -22.188 1067 H HIS 159 HN HIS 159 -24.088 15.503 -23.118 1068 HA HIS 159 HA HIS 159 -22.455 14.855 -24.508 1069 1HB HIS 159 HB2 HIS 159 -24.299 14.052 -25.976 1070 2HB HIS 159 HB1 HIS 159 -24.390 15.629 -26.723 1071 HD1 HIS 159 HD1 HIS 159 -23.642 15.270 -29.049 1072 HD2 HIS 159 HD2 HIS 159 -21.269 13.233 -26.320 1073 HE1 HIS 159 HE1 HIS 159 -21.840 14.151 -30.401 1074 H HIS 160 HN HIS 160 -22.939 17.624 -23.555 1075 HA HIS 160 HA HIS 160 -20.799 18.958 -25.027 1076 1HB HIS 160 HB2 HIS 160 -23.539 20.230 -24.864 1077 2HB HIS 160 HB1 HIS 160 -22.074 21.122 -25.223 1078 HD1 HIS 160 HD1 HIS 160 -21.104 20.826 -27.655 1079 HD2 HIS 160 HD2 HIS 160 -24.589 18.708 -26.883 1080 HE1 HIS 160 HE1 HIS 160 -22.041 20.176 -29.902 1081 H HIS 161 HN HIS 161 -23.105 19.074 -22.345 1082 HA HIS 161 HA HIS 161 -21.828 21.378 -21.170 1083 1HB HIS 161 HB2 HIS 161 -24.053 19.617 -20.115 1084 2HB HIS 161 HB1 HIS 161 -23.490 21.096 -19.356 1085 HD1 HIS 161 HD1 HIS 161 -25.040 23.002 -19.838 1086 HD2 HIS 161 HD2 HIS 161 -24.936 20.248 -22.945 1087 HE1 HIS 161 HE1 HIS 161 -26.677 23.829 -21.573 1088 H HIS 162 HN HIS 162 -19.904 21.042 -20.288 1089 HA HIS 162 HA HIS 162 -19.711 19.092 -18.171 1090 1HB HIS 162 HB2 HIS 162 -18.959 17.889 -20.236 1091 2HB HIS 162 HB1 HIS 162 -17.714 19.109 -20.456 1092 HD1 HIS 162 HD1 HIS 162 -18.680 16.347 -18.049 1093 HD2 HIS 162 HD2 HIS 162 -15.419 18.696 -19.067 1094 HE1 HIS 162 HE1 HIS 162 -16.722 15.391 -16.795 No H/Q in entry = 1094 Start of MODEL 12 1 H1 MET 1 HT1 MET 1 17.315 -17.946 -3.950 2 H2 MET 1 HT3 MET 1 17.089 -16.287 -3.916 3 H3 MET 1 HT2 MET 1 18.455 -16.939 -4.677 4 HA MET 1 HA MET 1 19.209 -17.783 -2.536 5 1HB MET 1 HB2 MET 1 18.566 -14.808 -2.621 6 2HB MET 1 HB1 MET 1 19.618 -15.529 -1.424 7 1HG MET 1 HG2 MET 1 20.912 -14.472 -3.164 8 2HG MET 1 HG1 MET 1 21.175 -16.204 -3.198 9 1HE MET 1 HE2 MET 1 22.125 -14.409 -5.546 10 2HE MET 1 HE1 MET 1 22.249 -16.164 -5.594 11 3HE MET 1 HE3 MET 1 21.550 -15.292 -6.960 12 H GLU 2 HN GLU 2 18.834 -16.695 -0.047 13 HA GLU 2 HA GLU 2 16.613 -17.992 0.994 14 1HB GLU 2 HB2 GLU 2 18.194 -15.653 2.010 15 2HB GLU 2 HB1 GLU 2 16.924 -16.420 2.942 16 1HG GLU 2 HG2 GLU 2 18.139 -18.429 3.082 17 2HG GLU 2 HG1 GLU 2 19.330 -17.876 1.906 18 H MET 3 HN MET 3 14.518 -17.523 0.823 19 HA MET 3 HA MET 3 13.758 -14.952 -0.148 20 1HB MET 3 HB2 MET 3 11.999 -17.226 0.812 21 2HB MET 3 HB1 MET 3 11.398 -15.752 0.072 22 1HG MET 3 HG2 MET 3 13.193 -17.769 -1.263 23 2HG MET 3 HG1 MET 3 11.450 -17.637 -1.490 24 1HE MET 3 HE2 MET 3 11.845 -17.558 -4.109 25 2HE MET 3 HE1 MET 3 12.908 -16.401 -4.910 26 3HE MET 3 HE3 MET 3 13.590 -17.653 -3.871 27 H GLY 4 HN GLY 4 14.251 -16.349 2.856 28 1HA GLY 4 HA1 GLY 4 14.208 -15.445 4.953 29 2HA GLY 4 HA2 GLY 4 12.735 -14.609 4.465 30 H GLN 5 HN GLN 5 15.951 -14.357 2.984 31 HA GLN 5 HA GLN 5 16.465 -11.864 4.290 32 1HB GLN 5 HB2 GLN 5 18.550 -11.810 3.215 33 2HB GLN 5 HB1 GLN 5 18.169 -13.527 3.393 34 1HG GLN 5 HG2 GLN 5 17.673 -13.759 1.120 35 2HG GLN 5 HG1 GLN 5 17.710 -12.015 0.863 36 1HE2 GLN 5 1HE2 GLN 5 19.302 -12.143 -0.688 37 2HE2 GLN 5 2HE2 GLN 5 20.941 -12.480 -0.285 38 H LEU 6 HN LEU 6 15.179 -12.903 1.256 39 HA LEU 6 HA LEU 6 14.992 -10.440 -0.057 40 1HB LEU 6 HB2 LEU 6 14.630 -12.606 -1.168 41 2HB LEU 6 HB1 LEU 6 13.248 -12.914 -0.151 42 HG LEU 6 HG LEU 6 12.777 -12.344 -2.573 43 1HD1 LEU 6 HD1 LEU 6 11.463 -10.694 -0.453 44 2HD1 LEU 6 HD1 LEU 6 10.853 -10.902 -2.089 45 3HD1 LEU 6 HD1 LEU 6 10.973 -12.284 -1.010 46 1HD2 LEU 6 HD2 LEU 6 13.549 -9.574 -1.670 47 2HD2 LEU 6 HD2 LEU 6 14.391 -10.552 -2.874 48 3HD2 LEU 6 HD2 LEU 6 12.752 -9.977 -3.189 49 H LYS 7 HN LYS 7 12.909 -12.087 2.201 50 HA LYS 7 HA LYS 7 10.817 -10.245 2.368 51 1HB LYS 7 HB2 LYS 7 11.691 -12.587 3.694 52 2HB LYS 7 HB1 LYS 7 11.294 -11.363 4.900 53 1HG LYS 7 HG2 LYS 7 9.489 -12.136 2.626 54 2HG LYS 7 HG1 LYS 7 9.402 -12.921 4.192 55 1HD LYS 7 HD2 LYS 7 9.056 -9.943 3.727 56 2HD LYS 7 HD1 LYS 7 7.718 -11.072 3.895 57 1HE LYS 7 HE2 LYS 7 8.526 -11.652 6.145 58 2HE LYS 7 HE1 LYS 7 9.808 -10.453 5.972 59 1HZ LYS 7 HZ1 LYS 7 6.914 -9.849 5.827 60 2HZ LYS 7 HZ3 LYS 7 7.855 -9.666 7.191 61 3HZ LYS 7 HZ2 LYS 7 8.159 -8.714 5.848 62 H ASN 8 HN ASN 8 13.831 -10.522 4.141 63 HA ASN 8 HA ASN 8 13.388 -8.371 5.894 64 1HB ASN 8 HB2 ASN 8 16.036 -9.476 4.914 65 2HB ASN 8 HB1 ASN 8 15.794 -8.342 6.244 66 1HD2 ASN 8 HD2 ASN 8 17.002 -10.974 6.258 67 2HD2 ASN 8 HD2 ASN 8 16.100 -11.892 7.406 68 H LYS 9 HN LYS 9 14.746 -8.537 2.670 69 HA LYS 9 HA LYS 9 15.516 -5.793 2.520 70 1HB LYS 9 HB2 LYS 9 14.747 -7.664 0.271 71 2HB LYS 9 HB1 LYS 9 15.578 -6.131 0.084 72 1HG LYS 9 HG2 LYS 9 16.661 -8.584 1.480 73 2HG LYS 9 HG1 LYS 9 17.122 -8.012 -0.117 74 1HD LYS 9 HD2 LYS 9 17.533 -6.486 2.462 75 2HD LYS 9 HD1 LYS 9 18.772 -7.421 1.632 76 1HE LYS 9 HE2 LYS 9 18.528 -5.981 -0.333 77 2HE LYS 9 HE1 LYS 9 17.310 -5.032 0.520 78 1HZ LYS 9 HZ3 LYS 9 18.999 -4.435 2.156 79 2HZ LYS 9 HZ2 LYS 9 20.150 -5.336 1.305 80 3HZ LYS 9 HZ1 LYS 9 19.470 -3.979 0.601 81 H ILE 10 HN ILE 10 12.593 -7.564 1.658 82 HA ILE 10 HA ILE 10 11.064 -5.463 0.654 83 HB ILE 10 HB ILE 10 10.259 -7.942 2.206 84 1HG1 ILE 10 2HG1 ILE 10 9.988 -7.204 -0.709 85 2HG1 ILE 10 1HG1 ILE 10 11.149 -8.338 -0.024 86 1HG2 ILE 10 3HG2 ILE 10 8.525 -6.291 2.651 87 2HG2 ILE 10 2HG2 ILE 10 8.344 -5.999 0.922 88 3HG2 ILE 10 1HG2 ILE 10 7.927 -7.575 1.596 89 1HD1 ILE 10 HD1 ILE 10 9.300 -9.805 0.634 90 2HD1 ILE 10 HD1 ILE 10 8.151 -8.663 -0.074 91 3HD1 ILE 10 HD1 ILE 10 9.322 -9.495 -1.101 92 H GLU 11 HN GLU 11 11.419 -6.609 3.973 93 HA GLU 11 HA GLU 11 9.808 -4.772 5.274 94 1HB GLU 11 HB2 GLU 11 12.353 -6.061 6.238 95 2HB GLU 11 HB1 GLU 11 11.247 -5.166 7.267 96 1HG GLU 11 HG2 GLU 11 10.655 -7.693 5.759 97 2HG GLU 11 HG1 GLU 11 10.863 -7.522 7.505 98 H ASN 12 HN ASN 12 13.250 -4.607 4.681 99 HA ASN 12 HA ASN 12 13.765 -2.144 5.894 100 1HB ASN 12 HB2 ASN 12 15.436 -3.867 5.280 101 2HB ASN 12 HB1 ASN 12 15.255 -3.411 3.592 102 1HD2 ASN 12 HD2 ASN 12 16.298 -1.573 2.871 103 2HD2 ASN 12 HD2 ASN 12 17.389 -0.674 3.866 104 H LYS 13 HN LYS 13 12.901 -2.911 2.545 105 HA LYS 13 HA LYS 13 13.219 -0.221 1.660 106 1HB LYS 13 HB2 LYS 13 13.431 -2.324 0.220 107 2HB LYS 13 HB1 LYS 13 11.684 -2.422 0.266 108 1HG LYS 13 HG2 LYS 13 12.483 -1.391 -1.831 109 2HG LYS 13 HG1 LYS 13 11.485 -0.295 -0.883 110 1HD LYS 13 HD2 LYS 13 13.402 0.874 -1.769 111 2HD LYS 13 HD1 LYS 13 13.507 0.805 -0.018 112 1HE LYS 13 HE2 LYS 13 15.684 0.392 -0.844 113 2HE LYS 13 HE1 LYS 13 15.064 -1.174 -0.339 114 1HZ LYS 13 HZ3 LYS 13 14.532 -1.619 -2.717 115 2HZ LYS 13 HZ2 LYS 13 15.216 -0.114 -3.100 116 3HZ LYS 13 HZ1 LYS 13 16.171 -1.312 -2.460 117 H LYS 14 HN LYS 14 10.429 -2.217 2.586 118 HA LYS 14 HA LYS 14 8.323 -0.500 2.215 119 1HB LYS 14 HB2 LYS 14 8.120 -2.838 2.922 120 2HB LYS 14 HB1 LYS 14 8.921 -2.459 4.435 121 1HG LYS 14 HG2 LYS 14 7.005 -1.010 5.031 122 2HG LYS 14 HG1 LYS 14 6.212 -1.519 3.541 123 1HD LYS 14 HD2 LYS 14 5.359 -2.825 5.419 124 2HD LYS 14 HD1 LYS 14 6.271 -3.852 4.316 125 1HE LYS 14 HE2 LYS 14 8.217 -3.738 5.819 126 2HE LYS 14 HE1 LYS 14 7.304 -2.658 6.860 127 1HZ LYS 14 HZ1 LYS 14 6.324 -5.420 6.283 128 2HZ LYS 14 HZ3 LYS 14 7.441 -5.116 7.455 129 3HZ LYS 14 HZ2 LYS 14 5.922 -4.436 7.588 130 H LYS 15 HN LYS 15 10.496 -0.872 4.965 131 HA LYS 15 HA LYS 15 9.439 1.095 6.628 132 1HB LYS 15 HB2 LYS 15 12.104 -0.246 6.459 133 2HB LYS 15 HB1 LYS 15 11.807 1.014 7.656 134 1HG LYS 15 HG2 LYS 15 10.118 -0.241 8.711 135 2HG LYS 15 HG1 LYS 15 9.995 -1.360 7.360 136 1HD LYS 15 HD2 LYS 15 11.929 -2.412 7.878 137 2HD LYS 15 HD1 LYS 15 12.560 -1.139 8.938 138 1HE LYS 15 HE2 LYS 15 10.236 -3.027 9.424 139 2HE LYS 15 HE1 LYS 15 11.793 -3.067 10.241 140 1HZ LYS 15 HZ2 LYS 15 11.270 -0.859 11.187 141 2HZ LYS 15 HZ1 LYS 15 9.765 -0.904 10.453 142 3HZ LYS 15 HZ3 LYS 15 10.151 -2.025 11.646 143 H GLU 16 HN GLU 16 11.920 1.384 4.171 144 HA GLU 16 HA GLU 16 12.646 4.081 4.471 145 1HB GLU 16 HB2 GLU 16 12.257 2.375 2.021 146 2HB GLU 16 HB1 GLU 16 12.905 3.996 1.949 147 1HG GLU 16 HG2 GLU 16 14.145 1.779 3.521 148 2HG GLU 16 HG1 GLU 16 14.552 2.140 1.843 149 H LEU 17 HN LEU 17 10.021 2.569 2.712 150 HA LEU 17 HA LEU 17 8.991 4.943 1.614 151 1HB LEU 17 HB2 LEU 17 8.575 2.971 0.418 152 2HB LEU 17 HB1 LEU 17 8.017 2.118 1.831 153 HG LEU 17 HG LEU 17 6.237 2.614 0.140 154 1HD1 LEU 17 HD1 LEU 17 5.703 1.972 2.254 155 2HD1 LEU 17 HD1 LEU 17 5.732 3.639 2.817 156 3HD1 LEU 17 HD1 LEU 17 4.528 3.134 1.613 157 1HD2 LEU 17 HD2 LEU 17 6.622 5.458 1.023 158 2HD2 LEU 17 HD2 LEU 17 6.972 4.819 -0.584 159 3HD2 LEU 17 HD2 LEU 17 5.309 4.857 0.006 160 H ILE 18 HN ILE 18 8.134 3.023 4.422 161 HA ILE 18 HA ILE 18 5.822 4.322 5.111 162 HB ILE 18 HB ILE 18 7.891 3.181 7.023 163 1HG1 ILE 18 2HG1 ILE 18 5.327 1.938 6.026 164 2HG1 ILE 18 1HG1 ILE 18 6.895 1.647 5.285 165 1HG2 ILE 18 3HG2 ILE 18 6.360 4.699 8.219 166 2HG2 ILE 18 2HG2 ILE 18 4.974 3.844 7.561 167 3HG2 ILE 18 1HG2 ILE 18 6.060 3.026 8.676 168 1HD1 ILE 18 HD1 ILE 18 6.180 1.027 8.133 169 2HD1 ILE 18 HD1 ILE 18 6.237 -0.145 6.812 170 3HD1 ILE 18 HD1 ILE 18 7.709 0.684 7.335 171 H GLN 19 HN GLN 19 9.155 5.108 5.826 172 HA GLN 19 HA GLN 19 8.712 7.321 7.529 173 1HB GLN 19 HB2 GLN 19 11.072 6.598 5.812 174 2HB GLN 19 HB1 GLN 19 11.078 7.875 7.016 175 1HG GLN 19 HG2 GLN 19 10.650 6.256 8.770 176 2HG GLN 19 HG1 GLN 19 10.549 4.972 7.564 177 1HE2 GLN 19 1HE2 GLN 19 12.204 3.845 8.516 178 2HE2 GLN 19 2HE2 GLN 19 13.859 4.329 8.393 179 H LEU 20 HN LEU 20 8.956 6.983 4.085 180 HA LEU 20 HA LEU 20 9.087 9.746 3.442 181 1HB LEU 20 HB2 LEU 20 8.587 7.222 1.957 182 2HB LEU 20 HB1 LEU 20 8.067 8.720 1.224 183 HG LEU 20 HG LEU 20 10.226 9.438 0.803 184 1HD1 LEU 20 HD1 LEU 20 11.062 9.294 3.108 185 2HD1 LEU 20 HD1 LEU 20 11.269 7.546 2.897 186 3HD1 LEU 20 HD1 LEU 20 12.199 8.682 1.906 187 1HD2 LEU 20 HD2 LEU 20 10.395 6.447 0.830 188 2HD2 LEU 20 HD2 LEU 20 9.799 7.462 -0.484 189 3HD2 LEU 20 HD2 LEU 20 11.500 7.519 -0.012 190 H VAL 21 HN VAL 21 6.351 7.405 3.296 191 HA VAL 21 HA VAL 21 4.390 9.336 2.826 192 HB VAL 21 HB VAL 21 3.984 6.853 4.518 193 1HG1 VAL 21 2HG1 VAL 21 2.072 8.345 4.443 194 2HG1 VAL 21 1HG1 VAL 21 2.115 8.340 2.684 195 3HG1 VAL 21 3HG1 VAL 21 1.733 6.858 3.557 196 1HG2 VAL 21 2HG2 VAL 21 4.051 7.081 1.519 197 2HG2 VAL 21 1HG2 VAL 21 5.184 6.205 2.556 198 3HG2 VAL 21 3HG2 VAL 21 3.513 5.660 2.425 199 H ALA 22 HN ALA 22 5.771 8.177 5.862 200 HA ALA 22 HA ALA 22 4.131 9.420 7.715 201 1HB ALA 22 HB1 ALA 22 7.082 8.925 7.953 202 2HB ALA 22 HB3 ALA 22 5.950 9.140 9.293 203 3HB ALA 22 HB2 ALA 22 5.819 7.732 8.230 204 H ARG 23 HN ARG 23 7.149 10.634 6.295 205 HA ARG 23 HA ARG 23 7.122 13.048 7.784 206 1HB ARG 23 HB2 ARG 23 9.004 13.760 6.423 207 2HB ARG 23 HB1 ARG 23 9.217 12.106 6.966 208 1HG ARG 23 HG2 ARG 23 8.445 11.348 4.740 209 2HG ARG 23 HG1 ARG 23 8.426 13.029 4.213 210 1HD ARG 23 HD2 ARG 23 10.512 11.976 3.544 211 2HD ARG 23 HD1 ARG 23 10.836 13.184 4.789 212 HE ARG 23 HE ARG 23 10.435 10.783 6.081 213 1HH1 ARG 23 1HH1 ARG 23 12.825 12.110 3.819 214 2HH1 ARG 23 2HH1 ARG 23 14.088 11.111 4.367 215 1HH2 ARG 23 1HH2 ARG 23 12.203 9.444 6.842 216 2HH2 ARG 23 2HH2 ARG 23 13.724 9.549 6.093 217 H HIS 24 HN HIS 24 5.518 12.085 4.980 218 HA HIS 24 HA HIS 24 5.177 14.540 3.688 219 1HB HIS 24 HB2 HIS 24 4.609 12.464 2.591 220 2HB HIS 24 HB1 HIS 24 3.363 12.100 3.743 221 HD1 HIS 24 HD1 HIS 24 4.131 14.838 1.155 222 HD2 HIS 24 HD2 HIS 24 0.956 13.017 3.059 223 HE1 HIS 24 HE1 HIS 24 2.069 15.848 0.120 224 H GLY 25 HN GLY 25 3.499 13.169 6.442 225 1HA GLY 25 HA1 GLY 25 1.579 15.375 6.370 226 2HA GLY 25 HA2 GLY 25 2.743 15.392 7.692 227 H LEU 26 HN LEU 26 2.256 12.210 7.167 228 HA LEU 26 HA LEU 26 -0.122 11.741 8.423 229 1HB LEU 26 HB2 LEU 26 2.376 10.285 7.891 230 2HB LEU 26 HB1 LEU 26 1.223 9.583 9.004 231 HG LEU 26 HG LEU 26 -0.467 9.748 7.235 232 1HD1 LEU 26 HD1 LEU 26 0.417 11.451 5.868 233 2HD1 LEU 26 HD1 LEU 26 1.801 10.444 5.422 234 3HD1 LEU 26 HD1 LEU 26 0.163 9.974 4.930 235 1HD2 LEU 26 HD2 LEU 26 1.967 8.106 6.677 236 2HD2 LEU 26 HD2 LEU 26 0.606 7.668 7.715 237 3HD2 LEU 26 HD2 LEU 26 0.385 7.809 5.961 238 H ASP 27 HN ASP 27 -0.584 11.253 10.417 239 HA ASP 27 HA ASP 27 0.886 12.478 12.573 240 1HB ASP 27 HB2 ASP 27 -1.488 10.591 12.725 241 2HB ASP 27 HB1 ASP 27 -0.908 11.655 13.983 242 H HIS 28 HN HIS 28 1.363 11.072 14.549 243 HA HIS 28 HA HIS 28 3.123 8.982 13.814 244 1HB HIS 28 HB2 HIS 28 1.913 9.498 16.555 245 2HB HIS 28 HB1 HIS 28 3.313 8.495 16.212 246 HD1 HIS 28 HD1 HIS 28 5.570 9.776 15.637 247 HD2 HIS 28 HD2 HIS 28 2.359 12.202 16.667 248 HE1 HIS 28 HE1 HIS 28 6.533 12.052 16.093 249 H ASP 29 HN ASP 29 -0.121 9.075 15.026 250 HA ASP 29 HA ASP 29 -0.602 6.315 15.274 251 1HB ASP 29 HB2 ASP 29 -2.485 8.591 14.709 252 2HB ASP 29 HB1 ASP 29 -3.032 6.939 14.971 253 H LYS 30 HN LYS 30 -0.969 8.527 12.578 254 HA LYS 30 HA LYS 30 -2.215 6.787 10.770 255 1HB LYS 30 HB2 LYS 30 -0.328 9.061 10.272 256 2HB LYS 30 HB1 LYS 30 -1.143 8.210 8.979 257 1HG LYS 30 HG2 LYS 30 -2.424 9.841 11.168 258 2HG LYS 30 HG1 LYS 30 -2.201 10.319 9.490 259 1HD LYS 30 HD2 LYS 30 -3.646 8.390 8.847 260 2HD LYS 30 HD1 LYS 30 -3.984 8.138 10.560 261 1HE LYS 30 HE2 LYS 30 -4.674 10.560 8.878 262 2HE LYS 30 HE1 LYS 30 -5.772 9.445 9.670 263 1HZ LYS 30 HZ2 LYS 30 -3.938 11.335 11.090 264 2HZ LYS 30 HZ1 LYS 30 -5.572 11.545 10.867 265 3HZ LYS 30 HZ3 LYS 30 -5.034 10.276 11.819 266 H VAL 31 HN VAL 31 1.226 7.421 11.407 267 HA VAL 31 HA VAL 31 2.330 5.839 9.405 268 HB VAL 31 HB VAL 31 3.466 6.404 12.163 269 1HG1 VAL 31 3HG1 VAL 31 4.672 4.634 11.016 270 2HG1 VAL 31 2HG1 VAL 31 4.864 5.671 9.601 271 3HG1 VAL 31 1HG1 VAL 31 5.650 6.098 11.118 272 1HG2 VAL 31 3HG2 VAL 31 2.832 8.459 11.027 273 2HG2 VAL 31 2HG2 VAL 31 4.587 8.309 11.119 274 3HG2 VAL 31 1HG2 VAL 31 3.745 7.967 9.604 275 H LEU 32 HN LEU 32 1.377 5.084 12.705 276 HA LEU 32 HA LEU 32 2.312 2.430 12.791 277 1HB LEU 32 HB2 LEU 32 -0.032 3.622 14.256 278 2HB LEU 32 HB1 LEU 32 0.822 2.155 14.695 279 HG LEU 32 HG LEU 32 1.937 4.953 14.761 280 1HD1 LEU 32 HD1 LEU 32 1.200 3.047 16.944 281 2HD1 LEU 32 HD1 LEU 32 1.978 4.618 17.166 282 3HD1 LEU 32 HD1 LEU 32 0.341 4.533 16.505 283 1HD2 LEU 32 HD2 LEU 32 3.211 2.329 15.532 284 2HD2 LEU 32 HD2 LEU 32 3.681 3.370 14.186 285 3HD2 LEU 32 HD2 LEU 32 3.887 3.923 15.849 286 H LEU 33 HN LEU 33 -0.854 3.760 12.022 287 HA LEU 33 HA LEU 33 -2.140 1.284 11.531 288 1HB LEU 33 HB2 LEU 33 -2.811 3.999 10.416 289 2HB LEU 33 HB1 LEU 33 -3.876 2.608 10.480 290 HG LEU 33 HG LEU 33 -2.795 4.053 12.900 291 1HD1 LEU 33 HD1 LEU 33 -4.305 5.467 11.646 292 2HD1 LEU 33 HD1 LEU 33 -5.511 4.180 11.629 293 3HD1 LEU 33 HD1 LEU 33 -5.049 4.937 13.154 294 1HD2 LEU 33 HD2 LEU 33 -4.898 1.906 12.634 295 2HD2 LEU 33 HD2 LEU 33 -3.298 1.708 13.348 296 3HD2 LEU 33 HD2 LEU 33 -4.488 2.752 14.122 297 H PHE 34 HN PHE 34 -0.612 3.646 9.410 298 HA PHE 34 HA PHE 34 -1.175 2.416 6.976 299 1HB PHE 34 HB2 PHE 34 -0.400 4.709 7.043 300 2HB PHE 34 HB1 PHE 34 1.123 4.218 7.767 301 HD1 PHE 34 HD1 PHE 34 -0.917 3.929 4.683 302 HD2 PHE 34 HD2 PHE 34 2.962 3.651 6.422 303 HE1 PHE 34 HE1 PHE 34 0.084 3.697 2.443 304 HE2 PHE 34 HE2 PHE 34 3.949 3.414 4.161 305 HZ PHE 34 HZ PHE 34 2.517 3.432 2.210 306 H SER 35 HN SER 35 1.702 2.142 9.056 307 HA SER 35 HA SER 35 3.118 0.519 7.294 308 1HB SER 35 HB2 SER 35 4.512 -0.045 9.319 309 2HB SER 35 HB1 SER 35 4.322 1.674 8.971 310 HG SER 35 HG SER 35 3.022 1.914 10.634 311 H ARG 36 HN ARG 36 0.939 -0.351 9.921 312 HA ARG 36 HA ARG 36 1.545 -3.115 9.653 313 1HB ARG 36 HB2 ARG 36 -0.233 -3.520 11.249 314 2HB ARG 36 HB1 ARG 36 0.793 -2.204 11.799 315 1HG ARG 36 HG2 ARG 36 -0.975 -0.659 10.829 316 2HG ARG 36 HG1 ARG 36 -1.985 -2.099 10.711 317 1HD ARG 36 HD2 ARG 36 -0.761 -0.937 13.202 318 2HD ARG 36 HD1 ARG 36 -2.464 -0.960 12.765 319 HE ARG 36 HE ARG 36 -1.021 -3.486 13.148 320 1HH1 ARG 36 1HH1 ARG 36 -3.627 -1.280 14.121 321 2HH1 ARG 36 2HH1 ARG 36 -4.221 -2.320 15.312 322 1HH2 ARG 36 1HH2 ARG 36 -1.885 -4.912 14.756 323 2HH2 ARG 36 2HH2 ARG 36 -3.267 -4.457 15.648 324 H ASP 37 HN ASP 37 -0.918 -0.999 8.300 325 HA ASP 37 HA ASP 37 -2.542 -3.110 7.226 326 1HB ASP 37 HB2 ASP 37 -3.185 -0.649 7.578 327 2HB ASP 37 HB1 ASP 37 -2.303 -0.320 6.095 328 H LEU 38 HN LEU 38 0.032 -1.073 6.058 329 HA LEU 38 HA LEU 38 0.311 -1.930 3.434 330 1HB LEU 38 HB2 LEU 38 1.443 0.005 4.107 331 2HB LEU 38 HB1 LEU 38 2.149 -0.780 5.490 332 HG LEU 38 HG LEU 38 3.762 -1.918 4.064 333 1HD1 LEU 38 HD1 LEU 38 2.394 -2.205 2.072 334 2HD1 LEU 38 HD1 LEU 38 2.486 -0.460 1.769 335 3HD1 LEU 38 HD1 LEU 38 3.955 -1.455 1.738 336 1HD2 LEU 38 HD2 LEU 38 3.523 1.027 3.554 337 2HD2 LEU 38 HD2 LEU 38 4.333 0.247 4.912 338 3HD2 LEU 38 HD2 LEU 38 4.968 0.066 3.274 339 H ASP 39 HN ASP 39 1.831 -3.157 6.386 340 HA ASP 39 HA ASP 39 3.390 -5.135 5.157 341 1HB ASP 39 HB2 ASP 39 3.713 -4.400 7.500 342 2HB ASP 39 HB1 ASP 39 2.196 -5.197 7.928 343 H LYS 40 HN LYS 40 0.150 -5.269 6.545 344 HA LYS 40 HA LYS 40 -0.348 -7.969 6.001 345 1HB LYS 40 HB2 LYS 40 -2.216 -5.642 6.366 346 2HB LYS 40 HB1 LYS 40 -2.762 -7.307 6.204 347 1HG LYS 40 HG2 LYS 40 -1.574 -7.951 8.161 348 2HG LYS 40 HG1 LYS 40 -0.844 -6.351 8.304 349 1HD LYS 40 HD2 LYS 40 -3.035 -5.393 8.727 350 2HD LYS 40 HD1 LYS 40 -3.786 -6.975 8.496 351 1HE LYS 40 HE2 LYS 40 -1.759 -6.296 10.624 352 2HE LYS 40 HE1 LYS 40 -3.502 -6.407 10.866 353 1HZ LYS 40 HZ2 LYS 40 -1.762 -8.671 9.992 354 2HZ LYS 40 HZ1 LYS 40 -2.357 -8.454 11.547 355 3HZ LYS 40 HZ3 LYS 40 -3.410 -8.746 10.280 356 H LEU 41 HN LEU 41 -0.823 -5.102 4.040 357 HA LEU 41 HA LEU 41 -2.208 -6.311 1.918 358 1HB LEU 41 HB2 LEU 41 -2.035 -3.887 2.174 359 2HB LEU 41 HB1 LEU 41 -0.306 -3.967 1.909 360 HG LEU 41 HG LEU 41 -0.706 -4.709 -0.408 361 1HD1 LEU 41 HD1 LEU 41 -3.610 -4.300 0.274 362 2HD1 LEU 41 HD1 LEU 41 -2.968 -4.520 -1.356 363 3HD1 LEU 41 HD1 LEU 41 -2.815 -5.812 -0.165 364 1HD2 LEU 41 HD2 LEU 41 -0.384 -2.346 0.079 365 2HD2 LEU 41 HD2 LEU 41 -1.511 -2.565 -1.259 366 3HD2 LEU 41 HD2 LEU 41 -2.116 -2.154 0.346 367 H ILE 42 HN ILE 42 1.201 -5.951 2.613 368 HA ILE 42 HA ILE 42 2.157 -7.143 0.226 369 HB ILE 42 HB ILE 42 3.498 -7.035 2.958 370 1HG1 ILE 42 2HG1 ILE 42 3.836 -5.259 0.543 371 2HG1 ILE 42 1HG1 ILE 42 2.966 -4.814 2.007 372 1HG2 ILE 42 3HG2 ILE 42 4.687 -7.600 0.236 373 2HG2 ILE 42 2HG2 ILE 42 5.606 -7.403 1.727 374 3HG2 ILE 42 1HG2 ILE 42 4.497 -8.763 1.548 375 1HD1 ILE 42 HD1 ILE 42 5.047 -5.033 3.268 376 2HD1 ILE 42 HD1 ILE 42 5.908 -5.404 1.776 377 3HD1 ILE 42 HD1 ILE 42 5.161 -3.816 1.992 378 H ASN 43 HN ASN 43 1.730 -8.437 3.488 379 HA ASN 43 HA ASN 43 2.349 -11.128 3.102 380 1HB ASN 43 HB2 ASN 43 0.049 -10.195 4.840 381 2HB ASN 43 HB1 ASN 43 0.933 -11.695 5.002 382 1HD2 ASN 43 HD2 ASN 43 3.562 -10.080 4.608 383 2HD2 ASN 43 HD2 ASN 43 3.723 -9.283 6.126 384 H LYS 44 HN LYS 44 -0.645 -9.443 2.500 385 HA LYS 44 HA LYS 44 -2.402 -11.496 1.857 386 1HB LYS 44 HB2 LYS 44 -3.043 -9.161 2.157 387 2HB LYS 44 HB1 LYS 44 -2.163 -8.713 0.714 388 1HG LYS 44 HG2 LYS 44 -3.770 -10.266 -0.549 389 2HG LYS 44 HG1 LYS 44 -4.720 -10.251 0.944 390 1HD LYS 44 HD2 LYS 44 -3.906 -7.784 -0.565 391 2HD LYS 44 HD1 LYS 44 -5.468 -8.583 -0.708 392 1HE LYS 44 HE2 LYS 44 -4.342 -7.467 1.868 393 2HE LYS 44 HE1 LYS 44 -5.478 -6.640 0.808 394 1HZ LYS 44 HZ2 LYS 44 -6.014 -9.234 2.149 395 2HZ LYS 44 HZ1 LYS 44 -6.574 -7.723 2.659 396 3HZ LYS 44 HZ3 LYS 44 -7.084 -8.358 1.183 397 H PHE 45 HN PHE 45 -0.259 -9.620 -0.261 398 HA PHE 45 HA PHE 45 -0.974 -11.164 -2.527 399 1HB PHE 45 HB2 PHE 45 0.934 -8.916 -2.105 400 2HB PHE 45 HB1 PHE 45 0.999 -9.855 -3.599 401 HD1 PHE 45 HD1 PHE 45 -1.039 -7.584 -1.573 402 HD2 PHE 45 HD2 PHE 45 -0.760 -9.800 -5.180 403 HE1 PHE 45 HE1 PHE 45 -2.978 -6.364 -2.466 404 HE2 PHE 45 HE2 PHE 45 -2.689 -8.601 -6.079 405 HZ PHE 45 HZ PHE 45 -3.805 -6.869 -4.724 406 H MET 46 HN MET 46 1.616 -11.228 -0.262 407 HA MET 46 HA MET 46 3.378 -12.958 -1.688 408 1HB MET 46 HB2 MET 46 3.016 -12.866 1.315 409 2HB MET 46 HB1 MET 46 4.428 -13.445 0.447 410 1HG MET 46 HG2 MET 46 4.796 -11.081 -0.341 411 2HG MET 46 HG1 MET 46 3.424 -10.626 0.636 412 1HE MET 46 HE3 MET 46 6.318 -13.178 1.325 413 2HE MET 46 HE2 MET 46 7.127 -11.775 0.630 414 3HE MET 46 HE1 MET 46 7.401 -12.197 2.311 415 H ASN 47 HN ASN 47 0.494 -13.397 0.084 416 HA ASN 47 HA ASN 47 -0.838 -15.058 0.689 417 1HB ASN 47 HB2 ASN 47 -0.870 -15.507 -1.805 418 2HB ASN 47 HB1 ASN 47 0.420 -16.673 -1.566 419 1HD2 ASN 47 HD2 ASN 47 -2.253 -17.060 -2.646 420 2HD2 ASN 47 HD2 ASN 47 -3.042 -18.234 -1.664 421 H VAL 48 HN VAL 48 0.306 -15.075 2.572 422 HA VAL 48 HA VAL 48 2.116 -17.322 2.896 423 HB VAL 48 HB VAL 48 2.815 -16.231 5.048 424 1HG1 VAL 48 3HG1 VAL 48 3.187 -14.603 2.536 425 2HG1 VAL 48 2HG1 VAL 48 4.188 -14.482 3.986 426 3HG1 VAL 48 1HG1 VAL 48 4.164 -15.976 3.049 427 1HG2 VAL 48 2HG2 VAL 48 0.829 -14.839 5.428 428 2HG2 VAL 48 1HG2 VAL 48 2.291 -13.856 5.400 429 3HG2 VAL 48 3HG2 VAL 48 1.222 -13.886 3.999 430 H LYS 49 HN LYS 49 1.647 -18.917 4.121 431 HA LYS 49 HA LYS 49 -0.851 -18.803 5.629 432 1HB LYS 49 HB2 LYS 49 0.552 -21.222 4.454 433 2HB LYS 49 HB1 LYS 49 -1.037 -21.198 5.214 434 1HG LYS 49 HG2 LYS 49 -1.932 -19.860 3.409 435 2HG LYS 49 HG1 LYS 49 -0.346 -19.717 2.672 436 1HD LYS 49 HD2 LYS 49 -0.310 -22.207 2.424 437 2HD LYS 49 HD1 LYS 49 -1.966 -22.243 3.023 438 1HE LYS 49 HE2 LYS 49 -1.937 -22.346 0.583 439 2HE LYS 49 HE1 LYS 49 -2.677 -20.848 1.133 440 1HZ LYS 49 HZ1 LYS 49 0.179 -20.994 0.356 441 2HZ LYS 49 HZ3 LYS 49 -1.026 -20.751 -0.760 442 3HZ LYS 49 HZ2 LYS 49 -0.812 -19.603 0.436 443 H ASP 50 HN ASP 50 0.121 -17.996 7.441 444 HA ASP 50 HA ASP 50 2.169 -19.679 8.661 445 1HB ASP 50 HB2 ASP 50 3.411 -17.852 7.819 446 2HB ASP 50 HB1 ASP 50 2.198 -16.688 8.320 447 H LYS 51 HN LYS 51 2.379 -19.577 10.813 448 HA LYS 51 HA LYS 51 0.152 -19.996 12.350 449 1HB LYS 51 HB2 LYS 51 1.820 -20.022 14.247 450 2HB LYS 51 HB1 LYS 51 2.138 -21.101 12.890 451 1HG LYS 51 HG2 LYS 51 3.615 -19.233 11.959 452 2HG LYS 51 HG1 LYS 51 3.482 -18.503 13.551 453 1HD LYS 51 HD2 LYS 51 4.567 -20.338 14.576 454 2HD LYS 51 HD1 LYS 51 4.430 -21.315 13.108 455 1HE LYS 51 HE2 LYS 51 6.083 -18.799 13.409 456 2HE LYS 51 HE1 LYS 51 6.703 -20.452 13.363 457 1HZ LYS 51 HZ3 LYS 51 5.727 -20.613 11.086 458 2HZ LYS 51 HZ2 LYS 51 5.319 -18.997 11.152 459 3HZ LYS 51 HZ1 LYS 51 6.932 -19.428 11.204 460 H VAL 52 HN VAL 52 1.827 -17.142 12.099 461 HA VAL 52 HA VAL 52 0.064 -16.004 14.167 462 HB VAL 52 HB VAL 52 1.545 -14.121 14.449 463 1HG1 VAL 52 3HG1 VAL 52 2.931 -16.772 14.715 464 2HG1 VAL 52 2HG1 VAL 52 3.443 -15.292 15.523 465 3HG1 VAL 52 1HG1 VAL 52 1.870 -16.004 15.894 466 1HG2 VAL 52 3HG2 VAL 52 2.549 -13.936 12.251 467 2HG2 VAL 52 2HG2 VAL 52 3.818 -14.082 13.471 468 3HG2 VAL 52 1HG2 VAL 52 3.379 -15.472 12.476 469 H HIS 53 HN HIS 53 0.521 -16.038 10.919 470 HA HIS 53 HA HIS 53 -0.587 -13.403 10.434 471 1HB HIS 53 HB2 HIS 53 0.309 -15.590 8.561 472 2HB HIS 53 HB1 HIS 53 -0.495 -14.136 7.993 473 HD1 HIS 53 HD1 HIS 53 2.716 -15.089 9.905 474 HD2 HIS 53 HD2 HIS 53 1.146 -12.073 7.495 475 HE1 HIS 53 HE1 HIS 53 4.601 -13.515 9.437 476 H LYS 54 HN LYS 54 -1.714 -16.498 10.930 477 HA LYS 54 HA LYS 54 -4.411 -15.646 10.205 478 1HB LYS 54 HB2 LYS 54 -3.167 -18.290 9.445 479 2HB LYS 54 HB1 LYS 54 -4.898 -18.004 9.441 480 1HG LYS 54 HG2 LYS 54 -4.562 -16.213 7.770 481 2HG LYS 54 HG1 LYS 54 -2.842 -16.588 7.750 482 1HD LYS 54 HD2 LYS 54 -3.988 -17.640 5.861 483 2HD LYS 54 HD1 LYS 54 -3.352 -18.857 6.964 484 1HE LYS 54 HE2 LYS 54 -5.618 -19.414 6.185 485 2HE LYS 54 HE1 LYS 54 -5.572 -19.188 7.925 486 1HZ LYS 54 HZ1 LYS 54 -6.493 -17.153 5.957 487 2HZ LYS 54 HZ3 LYS 54 -7.496 -18.145 6.862 488 3HZ LYS 54 HZ2 LYS 54 -6.554 -16.995 7.636 489 H LEU 55 HN LEU 55 -6.049 -16.539 11.473 490 HA LEU 55 HA LEU 55 -5.257 -18.304 13.608 491 1HB LEU 55 HB2 LEU 55 -6.152 -16.933 15.368 492 2HB LEU 55 HB1 LEU 55 -4.973 -16.032 14.437 493 HG LEU 55 HG LEU 55 -7.953 -15.642 14.089 494 1HD1 LEU 55 HD1 LEU 55 -6.034 -14.116 15.834 495 2HD1 LEU 55 HD1 LEU 55 -7.700 -13.656 15.498 496 3HD1 LEU 55 HD1 LEU 55 -7.359 -15.143 16.384 497 1HD2 LEU 55 HD2 LEU 55 -5.583 -13.898 13.364 498 2HD2 LEU 55 HD2 LEU 55 -6.555 -14.835 12.229 499 3HD2 LEU 55 HD2 LEU 55 -7.279 -13.491 13.114 500 H GLU 56 HN GLU 56 -6.689 -19.888 13.737 501 HA GLU 56 HA GLU 56 -9.419 -19.342 12.827 502 1HB GLU 56 HB2 GLU 56 -9.669 -21.800 12.566 503 2HB GLU 56 HB1 GLU 56 -8.417 -21.121 11.540 504 1HG GLU 56 HG2 GLU 56 -6.709 -21.953 13.046 505 2HG GLU 56 HG1 GLU 56 -7.954 -22.573 14.137 506 H HIS 57 HN HIS 57 -7.696 -19.474 15.528 507 HA HIS 57 HA HIS 57 -9.492 -20.935 17.216 508 1HB HIS 57 HB2 HIS 57 -7.239 -19.040 17.842 509 2HB HIS 57 HB1 HIS 57 -8.235 -19.777 19.085 510 HD1 HIS 57 HD1 HIS 57 -5.018 -20.253 17.812 511 HD2 HIS 57 HD2 HIS 57 -8.243 -22.825 18.344 512 HE1 HIS 57 HE1 HIS 57 -4.059 -22.555 17.933 513 H HIS 58 HN HIS 58 -10.931 -20.127 18.685 514 HA HIS 58 HA HIS 58 -12.134 -17.661 17.839 515 1HB HIS 58 HB2 HIS 58 -13.974 -18.223 19.455 516 2HB HIS 58 HB1 HIS 58 -13.689 -19.469 18.254 517 HD1 HIS 58 HD1 HIS 58 -13.816 -18.918 21.958 518 HD2 HIS 58 HD2 HIS 58 -12.500 -21.845 19.295 519 HE1 HIS 58 HE1 HIS 58 -13.475 -21.001 23.302 520 H HIS 59 HN HIS 59 -10.229 -18.861 20.392 521 HA HIS 59 HA HIS 59 -9.074 -17.991 22.041 522 1HB HIS 59 HB2 HIS 59 -9.678 -15.345 20.744 523 2HB HIS 59 HB1 HIS 59 -8.613 -15.520 22.138 524 HD1 HIS 59 HD1 HIS 59 -6.526 -17.315 21.622 525 HD2 HIS 59 HD2 HIS 59 -8.402 -15.503 18.394 526 HE1 HIS 59 HE1 HIS 59 -4.965 -17.572 19.670 527 H HIS 60 HN HIS 60 -12.062 -16.229 21.686 528 HA HIS 60 HA HIS 60 -12.234 -15.771 24.518 529 1HB HIS 60 HB2 HIS 60 -14.354 -15.465 22.378 530 2HB HIS 60 HB1 HIS 60 -14.485 -14.882 24.034 531 HD1 HIS 60 HD1 HIS 60 -13.196 -13.955 20.684 532 HD2 HIS 60 HD2 HIS 60 -12.734 -12.687 24.618 533 HE1 HIS 60 HE1 HIS 60 -12.141 -11.691 20.561 534 H HIS 61 HN HIS 61 -12.213 -17.701 25.526 535 HA HIS 61 HA HIS 61 -14.081 -19.775 24.708 536 1HB HIS 61 HB2 HIS 61 -12.975 -21.215 26.395 537 2HB HIS 61 HB1 HIS 61 -11.801 -20.504 25.306 538 HD1 HIS 61 HD1 HIS 61 -12.784 -20.630 28.907 539 HD2 HIS 61 HD2 HIS 61 -10.104 -18.590 26.483 540 HE1 HIS 61 HE1 HIS 61 -11.142 -19.530 30.460 541 H HIS 62 HN HIS 62 -13.769 -17.300 27.000 542 HA HIS 62 HA HIS 62 -16.347 -18.088 28.102 543 1HB HIS 62 HB2 HIS 62 -14.439 -18.380 29.767 544 2HB HIS 62 HB1 HIS 62 -14.142 -16.653 29.613 545 HD1 HIS 62 HD1 HIS 62 -15.762 -18.922 31.817 546 HD2 HIS 62 HD2 HIS 62 -16.729 -15.179 30.304 547 HE1 HIS 62 HE1 HIS 62 -17.490 -17.972 33.368 548 H1 MET 101 HT2 MET 101 11.831 22.440 2.444 549 H2 MET 101 HT1 MET 101 10.919 23.738 1.900 550 H3 MET 101 HT3 MET 101 10.935 23.343 3.544 551 HA MET 101 HA MET 101 9.871 21.253 3.040 552 1HB MET 101 HB2 MET 101 8.397 23.113 3.575 553 2HB MET 101 HB1 MET 101 8.485 23.710 1.928 554 1HG MET 101 HG2 MET 101 6.354 22.615 2.374 555 2HG MET 101 HG1 MET 101 7.265 21.780 1.122 556 1HE MET 101 HE2 MET 101 5.994 21.706 4.832 557 2HE MET 101 HE1 MET 101 6.763 20.245 5.454 558 3HE MET 101 HE3 MET 101 7.742 21.656 5.056 559 H GLU 102 HN GLU 102 9.551 19.677 1.620 560 HA GLU 102 HA GLU 102 9.720 20.295 -1.229 561 1HB GLU 102 HB2 GLU 102 10.824 18.059 -1.513 562 2HB GLU 102 HB1 GLU 102 11.828 19.258 -0.704 563 1HG GLU 102 HG2 GLU 102 11.601 18.219 1.363 564 2HG GLU 102 HG1 GLU 102 10.172 17.327 0.851 565 H MET 103 HN MET 103 8.165 19.356 -2.402 566 HA MET 103 HA MET 103 6.569 17.286 -1.087 567 1HB MET 103 HB2 MET 103 5.499 19.467 -2.887 568 2HB MET 103 HB1 MET 103 4.567 18.111 -2.249 569 1HG MET 103 HG2 MET 103 5.031 18.877 0.022 570 2HG MET 103 HG1 MET 103 5.903 20.254 -0.624 571 1HE MET 103 HE3 MET 103 4.459 21.900 0.802 572 2HE MET 103 HE2 MET 103 2.696 21.914 0.807 573 3HE MET 103 HE1 MET 103 3.568 20.536 1.481 574 H GLY 104 HN GLY 104 7.586 18.608 -4.214 575 1HA GLY 104 HA1 GLY 104 7.925 17.566 -6.228 576 2HA GLY 104 HA2 GLY 104 6.764 16.350 -5.705 577 H GLN 105 HN GLN 105 9.837 17.307 -4.255 578 HA GLN 105 HA GLN 105 11.325 15.033 -5.131 579 1HB GLN 105 HB2 GLN 105 11.842 16.726 -2.672 580 2HB GLN 105 HB1 GLN 105 12.989 15.685 -3.497 581 1HG GLN 105 HG2 GLN 105 13.005 17.124 -5.419 582 2HG GLN 105 HG1 GLN 105 11.745 18.136 -4.731 583 1HE2 GLN 105 1HE2 GLN 105 14.419 16.805 -2.869 584 2HE2 GLN 105 2HE2 GLN 105 15.208 18.305 -2.603 585 H LEU 106 HN LEU 106 9.089 15.604 -2.662 586 HA LEU 106 HA LEU 106 9.799 13.381 -1.000 587 1HB LEU 106 HB2 LEU 106 8.872 15.409 -0.001 588 2HB LEU 106 HB1 LEU 106 7.465 15.303 -1.020 589 HG LEU 106 HG LEU 106 7.207 14.750 1.456 590 1HD1 LEU 106 HD1 LEU 106 6.240 12.764 -0.580 591 2HD1 LEU 106 HD1 LEU 106 5.597 12.970 1.045 592 3HD1 LEU 106 HD1 LEU 106 5.451 14.278 -0.121 593 1HD2 LEU 106 HD2 LEU 106 9.162 13.308 1.709 594 2HD2 LEU 106 HD2 LEU 106 7.680 12.437 2.106 595 3HD2 LEU 106 HD2 LEU 106 8.477 12.166 0.557 596 H LYS 107 HN LYS 107 7.081 14.205 -3.159 597 HA LYS 107 HA LYS 107 5.888 11.685 -3.070 598 1HB LYS 107 HB2 LYS 107 5.504 14.139 -4.542 599 2HB LYS 107 HB1 LYS 107 5.235 12.741 -5.572 600 1HG LYS 107 HG2 LYS 107 3.935 13.113 -2.879 601 2HG LYS 107 HG1 LYS 107 3.186 13.586 -4.407 602 1HD LYS 107 HD2 LYS 107 4.201 10.802 -3.934 603 2HD LYS 107 HD1 LYS 107 2.560 11.264 -3.445 604 1HE LYS 107 HE2 LYS 107 3.746 11.458 -6.201 605 2HE LYS 107 HE1 LYS 107 2.688 10.163 -5.652 606 1HZ LYS 107 HZ1 LYS 107 0.947 11.841 -5.290 607 2HZ LYS 107 HZ3 LYS 107 1.940 13.051 -5.911 608 3HZ LYS 107 HZ2 LYS 107 1.432 11.796 -6.891 609 H ASN 108 HN ASN 108 8.365 12.992 -5.171 610 HA ASN 108 HA ASN 108 8.504 10.840 -6.923 611 1HB ASN 108 HB2 ASN 108 9.713 12.883 -7.425 612 2HB ASN 108 HB1 ASN 108 10.711 12.691 -5.991 613 1HD2 ASN 108 HD2 ASN 108 12.487 11.363 -6.077 614 2HD2 ASN 108 HD2 ASN 108 13.020 10.582 -7.508 615 H LYS 109 HN LYS 109 10.138 11.371 -3.819 616 HA LYS 109 HA LYS 109 11.518 8.924 -3.840 617 1HB LYS 109 HB2 LYS 109 10.685 10.697 -1.570 618 2HB LYS 109 HB1 LYS 109 11.471 9.156 -1.279 619 1HG LYS 109 HG2 LYS 109 13.359 9.984 -2.732 620 2HG LYS 109 HG1 LYS 109 12.583 11.571 -2.668 621 1HD LYS 109 HD2 LYS 109 13.391 9.979 -0.230 622 2HD LYS 109 HD1 LYS 109 14.389 11.229 -0.966 623 1HE LYS 109 HE2 LYS 109 11.591 11.689 0.057 624 2HE LYS 109 HE1 LYS 109 13.055 11.979 0.993 625 1HZ LYS 109 HZ3 LYS 109 12.453 13.276 -1.612 626 2HZ LYS 109 HZ2 LYS 109 12.218 14.010 -0.118 627 3HZ LYS 109 HZ1 LYS 109 13.764 13.579 -0.595 628 H ILE 110 HN ILE 110 8.422 9.784 -2.325 629 HA ILE 110 HA ILE 110 7.689 7.311 -1.380 630 HB ILE 110 HB ILE 110 5.890 9.425 -2.618 631 1HG1 ILE 110 2HG1 ILE 110 6.427 8.643 0.240 632 2HG1 ILE 110 1HG1 ILE 110 7.085 10.079 -0.553 633 1HG2 ILE 110 3HG2 ILE 110 4.750 7.260 -2.764 634 2HG2 ILE 110 2HG2 ILE 110 5.051 6.979 -1.050 635 3HG2 ILE 110 1HG2 ILE 110 3.987 8.294 -1.550 636 1HD1 ILE 110 HD1 ILE 110 4.780 10.925 -0.770 637 2HD1 ILE 110 HD1 ILE 110 4.199 9.494 0.080 638 3HD1 ILE 110 HD1 ILE 110 5.257 10.642 0.904 639 H GLU 111 HN GLU 111 6.989 8.521 -4.667 640 HA GLU 111 HA GLU 111 5.826 6.161 -5.599 641 1HB GLU 111 HB2 GLU 111 7.356 8.241 -7.173 642 2HB GLU 111 HB1 GLU 111 6.406 6.957 -7.889 643 1HG GLU 111 HG2 GLU 111 5.373 9.193 -6.167 644 2HG GLU 111 HG1 GLU 111 5.178 9.051 -7.909 645 H ASN 112 HN ASN 112 9.176 7.269 -5.982 646 HA ASN 112 HA ASN 112 10.094 5.028 -7.373 647 1HB ASN 112 HB2 ASN 112 11.483 6.933 -7.489 648 2HB ASN 112 HB1 ASN 112 11.540 7.102 -5.738 649 1HD2 ASN 112 HD2 ASN 112 13.087 6.045 -4.603 650 2HD2 ASN 112 HD2 ASN 112 14.237 4.963 -5.270 651 H LYS 113 HN LYS 113 10.158 5.643 -3.892 652 HA LYS 113 HA LYS 113 11.682 3.332 -3.292 653 1HB LYS 113 HB2 LYS 113 11.339 5.457 -1.876 654 2HB LYS 113 HB1 LYS 113 9.821 4.739 -1.389 655 1HG LYS 113 HG2 LYS 113 11.518 4.350 0.282 656 2HG LYS 113 HG1 LYS 113 11.015 2.826 -0.445 657 1HD LYS 113 HD2 LYS 113 13.422 2.859 -0.193 658 2HD LYS 113 HD1 LYS 113 13.019 2.880 -1.904 659 1HE LYS 113 HE2 LYS 113 14.814 4.386 -1.551 660 2HE LYS 113 HE1 LYS 113 13.374 5.349 -1.849 661 1HZ LYS 113 HZ3 LYS 113 13.203 5.716 0.594 662 2HZ LYS 113 HZ2 LYS 113 14.613 4.830 0.824 663 3HZ LYS 113 HZ1 LYS 113 14.661 6.253 -0.030 664 H LYS 114 HN LYS 114 8.239 4.041 -3.347 665 HA LYS 114 HA LYS 114 7.149 1.666 -2.449 666 1HB LYS 114 HB2 LYS 114 5.899 3.713 -2.838 667 2HB LYS 114 HB1 LYS 114 6.284 3.636 -4.545 668 1HG LYS 114 HG2 LYS 114 4.900 1.628 -4.749 669 2HG LYS 114 HG1 LYS 114 4.522 1.729 -3.025 670 1HD LYS 114 HD2 LYS 114 2.685 2.739 -4.233 671 2HD LYS 114 HD1 LYS 114 3.617 4.004 -3.424 672 1HE LYS 114 HE2 LYS 114 4.812 4.400 -5.600 673 2HE LYS 114 HE1 LYS 114 3.694 3.230 -6.296 674 1HZ LYS 114 HZ2 LYS 114 2.802 5.715 -4.935 675 2HZ LYS 114 HZ1 LYS 114 3.059 5.642 -6.569 676 3HZ LYS 114 HZ3 LYS 114 1.839 4.732 -5.873 677 H LYS 115 HN LYS 115 8.086 2.746 -5.691 678 HA LYS 115 HA LYS 115 7.353 0.388 -7.034 679 1HB LYS 115 HB2 LYS 115 9.344 2.510 -7.830 680 2HB LYS 115 HB1 LYS 115 8.750 1.235 -8.892 681 1HG LYS 115 HG2 LYS 115 6.510 2.089 -8.757 682 2HG LYS 115 HG1 LYS 115 6.996 3.282 -7.562 683 1HD LYS 115 HD2 LYS 115 6.889 4.517 -9.515 684 2HD LYS 115 HD1 LYS 115 8.604 4.146 -9.389 685 1HE LYS 115 HE2 LYS 115 6.585 2.738 -11.156 686 2HE LYS 115 HE1 LYS 115 7.772 3.913 -11.686 687 1HZ LYS 115 HZ1 LYS 115 9.530 2.291 -11.032 688 2HZ LYS 115 HZ3 LYS 115 8.311 1.169 -10.662 689 3HZ LYS 115 HZ2 LYS 115 8.479 1.736 -12.217 690 H GLU 116 HN GLU 116 10.445 1.398 -5.651 691 HA GLU 116 HA GLU 116 11.980 -0.826 -6.397 692 1HB GLU 116 HB2 GLU 116 12.131 0.894 -3.906 693 2HB GLU 116 HB1 GLU 116 13.288 -0.374 -4.267 694 1HG GLU 116 HG2 GLU 116 13.864 0.829 -6.353 695 2HG GLU 116 HG1 GLU 116 12.760 2.119 -5.870 696 H LEU 117 HN LEU 117 9.798 -0.364 -3.722 697 HA LEU 117 HA LEU 117 10.274 -2.871 -2.513 698 1HB LEU 117 HB2 LEU 117 9.453 -1.160 -1.116 699 2HB LEU 117 HB1 LEU 117 8.172 -0.751 -2.220 700 HG LEU 117 HG LEU 117 7.431 -1.824 -0.070 701 1HD1 LEU 117 HD1 LEU 117 5.987 -1.640 -1.823 702 2HD1 LEU 117 HD1 LEU 117 6.557 -3.151 -2.523 703 3HD1 LEU 117 HD1 LEU 117 5.736 -3.160 -0.947 704 1HD2 LEU 117 HD2 LEU 117 8.645 -4.298 -1.252 705 2HD2 LEU 117 HD2 LEU 117 9.207 -3.456 0.196 706 3HD2 LEU 117 HD2 LEU 117 7.608 -4.213 0.176 707 H ILE 118 HN ILE 118 7.789 -1.685 -4.721 708 HA ILE 118 HA ILE 118 6.163 -3.886 -4.745 709 HB ILE 118 HB ILE 118 6.790 -2.000 -7.042 710 1HG1 ILE 118 2HG1 ILE 118 4.346 -2.113 -5.282 711 2HG1 ILE 118 1HG1 ILE 118 5.742 -1.116 -4.899 712 1HG2 ILE 118 2HG2 ILE 118 5.869 -4.100 -7.956 713 2HG2 ILE 118 1HG2 ILE 118 4.496 -3.984 -6.873 714 3HG2 ILE 118 3HG2 ILE 118 4.728 -2.779 -8.139 715 1HD1 ILE 118 HD1 ILE 118 4.087 -0.904 -7.398 716 2HD1 ILE 118 HD1 ILE 118 3.962 0.151 -5.979 717 3HD1 ILE 118 HD1 ILE 118 5.440 0.122 -6.936 718 H GLN 119 HN GLN 119 9.039 -3.216 -6.621 719 HA GLN 119 HA GLN 119 8.995 -5.546 -8.216 720 1HB GLN 119 HB2 GLN 119 11.331 -3.800 -7.428 721 2HB GLN 119 HB1 GLN 119 11.362 -5.023 -8.690 722 1HG GLN 119 HG2 GLN 119 9.645 -3.797 -9.928 723 2HG GLN 119 HG1 GLN 119 9.616 -2.571 -8.662 724 1HE2 GLN 119 1HE2 GLN 119 11.339 -3.864 -11.325 725 2HE2 GLN 119 2HE2 GLN 119 12.490 -2.588 -11.490 726 H LEU 120 HN LEU 120 10.200 -4.900 -5.005 727 HA LEU 120 HA LEU 120 11.657 -7.338 -4.750 728 1HB LEU 120 HB2 LEU 120 10.601 -5.456 -2.643 729 2HB LEU 120 HB1 LEU 120 11.574 -6.866 -2.286 730 HG LEU 120 HG LEU 120 12.469 -4.468 -3.890 731 1HD1 LEU 120 HD1 LEU 120 12.248 -3.992 -1.516 732 2HD1 LEU 120 HD1 LEU 120 13.229 -5.406 -1.132 733 3HD1 LEU 120 HD1 LEU 120 13.943 -4.045 -1.993 734 1HD2 LEU 120 HD2 LEU 120 13.963 -6.954 -3.050 735 2HD2 LEU 120 HD2 LEU 120 13.548 -6.493 -4.699 736 3HD2 LEU 120 HD2 LEU 120 14.701 -5.528 -3.774 737 H VAL 121 HN VAL 121 8.436 -6.294 -3.521 738 HA VAL 121 HA VAL 121 7.625 -8.798 -2.581 739 HB VAL 121 HB VAL 121 5.834 -6.792 -3.972 740 1HG1 VAL 121 1HG1 VAL 121 4.788 -8.943 -3.526 741 2HG1 VAL 121 3HG1 VAL 121 5.211 -8.814 -1.819 742 3HG1 VAL 121 2HG1 VAL 121 4.070 -7.672 -2.538 743 1HG2 VAL 121 1HG2 VAL 121 6.727 -6.859 -1.097 744 2HG2 VAL 121 3HG2 VAL 121 7.147 -5.657 -2.322 745 3HG2 VAL 121 2HG2 VAL 121 5.478 -5.797 -1.761 746 H ALA 122 HN ALA 122 7.486 -7.424 -5.814 747 HA ALA 122 HA ALA 122 6.043 -9.415 -7.100 748 1HB ALA 122 HB2 ALA 122 8.220 -7.686 -8.244 749 2HB ALA 122 HB1 ALA 122 6.976 -8.536 -9.175 750 3HB ALA 122 HB3 ALA 122 6.528 -7.231 -8.071 751 H ARG 123 HN ARG 123 9.575 -9.075 -6.745 752 HA ARG 123 HA ARG 123 10.066 -11.550 -8.088 753 1HB ARG 123 HB2 ARG 123 12.402 -11.231 -7.575 754 2HB ARG 123 HB1 ARG 123 11.709 -9.735 -8.177 755 1HG ARG 123 HG2 ARG 123 11.601 -8.851 -5.960 756 2HG ARG 123 HG1 ARG 123 12.203 -10.362 -5.277 757 1HD ARG 123 HD2 ARG 123 13.682 -8.556 -7.195 758 2HD ARG 123 HD1 ARG 123 13.993 -8.701 -5.464 759 HE ARG 123 HE ARG 123 14.209 -11.245 -6.455 760 1HH1 ARG 123 1HH1 ARG 123 15.826 -8.165 -7.130 761 2HH1 ARG 123 2HH1 ARG 123 17.309 -8.881 -7.540 762 1HH2 ARG 123 1HH2 ARG 123 16.257 -12.236 -7.056 763 2HH2 ARG 123 2HH2 ARG 123 17.556 -11.246 -7.498 764 H HIS 124 HN HIS 124 8.850 -11.016 -5.110 765 HA HIS 124 HA HIS 124 10.151 -13.175 -3.766 766 1HB HIS 124 HB2 HIS 124 9.028 -11.482 -2.427 767 2HB HIS 124 HB1 HIS 124 7.495 -11.785 -3.210 768 HD1 HIS 124 HD1 HIS 124 10.021 -13.678 -0.963 769 HD2 HIS 124 HD2 HIS 124 6.026 -13.594 -1.998 770 HE1 HIS 124 HE1 HIS 124 8.921 -15.385 0.512 771 H GLY 125 HN GLY 125 7.575 -12.783 -6.007 772 1HA GLY 125 HA1 GLY 125 6.897 -15.622 -5.782 773 2HA GLY 125 HA2 GLY 125 7.526 -15.014 -7.304 774 H LEU 126 HN LEU 126 6.191 -12.518 -7.394 775 HA LEU 126 HA LEU 126 3.383 -13.300 -7.316 776 1HB LEU 126 HB2 LEU 126 4.653 -10.625 -7.783 777 2HB LEU 126 HB1 LEU 126 2.948 -10.890 -7.942 778 HG LEU 126 HG LEU 126 4.628 -11.018 -5.559 779 1HD1 LEU 126 HD1 LEU 126 2.280 -9.292 -6.249 780 2HD1 LEU 126 HD1 LEU 126 3.009 -9.367 -4.649 781 3HD1 LEU 126 HD1 LEU 126 3.965 -8.810 -6.028 782 1HD2 LEU 126 HD2 LEU 126 1.793 -11.972 -5.754 783 2HD2 LEU 126 HD2 LEU 126 3.221 -12.898 -5.295 784 3HD2 LEU 126 HD2 LEU 126 2.619 -11.633 -4.231 785 H ASP 127 HN ASP 127 2.097 -13.165 -8.958 786 HA ASP 127 HA ASP 127 3.214 -13.613 -11.606 787 1HB ASP 127 HB2 ASP 127 1.157 -14.855 -10.719 788 2HB ASP 127 HB1 ASP 127 0.302 -13.332 -10.803 789 H HIS 128 HN HIS 128 2.162 -12.257 -13.439 790 HA HIS 128 HA HIS 128 2.887 -9.595 -13.069 791 1HB HIS 128 HB2 HIS 128 2.719 -10.898 -15.247 792 2HB HIS 128 HB1 HIS 128 0.993 -10.622 -15.174 793 HD1 HIS 128 HD1 HIS 128 4.216 -8.795 -15.784 794 HD2 HIS 128 HD2 HIS 128 0.135 -8.075 -15.839 795 HE1 HIS 128 HE1 HIS 128 3.911 -6.536 -16.894 796 H ASP 129 HN ASP 129 -0.198 -11.243 -12.698 797 HA ASP 129 HA ASP 129 -1.780 -8.863 -12.710 798 1HB ASP 129 HB2 ASP 129 -3.640 -10.193 -12.208 799 2HB ASP 129 HB1 ASP 129 -2.582 -11.353 -12.989 800 H LYS 130 HN LYS 130 -0.153 -10.701 -10.327 801 HA LYS 130 HA LYS 130 -1.270 -9.496 -8.018 802 1HB LYS 130 HB2 LYS 130 1.232 -11.043 -8.499 803 2HB LYS 130 HB1 LYS 130 0.828 -10.557 -6.882 804 1HG LYS 130 HG2 LYS 130 -0.702 -12.382 -8.749 805 2HG LYS 130 HG1 LYS 130 0.160 -12.851 -7.284 806 1HD LYS 130 HD2 LYS 130 -1.439 -11.665 -5.912 807 2HD LYS 130 HD1 LYS 130 -2.249 -11.016 -7.341 808 1HE LYS 130 HE2 LYS 130 -2.052 -13.919 -6.588 809 2HE LYS 130 HE1 LYS 130 -3.465 -12.888 -6.367 810 1HZ LYS 130 HZ3 LYS 130 -2.238 -13.524 -9.010 811 2HZ LYS 130 HZ2 LYS 130 -3.644 -14.228 -8.409 812 3HZ LYS 130 HZ1 LYS 130 -3.579 -12.587 -8.775 813 H VAL 131 HN VAL 131 1.689 -8.904 -9.816 814 HA VAL 131 HA VAL 131 2.672 -6.849 -8.210 815 HB VAL 131 HB VAL 131 2.970 -6.994 -11.220 816 1HG1 VAL 131 2HG1 VAL 131 3.819 -4.958 -10.259 817 2HG1 VAL 131 1HG1 VAL 131 4.792 -5.882 -9.113 818 3HG1 VAL 131 3HG1 VAL 131 5.144 -5.973 -10.838 819 1HG2 VAL 131 3HG2 VAL 131 4.521 -8.496 -9.118 820 2HG2 VAL 131 2HG2 VAL 131 3.428 -9.181 -10.314 821 3HG2 VAL 131 1HG2 VAL 131 4.937 -8.420 -10.839 822 H LEU 132 HN LEU 132 0.428 -6.799 -10.959 823 HA LEU 132 HA LEU 132 0.133 -3.972 -11.095 824 1HB LEU 132 HB2 LEU 132 -1.840 -6.076 -11.948 825 2HB LEU 132 HB1 LEU 132 -1.851 -4.395 -12.430 826 HG LEU 132 HG LEU 132 0.122 -6.515 -13.205 827 1HD1 LEU 132 HD1 LEU 132 -1.828 -4.869 -14.778 828 2HD1 LEU 132 HD1 LEU 132 -0.656 -6.006 -15.461 829 3HD1 LEU 132 HD1 LEU 132 -1.940 -6.588 -14.400 830 1HD2 LEU 132 HD2 LEU 132 0.221 -3.554 -13.797 831 2HD2 LEU 132 HD2 LEU 132 1.363 -4.491 -12.821 832 3HD2 LEU 132 HD2 LEU 132 1.236 -4.793 -14.552 833 H LEU 133 HN LEU 133 -1.833 -6.440 -9.512 834 HA LEU 133 HA LEU 133 -3.731 -4.617 -8.507 835 1HB LEU 133 HB2 LEU 133 -2.944 -7.363 -7.598 836 2HB LEU 133 HB1 LEU 133 -4.307 -6.482 -6.929 837 HG LEU 133 HG LEU 133 -4.034 -7.326 -9.816 838 1HD1 LEU 133 HD1 LEU 133 -5.679 -8.513 -7.583 839 2HD1 LEU 133 HD1 LEU 133 -5.756 -8.978 -9.284 840 3HD1 LEU 133 HD1 LEU 133 -4.282 -9.256 -8.366 841 1HD2 LEU 133 HD2 LEU 133 -6.330 -6.116 -8.277 842 2HD2 LEU 133 HD2 LEU 133 -5.403 -5.329 -9.554 843 3HD2 LEU 133 HD2 LEU 133 -6.418 -6.714 -9.930 844 H PHE 134 HN PHE 134 -0.787 -5.979 -7.093 845 HA PHE 134 HA PHE 134 -1.118 -4.797 -4.574 846 1HB PHE 134 HB2 PHE 134 0.411 -6.641 -4.865 847 2HB PHE 134 HB1 PHE 134 1.408 -5.706 -5.976 848 HD1 PHE 134 HD1 PHE 134 0.197 -5.814 -2.467 849 HD2 PHE 134 HD2 PHE 134 3.191 -4.440 -5.156 850 HE1 PHE 134 HE1 PHE 134 1.546 -5.029 -0.565 851 HE2 PHE 134 HE2 PHE 134 4.540 -3.656 -3.243 852 HZ PHE 134 HZ PHE 134 3.721 -3.944 -0.975 853 H SER 135 HN SER 135 0.728 -3.712 -7.419 854 HA SER 135 HA SER 135 1.815 -1.446 -6.237 855 1HB SER 135 HB2 SER 135 2.097 -0.616 -8.605 856 2HB SER 135 HB1 SER 135 2.730 -2.235 -8.298 857 HG SER 135 HG SER 135 1.198 -3.105 -9.426 858 H ARG 136 HN ARG 136 -1.282 -1.871 -7.832 859 HA ARG 136 HA ARG 136 -1.803 0.928 -7.732 860 1HB ARG 136 HB2 ARG 136 -3.996 0.451 -8.569 861 2HB ARG 136 HB1 ARG 136 -2.770 -0.363 -9.542 862 1HG ARG 136 HG2 ARG 136 -3.383 -2.439 -8.238 863 2HG ARG 136 HG1 ARG 136 -4.752 -1.518 -7.605 864 1HD ARG 136 HD2 ARG 136 -4.149 -2.171 -10.478 865 2HD ARG 136 HD1 ARG 136 -5.515 -2.736 -9.519 866 HE ARG 136 HE ARG 136 -5.574 0.071 -9.563 867 1HH1 ARG 136 1HH1 ARG 136 -6.112 -2.622 -11.841 868 2HH1 ARG 136 2HH1 ARG 136 -7.101 -1.691 -12.856 869 1HH2 ARG 136 1HH2 ARG 136 -6.936 1.302 -10.973 870 2HH2 ARG 136 2HH2 ARG 136 -7.594 0.580 -12.355 871 H ASP 137 HN ASP 137 -2.830 -1.822 -5.780 872 HA ASP 137 HA ASP 137 -4.522 -0.150 -4.233 873 1HB ASP 137 HB2 ASP 137 -3.811 -2.963 -4.252 874 2HB ASP 137 HB1 ASP 137 -4.217 -2.345 -2.636 875 H LEU 138 HN LEU 138 -1.233 -1.097 -3.997 876 HA LEU 138 HA LEU 138 -0.725 -0.079 -1.426 877 1HB LEU 138 HB2 LEU 138 0.896 -1.474 -2.481 878 2HB LEU 138 HB1 LEU 138 0.967 -0.452 -3.889 879 HG LEU 138 HG LEU 138 2.254 1.210 -2.692 880 1HD1 LEU 138 HD1 LEU 138 1.949 -0.562 -0.286 881 2HD1 LEU 138 HD1 LEU 138 2.963 0.882 -0.424 882 3HD1 LEU 138 HD1 LEU 138 1.206 1.035 -0.521 883 1HD2 LEU 138 HD2 LEU 138 3.240 -1.586 -2.225 884 2HD2 LEU 138 HD2 LEU 138 3.488 -0.601 -3.669 885 3HD2 LEU 138 HD2 LEU 138 4.230 -0.134 -2.139 886 H ASP 139 HN ASP 139 -0.770 1.369 -4.628 887 HA ASP 139 HA ASP 139 0.059 3.971 -3.947 888 1HB ASP 139 HB2 ASP 139 -0.170 3.013 -6.277 889 2HB ASP 139 HB1 ASP 139 -1.909 3.180 -6.113 890 H LYS 140 HN LYS 140 -3.141 2.495 -4.209 891 HA LYS 140 HA LYS 140 -4.805 4.595 -3.462 892 1HB LYS 140 HB2 LYS 140 -5.088 1.674 -2.781 893 2HB LYS 140 HB1 LYS 140 -6.364 2.859 -2.604 894 1HG LYS 140 HG2 LYS 140 -6.435 3.173 -5.002 895 2HG LYS 140 HG1 LYS 140 -5.061 2.078 -5.205 896 1HD LYS 140 HD2 LYS 140 -6.433 0.277 -4.111 897 2HD LYS 140 HD1 LYS 140 -7.781 1.401 -4.116 898 1HE LYS 140 HE2 LYS 140 -7.857 1.450 -6.477 899 2HE LYS 140 HE1 LYS 140 -6.321 0.590 -6.610 900 1HZ LYS 140 HZ1 LYS 140 -8.795 -0.555 -5.431 901 2HZ LYS 140 HZ3 LYS 140 -8.244 -0.858 -7.000 902 3HZ LYS 140 HZ2 LYS 140 -7.328 -1.356 -5.669 903 H LEU 141 HN LEU 141 -3.276 2.148 -1.378 904 HA LEU 141 HA LEU 141 -4.288 3.013 1.065 905 1HB LEU 141 HB2 LEU 141 -3.224 0.845 0.776 906 2HB LEU 141 HB1 LEU 141 -1.687 1.619 0.456 907 HG LEU 141 HG LEU 141 -1.608 2.440 2.766 908 1HD1 LEU 141 HD1 LEU 141 -4.184 0.916 3.134 909 2HD1 LEU 141 HD1 LEU 141 -3.197 1.601 4.428 910 3HD1 LEU 141 HD1 LEU 141 -3.949 2.664 3.246 911 1HD2 LEU 141 HD2 LEU 141 -0.572 0.310 2.218 912 2HD2 LEU 141 HD2 LEU 141 -1.239 0.284 3.853 913 3HD2 LEU 141 HD2 LEU 141 -2.094 -0.523 2.540 914 H ILE 142 HN ILE 142 -1.342 3.945 -0.607 915 HA ILE 142 HA ILE 142 -0.415 5.644 1.451 916 HB ILE 142 HB ILE 142 0.227 5.708 -1.519 917 1HG1 ILE 142 2HG1 ILE 142 1.708 4.514 0.811 918 2HG1 ILE 142 1HG1 ILE 142 0.779 3.594 -0.368 919 1HG2 ILE 142 3HG2 ILE 142 1.641 7.000 0.820 920 2HG2 ILE 142 2HG2 ILE 142 2.247 6.949 -0.837 921 3HG2 ILE 142 1HG2 ILE 142 0.771 7.841 -0.463 922 1HD1 ILE 142 HD1 ILE 142 2.289 4.367 -2.104 923 2HD1 ILE 142 HD1 ILE 142 3.247 5.225 -0.896 924 3HD1 ILE 142 HD1 ILE 142 3.141 3.459 -0.847 925 H ASN 143 HN ASN 143 -2.032 6.377 -1.597 926 HA ASN 143 HA ASN 143 -2.519 9.092 -1.344 927 1HB ASN 143 HB2 ASN 143 -4.361 7.002 -2.537 928 2HB ASN 143 HB1 ASN 143 -4.575 8.729 -2.759 929 1HD2 ASN 143 HD2 ASN 143 -4.140 6.627 -4.722 930 2HD2 ASN 143 HD2 ASN 143 -2.692 6.997 -5.564 931 H LYS 144 HN LYS 144 -4.331 6.444 0.023 932 HA LYS 144 HA LYS 144 -6.551 7.732 1.111 933 1HB LYS 144 HB2 LYS 144 -6.205 5.293 0.968 934 2HB LYS 144 HB1 LYS 144 -4.988 5.399 2.228 935 1HG LYS 144 HG2 LYS 144 -6.792 6.284 3.742 936 2HG LYS 144 HG1 LYS 144 -7.950 5.879 2.475 937 1HD LYS 144 HD2 LYS 144 -6.090 3.952 3.888 938 2HD LYS 144 HD1 LYS 144 -7.832 4.082 4.117 939 1HE LYS 144 HE2 LYS 144 -8.179 3.405 1.783 940 2HE LYS 144 HE1 LYS 144 -6.442 3.275 1.556 941 1HZ LYS 144 HZ2 LYS 144 -8.036 1.646 3.468 942 2HZ LYS 144 HZ1 LYS 144 -7.442 1.120 1.989 943 3HZ LYS 144 HZ3 LYS 144 -6.390 1.510 3.231 944 H PHE 145 HN PHE 145 -3.328 7.191 2.453 945 HA PHE 145 HA PHE 145 -3.985 8.571 4.875 946 1HB PHE 145 HB2 PHE 145 -1.591 7.043 3.951 947 2HB PHE 145 HB1 PHE 145 -1.486 8.105 5.354 948 HD1 PHE 145 HD1 PHE 145 -2.206 7.427 7.401 949 HD2 PHE 145 HD2 PHE 145 -3.384 5.181 4.000 950 HE1 PHE 145 HE1 PHE 145 -3.151 5.684 8.884 951 HE2 PHE 145 HE2 PHE 145 -4.322 3.442 5.460 952 HZ PHE 145 HZ PHE 145 -4.207 3.689 7.901 953 H MET 146 HN MET 146 -2.398 9.286 1.899 954 HA MET 146 HA MET 146 -1.066 11.700 2.795 955 1HB MET 146 HB2 MET 146 -1.839 10.982 -0.040 956 2HB MET 146 HB1 MET 146 -0.659 12.178 0.463 957 1HG MET 146 HG2 MET 146 0.685 10.220 1.418 958 2HG MET 146 HG1 MET 146 -0.485 9.203 0.625 959 1HE MET 146 HE2 MET 146 2.252 11.870 0.141 960 2HE MET 146 HE1 MET 146 2.317 12.077 -1.614 961 3HE MET 146 HE3 MET 146 0.903 12.611 -0.707 962 H ASN 147 HN ASN 147 -4.121 10.839 2.333 963 HA ASN 147 HA ASN 147 -6.114 11.717 2.153 964 1HB ASN 147 HB2 ASN 147 -4.602 14.088 3.038 965 2HB ASN 147 HB1 ASN 147 -6.364 14.197 2.795 966 1HD2 ASN 147 HD2 ASN 147 -3.783 13.173 4.780 967 2HD2 ASN 147 HD2 ASN 147 -4.680 12.525 6.090 968 H VAL 148 HN VAL 148 -5.650 11.101 -0.014 969 HA VAL 148 HA VAL 148 -6.230 13.292 -1.860 970 HB VAL 148 HB VAL 148 -4.729 10.726 -2.472 971 1HG1 VAL 148 3HG1 VAL 148 -5.943 11.587 -4.381 972 2HG1 VAL 148 2HG1 VAL 148 -5.175 13.166 -4.187 973 3HG1 VAL 148 1HG1 VAL 148 -4.208 11.765 -4.638 974 1HG2 VAL 148 1HG2 VAL 148 -3.285 12.143 -1.106 975 2HG2 VAL 148 3HG2 VAL 148 -2.679 12.057 -2.759 976 3HG2 VAL 148 2HG2 VAL 148 -3.544 13.491 -2.210 977 H LYS 149 HN LYS 149 -7.884 12.720 -3.243 978 HA LYS 149 HA LYS 149 -9.406 10.449 -2.281 979 1HB LYS 149 HB2 LYS 149 -10.304 12.884 -3.837 980 2HB LYS 149 HB1 LYS 149 -11.353 11.655 -3.138 981 1HG LYS 149 HG2 LYS 149 -10.573 12.243 -0.893 982 2HG LYS 149 HG1 LYS 149 -9.518 13.468 -1.568 983 1HD LYS 149 HD2 LYS 149 -11.471 14.595 -0.778 984 2HD LYS 149 HD1 LYS 149 -11.577 14.557 -2.536 985 1HE LYS 149 HE2 LYS 149 -13.734 14.016 -1.666 986 2HE LYS 149 HE1 LYS 149 -13.037 12.540 -2.325 987 1HZ LYS 149 HZ3 LYS 149 -12.403 11.937 -0.007 988 2HZ LYS 149 HZ2 LYS 149 -13.252 13.319 0.515 989 3HZ LYS 149 HZ1 LYS 149 -14.066 12.093 -0.257 990 H ASP 150 HN ASP 150 -7.261 10.265 -3.971 991 HA ASP 150 HA ASP 150 -6.396 9.234 -5.675 992 1HB ASP 150 HB2 ASP 150 -8.029 7.470 -5.093 993 2HB ASP 150 HB1 ASP 150 -9.150 8.130 -6.279 994 H LYS 151 HN LYS 151 -6.293 9.001 -8.000 995 HA LYS 151 HA LYS 151 -6.616 11.659 -9.103 996 1HB LYS 151 HB2 LYS 151 -5.162 10.786 -10.928 997 2HB LYS 151 HB1 LYS 151 -4.463 10.643 -9.320 998 1HG LYS 151 HG2 LYS 151 -5.180 8.262 -9.279 999 2HG LYS 151 HG1 LYS 151 -5.715 8.442 -10.950 1000 1HD LYS 151 HD2 LYS 151 -3.467 8.981 -11.647 1001 2HD LYS 151 HD1 LYS 151 -2.908 8.924 -9.971 1002 1HE LYS 151 HE2 LYS 151 -3.574 6.552 -9.873 1003 2HE LYS 151 HE1 LYS 151 -4.029 6.628 -11.574 1004 1HZ LYS 151 HZ2 LYS 151 -1.722 7.175 -12.101 1005 2HZ LYS 151 HZ1 LYS 151 -1.323 7.089 -10.470 1006 3HZ LYS 151 HZ3 LYS 151 -1.832 5.702 -11.276 1007 H VAL 152 HN VAL 152 -8.796 9.564 -8.899 1008 HA VAL 152 HA VAL 152 -9.690 9.703 -11.672 1009 HB VAL 152 HB VAL 152 -11.363 7.945 -11.097 1010 1HG1 VAL 152 1HG1 VAL 152 -9.233 7.287 -12.066 1011 2HG1 VAL 152 3HG1 VAL 152 -8.510 7.200 -10.460 1012 3HG1 VAL 152 2HG1 VAL 152 -9.782 6.070 -10.912 1013 1HG2 VAL 152 1HG2 VAL 152 -11.552 8.411 -8.687 1014 2HG2 VAL 152 3HG2 VAL 152 -11.206 6.710 -9.000 1015 3HG2 VAL 152 2HG2 VAL 152 -9.920 7.784 -8.447 1016 H HIS 153 HN HIS 153 -11.398 10.900 -12.202 1017 HA HIS 153 HA HIS 153 -12.376 12.735 -10.210 1018 1HB HIS 153 HB2 HIS 153 -11.793 13.557 -12.487 1019 2HB HIS 153 HB1 HIS 153 -13.052 12.546 -13.173 1020 HD1 HIS 153 HD1 HIS 153 -15.232 13.765 -13.575 1021 HD2 HIS 153 HD2 HIS 153 -12.961 15.541 -10.580 1022 HE1 HIS 153 HE1 HIS 153 -16.475 15.833 -12.895 1023 H LYS 154 HN LYS 154 -14.422 12.903 -9.486 1024 HA LYS 154 HA LYS 154 -15.838 10.443 -9.460 1025 1HB LYS 154 HB2 LYS 154 -16.390 13.062 -8.043 1026 2HB LYS 154 HB1 LYS 154 -17.360 11.611 -7.827 1027 1HG LYS 154 HG2 LYS 154 -15.883 11.679 -5.994 1028 2HG LYS 154 HG1 LYS 154 -15.233 10.448 -7.066 1029 1HD LYS 154 HD2 LYS 154 -13.687 12.231 -7.981 1030 2HD LYS 154 HD1 LYS 154 -14.234 13.276 -6.675 1031 1HE LYS 154 HE2 LYS 154 -12.218 12.313 -5.922 1032 2HE LYS 154 HE1 LYS 154 -13.506 11.409 -5.116 1033 1HZ LYS 154 HZ2 LYS 154 -12.043 10.525 -7.538 1034 2HZ LYS 154 HZ1 LYS 154 -11.756 9.981 -5.974 1035 3HZ LYS 154 HZ3 LYS 154 -13.215 9.625 -6.741 1036 H LEU 155 HN LEU 155 -17.752 10.015 -10.396 1037 HA LEU 155 HA LEU 155 -18.213 11.480 -12.791 1038 1HB LEU 155 HB2 LEU 155 -19.596 9.061 -11.674 1039 2HB LEU 155 HB1 LEU 155 -19.854 9.716 -13.279 1040 HG LEU 155 HG LEU 155 -17.240 8.597 -12.262 1041 1HD1 LEU 155 HD1 LEU 155 -18.927 6.870 -12.527 1042 2HD1 LEU 155 HD1 LEU 155 -19.268 7.437 -14.163 1043 3HD1 LEU 155 HD1 LEU 155 -17.693 6.743 -13.780 1044 1HD2 LEU 155 HD2 LEU 155 -18.070 9.525 -15.014 1045 2HD2 LEU 155 HD2 LEU 155 -16.909 10.324 -13.957 1046 3HD2 LEU 155 HD2 LEU 155 -16.548 8.728 -14.618 1047 H GLU 156 HN GLU 156 -19.542 12.919 -13.213 1048 HA GLU 156 HA GLU 156 -21.039 14.508 -13.119 1049 1HB GLU 156 HB2 GLU 156 -22.228 12.673 -14.220 1050 2HB GLU 156 HB1 GLU 156 -22.939 12.218 -12.679 1051 1HG GLU 156 HG2 GLU 156 -24.458 13.550 -14.113 1052 2HG GLU 156 HG1 GLU 156 -24.138 14.298 -12.547 1053 H HIS 157 HN HIS 157 -21.012 15.973 -11.785 1054 HA HIS 157 HA HIS 157 -22.859 16.255 -9.715 1055 1HB HIS 157 HB2 HIS 157 -21.216 14.815 -8.444 1056 2HB HIS 157 HB1 HIS 157 -19.974 16.017 -8.762 1057 HD1 HIS 157 HD1 HIS 157 -22.927 15.354 -6.553 1058 HD2 HIS 157 HD2 HIS 157 -20.218 18.407 -7.304 1059 HE1 HIS 157 HE1 HIS 157 -23.189 16.986 -4.677 1060 H HIS 158 HN HIS 158 -19.642 17.123 -10.779 1061 HA HIS 158 HA HIS 158 -20.018 19.918 -10.343 1062 1HB HIS 158 HB2 HIS 158 -17.900 18.415 -11.891 1063 2HB HIS 158 HB1 HIS 158 -17.846 20.126 -11.506 1064 HD1 HIS 158 HD1 HIS 158 -15.990 17.449 -10.540 1065 HD2 HIS 158 HD2 HIS 158 -18.417 20.010 -8.338 1066 HE1 HIS 158 HE1 HIS 158 -15.177 17.307 -8.185 1067 H HIS 159 HN HIS 159 -20.695 21.382 -11.797 1068 HA HIS 159 HA HIS 159 -21.793 20.329 -14.301 1069 1HB HIS 159 HB2 HIS 159 -22.282 22.956 -12.887 1070 2HB HIS 159 HB1 HIS 159 -23.011 22.496 -14.413 1071 HD1 HIS 159 HD1 HIS 159 -25.305 21.482 -14.171 1072 HD2 HIS 159 HD2 HIS 159 -22.997 21.035 -10.746 1073 HE1 HIS 159 HE1 HIS 159 -26.814 20.464 -12.441 1074 H HIS 160 HN HIS 160 -20.085 23.209 -13.211 1075 HA HIS 160 HA HIS 160 -18.952 23.436 -15.904 1076 1HB HIS 160 HB2 HIS 160 -18.735 25.922 -15.378 1077 2HB HIS 160 HB1 HIS 160 -20.362 25.313 -15.639 1078 HD1 HIS 160 HD1 HIS 160 -22.051 25.965 -13.853 1079 HD2 HIS 160 HD2 HIS 160 -18.114 26.250 -12.557 1080 HE1 HIS 160 HE1 HIS 160 -22.150 27.029 -11.591 1081 H HIS 161 HN HIS 161 -18.087 22.125 -13.380 1082 HA HIS 161 HA HIS 161 -15.376 23.222 -13.362 1083 1HB HIS 161 HB2 HIS 161 -16.536 23.562 -11.173 1084 2HB HIS 161 HB1 HIS 161 -16.844 21.836 -11.084 1085 HD1 HIS 161 HD1 HIS 161 -14.144 24.387 -10.605 1086 HD2 HIS 161 HD2 HIS 161 -14.629 20.266 -10.384 1087 HE1 HIS 161 HE1 HIS 161 -12.113 23.509 -9.406 1088 H HIS 162 HN HIS 162 -13.966 21.801 -14.153 1089 HA HIS 162 HA HIS 162 -14.531 18.969 -13.937 1090 1HB HIS 162 HB2 HIS 162 -13.918 20.379 -16.557 1091 2HB HIS 162 HB1 HIS 162 -13.714 18.649 -16.332 1092 HD1 HIS 162 HD1 HIS 162 -16.199 21.162 -17.260 1093 HD2 HIS 162 HD2 HIS 162 -16.216 17.274 -15.810 1094 HE1 HIS 162 HE1 HIS 162 -18.519 20.268 -17.684 No H/Q in entry = 1094 Start of MODEL 13 1 H1 MET 1 HT2 MET 1 18.910 -20.251 -1.001 2 H2 MET 1 HT1 MET 1 19.168 -20.762 -2.618 3 H3 MET 1 HT3 MET 1 19.801 -19.305 -2.054 4 HA MET 1 HA MET 1 18.030 -18.754 -3.376 5 1HB MET 1 HB2 MET 1 16.915 -21.001 -3.262 6 2HB MET 1 HB1 MET 1 16.365 -20.635 -1.647 7 1HG MET 1 HG2 MET 1 15.571 -18.967 -4.021 8 2HG MET 1 HG1 MET 1 14.702 -20.421 -3.567 9 1HE MET 1 HE3 MET 1 13.288 -20.699 -1.393 10 2HE MET 1 HE2 MET 1 14.712 -20.353 -0.408 11 3HE MET 1 HE1 MET 1 13.203 -19.499 -0.104 12 H GLU 2 HN GLU 2 17.175 -19.501 -0.016 13 HA GLU 2 HA GLU 2 16.573 -18.330 1.710 14 1HB GLU 2 HB2 GLU 2 18.703 -16.460 0.704 15 2HB GLU 2 HB1 GLU 2 17.919 -16.286 2.261 16 1HG GLU 2 HG2 GLU 2 19.952 -17.349 2.684 17 2HG GLU 2 HG1 GLU 2 18.740 -18.612 2.785 18 H MET 3 HN MET 3 14.550 -17.846 1.484 19 HA MET 3 HA MET 3 13.855 -15.417 0.087 20 1HB MET 3 HB2 MET 3 11.493 -15.954 0.495 21 2HB MET 3 HB1 MET 3 12.347 -17.240 -0.323 22 1HG MET 3 HG2 MET 3 10.896 -18.186 1.161 23 2HG MET 3 HG1 MET 3 12.487 -18.443 1.859 24 1HE MET 3 HE2 MET 3 9.028 -16.609 2.147 25 2HE MET 3 HE1 MET 3 9.288 -15.486 3.484 26 3HE MET 3 HE3 MET 3 10.105 -15.228 1.945 27 H GLY 4 HN GLY 4 14.625 -16.416 3.165 28 1HA GLY 4 HA1 GLY 4 14.856 -15.239 5.122 29 2HA GLY 4 HA2 GLY 4 13.299 -14.509 4.726 30 H GLN 5 HN GLN 5 16.405 -14.392 3.036 31 HA GLN 5 HA GLN 5 17.066 -11.770 3.778 32 1HB GLN 5 HB2 GLN 5 18.757 -11.806 2.077 33 2HB GLN 5 HB1 GLN 5 18.640 -13.418 2.776 34 1HG GLN 5 HG2 GLN 5 17.408 -14.185 0.868 35 2HG GLN 5 HG1 GLN 5 17.420 -12.567 0.179 36 1HE2 GLN 5 1HE2 GLN 5 18.427 -15.049 -0.810 37 2HE2 GLN 5 2HE2 GLN 5 20.102 -14.793 -1.175 38 H LEU 6 HN LEU 6 15.105 -13.022 1.196 39 HA LEU 6 HA LEU 6 14.830 -10.597 -0.233 40 1HB LEU 6 HB2 LEU 6 14.466 -12.785 -1.280 41 2HB LEU 6 HB1 LEU 6 13.155 -13.121 -0.188 42 HG LEU 6 HG LEU 6 12.541 -12.551 -2.600 43 1HD1 LEU 6 HD1 LEU 6 11.308 -11.011 -0.351 44 2HD1 LEU 6 HD1 LEU 6 10.619 -11.153 -1.972 45 3HD1 LEU 6 HD1 LEU 6 10.829 -12.586 -0.976 46 1HD2 LEU 6 HD2 LEU 6 14.081 -10.681 -2.920 47 2HD2 LEU 6 HD2 LEU 6 12.410 -10.186 -3.191 48 3HD2 LEU 6 HD2 LEU 6 13.224 -9.755 -1.688 49 H LYS 7 HN LYS 7 12.850 -12.264 2.161 50 HA LYS 7 HA LYS 7 10.823 -10.311 2.316 51 1HB LYS 7 HB2 LYS 7 11.402 -12.783 3.577 52 2HB LYS 7 HB1 LYS 7 11.188 -11.599 4.857 53 1HG LYS 7 HG2 LYS 7 9.217 -12.093 2.643 54 2HG LYS 7 HG1 LYS 7 9.099 -12.793 4.253 55 1HD LYS 7 HD2 LYS 7 9.138 -9.833 3.639 56 2HD LYS 7 HD1 LYS 7 7.666 -10.769 3.911 57 1HE LYS 7 HE2 LYS 7 9.922 -10.378 5.870 58 2HE LYS 7 HE1 LYS 7 8.392 -9.516 5.898 59 1HZ LYS 7 HZ2 LYS 7 7.264 -11.652 6.289 60 2HZ LYS 7 HZ1 LYS 7 8.742 -12.445 6.256 61 3HZ LYS 7 HZ3 LYS 7 8.425 -11.342 7.468 62 H ASN 8 HN ASN 8 13.889 -10.718 3.920 63 HA ASN 8 HA ASN 8 13.783 -8.722 5.852 64 1HB ASN 8 HB2 ASN 8 15.604 -10.406 5.632 65 2HB ASN 8 HB1 ASN 8 16.158 -9.601 4.173 66 1HD2 ASN 8 HD2 ASN 8 18.176 -9.112 4.934 67 2HD2 ASN 8 HD2 ASN 8 18.462 -7.990 6.213 68 H LYS 9 HN LYS 9 14.893 -8.600 2.474 69 HA LYS 9 HA LYS 9 15.408 -5.822 2.389 70 1HB LYS 9 HB2 LYS 9 14.753 -7.780 0.187 71 2HB LYS 9 HB1 LYS 9 15.202 -6.112 -0.115 72 1HG LYS 9 HG2 LYS 9 16.933 -8.149 1.287 73 2HG LYS 9 HG1 LYS 9 17.051 -7.718 -0.416 74 1HD LYS 9 HD2 LYS 9 17.457 -5.813 1.902 75 2HD LYS 9 HD1 LYS 9 18.743 -6.554 0.955 76 1HE LYS 9 HE2 LYS 9 17.819 -5.437 -1.075 77 2HE LYS 9 HE1 LYS 9 16.643 -4.620 -0.046 78 1HZ LYS 9 HZ2 LYS 9 18.570 -3.646 1.179 79 2HZ LYS 9 HZ1 LYS 9 19.586 -4.358 0.088 80 3HZ LYS 9 HZ3 LYS 9 18.525 -3.174 -0.444 81 H ILE 10 HN ILE 10 12.502 -7.712 1.639 82 HA ILE 10 HA ILE 10 10.920 -5.619 0.675 83 HB ILE 10 HB ILE 10 10.135 -8.145 2.148 84 1HG1 ILE 10 2HG1 ILE 10 9.928 -7.294 -0.736 85 2HG1 ILE 10 1HG1 ILE 10 11.066 -8.461 -0.072 86 1HG2 ILE 10 1HG2 ILE 10 8.392 -6.495 2.607 87 2HG2 ILE 10 3HG2 ILE 10 8.242 -6.163 0.877 88 3HG2 ILE 10 2HG2 ILE 10 7.803 -7.748 1.513 89 1HD1 ILE 10 HD1 ILE 10 8.076 -8.760 -0.212 90 2HD1 ILE 10 HD1 ILE 10 9.257 -9.550 -1.253 91 3HD1 ILE 10 HD1 ILE 10 9.197 -9.945 0.463 92 H GLU 11 HN GLU 11 11.176 -6.848 3.976 93 HA GLU 11 HA GLU 11 9.601 -4.956 5.296 94 1HB GLU 11 HB2 GLU 11 12.072 -6.423 6.170 95 2HB GLU 11 HB1 GLU 11 11.098 -5.446 7.262 96 1HG GLU 11 HG2 GLU 11 10.150 -7.854 5.725 97 2HG GLU 11 HG1 GLU 11 10.606 -7.836 7.430 98 H ASN 12 HN ASN 12 12.967 -4.927 4.493 99 HA ASN 12 HA ASN 12 13.836 -2.605 5.718 100 1HB ASN 12 HB2 ASN 12 15.283 -4.312 4.718 101 2HB ASN 12 HB1 ASN 12 14.704 -3.875 3.126 102 1HD2 ASN 12 HD2 ASN 12 16.791 -3.105 5.677 103 2HD2 ASN 12 HD2 ASN 12 17.662 -1.826 4.893 104 H LYS 13 HN LYS 13 12.721 -3.089 2.402 105 HA LYS 13 HA LYS 13 12.976 -0.369 1.615 106 1HB LYS 13 HB2 LYS 13 13.101 -2.471 0.176 107 2HB LYS 13 HB1 LYS 13 11.357 -2.527 0.273 108 1HG LYS 13 HG2 LYS 13 12.024 -1.548 -1.820 109 2HG LYS 13 HG1 LYS 13 11.231 -0.329 -0.824 110 1HD LYS 13 HD2 LYS 13 13.185 0.616 -1.918 111 2HD LYS 13 HD1 LYS 13 13.421 0.560 -0.180 112 1HE LYS 13 HE2 LYS 13 15.453 -0.085 -1.284 113 2HE LYS 13 HE1 LYS 13 14.789 -1.483 -0.458 114 1HZ LYS 13 HZ3 LYS 13 13.911 -2.244 -2.669 115 2HZ LYS 13 HZ2 LYS 13 14.722 -0.960 -3.416 116 3HZ LYS 13 HZ1 LYS 13 15.578 -2.117 -2.612 117 H LYS 14 HN LYS 14 10.320 -2.396 2.704 118 HA LYS 14 HA LYS 14 8.087 -0.783 2.316 119 1HB LYS 14 HB2 LYS 14 8.062 -3.141 3.103 120 2HB LYS 14 HB1 LYS 14 8.725 -2.620 4.637 121 1HG LYS 14 HG2 LYS 14 6.654 -1.291 5.018 122 2HG LYS 14 HG1 LYS 14 5.993 -1.957 3.527 123 1HD LYS 14 HD2 LYS 14 5.116 -3.322 5.280 124 2HD LYS 14 HD1 LYS 14 6.411 -4.261 4.536 125 1HE LYS 14 HE2 LYS 14 7.937 -3.466 6.355 126 2HE LYS 14 HE1 LYS 14 6.532 -2.698 7.096 127 1HZ LYS 14 HZ2 LYS 14 5.522 -5.019 7.295 128 2HZ LYS 14 HZ1 LYS 14 6.938 -5.610 6.639 129 3HZ LYS 14 HZ3 LYS 14 6.971 -4.851 8.102 130 H LYS 15 HN LYS 15 10.294 -1.011 5.024 131 HA LYS 15 HA LYS 15 9.035 0.990 6.590 132 1HB LYS 15 HB2 LYS 15 11.808 -0.195 6.872 133 2HB LYS 15 HB1 LYS 15 11.017 0.852 8.049 134 1HG LYS 15 HG2 LYS 15 9.295 -0.802 8.434 135 2HG LYS 15 HG1 LYS 15 9.952 -1.828 7.168 136 1HD LYS 15 HD2 LYS 15 10.776 -2.844 9.086 137 2HD LYS 15 HD1 LYS 15 12.114 -1.815 8.615 138 1HE LYS 15 HE2 LYS 15 10.055 -1.165 10.745 139 2HE LYS 15 HE1 LYS 15 11.661 -1.791 11.056 140 1HZ LYS 15 HZ2 LYS 15 12.550 0.281 10.053 141 2HZ LYS 15 HZ1 LYS 15 10.970 0.860 9.908 142 3HZ LYS 15 HZ3 LYS 15 11.621 0.546 11.426 143 H GLU 16 HN GLU 16 11.760 1.044 4.337 144 HA GLU 16 HA GLU 16 12.566 3.695 4.728 145 1HB GLU 16 HB2 GLU 16 12.471 2.081 2.170 146 2HB GLU 16 HB1 GLU 16 13.179 3.677 2.272 147 1HG GLU 16 HG2 GLU 16 14.750 2.709 3.985 148 2HG GLU 16 HG1 GLU 16 14.113 1.122 3.530 149 H LEU 17 HN LEU 17 9.979 2.346 2.809 150 HA LEU 17 HA LEU 17 9.145 4.776 1.621 151 1HB LEU 17 HB2 LEU 17 8.510 2.831 0.558 152 2HB LEU 17 HB1 LEU 17 7.813 2.124 2.022 153 HG LEU 17 HG LEU 17 6.273 4.290 1.783 154 1HD1 LEU 17 HD1 LEU 17 7.160 3.964 -0.945 155 2HD1 LEU 17 HD1 LEU 17 5.669 4.777 -0.389 156 3HD1 LEU 17 HD1 LEU 17 7.251 5.348 0.147 157 1HD2 LEU 17 HD2 LEU 17 5.592 2.046 1.947 158 2HD2 LEU 17 HD2 LEU 17 4.641 3.001 0.788 159 3HD2 LEU 17 HD2 LEU 17 5.834 1.795 0.202 160 H ILE 18 HN ILE 18 8.032 2.914 4.420 161 HA ILE 18 HA ILE 18 5.862 4.493 5.115 162 HB ILE 18 HB ILE 18 7.706 2.968 6.999 163 1HG1 ILE 18 2HG1 ILE 18 4.984 2.156 5.990 164 2HG1 ILE 18 1HG1 ILE 18 6.447 1.690 5.142 165 1HG2 ILE 18 2HG2 ILE 18 6.389 4.652 8.260 166 2HG2 ILE 18 1HG2 ILE 18 4.909 4.054 7.547 167 3HG2 ILE 18 3HG2 ILE 18 5.838 3.029 8.632 168 1HD1 ILE 18 HD1 ILE 18 5.741 1.002 7.981 169 2HD1 ILE 18 HD1 ILE 18 5.644 -0.081 6.580 170 3HD1 ILE 18 HD1 ILE 18 7.209 0.529 7.130 171 H GLN 19 HN GLN 19 9.240 4.838 5.970 172 HA GLN 19 HA GLN 19 9.169 7.073 7.630 173 1HB GLN 19 HB2 GLN 19 11.163 6.364 5.492 174 2HB GLN 19 HB1 GLN 19 11.413 7.594 6.716 175 1HG GLN 19 HG2 GLN 19 11.323 5.960 8.440 176 2HG GLN 19 HG1 GLN 19 10.916 4.699 7.282 177 1HE2 GLN 19 1HE2 GLN 19 13.228 4.909 9.054 178 2HE2 GLN 19 2HE2 GLN 19 14.626 4.836 8.045 179 H LEU 20 HN LEU 20 9.248 6.894 4.114 180 HA LEU 20 HA LEU 20 9.348 9.689 3.703 181 1HB LEU 20 HB2 LEU 20 8.577 7.481 1.805 182 2HB LEU 20 HB1 LEU 20 8.877 9.148 1.349 183 HG LEU 20 HG LEU 20 10.921 7.268 2.537 184 1HD1 LEU 20 HD1 LEU 20 10.328 6.645 0.280 185 2HD1 LEU 20 HD1 LEU 20 10.610 8.298 -0.268 186 3HD1 LEU 20 HD1 LEU 20 11.953 7.325 0.339 187 1HD2 LEU 20 HD2 LEU 20 11.204 10.084 1.489 188 2HD2 LEU 20 HD2 LEU 20 11.384 9.570 3.165 189 3HD2 LEU 20 HD2 LEU 20 12.540 9.030 1.947 190 H VAL 21 HN VAL 21 6.652 7.317 3.481 191 HA VAL 21 HA VAL 21 4.674 9.238 2.896 192 HB VAL 21 HB VAL 21 4.291 6.683 4.480 193 1HG1 VAL 21 2HG1 VAL 21 2.340 8.133 4.449 194 2HG1 VAL 21 1HG1 VAL 21 2.434 8.208 2.684 195 3HG1 VAL 21 3HG1 VAL 21 2.082 6.665 3.467 196 1HG2 VAL 21 3HG2 VAL 21 4.363 7.064 1.498 197 2HG2 VAL 21 2HG2 VAL 21 5.540 6.202 2.502 198 3HG2 VAL 21 1HG2 VAL 21 3.897 5.578 2.343 199 H ALA 22 HN ALA 22 6.091 8.181 5.927 200 HA ALA 22 HA ALA 22 4.265 9.403 7.683 201 1HB ALA 22 HB3 ALA 22 7.178 8.727 8.120 202 2HB ALA 22 HB2 ALA 22 5.999 9.071 9.394 203 3HB ALA 22 HB1 ALA 22 5.811 7.650 8.365 204 H ARG 23 HN ARG 23 7.478 10.457 6.538 205 HA ARG 23 HA ARG 23 7.331 12.948 7.842 206 1HB ARG 23 HB2 ARG 23 9.325 13.611 6.577 207 2HB ARG 23 HB1 ARG 23 9.507 12.033 7.321 208 1HG ARG 23 HG2 ARG 23 9.131 10.963 5.196 209 2HG ARG 23 HG1 ARG 23 8.863 12.528 4.420 210 1HD ARG 23 HD2 ARG 23 11.419 11.670 5.787 211 2HD ARG 23 HD1 ARG 23 11.154 11.660 4.044 212 HE ARG 23 HE ARG 23 10.574 14.196 4.714 213 1HH1 ARG 23 1HH1 ARG 23 13.419 12.214 5.471 214 2HH1 ARG 23 2HH1 ARG 23 14.495 13.522 5.472 215 1HH2 ARG 23 1HH2 ARG 23 12.023 15.957 4.682 216 2HH2 ARG 23 2HH2 ARG 23 13.687 15.757 4.975 217 H HIS 24 HN HIS 24 6.024 11.882 4.889 218 HA HIS 24 HA HIS 24 5.582 14.192 3.446 219 1HB HIS 24 HB2 HIS 24 4.719 12.116 2.580 220 2HB HIS 24 HB1 HIS 24 3.766 11.839 4.027 221 HD1 HIS 24 HD1 HIS 24 1.403 12.785 4.061 222 HD2 HIS 24 HD2 HIS 24 3.617 14.092 0.809 223 HE1 HIS 24 HE1 HIS 24 -0.196 14.008 2.571 224 H GLY 25 HN GLY 25 3.871 13.009 6.277 225 1HA GLY 25 HA1 GLY 25 2.304 15.460 6.373 226 2HA GLY 25 HA2 GLY 25 3.431 15.171 7.692 227 H LEU 26 HN LEU 26 3.108 12.363 7.902 228 HA LEU 26 HA LEU 26 0.289 12.088 8.480 229 1HB LEU 26 HB2 LEU 26 2.572 10.163 8.560 230 2HB LEU 26 HB1 LEU 26 1.041 9.751 9.262 231 HG LEU 26 HG LEU 26 1.755 10.201 6.425 232 1HD1 LEU 26 HD1 LEU 26 0.488 7.889 7.833 233 2HD1 LEU 26 HD1 LEU 26 0.662 8.014 6.093 234 3HD1 LEU 26 HD1 LEU 26 2.101 7.970 7.126 235 1HD2 LEU 26 HD2 LEU 26 -1.036 10.170 7.537 236 2HD2 LEU 26 HD2 LEU 26 -0.235 11.460 6.638 237 3HD2 LEU 26 HD2 LEU 26 -0.634 9.960 5.831 238 H ASP 27 HN ASP 27 -0.438 11.388 10.422 239 HA ASP 27 HA ASP 27 0.835 12.556 12.758 240 1HB ASP 27 HB2 ASP 27 -1.625 10.763 12.666 241 2HB ASP 27 HB1 ASP 27 -1.108 11.798 13.973 242 H HIS 28 HN HIS 28 1.055 11.032 14.714 243 HA HIS 28 HA HIS 28 2.760 8.889 14.027 244 1HB HIS 28 HB2 HIS 28 2.818 10.056 16.228 245 2HB HIS 28 HB1 HIS 28 1.296 9.277 16.659 246 HD1 HIS 28 HD1 HIS 28 1.481 6.871 17.618 247 HD2 HIS 28 HD2 HIS 28 5.045 8.322 16.041 248 HE1 HIS 28 HE1 HIS 28 3.260 5.235 18.281 249 H ASP 29 HN ASP 29 -0.616 9.022 14.976 250 HA ASP 29 HA ASP 29 -1.128 6.266 14.961 251 1HB ASP 29 HB2 ASP 29 -3.529 6.881 14.681 252 2HB ASP 29 HB1 ASP 29 -2.723 7.701 16.014 253 H LYS 30 HN LYS 30 -1.202 8.616 12.421 254 HA LYS 30 HA LYS 30 -2.348 6.985 10.430 255 1HB LYS 30 HB2 LYS 30 -0.440 9.263 10.214 256 2HB LYS 30 HB1 LYS 30 -1.153 8.596 8.780 257 1HG LYS 30 HG2 LYS 30 -2.459 10.035 11.081 258 2HG LYS 30 HG1 LYS 30 -2.338 10.568 9.403 259 1HD LYS 30 HD2 LYS 30 -3.889 8.779 8.768 260 2HD LYS 30 HD1 LYS 30 -3.961 8.250 10.452 261 1HE LYS 30 HE2 LYS 30 -4.885 10.886 9.330 262 2HE LYS 30 HE1 LYS 30 -5.880 9.601 10.013 263 1HZ LYS 30 HZ3 LYS 30 -4.588 10.016 12.160 264 2HZ LYS 30 HZ2 LYS 30 -4.009 11.414 11.413 265 3HZ LYS 30 HZ1 LYS 30 -5.645 11.253 11.673 266 H VAL 31 HN VAL 31 1.066 7.569 11.241 267 HA VAL 31 HA VAL 31 2.191 5.881 9.345 268 HB VAL 31 HB VAL 31 3.246 6.387 12.152 269 1HG1 VAL 31 2HG1 VAL 31 4.422 4.600 11.036 270 2HG1 VAL 31 1HG1 VAL 31 4.704 5.637 9.638 271 3HG1 VAL 31 3HG1 VAL 31 5.448 6.027 11.189 272 1HG2 VAL 31 3HG2 VAL 31 2.725 8.496 11.043 273 2HG2 VAL 31 2HG2 VAL 31 4.468 8.278 11.194 274 3HG2 VAL 31 1HG2 VAL 31 3.670 8.001 9.644 275 H LEU 32 HN LEU 32 0.931 5.214 12.576 276 HA LEU 32 HA LEU 32 1.706 2.490 12.739 277 1HB LEU 32 HB2 LEU 32 -0.669 3.810 14.031 278 2HB LEU 32 HB1 LEU 32 0.062 2.298 14.512 279 HG LEU 32 HG LEU 32 1.213 5.059 14.786 280 1HD1 LEU 32 HD1 LEU 32 -0.435 4.482 16.432 281 2HD1 LEU 32 HD1 LEU 32 0.429 2.987 16.798 282 3HD1 LEU 32 HD1 LEU 32 1.174 4.542 17.161 283 1HD2 LEU 32 HD2 LEU 32 2.505 2.397 15.335 284 2HD2 LEU 32 HD2 LEU 32 3.018 3.600 14.156 285 3HD2 LEU 32 HD2 LEU 32 3.145 3.953 15.882 286 H LEU 33 HN LEU 33 -1.371 3.971 11.827 287 HA LEU 33 HA LEU 33 -2.709 1.570 11.228 288 1HB LEU 33 HB2 LEU 33 -3.184 4.337 10.142 289 2HB LEU 33 HB1 LEU 33 -4.308 2.998 10.025 290 HG LEU 33 HG LEU 33 -3.419 4.308 12.594 291 1HD1 LEU 33 HD1 LEU 33 -5.991 4.558 11.047 292 2HD1 LEU 33 HD1 LEU 33 -5.705 5.204 12.664 293 3HD1 LEU 33 HD1 LEU 33 -4.776 5.811 11.292 294 1HD2 LEU 33 HD2 LEU 33 -5.531 2.216 12.065 295 2HD2 LEU 33 HD2 LEU 33 -4.010 1.966 12.924 296 3HD2 LEU 33 HD2 LEU 33 -5.248 3.018 13.609 297 H PHE 34 HN PHE 34 -0.893 3.823 9.225 298 HA PHE 34 HA PHE 34 -1.333 2.635 6.742 299 1HB PHE 34 HB2 PHE 34 -0.421 4.862 6.907 300 2HB PHE 34 HB1 PHE 34 0.987 4.273 7.780 301 HD1 PHE 34 HD1 PHE 34 2.934 3.841 6.613 302 HD2 PHE 34 HD2 PHE 34 -0.765 3.909 4.546 303 HE1 PHE 34 HE1 PHE 34 4.130 3.582 4.481 304 HE2 PHE 34 HE2 PHE 34 0.412 3.654 2.411 305 HZ PHE 34 HZ PHE 34 2.874 3.490 2.375 306 H SER 35 HN SER 35 1.413 2.217 8.985 307 HA SER 35 HA SER 35 2.773 0.428 7.332 308 1HB SER 35 HB2 SER 35 4.100 -0.103 9.390 309 2HB SER 35 HB1 SER 35 3.983 1.614 9.000 310 HG SER 35 HG SER 35 2.687 1.952 10.632 311 H ARG 36 HN ARG 36 0.370 -0.146 9.818 312 HA ARG 36 HA ARG 36 0.822 -2.960 9.798 313 1HB ARG 36 HB2 ARG 36 -1.063 -3.165 11.255 314 2HB ARG 36 HB1 ARG 36 -0.074 -1.819 11.783 315 1HG ARG 36 HG2 ARG 36 -1.703 -0.313 10.616 316 2HG ARG 36 HG1 ARG 36 -2.736 -1.720 10.388 317 1HD ARG 36 HD2 ARG 36 -1.833 -0.476 12.974 318 2HD ARG 36 HD1 ARG 36 -3.478 -0.606 12.348 319 HE ARG 36 HE ARG 36 -2.158 -3.128 12.759 320 1HH1 ARG 36 1HH1 ARG 36 -4.424 -0.794 14.155 321 2HH1 ARG 36 2HH1 ARG 36 -4.831 -1.784 15.477 322 1HH2 ARG 36 1HH2 ARG 36 -2.681 -4.442 14.572 323 2HH2 ARG 36 2HH2 ARG 36 -3.846 -3.920 15.699 324 H ASP 37 HN ASP 37 -1.441 -0.820 8.138 325 HA ASP 37 HA ASP 37 -3.074 -2.874 7.004 326 1HB ASP 37 HB2 ASP 37 -3.572 -0.345 7.184 327 2HB ASP 37 HB1 ASP 37 -2.516 -0.155 5.803 328 H LEU 38 HN LEU 38 -0.264 -1.100 6.042 329 HA LEU 38 HA LEU 38 0.145 -2.121 3.472 330 1HB LEU 38 HB2 LEU 38 1.177 -0.107 4.212 331 2HB LEU 38 HB1 LEU 38 1.963 -0.928 5.530 332 HG LEU 38 HG LEU 38 3.593 -1.897 4.071 333 1HD1 LEU 38 HD1 LEU 38 1.937 -0.788 1.817 334 2HD1 LEU 38 HD1 LEU 38 3.517 -1.580 1.668 335 3HD1 LEU 38 HD1 LEU 38 2.113 -2.504 2.216 336 1HD2 LEU 38 HD2 LEU 38 3.884 0.435 4.664 337 2HD2 LEU 38 HD2 LEU 38 4.523 0.111 3.039 338 3HD2 LEU 38 HD2 LEU 38 2.947 0.887 3.238 339 H ASP 39 HN ASP 39 1.361 -3.149 6.624 340 HA ASP 39 HA ASP 39 3.021 -5.194 5.652 341 1HB ASP 39 HB2 ASP 39 3.070 -4.318 8.000 342 2HB ASP 39 HB1 ASP 39 1.570 -5.194 8.304 343 H LYS 40 HN LYS 40 -0.352 -5.227 6.704 344 HA LYS 40 HA LYS 40 -0.744 -7.951 6.136 345 1HB LYS 40 HB2 LYS 40 -2.659 -5.681 6.465 346 2HB LYS 40 HB1 LYS 40 -3.204 -7.292 6.003 347 1HG LYS 40 HG2 LYS 40 -2.154 -8.190 8.035 348 2HG LYS 40 HG1 LYS 40 -1.709 -6.547 8.494 349 1HD LYS 40 HD2 LYS 40 -3.978 -5.899 8.697 350 2HD LYS 40 HD1 LYS 40 -4.543 -7.397 7.964 351 1HE LYS 40 HE2 LYS 40 -3.080 -7.170 10.603 352 2HE LYS 40 HE1 LYS 40 -4.817 -7.407 10.416 353 1HZ LYS 40 HZ3 LYS 40 -2.715 -9.297 9.490 354 2HZ LYS 40 HZ2 LYS 40 -3.658 -9.477 10.876 355 3HZ LYS 40 HZ1 LYS 40 -4.382 -9.508 9.356 356 H LEU 41 HN LEU 41 -1.055 -5.102 4.110 357 HA LEU 41 HA LEU 41 -2.248 -6.377 1.913 358 1HB LEU 41 HB2 LEU 41 -2.115 -3.939 2.097 359 2HB LEU 41 HB1 LEU 41 -0.370 -4.010 1.981 360 HG LEU 41 HG LEU 41 -0.540 -4.812 -0.329 361 1HD1 LEU 41 HD1 LEU 41 -3.512 -4.481 0.041 362 2HD1 LEU 41 HD1 LEU 41 -2.687 -4.779 -1.491 363 3HD1 LEU 41 HD1 LEU 41 -2.640 -5.993 -0.217 364 1HD2 LEU 41 HD2 LEU 41 -2.121 -2.303 0.214 365 2HD2 LEU 41 HD2 LEU 41 -0.363 -2.423 0.068 366 3HD2 LEU 41 HD2 LEU 41 -1.389 -2.746 -1.328 367 H ILE 42 HN ILE 42 1.099 -5.914 2.828 368 HA ILE 42 HA ILE 42 2.163 -7.232 0.575 369 HB ILE 42 HB ILE 42 3.391 -6.674 3.293 370 1HG1 ILE 42 2HG1 ILE 42 3.788 -5.461 0.562 371 2HG1 ILE 42 1HG1 ILE 42 2.893 -4.732 1.891 372 1HG2 ILE 42 2HG2 ILE 42 4.476 -8.663 2.353 373 2HG2 ILE 42 1HG2 ILE 42 4.763 -7.801 0.840 374 3HG2 ILE 42 3HG2 ILE 42 5.568 -7.276 2.320 375 1HD1 ILE 42 HD1 ILE 42 5.845 -5.321 1.844 376 2HD1 ILE 42 HD1 ILE 42 5.096 -3.738 1.629 377 3HD1 ILE 42 HD1 ILE 42 4.952 -4.576 3.172 378 H ASN 43 HN ASN 43 1.498 -8.410 3.864 379 HA ASN 43 HA ASN 43 2.244 -11.087 3.430 380 1HB ASN 43 HB2 ASN 43 0.178 -9.929 5.306 381 2HB ASN 43 HB1 ASN 43 0.433 -11.662 5.184 382 1HD2 ASN 43 HD2 ASN 43 1.774 -8.646 6.246 383 2HD2 ASN 43 HD2 ASN 43 2.996 -9.289 7.242 384 H LYS 44 HN LYS 44 -0.729 -9.447 2.672 385 HA LYS 44 HA LYS 44 -2.382 -11.555 1.928 386 1HB LYS 44 HB2 LYS 44 -3.066 -9.190 2.147 387 2HB LYS 44 HB1 LYS 44 -2.176 -8.809 0.684 388 1HG LYS 44 HG2 LYS 44 -3.697 -10.419 -0.519 389 2HG LYS 44 HG1 LYS 44 -4.666 -10.475 0.956 390 1HD LYS 44 HD2 LYS 44 -4.058 -8.021 -0.712 391 2HD LYS 44 HD1 LYS 44 -5.603 -8.861 -0.608 392 1HE LYS 44 HE2 LYS 44 -5.751 -8.254 1.779 393 2HE LYS 44 HE1 LYS 44 -4.208 -7.416 1.655 394 1HZ LYS 44 HZ3 LYS 44 -5.259 -5.953 -0.047 395 2HZ LYS 44 HZ2 LYS 44 -6.713 -6.702 0.226 396 3HZ LYS 44 HZ1 LYS 44 -6.007 -5.809 1.456 397 H PHE 45 HN PHE 45 -0.123 -9.674 -0.072 398 HA PHE 45 HA PHE 45 -0.635 -11.346 -2.346 399 1HB PHE 45 HB2 PHE 45 1.056 -8.923 -1.914 400 2HB PHE 45 HB1 PHE 45 1.283 -9.916 -3.348 401 HD1 PHE 45 HD1 PHE 45 -0.146 -9.717 -5.182 402 HD2 PHE 45 HD2 PHE 45 -1.253 -7.943 -1.470 403 HE1 PHE 45 HE1 PHE 45 -2.033 -8.591 -6.283 404 HE2 PHE 45 HE2 PHE 45 -3.131 -6.810 -2.573 405 HZ PHE 45 HZ PHE 45 -3.528 -7.134 -4.979 406 H MET 46 HN MET 46 1.774 -11.154 0.114 407 HA MET 46 HA MET 46 3.767 -12.723 -1.207 408 1HB MET 46 HB2 MET 46 3.263 -12.132 1.710 409 2HB MET 46 HB1 MET 46 4.621 -13.094 1.155 410 1HG MET 46 HG2 MET 46 4.117 -10.265 0.262 411 2HG MET 46 HG1 MET 46 5.095 -10.682 1.661 412 1HE MET 46 HE1 MET 46 7.378 -11.776 1.597 413 2HE MET 46 HE3 MET 46 6.698 -13.219 0.837 414 3HE MET 46 HE2 MET 46 8.137 -12.460 0.159 415 H ASN 47 HN ASN 47 0.931 -13.325 0.646 416 HA ASN 47 HA ASN 47 -0.189 -15.081 1.345 417 1HB ASN 47 HB2 ASN 47 1.123 -16.177 -1.082 418 2HB ASN 47 HB1 ASN 47 -0.005 -17.180 -0.146 419 1HD2 ASN 47 HD2 ASN 47 0.397 -14.538 -2.351 420 2HD2 ASN 47 HD2 ASN 47 -1.282 -14.298 -2.664 421 H VAL 48 HN VAL 48 1.037 -15.042 3.243 422 HA VAL 48 HA VAL 48 3.291 -16.819 3.464 423 HB VAL 48 HB VAL 48 1.722 -15.690 5.739 424 1HG1 VAL 48 3HG1 VAL 48 4.579 -16.653 5.555 425 2HG1 VAL 48 2HG1 VAL 48 3.866 -15.921 6.990 426 3HG1 VAL 48 1HG1 VAL 48 3.248 -17.459 6.383 427 1HG2 VAL 48 3HG2 VAL 48 2.392 -13.846 4.310 428 2HG2 VAL 48 2HG2 VAL 48 3.352 -13.818 5.793 429 3HG2 VAL 48 1HG2 VAL 48 4.051 -14.438 4.294 430 H LYS 49 HN LYS 49 2.749 -18.599 2.896 431 HA LYS 49 HA LYS 49 1.103 -20.240 4.613 432 1HB LYS 49 HB2 LYS 49 1.076 -20.141 1.586 433 2HB LYS 49 HB1 LYS 49 0.318 -21.403 2.522 434 1HG LYS 49 HG2 LYS 49 -0.472 -18.516 2.814 435 2HG LYS 49 HG1 LYS 49 -1.155 -19.531 1.548 436 1HD LYS 49 HD2 LYS 49 -1.292 -20.107 4.512 437 2HD LYS 49 HD1 LYS 49 -2.589 -19.385 3.560 438 1HE LYS 49 HE2 LYS 49 -1.427 -22.167 3.217 439 2HE LYS 49 HE1 LYS 49 -3.015 -21.750 3.837 440 1HZ LYS 49 HZ3 LYS 49 -3.597 -20.846 1.650 441 2HZ LYS 49 HZ2 LYS 49 -2.084 -21.271 1.043 442 3HZ LYS 49 HZ1 LYS 49 -3.147 -22.455 1.532 443 H ASP 50 HN ASP 50 2.812 -21.597 5.291 444 HA ASP 50 HA ASP 50 5.147 -21.920 3.698 445 1HB ASP 50 HB2 ASP 50 4.298 -23.337 6.224 446 2HB ASP 50 HB1 ASP 50 5.794 -23.712 5.383 447 H LYS 51 HN LYS 51 4.530 -22.657 1.818 448 HA LYS 51 HA LYS 51 3.324 -25.313 1.641 449 1HB LYS 51 HB2 LYS 51 2.989 -24.791 -0.746 450 2HB LYS 51 HB1 LYS 51 2.264 -23.579 0.296 451 1HG LYS 51 HG2 LYS 51 4.153 -22.082 -0.116 452 2HG LYS 51 HG1 LYS 51 4.897 -23.302 -1.151 453 1HD LYS 51 HD2 LYS 51 2.930 -23.201 -2.627 454 2HD LYS 51 HD1 LYS 51 2.242 -21.948 -1.601 455 1HE LYS 51 HE2 LYS 51 4.842 -21.763 -3.125 456 2HE LYS 51 HE1 LYS 51 3.327 -21.009 -3.590 457 1HZ LYS 51 HZ3 LYS 51 3.423 -19.677 -1.544 458 2HZ LYS 51 HZ2 LYS 51 4.904 -20.375 -1.141 459 3HZ LYS 51 HZ1 LYS 51 4.779 -19.419 -2.501 460 H VAL 52 HN VAL 52 6.132 -24.346 2.217 461 HA VAL 52 HA VAL 52 7.435 -26.187 0.385 462 HB VAL 52 HB VAL 52 9.583 -25.009 0.900 463 1HG1 VAL 52 1HG1 VAL 52 7.414 -23.305 -0.324 464 2HG1 VAL 52 3HG1 VAL 52 9.147 -23.061 -0.538 465 3HG1 VAL 52 2HG1 VAL 52 8.379 -24.523 -1.155 466 1HG2 VAL 52 3HG2 VAL 52 7.777 -22.957 2.197 467 2HG2 VAL 52 2HG2 VAL 52 8.976 -23.952 3.017 468 3HG2 VAL 52 1HG2 VAL 52 9.494 -22.733 1.854 469 H HIS 53 HN HIS 53 8.467 -27.851 1.183 470 HA HIS 53 HA HIS 53 9.132 -27.950 4.005 471 1HB HIS 53 HB2 HIS 53 6.988 -29.208 3.765 472 2HB HIS 53 HB1 HIS 53 7.697 -30.168 2.480 473 HD1 HIS 53 HD1 HIS 53 7.977 -29.669 6.253 474 HD2 HIS 53 HD2 HIS 53 9.056 -32.392 3.302 475 HE1 HIS 53 HE1 HIS 53 8.863 -31.693 7.459 476 H LYS 54 HN LYS 54 11.171 -27.497 3.390 477 HA LYS 54 HA LYS 54 13.341 -27.919 2.836 478 1HB LYS 54 HB2 LYS 54 12.393 -30.723 2.270 479 2HB LYS 54 HB1 LYS 54 14.072 -30.235 2.410 480 1HG LYS 54 HG2 LYS 54 13.719 -29.690 4.772 481 2HG LYS 54 HG1 LYS 54 12.029 -30.184 4.631 482 1HD LYS 54 HD2 LYS 54 14.427 -31.952 4.153 483 2HD LYS 54 HD1 LYS 54 13.421 -31.963 5.604 484 1HE LYS 54 HE2 LYS 54 11.489 -32.640 4.270 485 2HE LYS 54 HE1 LYS 54 12.454 -32.575 2.803 486 1HZ LYS 54 HZ2 LYS 54 13.872 -34.325 3.786 487 2HZ LYS 54 HZ1 LYS 54 12.834 -34.427 5.076 488 3HZ LYS 54 HZ3 LYS 54 12.282 -34.832 3.539 489 H LEU 55 HN LEU 55 14.507 -29.368 0.861 490 HA LEU 55 HA LEU 55 15.143 -29.220 -1.218 491 1HB LEU 55 HB2 LEU 55 12.270 -29.599 -1.487 492 2HB LEU 55 HB1 LEU 55 13.261 -29.487 -2.952 493 HG LEU 55 HG LEU 55 13.305 -31.578 -0.771 494 1HD1 LEU 55 HD1 LEU 55 11.558 -31.788 -2.431 495 2HD1 LEU 55 HD1 LEU 55 12.766 -31.702 -3.713 496 3HD1 LEU 55 HD1 LEU 55 12.760 -33.079 -2.602 497 1HD2 LEU 55 HD2 LEU 55 15.212 -31.199 -3.085 498 2HD2 LEU 55 HD2 LEU 55 15.619 -31.198 -1.364 499 3HD2 LEU 55 HD2 LEU 55 15.073 -32.675 -2.147 500 H GLU 56 HN GLU 56 15.986 -27.390 -1.166 501 HA GLU 56 HA GLU 56 14.510 -25.160 -2.339 502 1HB GLU 56 HB2 GLU 56 16.299 -23.718 -1.246 503 2HB GLU 56 HB1 GLU 56 15.162 -24.495 -0.157 504 1HG GLU 56 HG2 GLU 56 16.827 -26.236 0.312 505 2HG GLU 56 HG1 GLU 56 17.970 -25.404 -0.743 506 H HIS 57 HN HIS 57 14.903 -25.159 -4.399 507 HA HIS 57 HA HIS 57 17.631 -25.681 -5.246 508 1HB HIS 57 HB2 HIS 57 15.110 -26.547 -6.660 509 2HB HIS 57 HB1 HIS 57 16.712 -26.595 -7.380 510 HD1 HIS 57 HD1 HIS 57 18.396 -28.398 -6.383 511 HD2 HIS 57 HD2 HIS 57 14.509 -28.590 -4.930 512 HE1 HIS 57 HE1 HIS 57 18.167 -30.649 -5.297 513 H HIS 58 HN HIS 58 17.933 -23.507 -5.016 514 HA HIS 58 HA HIS 58 17.973 -22.274 -7.529 515 1HB HIS 58 HB2 HIS 58 15.661 -21.554 -6.564 516 2HB HIS 58 HB1 HIS 58 16.590 -20.638 -5.383 517 HD1 HIS 58 HD1 HIS 58 16.882 -18.193 -6.106 518 HD2 HIS 58 HD2 HIS 58 16.633 -20.822 -9.326 519 HE1 HIS 58 HE1 HIS 58 17.042 -16.795 -8.154 520 H HIS 59 HN HIS 59 20.013 -21.897 -7.447 521 HA HIS 59 HA HIS 59 21.148 -20.902 -4.947 522 1HB HIS 59 HB2 HIS 59 22.322 -23.059 -6.731 523 2HB HIS 59 HB1 HIS 59 23.118 -22.339 -5.336 524 HD1 HIS 59 HD1 HIS 59 20.924 -25.126 -6.244 525 HD2 HIS 59 HD2 HIS 59 21.708 -22.865 -2.844 526 HE1 HIS 59 HE1 HIS 59 20.005 -26.433 -4.313 527 H HIS 60 HN HIS 60 23.737 -20.637 -5.844 528 HA HIS 60 HA HIS 60 23.458 -18.320 -7.505 529 1HB HIS 60 HB2 HIS 60 24.969 -18.424 -5.509 530 2HB HIS 60 HB1 HIS 60 25.953 -19.603 -6.365 531 HD1 HIS 60 HD1 HIS 60 27.795 -18.647 -7.807 532 HD2 HIS 60 HD2 HIS 60 24.872 -15.880 -6.820 533 HE1 HIS 60 HE1 HIS 60 28.621 -16.431 -8.677 534 H HIS 61 HN HIS 61 24.647 -21.592 -7.739 535 HA HIS 61 HA HIS 61 25.739 -21.108 -10.349 536 1HB HIS 61 HB2 HIS 61 26.975 -22.616 -8.872 537 2HB HIS 61 HB1 HIS 61 25.578 -23.682 -8.762 538 HD1 HIS 61 HD1 HIS 61 25.608 -25.603 -10.373 539 HD2 HIS 61 HD2 HIS 61 27.931 -22.423 -11.673 540 HE1 HIS 61 HE1 HIS 61 26.654 -26.348 -12.530 541 H HIS 62 HN HIS 62 24.050 -20.561 -11.557 542 HA HIS 62 HA HIS 62 22.476 -22.798 -12.528 543 1HB HIS 62 HB2 HIS 62 21.448 -20.030 -11.860 544 2HB HIS 62 HB1 HIS 62 20.679 -20.991 -13.117 545 HD1 HIS 62 HD1 HIS 62 18.726 -22.295 -12.276 546 HD2 HIS 62 HD2 HIS 62 21.500 -21.523 -9.287 547 HE1 HIS 62 HE1 HIS 62 17.744 -23.226 -10.164 548 H1 MET 101 HT3 MET 101 11.175 22.896 -0.887 549 H2 MET 101 HT2 MET 101 12.556 22.282 -0.141 550 H3 MET 101 HT1 MET 101 11.625 21.295 -1.130 551 HA MET 101 HA MET 101 11.194 20.748 1.124 552 1HB MET 101 HB2 MET 101 10.374 23.658 1.391 553 2HB MET 101 HB1 MET 101 10.076 22.413 2.590 554 1HG MET 101 HG2 MET 101 12.448 22.123 2.926 555 2HG MET 101 HG1 MET 101 12.796 23.288 1.654 556 1HE MET 101 HE3 MET 101 11.265 22.769 5.253 557 2HE MET 101 HE2 MET 101 10.787 24.410 5.683 558 3HE MET 101 HE1 MET 101 9.929 23.551 4.406 559 H GLU 102 HN GLU 102 9.807 21.541 -1.699 560 HA GLU 102 HA GLU 102 7.109 21.430 -0.788 561 1HB GLU 102 HB2 GLU 102 6.561 21.450 -3.250 562 2HB GLU 102 HB1 GLU 102 7.434 22.855 -2.665 563 1HG GLU 102 HG2 GLU 102 8.751 22.538 -4.433 564 2HG GLU 102 HG1 GLU 102 9.433 21.194 -3.520 565 H MET 103 HN MET 103 5.569 19.806 -1.667 566 HA MET 103 HA MET 103 6.849 17.346 -0.895 567 1HB MET 103 HB2 MET 103 3.902 17.964 -1.123 568 2HB MET 103 HB1 MET 103 4.557 16.427 -0.583 569 1HG MET 103 HG2 MET 103 5.627 17.557 1.312 570 2HG MET 103 HG1 MET 103 4.929 19.086 0.786 571 1HE MET 103 HE3 MET 103 2.277 19.565 0.768 572 2HE MET 103 HE2 MET 103 1.979 18.098 -0.169 573 3HE MET 103 HE1 MET 103 1.075 18.394 1.313 574 H GLY 104 HN GLY 104 6.469 18.661 -3.756 575 1HA GLY 104 HA1 GLY 104 6.279 17.801 -5.900 576 2HA GLY 104 HA2 GLY 104 5.397 16.427 -5.227 577 H GLN 105 HN GLN 105 8.547 17.746 -4.562 578 HA GLN 105 HA GLN 105 10.093 15.700 -5.750 579 1HB GLN 105 HB2 GLN 105 11.971 16.674 -4.504 580 2HB GLN 105 HB1 GLN 105 10.950 17.930 -5.210 581 1HG GLN 105 HG2 GLN 105 9.879 18.202 -2.992 582 2HG GLN 105 HG1 GLN 105 11.075 17.092 -2.335 583 1HE2 GLN 105 1HE2 GLN 105 13.151 18.187 -4.146 584 2HE2 GLN 105 2HE2 GLN 105 13.586 19.710 -3.458 585 H LEU 106 HN LEU 106 8.701 16.095 -2.624 586 HA LEU 106 HA LEU 106 9.921 13.895 -1.327 587 1HB LEU 106 HB2 LEU 106 8.914 15.773 -0.103 588 2HB LEU 106 HB1 LEU 106 7.365 15.424 -0.817 589 HG LEU 106 HG LEU 106 7.647 14.875 1.631 590 1HD1 LEU 106 HD1 LEU 106 6.760 12.664 -0.178 591 2HD1 LEU 106 HD1 LEU 106 6.379 12.812 1.535 592 3HD1 LEU 106 HD1 LEU 106 5.791 14.018 0.382 593 1HD2 LEU 106 HD2 LEU 106 9.287 12.596 0.534 594 2HD2 LEU 106 HD2 LEU 106 9.858 13.897 1.582 595 3HD2 LEU 106 HD2 LEU 106 8.689 12.722 2.187 596 H LYS 107 HN LYS 107 6.886 14.340 -3.066 597 HA LYS 107 HA LYS 107 5.844 11.765 -2.701 598 1HB LYS 107 HB2 LYS 107 5.049 14.127 -3.949 599 2HB LYS 107 HB1 LYS 107 5.107 12.933 -5.238 600 1HG LYS 107 HG2 LYS 107 3.670 12.562 -2.657 601 2HG LYS 107 HG1 LYS 107 2.880 13.162 -4.110 602 1HD LYS 107 HD2 LYS 107 4.254 10.468 -3.816 603 2HD LYS 107 HD1 LYS 107 2.510 10.721 -3.712 604 1HE LYS 107 HE2 LYS 107 4.238 11.315 -6.104 605 2HE LYS 107 HE1 LYS 107 3.252 9.871 -5.904 606 1HZ LYS 107 HZ3 LYS 107 1.283 11.338 -5.809 607 2HZ LYS 107 HZ2 LYS 107 2.278 12.672 -6.138 608 3HZ LYS 107 HZ1 LYS 107 2.111 11.468 -7.260 609 H ASN 108 HN ASN 108 7.987 13.120 -5.133 610 HA ASN 108 HA ASN 108 8.054 10.959 -6.918 611 1HB ASN 108 HB2 ASN 108 9.109 13.155 -7.413 612 2HB ASN 108 HB1 ASN 108 10.347 12.814 -6.207 613 1HD2 ASN 108 HD2 ASN 108 12.070 12.806 -7.606 614 2HD2 ASN 108 HD2 ASN 108 12.297 11.601 -8.821 615 H LYS 109 HN LYS 109 9.846 11.572 -3.950 616 HA LYS 109 HA LYS 109 11.469 9.247 -4.208 617 1HB LYS 109 HB2 LYS 109 10.901 10.924 -1.758 618 2HB LYS 109 HB1 LYS 109 12.140 9.679 -1.866 619 1HG LYS 109 HG2 LYS 109 13.173 10.975 -3.721 620 2HG LYS 109 HG1 LYS 109 12.019 12.265 -3.390 621 1HD LYS 109 HD2 LYS 109 12.881 12.464 -1.117 622 2HD LYS 109 HD1 LYS 109 14.024 11.154 -1.427 623 1HE LYS 109 HE2 LYS 109 14.968 12.523 -3.291 624 2HE LYS 109 HE1 LYS 109 13.929 13.847 -2.767 625 1HZ LYS 109 HZ1 LYS 109 15.060 13.821 -0.614 626 2HZ LYS 109 HZ3 LYS 109 16.030 12.540 -1.151 627 3HZ LYS 109 HZ2 LYS 109 16.161 14.046 -1.880 628 H ILE 110 HN ILE 110 8.420 9.951 -2.618 629 HA ILE 110 HA ILE 110 8.081 7.474 -1.284 630 HB ILE 110 HB ILE 110 6.012 9.352 -2.483 631 1HG1 ILE 110 2HG1 ILE 110 6.898 8.891 0.369 632 2HG1 ILE 110 1HG1 ILE 110 7.241 10.309 -0.615 633 1HG2 ILE 110 3HG2 ILE 110 5.046 7.125 -2.412 634 2HG2 ILE 110 2HG2 ILE 110 5.495 6.960 -0.714 635 3HG2 ILE 110 1HG2 ILE 110 4.294 8.161 -1.195 636 1HD1 ILE 110 HD1 ILE 110 4.523 9.422 0.338 637 2HD1 ILE 110 HD1 ILE 110 5.490 10.734 1.008 638 3HD1 ILE 110 HD1 ILE 110 4.857 10.857 -0.635 639 H GLU 111 HN GLU 111 7.080 8.527 -4.511 640 HA GLU 111 HA GLU 111 6.070 6.124 -5.471 641 1HB GLU 111 HB2 GLU 111 7.552 8.319 -6.911 642 2HB GLU 111 HB1 GLU 111 6.813 6.948 -7.727 643 1HG GLU 111 HG2 GLU 111 5.401 8.998 -6.059 644 2HG GLU 111 HG1 GLU 111 5.361 8.876 -7.822 645 H ASN 112 HN ASN 112 9.294 7.404 -5.629 646 HA ASN 112 HA ASN 112 10.612 5.464 -7.038 647 1HB ASN 112 HB2 ASN 112 11.483 7.691 -6.291 648 2HB ASN 112 HB1 ASN 112 11.690 7.013 -4.688 649 1HD2 ASN 112 HD2 ASN 112 12.840 7.170 -7.845 650 2HD2 ASN 112 HD2 ASN 112 14.330 6.306 -7.619 651 H LYS 113 HN LYS 113 10.142 5.679 -3.524 652 HA LYS 113 HA LYS 113 11.661 3.313 -3.036 653 1HB LYS 113 HB2 LYS 113 11.376 5.390 -1.522 654 2HB LYS 113 HB1 LYS 113 9.868 4.655 -1.031 655 1HG LYS 113 HG2 LYS 113 11.611 4.154 0.571 656 2HG LYS 113 HG1 LYS 113 11.065 2.679 -0.226 657 1HD LYS 113 HD2 LYS 113 13.471 2.644 -0.059 658 2HD LYS 113 HD1 LYS 113 13.045 2.821 -1.751 659 1HE LYS 113 HE2 LYS 113 14.810 4.303 -1.438 660 2HE LYS 113 HE1 LYS 113 13.404 5.347 -1.348 661 1HZ LYS 113 HZ2 LYS 113 13.591 5.242 1.139 662 2HZ LYS 113 HZ1 LYS 113 14.956 4.277 0.953 663 3HZ LYS 113 HZ3 LYS 113 14.976 5.858 0.404 664 H LYS 114 HN LYS 114 8.200 4.107 -2.981 665 HA LYS 114 HA LYS 114 7.098 1.714 -2.176 666 1HB LYS 114 HB2 LYS 114 5.818 3.680 -2.345 667 2HB LYS 114 HB1 LYS 114 6.173 3.893 -4.067 668 1HG LYS 114 HG2 LYS 114 4.864 1.717 -4.396 669 2HG LYS 114 HG1 LYS 114 4.353 1.903 -2.720 670 1HD LYS 114 HD2 LYS 114 2.607 2.889 -4.014 671 2HD LYS 114 HD1 LYS 114 3.568 4.230 -3.383 672 1HE LYS 114 HE2 LYS 114 4.772 4.352 -5.518 673 2HE LYS 114 HE1 LYS 114 3.745 3.061 -6.133 674 1HZ LYS 114 HZ3 LYS 114 1.771 4.667 -5.801 675 2HZ LYS 114 HZ2 LYS 114 2.928 5.830 -5.389 676 3HZ LYS 114 HZ1 LYS 114 2.959 5.191 -6.857 677 H LYS 115 HN LYS 115 7.924 2.876 -5.423 678 HA LYS 115 HA LYS 115 7.158 0.554 -6.819 679 1HB LYS 115 HB2 LYS 115 8.964 2.861 -7.495 680 2HB LYS 115 HB1 LYS 115 8.747 1.503 -8.591 681 1HG LYS 115 HG2 LYS 115 6.518 2.023 -9.021 682 2HG LYS 115 HG1 LYS 115 6.359 2.999 -7.558 683 1HD LYS 115 HD2 LYS 115 7.483 4.782 -8.457 684 2HD LYS 115 HD1 LYS 115 8.288 3.842 -9.704 685 1HE LYS 115 HE2 LYS 115 6.580 5.304 -10.666 686 2HE LYS 115 HE1 LYS 115 6.123 3.624 -10.878 687 1HZ LYS 115 HZ3 LYS 115 4.941 5.455 -8.789 688 2HZ LYS 115 HZ2 LYS 115 4.279 5.044 -10.248 689 3HZ LYS 115 HZ1 LYS 115 4.498 3.850 -9.112 690 H GLU 116 HN GLU 116 10.254 1.512 -5.444 691 HA GLU 116 HA GLU 116 11.818 -0.659 -6.235 692 1HB GLU 116 HB2 GLU 116 11.861 1.240 -3.939 693 2HB GLU 116 HB1 GLU 116 12.827 -0.221 -3.815 694 1HG GLU 116 HG2 GLU 116 13.026 1.708 -6.103 695 2HG GLU 116 HG1 GLU 116 14.037 1.779 -4.653 696 H LEU 117 HN LEU 117 9.614 -0.318 -3.536 697 HA LEU 117 HA LEU 117 10.161 -2.849 -2.411 698 1HB LEU 117 HB2 LEU 117 9.292 -1.244 -0.940 699 2HB LEU 117 HB1 LEU 117 8.012 -0.795 -2.034 700 HG LEU 117 HG LEU 117 7.278 -1.995 0.054 701 1HD1 LEU 117 HD1 LEU 117 5.888 -1.692 -1.729 702 2HD1 LEU 117 HD1 LEU 117 6.438 -3.192 -2.469 703 3HD1 LEU 117 HD1 LEU 117 5.584 -3.236 -0.908 704 1HD2 LEU 117 HD2 LEU 117 8.520 -4.375 -1.278 705 2HD2 LEU 117 HD2 LEU 117 9.069 -3.622 0.222 706 3HD2 LEU 117 HD2 LEU 117 7.481 -4.395 0.153 707 H ILE 118 HN ILE 118 7.706 -1.661 -4.603 708 HA ILE 118 HA ILE 118 6.133 -3.892 -4.735 709 HB ILE 118 HB ILE 118 6.788 -1.924 -6.954 710 1HG1 ILE 118 2HG1 ILE 118 4.362 -2.115 -5.170 711 2HG1 ILE 118 1HG1 ILE 118 5.746 -1.083 -4.836 712 1HG2 ILE 118 2HG2 ILE 118 4.530 -3.946 -6.864 713 2HG2 ILE 118 1HG2 ILE 118 4.726 -2.673 -8.072 714 3HG2 ILE 118 3HG2 ILE 118 5.909 -3.972 -7.958 715 1HD1 ILE 118 HD1 ILE 118 5.319 0.114 -6.928 716 2HD1 ILE 118 HD1 ILE 118 3.925 -0.916 -7.213 717 3HD1 ILE 118 HD1 ILE 118 3.945 0.178 -5.825 718 H GLN 119 HN GLN 119 9.020 -3.081 -6.470 719 HA GLN 119 HA GLN 119 9.359 -5.244 -8.232 720 1HB GLN 119 HB2 GLN 119 11.345 -3.532 -6.764 721 2HB GLN 119 HB1 GLN 119 11.810 -4.709 -7.983 722 1HG GLN 119 HG2 GLN 119 10.856 -3.495 -9.701 723 2HG GLN 119 HG1 GLN 119 9.784 -2.630 -8.602 724 1HE2 GLN 119 1HE2 GLN 119 13.107 -2.966 -7.743 725 2HE2 GLN 119 2HE2 GLN 119 13.528 -1.321 -8.011 726 H LEU 120 HN LEU 120 10.184 -4.914 -4.836 727 HA LEU 120 HA LEU 120 11.590 -7.379 -4.700 728 1HB LEU 120 HB2 LEU 120 10.523 -5.576 -2.543 729 2HB LEU 120 HB1 LEU 120 11.416 -7.049 -2.218 730 HG LEU 120 HG LEU 120 12.521 -4.721 -3.792 731 1HD1 LEU 120 HD1 LEU 120 12.986 -5.544 -0.932 732 2HD1 LEU 120 HD1 LEU 120 13.844 -4.266 -1.796 733 3HD1 LEU 120 HD1 LEU 120 12.120 -4.107 -1.469 734 1HD2 LEU 120 HD2 LEU 120 13.774 -7.230 -2.684 735 2HD2 LEU 120 HD2 LEU 120 13.550 -6.841 -4.386 736 3HD2 LEU 120 HD2 LEU 120 14.670 -5.897 -3.400 737 H VAL 121 HN VAL 121 8.328 -6.408 -3.524 738 HA VAL 121 HA VAL 121 7.562 -9.001 -2.789 739 HB VAL 121 HB VAL 121 5.673 -6.970 -4.004 740 1HG1 VAL 121 2HG1 VAL 121 4.696 -9.144 -3.524 741 2HG1 VAL 121 1HG1 VAL 121 5.253 -9.040 -1.854 742 3HG1 VAL 121 3HG1 VAL 121 4.037 -7.910 -2.451 743 1HG2 VAL 121 2HG2 VAL 121 6.745 -7.022 -1.187 744 2HG2 VAL 121 1HG2 VAL 121 7.026 -5.780 -2.409 745 3HG2 VAL 121 3HG2 VAL 121 5.408 -6.013 -1.748 746 H ALA 122 HN ALA 122 7.511 -7.410 -5.913 747 HA ALA 122 HA ALA 122 5.989 -9.199 -7.390 748 1HB ALA 122 HB1 ALA 122 8.238 -7.466 -8.372 749 2HB ALA 122 HB3 ALA 122 6.955 -8.174 -9.361 750 3HB ALA 122 HB2 ALA 122 6.567 -6.963 -8.141 751 H ARG 123 HN ARG 123 9.535 -9.003 -7.099 752 HA ARG 123 HA ARG 123 10.087 -11.201 -8.788 753 1HB ARG 123 HB2 ARG 123 12.361 -11.129 -7.924 754 2HB ARG 123 HB1 ARG 123 11.782 -9.505 -8.270 755 1HG ARG 123 HG2 ARG 123 11.411 -9.105 -5.923 756 2HG ARG 123 HG1 ARG 123 11.860 -10.758 -5.526 757 1HD ARG 123 HD2 ARG 123 13.718 -9.290 -5.063 758 2HD ARG 123 HD1 ARG 123 14.119 -10.314 -6.439 759 HE ARG 123 HE ARG 123 13.074 -8.031 -7.515 760 1HH1 ARG 123 1HH1 ARG 123 15.852 -8.844 -5.466 761 2HH1 ARG 123 2HH1 ARG 123 16.792 -7.506 -5.949 762 1HH2 ARG 123 1HH2 ARG 123 14.375 -6.231 -8.229 763 2HH2 ARG 123 2HH2 ARG 123 15.928 -5.969 -7.552 764 H HIS 124 HN HIS 124 9.022 -11.072 -5.569 765 HA HIS 124 HA HIS 124 10.156 -13.423 -4.575 766 1HB HIS 124 HB2 HIS 124 9.218 -11.826 -3.075 767 2HB HIS 124 HB1 HIS 124 7.622 -11.967 -3.740 768 HD1 HIS 124 HD1 HIS 124 10.172 -14.122 -1.836 769 HD2 HIS 124 HD2 HIS 124 6.116 -13.945 -2.641 770 HE1 HIS 124 HE1 HIS 124 9.128 -15.962 -0.473 771 H GLY 125 HN GLY 125 7.313 -12.910 -6.529 772 1HA GLY 125 HA1 GLY 125 6.281 -15.534 -6.055 773 2HA GLY 125 HA2 GLY 125 7.202 -15.448 -7.548 774 H LEU 126 HN LEU 126 5.561 -12.554 -6.569 775 HA LEU 126 HA LEU 126 3.120 -12.878 -7.545 776 1HB LEU 126 HB2 LEU 126 4.983 -10.708 -7.079 777 2HB LEU 126 HB1 LEU 126 3.570 -10.320 -8.062 778 HG LEU 126 HG LEU 126 2.181 -11.175 -6.246 779 1HD1 LEU 126 HD1 LEU 126 3.591 -12.665 -5.208 780 2HD1 LEU 126 HD1 LEU 126 4.672 -11.373 -4.624 781 3HD1 LEU 126 HD1 LEU 126 2.986 -11.485 -4.053 782 1HD2 LEU 126 HD2 LEU 126 4.035 -8.938 -5.546 783 2HD2 LEU 126 HD2 LEU 126 2.550 -8.814 -6.489 784 3HD2 LEU 126 HD2 LEU 126 2.478 -9.225 -4.768 785 H ASP 127 HN ASP 127 2.211 -12.942 -9.286 786 HA ASP 127 HA ASP 127 3.428 -13.217 -11.846 787 1HB ASP 127 HB2 ASP 127 0.510 -12.638 -11.249 788 2HB ASP 127 HB1 ASP 127 1.174 -13.446 -12.659 789 H HIS 128 HN HIS 128 2.634 -11.733 -13.681 790 HA HIS 128 HA HIS 128 3.374 -9.068 -13.125 791 1HB HIS 128 HB2 HIS 128 3.521 -10.234 -15.380 792 2HB HIS 128 HB1 HIS 128 1.782 -10.023 -15.522 793 HD1 HIS 128 HD1 HIS 128 5.014 -8.185 -15.836 794 HD2 HIS 128 HD2 HIS 128 0.945 -7.370 -15.991 795 HE1 HIS 128 HE1 HIS 128 4.810 -5.895 -16.829 796 H ASP 129 HN ASP 129 0.281 -10.672 -13.414 797 HA ASP 129 HA ASP 129 -1.435 -8.460 -13.272 798 1HB ASP 129 HB2 ASP 129 -2.269 -10.585 -13.996 799 2HB ASP 129 HB1 ASP 129 -1.751 -11.357 -12.509 800 H LYS 130 HN LYS 130 0.033 -10.501 -10.845 801 HA LYS 130 HA LYS 130 -1.199 -9.518 -8.524 802 1HB LYS 130 HB2 LYS 130 1.567 -10.607 -8.952 803 2HB LYS 130 HB1 LYS 130 0.888 -10.225 -7.380 804 1HG LYS 130 HG2 LYS 130 -0.412 -12.185 -9.233 805 2HG LYS 130 HG1 LYS 130 0.898 -12.638 -8.147 806 1HD LYS 130 HD2 LYS 130 -0.368 -11.940 -6.263 807 2HD LYS 130 HD1 LYS 130 -1.699 -11.384 -7.249 808 1HE LYS 130 HE2 LYS 130 -0.700 -14.211 -6.792 809 2HE LYS 130 HE1 LYS 130 -2.294 -13.551 -6.434 810 1HZ LYS 130 HZ2 LYS 130 -2.654 -13.350 -8.870 811 2HZ LYS 130 HZ1 LYS 130 -1.176 -14.103 -9.137 812 3HZ LYS 130 HZ3 LYS 130 -2.424 -14.934 -8.377 813 H VAL 131 HN VAL 131 1.679 -8.497 -10.311 814 HA VAL 131 HA VAL 131 2.575 -6.562 -8.470 815 HB VAL 131 HB VAL 131 3.062 -6.573 -11.465 816 1HG1 VAL 131 2HG1 VAL 131 4.652 -5.375 -9.220 817 2HG1 VAL 131 1HG1 VAL 131 5.136 -5.415 -10.914 818 3HG1 VAL 131 3HG1 VAL 131 3.709 -4.502 -10.428 819 1HG2 VAL 131 2HG2 VAL 131 4.609 -7.970 -9.293 820 2HG2 VAL 131 1HG2 VAL 131 3.631 -8.731 -10.548 821 3HG2 VAL 131 3HG2 VAL 131 5.093 -7.850 -10.990 822 H LEU 132 HN LEU 132 0.537 -6.395 -11.327 823 HA LEU 132 HA LEU 132 0.137 -3.590 -11.352 824 1HB LEU 132 HB2 LEU 132 -1.722 -5.750 -12.302 825 2HB LEU 132 HB1 LEU 132 -1.813 -4.054 -12.733 826 HG LEU 132 HG LEU 132 0.357 -5.998 -13.502 827 1HD1 LEU 132 HD1 LEU 132 -1.742 -4.592 -15.115 828 2HD1 LEU 132 HD1 LEU 132 -0.452 -5.609 -15.765 829 3HD1 LEU 132 HD1 LEU 132 -1.688 -6.309 -14.713 830 1HD2 LEU 132 HD2 LEU 132 0.100 -3.055 -14.141 831 2HD2 LEU 132 HD2 LEU 132 1.338 -3.814 -13.130 832 3HD2 LEU 132 HD2 LEU 132 1.268 -4.164 -14.858 833 H LEU 133 HN LEU 133 -1.655 -6.179 -9.804 834 HA LEU 133 HA LEU 133 -3.652 -4.464 -8.744 835 1HB LEU 133 HB2 LEU 133 -2.790 -7.226 -7.927 836 2HB LEU 133 HB1 LEU 133 -4.203 -6.401 -7.300 837 HG LEU 133 HG LEU 133 -3.805 -7.051 -10.212 838 1HD1 LEU 133 HD1 LEU 133 -5.372 -8.531 -8.114 839 2HD1 LEU 133 HD1 LEU 133 -5.417 -8.839 -9.853 840 3HD1 LEU 133 HD1 LEU 133 -3.921 -9.095 -8.973 841 1HD2 LEU 133 HD2 LEU 133 -6.231 -6.167 -8.650 842 2HD2 LEU 133 HD2 LEU 133 -5.326 -5.194 -9.810 843 3HD2 LEU 133 HD2 LEU 133 -6.212 -6.617 -10.356 844 H PHE 134 HN PHE 134 -0.699 -5.854 -7.392 845 HA PHE 134 HA PHE 134 -1.060 -4.837 -4.810 846 1HB PHE 134 HB2 PHE 134 0.507 -6.659 -5.266 847 2HB PHE 134 HB1 PHE 134 1.504 -5.581 -6.235 848 HD1 PHE 134 HD1 PHE 134 3.189 -4.306 -5.246 849 HD2 PHE 134 HD2 PHE 134 0.239 -6.143 -2.794 850 HE1 PHE 134 HE1 PHE 134 4.461 -3.671 -3.235 851 HE2 PHE 134 HE2 PHE 134 1.514 -5.509 -0.787 852 HZ PHE 134 HZ PHE 134 3.630 -4.265 -1.027 853 H SER 135 HN SER 135 0.677 -3.514 -7.617 854 HA SER 135 HA SER 135 1.812 -1.347 -6.284 855 1HB SER 135 HB2 SER 135 2.019 -0.339 -8.591 856 2HB SER 135 HB1 SER 135 2.671 -1.969 -8.425 857 HG SER 135 HG SER 135 1.068 -2.777 -9.532 858 H ARG 136 HN ARG 136 -1.250 -1.564 -8.021 859 HA ARG 136 HA ARG 136 -1.884 1.176 -7.589 860 1HB ARG 136 HB2 ARG 136 -4.110 0.614 -8.455 861 2HB ARG 136 HB1 ARG 136 -2.829 0.000 -9.490 862 1HG ARG 136 HG2 ARG 136 -3.132 -2.223 -8.410 863 2HG ARG 136 HG1 ARG 136 -4.521 -1.557 -7.554 864 1HD ARG 136 HD2 ARG 136 -4.201 -1.733 -10.544 865 2HD ARG 136 HD1 ARG 136 -5.149 -2.817 -9.549 866 HE ARG 136 HE ARG 136 -5.870 -0.047 -9.254 867 1HH1 ARG 136 1HH1 ARG 136 -6.431 -2.937 -11.255 868 2HH1 ARG 136 2HH1 ARG 136 -8.035 -2.545 -11.608 869 1HH2 ARG 136 1HH2 ARG 136 -8.097 0.484 -9.753 870 2HH2 ARG 136 2HH2 ARG 136 -9.014 -0.550 -10.730 871 H ASP 137 HN ASP 137 -2.540 -1.776 -5.802 872 HA ASP 137 HA ASP 137 -4.518 -0.604 -4.086 873 1HB ASP 137 HB2 ASP 137 -4.109 -3.125 -4.624 874 2HB ASP 137 HB1 ASP 137 -2.864 -3.023 -3.390 875 H LEU 138 HN LEU 138 -1.075 -1.238 -3.932 876 HA LEU 138 HA LEU 138 -0.616 -0.243 -1.343 877 1HB LEU 138 HB2 LEU 138 1.042 -1.585 -2.397 878 2HB LEU 138 HB1 LEU 138 1.100 -0.545 -3.794 879 HG LEU 138 HG LEU 138 2.303 1.147 -2.553 880 1HD1 LEU 138 HD1 LEU 138 1.237 0.854 -0.384 881 2HD1 LEU 138 HD1 LEU 138 2.064 -0.700 -0.201 882 3HD1 LEU 138 HD1 LEU 138 3.000 0.803 -0.272 883 1HD2 LEU 138 HD2 LEU 138 3.395 -1.613 -2.122 884 2HD2 LEU 138 HD2 LEU 138 3.589 -0.618 -3.562 885 3HD2 LEU 138 HD2 LEU 138 4.334 -0.123 -2.040 886 H ASP 139 HN ASP 139 -0.607 1.246 -4.518 887 HA ASP 139 HA ASP 139 0.180 3.811 -3.761 888 1HB ASP 139 HB2 ASP 139 0.143 3.067 -6.083 889 2HB ASP 139 HB1 ASP 139 -1.610 2.950 -6.039 890 H LYS 140 HN LYS 140 -3.027 2.318 -3.822 891 HA LYS 140 HA LYS 140 -4.399 4.726 -3.249 892 1HB LYS 140 HB2 LYS 140 -6.361 3.494 -3.035 893 2HB LYS 140 HB1 LYS 140 -5.371 2.792 -4.320 894 1HG LYS 140 HG2 LYS 140 -6.257 1.048 -3.374 895 2HG LYS 140 HG1 LYS 140 -4.695 1.065 -2.549 896 1HD LYS 140 HD2 LYS 140 -5.864 2.232 -0.607 897 2HD LYS 140 HD1 LYS 140 -7.391 1.944 -1.444 898 1HE LYS 140 HE2 LYS 140 -7.159 0.231 0.204 899 2HE LYS 140 HE1 LYS 140 -6.871 -0.507 -1.370 900 1HZ LYS 140 HZ1 LYS 140 -4.411 -0.200 -0.858 901 2HZ LYS 140 HZ3 LYS 140 -4.889 0.081 0.762 902 3HZ LYS 140 HZ2 LYS 140 -5.233 -1.356 -0.058 903 H LEU 141 HN LEU 141 -2.941 2.327 -1.333 904 HA LEU 141 HA LEU 141 -4.130 2.901 1.199 905 1HB LEU 141 HB2 LEU 141 -2.566 0.939 0.357 906 2HB LEU 141 HB1 LEU 141 -1.275 2.030 0.766 907 HG LEU 141 HG LEU 141 -3.068 0.452 2.528 908 1HD1 LEU 141 HD1 LEU 141 -1.048 -0.498 2.004 909 2HD1 LEU 141 HD1 LEU 141 -0.173 0.923 2.585 910 3HD1 LEU 141 HD1 LEU 141 -1.120 -0.054 3.712 911 1HD2 LEU 141 HD2 LEU 141 -1.766 2.988 3.336 912 2HD2 LEU 141 HD2 LEU 141 -3.473 2.590 3.483 913 3HD2 LEU 141 HD2 LEU 141 -2.281 1.758 4.497 914 H ILE 142 HN ILE 142 -1.418 4.007 -0.567 915 HA ILE 142 HA ILE 142 -0.399 5.688 1.508 916 HB ILE 142 HB ILE 142 0.301 5.666 -1.449 917 1HG1 ILE 142 2HG1 ILE 142 1.673 4.453 0.946 918 2HG1 ILE 142 1HG1 ILE 142 0.739 3.562 -0.251 919 1HG2 ILE 142 2HG2 ILE 142 1.733 6.944 0.890 920 2HG2 ILE 142 1HG2 ILE 142 2.338 6.867 -0.766 921 3HG2 ILE 142 3HG2 ILE 142 0.887 7.803 -0.400 922 1HD1 ILE 142 HD1 ILE 142 2.320 4.219 -1.941 923 2HD1 ILE 142 HD1 ILE 142 3.288 5.073 -0.738 924 3HD1 ILE 142 HD1 ILE 142 3.091 3.313 -0.638 925 H ASN 143 HN ASN 143 -1.924 6.466 -1.596 926 HA ASN 143 HA ASN 143 -2.321 9.186 -1.227 927 1HB ASN 143 HB2 ASN 143 -4.021 7.194 -2.734 928 2HB ASN 143 HB1 ASN 143 -4.433 8.897 -2.681 929 1HD2 ASN 143 HD2 ASN 143 -2.193 6.540 -3.893 930 2HD2 ASN 143 HD2 ASN 143 -1.431 7.554 -5.040 931 H LYS 144 HN LYS 144 -4.258 6.532 0.054 932 HA LYS 144 HA LYS 144 -6.418 7.939 1.056 933 1HB LYS 144 HB2 LYS 144 -6.338 5.536 1.000 934 2HB LYS 144 HB1 LYS 144 -4.998 5.510 2.135 935 1HG LYS 144 HG2 LYS 144 -6.494 6.447 3.871 936 2HG LYS 144 HG1 LYS 144 -7.820 6.382 2.702 937 1HD LYS 144 HD2 LYS 144 -6.224 3.989 3.567 938 2HD LYS 144 HD1 LYS 144 -7.761 4.465 4.283 939 1HE LYS 144 HE2 LYS 144 -7.293 3.737 1.379 940 2HE LYS 144 HE1 LYS 144 -8.042 2.728 2.609 941 1HZ LYS 144 HZ2 LYS 144 -9.154 5.339 1.681 942 2HZ LYS 144 HZ1 LYS 144 -9.674 3.823 1.189 943 3HZ LYS 144 HZ3 LYS 144 -9.859 4.280 2.792 944 H PHE 145 HN PHE 145 -3.361 7.121 2.636 945 HA PHE 145 HA PHE 145 -4.012 8.635 4.980 946 1HB PHE 145 HB2 PHE 145 -1.634 7.032 4.143 947 2HB PHE 145 HB1 PHE 145 -1.556 8.065 5.565 948 HD1 PHE 145 HD1 PHE 145 -2.722 7.527 7.546 949 HD2 PHE 145 HD2 PHE 145 -3.219 5.117 4.080 950 HE1 PHE 145 HE1 PHE 145 -3.865 5.832 8.893 951 HE2 PHE 145 HE2 PHE 145 -4.354 3.410 5.428 952 HZ PHE 145 HZ PHE 145 -4.685 3.764 7.837 953 H MET 146 HN MET 146 -2.212 9.256 2.119 954 HA MET 146 HA MET 146 -0.762 11.545 3.000 955 1HB MET 146 HB2 MET 146 -1.816 10.939 0.260 956 2HB MET 146 HB1 MET 146 -0.587 12.140 0.632 957 1HG MET 146 HG2 MET 146 0.860 10.232 1.422 958 2HG MET 146 HG1 MET 146 -0.408 9.161 0.867 959 1HE MET 146 HE3 MET 146 0.993 12.486 -0.641 960 2HE MET 146 HE2 MET 146 2.423 11.575 -0.146 961 3HE MET 146 HE1 MET 146 2.091 11.837 -1.863 962 H ASN 147 HN ASN 147 -4.065 11.045 2.217 963 HA ASN 147 HA ASN 147 -5.904 12.288 2.287 964 1HB ASN 147 HB2 ASN 147 -5.049 13.358 4.318 965 2HB ASN 147 HB1 ASN 147 -4.077 14.471 3.375 966 1HD2 ASN 147 HD2 ASN 147 -7.312 13.675 4.441 967 2HD2 ASN 147 HD2 ASN 147 -8.028 15.185 4.071 968 H VAL 148 HN VAL 148 -3.700 12.445 0.177 969 HA VAL 148 HA VAL 148 -4.616 14.714 -1.365 970 HB VAL 148 HB VAL 148 -3.005 14.083 -3.077 971 1HG1 VAL 148 2HG1 VAL 148 -1.797 13.998 -0.321 972 2HG1 VAL 148 1HG1 VAL 148 -0.903 14.292 -1.812 973 3HG1 VAL 148 3HG1 VAL 148 -2.143 15.431 -1.290 974 1HG2 VAL 148 1HG2 VAL 148 -2.453 11.651 -1.385 975 2HG2 VAL 148 3HG2 VAL 148 -3.119 11.678 -3.015 976 3HG2 VAL 148 2HG2 VAL 148 -1.449 12.172 -2.732 977 H LYS 149 HN LYS 149 -5.734 14.545 -3.301 978 HA LYS 149 HA LYS 149 -7.035 11.970 -3.751 979 1HB LYS 149 HB2 LYS 149 -8.419 14.654 -3.519 980 2HB LYS 149 HB1 LYS 149 -9.197 13.138 -3.955 981 1HG LYS 149 HG2 LYS 149 -8.652 12.229 -1.746 982 2HG LYS 149 HG1 LYS 149 -7.879 13.748 -1.315 983 1HD LYS 149 HD2 LYS 149 -10.033 14.901 -1.650 984 2HD LYS 149 HD1 LYS 149 -10.791 13.346 -1.997 985 1HE LYS 149 HE2 LYS 149 -9.432 14.122 0.580 986 2HE LYS 149 HE1 LYS 149 -11.173 14.034 0.328 987 1HZ LYS 149 HZ3 LYS 149 -10.871 11.621 -0.126 988 2HZ LYS 149 HZ2 LYS 149 -9.243 11.787 0.216 989 3HZ LYS 149 HZ1 LYS 149 -10.364 12.064 1.425 990 H ASP 150 HN ASP 150 -4.878 13.168 -5.145 991 HA ASP 150 HA ASP 150 -5.960 14.507 -7.400 992 1HB ASP 150 HB2 ASP 150 -3.693 14.403 -8.430 993 2HB ASP 150 HB1 ASP 150 -3.698 15.134 -6.838 994 H LYS 151 HN LYS 151 -7.521 13.151 -7.912 995 HA LYS 151 HA LYS 151 -6.881 10.670 -9.256 996 1HB LYS 151 HB2 LYS 151 -9.321 10.504 -9.608 997 2HB LYS 151 HB1 LYS 151 -8.879 10.752 -7.926 998 1HG LYS 151 HG2 LYS 151 -9.440 13.176 -8.225 999 2HG LYS 151 HG1 LYS 151 -10.041 12.779 -9.835 1000 1HD LYS 151 HD2 LYS 151 -11.892 12.832 -8.327 1001 2HD LYS 151 HD1 LYS 151 -11.607 11.148 -8.779 1002 1HE LYS 151 HE2 LYS 151 -10.301 10.877 -6.654 1003 2HE LYS 151 HE1 LYS 151 -10.781 12.512 -6.213 1004 1HZ LYS 151 HZ3 LYS 151 -13.102 11.756 -6.254 1005 2HZ LYS 151 HZ2 LYS 151 -12.567 10.193 -6.644 1006 3HZ LYS 151 HZ1 LYS 151 -12.144 10.881 -5.172 1007 H VAL 152 HN VAL 152 -6.150 13.441 -10.028 1008 HA VAL 152 HA VAL 152 -7.143 13.691 -12.728 1009 HB VAL 152 HB VAL 152 -5.661 15.669 -12.851 1010 1HG1 VAL 152 1HG1 VAL 152 -7.286 15.540 -10.317 1011 2HG1 VAL 152 3HG1 VAL 152 -6.743 17.020 -11.107 1012 3HG1 VAL 152 2HG1 VAL 152 -7.881 15.950 -11.928 1013 1HG2 VAL 152 3HG2 VAL 152 -3.817 14.827 -11.444 1014 2HG2 VAL 152 2HG2 VAL 152 -4.379 16.407 -10.890 1015 3HG2 VAL 152 1HG2 VAL 152 -4.861 14.944 -10.029 1016 H HIS 153 HN HIS 153 -4.731 12.048 -11.036 1017 HA HIS 153 HA HIS 153 -2.889 11.906 -13.186 1018 1HB HIS 153 HB2 HIS 153 -2.037 11.583 -10.904 1019 2HB HIS 153 HB1 HIS 153 -3.102 10.202 -10.674 1020 HD1 HIS 153 HD1 HIS 153 -1.659 8.117 -10.672 1021 HD2 HIS 153 HD2 HIS 153 -0.420 10.903 -13.508 1022 HE1 HIS 153 HE1 HIS 153 0.232 7.040 -11.932 1023 H LYS 154 HN LYS 154 -3.787 11.186 -14.931 1024 HA LYS 154 HA LYS 154 -4.651 8.421 -15.027 1025 1HB LYS 154 HB2 LYS 154 -6.121 10.802 -16.166 1026 2HB LYS 154 HB1 LYS 154 -6.386 9.160 -16.739 1027 1HG LYS 154 HG2 LYS 154 -7.182 8.464 -14.602 1028 2HG LYS 154 HG1 LYS 154 -6.717 9.994 -13.874 1029 1HD LYS 154 HD2 LYS 154 -8.789 9.748 -16.050 1030 2HD LYS 154 HD1 LYS 154 -9.179 9.677 -14.335 1031 1HE LYS 154 HE2 LYS 154 -9.554 11.922 -14.806 1032 2HE LYS 154 HE1 LYS 154 -7.894 11.893 -14.213 1033 1HZ LYS 154 HZ2 LYS 154 -8.564 11.906 -17.106 1034 2HZ LYS 154 HZ1 LYS 154 -8.358 13.282 -16.184 1035 3HZ LYS 154 HZ3 LYS 154 -7.057 12.267 -16.411 1036 H LEU 155 HN LEU 155 -4.396 7.610 -17.274 1037 HA LEU 155 HA LEU 155 -2.158 8.933 -18.518 1038 1HB LEU 155 HB2 LEU 155 -3.591 6.406 -19.316 1039 2HB LEU 155 HB1 LEU 155 -2.153 7.036 -20.085 1040 HG LEU 155 HG LEU 155 -2.373 5.955 -17.283 1041 1HD1 LEU 155 HD1 LEU 155 -2.363 4.316 -19.045 1042 2HD1 LEU 155 HD1 LEU 155 -0.920 5.073 -19.722 1043 3HD1 LEU 155 HD1 LEU 155 -0.837 4.270 -18.138 1044 1HD2 LEU 155 HD2 LEU 155 0.011 7.162 -18.696 1045 2HD2 LEU 155 HD2 LEU 155 -0.812 7.835 -17.286 1046 3HD2 LEU 155 HD2 LEU 155 0.062 6.314 -17.152 1047 H GLU 156 HN GLU 156 -2.978 10.684 -19.149 1048 HA GLU 156 HA GLU 156 -4.997 10.569 -21.255 1049 1HB GLU 156 HB2 GLU 156 -5.754 12.834 -20.600 1050 2HB GLU 156 HB1 GLU 156 -5.991 11.629 -19.349 1051 1HG GLU 156 HG2 GLU 156 -4.004 12.466 -18.181 1052 2HG GLU 156 HG1 GLU 156 -3.803 13.694 -19.430 1053 H HIS 157 HN HIS 157 -4.408 11.134 -23.124 1054 HA HIS 157 HA HIS 157 -1.842 12.318 -23.587 1055 1HB HIS 157 HB2 HIS 157 -4.048 11.665 -25.543 1056 2HB HIS 157 HB1 HIS 157 -2.383 12.068 -25.951 1057 HD1 HIS 157 HD1 HIS 157 -4.540 9.211 -24.955 1058 HD2 HIS 157 HD2 HIS 157 -0.483 10.063 -25.249 1059 HE1 HIS 157 HE1 HIS 157 -3.353 7.011 -24.771 1060 H HIS 158 HN HIS 158 -2.015 14.279 -22.686 1061 HA HIS 158 HA HIS 158 -4.120 16.006 -23.604 1062 1HB HIS 158 HB2 HIS 158 -3.273 17.630 -21.855 1063 2HB HIS 158 HB1 HIS 158 -3.879 16.099 -21.241 1064 HD1 HIS 158 HD1 HIS 158 -2.144 14.545 -20.030 1065 HD2 HIS 158 HD2 HIS 158 -0.539 18.079 -21.531 1066 HE1 HIS 158 HE1 HIS 158 0.114 14.791 -18.970 1067 H HIS 159 HN HIS 159 -1.238 15.217 -24.719 1068 HA HIS 159 HA HIS 159 -1.102 17.712 -26.193 1069 1HB HIS 159 HB2 HIS 159 0.760 17.606 -24.430 1070 2HB HIS 159 HB1 HIS 159 1.377 16.200 -25.288 1071 HD1 HIS 159 HD1 HIS 159 3.298 16.855 -26.797 1072 HD2 HIS 159 HD2 HIS 159 0.455 19.867 -26.445 1073 HE1 HIS 159 HE1 HIS 159 4.089 18.756 -28.244 1074 H HIS 160 HN HIS 160 0.135 17.258 -28.295 1075 HA HIS 160 HA HIS 160 -1.177 15.083 -29.546 1076 1HB HIS 160 HB2 HIS 160 1.009 16.861 -30.635 1077 2HB HIS 160 HB1 HIS 160 -0.018 15.794 -31.590 1078 HD1 HIS 160 HD1 HIS 160 0.254 19.192 -31.129 1079 HD2 HIS 160 HD2 HIS 160 -2.919 16.562 -30.643 1080 HE1 HIS 160 HE1 HIS 160 -1.843 20.583 -31.254 1081 H HIS 161 HN HIS 161 1.907 15.414 -28.109 1082 HA HIS 161 HA HIS 161 2.433 12.631 -28.507 1083 1HB HIS 161 HB2 HIS 161 3.426 13.734 -30.538 1084 2HB HIS 161 HB1 HIS 161 4.425 14.718 -29.490 1085 HD1 HIS 161 HD1 HIS 161 4.031 11.196 -30.756 1086 HD2 HIS 161 HD2 HIS 161 6.668 13.454 -28.482 1087 HE1 HIS 161 HE1 HIS 161 6.112 9.802 -30.520 1088 H HIS 162 HN HIS 162 3.880 11.885 -26.892 1089 HA HIS 162 HA HIS 162 4.437 13.889 -24.861 1090 1HB HIS 162 HB2 HIS 162 3.363 11.095 -24.461 1091 2HB HIS 162 HB1 HIS 162 4.078 12.035 -23.158 1092 HD1 HIS 162 HD1 HIS 162 2.554 13.664 -21.986 1093 HD2 HIS 162 HD2 HIS 162 0.940 12.281 -25.552 1094 HE1 HIS 162 HE1 HIS 162 0.204 14.541 -22.071 No H/Q in entry = 1094 Start of MODEL 14 1 H1 MET 1 HT2 MET 1 19.314 -18.654 -3.239 2 H2 MET 1 HT1 MET 1 17.907 -18.924 -4.118 3 H3 MET 1 HT3 MET 1 19.173 -17.997 -4.796 4 HA MET 1 HA MET 1 18.865 -16.357 -3.054 5 1HB MET 1 HB2 MET 1 16.255 -17.090 -4.427 6 2HB MET 1 HB1 MET 1 16.589 -15.551 -3.659 7 1HG MET 1 HG2 MET 1 18.375 -15.136 -5.299 8 2HG MET 1 HG1 MET 1 17.989 -16.669 -6.079 9 1HE MET 1 HE2 MET 1 18.104 -13.927 -7.670 10 2HE MET 1 HE1 MET 1 17.678 -15.460 -8.426 11 3HE MET 1 HE3 MET 1 16.657 -14.043 -8.666 12 H GLU 2 HN GLU 2 17.644 -15.664 -1.220 13 HA GLU 2 HA GLU 2 16.490 -17.923 0.242 14 1HB GLU 2 HB2 GLU 2 18.818 -16.894 0.877 15 2HB GLU 2 HB1 GLU 2 17.873 -15.558 1.501 16 1HG GLU 2 HG2 GLU 2 17.702 -18.431 2.401 17 2HG GLU 2 HG1 GLU 2 18.537 -17.129 3.238 18 H MET 3 HN MET 3 14.391 -17.576 0.511 19 HA MET 3 HA MET 3 13.123 -15.158 -0.206 20 1HB MET 3 HB2 MET 3 11.010 -16.211 0.482 21 2HB MET 3 HB1 MET 3 11.974 -17.233 -0.567 22 1HG MET 3 HG2 MET 3 12.683 -18.560 1.349 23 2HG MET 3 HG1 MET 3 11.772 -17.502 2.425 24 1HE MET 3 HE2 MET 3 11.533 -20.083 -0.538 25 2HE MET 3 HE1 MET 3 9.787 -20.193 -0.766 26 3HE MET 3 HE3 MET 3 10.633 -18.701 -1.164 27 H GLY 4 HN GLY 4 14.201 -16.329 2.891 28 1HA GLY 4 HA1 GLY 4 14.075 -15.387 4.983 29 2HA GLY 4 HA2 GLY 4 12.589 -14.589 4.471 30 H GLN 5 HN GLN 5 15.930 -14.482 3.404 31 HA GLN 5 HA GLN 5 16.540 -11.864 4.235 32 1HB GLN 5 HB2 GLN 5 17.685 -13.479 1.976 33 2HB GLN 5 HB1 GLN 5 18.352 -11.961 2.541 34 1HG GLN 5 HG2 GLN 5 18.805 -12.908 4.704 35 2HG GLN 5 HG1 GLN 5 18.023 -14.416 4.221 36 1HE2 GLN 5 1HE2 GLN 5 19.995 -12.627 1.976 37 2HE2 GLN 5 2HE2 GLN 5 21.301 -13.733 1.975 38 H LEU 6 HN LEU 6 14.983 -13.042 1.389 39 HA LEU 6 HA LEU 6 15.016 -10.620 -0.077 40 1HB LEU 6 HB2 LEU 6 14.607 -12.835 -1.103 41 2HB LEU 6 HB1 LEU 6 13.130 -12.993 -0.193 42 HG LEU 6 HG LEU 6 12.916 -12.478 -2.676 43 1HD1 LEU 6 HD1 LEU 6 11.545 -10.634 -0.762 44 2HD1 LEU 6 HD1 LEU 6 11.036 -10.983 -2.419 45 3HD1 LEU 6 HD1 LEU 6 11.037 -12.259 -1.201 46 1HD2 LEU 6 HD2 LEU 6 13.781 -9.746 -1.750 47 2HD2 LEU 6 HD2 LEU 6 14.667 -10.801 -2.853 48 3HD2 LEU 6 HD2 LEU 6 13.110 -10.126 -3.335 49 H LYS 7 HN LYS 7 12.675 -12.122 2.096 50 HA LYS 7 HA LYS 7 10.780 -10.020 2.013 51 1HB LYS 7 HB2 LYS 7 10.875 -12.588 3.015 52 2HB LYS 7 HB1 LYS 7 10.861 -11.620 4.475 53 1HG LYS 7 HG2 LYS 7 8.830 -11.306 2.274 54 2HG LYS 7 HG1 LYS 7 8.619 -12.425 3.605 55 1HD LYS 7 HD2 LYS 7 8.936 -9.421 3.858 56 2HD LYS 7 HD1 LYS 7 7.410 -10.300 3.950 57 1HE LYS 7 HE2 LYS 7 8.440 -11.598 5.878 58 2HE LYS 7 HE1 LYS 7 9.740 -10.413 5.841 59 1HZ LYS 7 HZ2 LYS 7 8.053 -8.659 6.245 60 2HZ LYS 7 HZ1 LYS 7 6.875 -9.835 6.341 61 3HZ LYS 7 HZ3 LYS 7 8.107 -9.818 7.473 62 H ASN 8 HN ASN 8 13.621 -10.638 3.879 63 HA ASN 8 HA ASN 8 13.430 -8.678 5.878 64 1HB ASN 8 HB2 ASN 8 15.136 -10.488 5.839 65 2HB ASN 8 HB1 ASN 8 15.871 -9.761 4.425 66 1HD2 ASN 8 HD2 ASN 8 16.922 -10.430 7.099 67 2HD2 ASN 8 HD2 ASN 8 17.633 -8.973 7.682 68 H LYS 9 HN LYS 9 14.767 -8.509 2.578 69 HA LYS 9 HA LYS 9 15.396 -5.747 2.612 70 1HB LYS 9 HB2 LYS 9 14.780 -7.618 0.321 71 2HB LYS 9 HB1 LYS 9 15.239 -5.940 0.078 72 1HG LYS 9 HG2 LYS 9 16.927 -7.945 1.539 73 2HG LYS 9 HG1 LYS 9 17.093 -7.600 -0.184 74 1HD LYS 9 HD2 LYS 9 17.600 -5.261 0.328 75 2HD LYS 9 HD1 LYS 9 17.386 -5.573 2.046 76 1HE LYS 9 HE2 LYS 9 19.755 -5.515 1.413 77 2HE LYS 9 HE1 LYS 9 19.287 -7.094 2.031 78 1HZ LYS 9 HZ2 LYS 9 19.588 -6.386 -0.844 79 2HZ LYS 9 HZ1 LYS 9 20.700 -7.234 0.077 80 3HZ LYS 9 HZ3 LYS 9 19.194 -7.912 -0.232 81 H ILE 10 HN ILE 10 12.525 -7.529 1.775 82 HA ILE 10 HA ILE 10 10.955 -5.433 0.834 83 HB ILE 10 HB ILE 10 10.242 -8.019 2.200 84 1HG1 ILE 10 2HG1 ILE 10 10.042 -7.071 -0.655 85 2HG1 ILE 10 1HG1 ILE 10 11.266 -8.152 -0.001 86 1HG2 ILE 10 2HG2 ILE 10 8.415 -6.471 2.690 87 2HG2 ILE 10 1HG2 ILE 10 8.291 -6.074 0.976 88 3HG2 ILE 10 3HG2 ILE 10 7.904 -7.700 1.534 89 1HD1 ILE 10 HD1 ILE 10 9.542 -9.804 0.449 90 2HD1 ILE 10 HD1 ILE 10 8.327 -8.715 -0.215 91 3HD1 ILE 10 HD1 ILE 10 9.604 -9.355 -1.251 92 H GLU 11 HN GLU 11 11.243 -6.706 4.136 93 HA GLU 11 HA GLU 11 9.603 -4.889 5.458 94 1HB GLU 11 HB2 GLU 11 12.157 -6.188 6.394 95 2HB GLU 11 HB1 GLU 11 11.114 -5.237 7.436 96 1HG GLU 11 HG2 GLU 11 10.364 -7.771 6.008 97 2HG GLU 11 HG1 GLU 11 10.719 -7.600 7.728 98 H ASN 12 HN ASN 12 13.014 -4.694 4.810 99 HA ASN 12 HA ASN 12 13.643 -2.266 5.998 100 1HB ASN 12 HB2 ASN 12 15.219 -4.009 5.016 101 2HB ASN 12 HB1 ASN 12 14.845 -3.347 3.443 102 1HD2 ASN 12 HD2 ASN 12 17.358 -3.563 4.800 103 2HD2 ASN 12 HD2 ASN 12 18.019 -1.977 4.936 104 H LYS 13 HN LYS 13 12.671 -2.957 2.670 105 HA LYS 13 HA LYS 13 12.871 -0.318 1.694 106 1HB LYS 13 HB2 LYS 13 12.856 -2.586 0.457 107 2HB LYS 13 HB1 LYS 13 11.116 -2.445 0.540 108 1HG LYS 13 HG2 LYS 13 11.968 -1.668 -1.601 109 2HG LYS 13 HG1 LYS 13 11.188 -0.365 -0.702 110 1HD LYS 13 HD2 LYS 13 13.328 0.299 -1.789 111 2HD LYS 13 HD1 LYS 13 13.310 0.548 -0.050 112 1HE LYS 13 HE2 LYS 13 14.544 -1.473 0.281 113 2HE LYS 13 HE1 LYS 13 14.566 -1.818 -1.463 114 1HZ LYS 13 HZ3 LYS 13 15.782 0.292 -1.714 115 2HZ LYS 13 HZ2 LYS 13 15.766 0.435 0.001 116 3HZ LYS 13 HZ1 LYS 13 16.616 -0.828 -0.736 117 H LYS 14 HN LYS 14 10.169 -2.306 2.730 118 HA LYS 14 HA LYS 14 7.974 -0.668 2.333 119 1HB LYS 14 HB2 LYS 14 7.947 -3.027 3.073 120 2HB LYS 14 HB1 LYS 14 8.625 -2.537 4.609 121 1HG LYS 14 HG2 LYS 14 6.562 -1.259 5.064 122 2HG LYS 14 HG1 LYS 14 5.897 -1.859 3.544 123 1HD LYS 14 HD2 LYS 14 5.057 -3.265 5.320 124 2HD LYS 14 HD1 LYS 14 6.247 -4.185 4.395 125 1HE LYS 14 HE2 LYS 14 7.941 -3.675 6.077 126 2HE LYS 14 HE1 LYS 14 6.738 -2.780 7.000 127 1HZ LYS 14 HZ3 LYS 14 5.486 -5.034 7.138 128 2HZ LYS 14 HZ2 LYS 14 6.891 -5.700 6.484 129 3HZ LYS 14 HZ1 LYS 14 6.976 -4.936 7.920 130 H LYS 15 HN LYS 15 10.124 -0.977 5.021 131 HA LYS 15 HA LYS 15 9.027 0.992 6.716 132 1HB LYS 15 HB2 LYS 15 11.629 -0.472 6.655 133 2HB LYS 15 HB1 LYS 15 11.350 0.807 7.827 134 1HG LYS 15 HG2 LYS 15 9.607 -0.377 8.874 135 2HG LYS 15 HG1 LYS 15 9.444 -1.493 7.517 136 1HD LYS 15 HD2 LYS 15 11.374 -2.598 8.025 137 2HD LYS 15 HD1 LYS 15 11.998 -1.369 9.130 138 1HE LYS 15 HE2 LYS 15 10.058 -1.949 10.636 139 2HE LYS 15 HE1 LYS 15 9.639 -3.234 9.505 140 1HZ LYS 15 HZ2 LYS 15 12.226 -3.044 10.959 141 2HZ LYS 15 HZ1 LYS 15 10.941 -4.039 11.390 142 3HZ LYS 15 HZ3 LYS 15 11.752 -4.288 9.946 143 H GLU 16 HN GLU 16 11.692 1.144 4.410 144 HA GLU 16 HA GLU 16 12.483 3.787 4.870 145 1HB GLU 16 HB2 GLU 16 12.424 2.186 2.302 146 2HB GLU 16 HB1 GLU 16 13.117 3.796 2.409 147 1HG GLU 16 HG2 GLU 16 14.724 2.868 4.066 148 2HG GLU 16 HG1 GLU 16 14.029 1.273 3.754 149 H LEU 17 HN LEU 17 9.963 2.454 2.820 150 HA LEU 17 HA LEU 17 9.066 4.839 1.629 151 1HB LEU 17 HB2 LEU 17 8.443 2.722 0.733 152 2HB LEU 17 HB1 LEU 17 7.654 2.267 2.235 153 HG LEU 17 HG LEU 17 6.226 4.429 1.733 154 1HD1 LEU 17 HD1 LEU 17 7.217 3.906 -0.917 155 2HD1 LEU 17 HD1 LEU 17 5.719 4.776 -0.468 156 3HD1 LEU 17 HD1 LEU 17 7.287 5.344 0.112 157 1HD2 LEU 17 HD2 LEU 17 5.440 2.230 2.009 158 2HD2 LEU 17 HD2 LEU 17 4.587 3.178 0.805 159 3HD2 LEU 17 HD2 LEU 17 5.726 1.872 0.283 160 H ILE 18 HN ILE 18 8.009 3.077 4.489 161 HA ILE 18 HA ILE 18 5.812 4.652 5.088 162 HB ILE 18 HB ILE 18 7.565 3.195 7.102 163 1HG1 ILE 18 2HG1 ILE 18 4.970 2.255 5.888 164 2HG1 ILE 18 1HG1 ILE 18 6.528 1.876 5.164 165 1HG2 ILE 18 3HG2 ILE 18 4.735 4.257 7.279 166 2HG2 ILE 18 2HG2 ILE 18 5.476 3.221 8.509 167 3HG2 ILE 18 1HG2 ILE 18 6.118 4.830 8.188 168 1HD1 ILE 18 HD1 ILE 18 5.699 1.131 7.960 169 2HD1 ILE 18 HD1 ILE 18 5.637 0.068 6.559 170 3HD1 ILE 18 HD1 ILE 18 7.184 0.663 7.142 171 H GLN 19 HN GLN 19 9.186 4.963 6.090 172 HA GLN 19 HA GLN 19 8.937 7.180 7.775 173 1HB GLN 19 HB2 GLN 19 11.214 6.378 5.960 174 2HB GLN 19 HB1 GLN 19 11.335 7.607 7.204 175 1HG GLN 19 HG2 GLN 19 10.857 5.924 8.912 176 2HG GLN 19 HG1 GLN 19 10.707 4.700 7.653 177 1HE2 GLN 19 1HE2 GLN 19 12.533 4.853 9.920 178 2HE2 GLN 19 2HE2 GLN 19 14.121 4.758 9.252 179 H LEU 20 HN LEU 20 9.195 6.929 4.301 180 HA LEU 20 HA LEU 20 9.502 9.699 3.838 181 1HB LEU 20 HB2 LEU 20 8.636 7.505 1.971 182 2HB LEU 20 HB1 LEU 20 8.999 9.146 1.478 183 HG LEU 20 HG LEU 20 10.973 7.221 2.708 184 1HD1 LEU 20 HD1 LEU 20 10.668 8.196 -0.122 185 2HD1 LEU 20 HD1 LEU 20 11.993 7.208 0.489 186 3HD1 LEU 20 HD1 LEU 20 10.348 6.566 0.464 187 1HD2 LEU 20 HD2 LEU 20 11.343 10.005 1.599 188 2HD2 LEU 20 HD2 LEU 20 11.524 9.517 3.282 189 3HD2 LEU 20 HD2 LEU 20 12.648 8.917 2.063 190 H VAL 21 HN VAL 21 6.511 7.548 3.504 191 HA VAL 21 HA VAL 21 4.946 9.756 2.930 192 HB VAL 21 HB VAL 21 3.132 8.343 3.050 193 1HG1 VAL 21 2HG1 VAL 21 5.375 6.545 2.446 194 2HG1 VAL 21 1HG1 VAL 21 3.672 6.232 2.087 195 3HG1 VAL 21 3HG1 VAL 21 4.488 7.614 1.343 196 1HG2 VAL 21 3HG2 VAL 21 4.553 6.608 5.034 197 2HG2 VAL 21 2HG2 VAL 21 3.153 7.689 5.284 198 3HG2 VAL 21 1HG2 VAL 21 2.984 6.253 4.276 199 H ALA 22 HN ALA 22 6.050 8.434 5.958 200 HA ALA 22 HA ALA 22 4.221 9.638 7.709 201 1HB ALA 22 HB1 ALA 22 7.063 8.833 8.228 202 2HB ALA 22 HB3 ALA 22 5.805 9.069 9.451 203 3HB ALA 22 HB2 ALA 22 5.673 7.762 8.259 204 H ARG 23 HN ARG 23 7.475 10.623 6.701 205 HA ARG 23 HA ARG 23 7.551 12.974 8.255 206 1HB ARG 23 HB2 ARG 23 9.479 13.633 6.906 207 2HB ARG 23 HB1 ARG 23 9.604 11.955 7.422 208 1HG ARG 23 HG2 ARG 23 8.814 11.282 5.181 209 2HG ARG 23 HG1 ARG 23 8.845 12.973 4.688 210 1HD ARG 23 HD2 ARG 23 10.880 11.857 3.986 211 2HD ARG 23 HD1 ARG 23 11.244 13.052 5.234 212 HE ARG 23 HE ARG 23 10.811 10.611 6.491 213 1HH1 ARG 23 1HH1 ARG 23 13.155 12.045 4.279 214 2HH1 ARG 23 2HH1 ARG 23 14.475 11.120 4.813 215 1HH2 ARG 23 1HH2 ARG 23 12.572 9.315 7.234 216 2HH2 ARG 23 2HH2 ARG 23 14.131 9.487 6.563 217 H HIS 24 HN HIS 24 5.986 12.249 5.367 218 HA HIS 24 HA HIS 24 5.850 14.762 4.159 219 1HB HIS 24 HB2 HIS 24 5.256 12.739 2.964 220 2HB HIS 24 HB1 HIS 24 3.908 12.427 4.033 221 HD1 HIS 24 HD1 HIS 24 5.009 15.086 1.467 222 HD2 HIS 24 HD2 HIS 24 1.628 13.481 3.223 223 HE1 HIS 24 HE1 HIS 24 3.066 16.185 0.312 224 H GLY 25 HN GLY 25 4.110 13.478 6.916 225 1HA GLY 25 HA1 GLY 25 2.251 15.733 6.795 226 2HA GLY 25 HA2 GLY 25 3.419 15.740 8.108 227 H LEU 26 HN LEU 26 2.695 12.543 7.603 228 HA LEU 26 HA LEU 26 0.257 12.308 8.869 229 1HB LEU 26 HB2 LEU 26 2.562 10.547 8.315 230 2HB LEU 26 HB1 LEU 26 1.266 9.983 9.344 231 HG LEU 26 HG LEU 26 -0.301 10.414 7.526 232 1HD1 LEU 26 HD1 LEU 26 2.099 10.923 5.827 233 2HD1 LEU 26 HD1 LEU 26 0.436 10.616 5.290 234 3HD1 LEU 26 HD1 LEU 26 0.795 12.056 6.261 235 1HD2 LEU 26 HD2 LEU 26 1.948 8.563 6.922 236 2HD2 LEU 26 HD2 LEU 26 0.513 8.208 7.903 237 3HD2 LEU 26 HD2 LEU 26 0.361 8.512 6.157 238 H ASP 27 HN ASP 27 -0.248 11.676 10.857 239 HA ASP 27 HA ASP 27 1.525 12.377 13.067 240 1HB ASP 27 HB2 ASP 27 -0.960 12.857 13.208 241 2HB ASP 27 HB1 ASP 27 -1.254 11.128 13.108 242 H HIS 28 HN HIS 28 1.966 10.689 14.729 243 HA HIS 28 HA HIS 28 2.978 8.395 13.530 244 1HB HIS 28 HB2 HIS 28 2.573 9.051 16.436 245 2HB HIS 28 HB1 HIS 28 3.265 7.524 15.896 246 HD1 HIS 28 HD1 HIS 28 4.475 10.523 17.202 247 HD2 HIS 28 HD2 HIS 28 5.430 8.319 13.811 248 HE1 HIS 28 HE1 HIS 28 6.814 11.206 16.558 249 H ASP 29 HN ASP 29 -0.164 8.977 14.888 250 HA ASP 29 HA ASP 29 -1.104 6.309 15.149 251 1HB ASP 29 HB2 ASP 29 -2.433 8.087 15.984 252 2HB ASP 29 HB1 ASP 29 -2.440 8.924 14.439 253 H LYS 30 HN LYS 30 -0.921 8.506 12.488 254 HA LYS 30 HA LYS 30 -2.220 6.789 10.626 255 1HB LYS 30 HB2 LYS 30 -0.598 9.286 10.333 256 2HB LYS 30 HB1 LYS 30 -1.319 8.480 8.953 257 1HG LYS 30 HG2 LYS 30 -2.776 9.637 11.339 258 2HG LYS 30 HG1 LYS 30 -2.691 10.355 9.729 259 1HD LYS 30 HD2 LYS 30 -3.892 8.468 8.791 260 2HD LYS 30 HD1 LYS 30 -3.908 7.656 10.349 261 1HE LYS 30 HE2 LYS 30 -5.223 10.277 9.722 262 2HE LYS 30 HE1 LYS 30 -6.045 8.724 9.842 263 1HZ LYS 30 HZ2 LYS 30 -5.135 8.661 12.224 264 2HZ LYS 30 HZ1 LYS 30 -4.731 10.265 12.008 265 3HZ LYS 30 HZ3 LYS 30 -6.347 9.807 11.911 266 H VAL 31 HN VAL 31 1.056 7.434 11.548 267 HA VAL 31 HA VAL 31 2.292 6.015 9.438 268 HB VAL 31 HB VAL 31 3.324 6.498 12.252 269 1HG1 VAL 31 3HG1 VAL 31 4.590 4.794 11.046 270 2HG1 VAL 31 2HG1 VAL 31 4.817 5.918 9.707 271 3HG1 VAL 31 1HG1 VAL 31 5.539 6.263 11.278 272 1HG2 VAL 31 2HG2 VAL 31 2.641 8.557 11.127 273 2HG2 VAL 31 1HG2 VAL 31 4.403 8.486 11.336 274 3HG2 VAL 31 3HG2 VAL 31 3.665 8.152 9.765 275 H LEU 32 HN LEU 32 1.192 5.149 12.682 276 HA LEU 32 HA LEU 32 2.038 2.484 12.624 277 1HB LEU 32 HB2 LEU 32 -0.313 3.654 14.097 278 2HB LEU 32 HB1 LEU 32 0.390 2.082 14.395 279 HG LEU 32 HG LEU 32 1.639 4.765 14.919 280 1HD1 LEU 32 HD1 LEU 32 0.012 4.089 16.537 281 2HD1 LEU 32 HD1 LEU 32 0.818 2.533 16.737 282 3HD1 LEU 32 HD1 LEU 32 1.634 4.016 17.234 283 1HD2 LEU 32 HD2 LEU 32 2.869 2.029 15.247 284 2HD2 LEU 32 HD2 LEU 32 3.357 3.276 14.093 285 3HD2 LEU 32 HD2 LEU 32 3.557 3.552 15.820 286 H LEU 33 HN LEU 33 -1.133 3.894 11.929 287 HA LEU 33 HA LEU 33 -2.367 1.486 11.226 288 1HB LEU 33 HB2 LEU 33 -2.974 4.259 10.242 289 2HB LEU 33 HB1 LEU 33 -4.040 2.876 10.093 290 HG LEU 33 HG LEU 33 -3.122 4.033 12.715 291 1HD1 LEU 33 HD1 LEU 33 -5.687 4.420 11.212 292 2HD1 LEU 33 HD1 LEU 33 -5.365 4.921 12.880 293 3HD1 LEU 33 HD1 LEU 33 -4.451 5.637 11.554 294 1HD2 LEU 33 HD2 LEU 33 -5.268 2.015 12.055 295 2HD2 LEU 33 HD2 LEU 33 -3.737 1.678 12.867 296 3HD2 LEU 33 HD2 LEU 33 -4.947 2.693 13.653 297 H PHE 34 HN PHE 34 -0.668 3.835 9.183 298 HA PHE 34 HA PHE 34 -1.185 2.589 6.736 299 1HB PHE 34 HB2 PHE 34 -0.323 4.853 6.792 300 2HB PHE 34 HB1 PHE 34 1.155 4.314 7.581 301 HD1 PHE 34 HD1 PHE 34 -0.789 4.024 4.427 302 HD2 PHE 34 HD2 PHE 34 3.004 3.679 6.316 303 HE1 PHE 34 HE1 PHE 34 0.282 3.722 2.232 304 HE2 PHE 34 HE2 PHE 34 4.074 3.380 4.131 305 HZ PHE 34 HZ PHE 34 2.724 3.398 2.093 306 H SER 35 HN SER 35 1.622 2.240 8.908 307 HA SER 35 HA SER 35 3.017 0.469 7.272 308 1HB SER 35 HB2 SER 35 4.275 -0.103 9.396 309 2HB SER 35 HB1 SER 35 4.164 1.615 9.003 310 HG SER 35 HG SER 35 2.782 1.944 10.566 311 H ARG 36 HN ARG 36 0.581 -0.126 9.673 312 HA ARG 36 HA ARG 36 0.896 -2.959 9.786 313 1HB ARG 36 HB2 ARG 36 -1.502 -1.283 10.502 314 2HB ARG 36 HB1 ARG 36 -1.206 -2.945 11.014 315 1HG ARG 36 HG2 ARG 36 0.728 -2.237 12.267 316 2HG ARG 36 HG1 ARG 36 0.515 -0.602 11.621 317 1HD ARG 36 HD2 ARG 36 -0.329 -0.629 13.848 318 2HD ARG 36 HD1 ARG 36 -1.671 -0.482 12.729 319 HE ARG 36 HE ARG 36 -2.191 -2.749 13.101 320 1HH1 ARG 36 1HH1 ARG 36 0.301 -1.472 15.256 321 2HH1 ARG 36 2HH1 ARG 36 -0.120 -2.457 16.577 322 1HH2 ARG 36 1HH2 ARG 36 -2.726 -4.168 14.897 323 2HH2 ARG 36 2HH2 ARG 36 -1.890 -3.991 16.379 324 H ASP 37 HN ASP 37 -1.287 -0.791 8.006 325 HA ASP 37 HA ASP 37 -2.714 -3.010 6.860 326 1HB ASP 37 HB2 ASP 37 -3.566 -0.600 7.289 327 2HB ASP 37 HB1 ASP 37 -2.791 -0.224 5.759 328 H LEU 38 HN LEU 38 -0.052 -1.032 5.986 329 HA LEU 38 HA LEU 38 0.260 -1.868 3.317 330 1HB LEU 38 HB2 LEU 38 1.424 0.067 4.066 331 2HB LEU 38 HB1 LEU 38 2.136 -0.789 5.406 332 HG LEU 38 HG LEU 38 3.690 -1.916 3.936 333 1HD1 LEU 38 HD1 LEU 38 2.255 -2.200 1.997 334 2HD1 LEU 38 HD1 LEU 38 2.332 -0.453 1.682 335 3HD1 LEU 38 HD1 LEU 38 3.796 -1.442 1.581 336 1HD2 LEU 38 HD2 LEU 38 3.491 1.024 3.357 337 2HD2 LEU 38 HD2 LEU 38 4.294 0.277 4.738 338 3HD2 LEU 38 HD2 LEU 38 4.917 0.022 3.106 339 H ASP 39 HN ASP 39 1.514 -3.094 6.387 340 HA ASP 39 HA ASP 39 3.042 -5.210 5.350 341 1HB ASP 39 HB2 ASP 39 3.102 -4.370 7.729 342 2HB ASP 39 HB1 ASP 39 1.568 -5.185 8.000 343 H LYS 40 HN LYS 40 -0.290 -5.088 6.504 344 HA LYS 40 HA LYS 40 -1.166 -7.665 5.966 345 1HB LYS 40 HB2 LYS 40 -2.601 -5.022 5.780 346 2HB LYS 40 HB1 LYS 40 -3.407 -6.563 5.541 347 1HG LYS 40 HG2 LYS 40 -3.081 -7.196 7.797 348 2HG LYS 40 HG1 LYS 40 -1.898 -5.914 8.060 349 1HD LYS 40 HD2 LYS 40 -4.131 -5.452 9.066 350 2HD LYS 40 HD1 LYS 40 -3.636 -4.211 7.937 351 1HE LYS 40 HE2 LYS 40 -5.040 -5.449 6.204 352 2HE LYS 40 HE1 LYS 40 -5.675 -6.399 7.549 353 1HZ LYS 40 HZ3 LYS 40 -6.345 -4.218 8.565 354 2HZ LYS 40 HZ2 LYS 40 -5.879 -3.476 7.125 355 3HZ LYS 40 HZ1 LYS 40 -7.139 -4.583 7.112 356 H LEU 41 HN LEU 41 -1.106 -4.865 3.776 357 HA LEU 41 HA LEU 41 -2.344 -6.025 1.512 358 1HB LEU 41 HB2 LEU 41 -1.580 -3.523 2.097 359 2HB LEU 41 HB1 LEU 41 -0.130 -3.997 1.264 360 HG LEU 41 HG LEU 41 -2.897 -3.815 0.059 361 1HD1 LEU 41 HD1 LEU 41 -1.984 -1.675 0.446 362 2HD1 LEU 41 HD1 LEU 41 -0.505 -2.128 -0.409 363 3HD1 LEU 41 HD1 LEU 41 -2.045 -2.057 -1.273 364 1HD2 LEU 41 HD2 LEU 41 -1.662 -5.621 -0.971 365 2HD2 LEU 41 HD2 LEU 41 -1.916 -4.262 -2.071 366 3HD2 LEU 41 HD2 LEU 41 -0.345 -4.499 -1.297 367 H ILE 42 HN ILE 42 1.039 -5.677 2.410 368 HA ILE 42 HA ILE 42 2.131 -7.036 0.211 369 HB ILE 42 HB ILE 42 3.242 -6.586 3.002 370 1HG1 ILE 42 2HG1 ILE 42 3.798 -5.266 0.362 371 2HG1 ILE 42 1HG1 ILE 42 2.835 -4.571 1.660 372 1HG2 ILE 42 2HG2 ILE 42 4.653 -7.652 0.556 373 2HG2 ILE 42 1HG2 ILE 42 5.455 -7.148 2.050 374 3HG2 ILE 42 3HG2 ILE 42 4.342 -8.519 2.060 375 1HD1 ILE 42 HD1 ILE 42 5.772 -5.214 1.774 376 2HD1 ILE 42 HD1 ILE 42 5.060 -3.612 1.573 377 3HD1 ILE 42 HD1 ILE 42 4.799 -4.502 3.070 378 H ASN 43 HN ASN 43 1.431 -8.236 3.480 379 HA ASN 43 HA ASN 43 2.244 -10.879 3.133 380 1HB ASN 43 HB2 ASN 43 -0.089 -9.918 4.825 381 2HB ASN 43 HB1 ASN 43 0.651 -11.518 4.864 382 1HD2 ASN 43 HD2 ASN 43 0.376 -9.393 6.910 383 2HD2 ASN 43 HD2 ASN 43 1.960 -9.038 7.471 384 H LYS 44 HN LYS 44 -0.749 -9.342 2.243 385 HA LYS 44 HA LYS 44 -2.312 -11.567 1.643 386 1HB LYS 44 HB2 LYS 44 -3.116 -9.260 1.874 387 2HB LYS 44 HB1 LYS 44 -2.329 -8.839 0.367 388 1HG LYS 44 HG2 LYS 44 -3.809 -10.493 -0.793 389 2HG LYS 44 HG1 LYS 44 -4.636 -10.717 0.753 390 1HD LYS 44 HD2 LYS 44 -4.410 -8.119 -0.737 391 2HD LYS 44 HD1 LYS 44 -5.839 -9.150 -0.660 392 1HE LYS 44 HE2 LYS 44 -4.511 -7.743 1.666 393 2HE LYS 44 HE1 LYS 44 -6.024 -7.305 0.886 394 1HZ LYS 44 HZ3 LYS 44 -6.945 -9.460 1.619 395 2HZ LYS 44 HZ2 LYS 44 -5.513 -9.797 2.413 396 3HZ LYS 44 HZ1 LYS 44 -6.447 -8.483 2.907 397 H PHE 45 HN PHE 45 -0.275 -9.594 -0.441 398 HA PHE 45 HA PHE 45 -0.790 -11.245 -2.714 399 1HB PHE 45 HB2 PHE 45 0.841 -8.808 -2.228 400 2HB PHE 45 HB1 PHE 45 1.083 -9.706 -3.718 401 HD1 PHE 45 HD1 PHE 45 -1.234 -7.643 -1.789 402 HD2 PHE 45 HD2 PHE 45 -0.674 -9.892 -5.351 403 HE1 PHE 45 HE1 PHE 45 -3.265 -6.625 -2.743 404 HE2 PHE 45 HE2 PHE 45 -2.695 -8.887 -6.310 405 HZ PHE 45 HZ PHE 45 -3.995 -7.246 -5.009 406 H MET 46 HN MET 46 1.728 -10.861 -0.443 407 HA MET 46 HA MET 46 3.753 -12.411 -1.746 408 1HB MET 46 HB2 MET 46 3.254 -11.710 1.130 409 2HB MET 46 HB1 MET 46 4.700 -12.548 0.568 410 1HG MET 46 HG2 MET 46 3.800 -9.838 -0.360 411 2HG MET 46 HG1 MET 46 4.993 -10.125 0.904 412 1HE MET 46 HE2 MET 46 7.310 -10.947 0.561 413 2HE MET 46 HE1 MET 46 6.683 -12.484 -0.062 414 3HE MET 46 HE3 MET 46 7.939 -11.610 -0.950 415 H ASN 47 HN ASN 47 0.948 -13.120 0.147 416 HA ASN 47 HA ASN 47 -0.154 -15.004 0.680 417 1HB ASN 47 HB2 ASN 47 0.358 -15.778 -1.623 418 2HB ASN 47 HB1 ASN 47 1.913 -16.378 -1.085 419 1HD2 ASN 47 HD2 ASN 47 1.474 -18.422 -1.806 420 2HD2 ASN 47 HD2 ASN 47 0.376 -19.483 -1.008 421 H VAL 48 HN VAL 48 2.485 -14.027 1.836 422 HA VAL 48 HA VAL 48 3.530 -16.328 3.126 423 HB VAL 48 HB VAL 48 5.034 -14.836 4.399 424 1HG1 VAL 48 3HG1 VAL 48 4.955 -14.446 1.428 425 2HG1 VAL 48 2HG1 VAL 48 6.345 -14.044 2.444 426 3HG1 VAL 48 1HG1 VAL 48 5.776 -15.715 2.323 427 1HG2 VAL 48 1HG2 VAL 48 3.698 -12.625 2.844 428 2HG2 VAL 48 3HG2 VAL 48 3.638 -12.868 4.588 429 3HG2 VAL 48 2HG2 VAL 48 5.167 -12.438 3.810 430 H LYS 49 HN LYS 49 2.438 -17.260 4.375 431 HA LYS 49 HA LYS 49 1.053 -15.896 6.546 432 1HB LYS 49 HB2 LYS 49 0.883 -18.767 5.590 433 2HB LYS 49 HB1 LYS 49 -0.121 -18.055 6.850 434 1HG LYS 49 HG2 LYS 49 -1.197 -16.597 5.273 435 2HG LYS 49 HG1 LYS 49 -0.084 -17.074 4.000 436 1HD LYS 49 HD2 LYS 49 -2.091 -18.884 5.352 437 2HD LYS 49 HD1 LYS 49 -2.293 -18.139 3.766 438 1HE LYS 49 HE2 LYS 49 -0.170 -20.149 4.546 439 2HE LYS 49 HE1 LYS 49 -1.578 -20.452 3.542 440 1HZ LYS 49 HZ1 LYS 49 0.636 -18.578 2.805 441 2HZ LYS 49 HZ3 LYS 49 0.449 -20.155 2.274 442 3HZ LYS 49 HZ2 LYS 49 -0.683 -18.995 1.840 443 H ASP 50 HN ASP 50 2.911 -15.437 7.636 444 HA ASP 50 HA ASP 50 4.944 -17.439 7.933 445 1HB ASP 50 HB2 ASP 50 5.280 -14.907 7.602 446 2HB ASP 50 HB1 ASP 50 4.907 -14.762 9.312 447 H LYS 51 HN LYS 51 5.933 -17.370 10.338 448 HA LYS 51 HA LYS 51 3.837 -18.713 11.847 449 1HB LYS 51 HB2 LYS 51 5.755 -19.725 13.112 450 2HB LYS 51 HB1 LYS 51 5.689 -20.119 11.405 451 1HG LYS 51 HG2 LYS 51 7.433 -18.417 10.973 452 2HG LYS 51 HG1 LYS 51 7.526 -18.109 12.707 453 1HD LYS 51 HD2 LYS 51 8.230 -20.368 13.129 454 2HD LYS 51 HD1 LYS 51 7.985 -20.809 11.443 455 1HE LYS 51 HE2 LYS 51 10.351 -20.488 11.904 456 2HE LYS 51 HE1 LYS 51 9.773 -19.264 10.784 457 1HZ LYS 51 HZ1 LYS 51 10.178 -18.864 13.698 458 2HZ LYS 51 HZ3 LYS 51 11.235 -18.360 12.508 459 3HZ LYS 51 HZ2 LYS 51 9.715 -17.662 12.615 460 H VAL 52 HN VAL 52 4.667 -15.807 11.758 461 HA VAL 52 HA VAL 52 5.071 -15.332 14.582 462 HB VAL 52 HB VAL 52 5.038 -12.858 13.935 463 1HG1 VAL 52 3HG1 VAL 52 7.086 -14.665 12.653 464 2HG1 VAL 52 2HG1 VAL 52 7.311 -12.950 13.009 465 3HG1 VAL 52 1HG1 VAL 52 7.104 -14.106 14.324 466 1HG2 VAL 52 2HG2 VAL 52 3.830 -13.157 11.791 467 2HG2 VAL 52 1HG2 VAL 52 5.374 -12.319 11.581 468 3HG2 VAL 52 3HG2 VAL 52 5.230 -14.023 11.164 469 H HIS 53 HN HIS 53 3.714 -13.605 15.617 470 HA HIS 53 HA HIS 53 0.974 -14.538 15.343 471 1HB HIS 53 HB2 HIS 53 2.356 -13.075 17.606 472 2HB HIS 53 HB1 HIS 53 0.660 -13.530 17.623 473 HD1 HIS 53 HD1 HIS 53 0.132 -15.941 18.371 474 HD2 HIS 53 HD2 HIS 53 4.173 -15.270 17.665 475 HE1 HIS 53 HE1 HIS 53 1.325 -17.967 19.213 476 H LYS 54 HN LYS 54 -0.538 -12.598 16.333 477 HA LYS 54 HA LYS 54 -0.374 -10.533 14.289 478 1HB LYS 54 HB2 LYS 54 -2.541 -11.386 16.210 479 2HB LYS 54 HB1 LYS 54 -2.638 -9.919 15.260 480 1HG LYS 54 HG2 LYS 54 -2.214 -12.592 13.973 481 2HG LYS 54 HG1 LYS 54 -3.824 -12.005 14.381 482 1HD LYS 54 HD2 LYS 54 -1.919 -10.350 12.731 483 2HD LYS 54 HD1 LYS 54 -2.927 -11.581 11.994 484 1HE LYS 54 HE2 LYS 54 -3.990 -9.380 11.792 485 2HE LYS 54 HE1 LYS 54 -4.954 -10.443 12.796 486 1HZ LYS 54 HZ3 LYS 54 -3.186 -8.242 13.796 487 2HZ LYS 54 HZ2 LYS 54 -4.856 -8.197 13.669 488 3HZ LYS 54 HZ1 LYS 54 -4.159 -9.251 14.760 489 H LEU 55 HN LEU 55 -0.668 -8.328 14.853 490 HA LEU 55 HA LEU 55 0.526 -7.552 17.362 491 1HB LEU 55 HB2 LEU 55 -0.636 -5.892 15.110 492 2HB LEU 55 HB1 LEU 55 0.279 -5.263 16.460 493 HG LEU 55 HG LEU 55 1.370 -7.086 14.309 494 1HD1 LEU 55 HD1 LEU 55 1.782 -4.144 14.802 495 2HD1 LEU 55 HD1 LEU 55 2.634 -5.113 13.598 496 3HD1 LEU 55 HD1 LEU 55 0.893 -4.868 13.462 497 1HD2 LEU 55 HD2 LEU 55 2.755 -5.694 16.606 498 2HD2 LEU 55 HD2 LEU 55 2.496 -7.431 16.448 499 3HD2 LEU 55 HD2 LEU 55 3.556 -6.590 15.316 500 H GLU 56 HN GLU 56 -0.880 -5.386 18.201 501 HA GLU 56 HA GLU 56 -2.648 -4.678 19.370 502 1HB GLU 56 HB2 GLU 56 -4.249 -6.744 17.852 503 2HB GLU 56 HB1 GLU 56 -4.947 -5.672 19.054 504 1HG GLU 56 HG2 GLU 56 -4.387 -3.758 17.686 505 2HG GLU 56 HG1 GLU 56 -3.589 -4.811 16.519 506 H HIS 57 HN HIS 57 -2.150 -5.008 21.313 507 HA HIS 57 HA HIS 57 -2.067 -7.652 22.399 508 1HB HIS 57 HB2 HIS 57 -1.514 -4.924 23.573 509 2HB HIS 57 HB1 HIS 57 -1.556 -6.375 24.554 510 HD1 HIS 57 HD1 HIS 57 0.779 -7.001 25.075 511 HD2 HIS 57 HD2 HIS 57 0.395 -5.613 21.180 512 HE1 HIS 57 HE1 HIS 57 3.087 -7.142 24.047 513 H HIS 58 HN HIS 58 -3.999 -8.496 22.544 514 HA HIS 58 HA HIS 58 -5.825 -7.297 24.406 515 1HB HIS 58 HB2 HIS 58 -7.798 -7.698 22.912 516 2HB HIS 58 HB1 HIS 58 -6.759 -6.392 22.377 517 HD1 HIS 58 HD1 HIS 58 -6.879 -6.411 19.855 518 HD2 HIS 58 HD2 HIS 58 -6.677 -10.255 21.425 519 HE1 HIS 58 HE1 HIS 58 -6.844 -7.972 17.891 520 H HIS 59 HN HIS 59 -7.246 -8.756 25.288 521 HA HIS 59 HA HIS 59 -6.487 -11.584 24.891 522 1HB HIS 59 HB2 HIS 59 -7.777 -10.308 27.315 523 2HB HIS 59 HB1 HIS 59 -7.222 -11.969 27.180 524 HD1 HIS 59 HD1 HIS 59 -4.751 -12.390 27.726 525 HD2 HIS 59 HD2 HIS 59 -5.757 -8.378 27.503 526 HE1 HIS 59 HE1 HIS 59 -2.772 -11.121 28.626 527 H HIS 60 HN HIS 60 -8.968 -9.209 25.060 528 HA HIS 60 HA HIS 60 -11.093 -9.081 24.632 529 1HB HIS 60 HB2 HIS 60 -10.801 -11.853 23.451 530 2HB HIS 60 HB1 HIS 60 -12.344 -11.015 23.509 531 HD1 HIS 60 HD1 HIS 60 -9.748 -11.614 21.159 532 HD2 HIS 60 HD2 HIS 60 -11.936 -8.257 22.272 533 HE1 HIS 60 HE1 HIS 60 -9.622 -10.021 19.228 534 H HIS 61 HN HIS 61 -12.774 -9.101 25.853 535 HA HIS 61 HA HIS 61 -12.544 -10.586 28.312 536 1HB HIS 61 HB2 HIS 61 -13.139 -8.104 28.096 537 2HB HIS 61 HB1 HIS 61 -14.707 -8.625 27.506 538 HD1 HIS 61 HD1 HIS 61 -16.455 -8.985 29.303 539 HD2 HIS 61 HD2 HIS 61 -12.590 -8.982 30.803 540 HE1 HIS 61 HE1 HIS 61 -16.677 -9.074 31.816 541 H HIS 62 HN HIS 62 -13.635 -11.388 25.423 542 HA HIS 62 HA HIS 62 -15.794 -13.073 26.438 543 1HB HIS 62 HB2 HIS 62 -15.299 -12.108 23.603 544 2HB HIS 62 HB1 HIS 62 -16.536 -13.267 24.063 545 HD1 HIS 62 HD1 HIS 62 -18.649 -12.313 25.244 546 HD2 HIS 62 HD2 HIS 62 -15.840 -9.461 24.173 547 HE1 HIS 62 HE1 HIS 62 -19.845 -10.089 25.342 548 H1 MET 101 HT2 MET 101 5.046 24.302 -1.689 549 H2 MET 101 HT1 MET 101 5.462 25.475 -0.534 550 H3 MET 101 HT3 MET 101 6.525 25.085 -1.782 551 HA MET 101 HA MET 101 7.337 24.065 0.118 552 1HB MET 101 HB2 MET 101 4.572 22.870 0.302 553 2HB MET 101 HB1 MET 101 5.954 22.233 1.179 554 1HG MET 101 HG2 MET 101 4.815 25.005 1.458 555 2HG MET 101 HG1 MET 101 4.584 23.667 2.587 556 1HE MET 101 HE3 MET 101 5.416 25.124 4.596 557 2HE MET 101 HE2 MET 101 6.929 26.032 4.601 558 3HE MET 101 HE1 MET 101 5.619 26.502 3.514 559 H GLU 102 HN GLU 102 8.698 22.492 -0.439 560 HA GLU 102 HA GLU 102 8.115 21.087 -2.880 561 1HB GLU 102 HB2 GLU 102 10.375 22.143 -2.455 562 2HB GLU 102 HB1 GLU 102 10.632 20.960 -1.181 563 1HG GLU 102 HG2 GLU 102 10.170 20.222 -4.061 564 2HG GLU 102 HG1 GLU 102 11.762 20.530 -3.396 565 H MET 103 HN MET 103 6.852 19.525 -2.653 566 HA MET 103 HA MET 103 7.531 17.384 -0.779 567 1HB MET 103 HB2 MET 103 5.134 16.949 -0.387 568 2HB MET 103 HB1 MET 103 5.608 18.548 0.161 569 1HG MET 103 HG2 MET 103 4.658 19.504 -1.914 570 2HG MET 103 HG1 MET 103 4.118 17.891 -2.374 571 1HE MET 103 HE3 MET 103 3.793 20.809 0.201 572 2HE MET 103 HE2 MET 103 2.558 20.210 1.310 573 3HE MET 103 HE1 MET 103 4.147 19.457 1.274 574 H GLY 104 HN GLY 104 7.638 18.267 -3.720 575 1HA GLY 104 HA1 GLY 104 7.087 17.490 -5.817 576 2HA GLY 104 HA2 GLY 104 6.083 16.243 -5.081 577 H GLN 105 HN GLN 105 9.417 16.989 -4.265 578 HA GLN 105 HA GLN 105 10.382 14.711 -5.752 579 1HB GLN 105 HB2 GLN 105 11.946 16.343 -3.742 580 2HB GLN 105 HB1 GLN 105 12.523 15.346 -5.083 581 1HG GLN 105 HG2 GLN 105 11.043 17.949 -5.358 582 2HG GLN 105 HG1 GLN 105 12.766 17.736 -5.554 583 1HE2 GLN 105 1HE2 GLN 105 13.527 16.550 -7.302 584 2HE2 GLN 105 2HE2 GLN 105 12.577 16.347 -8.731 585 H LEU 106 HN LEU 106 9.437 15.682 -2.621 586 HA LEU 106 HA LEU 106 10.288 13.448 -1.152 587 1HB LEU 106 HB2 LEU 106 9.424 15.524 -0.105 588 2HB LEU 106 HB1 LEU 106 7.855 15.236 -0.802 589 HG LEU 106 HG LEU 106 8.119 14.827 1.699 590 1HD1 LEU 106 HD1 LEU 106 7.004 12.634 -0.029 591 2HD1 LEU 106 HD1 LEU 106 6.705 12.816 1.701 592 3HD1 LEU 106 HD1 LEU 106 6.152 14.044 0.573 593 1HD2 LEU 106 HD2 LEU 106 10.253 13.648 1.641 594 2HD2 LEU 106 HD2 LEU 106 8.999 12.653 2.383 595 3HD2 LEU 106 HD2 LEU 106 9.510 12.335 0.726 596 H LYS 107 HN LYS 107 7.281 14.098 -2.935 597 HA LYS 107 HA LYS 107 6.149 11.527 -2.596 598 1HB LYS 107 HB2 LYS 107 5.399 13.944 -3.860 599 2HB LYS 107 HB1 LYS 107 5.348 12.701 -5.105 600 1HG LYS 107 HG2 LYS 107 3.958 12.516 -2.447 601 2HG LYS 107 HG1 LYS 107 3.179 13.044 -3.931 602 1HD LYS 107 HD2 LYS 107 4.516 10.349 -3.592 603 2HD LYS 107 HD1 LYS 107 2.799 10.626 -3.295 604 1HE LYS 107 HE2 LYS 107 4.197 11.196 -5.902 605 2HE LYS 107 HE1 LYS 107 3.366 9.685 -5.546 606 1HZ LYS 107 HZ2 LYS 107 2.094 12.389 -5.643 607 2HZ LYS 107 HZ1 LYS 107 1.981 11.189 -6.801 608 3HZ LYS 107 HZ3 LYS 107 1.300 10.942 -5.288 609 H ASN 108 HN ASN 108 8.362 12.879 -4.899 610 HA ASN 108 HA ASN 108 8.538 10.871 -6.840 611 1HB ASN 108 HB2 ASN 108 9.660 13.060 -6.999 612 2HB ASN 108 HB1 ASN 108 10.707 12.619 -5.659 613 1HD2 ASN 108 HD2 ASN 108 10.163 12.469 -8.983 614 2HD2 ASN 108 HD2 ASN 108 11.576 11.577 -9.414 615 H LYS 109 HN LYS 109 10.337 11.310 -3.804 616 HA LYS 109 HA LYS 109 11.814 8.923 -3.949 617 1HB LYS 109 HB2 LYS 109 11.025 10.527 -1.516 618 2HB LYS 109 HB1 LYS 109 12.224 9.244 -1.538 619 1HG LYS 109 HG2 LYS 109 13.575 10.563 -3.123 620 2HG LYS 109 HG1 LYS 109 12.378 11.855 -3.035 621 1HD LYS 109 HD2 LYS 109 14.233 12.383 -1.574 622 2HD LYS 109 HD1 LYS 109 12.810 12.028 -0.596 623 1HE LYS 109 HE2 LYS 109 14.809 10.987 0.345 624 2HE LYS 109 HE1 LYS 109 13.660 9.763 -0.176 625 1HZ LYS 109 HZ3 LYS 109 16.056 10.645 -1.696 626 2HZ LYS 109 HZ2 LYS 109 15.941 9.230 -0.821 627 3HZ LYS 109 HZ1 LYS 109 14.984 9.449 -2.195 628 H ILE 110 HN ILE 110 8.737 9.694 -2.449 629 HA ILE 110 HA ILE 110 8.230 7.238 -1.231 630 HB ILE 110 HB ILE 110 6.326 9.278 -2.401 631 1HG1 ILE 110 2HG1 ILE 110 7.129 8.630 0.432 632 2HG1 ILE 110 1HG1 ILE 110 7.694 10.007 -0.503 633 1HG2 ILE 110 1HG2 ILE 110 5.179 7.116 -2.385 634 2HG2 ILE 110 3HG2 ILE 110 5.597 6.904 -0.683 635 3HG2 ILE 110 2HG2 ILE 110 4.506 8.200 -1.169 636 1HD1 ILE 110 HD1 ILE 110 4.873 9.492 0.389 637 2HD1 ILE 110 HD1 ILE 110 6.003 10.653 1.084 638 3HD1 ILE 110 HD1 ILE 110 5.418 10.871 -0.565 639 H GLU 111 HN GLU 111 7.307 8.346 -4.474 640 HA GLU 111 HA GLU 111 6.144 5.968 -5.323 641 1HB GLU 111 HB2 GLU 111 7.484 8.190 -6.832 642 2HB GLU 111 HB1 GLU 111 6.829 6.781 -7.657 643 1HG GLU 111 HG2 GLU 111 5.282 8.633 -5.877 644 2HG GLU 111 HG1 GLU 111 5.252 8.655 -7.643 645 H ASN 112 HN ASN 112 9.441 7.093 -5.850 646 HA ASN 112 HA ASN 112 10.407 4.850 -7.159 647 1HB ASN 112 HB2 ASN 112 11.670 6.902 -7.140 648 2HB ASN 112 HB1 ASN 112 11.848 6.825 -5.395 649 1HD2 ASN 112 HD2 ASN 112 13.492 5.648 -4.534 650 2HD2 ASN 112 HD2 ASN 112 14.650 4.783 -5.466 651 H LYS 113 HN LYS 113 10.232 5.472 -3.696 652 HA LYS 113 HA LYS 113 11.755 3.206 -2.925 653 1HB LYS 113 HB2 LYS 113 11.314 5.286 -1.561 654 2HB LYS 113 HB1 LYS 113 9.705 4.660 -1.277 655 1HG LYS 113 HG2 LYS 113 11.160 4.197 0.603 656 2HG LYS 113 HG1 LYS 113 10.635 2.703 -0.175 657 1HD LYS 113 HD2 LYS 113 13.028 2.666 0.419 658 2HD LYS 113 HD1 LYS 113 12.774 2.502 -1.312 659 1HE LYS 113 HE2 LYS 113 13.320 4.807 -1.645 660 2HE LYS 113 HE1 LYS 113 13.496 5.080 0.099 661 1HZ LYS 113 HZ2 LYS 113 15.106 3.305 -1.631 662 2HZ LYS 113 HZ1 LYS 113 15.605 4.782 -1.007 663 3HZ LYS 113 HZ3 LYS 113 15.331 3.507 0.071 664 H LYS 114 HN LYS 114 8.274 3.866 -2.970 665 HA LYS 114 HA LYS 114 7.284 1.422 -2.168 666 1HB LYS 114 HB2 LYS 114 5.907 3.335 -2.331 667 2HB LYS 114 HB1 LYS 114 6.274 3.559 -4.044 668 1HG LYS 114 HG2 LYS 114 5.131 1.235 -4.332 669 2HG LYS 114 HG1 LYS 114 4.466 1.549 -2.730 670 1HD LYS 114 HD2 LYS 114 2.827 2.339 -4.338 671 2HD LYS 114 HD1 LYS 114 3.631 3.743 -3.625 672 1HE LYS 114 HE2 LYS 114 5.077 3.939 -5.574 673 2HE LYS 114 HE1 LYS 114 4.310 2.505 -6.259 674 1HZ LYS 114 HZ3 LYS 114 2.955 5.085 -5.666 675 2HZ LYS 114 HZ2 LYS 114 3.469 4.632 -7.142 676 3HZ LYS 114 HZ1 LYS 114 2.219 3.737 -6.404 677 H LYS 115 HN LYS 115 8.180 2.625 -5.373 678 HA LYS 115 HA LYS 115 7.497 0.286 -6.789 679 1HB LYS 115 HB2 LYS 115 9.297 2.600 -7.461 680 2HB LYS 115 HB1 LYS 115 9.004 1.273 -8.583 681 1HG LYS 115 HG2 LYS 115 6.722 1.793 -8.786 682 2HG LYS 115 HG1 LYS 115 6.746 2.819 -7.355 683 1HD LYS 115 HD2 LYS 115 8.007 4.464 -8.449 684 2HD LYS 115 HD1 LYS 115 8.290 3.467 -9.871 685 1HE LYS 115 HE2 LYS 115 5.835 3.506 -10.284 686 2HE LYS 115 HE1 LYS 115 5.639 4.553 -8.881 687 1HZ LYS 115 HZ2 LYS 115 7.182 5.233 -11.335 688 2HZ LYS 115 HZ1 LYS 115 5.645 5.786 -10.942 689 3HZ LYS 115 HZ3 LYS 115 6.957 6.241 -10.007 690 H GLU 116 HN GLU 116 10.573 1.314 -5.329 691 HA GLU 116 HA GLU 116 12.178 -0.843 -6.105 692 1HB GLU 116 HB2 GLU 116 12.125 0.672 -3.472 693 2HB GLU 116 HB1 GLU 116 13.275 -0.614 -3.784 694 1HG GLU 116 HG2 GLU 116 14.153 0.784 -5.664 695 2HG GLU 116 HG1 GLU 116 13.049 2.064 -5.144 696 H LEU 117 HN LEU 117 9.830 -0.561 -3.551 697 HA LEU 117 HA LEU 117 10.231 -3.120 -2.422 698 1HB LEU 117 HB2 LEU 117 9.371 -1.476 -0.987 699 2HB LEU 117 HB1 LEU 117 8.139 -0.995 -2.127 700 HG LEU 117 HG LEU 117 7.308 -2.166 -0.051 701 1HD1 LEU 117 HD1 LEU 117 5.936 -1.865 -1.855 702 2HD1 LEU 117 HD1 LEU 117 6.500 -3.364 -2.591 703 3HD1 LEU 117 HD1 LEU 117 5.635 -3.409 -1.041 704 1HD2 LEU 117 HD2 LEU 117 8.547 -4.565 -1.333 705 2HD2 LEU 117 HD2 LEU 117 9.027 -3.838 0.204 706 3HD2 LEU 117 HD2 LEU 117 7.426 -4.569 0.035 707 H ILE 118 HN ILE 118 7.824 -1.843 -4.672 708 HA ILE 118 HA ILE 118 6.299 -4.149 -4.794 709 HB ILE 118 HB ILE 118 6.733 -2.084 -6.978 710 1HG1 ILE 118 2HG1 ILE 118 4.335 -2.383 -5.187 711 2HG1 ILE 118 1HG1 ILE 118 5.684 -1.398 -4.663 712 1HG2 ILE 118 2HG2 ILE 118 4.588 -4.225 -6.732 713 2HG2 ILE 118 1HG2 ILE 118 4.614 -2.948 -7.949 714 3HG2 ILE 118 3HG2 ILE 118 5.865 -4.184 -7.925 715 1HD1 ILE 118 HD1 ILE 118 4.053 -1.002 -7.160 716 2HD1 ILE 118 HD1 ILE 118 3.928 -0.067 -5.662 717 3HD1 ILE 118 HD1 ILE 118 5.402 -0.002 -6.623 718 H GLN 119 HN GLN 119 9.123 -3.156 -6.634 719 HA GLN 119 HA GLN 119 9.240 -5.409 -8.302 720 1HB GLN 119 HB2 GLN 119 11.416 -3.527 -7.384 721 2HB GLN 119 HB1 GLN 119 11.619 -4.729 -8.657 722 1HG GLN 119 HG2 GLN 119 9.848 -3.614 -9.957 723 2HG GLN 119 HG1 GLN 119 9.682 -2.417 -8.682 724 1HE2 GLN 119 1HE2 GLN 119 11.662 -3.582 -11.241 725 2HE2 GLN 119 2HE2 GLN 119 12.698 -2.220 -11.375 726 H LEU 120 HN LEU 120 10.187 -4.928 -4.989 727 HA LEU 120 HA LEU 120 11.810 -7.269 -4.797 728 1HB LEU 120 HB2 LEU 120 10.541 -5.562 -2.663 729 2HB LEU 120 HB1 LEU 120 11.524 -6.967 -2.310 730 HG LEU 120 HG LEU 120 12.478 -4.479 -3.736 731 1HD1 LEU 120 HD1 LEU 120 12.987 -5.481 -0.943 732 2HD1 LEU 120 HD1 LEU 120 13.744 -4.076 -1.692 733 3HD1 LEU 120 HD1 LEU 120 12.008 -4.082 -1.385 734 1HD2 LEU 120 HD2 LEU 120 13.963 -6.929 -2.795 735 2HD2 LEU 120 HD2 LEU 120 13.691 -6.460 -4.473 736 3HD2 LEU 120 HD2 LEU 120 14.711 -5.467 -3.432 737 H VAL 121 HN VAL 121 8.411 -6.553 -3.600 738 HA VAL 121 HA VAL 121 7.931 -9.186 -2.924 739 HB VAL 121 HB VAL 121 5.709 -8.630 -2.745 740 1HG1 VAL 121 3HG1 VAL 121 6.996 -7.414 -1.189 741 2HG1 VAL 121 2HG1 VAL 121 7.166 -6.087 -2.351 742 3HG1 VAL 121 1HG1 VAL 121 5.582 -6.465 -1.672 743 1HG2 VAL 121 1HG2 VAL 121 5.245 -7.932 -4.962 744 2HG2 VAL 121 3HG2 VAL 121 4.559 -6.775 -3.818 745 3HG2 VAL 121 2HG2 VAL 121 6.056 -6.378 -4.695 746 H ALA 122 HN ALA 122 7.923 -7.615 -6.012 747 HA ALA 122 HA ALA 122 6.478 -9.537 -7.463 748 1HB ALA 122 HB1 ALA 122 8.644 -7.693 -8.452 749 2HB ALA 122 HB3 ALA 122 7.389 -8.468 -9.444 750 3HB ALA 122 HB2 ALA 122 6.955 -7.265 -8.225 751 H ARG 123 HN ARG 123 9.984 -9.084 -6.974 752 HA ARG 123 HA ARG 123 10.689 -11.412 -8.422 753 1HB ARG 123 HB2 ARG 123 12.961 -11.136 -7.488 754 2HB ARG 123 HB1 ARG 123 12.335 -9.664 -8.210 755 1HG ARG 123 HG2 ARG 123 11.871 -8.748 -6.048 756 2HG ARG 123 HG1 ARG 123 12.326 -10.262 -5.275 757 1HD ARG 123 HD2 ARG 123 14.220 -8.622 -6.954 758 2HD ARG 123 HD1 ARG 123 14.099 -8.486 -5.198 759 HE ARG 123 HE ARG 123 14.472 -11.141 -5.648 760 1HH1 ARG 123 1HH1 ARG 123 16.325 -8.245 -6.543 761 2HH1 ARG 123 2HH1 ARG 123 17.826 -9.038 -6.467 762 1HH2 ARG 123 1HH2 ARG 123 16.555 -12.193 -5.508 763 2HH2 ARG 123 2HH2 ARG 123 17.971 -11.307 -5.887 764 H HIS 124 HN HIS 124 9.323 -11.127 -5.407 765 HA HIS 124 HA HIS 124 10.310 -13.433 -4.122 766 1HB HIS 124 HB2 HIS 124 8.865 -12.009 -2.865 767 2HB HIS 124 HB1 HIS 124 7.615 -12.032 -4.078 768 HD1 HIS 124 HD1 HIS 124 5.888 -14.021 -3.946 769 HD2 HIS 124 HD2 HIS 124 8.956 -14.256 -1.161 770 HE1 HIS 124 HE1 HIS 124 5.264 -15.872 -2.368 771 H GLY 125 HN GLY 125 7.756 -12.896 -6.448 772 1HA GLY 125 HA1 GLY 125 7.391 -15.773 -6.761 773 2HA GLY 125 HA2 GLY 125 7.902 -14.836 -8.161 774 H LEU 126 HN LEU 126 6.384 -12.501 -7.728 775 HA LEU 126 HA LEU 126 3.674 -13.473 -7.606 776 1HB LEU 126 HB2 LEU 126 4.762 -10.702 -7.973 777 2HB LEU 126 HB1 LEU 126 3.059 -11.043 -8.093 778 HG LEU 126 HG LEU 126 4.832 -11.298 -5.770 779 1HD1 LEU 126 HD1 LEU 126 4.053 -9.058 -6.204 780 2HD1 LEU 126 HD1 LEU 126 2.387 -9.601 -6.224 781 3HD1 LEU 126 HD1 LEU 126 3.310 -9.663 -4.721 782 1HD2 LEU 126 HD2 LEU 126 2.012 -12.312 -6.008 783 2HD2 LEU 126 HD2 LEU 126 3.469 -13.203 -5.582 784 3HD2 LEU 126 HD2 LEU 126 2.816 -12.021 -4.463 785 H ASP 127 HN ASP 127 2.421 -13.741 -9.104 786 HA ASP 127 HA ASP 127 3.507 -14.242 -11.742 787 1HB ASP 127 HB2 ASP 127 0.945 -14.873 -10.399 788 2HB ASP 127 HB1 ASP 127 1.078 -15.033 -12.138 789 H HIS 128 HN HIS 128 3.572 -11.708 -11.427 790 HA HIS 128 HA HIS 128 3.342 -9.824 -12.438 791 1HB HIS 128 HB2 HIS 128 3.548 -11.163 -14.504 792 2HB HIS 128 HB1 HIS 128 1.798 -11.252 -14.608 793 HD1 HIS 128 HD1 HIS 128 4.589 -8.668 -14.812 794 HD2 HIS 128 HD2 HIS 128 0.598 -9.147 -15.856 795 HE1 HIS 128 HE1 HIS 128 3.999 -6.672 -16.202 796 H ASP 129 HN ASP 129 0.164 -11.428 -12.644 797 HA ASP 129 HA ASP 129 -1.430 -9.095 -12.673 798 1HB ASP 129 HB2 ASP 129 -3.313 -10.495 -12.233 799 2HB ASP 129 HB1 ASP 129 -2.208 -11.530 -13.115 800 H LYS 130 HN LYS 130 -0.137 -11.053 -10.189 801 HA LYS 130 HA LYS 130 -1.228 -9.837 -7.926 802 1HB LYS 130 HB2 LYS 130 1.299 -11.269 -8.465 803 2HB LYS 130 HB1 LYS 130 0.911 -10.877 -6.803 804 1HG LYS 130 HG2 LYS 130 -0.579 -12.638 -8.766 805 2HG LYS 130 HG1 LYS 130 0.333 -13.178 -7.352 806 1HD LYS 130 HD2 LYS 130 -1.309 -12.141 -5.894 807 2HD LYS 130 HD1 LYS 130 -2.172 -11.487 -7.289 808 1HE LYS 130 HE2 LYS 130 -1.771 -14.412 -6.680 809 2HE LYS 130 HE1 LYS 130 -3.255 -13.501 -6.418 810 1HZ LYS 130 HZ3 LYS 130 -3.279 -13.059 -8.879 811 2HZ LYS 130 HZ2 LYS 130 -1.974 -14.054 -9.058 812 3HZ LYS 130 HZ1 LYS 130 -3.409 -14.693 -8.498 813 H VAL 131 HN VAL 131 1.703 -9.059 -9.749 814 HA VAL 131 HA VAL 131 2.662 -7.023 -8.040 815 HB VAL 131 HB VAL 131 3.105 -7.274 -11.035 816 1HG1 VAL 131 2HG1 VAL 131 3.846 -5.157 -10.149 817 2HG1 VAL 131 1HG1 VAL 131 4.801 -5.981 -8.921 818 3HG1 VAL 131 3HG1 VAL 131 5.226 -6.149 -10.623 819 1HG2 VAL 131 3HG2 VAL 131 3.617 -9.391 -9.955 820 2HG2 VAL 131 2HG2 VAL 131 5.090 -8.601 -10.515 821 3HG2 VAL 131 1HG2 VAL 131 4.661 -8.564 -8.802 822 H LEU 132 HN LEU 132 0.607 -7.035 -10.903 823 HA LEU 132 HA LEU 132 0.312 -4.235 -11.189 824 1HB LEU 132 HB2 LEU 132 -1.575 -6.421 -12.026 825 2HB LEU 132 HB1 LEU 132 -1.608 -4.767 -12.599 826 HG LEU 132 HG LEU 132 0.552 -6.803 -13.117 827 1HD1 LEU 132 HD1 LEU 132 -1.479 -7.187 -14.358 828 2HD1 LEU 132 HD1 LEU 132 -1.468 -5.513 -14.918 829 3HD1 LEU 132 HD1 LEU 132 -0.190 -6.624 -15.423 830 1HD2 LEU 132 HD2 LEU 132 0.344 -3.930 -14.039 831 2HD2 LEU 132 HD2 LEU 132 1.536 -4.583 -12.909 832 3HD2 LEU 132 HD2 LEU 132 1.538 -5.108 -14.589 833 H LEU 133 HN LEU 133 -1.734 -6.632 -9.592 834 HA LEU 133 HA LEU 133 -3.698 -4.753 -8.786 835 1HB LEU 133 HB2 LEU 133 -3.008 -7.441 -7.645 836 2HB LEU 133 HB1 LEU 133 -4.437 -6.501 -7.250 837 HG LEU 133 HG LEU 133 -3.810 -7.563 -10.011 838 1HD1 LEU 133 HD1 LEU 133 -5.646 -8.680 -7.896 839 2HD1 LEU 133 HD1 LEU 133 -5.527 -9.248 -9.566 840 3HD1 LEU 133 HD1 LEU 133 -4.149 -9.410 -8.481 841 1HD2 LEU 133 HD2 LEU 133 -6.328 -6.385 -8.830 842 2HD2 LEU 133 HD2 LEU 133 -5.274 -5.606 -10.013 843 3HD2 LEU 133 HD2 LEU 133 -6.168 -7.063 -10.448 844 H PHE 134 HN PHE 134 -0.824 -6.076 -7.234 845 HA PHE 134 HA PHE 134 -1.209 -4.969 -4.698 846 1HB PHE 134 HB2 PHE 134 0.338 -6.742 -5.028 847 2HB PHE 134 HB1 PHE 134 1.298 -5.801 -6.163 848 HD1 PHE 134 HD1 PHE 134 0.201 -5.949 -2.617 849 HD2 PHE 134 HD2 PHE 134 3.114 -4.567 -5.381 850 HE1 PHE 134 HE1 PHE 134 1.610 -5.244 -0.767 851 HE2 PHE 134 HE2 PHE 134 4.542 -3.840 -3.476 852 HZ PHE 134 HZ PHE 134 3.781 -4.182 -1.207 853 H SER 135 HN SER 135 0.717 -3.781 -7.451 854 HA SER 135 HA SER 135 1.721 -1.528 -6.180 855 1HB SER 135 HB2 SER 135 2.074 -0.680 -8.554 856 2HB SER 135 HB1 SER 135 2.753 -2.267 -8.185 857 HG SER 135 HG SER 135 1.343 -3.211 -9.393 858 H ARG 136 HN ARG 136 -1.228 -1.934 -8.031 859 HA ARG 136 HA ARG 136 -1.807 0.841 -7.933 860 1HB ARG 136 HB2 ARG 136 -3.874 0.348 -9.020 861 2HB ARG 136 HB1 ARG 136 -2.567 -0.535 -9.789 862 1HG ARG 136 HG2 ARG 136 -3.323 -2.549 -8.522 863 2HG ARG 136 HG1 ARG 136 -4.726 -1.604 -8.001 864 1HD ARG 136 HD2 ARG 136 -3.924 -2.282 -10.822 865 2HD ARG 136 HD1 ARG 136 -5.337 -2.870 -9.951 866 HE ARG 136 HE ARG 136 -5.994 -0.418 -9.872 867 1HH1 ARG 136 1HH1 ARG 136 -4.120 -1.773 -12.586 868 2HH1 ARG 136 2HH1 ARG 136 -4.737 -0.683 -13.725 869 1HH2 ARG 136 1HH2 ARG 136 -6.787 1.101 -11.471 870 2HH2 ARG 136 2HH2 ARG 136 -6.255 1.001 -13.090 871 H ASP 137 HN ASP 137 -2.652 -1.852 -5.830 872 HA ASP 137 HA ASP 137 -4.630 -0.214 -4.501 873 1HB ASP 137 HB2 ASP 137 -4.684 -2.767 -4.568 874 2HB ASP 137 HB1 ASP 137 -3.432 -2.714 -3.344 875 H LEU 138 HN LEU 138 -1.352 -1.071 -4.118 876 HA LEU 138 HA LEU 138 -0.909 0.019 -1.586 877 1HB LEU 138 HB2 LEU 138 0.608 -1.509 -2.640 878 2HB LEU 138 HB1 LEU 138 0.852 -0.421 -3.973 879 HG LEU 138 HG LEU 138 2.354 0.926 -2.743 880 1HD1 LEU 138 HD1 LEU 138 1.411 -0.508 -0.261 881 2HD1 LEU 138 HD1 LEU 138 2.680 0.716 -0.380 882 3HD1 LEU 138 HD1 LEU 138 0.997 1.167 -0.700 883 1HD2 LEU 138 HD2 LEU 138 3.188 -1.260 -3.340 884 2HD2 LEU 138 HD2 LEU 138 3.909 -0.694 -1.815 885 3HD2 LEU 138 HD2 LEU 138 2.588 -1.871 -1.793 886 H ASP 139 HN ASP 139 -0.839 1.416 -4.804 887 HA ASP 139 HA ASP 139 -0.072 4.016 -4.092 888 1HB ASP 139 HB2 ASP 139 -0.166 3.359 -6.408 889 2HB ASP 139 HB1 ASP 139 -1.897 3.064 -6.296 890 H LYS 140 HN LYS 140 -3.273 2.532 -4.301 891 HA LYS 140 HA LYS 140 -4.887 4.668 -3.522 892 1HB LYS 140 HB2 LYS 140 -5.165 1.711 -3.004 893 2HB LYS 140 HB1 LYS 140 -6.398 2.878 -2.562 894 1HG LYS 140 HG2 LYS 140 -6.860 3.386 -4.819 895 2HG LYS 140 HG1 LYS 140 -5.395 2.573 -5.374 896 1HD LYS 140 HD2 LYS 140 -7.459 1.285 -5.779 897 2HD LYS 140 HD1 LYS 140 -6.323 0.399 -4.791 898 1HE LYS 140 HE2 LYS 140 -7.650 1.217 -2.786 899 2HE LYS 140 HE1 LYS 140 -8.863 1.772 -3.942 900 1HZ LYS 140 HZ3 LYS 140 -8.968 -0.556 -4.777 901 2HZ LYS 140 HZ2 LYS 140 -7.871 -0.984 -3.579 902 3HZ LYS 140 HZ1 LYS 140 -9.399 -0.438 -3.137 903 H LEU 141 HN LEU 141 -3.329 2.198 -1.515 904 HA LEU 141 HA LEU 141 -4.226 3.113 0.964 905 1HB LEU 141 HB2 LEU 141 -3.268 0.888 0.629 906 2HB LEU 141 HB1 LEU 141 -1.708 1.600 0.282 907 HG LEU 141 HG LEU 141 -1.558 2.419 2.588 908 1HD1 LEU 141 HD1 LEU 141 -4.157 0.962 2.990 909 2HD1 LEU 141 HD1 LEU 141 -3.159 1.644 4.276 910 3HD1 LEU 141 HD1 LEU 141 -3.907 2.706 3.079 911 1HD2 LEU 141 HD2 LEU 141 -2.166 -0.521 2.366 912 2HD2 LEU 141 HD2 LEU 141 -0.611 0.251 2.046 913 3HD2 LEU 141 HD2 LEU 141 -1.280 0.239 3.680 914 H ILE 142 HN ILE 142 -1.288 3.878 -0.834 915 HA ILE 142 HA ILE 142 -0.220 5.533 1.161 916 HB ILE 142 HB ILE 142 0.351 5.395 -1.808 917 1HG1 ILE 142 2HG1 ILE 142 1.889 4.515 0.622 918 2HG1 ILE 142 1HG1 ILE 142 0.954 3.457 -0.431 919 1HG2 ILE 142 1HG2 ILE 142 1.821 7.005 0.289 920 2HG2 ILE 142 3HG2 ILE 142 2.350 6.759 -1.375 921 3HG2 ILE 142 2HG2 ILE 142 0.875 7.665 -1.049 922 1HD1 ILE 142 HD1 ILE 142 2.402 4.027 -2.255 923 2HD1 ILE 142 HD1 ILE 142 3.384 5.043 -1.200 924 3HD1 ILE 142 HD1 ILE 142 3.299 3.292 -0.922 925 H ASN 143 HN ASN 143 -2.012 6.401 -1.784 926 HA ASN 143 HA ASN 143 -2.152 9.175 -1.342 927 1HB ASN 143 HB2 ASN 143 -4.213 7.390 -2.671 928 2HB ASN 143 HB1 ASN 143 -4.226 9.146 -2.739 929 1HD2 ASN 143 HD2 ASN 143 -4.048 7.226 -4.866 930 2HD2 ASN 143 HD2 ASN 143 -2.578 7.464 -5.703 931 H LYS 144 HN LYS 144 -4.223 6.621 -0.217 932 HA LYS 144 HA LYS 144 -6.253 7.937 1.099 933 1HB LYS 144 HB2 LYS 144 -6.120 5.558 0.772 934 2HB LYS 144 HB1 LYS 144 -4.722 5.443 1.814 935 1HG LYS 144 HG2 LYS 144 -6.147 6.073 3.739 936 2HG LYS 144 HG1 LYS 144 -7.544 6.099 2.653 937 1HD LYS 144 HD2 LYS 144 -5.788 3.702 3.202 938 2HD LYS 144 HD1 LYS 144 -7.407 3.967 3.848 939 1HE LYS 144 HE2 LYS 144 -8.287 4.011 1.560 940 2HE LYS 144 HE1 LYS 144 -6.684 3.678 0.926 941 1HZ LYS 144 HZ3 LYS 144 -8.132 1.884 2.775 942 2HZ LYS 144 HZ2 LYS 144 -8.129 1.677 1.123 943 3HZ LYS 144 HZ1 LYS 144 -6.702 1.525 1.999 944 H PHE 145 HN PHE 145 -2.975 7.253 2.161 945 HA PHE 145 HA PHE 145 -3.456 8.537 4.692 946 1HB PHE 145 HB2 PHE 145 -1.419 6.669 3.665 947 2HB PHE 145 HB1 PHE 145 -0.980 7.735 4.995 948 HD1 PHE 145 HD1 PHE 145 -1.804 7.458 7.091 949 HD2 PHE 145 HD2 PHE 145 -3.336 5.066 3.941 950 HE1 PHE 145 HE1 PHE 145 -2.964 6.000 8.751 951 HE2 PHE 145 HE2 PHE 145 -4.474 3.617 5.559 952 HZ PHE 145 HZ PHE 145 -4.293 4.083 7.968 953 H MET 146 HN MET 146 -2.254 9.431 1.690 954 HA MET 146 HA MET 146 -0.372 11.324 2.782 955 1HB MET 146 HB2 MET 146 -1.303 11.054 -0.079 956 2HB MET 146 HB1 MET 146 -0.008 12.097 0.466 957 1HG MET 146 HG2 MET 146 0.979 9.832 1.380 958 2HG MET 146 HG1 MET 146 -0.101 9.156 0.182 959 1HE MET 146 HE2 MET 146 2.944 11.259 0.918 960 2HE MET 146 HE1 MET 146 3.410 11.965 -0.630 961 3HE MET 146 HE3 MET 146 1.940 12.506 0.189 962 H ASN 147 HN ASN 147 -3.424 11.177 2.831 963 HA ASN 147 HA ASN 147 -5.106 12.520 3.370 964 1HB ASN 147 HB2 ASN 147 -3.518 13.980 4.497 965 2HB ASN 147 HB1 ASN 147 -3.210 14.852 3.005 966 1HD2 ASN 147 HD2 ASN 147 -3.882 16.812 3.817 967 2HD2 ASN 147 HD2 ASN 147 -5.523 17.204 4.166 968 H VAL 148 HN VAL 148 -5.722 11.522 1.294 969 HA VAL 148 HA VAL 148 -6.694 13.714 -0.355 970 HB VAL 148 HB VAL 148 -7.171 12.155 -2.130 971 1HG1 VAL 148 1HG1 VAL 148 -4.968 13.077 -2.211 972 2HG1 VAL 148 3HG1 VAL 148 -4.342 11.766 -1.210 973 3HG1 VAL 148 2HG1 VAL 148 -4.942 11.428 -2.838 974 1HG2 VAL 148 1HG2 VAL 148 -7.754 10.161 -0.856 975 2HG2 VAL 148 3HG2 VAL 148 -6.552 9.765 -2.083 976 3HG2 VAL 148 2HG2 VAL 148 -6.064 9.937 -0.398 977 H LYS 149 HN LYS 149 -8.848 13.895 -0.539 978 HA LYS 149 HA LYS 149 -10.260 12.211 1.354 979 1HB LYS 149 HB2 LYS 149 -10.744 15.102 0.663 980 2HB LYS 149 HB1 LYS 149 -11.827 14.119 1.638 981 1HG LYS 149 HG2 LYS 149 -10.069 13.786 3.289 982 2HG LYS 149 HG1 LYS 149 -8.962 14.744 2.317 983 1HD LYS 149 HD2 LYS 149 -10.400 16.700 2.565 984 2HD LYS 149 HD1 LYS 149 -11.570 15.743 3.472 985 1HE LYS 149 HE2 LYS 149 -8.724 16.285 4.318 986 2HE LYS 149 HE1 LYS 149 -10.147 17.128 4.925 987 1HZ LYS 149 HZ1 LYS 149 -9.609 14.222 5.226 988 2HZ LYS 149 HZ3 LYS 149 -9.427 15.382 6.420 989 3HZ LYS 149 HZ2 LYS 149 -10.959 15.022 5.821 990 H ASP 150 HN ASP 150 -10.822 10.707 -0.028 991 HA ASP 150 HA ASP 150 -12.430 11.440 -2.342 992 1HB ASP 150 HB2 ASP 150 -10.642 9.567 -2.360 993 2HB ASP 150 HB1 ASP 150 -11.752 8.640 -1.369 994 H LYS 151 HN LYS 151 -14.522 10.196 -2.491 995 HA LYS 151 HA LYS 151 -15.975 10.836 -0.097 996 1HB LYS 151 HB2 LYS 151 -17.991 10.447 -1.438 997 2HB LYS 151 HB1 LYS 151 -16.872 11.557 -2.213 998 1HG LYS 151 HG2 LYS 151 -16.026 9.656 -3.585 999 2HG LYS 151 HG1 LYS 151 -17.304 8.665 -2.899 1000 1HD LYS 151 HD2 LYS 151 -17.859 11.237 -4.357 1001 2HD LYS 151 HD1 LYS 151 -17.717 9.700 -5.190 1002 1HE LYS 151 HE2 LYS 151 -20.052 10.207 -4.829 1003 2HE LYS 151 HE1 LYS 151 -19.603 8.834 -3.832 1004 1HZ LYS 151 HZ3 LYS 151 -19.854 11.631 -2.830 1005 2HZ LYS 151 HZ2 LYS 151 -21.052 10.480 -2.750 1006 3HZ LYS 151 HZ1 LYS 151 -19.631 10.243 -1.897 1007 H VAL 152 HN VAL 152 -14.514 8.274 -1.179 1008 HA VAL 152 HA VAL 152 -16.282 6.257 -0.078 1009 HB VAL 152 HB VAL 152 -14.522 4.589 -0.513 1010 1HG1 VAL 152 3HG1 VAL 152 -16.037 5.157 -2.316 1011 2HG1 VAL 152 2HG1 VAL 152 -14.967 6.463 -2.825 1012 3HG1 VAL 152 1HG1 VAL 152 -14.436 4.788 -2.958 1013 1HG2 VAL 152 2HG2 VAL 152 -12.548 5.963 -0.018 1014 2HG2 VAL 152 1HG2 VAL 152 -12.421 5.219 -1.615 1015 3HG2 VAL 152 3HG2 VAL 152 -12.863 6.918 -1.470 1016 H HIS 153 HN HIS 153 -14.047 8.392 1.183 1017 HA HIS 153 HA HIS 153 -13.476 6.803 3.553 1018 1HB HIS 153 HB2 HIS 153 -12.834 9.709 2.935 1019 2HB HIS 153 HB1 HIS 153 -12.304 8.852 4.365 1020 HD1 HIS 153 HD1 HIS 153 -9.856 8.441 4.148 1021 HD2 HIS 153 HD2 HIS 153 -11.838 8.034 0.530 1022 HE1 HIS 153 HE1 HIS 153 -8.083 7.970 2.435 1023 H LYS 154 HN LYS 154 -15.807 8.817 2.337 1024 HA LYS 154 HA LYS 154 -17.346 10.249 3.034 1025 1HB LYS 154 HB2 LYS 154 -17.641 8.214 5.249 1026 2HB LYS 154 HB1 LYS 154 -18.793 9.508 4.950 1027 1HG LYS 154 HG2 LYS 154 -19.037 8.580 2.608 1028 2HG LYS 154 HG1 LYS 154 -18.121 7.186 3.167 1029 1HD LYS 154 HD2 LYS 154 -20.716 8.158 4.370 1030 2HD LYS 154 HD1 LYS 154 -20.549 6.818 3.239 1031 1HE LYS 154 HE2 LYS 154 -19.260 6.977 5.950 1032 2HE LYS 154 HE1 LYS 154 -20.745 6.093 5.596 1033 1HZ LYS 154 HZ1 LYS 154 -19.431 4.747 4.001 1034 2HZ LYS 154 HZ3 LYS 154 -18.031 5.530 4.514 1035 3HZ LYS 154 HZ2 LYS 154 -18.903 4.596 5.593 1036 H LEU 155 HN LEU 155 -16.010 11.870 3.261 1037 HA LEU 155 HA LEU 155 -14.519 12.417 5.560 1038 1HB LEU 155 HB2 LEU 155 -14.122 14.634 4.481 1039 2HB LEU 155 HB1 LEU 155 -13.703 13.245 3.512 1040 HG LEU 155 HG LEU 155 -15.976 13.608 2.347 1041 1HD1 LEU 155 HD1 LEU 155 -16.952 15.161 3.915 1042 2HD1 LEU 155 HD1 LEU 155 -15.682 16.335 3.571 1043 3HD1 LEU 155 HD1 LEU 155 -16.831 15.879 2.309 1044 1HD2 LEU 155 HD2 LEU 155 -13.727 15.576 2.005 1045 2HD2 LEU 155 HD2 LEU 155 -13.878 13.989 1.245 1046 3HD2 LEU 155 HD2 LEU 155 -15.004 15.280 0.828 1047 H GLU 156 HN GLU 156 -14.800 13.714 7.235 1048 HA GLU 156 HA GLU 156 -17.458 14.884 7.593 1049 1HB GLU 156 HB2 GLU 156 -15.263 14.476 9.624 1050 2HB GLU 156 HB1 GLU 156 -16.905 15.004 9.949 1051 1HG GLU 156 HG2 GLU 156 -17.696 12.794 9.157 1052 2HG GLU 156 HG1 GLU 156 -16.009 12.289 9.037 1053 H HIS 157 HN HIS 157 -17.276 16.855 6.616 1054 HA HIS 157 HA HIS 157 -15.080 18.505 7.610 1055 1HB HIS 157 HB2 HIS 157 -14.598 17.480 5.316 1056 2HB HIS 157 HB1 HIS 157 -15.861 18.526 4.698 1057 HD1 HIS 157 HD1 HIS 157 -15.311 21.267 5.193 1058 HD2 HIS 157 HD2 HIS 157 -12.174 18.538 5.339 1059 HE1 HIS 157 HE1 HIS 157 -13.207 22.607 4.964 1060 H HIS 158 HN HIS 158 -17.613 18.990 5.143 1061 HA HIS 158 HA HIS 158 -19.302 20.467 4.912 1062 1HB HIS 158 HB2 HIS 158 -19.132 20.769 7.940 1063 2HB HIS 158 HB1 HIS 158 -20.380 21.495 6.948 1064 HD1 HIS 158 HD1 HIS 158 -19.771 18.609 9.005 1065 HD2 HIS 158 HD2 HIS 158 -21.948 19.393 5.549 1066 HE1 HIS 158 HE1 HIS 158 -21.512 16.798 8.856 1067 H HIS 159 HN HIS 159 -19.802 22.963 5.770 1068 HA HIS 159 HA HIS 159 -17.281 24.325 5.276 1069 1HB HIS 159 HB2 HIS 159 -20.126 25.346 5.408 1070 2HB HIS 159 HB1 HIS 159 -18.730 26.411 5.331 1071 HD1 HIS 159 HD1 HIS 159 -18.193 27.155 3.052 1072 HD2 HIS 159 HD2 HIS 159 -20.051 23.447 3.070 1073 HE1 HIS 159 HE1 HIS 159 -18.473 26.512 0.643 1074 H HIS 160 HN HIS 160 -19.785 24.033 7.644 1075 HA HIS 160 HA HIS 160 -20.049 24.418 9.770 1076 1HB HIS 160 HB2 HIS 160 -18.323 23.707 11.391 1077 2HB HIS 160 HB1 HIS 160 -18.543 22.566 10.082 1078 HD1 HIS 160 HD1 HIS 160 -15.988 24.556 11.850 1079 HD2 HIS 160 HD2 HIS 160 -16.283 22.472 8.267 1080 HE1 HIS 160 HE1 HIS 160 -13.632 24.154 11.070 1081 H HIS 161 HN HIS 161 -17.779 26.535 8.487 1082 HA HIS 161 HA HIS 161 -17.861 28.338 10.730 1083 1HB HIS 161 HB2 HIS 161 -16.785 28.722 7.923 1084 2HB HIS 161 HB1 HIS 161 -16.577 29.850 9.255 1085 HD1 HIS 161 HD1 HIS 161 -15.054 26.883 7.691 1086 HD2 HIS 161 HD2 HIS 161 -14.904 28.824 11.363 1087 HE1 HIS 161 HE1 HIS 161 -12.983 26.067 8.821 1088 H HIS 162 HN HIS 162 -19.522 29.594 11.037 1089 HA HIS 162 HA HIS 162 -20.983 30.636 8.742 1090 1HB HIS 162 HB2 HIS 162 -22.221 29.487 11.261 1091 2HB HIS 162 HB1 HIS 162 -23.106 30.452 10.086 1092 HD1 HIS 162 HD1 HIS 162 -23.653 29.286 7.776 1093 HD2 HIS 162 HD2 HIS 162 -21.740 26.856 10.553 1094 HE1 HIS 162 HE1 HIS 162 -23.875 26.929 6.917 No H/Q in entry = 1094 Start of MODEL 15 1 H1 MET 1 HT2 MET 1 19.310 -16.317 -3.565 2 H2 MET 1 HT1 MET 1 19.242 -17.900 -4.141 3 H3 MET 1 HT3 MET 1 19.012 -16.603 -5.199 4 HA MET 1 HA MET 1 17.030 -15.985 -3.988 5 1HB MET 1 HB2 MET 1 17.094 -18.885 -4.866 6 2HB MET 1 HB1 MET 1 15.622 -17.994 -4.533 7 1HG MET 1 HG2 MET 1 16.168 -16.431 -6.339 8 2HG MET 1 HG1 MET 1 17.628 -17.353 -6.681 9 1HE MET 1 HE3 MET 1 13.717 -17.318 -6.721 10 2HE MET 1 HE2 MET 1 13.326 -18.932 -7.306 11 3HE MET 1 HE1 MET 1 14.023 -18.723 -5.700 12 H GLU 2 HN GLU 2 16.569 -15.673 -1.932 13 HA GLU 2 HA GLU 2 16.342 -17.891 -0.110 14 1HB GLU 2 HB2 GLU 2 18.797 -16.978 -0.199 15 2HB GLU 2 HB1 GLU 2 18.142 -15.578 0.625 16 1HG GLU 2 HG2 GLU 2 18.021 -18.402 1.661 17 2HG GLU 2 HG1 GLU 2 19.243 -17.218 2.114 18 H MET 3 HN MET 3 14.465 -17.464 0.856 19 HA MET 3 HA MET 3 13.055 -15.078 0.474 20 1HB MET 3 HB2 MET 3 11.304 -16.025 1.892 21 2HB MET 3 HB1 MET 3 11.867 -17.163 0.684 22 1HG MET 3 HG2 MET 3 13.184 -18.325 2.382 23 2HG MET 3 HG1 MET 3 12.662 -17.159 3.594 24 1HE MET 3 HE2 MET 3 10.499 -18.760 0.680 25 2HE MET 3 HE1 MET 3 11.545 -20.084 1.195 26 3HE MET 3 HE3 MET 3 9.813 -20.151 1.510 27 H GLY 4 HN GLY 4 15.099 -16.073 3.137 28 1HA GLY 4 HA1 GLY 4 15.704 -14.982 5.053 29 2HA GLY 4 HA2 GLY 4 14.107 -14.240 5.056 30 H GLN 5 HN GLN 5 16.840 -14.129 2.849 31 HA GLN 5 HA GLN 5 17.629 -11.453 3.274 32 1HB GLN 5 HB2 GLN 5 17.709 -12.973 0.667 33 2HB GLN 5 HB1 GLN 5 18.553 -11.475 0.987 34 1HG GLN 5 HG2 GLN 5 19.887 -12.634 2.700 35 2HG GLN 5 HG1 GLN 5 19.063 -14.141 2.281 36 1HE2 GLN 5 1HE2 GLN 5 21.892 -13.423 2.038 37 2HE2 GLN 5 2HE2 GLN 5 22.277 -13.658 0.367 38 H LEU 6 HN LEU 6 15.358 -12.830 1.006 39 HA LEU 6 HA LEU 6 14.619 -10.522 -0.339 40 1HB LEU 6 HB2 LEU 6 14.206 -12.824 -1.115 41 2HB LEU 6 HB1 LEU 6 13.070 -13.060 0.184 42 HG LEU 6 HG LEU 6 12.120 -12.762 -2.146 43 1HD1 LEU 6 HD1 LEU 6 11.179 -10.932 0.030 44 2HD1 LEU 6 HD1 LEU 6 10.249 -11.350 -1.402 45 3HD1 LEU 6 HD1 LEU 6 10.691 -12.604 -0.232 46 1HD2 LEU 6 HD2 LEU 6 12.889 -9.889 -1.649 47 2HD2 LEU 6 HD2 LEU 6 13.543 -10.947 -2.901 48 3HD2 LEU 6 HD2 LEU 6 11.846 -10.461 -2.949 49 H LYS 7 HN LYS 7 13.040 -12.048 2.489 50 HA LYS 7 HA LYS 7 11.066 -10.079 2.805 51 1HB LYS 7 HB2 LYS 7 12.034 -12.368 4.322 52 2HB LYS 7 HB1 LYS 7 11.484 -11.058 5.354 53 1HG LYS 7 HG2 LYS 7 9.847 -12.168 3.091 54 2HG LYS 7 HG1 LYS 7 9.756 -12.785 4.740 55 1HD LYS 7 HD2 LYS 7 9.411 -9.863 4.170 56 2HD LYS 7 HD1 LYS 7 8.031 -10.960 4.007 57 1HE LYS 7 HE2 LYS 7 8.461 -11.656 6.389 58 2HE LYS 7 HE1 LYS 7 9.694 -10.404 6.479 59 1HZ LYS 7 HZ1 LYS 7 6.852 -9.843 5.812 60 2HZ LYS 7 HZ3 LYS 7 7.447 -9.796 7.365 61 3HZ LYS 7 HZ2 LYS 7 8.024 -8.706 6.235 62 H ASN 8 HN ASN 8 14.304 -10.344 4.059 63 HA ASN 8 HA ASN 8 14.124 -8.186 5.822 64 1HB ASN 8 HB2 ASN 8 15.919 -9.801 6.012 65 2HB ASN 8 HB1 ASN 8 16.524 -9.373 4.425 66 1HD2 ASN 8 HD2 ASN 8 17.964 -7.731 4.237 67 2HD2 ASN 8 HD2 ASN 8 18.512 -6.793 5.569 68 H LYS 9 HN LYS 9 15.009 -8.373 2.438 69 HA LYS 9 HA LYS 9 15.685 -5.660 1.977 70 1HB LYS 9 HB2 LYS 9 14.260 -7.541 0.080 71 2HB LYS 9 HB1 LYS 9 15.047 -6.033 -0.350 72 1HG LYS 9 HG2 LYS 9 17.212 -6.979 0.151 73 2HG LYS 9 HG1 LYS 9 16.455 -8.457 0.760 74 1HD LYS 9 HD2 LYS 9 15.460 -8.821 -1.494 75 2HD LYS 9 HD1 LYS 9 16.353 -7.419 -2.076 76 1HE LYS 9 HE2 LYS 9 17.604 -9.891 -0.881 77 2HE LYS 9 HE1 LYS 9 17.423 -9.595 -2.603 78 1HZ LYS 9 HZ1 LYS 9 18.987 -7.914 -0.720 79 2HZ LYS 9 HZ3 LYS 9 19.631 -9.045 -1.787 80 3HZ LYS 9 HZ2 LYS 9 18.865 -7.666 -2.387 81 H ILE 10 HN ILE 10 12.637 -7.424 1.671 82 HA ILE 10 HA ILE 10 11.006 -5.304 0.918 83 HB ILE 10 HB ILE 10 10.323 -7.864 2.375 84 1HG1 ILE 10 2HG1 ILE 10 9.944 -6.966 -0.485 85 2HG1 ILE 10 1HG1 ILE 10 11.144 -8.117 0.092 86 1HG2 ILE 10 1HG2 ILE 10 8.608 -6.224 2.959 87 2HG2 ILE 10 3HG2 ILE 10 8.376 -5.839 1.252 88 3HG2 ILE 10 2HG2 ILE 10 7.954 -7.438 1.857 89 1HD1 ILE 10 HD1 ILE 10 9.338 -9.628 0.748 90 2HD1 ILE 10 HD1 ILE 10 8.162 -8.473 0.114 91 3HD1 ILE 10 HD1 ILE 10 9.316 -9.252 -0.979 92 H GLU 11 HN GLU 11 11.600 -6.583 4.178 93 HA GLU 11 HA GLU 11 10.006 -4.802 5.569 94 1HB GLU 11 HB2 GLU 11 12.593 -6.080 6.402 95 2HB GLU 11 HB1 GLU 11 11.610 -5.112 7.489 96 1HG GLU 11 HG2 GLU 11 10.868 -7.687 6.149 97 2HG GLU 11 HG1 GLU 11 11.107 -7.397 7.873 98 H ASN 12 HN ASN 12 13.429 -4.452 4.825 99 HA ASN 12 HA ASN 12 13.737 -1.923 5.958 100 1HB ASN 12 HB2 ASN 12 15.707 -3.191 5.462 101 2HB ASN 12 HB1 ASN 12 15.288 -3.294 3.758 102 1HD2 ASN 12 HD2 ASN 12 15.895 -1.662 2.400 103 2HD2 ASN 12 HD2 ASN 12 16.775 -0.280 2.892 104 H LYS 13 HN LYS 13 12.912 -2.825 2.644 105 HA LYS 13 HA LYS 13 12.970 -0.204 1.607 106 1HB LYS 13 HB2 LYS 13 13.021 -2.439 0.362 107 2HB LYS 13 HB1 LYS 13 11.282 -2.455 0.560 108 1HG LYS 13 HG2 LYS 13 11.939 -1.606 -1.647 109 2HG LYS 13 HG1 LYS 13 11.072 -0.401 -0.692 110 1HD LYS 13 HD2 LYS 13 13.048 0.497 -1.887 111 2HD LYS 13 HD1 LYS 13 13.105 0.734 -0.146 112 1HE LYS 13 HE2 LYS 13 14.578 -1.181 0.057 113 2HE LYS 13 HE1 LYS 13 14.555 -1.414 -1.704 114 1HZ LYS 13 HZ1 LYS 13 15.511 0.809 -1.901 115 2HZ LYS 13 HZ3 LYS 13 15.562 0.921 -0.188 116 3HZ LYS 13 HZ2 LYS 13 16.495 -0.240 -0.998 117 H LYS 14 HN LYS 14 10.305 -2.236 2.721 118 HA LYS 14 HA LYS 14 8.137 -0.574 2.345 119 1HB LYS 14 HB2 LYS 14 8.074 -2.958 2.942 120 2HB LYS 14 HB1 LYS 14 8.759 -2.568 4.505 121 1HG LYS 14 HG2 LYS 14 6.719 -1.333 5.078 122 2HG LYS 14 HG1 LYS 14 6.043 -1.753 3.500 123 1HD LYS 14 HD2 LYS 14 5.172 -3.310 5.146 124 2HD LYS 14 HD1 LYS 14 6.305 -4.148 4.081 125 1HE LYS 14 HE2 LYS 14 8.072 -3.845 5.794 126 2HE LYS 14 HE1 LYS 14 6.835 -3.112 6.818 127 1HZ LYS 14 HZ1 LYS 14 6.648 -5.897 5.785 128 2HZ LYS 14 HZ3 LYS 14 7.389 -5.505 7.195 129 3HZ LYS 14 HZ2 LYS 14 5.753 -5.242 7.067 130 H LYS 15 HN LYS 15 10.275 -0.997 5.141 131 HA LYS 15 HA LYS 15 9.064 0.965 6.727 132 1HB LYS 15 HB2 LYS 15 11.714 -0.445 6.857 133 2HB LYS 15 HB1 LYS 15 11.293 0.812 8.019 134 1HG LYS 15 HG2 LYS 15 9.566 -0.442 8.958 135 2HG LYS 15 HG1 LYS 15 9.419 -1.481 7.544 136 1HD LYS 15 HD2 LYS 15 11.347 -2.677 8.083 137 2HD LYS 15 HD1 LYS 15 11.905 -1.500 9.262 138 1HE LYS 15 HE2 LYS 15 11.002 -3.518 10.352 139 2HE LYS 15 HE1 LYS 15 10.015 -2.116 10.729 140 1HZ LYS 15 HZ2 LYS 15 8.391 -2.857 9.104 141 2HZ LYS 15 HZ1 LYS 15 9.305 -4.250 8.727 142 3HZ LYS 15 HZ3 LYS 15 8.657 -4.005 10.256 143 H GLU 16 HN GLU 16 11.768 1.176 4.447 144 HA GLU 16 HA GLU 16 12.472 3.864 4.886 145 1HB GLU 16 HB2 GLU 16 12.423 2.294 2.288 146 2HB GLU 16 HB1 GLU 16 12.997 3.945 2.384 147 1HG GLU 16 HG2 GLU 16 14.720 3.118 4.008 148 2HG GLU 16 HG1 GLU 16 14.182 1.480 3.614 149 H LEU 17 HN LEU 17 9.971 2.454 2.927 150 HA LEU 17 HA LEU 17 9.031 4.880 1.854 151 1HB LEU 17 HB2 LEU 17 8.634 2.951 0.592 152 2HB LEU 17 HB1 LEU 17 7.994 2.074 1.954 153 HG LEU 17 HG LEU 17 6.313 2.663 0.181 154 1HD1 LEU 17 HD1 LEU 17 5.633 1.956 2.240 155 2HD1 LEU 17 HD1 LEU 17 5.700 3.595 2.880 156 3HD1 LEU 17 HD1 LEU 17 4.541 3.192 1.593 157 1HD2 LEU 17 HD2 LEU 17 6.705 5.450 1.208 158 2HD2 LEU 17 HD2 LEU 17 7.107 4.871 -0.411 159 3HD2 LEU 17 HD2 LEU 17 5.421 4.911 0.123 160 H ILE 18 HN ILE 18 7.999 2.922 4.595 161 HA ILE 18 HA ILE 18 5.693 4.327 5.138 162 HB ILE 18 HB ILE 18 7.506 2.942 7.152 163 1HG1 ILE 18 2HG1 ILE 18 4.921 1.949 5.965 164 2HG1 ILE 18 1HG1 ILE 18 6.471 1.611 5.205 165 1HG2 ILE 18 2HG2 ILE 18 4.635 3.867 7.413 166 2HG2 ILE 18 1HG2 ILE 18 5.500 2.891 8.615 167 3HG2 ILE 18 3HG2 ILE 18 6.010 4.539 8.255 168 1HD1 ILE 18 HD1 ILE 18 5.697 0.821 8.005 169 2HD1 ILE 18 HD1 ILE 18 5.672 -0.238 6.588 170 3HD1 ILE 18 HD1 ILE 18 7.196 0.422 7.165 171 H GLN 19 HN GLN 19 8.988 4.839 6.219 172 HA GLN 19 HA GLN 19 8.639 7.071 7.884 173 1HB GLN 19 HB2 GLN 19 10.928 6.254 6.120 174 2HB GLN 19 HB1 GLN 19 11.039 7.528 7.330 175 1HG GLN 19 HG2 GLN 19 10.703 5.959 9.095 176 2HG GLN 19 HG1 GLN 19 10.301 4.682 7.950 177 1HE2 GLN 19 1HE2 GLN 19 12.371 4.864 9.999 178 2HE2 GLN 19 2HE2 GLN 19 13.865 4.533 9.211 179 H LEU 20 HN LEU 20 8.850 6.759 4.406 180 HA LEU 20 HA LEU 20 9.158 9.540 3.905 181 1HB LEU 20 HB2 LEU 20 8.388 7.301 2.043 182 2HB LEU 20 HB1 LEU 20 8.683 8.952 1.542 183 HG LEU 20 HG LEU 20 10.725 7.097 2.764 184 1HD1 LEU 20 HD1 LEU 20 10.401 8.109 -0.053 185 2HD1 LEU 20 HD1 LEU 20 11.747 7.141 0.548 186 3HD1 LEU 20 HD1 LEU 20 10.119 6.461 0.505 187 1HD2 LEU 20 HD2 LEU 20 11.004 9.907 1.688 188 2HD2 LEU 20 HD2 LEU 20 11.181 9.411 3.370 189 3HD2 LEU 20 HD2 LEU 20 12.339 8.859 2.162 190 H VAL 21 HN VAL 21 6.254 7.309 3.535 191 HA VAL 21 HA VAL 21 4.593 9.442 2.982 192 HB VAL 21 HB VAL 21 2.809 8.027 3.334 193 1HG1 VAL 21 2HG1 VAL 21 4.073 7.370 1.471 194 2HG1 VAL 21 1HG1 VAL 21 5.085 6.336 2.505 195 3HG1 VAL 21 3HG1 VAL 21 3.386 5.930 2.247 196 1HG2 VAL 21 3HG2 VAL 21 4.509 6.275 5.069 197 2HG2 VAL 21 2HG2 VAL 21 3.149 7.315 5.535 198 3HG2 VAL 21 1HG2 VAL 21 2.860 5.895 4.523 199 H ALA 22 HN ALA 22 5.802 8.238 6.026 200 HA ALA 22 HA ALA 22 4.007 9.423 7.786 201 1HB ALA 22 HB3 ALA 22 6.933 8.873 8.169 202 2HB ALA 22 HB2 ALA 22 5.737 9.103 9.463 203 3HB ALA 22 HB1 ALA 22 5.620 7.717 8.368 204 H ARG 23 HN ARG 23 7.141 10.583 6.634 205 HA ARG 23 HA ARG 23 7.063 13.064 7.953 206 1HB ARG 23 HB2 ARG 23 8.945 13.730 6.495 207 2HB ARG 23 HB1 ARG 23 9.183 12.142 7.216 208 1HG ARG 23 HG2 ARG 23 8.400 11.148 5.077 209 2HG ARG 23 HG1 ARG 23 8.378 12.773 4.399 210 1HD ARG 23 HD2 ARG 23 10.810 11.436 5.581 211 2HD ARG 23 HD1 ARG 23 10.446 11.504 3.860 212 HE ARG 23 HE ARG 23 10.383 14.075 4.565 213 1HH1 ARG 23 1HH1 ARG 23 12.805 11.557 5.208 214 2HH1 ARG 23 2HH1 ARG 23 14.138 12.613 5.120 215 1HH2 ARG 23 1HH2 ARG 23 12.235 15.520 4.446 216 2HH2 ARG 23 2HH2 ARG 23 13.807 14.935 4.692 217 H HIS 24 HN HIS 24 5.493 12.028 5.122 218 HA HIS 24 HA HIS 24 5.066 14.418 3.759 219 1HB HIS 24 HB2 HIS 24 4.349 12.378 2.746 220 2HB HIS 24 HB1 HIS 24 3.266 11.974 4.057 221 HD1 HIS 24 HD1 HIS 24 0.895 13.316 4.031 222 HD2 HIS 24 HD2 HIS 24 3.419 14.089 0.837 223 HE1 HIS 24 HE1 HIS 24 -0.473 14.562 2.343 224 H GLY 25 HN GLY 25 3.491 13.135 6.648 225 1HA GLY 25 HA1 GLY 25 1.538 15.291 6.574 226 2HA GLY 25 HA2 GLY 25 2.740 15.378 7.850 227 H LEU 26 HN LEU 26 2.071 12.133 7.213 228 HA LEU 26 HA LEU 26 -0.268 11.650 8.511 229 1HB LEU 26 HB2 LEU 26 2.213 10.159 8.000 230 2HB LEU 26 HB1 LEU 26 1.050 9.469 9.107 231 HG LEU 26 HG LEU 26 -0.628 9.676 7.303 232 1HD1 LEU 26 HD1 LEU 26 0.347 11.313 5.915 233 2HD1 LEU 26 HD1 LEU 26 1.693 10.221 5.516 234 3HD1 LEU 26 HD1 LEU 26 0.034 9.798 5.053 235 1HD2 LEU 26 HD2 LEU 26 1.758 7.940 6.950 236 2HD2 LEU 26 HD2 LEU 26 0.261 7.565 7.802 237 3HD2 LEU 26 HD2 LEU 26 0.272 7.703 6.032 238 H ASP 27 HN ASP 27 -0.808 11.119 10.488 239 HA ASP 27 HA ASP 27 0.647 12.199 12.749 240 1HB ASP 27 HB2 ASP 27 -1.735 10.312 12.829 241 2HB ASP 27 HB1 ASP 27 -1.171 11.370 14.104 242 H HIS 28 HN HIS 28 1.222 10.743 14.599 243 HA HIS 28 HA HIS 28 2.786 8.547 13.877 244 1HB HIS 28 HB2 HIS 28 3.008 9.784 16.018 245 2HB HIS 28 HB1 HIS 28 1.476 9.113 16.558 246 HD1 HIS 28 HD1 HIS 28 1.673 7.029 17.928 247 HD2 HIS 28 HD2 HIS 28 5.027 7.712 15.579 248 HE1 HIS 28 HE1 HIS 28 3.351 5.271 18.574 249 H ASP 29 HN ASP 29 -0.526 8.752 14.981 250 HA ASP 29 HA ASP 29 -1.306 6.105 15.181 251 1HB ASP 29 HB2 ASP 29 -2.837 7.642 16.002 252 2HB ASP 29 HB1 ASP 29 -2.641 8.724 14.636 253 H LYS 30 HN LYS 30 -1.195 8.258 12.438 254 HA LYS 30 HA LYS 30 -2.463 6.519 10.604 255 1HB LYS 30 HB2 LYS 30 -0.623 8.837 10.171 256 2HB LYS 30 HB1 LYS 30 -1.502 8.049 8.872 257 1HG LYS 30 HG2 LYS 30 -2.660 9.535 11.221 258 2HG LYS 30 HG1 LYS 30 -2.585 10.099 9.554 259 1HD LYS 30 HD2 LYS 30 -4.073 8.333 8.871 260 2HD LYS 30 HD1 LYS 30 -4.102 7.673 10.505 261 1HE LYS 30 HE2 LYS 30 -5.138 10.368 9.630 262 2HE LYS 30 HE1 LYS 30 -6.093 8.986 10.164 263 1HZ LYS 30 HZ3 LYS 30 -4.906 9.195 12.363 264 2HZ LYS 30 HZ2 LYS 30 -4.282 10.680 11.780 265 3HZ LYS 30 HZ1 LYS 30 -5.926 10.489 11.952 266 H VAL 31 HN VAL 31 0.877 7.166 11.452 267 HA VAL 31 HA VAL 31 2.061 5.612 9.431 268 HB VAL 31 HB VAL 31 3.138 6.289 12.194 269 1HG1 VAL 31 3HG1 VAL 31 4.394 4.481 11.152 270 2HG1 VAL 31 2HG1 VAL 31 4.599 5.459 9.698 271 3HG1 VAL 31 1HG1 VAL 31 5.348 5.965 11.212 272 1HG2 VAL 31 1HG2 VAL 31 2.479 8.263 10.931 273 2HG2 VAL 31 3HG2 VAL 31 4.234 8.167 11.102 274 3HG2 VAL 31 2HG2 VAL 31 3.465 7.730 9.572 275 H LEU 32 HN LEU 32 1.007 4.898 12.698 276 HA LEU 32 HA LEU 32 1.840 2.187 12.848 277 1HB LEU 32 HB2 LEU 32 -0.500 3.531 14.162 278 2HB LEU 32 HB1 LEU 32 0.197 1.991 14.626 279 HG LEU 32 HG LEU 32 1.557 4.675 14.802 280 1HD1 LEU 32 HD1 LEU 32 0.466 2.865 16.921 281 2HD1 LEU 32 HD1 LEU 32 1.380 4.355 17.196 282 3HD1 LEU 32 HD1 LEU 32 -0.197 4.421 16.407 283 1HD2 LEU 32 HD2 LEU 32 2.507 1.943 15.664 284 2HD2 LEU 32 HD2 LEU 32 3.170 2.923 14.354 285 3HD2 LEU 32 HD2 LEU 32 3.308 3.472 16.023 286 H LEU 33 HN LEU 33 -1.217 3.593 11.844 287 HA LEU 33 HA LEU 33 -2.452 1.103 11.292 288 1HB LEU 33 HB2 LEU 33 -3.050 3.828 10.174 289 2HB LEU 33 HB1 LEU 33 -4.120 2.441 10.106 290 HG LEU 33 HG LEU 33 -3.230 3.812 12.636 291 1HD1 LEU 33 HD1 LEU 33 -5.835 3.978 11.143 292 2HD1 LEU 33 HD1 LEU 33 -5.503 4.659 12.738 293 3HD1 LEU 33 HD1 LEU 33 -4.635 5.260 11.331 294 1HD2 LEU 33 HD2 LEU 33 -3.747 1.456 12.965 295 2HD2 LEU 33 HD2 LEU 33 -4.974 2.490 13.689 296 3HD2 LEU 33 HD2 LEU 33 -5.304 1.676 12.159 297 H PHE 34 HN PHE 34 -0.789 3.460 9.260 298 HA PHE 34 HA PHE 34 -1.237 2.156 6.839 299 1HB PHE 34 HB2 PHE 34 -0.517 4.465 6.863 300 2HB PHE 34 HB1 PHE 34 0.994 4.027 7.650 301 HD1 PHE 34 HD1 PHE 34 -0.946 3.642 4.521 302 HD2 PHE 34 HD2 PHE 34 2.860 3.385 6.399 303 HE1 PHE 34 HE1 PHE 34 0.127 3.327 2.325 304 HE2 PHE 34 HE2 PHE 34 3.921 3.070 4.192 305 HZ PHE 34 HZ PHE 34 2.569 3.030 2.193 306 H SER 35 HN SER 35 1.552 1.961 9.066 307 HA SER 35 HA SER 35 3.107 0.337 7.432 308 1HB SER 35 HB2 SER 35 4.306 -0.251 9.585 309 2HB SER 35 HB1 SER 35 4.153 1.472 9.233 310 HG SER 35 HG SER 35 2.714 1.708 10.751 311 H ARG 36 HN ARG 36 0.738 -0.538 9.875 312 HA ARG 36 HA ARG 36 1.327 -3.303 9.619 313 1HB ARG 36 HB2 ARG 36 -0.567 -3.688 11.096 314 2HB ARG 36 HB1 ARG 36 0.495 -2.440 11.720 315 1HG ARG 36 HG2 ARG 36 -1.091 -0.740 10.849 316 2HG ARG 36 HG1 ARG 36 -2.178 -2.058 10.403 317 1HD ARG 36 HD2 ARG 36 -1.171 -1.370 13.139 318 2HD ARG 36 HD1 ARG 36 -2.817 -1.164 12.540 319 HE ARG 36 HE ARG 36 -2.350 -3.784 12.130 320 1HH1 ARG 36 1HH1 ARG 36 -2.204 -1.734 14.987 321 2HH1 ARG 36 2HH1 ARG 36 -2.554 -2.963 16.103 322 1HH2 ARG 36 1HH2 ARG 36 -2.838 -5.518 13.630 323 2HH2 ARG 36 2HH2 ARG 36 -2.917 -5.201 15.295 324 H ASP 37 HN ASP 37 -1.150 -1.178 8.227 325 HA ASP 37 HA ASP 37 -2.638 -3.311 7.055 326 1HB ASP 37 HB2 ASP 37 -3.456 -0.888 7.406 327 2HB ASP 37 HB1 ASP 37 -2.521 -0.494 5.977 328 H LEU 38 HN LEU 38 -0.015 -1.285 6.024 329 HA LEU 38 HA LEU 38 0.253 -2.170 3.383 330 1HB LEU 38 HB2 LEU 38 1.372 -0.200 4.054 331 2HB LEU 38 HB1 LEU 38 2.153 -0.998 5.393 332 HG LEU 38 HG LEU 38 3.680 -2.131 3.879 333 1HD1 LEU 38 HD1 LEU 38 2.222 -0.700 1.671 334 2HD1 LEU 38 HD1 LEU 38 3.717 -1.632 1.531 335 3HD1 LEU 38 HD1 LEU 38 2.217 -2.450 1.978 336 1HD2 LEU 38 HD2 LEU 38 3.408 0.806 3.339 337 2HD2 LEU 38 HD2 LEU 38 4.297 0.056 4.664 338 3HD2 LEU 38 HD2 LEU 38 4.837 -0.158 2.996 339 H ASP 39 HN ASP 39 1.828 -3.270 6.372 340 HA ASP 39 HA ASP 39 3.376 -5.325 5.301 341 1HB ASP 39 HB2 ASP 39 3.569 -4.546 7.638 342 2HB ASP 39 HB1 ASP 39 2.005 -5.263 8.001 343 H LYS 40 HN LYS 40 0.034 -5.427 6.562 344 HA LYS 40 HA LYS 40 -0.467 -8.072 6.199 345 1HB LYS 40 HB2 LYS 40 -1.513 -6.543 7.654 346 2HB LYS 40 HB1 LYS 40 -2.106 -5.595 6.314 347 1HG LYS 40 HG2 LYS 40 -3.560 -7.247 5.636 348 2HG LYS 40 HG1 LYS 40 -2.828 -8.429 6.746 349 1HD LYS 40 HD2 LYS 40 -5.013 -7.525 7.574 350 2HD LYS 40 HD1 LYS 40 -3.676 -7.211 8.678 351 1HE LYS 40 HE2 LYS 40 -5.066 -5.264 8.521 352 2HE LYS 40 HE1 LYS 40 -3.535 -4.923 7.729 353 1HZ LYS 40 HZ2 LYS 40 -4.680 -5.394 5.573 354 2HZ LYS 40 HZ1 LYS 40 -6.129 -5.549 6.424 355 3HZ LYS 40 HZ3 LYS 40 -5.309 -4.071 6.402 356 H LEU 41 HN LEU 41 -0.810 -5.285 4.018 357 HA LEU 41 HA LEU 41 -2.288 -6.617 1.993 358 1HB LEU 41 HB2 LEU 41 -2.132 -4.167 2.054 359 2HB LEU 41 HB1 LEU 41 -0.403 -4.258 1.824 360 HG LEU 41 HG LEU 41 -0.750 -5.154 -0.443 361 1HD1 LEU 41 HD1 LEU 41 -3.677 -4.729 0.120 362 2HD1 LEU 41 HD1 LEU 41 -2.970 -5.037 -1.466 363 3HD1 LEU 41 HD1 LEU 41 -2.859 -6.265 -0.208 364 1HD2 LEU 41 HD2 LEU 41 -2.180 -2.561 0.118 365 2HD2 LEU 41 HD2 LEU 41 -0.447 -2.770 -0.150 366 3HD2 LEU 41 HD2 LEU 41 -1.589 -3.089 -1.457 367 H ILE 42 HN ILE 42 1.064 -6.194 2.696 368 HA ILE 42 HA ILE 42 2.033 -7.391 0.301 369 HB ILE 42 HB ILE 42 3.439 -7.009 2.975 370 1HG1 ILE 42 2HG1 ILE 42 3.576 -5.445 0.407 371 2HG1 ILE 42 1HG1 ILE 42 2.724 -4.935 1.862 372 1HG2 ILE 42 1HG2 ILE 42 4.596 -7.720 0.274 373 2HG2 ILE 42 3HG2 ILE 42 5.529 -7.332 1.717 374 3HG2 ILE 42 2HG2 ILE 42 4.528 -8.781 1.684 375 1HD1 ILE 42 HD1 ILE 42 5.692 -5.362 1.603 376 2HD1 ILE 42 HD1 ILE 42 4.854 -3.802 1.633 377 3HD1 ILE 42 HD1 ILE 42 4.816 -4.850 3.050 378 H ASN 43 HN ASN 43 1.811 -8.570 3.598 379 HA ASN 43 HA ASN 43 2.461 -11.245 3.314 380 1HB ASN 43 HB2 ASN 43 0.274 -10.160 5.110 381 2HB ASN 43 HB1 ASN 43 1.016 -11.742 5.258 382 1HD2 ASN 43 HD2 ASN 43 0.861 -9.573 7.152 383 2HD2 ASN 43 HD2 ASN 43 2.464 -9.091 7.532 384 H LYS 44 HN LYS 44 -0.588 -9.693 2.585 385 HA LYS 44 HA LYS 44 -2.139 -12.004 2.154 386 1HB LYS 44 HB2 LYS 44 -3.127 -9.806 2.424 387 2HB LYS 44 HB1 LYS 44 -2.372 -9.249 0.937 388 1HG LYS 44 HG2 LYS 44 -3.726 -10.919 -0.319 389 2HG LYS 44 HG1 LYS 44 -4.510 -11.341 1.208 390 1HD LYS 44 HD2 LYS 44 -4.526 -8.593 -0.005 391 2HD LYS 44 HD1 LYS 44 -5.830 -9.771 -0.165 392 1HE LYS 44 HE2 LYS 44 -4.802 -8.640 2.442 393 2HE LYS 44 HE1 LYS 44 -6.242 -8.128 1.574 394 1HZ LYS 44 HZ2 LYS 44 -5.847 -10.900 2.626 395 2HZ LYS 44 HZ1 LYS 44 -6.734 -9.697 3.396 396 3HZ LYS 44 HZ3 LYS 44 -7.221 -10.276 1.902 397 H PHE 45 HN PHE 45 -0.251 -10.003 -0.058 398 HA PHE 45 HA PHE 45 -0.800 -11.669 -2.315 399 1HB PHE 45 HB2 PHE 45 0.894 -9.251 -1.861 400 2HB PHE 45 HB1 PHE 45 1.083 -10.201 -3.334 401 HD1 PHE 45 HD1 PHE 45 -1.452 -8.303 -1.324 402 HD2 PHE 45 HD2 PHE 45 -0.398 -9.993 -5.101 403 HE1 PHE 45 HE1 PHE 45 -3.371 -7.192 -2.362 404 HE2 PHE 45 HE2 PHE 45 -2.322 -8.883 -6.132 405 HZ PHE 45 HZ PHE 45 -3.815 -7.477 -4.764 406 H MET 46 HN MET 46 1.789 -11.414 0.010 407 HA MET 46 HA MET 46 3.602 -13.184 -1.360 408 1HB MET 46 HB2 MET 46 3.469 -12.775 1.636 409 2HB MET 46 HB1 MET 46 4.821 -13.348 0.677 410 1HG MET 46 HG2 MET 46 4.938 -11.030 -0.344 411 2HG MET 46 HG1 MET 46 3.693 -10.590 0.786 412 1HE MET 46 HE2 MET 46 7.403 -11.745 0.414 413 2HE MET 46 HE1 MET 46 7.924 -11.865 2.092 414 3HE MET 46 HE3 MET 46 6.758 -13.018 1.450 415 H ASN 47 HN ASN 47 0.925 -13.559 0.841 416 HA ASN 47 HA ASN 47 -0.237 -15.147 1.679 417 1HB ASN 47 HB2 ASN 47 0.965 -16.604 -0.563 418 2HB ASN 47 HB1 ASN 47 -0.025 -17.521 0.595 419 1HD2 ASN 47 HD2 ASN 47 0.041 -15.321 -2.024 420 2HD2 ASN 47 HD2 ASN 47 -1.662 -15.145 -2.210 421 H VAL 48 HN VAL 48 2.800 -14.945 2.161 422 HA VAL 48 HA VAL 48 3.006 -17.370 3.683 423 HB VAL 48 HB VAL 48 5.291 -16.674 4.323 424 1HG1 VAL 48 3HG1 VAL 48 4.834 -18.221 2.474 425 2HG1 VAL 48 2HG1 VAL 48 4.664 -16.866 1.360 426 3HG1 VAL 48 1HG1 VAL 48 6.241 -17.227 2.077 427 1HG2 VAL 48 2HG2 VAL 48 5.079 -14.288 3.979 428 2HG2 VAL 48 1HG2 VAL 48 6.400 -14.915 2.974 429 3HG2 VAL 48 3HG2 VAL 48 4.825 -14.543 2.256 430 H LYS 49 HN LYS 49 1.482 -17.030 4.870 431 HA LYS 49 HA LYS 49 1.829 -15.247 7.167 432 1HB LYS 49 HB2 LYS 49 -0.356 -17.279 6.634 433 2HB LYS 49 HB1 LYS 49 -0.386 -16.011 7.852 434 1HG LYS 49 HG2 LYS 49 -0.524 -14.310 6.174 435 2HG LYS 49 HG1 LYS 49 -0.258 -15.494 4.895 436 1HD LYS 49 HD2 LYS 49 -2.369 -16.606 5.512 437 2HD LYS 49 HD1 LYS 49 -2.640 -15.367 6.740 438 1HE LYS 49 HE2 LYS 49 -2.744 -13.653 5.044 439 2HE LYS 49 HE1 LYS 49 -2.328 -14.821 3.791 440 1HZ LYS 49 HZ3 LYS 49 -4.415 -15.976 4.264 441 2HZ LYS 49 HZ2 LYS 49 -4.801 -14.818 5.429 442 3HZ LYS 49 HZ1 LYS 49 -4.681 -14.368 3.819 443 H ASP 50 HN ASP 50 2.528 -18.086 5.981 444 HA ASP 50 HA ASP 50 4.145 -19.204 7.846 445 1HB ASP 50 HB2 ASP 50 2.023 -19.778 9.092 446 2HB ASP 50 HB1 ASP 50 1.399 -20.527 7.631 447 H LYS 51 HN LYS 51 4.553 -21.456 6.907 448 HA LYS 51 HA LYS 51 4.787 -21.490 4.045 449 1HB LYS 51 HB2 LYS 51 5.701 -23.792 4.558 450 2HB LYS 51 HB1 LYS 51 6.492 -22.489 5.440 451 1HG LYS 51 HG2 LYS 51 4.913 -23.012 7.370 452 2HG LYS 51 HG1 LYS 51 4.455 -24.444 6.466 453 1HD LYS 51 HD2 LYS 51 6.570 -25.388 6.677 454 2HD LYS 51 HD1 LYS 51 7.308 -23.851 7.139 455 1HE LYS 51 HE2 LYS 51 5.286 -25.386 8.770 456 2HE LYS 51 HE1 LYS 51 7.022 -25.322 9.080 457 1HZ LYS 51 HZ3 LYS 51 6.794 -22.897 9.349 458 2HZ LYS 51 HZ2 LYS 51 5.120 -22.997 9.246 459 3HZ LYS 51 HZ1 LYS 51 5.934 -23.749 10.508 460 H VAL 52 HN VAL 52 2.169 -21.180 4.686 461 HA VAL 52 HA VAL 52 0.414 -23.069 5.383 462 HB VAL 52 HB VAL 52 -1.272 -21.880 3.843 463 1HG1 VAL 52 3HG1 VAL 52 -0.926 -21.354 6.236 464 2HG1 VAL 52 2HG1 VAL 52 0.396 -20.272 5.785 465 3HG1 VAL 52 1HG1 VAL 52 -1.252 -19.900 5.288 466 1HG2 VAL 52 2HG2 VAL 52 1.164 -20.157 3.448 467 2HG2 VAL 52 1HG2 VAL 52 0.345 -21.068 2.184 468 3HG2 VAL 52 3HG2 VAL 52 -0.478 -19.709 2.969 469 H HIS 53 HN HIS 53 0.818 -25.076 4.816 470 HA HIS 53 HA HIS 53 -0.154 -25.826 2.143 471 1HB HIS 53 HB2 HIS 53 1.395 -27.758 2.124 472 2HB HIS 53 HB1 HIS 53 2.278 -26.243 2.217 473 HD1 HIS 53 HD1 HIS 53 3.517 -25.750 4.477 474 HD2 HIS 53 HD2 HIS 53 1.695 -29.468 4.288 475 HE1 HIS 53 HE1 HIS 53 4.485 -27.099 6.386 476 H LYS 54 HN LYS 54 -0.604 -25.910 5.400 477 HA LYS 54 HA LYS 54 -1.747 -28.561 5.510 478 1HB LYS 54 HB2 LYS 54 -1.416 -26.431 7.619 479 2HB LYS 54 HB1 LYS 54 -2.156 -27.997 7.910 480 1HG LYS 54 HG2 LYS 54 -0.067 -29.101 7.296 481 2HG LYS 54 HG1 LYS 54 0.680 -27.528 7.014 482 1HD LYS 54 HD2 LYS 54 0.290 -26.934 9.357 483 2HD LYS 54 HD1 LYS 54 -0.466 -28.506 9.622 484 1HE LYS 54 HE2 LYS 54 1.636 -29.611 9.042 485 2HE LYS 54 HE1 LYS 54 2.388 -28.042 8.772 486 1HZ LYS 54 HZ3 LYS 54 1.986 -27.503 11.105 487 2HZ LYS 54 HZ2 LYS 54 1.318 -29.010 11.382 488 3HZ LYS 54 HZ1 LYS 54 2.936 -28.868 10.960 489 H LEU 55 HN LEU 55 -3.821 -28.292 7.185 490 HA LEU 55 HA LEU 55 -5.916 -27.628 5.431 491 1HB LEU 55 HB2 LEU 55 -6.019 -28.191 8.387 492 2HB LEU 55 HB1 LEU 55 -7.352 -28.294 7.257 493 HG LEU 55 HG LEU 55 -4.933 -30.098 7.331 494 1HD1 LEU 55 HD1 LEU 55 -7.808 -30.594 8.059 495 2HD1 LEU 55 HD1 LEU 55 -6.542 -31.824 7.986 496 3HD1 LEU 55 HD1 LEU 55 -6.433 -30.516 9.162 497 1HD2 LEU 55 HD2 LEU 55 -5.723 -29.800 5.035 498 2HD2 LEU 55 HD2 LEU 55 -6.091 -31.421 5.620 499 3HD2 LEU 55 HD2 LEU 55 -7.365 -30.210 5.534 500 H GLU 56 HN GLU 56 -7.362 -26.005 5.532 501 HA GLU 56 HA GLU 56 -7.095 -23.870 7.502 502 1HB GLU 56 HB2 GLU 56 -5.759 -23.146 5.549 503 2HB GLU 56 HB1 GLU 56 -7.125 -23.451 4.491 504 1HG GLU 56 HG2 GLU 56 -6.928 -21.089 4.856 505 2HG GLU 56 HG1 GLU 56 -8.382 -21.667 5.659 506 H HIS 57 HN HIS 57 -8.803 -24.842 4.557 507 HA HIS 57 HA HIS 57 -11.337 -23.849 5.486 508 1HB HIS 57 HB2 HIS 57 -10.616 -25.581 3.116 509 2HB HIS 57 HB1 HIS 57 -12.238 -24.990 3.443 510 HD1 HIS 57 HD1 HIS 57 -12.796 -22.915 2.187 511 HD2 HIS 57 HD2 HIS 57 -8.720 -23.284 2.849 512 HE1 HIS 57 HE1 HIS 57 -11.721 -21.007 0.963 513 H HIS 58 HN HIS 58 -9.677 -26.871 5.265 514 HA HIS 58 HA HIS 58 -11.921 -28.342 6.360 515 1HB HIS 58 HB2 HIS 58 -9.121 -29.243 5.643 516 2HB HIS 58 HB1 HIS 58 -10.435 -30.304 6.149 517 HD1 HIS 58 HD1 HIS 58 -8.767 -29.572 3.182 518 HD2 HIS 58 HD2 HIS 58 -12.786 -29.575 4.249 519 HE1 HIS 58 HE1 HIS 58 -10.058 -29.764 1.039 520 H HIS 59 HN HIS 59 -11.965 -29.093 8.430 521 HA HIS 59 HA HIS 59 -10.141 -27.691 10.209 522 1HB HIS 59 HB2 HIS 59 -12.754 -29.124 10.765 523 2HB HIS 59 HB1 HIS 59 -11.777 -28.325 11.982 524 HD1 HIS 59 HD1 HIS 59 -13.779 -26.684 12.519 525 HD2 HIS 59 HD2 HIS 59 -12.362 -26.442 8.618 526 HE1 HIS 59 HE1 HIS 59 -14.845 -24.653 11.511 527 H HIS 60 HN HIS 60 -9.057 -28.768 11.886 528 HA HIS 60 HA HIS 60 -8.155 -31.379 11.162 529 1HB HIS 60 HB2 HIS 60 -7.533 -29.695 13.611 530 2HB HIS 60 HB1 HIS 60 -6.778 -31.235 13.252 531 HD1 HIS 60 HD1 HIS 60 -4.657 -31.100 11.953 532 HD2 HIS 60 HD2 HIS 60 -6.986 -27.701 11.494 533 HE1 HIS 60 HE1 HIS 60 -3.254 -29.459 10.629 534 H HIS 61 HN HIS 61 -10.482 -30.075 13.293 535 HA HIS 61 HA HIS 61 -10.844 -32.568 14.680 536 1HB HIS 61 HB2 HIS 61 -12.822 -31.354 15.744 537 2HB HIS 61 HB1 HIS 61 -11.239 -30.723 16.121 538 HD1 HIS 61 HD1 HIS 61 -10.740 -28.276 15.358 539 HD2 HIS 61 HD2 HIS 61 -14.454 -29.714 14.164 540 HE1 HIS 61 HE1 HIS 61 -12.031 -26.284 14.565 541 H HIS 62 HN HIS 62 -11.864 -34.163 13.831 542 HA HIS 62 HA HIS 62 -14.445 -33.934 12.843 543 1HB HIS 62 HB2 HIS 62 -14.083 -34.845 10.520 544 2HB HIS 62 HB1 HIS 62 -13.480 -33.215 10.729 545 HD1 HIS 62 HD1 HIS 62 -10.804 -32.954 10.637 546 HD2 HIS 62 HD2 HIS 62 -12.303 -36.714 9.765 547 HE1 HIS 62 HE1 HIS 62 -8.908 -34.231 9.584 548 H1 MET 101 HT3 MET 101 2.501 23.064 -2.052 549 H2 MET 101 HT2 MET 101 3.130 23.969 -0.816 550 H3 MET 101 HT1 MET 101 2.201 24.727 -2.017 551 HA MET 101 HA MET 101 3.873 24.135 -3.649 552 1HB MET 101 HB2 MET 101 4.924 25.611 -1.230 553 2HB MET 101 HB1 MET 101 5.736 25.609 -2.792 554 1HG MET 101 HG2 MET 101 3.013 26.737 -2.156 555 2HG MET 101 HG1 MET 101 4.491 27.657 -2.437 556 1HE MET 101 HE1 MET 101 1.825 28.333 -3.935 557 2HE MET 101 HE3 MET 101 3.350 29.164 -4.252 558 3HE MET 101 HE2 MET 101 2.388 28.538 -5.591 559 H GLU 102 HN GLU 102 5.886 23.171 -4.131 560 HA GLU 102 HA GLU 102 7.288 21.434 -4.160 561 1HB GLU 102 HB2 GLU 102 7.425 21.792 -1.137 562 2HB GLU 102 HB1 GLU 102 8.512 20.834 -2.141 563 1HG GLU 102 HG2 GLU 102 9.278 22.823 -3.271 564 2HG GLU 102 HG1 GLU 102 8.200 23.807 -2.278 565 H MET 103 HN MET 103 7.546 19.428 -1.979 566 HA MET 103 HA MET 103 6.681 17.547 -1.172 567 1HB MET 103 HB2 MET 103 3.980 18.718 -1.848 568 2HB MET 103 HB1 MET 103 4.178 17.138 -1.108 569 1HG MET 103 HG2 MET 103 5.276 18.175 0.813 570 2HG MET 103 HG1 MET 103 5.097 19.757 0.059 571 1HE MET 103 HE2 MET 103 3.987 20.565 2.357 572 2HE MET 103 HE1 MET 103 2.570 19.803 3.079 573 3HE MET 103 HE3 MET 103 4.107 18.938 3.026 574 H GLY 104 HN GLY 104 6.142 18.499 -4.350 575 1HA GLY 104 HA1 GLY 104 6.117 17.308 -6.312 576 2HA GLY 104 HA2 GLY 104 5.302 16.023 -5.424 577 H GLN 105 HN GLN 105 8.382 17.439 -4.633 578 HA GLN 105 HA GLN 105 9.991 15.398 -5.802 579 1HB GLN 105 HB2 GLN 105 10.926 16.945 -3.407 580 2HB GLN 105 HB1 GLN 105 11.847 16.424 -4.810 581 1HG GLN 105 HG2 GLN 105 11.741 18.679 -5.226 582 2HG GLN 105 HG1 GLN 105 10.233 18.182 -6.007 583 1HE2 GLN 105 1HE2 GLN 105 11.685 19.732 -3.347 584 2HE2 GLN 105 2HE2 GLN 105 10.293 20.490 -2.692 585 H LEU 106 HN LEU 106 8.462 15.887 -2.733 586 HA LEU 106 HA LEU 106 9.722 13.756 -1.350 587 1HB LEU 106 HB2 LEU 106 8.677 15.669 -0.196 588 2HB LEU 106 HB1 LEU 106 7.118 15.220 -0.828 589 HG LEU 106 HG LEU 106 7.568 14.765 1.637 590 1HD1 LEU 106 HD1 LEU 106 6.653 12.473 -0.061 591 2HD1 LEU 106 HD1 LEU 106 6.367 12.651 1.669 592 3HD1 LEU 106 HD1 LEU 106 5.662 13.803 0.535 593 1HD2 LEU 106 HD2 LEU 106 9.823 13.839 1.404 594 2HD2 LEU 106 HD2 LEU 106 8.739 12.696 2.201 595 3HD2 LEU 106 HD2 LEU 106 9.166 12.473 0.507 596 H LYS 107 HN LYS 107 6.610 14.084 -3.023 597 HA LYS 107 HA LYS 107 5.807 11.428 -2.762 598 1HB LYS 107 HB2 LYS 107 4.977 13.731 -4.313 599 2HB LYS 107 HB1 LYS 107 4.785 12.231 -5.212 600 1HG LYS 107 HG2 LYS 107 3.763 12.607 -2.410 601 2HG LYS 107 HG1 LYS 107 2.796 12.969 -3.835 602 1HD LYS 107 HD2 LYS 107 4.126 10.315 -3.643 603 2HD LYS 107 HD1 LYS 107 2.630 10.568 -2.706 604 1HE LYS 107 HE2 LYS 107 1.587 11.283 -4.884 605 2HE LYS 107 HE1 LYS 107 3.074 10.785 -5.686 606 1HZ LYS 107 HZ3 LYS 107 1.285 8.985 -4.111 607 2HZ LYS 107 HZ2 LYS 107 1.350 9.115 -5.771 608 3HZ LYS 107 HZ1 LYS 107 2.686 8.503 -4.953 609 H ASN 108 HN ASN 108 7.867 12.972 -5.102 610 HA ASN 108 HA ASN 108 8.188 10.910 -6.919 611 1HB ASN 108 HB2 ASN 108 9.086 13.139 -7.313 612 2HB ASN 108 HB1 ASN 108 10.195 12.961 -5.961 613 1HD2 ASN 108 HD2 ASN 108 12.028 13.291 -7.164 614 2HD2 ASN 108 HD2 ASN 108 12.583 12.182 -8.358 615 H LYS 109 HN LYS 109 9.943 11.554 -3.901 616 HA LYS 109 HA LYS 109 11.771 9.412 -3.940 617 1HB LYS 109 HB2 LYS 109 10.409 10.661 -1.541 618 2HB LYS 109 HB1 LYS 109 11.823 9.631 -1.497 619 1HG LYS 109 HG2 LYS 109 11.692 12.344 -2.799 620 2HG LYS 109 HG1 LYS 109 12.331 12.024 -1.189 621 1HD LYS 109 HD2 LYS 109 13.992 10.475 -2.255 622 2HD LYS 109 HD1 LYS 109 13.415 11.043 -3.826 623 1HE LYS 109 HE2 LYS 109 15.411 12.271 -3.160 624 2HE LYS 109 HE1 LYS 109 14.008 13.337 -3.203 625 1HZ LYS 109 HZ1 LYS 109 15.143 12.106 -0.754 626 2HZ LYS 109 HZ3 LYS 109 15.380 13.702 -1.237 627 3HZ LYS 109 HZ2 LYS 109 13.845 13.181 -0.801 628 H ILE 110 HN ILE 110 8.563 9.753 -2.573 629 HA ILE 110 HA ILE 110 8.251 7.225 -1.474 630 HB ILE 110 HB ILE 110 6.239 9.233 -2.477 631 1HG1 ILE 110 2HG1 ILE 110 7.118 8.376 0.272 632 2HG1 ILE 110 1HG1 ILE 110 7.605 9.851 -0.555 633 1HG2 ILE 110 2HG2 ILE 110 5.170 7.035 -2.638 634 2HG2 ILE 110 1HG2 ILE 110 5.633 6.680 -0.974 635 3HG2 ILE 110 3HG2 ILE 110 4.480 7.974 -1.312 636 1HD1 ILE 110 HD1 ILE 110 4.833 9.134 0.338 637 2HD1 ILE 110 HD1 ILE 110 5.929 10.277 1.120 638 3HD1 ILE 110 HD1 ILE 110 5.300 10.619 -0.490 639 H GLU 111 HN GLU 111 7.203 8.409 -4.642 640 HA GLU 111 HA GLU 111 6.117 6.064 -5.680 641 1HB GLU 111 HB2 GLU 111 7.672 8.220 -7.112 642 2HB GLU 111 HB1 GLU 111 6.695 6.995 -7.908 643 1HG GLU 111 HG2 GLU 111 5.686 9.076 -5.990 644 2HG GLU 111 HG1 GLU 111 5.515 9.155 -7.735 645 H ASN 112 HN ASN 112 9.415 7.228 -5.907 646 HA ASN 112 HA ASN 112 10.489 5.065 -7.303 647 1HB ASN 112 HB2 ASN 112 11.770 7.063 -7.209 648 2HB ASN 112 HB1 ASN 112 11.751 7.079 -5.450 649 1HD2 ASN 112 HD2 ASN 112 13.311 5.991 -4.360 650 2HD2 ASN 112 HD2 ASN 112 14.557 5.091 -5.122 651 H LYS 113 HN LYS 113 10.357 5.609 -3.809 652 HA LYS 113 HA LYS 113 11.782 3.245 -3.143 653 1HB LYS 113 HB2 LYS 113 11.389 5.415 -1.761 654 2HB LYS 113 HB1 LYS 113 9.861 4.685 -1.325 655 1HG LYS 113 HG2 LYS 113 11.583 4.355 0.395 656 2HG LYS 113 HG1 LYS 113 10.993 2.829 -0.262 657 1HD LYS 113 HD2 LYS 113 13.428 2.826 0.010 658 2HD LYS 113 HD1 LYS 113 12.982 2.634 -1.674 659 1HE LYS 113 HE2 LYS 113 14.821 4.111 -1.612 660 2HE LYS 113 HE1 LYS 113 13.422 5.125 -1.923 661 1HZ LYS 113 HZ3 LYS 113 14.750 4.730 0.702 662 2HZ LYS 113 HZ2 LYS 113 14.928 6.071 -0.280 663 3HZ LYS 113 HZ1 LYS 113 13.457 5.785 0.455 664 H LYS 114 HN LYS 114 8.352 4.021 -3.376 665 HA LYS 114 HA LYS 114 7.143 1.699 -2.526 666 1HB LYS 114 HB2 LYS 114 6.042 3.847 -3.062 667 2HB LYS 114 HB1 LYS 114 6.410 3.591 -4.755 668 1HG LYS 114 HG2 LYS 114 4.911 1.632 -4.748 669 2HG LYS 114 HG1 LYS 114 4.535 1.959 -3.055 670 1HD LYS 114 HD2 LYS 114 2.765 2.926 -4.373 671 2HD LYS 114 HD1 LYS 114 3.758 4.246 -3.753 672 1HE LYS 114 HE2 LYS 114 4.966 4.253 -5.954 673 2HE LYS 114 HE1 LYS 114 3.774 3.056 -6.476 674 1HZ LYS 114 HZ3 LYS 114 1.999 4.786 -6.141 675 2HZ LYS 114 HZ2 LYS 114 3.178 5.845 -5.605 676 3HZ LYS 114 HZ1 LYS 114 3.198 5.372 -7.160 677 H LYS 115 HN LYS 115 8.268 2.678 -5.753 678 HA LYS 115 HA LYS 115 7.507 0.289 -7.058 679 1HB LYS 115 HB2 LYS 115 9.492 2.400 -7.893 680 2HB LYS 115 HB1 LYS 115 8.928 1.088 -8.924 681 1HG LYS 115 HG2 LYS 115 6.665 1.908 -8.826 682 2HG LYS 115 HG1 LYS 115 7.127 3.145 -7.661 683 1HD LYS 115 HD2 LYS 115 6.928 4.190 -9.785 684 2HD LYS 115 HD1 LYS 115 8.631 4.110 -9.383 685 1HE LYS 115 HE2 LYS 115 8.317 3.502 -11.725 686 2HE LYS 115 HE1 LYS 115 8.918 2.129 -10.804 687 1HZ LYS 115 HZ1 LYS 115 6.075 2.545 -11.583 688 2HZ LYS 115 HZ3 LYS 115 7.150 1.507 -12.334 689 3HZ LYS 115 HZ2 LYS 115 6.676 1.207 -10.763 690 H GLU 116 HN GLU 116 10.439 1.210 -5.412 691 HA GLU 116 HA GLU 116 11.999 -1.020 -6.206 692 1HB GLU 116 HB2 GLU 116 12.010 0.609 -3.668 693 2HB GLU 116 HB1 GLU 116 13.171 -0.667 -3.970 694 1HG GLU 116 HG2 GLU 116 13.964 0.613 -5.938 695 2HG GLU 116 HG1 GLU 116 12.824 1.889 -5.510 696 H LEU 117 HN LEU 117 9.703 -0.483 -3.638 697 HA LEU 117 HA LEU 117 10.025 -3.001 -2.406 698 1HB LEU 117 HB2 LEU 117 9.225 -1.264 -1.044 699 2HB LEU 117 HB1 LEU 117 8.006 -0.795 -2.197 700 HG LEU 117 HG LEU 117 7.146 -1.840 -0.070 701 1HD1 LEU 117 HD1 LEU 117 5.808 -1.569 -1.907 702 2HD1 LEU 117 HD1 LEU 117 6.295 -3.131 -2.554 703 3HD1 LEU 117 HD1 LEU 117 5.407 -3.050 -1.016 704 1HD2 LEU 117 HD2 LEU 117 8.292 -4.351 -1.241 705 2HD2 LEU 117 HD2 LEU 117 8.836 -3.558 0.240 706 3HD2 LEU 117 HD2 LEU 117 7.214 -4.256 0.154 707 H ILE 118 HN ILE 118 7.673 -1.731 -4.692 708 HA ILE 118 HA ILE 118 5.933 -3.839 -4.780 709 HB ILE 118 HB ILE 118 6.806 -2.071 -7.083 710 1HG1 ILE 118 2HG1 ILE 118 4.313 -1.941 -5.395 711 2HG1 ILE 118 1HG1 ILE 118 5.768 -1.014 -5.046 712 1HG2 ILE 118 2HG2 ILE 118 5.762 -4.133 -7.947 713 2HG2 ILE 118 1HG2 ILE 118 4.352 -3.855 -6.948 714 3HG2 ILE 118 3HG2 ILE 118 4.749 -2.726 -8.243 715 1HD1 ILE 118 HD1 ILE 118 4.128 -0.824 -7.559 716 2HD1 ILE 118 HD1 ILE 118 4.088 0.311 -6.209 717 3HD1 ILE 118 HD1 ILE 118 5.558 0.130 -7.163 718 H GLN 119 HN GLN 119 8.921 -3.364 -6.544 719 HA GLN 119 HA GLN 119 8.699 -5.764 -8.024 720 1HB GLN 119 HB2 GLN 119 11.028 -3.922 -7.585 721 2HB GLN 119 HB1 GLN 119 11.012 -5.276 -8.715 722 1HG GLN 119 HG2 GLN 119 9.192 -4.269 -9.952 723 2HG GLN 119 HG1 GLN 119 9.093 -2.956 -8.786 724 1HE2 GLN 119 1HE2 GLN 119 10.670 -1.418 -8.772 725 2HE2 GLN 119 2HE2 GLN 119 11.758 -1.169 -10.096 726 H LEU 120 HN LEU 120 9.935 -4.976 -4.912 727 HA LEU 120 HA LEU 120 11.466 -7.364 -4.623 728 1HB LEU 120 HB2 LEU 120 10.350 -5.505 -2.518 729 2HB LEU 120 HB1 LEU 120 11.381 -6.873 -2.166 730 HG LEU 120 HG LEU 120 12.166 -4.435 -3.764 731 1HD1 LEU 120 HD1 LEU 120 12.957 -5.353 -1.015 732 2HD1 LEU 120 HD1 LEU 120 13.633 -3.968 -1.870 733 3HD1 LEU 120 HD1 LEU 120 11.933 -3.974 -1.403 734 1HD2 LEU 120 HD2 LEU 120 13.778 -6.853 -2.946 735 2HD2 LEU 120 HD2 LEU 120 13.339 -6.392 -4.590 736 3HD2 LEU 120 HD2 LEU 120 14.443 -5.381 -3.659 737 H VAL 121 HN VAL 121 8.202 -6.369 -3.437 738 HA VAL 121 HA VAL 121 7.401 -8.889 -2.531 739 HB VAL 121 HB VAL 121 5.610 -6.912 -3.965 740 1HG1 VAL 121 2HG1 VAL 121 4.578 -9.067 -3.519 741 2HG1 VAL 121 1HG1 VAL 121 4.984 -8.929 -1.813 742 3HG1 VAL 121 3HG1 VAL 121 3.833 -7.799 -2.538 743 1HG2 VAL 121 2HG2 VAL 121 6.467 -6.932 -1.078 744 2HG2 VAL 121 1HG2 VAL 121 6.864 -5.727 -2.305 745 3HG2 VAL 121 3HG2 VAL 121 5.197 -5.906 -1.760 746 H ALA 122 HN ALA 122 7.449 -7.542 -5.755 747 HA ALA 122 HA ALA 122 6.016 -9.489 -7.127 748 1HB ALA 122 HB2 ALA 122 8.301 -7.833 -8.149 749 2HB ALA 122 HB1 ALA 122 7.064 -8.620 -9.133 750 3HB ALA 122 HB3 ALA 122 6.627 -7.298 -8.039 751 H ARG 123 HN ARG 123 9.525 -9.160 -6.668 752 HA ARG 123 HA ARG 123 10.131 -11.571 -8.041 753 1HB ARG 123 HB2 ARG 123 12.429 -11.219 -7.341 754 2HB ARG 123 HB1 ARG 123 11.731 -9.722 -7.931 755 1HG ARG 123 HG2 ARG 123 11.306 -9.097 -5.572 756 2HG ARG 123 HG1 ARG 123 12.243 -10.493 -5.070 757 1HD ARG 123 HD2 ARG 123 13.191 -8.142 -6.713 758 2HD ARG 123 HD1 ARG 123 13.654 -8.533 -5.059 759 HE ARG 123 HE ARG 123 14.279 -10.465 -7.151 760 1HH1 ARG 123 1HH1 ARG 123 15.486 -7.956 -4.948 761 2HH1 ARG 123 2HH1 ARG 123 17.121 -8.413 -5.150 762 1HH2 ARG 123 1HH2 ARG 123 16.485 -11.000 -7.450 763 2HH2 ARG 123 2HH2 ARG 123 17.701 -10.174 -6.572 764 H HIS 124 HN HIS 124 8.840 -11.107 -5.023 765 HA HIS 124 HA HIS 124 9.939 -13.276 -3.606 766 1HB HIS 124 HB2 HIS 124 8.598 -11.741 -2.366 767 2HB HIS 124 HB1 HIS 124 7.247 -11.864 -3.449 768 HD1 HIS 124 HD1 HIS 124 5.516 -13.716 -2.896 769 HD2 HIS 124 HD2 HIS 124 9.008 -14.031 -0.675 770 HE1 HIS 124 HE1 HIS 124 5.118 -15.542 -1.209 771 H GLY 125 HN GLY 125 7.443 -13.002 -6.009 772 1HA GLY 125 HA1 GLY 125 6.844 -15.864 -5.842 773 2HA GLY 125 HA2 GLY 125 7.564 -15.276 -7.336 774 H LEU 126 HN LEU 126 6.173 -12.703 -7.251 775 HA LEU 126 HA LEU 126 3.405 -13.514 -7.449 776 1HB LEU 126 HB2 LEU 126 4.761 -10.872 -7.672 777 2HB LEU 126 HB1 LEU 126 3.081 -11.053 -8.047 778 HG LEU 126 HG LEU 126 4.489 -11.326 -5.496 779 1HD1 LEU 126 HD1 LEU 126 2.226 -9.547 -6.351 780 2HD1 LEU 126 HD1 LEU 126 2.802 -9.672 -4.691 781 3HD1 LEU 126 HD1 LEU 126 3.882 -9.089 -5.955 782 1HD2 LEU 126 HD2 LEU 126 1.672 -12.261 -6.003 783 2HD2 LEU 126 HD2 LEU 126 3.042 -13.204 -5.421 784 3HD2 LEU 126 HD2 LEU 126 2.335 -11.969 -4.395 785 H ASP 127 HN ASP 127 2.230 -13.324 -9.179 786 HA ASP 127 HA ASP 127 3.441 -13.608 -11.808 787 1HB ASP 127 HB2 ASP 127 0.523 -13.004 -11.177 788 2HB ASP 127 HB1 ASP 127 1.162 -13.681 -12.660 789 H HIS 128 HN HIS 128 2.930 -11.945 -13.523 790 HA HIS 128 HA HIS 128 3.416 -9.376 -12.511 791 1HB HIS 128 HB2 HIS 128 2.695 -10.298 -15.276 792 2HB HIS 128 HB1 HIS 128 2.795 -8.579 -14.905 793 HD1 HIS 128 HD1 HIS 128 5.171 -7.569 -14.603 794 HD2 HIS 128 HD2 HIS 128 5.137 -11.694 -15.129 795 HE1 HIS 128 HE1 HIS 128 7.562 -8.248 -14.933 796 H ASP 129 HN ASP 129 0.447 -10.985 -13.198 797 HA ASP 129 HA ASP 129 -1.264 -8.760 -13.033 798 1HB ASP 129 HB2 ASP 129 -1.710 -11.675 -12.413 799 2HB ASP 129 HB1 ASP 129 -2.992 -10.473 -12.300 800 H LYS 130 HN LYS 130 0.016 -10.950 -10.616 801 HA LYS 130 HA LYS 130 -1.288 -10.009 -8.332 802 1HB LYS 130 HB2 LYS 130 1.440 -11.111 -8.773 803 2HB LYS 130 HB1 LYS 130 0.862 -10.810 -7.152 804 1HG LYS 130 HG2 LYS 130 -0.339 -12.711 -9.166 805 2HG LYS 130 HG1 LYS 130 0.770 -13.146 -7.873 806 1HD LYS 130 HD2 LYS 130 -0.864 -12.323 -6.247 807 2HD LYS 130 HD1 LYS 130 -2.039 -12.040 -7.510 808 1HE LYS 130 HE2 LYS 130 -0.811 -14.668 -6.645 809 2HE LYS 130 HE1 LYS 130 -2.500 -14.197 -6.534 810 1HZ LYS 130 HZ2 LYS 130 -2.586 -14.242 -8.970 811 2HZ LYS 130 HZ1 LYS 130 -0.979 -14.768 -9.030 812 3HZ LYS 130 HZ3 LYS 130 -2.152 -15.738 -8.304 813 H VAL 131 HN VAL 131 1.795 -9.036 -9.832 814 HA VAL 131 HA VAL 131 2.603 -7.043 -8.089 815 HB VAL 131 HB VAL 131 3.021 -7.143 -11.084 816 1HG1 VAL 131 3HG1 VAL 131 3.690 -5.014 -10.126 817 2HG1 VAL 131 2HG1 VAL 131 4.684 -5.850 -8.932 818 3HG1 VAL 131 1HG1 VAL 131 5.104 -5.934 -10.642 819 1HG2 VAL 131 2HG2 VAL 131 4.634 -8.431 -8.896 820 2HG2 VAL 131 1HG2 VAL 131 3.657 -9.257 -10.107 821 3HG2 VAL 131 3HG2 VAL 131 5.096 -8.363 -10.600 822 H LEU 132 HN LEU 132 0.586 -6.890 -10.986 823 HA LEU 132 HA LEU 132 0.199 -4.113 -11.091 824 1HB LEU 132 HB2 LEU 132 -1.633 -6.324 -11.973 825 2HB LEU 132 HB1 LEU 132 -1.796 -4.642 -12.428 826 HG LEU 132 HG LEU 132 0.517 -6.431 -13.128 827 1HD1 LEU 132 HD1 LEU 132 -1.759 -5.401 -14.776 828 2HD1 LEU 132 HD1 LEU 132 -0.342 -6.281 -15.382 829 3HD1 LEU 132 HD1 LEU 132 -1.457 -7.070 -14.269 830 1HD2 LEU 132 HD2 LEU 132 -0.086 -3.579 -13.898 831 2HD2 LEU 132 HD2 LEU 132 1.253 -4.171 -12.905 832 3HD2 LEU 132 HD2 LEU 132 1.174 -4.590 -14.615 833 H LEU 133 HN LEU 133 -1.790 -6.640 -9.644 834 HA LEU 133 HA LEU 133 -3.801 -4.917 -8.674 835 1HB LEU 133 HB2 LEU 133 -2.943 -7.596 -7.602 836 2HB LEU 133 HB1 LEU 133 -4.469 -6.780 -7.285 837 HG LEU 133 HG LEU 133 -3.560 -7.766 -9.991 838 1HD1 LEU 133 HD1 LEU 133 -5.530 -8.981 -8.078 839 2HD1 LEU 133 HD1 LEU 133 -5.218 -9.518 -9.732 840 3HD1 LEU 133 HD1 LEU 133 -3.943 -9.625 -8.524 841 1HD2 LEU 133 HD2 LEU 133 -5.099 -5.880 -10.139 842 2HD2 LEU 133 HD2 LEU 133 -5.875 -7.371 -10.669 843 3HD2 LEU 133 HD2 LEU 133 -6.234 -6.712 -9.073 844 H PHE 134 HN PHE 134 -0.868 -6.219 -7.213 845 HA PHE 134 HA PHE 134 -1.254 -5.112 -4.665 846 1HB PHE 134 HB2 PHE 134 0.349 -6.913 -4.997 847 2HB PHE 134 HB1 PHE 134 1.311 -5.905 -6.071 848 HD1 PHE 134 HD1 PHE 134 3.010 -4.538 -5.219 849 HD2 PHE 134 HD2 PHE 134 0.106 -6.184 -2.573 850 HE1 PHE 134 HE1 PHE 134 4.291 -3.698 -3.276 851 HE2 PHE 134 HE2 PHE 134 1.397 -5.347 -0.649 852 HZ PHE 134 HZ PHE 134 3.487 -4.098 -1.028 853 H SER 135 HN SER 135 0.671 -3.939 -7.430 854 HA SER 135 HA SER 135 1.678 -1.686 -6.163 855 1HB SER 135 HB2 SER 135 2.131 -0.834 -8.475 856 2HB SER 135 HB1 SER 135 2.711 -2.470 -8.160 857 HG SER 135 HG SER 135 1.166 -3.292 -9.364 858 H ARG 136 HN ARG 136 -1.332 -2.075 -7.953 859 HA ARG 136 HA ARG 136 -1.821 0.728 -7.804 860 1HB ARG 136 HB2 ARG 136 -3.971 0.300 -8.824 861 2HB ARG 136 HB1 ARG 136 -2.696 -0.535 -9.701 862 1HG ARG 136 HG2 ARG 136 -3.403 -2.604 -8.413 863 2HG ARG 136 HG1 ARG 136 -4.811 -1.665 -7.906 864 1HD ARG 136 HD2 ARG 136 -4.009 -2.394 -10.721 865 2HD ARG 136 HD1 ARG 136 -5.413 -2.938 -9.821 866 HE ARG 136 HE ARG 136 -6.040 -0.486 -9.784 867 1HH1 ARG 136 1HH1 ARG 136 -4.197 -1.876 -12.475 868 2HH1 ARG 136 2HH1 ARG 136 -4.933 -0.926 -13.674 869 1HH2 ARG 136 1HH2 ARG 136 -7.024 0.878 -11.456 870 2HH2 ARG 136 2HH2 ARG 136 -6.575 0.680 -13.084 871 H ASP 137 HN ASP 137 -2.845 -2.075 -5.889 872 HA ASP 137 HA ASP 137 -4.745 -0.600 -4.359 873 1HB ASP 137 HB2 ASP 137 -4.594 -3.114 -4.522 874 2HB ASP 137 HB1 ASP 137 -3.199 -3.032 -3.457 875 H LEU 138 HN LEU 138 -1.368 -1.427 -3.993 876 HA LEU 138 HA LEU 138 -0.792 -0.216 -1.545 877 1HB LEU 138 HB2 LEU 138 0.795 -1.674 -2.523 878 2HB LEU 138 HB1 LEU 138 0.833 -0.761 -4.012 879 HG LEU 138 HG LEU 138 2.036 1.053 -2.868 880 1HD1 LEU 138 HD1 LEU 138 2.041 -0.785 -0.495 881 2HD1 LEU 138 HD1 LEU 138 2.949 0.722 -0.679 882 3HD1 LEU 138 HD1 LEU 138 1.185 0.764 -0.640 883 1HD2 LEU 138 HD2 LEU 138 3.266 -1.667 -2.556 884 2HD2 LEU 138 HD2 LEU 138 3.276 -0.662 -4.006 885 3HD2 LEU 138 HD2 LEU 138 4.140 -0.136 -2.562 886 H ASP 139 HN ASP 139 -0.743 1.071 -4.832 887 HA ASP 139 HA ASP 139 0.245 3.625 -4.249 888 1HB ASP 139 HB2 ASP 139 0.047 2.702 -6.548 889 2HB ASP 139 HB1 ASP 139 -1.702 2.852 -6.429 890 H LYS 140 HN LYS 140 -3.018 2.337 -4.334 891 HA LYS 140 HA LYS 140 -4.290 4.763 -3.675 892 1HB LYS 140 HB2 LYS 140 -5.256 1.955 -3.195 893 2HB LYS 140 HB1 LYS 140 -6.226 3.414 -3.057 894 1HG LYS 140 HG2 LYS 140 -5.722 3.821 -5.504 895 2HG LYS 140 HG1 LYS 140 -5.027 2.203 -5.534 896 1HD LYS 140 HD2 LYS 140 -7.282 2.024 -6.302 897 2HD LYS 140 HD1 LYS 140 -7.214 1.333 -4.688 898 1HE LYS 140 HE2 LYS 140 -9.195 2.756 -5.017 899 2HE LYS 140 HE1 LYS 140 -8.159 3.362 -3.730 900 1HZ LYS 140 HZ2 LYS 140 -8.207 4.400 -6.525 901 2HZ LYS 140 HZ1 LYS 140 -8.933 5.141 -5.199 902 3HZ LYS 140 HZ3 LYS 140 -7.266 4.995 -5.274 903 H LEU 141 HN LEU 141 -3.250 1.998 -1.685 904 HA LEU 141 HA LEU 141 -4.206 2.901 0.763 905 1HB LEU 141 HB2 LEU 141 -3.380 0.648 0.524 906 2HB LEU 141 HB1 LEU 141 -1.772 1.225 0.143 907 HG LEU 141 HG LEU 141 -1.481 2.014 2.433 908 1HD1 LEU 141 HD1 LEU 141 -3.785 2.603 2.945 909 2HD1 LEU 141 HD1 LEU 141 -4.222 0.896 2.957 910 3HD1 LEU 141 HD1 LEU 141 -3.111 1.528 4.167 911 1HD2 LEU 141 HD2 LEU 141 -2.452 -0.830 2.263 912 2HD2 LEU 141 HD2 LEU 141 -0.808 -0.264 1.958 913 3HD2 LEU 141 HD2 LEU 141 -1.497 -0.171 3.585 914 H ILE 142 HN ILE 142 -1.175 3.593 -0.822 915 HA ILE 142 HA ILE 142 -0.121 5.157 1.267 916 HB ILE 142 HB ILE 142 0.537 5.143 -1.693 917 1HG1 ILE 142 2HG1 ILE 142 1.935 4.050 0.729 918 2HG1 ILE 142 1HG1 ILE 142 1.049 3.093 -0.453 919 1HG2 ILE 142 1HG2 ILE 142 1.974 6.559 0.559 920 2HG2 ILE 142 3HG2 ILE 142 2.574 6.400 -1.094 921 3HG2 ILE 142 2HG2 ILE 142 1.111 7.333 -0.769 922 1HD1 ILE 142 HD1 ILE 142 3.542 4.693 -0.990 923 2HD1 ILE 142 HD1 ILE 142 3.465 2.943 -0.748 924 3HD1 ILE 142 HD1 ILE 142 2.672 3.674 -2.138 925 H ASN 143 HN ASN 143 -1.614 6.193 -1.783 926 HA ASN 143 HA ASN 143 -1.621 8.930 -1.185 927 1HB ASN 143 HB2 ASN 143 -3.467 7.390 -3.023 928 2HB ASN 143 HB1 ASN 143 -3.402 9.143 -2.945 929 1HD2 ASN 143 HD2 ASN 143 -2.880 7.435 -5.182 930 2HD2 ASN 143 HD2 ASN 143 -1.271 7.720 -5.711 931 H LYS 144 HN LYS 144 -3.894 6.454 -0.396 932 HA LYS 144 HA LYS 144 -6.085 7.857 0.595 933 1HB LYS 144 HB2 LYS 144 -5.942 5.438 0.254 934 2HB LYS 144 HB1 LYS 144 -4.807 5.304 1.581 935 1HG LYS 144 HG2 LYS 144 -6.639 6.141 3.090 936 2HG LYS 144 HG1 LYS 144 -7.737 5.987 1.719 937 1HD LYS 144 HD2 LYS 144 -6.126 3.756 2.994 938 2HD LYS 144 HD1 LYS 144 -7.866 4.006 3.109 939 1HE LYS 144 HE2 LYS 144 -8.062 3.653 0.681 940 2HE LYS 144 HE1 LYS 144 -6.330 3.389 0.574 941 1HZ LYS 144 HZ2 LYS 144 -6.590 1.422 2.021 942 2HZ LYS 144 HZ1 LYS 144 -8.243 1.669 2.080 943 3HZ LYS 144 HZ3 LYS 144 -7.488 1.270 0.626 944 H PHE 145 HN PHE 145 -3.193 6.682 2.267 945 HA PHE 145 HA PHE 145 -3.911 7.931 4.710 946 1HB PHE 145 HB2 PHE 145 -1.684 6.239 3.791 947 2HB PHE 145 HB1 PHE 145 -1.387 7.300 5.168 948 HD1 PHE 145 HD1 PHE 145 -2.206 6.882 7.211 949 HD2 PHE 145 HD2 PHE 145 -3.631 4.608 3.933 950 HE1 PHE 145 HE1 PHE 145 -3.376 5.364 8.783 951 HE2 PHE 145 HE2 PHE 145 -4.783 3.079 5.466 952 HZ PHE 145 HZ PHE 145 -4.665 3.451 7.900 953 H MET 146 HN MET 146 -1.864 8.767 2.068 954 HA MET 146 HA MET 146 -0.482 10.953 3.285 955 1HB MET 146 HB2 MET 146 -1.325 10.767 0.394 956 2HB MET 146 HB1 MET 146 -0.015 11.733 1.061 957 1HG MET 146 HG2 MET 146 1.068 9.541 1.723 958 2HG MET 146 HG1 MET 146 -0.183 8.761 0.783 959 1HE MET 146 HE2 MET 146 2.997 10.709 0.847 960 2HE MET 146 HE1 MET 146 3.206 11.357 -0.782 961 3HE MET 146 HE3 MET 146 1.943 11.999 0.278 962 H ASN 147 HN ASN 147 -3.614 10.448 1.934 963 HA ASN 147 HA ASN 147 -5.529 11.595 1.805 964 1HB ASN 147 HB2 ASN 147 -5.013 12.015 4.268 965 2HB ASN 147 HB1 ASN 147 -4.282 13.539 3.792 966 1HD2 ASN 147 HD2 ASN 147 -7.248 11.767 4.138 967 2HD2 ASN 147 HD2 ASN 147 -8.293 13.130 4.084 968 H VAL 148 HN VAL 148 -3.879 11.880 -0.167 969 HA VAL 148 HA VAL 148 -3.428 14.661 -0.657 970 HB VAL 148 HB VAL 148 -2.573 13.978 -2.929 971 1HG1 VAL 148 3HG1 VAL 148 -1.312 12.717 -0.504 972 2HG1 VAL 148 2HG1 VAL 148 -0.490 13.000 -2.041 973 3HG1 VAL 148 1HG1 VAL 148 -1.075 14.363 -1.079 974 1HG2 VAL 148 2HG2 VAL 148 -3.819 11.913 -3.136 975 2HG2 VAL 148 1HG2 VAL 148 -2.078 11.604 -3.297 976 3HG2 VAL 148 3HG2 VAL 148 -2.925 11.214 -1.788 977 H LYS 149 HN LYS 149 -4.965 15.780 -0.891 978 HA LYS 149 HA LYS 149 -7.020 15.195 -2.912 979 1HB LYS 149 HB2 LYS 149 -7.100 17.014 -0.492 980 2HB LYS 149 HB1 LYS 149 -8.428 16.782 -1.625 981 1HG LYS 149 HG2 LYS 149 -8.581 14.442 -0.992 982 2HG LYS 149 HG1 LYS 149 -7.214 14.634 0.100 983 1HD LYS 149 HD2 LYS 149 -8.491 16.223 1.427 984 2HD LYS 149 HD1 LYS 149 -9.860 16.058 0.325 985 1HE LYS 149 HE2 LYS 149 -9.969 13.653 0.859 986 2HE LYS 149 HE1 LYS 149 -8.634 13.861 1.990 987 1HZ LYS 149 HZ3 LYS 149 -10.043 15.379 3.272 988 2HZ LYS 149 HZ2 LYS 149 -11.306 15.135 2.192 989 3HZ LYS 149 HZ1 LYS 149 -10.731 13.847 3.130 990 H ASP 150 HN ASP 150 -4.378 16.130 -3.064 991 HA ASP 150 HA ASP 150 -4.306 18.942 -3.725 992 1HB ASP 150 HB2 ASP 150 -2.437 17.837 -2.596 993 2HB ASP 150 HB1 ASP 150 -2.309 16.682 -3.910 994 H LYS 151 HN LYS 151 -4.023 19.679 -5.906 995 HA LYS 151 HA LYS 151 -4.815 17.673 -7.899 996 1HB LYS 151 HB2 LYS 151 -6.016 19.414 -9.116 997 2HB LYS 151 HB1 LYS 151 -6.620 19.255 -7.475 998 1HG LYS 151 HG2 LYS 151 -5.254 21.229 -6.831 999 2HG LYS 151 HG1 LYS 151 -4.786 21.409 -8.520 1000 1HD LYS 151 HD2 LYS 151 -7.619 21.514 -7.466 1001 2HD LYS 151 HD1 LYS 151 -6.618 22.907 -7.857 1002 1HE LYS 151 HE2 LYS 151 -7.494 20.780 -9.834 1003 2HE LYS 151 HE1 LYS 151 -8.253 22.353 -9.627 1004 1HZ LYS 151 HZ3 LYS 151 -6.192 23.412 -10.340 1005 2HZ LYS 151 HZ2 LYS 151 -5.450 21.907 -10.527 1006 3HZ LYS 151 HZ1 LYS 151 -6.726 22.328 -11.497 1007 H VAL 152 HN VAL 152 -2.060 18.807 -7.131 1008 HA VAL 152 HA VAL 152 -1.443 19.677 -9.844 1009 HB VAL 152 HB VAL 152 0.461 20.875 -9.078 1010 1HG1 VAL 152 1HG1 VAL 152 -1.964 21.613 -7.469 1011 2HG1 VAL 152 3HG1 VAL 152 -0.584 22.672 -7.756 1012 3HG1 VAL 152 2HG1 VAL 152 -1.572 22.125 -9.110 1013 1HG2 VAL 152 2HG2 VAL 152 -0.225 20.014 -6.269 1014 2HG2 VAL 152 1HG2 VAL 152 1.193 19.526 -7.197 1015 3HG2 VAL 152 3HG2 VAL 152 1.007 21.205 -6.686 1016 H HIS 153 HN HIS 153 0.670 19.150 -10.621 1017 HA HIS 153 HA HIS 153 2.295 17.163 -9.447 1018 1HB HIS 153 HB2 HIS 153 0.404 15.717 -10.367 1019 2HB HIS 153 HB1 HIS 153 0.805 16.319 -11.969 1020 HD1 HIS 153 HD1 HIS 153 2.019 14.485 -13.192 1021 HD2 HIS 153 HD2 HIS 153 3.102 14.685 -9.184 1022 HE1 HIS 153 HE1 HIS 153 3.806 12.734 -12.858 1023 H LYS 154 HN LYS 154 1.211 18.705 -12.275 1024 HA LYS 154 HA LYS 154 3.974 19.543 -12.863 1025 1HB LYS 154 HB2 LYS 154 2.822 18.263 -14.727 1026 2HB LYS 154 HB1 LYS 154 1.601 19.532 -14.774 1027 1HG LYS 154 HG2 LYS 154 3.345 21.164 -15.344 1028 2HG LYS 154 HG1 LYS 154 4.536 19.865 -15.315 1029 1HD LYS 154 HD2 LYS 154 3.338 18.752 -17.149 1030 2HD LYS 154 HD1 LYS 154 2.188 20.092 -17.197 1031 1HE LYS 154 HE2 LYS 154 4.064 21.641 -17.657 1032 2HE LYS 154 HE1 LYS 154 5.164 20.269 -17.690 1033 1HZ LYS 154 HZ3 LYS 154 3.851 19.383 -19.559 1034 2HZ LYS 154 HZ2 LYS 154 2.926 20.805 -19.529 1035 3HZ LYS 154 HZ1 LYS 154 4.554 20.888 -19.900 1036 H LEU 155 HN LEU 155 4.224 21.865 -13.225 1037 HA LEU 155 HA LEU 155 1.901 23.305 -12.197 1038 1HB LEU 155 HB2 LEU 155 4.773 23.854 -11.588 1039 2HB LEU 155 HB1 LEU 155 3.463 24.948 -11.205 1040 HG LEU 155 HG LEU 155 3.822 22.167 -10.091 1041 1HD1 LEU 155 HD1 LEU 155 4.086 24.895 -8.945 1042 2HD1 LEU 155 HD1 LEU 155 4.222 23.392 -8.019 1043 3HD1 LEU 155 HD1 LEU 155 5.414 23.774 -9.288 1044 1HD2 LEU 155 HD2 LEU 155 1.744 24.285 -9.510 1045 2HD2 LEU 155 HD2 LEU 155 1.449 22.724 -10.283 1046 3HD2 LEU 155 HD2 LEU 155 1.970 22.795 -8.602 1047 H GLU 156 HN GLU 156 1.208 23.673 -14.112 1048 HA GLU 156 HA GLU 156 0.591 24.937 -15.874 1049 1HB GLU 156 HB2 GLU 156 2.171 26.997 -14.385 1050 2HB GLU 156 HB1 GLU 156 1.210 27.370 -15.810 1051 1HG GLU 156 HG2 GLU 156 -0.791 26.570 -14.682 1052 2HG GLU 156 HG1 GLU 156 0.169 26.166 -13.261 1053 H HIS 157 HN HIS 157 3.992 25.659 -15.454 1054 HA HIS 157 HA HIS 157 4.246 25.988 -18.343 1055 1HB HIS 157 HB2 HIS 157 6.181 26.666 -16.112 1056 2HB HIS 157 HB1 HIS 157 6.438 26.994 -17.818 1057 HD1 HIS 157 HD1 HIS 157 5.235 29.051 -18.804 1058 HD2 HIS 157 HD2 HIS 157 4.307 28.315 -14.831 1059 HE1 HIS 157 HE1 HIS 157 3.986 31.072 -17.994 1060 H HIS 158 HN HIS 158 6.593 25.301 -18.999 1061 HA HIS 158 HA HIS 158 6.721 22.482 -18.590 1062 1HB HIS 158 HB2 HIS 158 8.634 22.474 -20.122 1063 2HB HIS 158 HB1 HIS 158 7.364 23.490 -20.766 1064 HD1 HIS 158 HD1 HIS 158 10.897 23.607 -19.520 1065 HD2 HIS 158 HD2 HIS 158 7.989 26.212 -20.944 1066 HE1 HIS 158 HE1 HIS 158 12.078 25.771 -20.022 1067 H HIS 159 HN HIS 159 8.183 25.239 -17.194 1068 HA HIS 159 HA HIS 159 10.205 23.726 -15.757 1069 1HB HIS 159 HB2 HIS 159 10.566 26.087 -16.728 1070 2HB HIS 159 HB1 HIS 159 9.480 26.657 -15.464 1071 HD1 HIS 159 HD1 HIS 159 10.745 27.523 -13.441 1072 HD2 HIS 159 HD2 HIS 159 12.798 24.542 -15.497 1073 HE1 HIS 159 HE1 HIS 159 12.948 27.237 -12.268 1074 H HIS 160 HN HIS 160 10.152 23.913 -13.266 1075 HA HIS 160 HA HIS 160 7.357 24.034 -12.422 1076 1HB HIS 160 HB2 HIS 160 9.421 22.020 -11.503 1077 2HB HIS 160 HB1 HIS 160 7.828 22.214 -10.785 1078 HD1 HIS 160 HD1 HIS 160 7.001 22.652 -14.165 1079 HD2 HIS 160 HD2 HIS 160 8.299 19.359 -11.984 1080 HE1 HIS 160 HE1 HIS 160 6.348 20.637 -15.499 1081 H HIS 161 HN HIS 161 7.070 24.223 -10.062 1082 HA HIS 161 HA HIS 161 7.120 25.465 -8.212 1083 1HB HIS 161 HB2 HIS 161 10.107 25.681 -8.733 1084 2HB HIS 161 HB1 HIS 161 9.328 26.335 -7.298 1085 HD1 HIS 161 HD1 HIS 161 10.947 23.314 -8.552 1086 HD2 HIS 161 HD2 HIS 161 8.067 24.236 -5.703 1087 HE1 HIS 161 HE1 HIS 161 10.777 21.309 -7.060 1088 H HIS 162 HN HIS 162 9.370 27.038 -10.394 1089 HA HIS 162 HA HIS 162 7.762 29.004 -11.383 1090 1HB HIS 162 HB2 HIS 162 7.785 29.882 -9.001 1091 2HB HIS 162 HB1 HIS 162 9.526 30.065 -9.129 1092 HD1 HIS 162 HD1 HIS 162 10.365 32.220 -10.229 1093 HD2 HIS 162 HD2 HIS 162 6.284 31.621 -10.697 1094 HE1 HIS 162 HE1 HIS 162 9.445 34.366 -11.163 No H/Q in entry = 1094 Start of MODEL 16 1 H1 MET 1 HT1 MET 1 20.524 -14.528 -0.186 2 H2 MET 1 HT3 MET 1 20.965 -15.900 -1.051 3 H3 MET 1 HT2 MET 1 21.546 -14.405 -1.510 4 HA MET 1 HA MET 1 19.313 -13.682 -2.079 5 1HB MET 1 HB2 MET 1 19.007 -15.025 -4.099 6 2HB MET 1 HB1 MET 1 20.717 -14.743 -3.842 7 1HG MET 1 HG2 MET 1 21.002 -17.001 -3.013 8 2HG MET 1 HG1 MET 1 19.266 -17.292 -3.127 9 1HE MET 1 HE1 MET 1 21.503 -19.209 -4.371 10 2HE MET 1 HE3 MET 1 19.774 -19.526 -4.518 11 3HE MET 1 HE2 MET 1 20.802 -19.570 -5.947 12 H GLU 2 HN GLU 2 19.112 -15.532 0.398 13 HA GLU 2 HA GLU 2 17.108 -17.465 -0.128 14 1HB GLU 2 HB2 GLU 2 17.806 -16.073 2.464 15 2HB GLU 2 HB1 GLU 2 16.920 -17.578 2.287 16 1HG GLU 2 HG2 GLU 2 19.794 -17.159 1.507 17 2HG GLU 2 HG1 GLU 2 19.243 -17.907 2.998 18 H MET 3 HN MET 3 14.886 -17.330 0.344 19 HA MET 3 HA MET 3 13.749 -14.840 -0.305 20 1HB MET 3 HB2 MET 3 12.451 -17.404 0.591 21 2HB MET 3 HB1 MET 3 11.541 -15.969 0.148 22 1HG MET 3 HG2 MET 3 12.537 -16.018 -2.087 23 2HG MET 3 HG1 MET 3 13.427 -17.475 -1.654 24 1HE MET 3 HE2 MET 3 12.351 -19.796 -1.252 25 2HE MET 3 HE1 MET 3 11.319 -19.148 0.023 26 3HE MET 3 HE3 MET 3 10.624 -20.131 -1.270 27 H GLY 4 HN GLY 4 14.454 -16.306 2.734 28 1HA GLY 4 HA1 GLY 4 14.313 -15.439 4.872 29 2HA GLY 4 HA2 GLY 4 12.834 -14.629 4.353 30 H GLN 5 HN GLN 5 16.020 -14.325 2.966 31 HA GLN 5 HA GLN 5 16.736 -11.848 4.190 32 1HB GLN 5 HB2 GLN 5 17.738 -13.155 1.650 33 2HB GLN 5 HB1 GLN 5 18.481 -11.771 2.441 34 1HG GLN 5 HG2 GLN 5 19.060 -13.083 4.344 35 2HG GLN 5 HG1 GLN 5 18.160 -14.467 3.726 36 1HE2 GLN 5 1HE2 GLN 5 20.964 -14.189 4.443 37 2HE2 GLN 5 2HE2 GLN 5 21.857 -14.653 3.049 38 H LEU 6 HN LEU 6 15.252 -12.830 1.198 39 HA LEU 6 HA LEU 6 14.959 -10.348 -0.044 40 1HB LEU 6 HB2 LEU 6 14.614 -12.590 -1.103 41 2HB LEU 6 HB1 LEU 6 13.160 -12.780 -0.169 42 HG LEU 6 HG LEU 6 12.853 -12.242 -2.610 43 1HD1 LEU 6 HD1 LEU 6 11.609 -10.362 -0.629 44 2HD1 LEU 6 HD1 LEU 6 11.053 -10.608 -2.273 45 3HD1 LEU 6 HD1 LEU 6 10.977 -11.929 -1.116 46 1HD2 LEU 6 HD2 LEU 6 14.633 -10.596 -2.862 47 2HD2 LEU 6 HD2 LEU 6 13.063 -9.919 -3.310 48 3HD2 LEU 6 HD2 LEU 6 13.782 -9.511 -1.757 49 H LYS 7 HN LYS 7 12.810 -12.104 2.185 50 HA LYS 7 HA LYS 7 10.835 -10.142 2.350 51 1HB LYS 7 HB2 LYS 7 11.509 -12.569 3.789 52 2HB LYS 7 HB1 LYS 7 10.819 -11.340 4.843 53 1HG LYS 7 HG2 LYS 7 9.588 -12.191 2.250 54 2HG LYS 7 HG1 LYS 7 9.170 -12.928 3.789 55 1HD LYS 7 HD2 LYS 7 9.022 -9.954 3.355 56 2HD LYS 7 HD1 LYS 7 7.653 -11.000 2.945 57 1HE LYS 7 HE2 LYS 7 7.676 -11.766 5.329 58 2HE LYS 7 HE1 LYS 7 8.936 -10.577 5.651 59 1HZ LYS 7 HZ3 LYS 7 6.211 -9.917 4.632 60 2HZ LYS 7 HZ2 LYS 7 6.681 -9.813 6.218 61 3HZ LYS 7 HZ1 LYS 7 7.395 -8.795 5.094 62 H ASN 8 HN ASN 8 13.799 -10.566 4.130 63 HA ASN 8 HA ASN 8 13.376 -8.509 5.965 64 1HB ASN 8 HB2 ASN 8 15.174 -10.188 6.223 65 2HB ASN 8 HB1 ASN 8 16.007 -9.521 4.830 66 1HD2 ASN 8 HD2 ASN 8 17.844 -9.144 6.038 67 2HD2 ASN 8 HD2 ASN 8 17.964 -7.862 7.180 68 H LYS 9 HN LYS 9 14.711 -8.488 2.704 69 HA LYS 9 HA LYS 9 15.382 -5.731 2.540 70 1HB LYS 9 HB2 LYS 9 14.526 -7.679 0.388 71 2HB LYS 9 HB1 LYS 9 15.091 -6.056 0.043 72 1HG LYS 9 HG2 LYS 9 16.698 -8.180 1.439 73 2HG LYS 9 HG1 LYS 9 16.783 -7.836 -0.285 74 1HD LYS 9 HD2 LYS 9 17.378 -5.822 1.889 75 2HD LYS 9 HD1 LYS 9 18.600 -6.762 1.037 76 1HE LYS 9 HE2 LYS 9 17.877 -5.759 -1.092 77 2HE LYS 9 HE1 LYS 9 16.671 -4.806 -0.234 78 1HZ LYS 9 HZ1 LYS 9 19.601 -4.634 0.166 79 2HZ LYS 9 HZ3 LYS 9 18.650 -3.530 -0.692 80 3HZ LYS 9 HZ2 LYS 9 18.447 -3.721 0.976 81 H ILE 10 HN ILE 10 12.441 -7.518 1.867 82 HA ILE 10 HA ILE 10 10.909 -5.389 0.880 83 HB ILE 10 HB ILE 10 10.113 -7.975 2.211 84 1HG1 ILE 10 2HG1 ILE 10 10.000 -6.985 -0.625 85 2HG1 ILE 10 1HG1 ILE 10 11.179 -8.114 0.031 86 1HG2 ILE 10 2HG2 ILE 10 8.319 -6.364 2.659 87 2HG2 ILE 10 1HG2 ILE 10 8.250 -5.967 0.939 88 3HG2 ILE 10 3HG2 ILE 10 7.801 -7.584 1.493 89 1HD1 ILE 10 HD1 ILE 10 8.227 -8.573 -0.248 90 2HD1 ILE 10 HD1 ILE 10 9.513 -9.239 -1.267 91 3HD1 ILE 10 HD1 ILE 10 9.398 -9.712 0.425 92 H GLU 11 HN GLU 11 11.131 -6.706 4.153 93 HA GLU 11 HA GLU 11 9.453 -4.810 5.399 94 1HB GLU 11 HB2 GLU 11 11.860 -6.233 6.562 95 2HB GLU 11 HB1 GLU 11 10.598 -5.435 7.484 96 1HG GLU 11 HG2 GLU 11 10.217 -7.862 5.726 97 2HG GLU 11 HG1 GLU 11 10.362 -7.884 7.475 98 H ASN 12 HN ASN 12 12.886 -4.827 4.764 99 HA ASN 12 HA ASN 12 13.690 -2.499 6.037 100 1HB ASN 12 HB2 ASN 12 15.153 -4.235 4.964 101 2HB ASN 12 HB1 ASN 12 14.712 -3.571 3.401 102 1HD2 ASN 12 HD2 ASN 12 16.751 -3.385 6.034 103 2HD2 ASN 12 HD2 ASN 12 17.648 -1.975 5.585 104 H LYS 13 HN LYS 13 12.738 -2.975 2.648 105 HA LYS 13 HA LYS 13 12.999 -0.285 1.852 106 1HB LYS 13 HB2 LYS 13 13.154 -2.293 0.366 107 2HB LYS 13 HB1 LYS 13 11.428 -2.506 0.539 108 1HG LYS 13 HG2 LYS 13 11.968 -1.429 -1.598 109 2HG LYS 13 HG1 LYS 13 11.039 -0.358 -0.550 110 1HD LYS 13 HD2 LYS 13 12.832 0.834 -1.648 111 2HD LYS 13 HD1 LYS 13 13.069 0.803 0.094 112 1HE LYS 13 HE2 LYS 13 14.713 -0.974 -0.171 113 2HE LYS 13 HE1 LYS 13 14.471 -0.959 -1.928 114 1HZ LYS 13 HZ3 LYS 13 15.181 1.423 -1.851 115 2HZ LYS 13 HZ2 LYS 13 15.546 1.167 -0.194 116 3HZ LYS 13 HZ1 LYS 13 16.408 0.345 -1.363 117 H LYS 14 HN LYS 14 10.227 -2.252 2.789 118 HA LYS 14 HA LYS 14 8.109 -0.529 2.400 119 1HB LYS 14 HB2 LYS 14 7.970 -2.903 3.077 120 2HB LYS 14 HB1 LYS 14 8.625 -2.479 4.642 121 1HG LYS 14 HG2 LYS 14 6.596 -1.126 5.078 122 2HG LYS 14 HG1 LYS 14 5.949 -1.658 3.523 123 1HD LYS 14 HD2 LYS 14 5.009 -3.109 5.204 124 2HD LYS 14 HD1 LYS 14 6.233 -4.023 4.319 125 1HE LYS 14 HE2 LYS 14 7.855 -3.461 6.161 126 2HE LYS 14 HE1 LYS 14 6.480 -2.765 7.016 127 1HZ LYS 14 HZ3 LYS 14 5.437 -5.015 7.050 128 2HZ LYS 14 HZ2 LYS 14 6.772 -5.631 6.224 129 3HZ LYS 14 HZ1 LYS 14 6.960 -5.005 7.734 130 H LYS 15 HN LYS 15 10.260 -0.951 5.183 131 HA LYS 15 HA LYS 15 9.086 1.063 6.769 132 1HB LYS 15 HB2 LYS 15 11.782 -0.242 6.934 133 2HB LYS 15 HB1 LYS 15 11.165 0.887 8.134 134 1HG LYS 15 HG2 LYS 15 9.324 -0.592 8.635 135 2HG LYS 15 HG1 LYS 15 9.823 -1.688 7.354 136 1HD LYS 15 HD2 LYS 15 10.603 -2.695 9.291 137 2HD LYS 15 HD1 LYS 15 12.016 -1.910 8.624 138 1HE LYS 15 HE2 LYS 15 10.318 -0.746 10.850 139 2HE LYS 15 HE1 LYS 15 11.800 -1.638 11.110 140 1HZ LYS 15 HZ1 LYS 15 12.943 0.154 9.785 141 2HZ LYS 15 HZ3 LYS 15 11.501 1.035 9.823 142 3HZ LYS 15 HZ2 LYS 15 12.278 0.632 11.242 143 H GLU 16 HN GLU 16 11.788 1.148 4.497 144 HA GLU 16 HA GLU 16 12.656 3.792 4.935 145 1HB GLU 16 HB2 GLU 16 12.432 2.257 2.334 146 2HB GLU 16 HB1 GLU 16 13.151 3.845 2.460 147 1HG GLU 16 HG2 GLU 16 14.838 2.847 3.997 148 2HG GLU 16 HG1 GLU 16 14.144 1.263 3.617 149 H LEU 17 HN LEU 17 10.102 2.493 2.989 150 HA LEU 17 HA LEU 17 9.245 4.934 1.888 151 1HB LEU 17 HB2 LEU 17 8.828 2.976 0.666 152 2HB LEU 17 HB1 LEU 17 8.115 2.166 2.036 153 HG LEU 17 HG LEU 17 6.516 2.781 0.195 154 1HD1 LEU 17 HD1 LEU 17 5.764 2.140 2.256 155 2HD1 LEU 17 HD1 LEU 17 5.852 3.806 2.834 156 3HD1 LEU 17 HD1 LEU 17 4.737 3.380 1.518 157 1HD2 LEU 17 HD2 LEU 17 6.985 5.568 1.178 158 2HD2 LEU 17 HD2 LEU 17 7.408 4.940 -0.417 159 3HD2 LEU 17 HD2 LEU 17 5.712 5.046 0.072 160 H ILE 18 HN ILE 18 8.071 2.961 4.568 161 HA ILE 18 HA ILE 18 5.843 4.432 5.161 162 HB ILE 18 HB ILE 18 7.650 2.932 7.082 163 1HG1 ILE 18 2HG1 ILE 18 4.931 2.130 6.076 164 2HG1 ILE 18 1HG1 ILE 18 6.385 1.691 5.191 165 1HG2 ILE 18 1HG2 ILE 18 4.870 4.030 7.642 166 2HG2 ILE 18 3HG2 ILE 18 5.763 2.944 8.694 167 3HG2 ILE 18 2HG2 ILE 18 6.360 4.568 8.382 168 1HD1 ILE 18 HD1 ILE 18 5.792 0.959 8.048 169 2HD1 ILE 18 HD1 ILE 18 5.593 -0.103 6.639 170 3HD1 ILE 18 HD1 ILE 18 7.194 0.481 7.088 171 H GLN 19 HN GLN 19 9.152 4.912 6.153 172 HA GLN 19 HA GLN 19 8.761 7.110 7.872 173 1HB GLN 19 HB2 GLN 19 11.116 6.386 6.178 174 2HB GLN 19 HB1 GLN 19 11.145 7.614 7.435 175 1HG GLN 19 HG2 GLN 19 10.601 5.869 9.084 176 2HG GLN 19 HG1 GLN 19 10.659 4.680 7.781 177 1HE2 GLN 19 1HE2 GLN 19 12.473 6.792 9.780 178 2HE2 GLN 19 2HE2 GLN 19 14.033 6.178 9.409 179 H LEU 20 HN LEU 20 9.273 6.899 4.387 180 HA LEU 20 HA LEU 20 9.496 9.689 3.918 181 1HB LEU 20 HB2 LEU 20 8.606 7.494 2.043 182 2HB LEU 20 HB1 LEU 20 8.947 9.135 1.555 183 HG LEU 20 HG LEU 20 10.956 7.178 2.675 184 1HD1 LEU 20 HD1 LEU 20 10.584 8.280 -0.100 185 2HD1 LEU 20 HD1 LEU 20 11.905 7.243 0.426 186 3HD1 LEU 20 HD1 LEU 20 10.252 6.629 0.420 187 1HD2 LEU 20 HD2 LEU 20 11.319 10.000 1.657 188 2HD2 LEU 20 HD2 LEU 20 11.524 9.460 3.323 189 3HD2 LEU 20 HD2 LEU 20 12.624 8.889 2.069 190 H VAL 21 HN VAL 21 6.739 7.430 3.584 191 HA VAL 21 HA VAL 21 4.781 9.328 3.087 192 HB VAL 21 HB VAL 21 4.573 6.745 4.664 193 1HG1 VAL 21 1HG1 VAL 21 2.614 8.185 5.009 194 2HG1 VAL 21 3HG1 VAL 21 2.401 8.293 3.262 195 3HG1 VAL 21 2HG1 VAL 21 2.221 6.742 4.078 196 1HG2 VAL 21 1HG2 VAL 21 5.507 6.465 2.497 197 2HG2 VAL 21 3HG2 VAL 21 3.885 5.777 2.569 198 3HG2 VAL 21 2HG2 VAL 21 4.145 7.334 1.756 199 H ALA 22 HN ALA 22 6.011 8.169 6.187 200 HA ALA 22 HA ALA 22 4.334 9.513 7.908 201 1HB ALA 22 HB2 ALA 22 7.222 8.803 8.307 202 2HB ALA 22 HB1 ALA 22 6.040 9.106 9.601 203 3HB ALA 22 HB3 ALA 22 5.852 7.725 8.511 204 H ARG 23 HN ARG 23 7.515 10.542 6.681 205 HA ARG 23 HA ARG 23 7.438 13.032 7.979 206 1HB ARG 23 HB2 ARG 23 9.349 13.698 6.582 207 2HB ARG 23 HB1 ARG 23 9.586 12.165 7.403 208 1HG ARG 23 HG2 ARG 23 9.249 10.974 5.387 209 2HG ARG 23 HG1 ARG 23 8.779 12.445 4.525 210 1HD ARG 23 HD2 ARG 23 11.486 11.941 5.773 211 2HD ARG 23 HD1 ARG 23 11.118 11.790 4.052 212 HE ARG 23 HE ARG 23 10.316 14.304 4.977 213 1HH1 ARG 23 1HH1 ARG 23 13.375 12.627 4.414 214 2HH1 ARG 23 2HH1 ARG 23 14.190 14.021 3.882 215 1HH2 ARG 23 1HH2 ARG 23 11.393 16.152 4.337 216 2HH2 ARG 23 2HH2 ARG 23 13.044 16.131 3.875 217 H HIS 24 HN HIS 24 5.903 12.011 5.146 218 HA HIS 24 HA HIS 24 5.649 14.428 3.755 219 1HB HIS 24 HB2 HIS 24 4.940 12.342 2.754 220 2HB HIS 24 HB1 HIS 24 3.710 12.080 3.959 221 HD1 HIS 24 HD1 HIS 24 1.447 13.560 3.646 222 HD2 HIS 24 HD2 HIS 24 4.293 14.045 0.642 223 HE1 HIS 24 HE1 HIS 24 0.302 14.718 1.756 224 H GLY 25 HN GLY 25 4.084 13.305 6.671 225 1HA GLY 25 HA1 GLY 25 2.133 15.469 6.582 226 2HA GLY 25 HA2 GLY 25 3.401 15.634 7.787 227 H LEU 26 HN LEU 26 2.519 12.370 7.229 228 HA LEU 26 HA LEU 26 0.244 11.979 8.632 229 1HB LEU 26 HB2 LEU 26 2.665 10.383 8.163 230 2HB LEU 26 HB1 LEU 26 1.434 9.763 9.243 231 HG LEU 26 HG LEU 26 -0.179 9.979 7.374 232 1HD1 LEU 26 HD1 LEU 26 0.916 11.613 6.025 233 2HD1 LEU 26 HD1 LEU 26 2.240 10.495 5.692 234 3HD1 LEU 26 HD1 LEU 26 0.611 10.134 5.103 235 1HD2 LEU 26 HD2 LEU 26 2.210 8.215 7.050 236 2HD2 LEU 26 HD2 LEU 26 0.745 7.872 7.969 237 3HD2 LEU 26 HD2 LEU 26 0.684 7.955 6.208 238 H ASP 27 HN ASP 27 -0.261 11.380 10.615 239 HA ASP 27 HA ASP 27 1.408 12.356 12.790 240 1HB ASP 27 HB2 ASP 27 -1.384 11.168 12.857 241 2HB ASP 27 HB1 ASP 27 -0.522 11.844 14.232 242 H HIS 28 HN HIS 28 1.047 10.754 14.828 243 HA HIS 28 HA HIS 28 2.779 8.594 14.190 244 1HB HIS 28 HB2 HIS 28 1.275 9.124 16.768 245 2HB HIS 28 HB1 HIS 28 2.623 8.010 16.575 246 HD1 HIS 28 HD1 HIS 28 4.998 9.040 16.521 247 HD2 HIS 28 HD2 HIS 28 1.939 11.831 16.750 248 HE1 HIS 28 HE1 HIS 28 6.112 11.268 16.962 249 H ASP 29 HN ASP 29 -0.597 8.773 15.166 250 HA ASP 29 HA ASP 29 -1.203 6.042 15.076 251 1HB ASP 29 HB2 ASP 29 -2.731 7.558 16.134 252 2HB ASP 29 HB1 ASP 29 -2.902 8.494 14.657 253 H LYS 30 HN LYS 30 -1.153 8.512 12.627 254 HA LYS 30 HA LYS 30 -2.315 7.061 10.523 255 1HB LYS 30 HB2 LYS 30 -0.286 9.275 10.479 256 2HB LYS 30 HB1 LYS 30 -1.006 8.604 9.028 257 1HG LYS 30 HG2 LYS 30 -2.522 9.941 11.257 258 2HG LYS 30 HG1 LYS 30 -2.020 10.714 9.755 259 1HD LYS 30 HD2 LYS 30 -3.343 9.005 8.505 260 2HD LYS 30 HD1 LYS 30 -3.942 8.406 10.056 261 1HE LYS 30 HE2 LYS 30 -4.894 10.601 10.537 262 2HE LYS 30 HE1 LYS 30 -4.270 11.204 9.005 263 1HZ LYS 30 HZ3 LYS 30 -5.697 9.561 7.870 264 2HZ LYS 30 HZ2 LYS 30 -6.288 9.071 9.358 265 3HZ LYS 30 HZ1 LYS 30 -6.596 10.631 8.825 266 H VAL 31 HN VAL 31 1.088 7.346 11.570 267 HA VAL 31 HA VAL 31 2.152 5.745 9.521 268 HB VAL 31 HB VAL 31 3.290 6.273 12.302 269 1HG1 VAL 31 2HG1 VAL 31 4.358 4.367 11.264 270 2HG1 VAL 31 1HG1 VAL 31 4.676 5.322 9.817 271 3HG1 VAL 31 3HG1 VAL 31 5.454 5.749 11.342 272 1HG2 VAL 31 1HG2 VAL 31 2.861 8.332 11.082 273 2HG2 VAL 31 3HG2 VAL 31 4.593 8.028 11.222 274 3HG2 VAL 31 2HG2 VAL 31 3.758 7.709 9.699 275 H LEU 32 HN LEU 32 0.911 5.013 12.738 276 HA LEU 32 HA LEU 32 1.564 2.233 12.802 277 1HB LEU 32 HB2 LEU 32 -0.774 3.631 14.084 278 2HB LEU 32 HB1 LEU 32 -0.130 2.061 14.524 279 HG LEU 32 HG LEU 32 1.215 4.732 14.899 280 1HD1 LEU 32 HD1 LEU 32 0.139 2.735 16.848 281 2HD1 LEU 32 HD1 LEU 32 1.015 4.209 17.269 282 3HD1 LEU 32 HD1 LEU 32 -0.554 4.316 16.467 283 1HD2 LEU 32 HD2 LEU 32 2.222 1.963 15.553 284 2HD2 LEU 32 HD2 LEU 32 2.885 3.054 14.340 285 3HD2 LEU 32 HD2 LEU 32 2.989 3.471 16.052 286 H LEU 33 HN LEU 33 -1.378 3.895 11.803 287 HA LEU 33 HA LEU 33 -2.758 1.596 10.959 288 1HB LEU 33 HB2 LEU 33 -2.962 4.427 9.945 289 2HB LEU 33 HB1 LEU 33 -4.109 3.151 9.607 290 HG LEU 33 HG LEU 33 -3.555 4.233 12.364 291 1HD1 LEU 33 HD1 LEU 33 -5.781 4.853 10.417 292 2HD1 LEU 33 HD1 LEU 33 -5.715 5.364 12.107 293 3HD1 LEU 33 HD1 LEU 33 -4.514 5.956 10.967 294 1HD2 LEU 33 HD2 LEU 33 -4.412 1.937 12.289 295 2HD2 LEU 33 HD2 LEU 33 -5.612 3.057 12.941 296 3HD2 LEU 33 HD2 LEU 33 -5.753 2.480 11.285 297 H PHE 34 HN PHE 34 -0.776 3.903 9.149 298 HA PHE 34 HA PHE 34 -1.073 2.806 6.625 299 1HB PHE 34 HB2 PHE 34 -0.080 5.009 6.991 300 2HB PHE 34 HB1 PHE 34 1.316 4.270 7.762 301 HD1 PHE 34 HD1 PHE 34 3.205 3.827 6.477 302 HD2 PHE 34 HD2 PHE 34 -0.561 4.223 4.546 303 HE1 PHE 34 HE1 PHE 34 4.290 3.659 4.242 304 HE2 PHE 34 HE2 PHE 34 0.510 4.078 2.388 305 HZ PHE 34 HZ PHE 34 2.933 3.791 2.227 306 H SER 35 HN SER 35 1.477 2.183 9.011 307 HA SER 35 HA SER 35 2.902 0.472 7.344 308 1HB SER 35 HB2 SER 35 4.059 -0.253 9.441 309 2HB SER 35 HB1 SER 35 4.023 1.494 9.186 310 HG SER 35 HG SER 35 2.514 1.707 10.725 311 H ARG 36 HN ARG 36 0.397 -0.260 9.738 312 HA ARG 36 HA ARG 36 0.736 -3.075 9.403 313 1HB ARG 36 HB2 ARG 36 -1.253 -3.321 10.801 314 2HB ARG 36 HB1 ARG 36 -0.106 -2.194 11.500 315 1HG ARG 36 HG2 ARG 36 -1.479 -0.330 10.612 316 2HG ARG 36 HG1 ARG 36 -2.666 -1.520 10.075 317 1HD ARG 36 HD2 ARG 36 -1.728 -1.072 12.889 318 2HD ARG 36 HD1 ARG 36 -3.267 -0.550 12.210 319 HE ARG 36 HE ARG 36 -3.578 -3.039 11.716 320 1HH1 ARG 36 1HH1 ARG 36 -1.921 -1.844 14.610 321 2HH1 ARG 36 2HH1 ARG 36 -2.446 -3.127 15.599 322 1HH2 ARG 36 1HH2 ARG 36 -4.275 -4.816 13.072 323 2HH2 ARG 36 2HH2 ARG 36 -3.795 -4.871 14.695 324 H ASP 37 HN ASP 37 -1.354 -0.676 7.932 325 HA ASP 37 HA ASP 37 -3.167 -2.506 6.691 326 1HB ASP 37 HB2 ASP 37 -3.518 0.011 7.097 327 2HB ASP 37 HB1 ASP 37 -2.428 0.285 5.762 328 H LEU 38 HN LEU 38 -0.210 -0.991 5.863 329 HA LEU 38 HA LEU 38 0.039 -1.938 3.202 330 1HB LEU 38 HB2 LEU 38 1.087 0.059 3.831 331 2HB LEU 38 HB1 LEU 38 1.818 -0.664 5.231 332 HG LEU 38 HG LEU 38 3.540 -1.673 3.912 333 1HD1 LEU 38 HD1 LEU 38 2.001 -0.704 1.513 334 2HD1 LEU 38 HD1 LEU 38 3.602 -1.477 1.520 335 3HD1 LEU 38 HD1 LEU 38 2.178 -2.402 2.013 336 1HD2 LEU 38 HD2 LEU 38 2.844 1.049 2.963 337 2HD2 LEU 38 HD2 LEU 38 3.767 0.666 4.413 338 3HD2 LEU 38 HD2 LEU 38 4.450 0.309 2.810 339 H ASP 39 HN ASP 39 1.408 -2.936 6.310 340 HA ASP 39 HA ASP 39 3.036 -5.018 5.423 341 1HB ASP 39 HB2 ASP 39 3.044 -4.098 7.733 342 2HB ASP 39 HB1 ASP 39 1.492 -4.882 8.016 343 H LYS 40 HN LYS 40 -0.381 -4.997 6.259 344 HA LYS 40 HA LYS 40 -0.773 -7.789 6.045 345 1HB LYS 40 HB2 LYS 40 -3.009 -7.411 6.356 346 2HB LYS 40 HB1 LYS 40 -2.346 -5.908 7.043 347 1HG LYS 40 HG2 LYS 40 -2.858 -4.759 4.953 348 2HG LYS 40 HG1 LYS 40 -3.528 -6.241 4.293 349 1HD LYS 40 HD2 LYS 40 -5.191 -6.179 6.189 350 2HD LYS 40 HD1 LYS 40 -4.585 -4.555 6.550 351 1HE LYS 40 HE2 LYS 40 -5.796 -5.468 3.935 352 2HE LYS 40 HE1 LYS 40 -6.555 -4.403 5.119 353 1HZ LYS 40 HZ2 LYS 40 -3.991 -3.658 3.786 354 2HZ LYS 40 HZ1 LYS 40 -5.507 -3.271 3.148 355 3HZ LYS 40 HZ3 LYS 40 -5.059 -2.707 4.639 356 H LEU 41 HN LEU 41 -0.852 -5.158 3.746 357 HA LEU 41 HA LEU 41 -2.233 -6.497 1.668 358 1HB LEU 41 HB2 LEU 41 -2.151 -4.083 1.826 359 2HB LEU 41 HB1 LEU 41 -0.408 -4.102 1.659 360 HG LEU 41 HG LEU 41 -0.674 -4.980 -0.640 361 1HD1 LEU 41 HD1 LEU 41 -3.592 -4.480 -0.144 362 2HD1 LEU 41 HD1 LEU 41 -2.862 -4.863 -1.706 363 3HD1 LEU 41 HD1 LEU 41 -2.825 -6.050 -0.397 364 1HD2 LEU 41 HD2 LEU 41 -0.362 -2.606 -0.224 365 2HD2 LEU 41 HD2 LEU 41 -1.424 -2.874 -1.611 366 3HD2 LEU 41 HD2 LEU 41 -2.109 -2.403 -0.057 367 H ILE 42 HN ILE 42 0.991 -6.126 2.637 368 HA ILE 42 HA ILE 42 2.149 -7.097 0.196 369 HB ILE 42 HB ILE 42 3.420 -6.788 2.938 370 1HG1 ILE 42 2HG1 ILE 42 3.586 -5.126 0.435 371 2HG1 ILE 42 1HG1 ILE 42 2.706 -4.689 1.895 372 1HG2 ILE 42 1HG2 ILE 42 4.707 -7.381 0.273 373 2HG2 ILE 42 3HG2 ILE 42 5.573 -7.005 1.763 374 3HG2 ILE 42 2HG2 ILE 42 4.615 -8.486 1.643 375 1HD1 ILE 42 HD1 ILE 42 5.684 -5.043 1.660 376 2HD1 ILE 42 HD1 ILE 42 4.819 -3.502 1.724 377 3HD1 ILE 42 HD1 ILE 42 4.788 -4.587 3.112 378 H ASN 43 HN ASN 43 1.899 -8.482 3.408 379 HA ASN 43 HA ASN 43 2.775 -11.048 2.753 380 1HB ASN 43 HB2 ASN 43 0.923 -10.130 4.945 381 2HB ASN 43 HB1 ASN 43 1.540 -11.769 4.842 382 1HD2 ASN 43 HD2 ASN 43 1.903 -9.679 6.863 383 2HD2 ASN 43 HD2 ASN 43 3.601 -9.424 7.027 384 H LYS 44 HN LYS 44 -0.384 -9.620 2.481 385 HA LYS 44 HA LYS 44 -1.968 -11.861 1.916 386 1HB LYS 44 HB2 LYS 44 -2.926 -9.709 2.313 387 2HB LYS 44 HB1 LYS 44 -2.076 -9.008 0.952 388 1HG LYS 44 HG2 LYS 44 -3.436 -10.493 -0.568 389 2HG LYS 44 HG1 LYS 44 -4.370 -10.958 0.857 390 1HD LYS 44 HD2 LYS 44 -4.044 -8.122 -0.075 391 2HD LYS 44 HD1 LYS 44 -5.408 -9.153 -0.495 392 1HE LYS 44 HE2 LYS 44 -4.597 -8.422 2.322 393 2HE LYS 44 HE1 LYS 44 -5.876 -7.650 1.389 394 1HZ LYS 44 HZ2 LYS 44 -5.847 -10.530 2.139 395 2HZ LYS 44 HZ1 LYS 44 -6.741 -9.321 2.900 396 3HZ LYS 44 HZ3 LYS 44 -7.058 -9.729 1.307 397 H PHE 45 HN PHE 45 -0.159 -9.731 -0.276 398 HA PHE 45 HA PHE 45 -0.849 -11.329 -2.519 399 1HB PHE 45 HB2 PHE 45 0.726 -8.837 -2.167 400 2HB PHE 45 HB1 PHE 45 0.941 -9.769 -3.648 401 HD1 PHE 45 HD1 PHE 45 -0.822 -10.064 -5.210 402 HD2 PHE 45 HD2 PHE 45 -1.411 -7.789 -1.667 403 HE1 PHE 45 HE1 PHE 45 -2.934 -9.209 -6.115 404 HE2 PHE 45 HE2 PHE 45 -3.523 -6.908 -2.579 405 HZ PHE 45 HZ PHE 45 -4.286 -7.619 -4.799 406 H MET 46 HN MET 46 1.864 -11.089 -0.427 407 HA MET 46 HA MET 46 3.691 -12.509 -2.047 408 1HB MET 46 HB2 MET 46 3.596 -12.574 0.968 409 2HB MET 46 HB1 MET 46 4.971 -12.969 -0.054 410 1HG MET 46 HG2 MET 46 4.851 -10.528 -0.840 411 2HG MET 46 HG1 MET 46 3.727 -10.313 0.479 412 1HE MET 46 HE2 MET 46 7.272 -11.058 -0.592 413 2HE MET 46 HE1 MET 46 8.118 -11.450 0.906 414 3HE MET 46 HE3 MET 46 6.919 -12.566 0.250 415 H ASN 47 HN ASN 47 1.091 -13.430 0.051 416 HA ASN 47 HA ASN 47 -0.109 -15.303 0.286 417 1HB ASN 47 HB2 ASN 47 -0.079 -15.426 -2.131 418 2HB ASN 47 HB1 ASN 47 1.519 -16.135 -2.141 419 1HD2 ASN 47 HD2 ASN 47 1.683 -18.296 -2.048 420 2HD2 ASN 47 HD2 ASN 47 0.337 -19.371 -1.977 421 H VAL 48 HN VAL 48 2.474 -14.820 1.570 422 HA VAL 48 HA VAL 48 2.946 -17.507 2.581 423 HB VAL 48 HB VAL 48 5.235 -16.879 3.138 424 1HG1 VAL 48 3HG1 VAL 48 4.645 -16.424 0.230 425 2HG1 VAL 48 2HG1 VAL 48 6.237 -16.779 0.898 426 3HG1 VAL 48 1HG1 VAL 48 4.941 -17.975 1.017 427 1HG2 VAL 48 1HG2 VAL 48 4.980 -14.476 3.429 428 2HG2 VAL 48 3HG2 VAL 48 6.282 -14.814 2.285 429 3HG2 VAL 48 2HG2 VAL 48 4.706 -14.279 1.700 430 H LYS 49 HN LYS 49 3.580 -17.470 4.825 431 HA LYS 49 HA LYS 49 2.404 -15.179 6.212 432 1HB LYS 49 HB2 LYS 49 2.139 -18.111 6.921 433 2HB LYS 49 HB1 LYS 49 1.505 -16.767 7.864 434 1HG LYS 49 HG2 LYS 49 0.052 -16.133 5.994 435 2HG LYS 49 HG1 LYS 49 0.684 -17.464 5.045 436 1HD LYS 49 HD2 LYS 49 -1.469 -18.078 5.976 437 2HD LYS 49 HD1 LYS 49 -0.205 -19.047 6.730 438 1HE LYS 49 HE2 LYS 49 -1.837 -18.277 8.382 439 2HE LYS 49 HE1 LYS 49 -0.244 -17.596 8.692 440 1HZ LYS 49 HZ2 LYS 49 -2.493 -16.167 7.356 441 2HZ LYS 49 HZ1 LYS 49 -2.005 -15.934 8.936 442 3HZ LYS 49 HZ3 LYS 49 -0.979 -15.518 7.681 443 H ASP 50 HN ASP 50 5.137 -16.215 5.437 444 HA ASP 50 HA ASP 50 6.460 -16.766 7.919 445 1HB ASP 50 HB2 ASP 50 7.642 -16.049 5.215 446 2HB ASP 50 HB1 ASP 50 8.579 -16.478 6.636 447 H LYS 51 HN LYS 51 5.570 -14.936 8.980 448 HA LYS 51 HA LYS 51 7.039 -12.467 8.423 449 1HB LYS 51 HB2 LYS 51 5.504 -11.382 10.038 450 2HB LYS 51 HB1 LYS 51 4.621 -12.191 8.753 451 1HG LYS 51 HG2 LYS 51 4.226 -14.096 10.260 452 2HG LYS 51 HG1 LYS 51 5.043 -13.216 11.553 453 1HD LYS 51 HD2 LYS 51 3.382 -11.416 11.337 454 2HD LYS 51 HD1 LYS 51 2.546 -12.361 10.099 455 1HE LYS 51 HE2 LYS 51 2.235 -14.171 11.752 456 2HE LYS 51 HE1 LYS 51 2.992 -13.151 12.970 457 1HZ LYS 51 HZ3 LYS 51 1.193 -11.520 12.615 458 2HZ LYS 51 HZ2 LYS 51 0.468 -12.579 11.525 459 3HZ LYS 51 HZ1 LYS 51 0.620 -13.013 13.137 460 H VAL 52 HN VAL 52 7.257 -15.130 9.991 461 HA VAL 52 HA VAL 52 8.667 -14.080 12.301 462 HB VAL 52 HB VAL 52 8.706 -16.490 13.152 463 1HG1 VAL 52 1HG1 VAL 52 7.138 -14.821 14.006 464 2HG1 VAL 52 3HG1 VAL 52 6.017 -15.194 12.696 465 3HG1 VAL 52 2HG1 VAL 52 6.380 -16.408 13.924 466 1HG2 VAL 52 1HG2 VAL 52 6.694 -16.866 10.919 467 2HG2 VAL 52 3HG2 VAL 52 8.280 -17.629 11.014 468 3HG2 VAL 52 2HG2 VAL 52 7.033 -18.034 12.195 469 H HIS 53 HN HIS 53 10.215 -13.358 10.792 470 HA HIS 53 HA HIS 53 12.264 -15.390 10.466 471 1HB HIS 53 HB2 HIS 53 13.133 -14.168 8.475 472 2HB HIS 53 HB1 HIS 53 11.509 -14.766 8.213 473 HD1 HIS 53 HD1 HIS 53 13.535 -11.742 8.013 474 HD2 HIS 53 HD2 HIS 53 9.498 -12.660 8.327 475 HE1 HIS 53 HE1 HIS 53 12.274 -9.647 7.344 476 H LYS 54 HN LYS 54 14.342 -14.699 10.869 477 HA LYS 54 HA LYS 54 15.814 -13.904 12.256 478 1HB LYS 54 HB2 LYS 54 16.121 -12.100 10.751 479 2HB LYS 54 HB1 LYS 54 14.677 -11.278 11.308 480 1HG LYS 54 HG2 LYS 54 15.724 -10.531 13.275 481 2HG LYS 54 HG1 LYS 54 17.030 -11.703 13.128 482 1HD LYS 54 HD2 LYS 54 16.621 -9.558 11.065 483 2HD LYS 54 HD1 LYS 54 17.517 -9.240 12.549 484 1HE LYS 54 HE2 LYS 54 18.167 -11.473 10.617 485 2HE LYS 54 HE1 LYS 54 18.956 -9.896 10.619 486 1HZ LYS 54 HZ2 LYS 54 18.938 -11.638 13.048 487 2HZ LYS 54 HZ1 LYS 54 20.142 -11.714 11.856 488 3HZ LYS 54 HZ3 LYS 54 19.888 -10.299 12.709 489 H LEU 55 HN LEU 55 14.817 -15.066 13.853 490 HA LEU 55 HA LEU 55 13.852 -13.382 16.028 491 1HB LEU 55 HB2 LEU 55 14.075 -16.404 15.832 492 2HB LEU 55 HB1 LEU 55 13.416 -15.526 17.192 493 HG LEU 55 HG LEU 55 12.206 -15.689 14.430 494 1HD1 LEU 55 HD1 LEU 55 11.342 -16.840 17.067 495 2HD1 LEU 55 HD1 LEU 55 10.422 -16.917 15.563 496 3HD1 LEU 55 HD1 LEU 55 11.979 -17.741 15.691 497 1HD2 LEU 55 HD2 LEU 55 11.210 -14.274 16.910 498 2HD2 LEU 55 HD2 LEU 55 11.746 -13.508 15.413 499 3HD2 LEU 55 HD2 LEU 55 10.291 -14.498 15.425 500 H GLU 56 HN GLU 56 15.356 -12.650 17.315 501 HA GLU 56 HA GLU 56 18.032 -13.508 16.828 502 1HB GLU 56 HB2 GLU 56 16.891 -11.287 18.481 503 2HB GLU 56 HB1 GLU 56 18.614 -11.658 18.439 504 1HG GLU 56 HG2 GLU 56 16.894 -10.902 16.085 505 2HG GLU 56 HG1 GLU 56 18.098 -9.881 16.876 506 H HIS 57 HN HIS 57 19.368 -14.553 18.043 507 HA HIS 57 HA HIS 57 18.244 -15.997 20.273 508 1HB HIS 57 HB2 HIS 57 20.976 -16.141 18.987 509 2HB HIS 57 HB1 HIS 57 20.420 -17.204 20.268 510 HD1 HIS 57 HD1 HIS 57 19.861 -19.470 19.276 511 HD2 HIS 57 HD2 HIS 57 18.894 -16.359 16.700 512 HE1 HIS 57 HE1 HIS 57 18.880 -20.543 17.226 513 H HIS 58 HN HIS 58 17.987 -14.230 21.552 514 HA HIS 58 HA HIS 58 20.244 -12.635 22.114 515 1HB HIS 58 HB2 HIS 58 18.662 -11.248 23.531 516 2HB HIS 58 HB1 HIS 58 18.254 -11.376 21.826 517 HD1 HIS 58 HD1 HIS 58 16.097 -12.935 21.265 518 HD2 HIS 58 HD2 HIS 58 16.804 -12.115 25.288 519 HE1 HIS 58 HE1 HIS 58 14.001 -13.554 22.487 520 H HIS 59 HN HIS 59 21.606 -13.848 23.090 521 HA HIS 59 HA HIS 59 21.031 -14.690 25.848 522 1HB HIS 59 HB2 HIS 59 23.245 -15.519 23.938 523 2HB HIS 59 HB1 HIS 59 23.184 -15.977 25.635 524 HD1 HIS 59 HD1 HIS 59 22.000 -18.143 26.117 525 HD2 HIS 59 HD2 HIS 59 20.964 -16.531 22.435 526 HE1 HIS 59 HE1 HIS 59 20.476 -19.807 25.040 527 H HIS 60 HN HIS 60 23.418 -14.500 27.060 528 HA HIS 60 HA HIS 60 23.782 -11.677 26.966 529 1HB HIS 60 HB2 HIS 60 24.682 -13.748 28.886 530 2HB HIS 60 HB1 HIS 60 25.617 -12.261 28.779 531 HD1 HIS 60 HD1 HIS 60 24.477 -10.062 29.602 532 HD2 HIS 60 HD2 HIS 60 22.142 -13.494 29.942 533 HE1 HIS 60 HE1 HIS 60 22.570 -9.448 31.109 534 H HIS 61 HN HIS 61 24.624 -11.205 25.127 535 HA HIS 61 HA HIS 61 27.413 -11.965 24.678 536 1HB HIS 61 HB2 HIS 61 25.667 -11.767 22.791 537 2HB HIS 61 HB1 HIS 61 25.716 -10.032 23.060 538 HD1 HIS 61 HD1 HIS 61 26.975 -9.145 21.021 539 HD2 HIS 61 HD2 HIS 61 28.739 -12.528 22.664 540 HE1 HIS 61 HE1 HIS 61 29.074 -9.541 19.721 541 H HIS 62 HN HIS 62 25.267 -9.610 25.854 542 HA HIS 62 HA HIS 62 27.384 -8.139 27.142 543 1HB HIS 62 HB2 HIS 62 24.991 -6.915 25.704 544 2HB HIS 62 HB1 HIS 62 25.997 -6.044 26.847 545 HD1 HIS 62 HD1 HIS 62 25.671 -6.759 23.299 546 HD2 HIS 62 HD2 HIS 62 28.753 -5.800 25.910 547 HE1 HIS 62 HE1 HIS 62 27.548 -5.897 21.876 548 H1 MET 101 HT1 MET 101 12.598 22.449 -0.825 549 H2 MET 101 HT3 MET 101 12.037 22.954 0.677 550 H3 MET 101 HT2 MET 101 13.585 22.289 0.545 551 HA MET 101 HA MET 101 12.652 20.218 -0.199 552 1HB MET 101 HB2 MET 101 11.536 19.501 1.931 553 2HB MET 101 HB1 MET 101 13.070 20.311 2.171 554 1HG MET 101 HG2 MET 101 11.811 22.386 2.730 555 2HG MET 101 HG1 MET 101 10.320 21.458 2.619 556 1HE MET 101 HE1 MET 101 9.686 19.464 4.248 557 2HE MET 101 HE3 MET 101 11.199 18.632 3.883 558 3HE MET 101 HE2 MET 101 10.718 18.895 5.560 559 H GLU 102 HN GLU 102 11.434 19.813 -1.768 560 HA GLU 102 HA GLU 102 8.823 21.055 -1.908 561 1HB GLU 102 HB2 GLU 102 10.524 19.711 -4.012 562 2HB GLU 102 HB1 GLU 102 8.923 20.342 -4.308 563 1HG GLU 102 HG2 GLU 102 10.559 21.915 -5.140 564 2HG GLU 102 HG1 GLU 102 9.727 22.624 -3.768 565 H MET 103 HN MET 103 7.037 19.937 -1.806 566 HA MET 103 HA MET 103 7.202 17.283 -0.784 567 1HB MET 103 HB2 MET 103 4.909 19.159 -1.198 568 2HB MET 103 HB1 MET 103 4.672 17.504 -0.643 569 1HG MET 103 HG2 MET 103 6.417 19.531 0.720 570 2HG MET 103 HG1 MET 103 4.761 19.143 1.192 571 1HE MET 103 HE3 MET 103 5.835 18.721 3.659 572 2HE MET 103 HE2 MET 103 7.075 17.506 3.976 573 3HE MET 103 HE1 MET 103 7.474 18.956 3.053 574 H GLY 104 HN GLY 104 6.512 18.636 -3.863 575 1HA GLY 104 HA1 GLY 104 6.093 17.582 -5.900 576 2HA GLY 104 HA2 GLY 104 5.177 16.391 -4.978 577 H GLN 105 HN GLN 105 8.544 17.272 -4.623 578 HA GLN 105 HA GLN 105 9.494 14.920 -5.920 579 1HB GLN 105 HB2 GLN 105 10.847 17.085 -4.368 580 2HB GLN 105 HB1 GLN 105 11.716 15.616 -4.768 581 1HG GLN 105 HG2 GLN 105 12.212 17.327 -6.388 582 2HG GLN 105 HG1 GLN 105 11.302 16.023 -7.137 583 1HE2 GLN 105 1HE2 GLN 105 11.223 19.290 -6.066 584 2HE2 GLN 105 2HE2 GLN 105 9.820 19.784 -6.944 585 H LEU 106 HN LEU 106 8.725 15.811 -2.667 586 HA LEU 106 HA LEU 106 9.882 13.596 -1.380 587 1HB LEU 106 HB2 LEU 106 8.960 15.617 -0.193 588 2HB LEU 106 HB1 LEU 106 7.360 15.108 -0.645 589 HG LEU 106 HG LEU 106 8.051 14.724 1.769 590 1HD1 LEU 106 HD1 LEU 106 7.069 12.351 0.215 591 2HD1 LEU 106 HD1 LEU 106 6.944 12.552 1.962 592 3HD1 LEU 106 HD1 LEU 106 6.102 13.653 0.885 593 1HD2 LEU 106 HD2 LEU 106 10.308 13.878 1.379 594 2HD2 LEU 106 HD2 LEU 106 9.321 12.708 2.264 595 3HD2 LEU 106 HD2 LEU 106 9.622 12.474 0.547 596 H LYS 107 HN LYS 107 6.666 14.096 -2.767 597 HA LYS 107 HA LYS 107 5.755 11.471 -2.259 598 1HB LYS 107 HB2 LYS 107 4.653 13.818 -3.309 599 2HB LYS 107 HB1 LYS 107 4.526 12.647 -4.611 600 1HG LYS 107 HG2 LYS 107 3.575 12.103 -1.812 601 2HG LYS 107 HG1 LYS 107 2.547 12.807 -3.042 602 1HD LYS 107 HD2 LYS 107 3.949 10.153 -3.428 603 2HD LYS 107 HD1 LYS 107 2.350 10.267 -2.681 604 1HE LYS 107 HE2 LYS 107 1.605 11.446 -4.776 605 2HE LYS 107 HE1 LYS 107 3.172 11.041 -5.477 606 1HZ LYS 107 HZ1 LYS 107 1.189 9.052 -4.469 607 2HZ LYS 107 HZ3 LYS 107 1.419 9.439 -6.073 608 3HZ LYS 107 HZ2 LYS 107 2.630 8.657 -5.201 609 H ASN 108 HN ASN 108 7.607 12.892 -4.806 610 HA ASN 108 HA ASN 108 7.426 10.699 -6.595 611 1HB ASN 108 HB2 ASN 108 8.167 13.035 -7.224 612 2HB ASN 108 HB1 ASN 108 9.693 12.697 -6.421 613 1HD2 ASN 108 HD2 ASN 108 11.178 11.369 -7.421 614 2HD2 ASN 108 HD2 ASN 108 10.983 10.825 -9.050 615 H LYS 109 HN LYS 109 9.588 11.467 -3.909 616 HA LYS 109 HA LYS 109 11.354 9.239 -4.251 617 1HB LYS 109 HB2 LYS 109 10.557 10.665 -1.693 618 2HB LYS 109 HB1 LYS 109 11.894 9.548 -1.849 619 1HG LYS 109 HG2 LYS 109 13.045 11.097 -3.312 620 2HG LYS 109 HG1 LYS 109 11.663 12.197 -3.250 621 1HD LYS 109 HD2 LYS 109 11.953 12.383 -0.809 622 2HD LYS 109 HD1 LYS 109 13.374 11.346 -0.913 623 1HE LYS 109 HE2 LYS 109 14.011 13.700 -0.809 624 2HE LYS 109 HE1 LYS 109 14.464 12.995 -2.359 625 1HZ LYS 109 HZ1 LYS 109 12.007 14.583 -1.902 626 2HZ LYS 109 HZ3 LYS 109 13.440 15.204 -2.522 627 3HZ LYS 109 HZ2 LYS 109 12.611 14.039 -3.400 628 H ILE 110 HN ILE 110 8.325 9.788 -2.615 629 HA ILE 110 HA ILE 110 8.040 7.311 -1.353 630 HB ILE 110 HB ILE 110 5.990 9.293 -2.365 631 1HG1 ILE 110 2HG1 ILE 110 7.001 8.623 0.402 632 2HG1 ILE 110 1HG1 ILE 110 7.415 10.044 -0.542 633 1HG2 ILE 110 1HG2 ILE 110 4.923 7.100 -2.352 634 2HG2 ILE 110 3HG2 ILE 110 5.427 6.865 -0.674 635 3HG2 ILE 110 2HG2 ILE 110 4.277 8.139 -1.080 636 1HD1 ILE 110 HD1 ILE 110 5.081 10.784 -0.410 637 2HD1 ILE 110 HD1 ILE 110 4.706 9.367 0.579 638 3HD1 ILE 110 HD1 ILE 110 5.841 10.594 1.163 639 H GLU 111 HN GLU 111 6.903 8.414 -4.522 640 HA GLU 111 HA GLU 111 5.887 5.996 -5.528 641 1HB GLU 111 HB2 GLU 111 7.361 8.183 -7.021 642 2HB GLU 111 HB1 GLU 111 6.382 6.923 -7.756 643 1HG GLU 111 HG2 GLU 111 5.373 9.007 -5.847 644 2HG GLU 111 HG1 GLU 111 5.216 9.107 -7.592 645 H ASN 112 HN ASN 112 9.093 7.340 -5.731 646 HA ASN 112 HA ASN 112 10.454 5.403 -7.113 647 1HB ASN 112 HB2 ASN 112 11.399 7.569 -6.461 648 2HB ASN 112 HB1 ASN 112 11.412 7.066 -4.779 649 1HD2 ASN 112 HD2 ASN 112 13.010 7.011 -7.735 650 2HD2 ASN 112 HD2 ASN 112 14.403 6.096 -7.240 651 H LYS 113 HN LYS 113 10.036 5.641 -3.600 652 HA LYS 113 HA LYS 113 11.503 3.281 -3.015 653 1HB LYS 113 HB2 LYS 113 10.979 5.405 -1.557 654 2HB LYS 113 HB1 LYS 113 9.530 4.526 -1.131 655 1HG LYS 113 HG2 LYS 113 11.278 4.201 0.552 656 2HG LYS 113 HG1 LYS 113 10.857 2.689 -0.251 657 1HD LYS 113 HD2 LYS 113 13.259 2.896 0.005 658 2HD LYS 113 HD1 LYS 113 12.839 2.890 -1.697 659 1HE LYS 113 HE2 LYS 113 14.489 4.500 -1.419 660 2HE LYS 113 HE1 LYS 113 13.003 5.433 -1.573 661 1HZ LYS 113 HZ3 LYS 113 14.414 4.707 0.912 662 2HZ LYS 113 HZ2 LYS 113 14.459 6.221 0.217 663 3HZ LYS 113 HZ1 LYS 113 13.022 5.657 0.906 664 H LYS 114 HN LYS 114 8.062 4.029 -3.227 665 HA LYS 114 HA LYS 114 6.845 1.675 -2.514 666 1HB LYS 114 HB2 LYS 114 5.764 3.834 -3.099 667 2HB LYS 114 HB1 LYS 114 6.205 3.574 -4.772 668 1HG LYS 114 HG2 LYS 114 4.745 1.566 -4.785 669 2HG LYS 114 HG1 LYS 114 4.252 1.967 -3.139 670 1HD LYS 114 HD2 LYS 114 2.566 2.861 -4.589 671 2HD LYS 114 HD1 LYS 114 3.529 4.225 -4.017 672 1HE LYS 114 HE2 LYS 114 4.838 4.120 -6.133 673 2HE LYS 114 HE1 LYS 114 3.740 2.835 -6.648 674 1HZ LYS 114 HZ1 LYS 114 1.889 4.484 -6.498 675 2HZ LYS 114 HZ3 LYS 114 3.030 5.686 -6.121 676 3HZ LYS 114 HZ2 LYS 114 3.082 4.898 -7.588 677 H LYS 115 HN LYS 115 8.058 2.756 -5.649 678 HA LYS 115 HA LYS 115 7.470 0.395 -7.042 679 1HB LYS 115 HB2 LYS 115 9.281 2.702 -7.666 680 2HB LYS 115 HB1 LYS 115 9.038 1.379 -8.797 681 1HG LYS 115 HG2 LYS 115 6.657 1.875 -8.897 682 2HG LYS 115 HG1 LYS 115 6.848 3.115 -7.666 683 1HD LYS 115 HD2 LYS 115 6.716 4.306 -9.687 684 2HD LYS 115 HD1 LYS 115 8.411 4.273 -9.288 685 1HE LYS 115 HE2 LYS 115 7.157 2.315 -11.225 686 2HE LYS 115 HE1 LYS 115 7.853 3.849 -11.725 687 1HZ LYS 115 HZ1 LYS 115 9.990 3.073 -10.809 688 2HZ LYS 115 HZ3 LYS 115 9.293 1.554 -10.487 689 3HZ LYS 115 HZ2 LYS 115 9.410 2.117 -12.056 690 H GLU 116 HN GLU 116 10.403 1.406 -5.343 691 HA GLU 116 HA GLU 116 11.998 -0.791 -6.189 692 1HB GLU 116 HB2 GLU 116 12.126 0.789 -3.609 693 2HB GLU 116 HB1 GLU 116 13.305 -0.429 -4.032 694 1HG GLU 116 HG2 GLU 116 13.720 1.017 -6.116 695 2HG GLU 116 HG1 GLU 116 12.817 2.262 -5.250 696 H LEU 117 HN LEU 117 9.615 -0.436 -3.718 697 HA LEU 117 HA LEU 117 10.117 -2.953 -2.503 698 1HB LEU 117 HB2 LEU 117 9.266 -1.307 -1.074 699 2HB LEU 117 HB1 LEU 117 8.026 -0.832 -2.200 700 HG LEU 117 HG LEU 117 7.209 -1.977 -0.112 701 1HD1 LEU 117 HD1 LEU 117 5.833 -1.680 -1.894 702 2HD1 LEU 117 HD1 LEU 117 6.375 -3.184 -2.637 703 3HD1 LEU 117 HD1 LEU 117 5.518 -3.220 -1.078 704 1HD2 LEU 117 HD2 LEU 117 8.419 -4.414 -1.365 705 2HD2 LEU 117 HD2 LEU 117 8.929 -3.655 0.147 706 3HD2 LEU 117 HD2 LEU 117 7.322 -4.383 0.019 707 H ILE 118 HN ILE 118 7.718 -1.754 -4.803 708 HA ILE 118 HA ILE 118 6.155 -4.022 -4.841 709 HB ILE 118 HB ILE 118 6.715 -2.217 -7.229 710 1HG1 ILE 118 2HG1 ILE 118 4.382 -2.137 -5.313 711 2HG1 ILE 118 1HG1 ILE 118 5.818 -1.140 -5.111 712 1HG2 ILE 118 2HG2 ILE 118 4.464 -4.176 -6.691 713 2HG2 ILE 118 1HG2 ILE 118 4.505 -3.045 -8.055 714 3HG2 ILE 118 3HG2 ILE 118 5.705 -4.329 -7.914 715 1HD1 ILE 118 HD1 ILE 118 3.990 -1.082 -7.502 716 2HD1 ILE 118 HD1 ILE 118 3.979 0.070 -6.157 717 3HD1 ILE 118 HD1 ILE 118 5.387 -0.046 -7.207 718 H GLN 119 HN GLN 119 9.015 -3.192 -6.698 719 HA GLN 119 HA GLN 119 9.319 -5.434 -8.308 720 1HB GLN 119 HB2 GLN 119 11.372 -3.749 -6.916 721 2HB GLN 119 HB1 GLN 119 11.763 -4.940 -8.148 722 1HG GLN 119 HG2 GLN 119 10.522 -3.671 -9.787 723 2HG GLN 119 HG1 GLN 119 10.009 -2.532 -8.539 724 1HE2 GLN 119 1HE2 GLN 119 10.962 -0.836 -9.613 725 2HE2 GLN 119 2HE2 GLN 119 12.675 -0.598 -9.675 726 H LEU 120 HN LEU 120 10.227 -4.915 -4.934 727 HA LEU 120 HA LEU 120 11.658 -7.326 -4.622 728 1HB LEU 120 HB2 LEU 120 10.412 -5.496 -2.582 729 2HB LEU 120 HB1 LEU 120 11.356 -6.916 -2.172 730 HG LEU 120 HG LEU 120 12.424 -4.562 -3.731 731 1HD1 LEU 120 HD1 LEU 120 11.859 -3.946 -1.435 732 2HD1 LEU 120 HD1 LEU 120 12.787 -5.322 -0.837 733 3HD1 LEU 120 HD1 LEU 120 13.603 -4.003 -1.679 734 1HD2 LEU 120 HD2 LEU 120 13.776 -6.951 -2.479 735 2HD2 LEU 120 HD2 LEU 120 13.580 -6.659 -4.206 736 3HD2 LEU 120 HD2 LEU 120 14.595 -5.589 -3.241 737 H VAL 121 HN VAL 121 8.261 -6.495 -3.514 738 HA VAL 121 HA VAL 121 7.767 -9.094 -2.718 739 HB VAL 121 HB VAL 121 5.549 -8.526 -2.560 740 1HG1 VAL 121 3HG1 VAL 121 6.807 -7.262 -1.034 741 2HG1 VAL 121 2HG1 VAL 121 7.031 -5.984 -2.238 742 3HG1 VAL 121 1HG1 VAL 121 5.425 -6.306 -1.584 743 1HG2 VAL 121 1HG2 VAL 121 5.089 -7.915 -4.794 744 2HG2 VAL 121 3HG2 VAL 121 4.391 -6.716 -3.703 745 3HG2 VAL 121 2HG2 VAL 121 5.890 -6.347 -4.594 746 H ALA 122 HN ALA 122 7.660 -7.618 -5.882 747 HA ALA 122 HA ALA 122 6.130 -9.592 -7.157 748 1HB ALA 122 HB1 ALA 122 8.113 -7.693 -8.379 749 2HB ALA 122 HB3 ALA 122 6.806 -8.532 -9.234 750 3HB ALA 122 HB2 ALA 122 6.437 -7.320 -8.004 751 H ARG 123 HN ARG 123 9.607 -9.087 -6.876 752 HA ARG 123 HA ARG 123 10.233 -11.361 -8.474 753 1HB ARG 123 HB2 ARG 123 12.544 -10.990 -7.864 754 2HB ARG 123 HB1 ARG 123 11.783 -9.477 -8.308 755 1HG ARG 123 HG2 ARG 123 11.597 -8.844 -5.988 756 2HG ARG 123 HG1 ARG 123 12.261 -10.391 -5.473 757 1HD ARG 123 HD2 ARG 123 13.682 -8.296 -7.120 758 2HD ARG 123 HD1 ARG 123 13.983 -8.666 -5.420 759 HE ARG 123 HE ARG 123 14.270 -10.895 -7.233 760 1HH1 ARG 123 1HH1 ARG 123 15.989 -8.230 -5.678 761 2HH1 ARG 123 2HH1 ARG 123 17.516 -8.964 -5.805 762 1HH2 ARG 123 1HH2 ARG 123 16.294 -11.864 -7.463 763 2HH2 ARG 123 2HH2 ARG 123 17.719 -11.119 -6.875 764 H HIS 124 HN HIS 124 9.097 -11.116 -5.378 765 HA HIS 124 HA HIS 124 10.428 -13.385 -4.261 766 1HB HIS 124 HB2 HIS 124 9.418 -11.664 -2.835 767 2HB HIS 124 HB1 HIS 124 7.820 -12.042 -3.450 768 HD1 HIS 124 HD1 HIS 124 10.579 -13.521 -1.226 769 HD2 HIS 124 HD2 HIS 124 6.608 -14.146 -2.206 770 HE1 HIS 124 HE1 HIS 124 9.720 -15.198 0.431 771 H GLY 125 HN GLY 125 7.856 -12.881 -6.434 772 1HA GLY 125 HA1 GLY 125 7.016 -15.677 -6.167 773 2HA GLY 125 HA2 GLY 125 7.627 -15.100 -7.708 774 H LEU 126 HN LEU 126 6.346 -12.475 -7.628 775 HA LEU 126 HA LEU 126 3.572 -13.343 -7.705 776 1HB LEU 126 HB2 LEU 126 4.652 -10.551 -7.934 777 2HB LEU 126 HB1 LEU 126 2.970 -10.958 -7.985 778 HG LEU 126 HG LEU 126 4.830 -11.218 -5.802 779 1HD1 LEU 126 HD1 LEU 126 3.971 -8.992 -6.098 780 2HD1 LEU 126 HD1 LEU 126 2.310 -9.592 -6.033 781 3HD1 LEU 126 HD1 LEU 126 3.340 -9.679 -4.601 782 1HD2 LEU 126 HD2 LEU 126 2.033 -12.292 -5.885 783 2HD2 LEU 126 HD2 LEU 126 3.544 -13.162 -5.597 784 3HD2 LEU 126 HD2 LEU 126 2.937 -12.044 -4.388 785 H ASP 127 HN ASP 127 2.484 -13.445 -9.328 786 HA ASP 127 HA ASP 127 3.521 -13.438 -12.009 787 1HB ASP 127 HB2 ASP 127 1.629 -14.906 -11.341 788 2HB ASP 127 HB1 ASP 127 0.666 -13.489 -10.967 789 H HIS 128 HN HIS 128 2.667 -11.960 -13.678 790 HA HIS 128 HA HIS 128 2.981 -9.270 -13.168 791 1HB HIS 128 HB2 HIS 128 1.238 -10.496 -15.321 792 2HB HIS 128 HB1 HIS 128 1.830 -8.842 -15.306 793 HD1 HIS 128 HD1 HIS 128 2.555 -11.935 -16.879 794 HD2 HIS 128 HD2 HIS 128 4.878 -8.939 -15.175 795 HE1 HIS 128 HE1 HIS 128 4.856 -12.231 -17.812 796 H ASP 129 HN ASP 129 0.061 -11.234 -12.972 797 HA ASP 129 HA ASP 129 -1.886 -9.235 -12.690 798 1HB ASP 129 HB2 ASP 129 -2.597 -11.456 -13.140 799 2HB ASP 129 HB1 ASP 129 -1.682 -12.098 -11.790 800 H LYS 130 HN LYS 130 0.002 -10.976 -10.367 801 HA LYS 130 HA LYS 130 -1.218 -9.874 -8.064 802 1HB LYS 130 HB2 LYS 130 1.311 -11.329 -8.584 803 2HB LYS 130 HB1 LYS 130 0.939 -10.895 -6.935 804 1HG LYS 130 HG2 LYS 130 -0.536 -12.731 -8.846 805 2HG LYS 130 HG1 LYS 130 0.298 -13.181 -7.358 806 1HD LYS 130 HD2 LYS 130 -1.379 -12.084 -6.020 807 2HD LYS 130 HD1 LYS 130 -2.155 -11.410 -7.450 808 1HE LYS 130 HE2 LYS 130 -1.946 -14.334 -6.785 809 2HE LYS 130 HE1 LYS 130 -3.374 -13.325 -6.591 810 1HZ LYS 130 HZ2 LYS 130 -3.237 -12.906 -9.058 811 2HZ LYS 130 HZ1 LYS 130 -2.052 -14.065 -9.155 812 3HZ LYS 130 HZ3 LYS 130 -3.593 -14.501 -8.646 813 H VAL 131 HN VAL 131 1.644 -9.045 -9.888 814 HA VAL 131 HA VAL 131 2.542 -6.979 -8.216 815 HB VAL 131 HB VAL 131 2.823 -7.074 -11.226 816 1HG1 VAL 131 2HG1 VAL 131 4.593 -5.883 -9.119 817 2HG1 VAL 131 1HG1 VAL 131 4.942 -5.946 -10.848 818 3HG1 VAL 131 3HG1 VAL 131 3.572 -5.005 -10.258 819 1HG2 VAL 131 2HG2 VAL 131 4.451 -8.507 -9.145 820 2HG2 VAL 131 1HG2 VAL 131 3.396 -9.229 -10.352 821 3HG2 VAL 131 3HG2 VAL 131 4.866 -8.390 -10.866 822 H LEU 132 HN LEU 132 0.290 -7.012 -10.973 823 HA LEU 132 HA LEU 132 -0.189 -4.229 -11.120 824 1HB LEU 132 HB2 LEU 132 -2.014 -6.502 -11.864 825 2HB LEU 132 HB1 LEU 132 -2.223 -4.829 -12.340 826 HG LEU 132 HG LEU 132 0.005 -6.669 -13.179 827 1HD1 LEU 132 HD1 LEU 132 -2.294 -5.499 -14.697 828 2HD1 LEU 132 HD1 LEU 132 -0.974 -6.452 -15.395 829 3HD1 LEU 132 HD1 LEU 132 -2.070 -7.188 -14.221 830 1HD2 LEU 132 HD2 LEU 132 -0.497 -3.778 -13.873 831 2HD2 LEU 132 HD2 LEU 132 0.863 -4.448 -12.960 832 3HD2 LEU 132 HD2 LEU 132 0.681 -4.826 -14.673 833 H LEU 133 HN LEU 133 -1.998 -6.796 -9.516 834 HA LEU 133 HA LEU 133 -3.977 -5.110 -8.450 835 1HB LEU 133 HB2 LEU 133 -2.969 -7.750 -7.479 836 2HB LEU 133 HB1 LEU 133 -4.430 -6.946 -6.920 837 HG LEU 133 HG LEU 133 -3.958 -7.878 -9.759 838 1HD1 LEU 133 HD1 LEU 133 -5.497 -9.181 -7.516 839 2HD1 LEU 133 HD1 LEU 133 -5.549 -9.665 -9.217 840 3HD1 LEU 133 HD1 LEU 133 -4.043 -9.783 -8.322 841 1HD2 LEU 133 HD2 LEU 133 -6.420 -6.860 -8.341 842 2HD2 LEU 133 HD2 LEU 133 -5.535 -6.039 -9.628 843 3HD2 LEU 133 HD2 LEU 133 -6.393 -7.543 -9.962 844 H PHE 134 HN PHE 134 -0.924 -6.292 -7.101 845 HA PHE 134 HA PHE 134 -1.269 -5.182 -4.557 846 1HB PHE 134 HB2 PHE 134 0.392 -6.891 -4.933 847 2HB PHE 134 HB1 PHE 134 1.264 -5.858 -6.063 848 HD1 PHE 134 HD1 PHE 134 0.223 -6.151 -2.520 849 HD2 PHE 134 HD2 PHE 134 2.937 -4.427 -5.301 850 HE1 PHE 134 HE1 PHE 134 1.573 -5.267 -0.664 851 HE2 PHE 134 HE2 PHE 134 4.289 -3.547 -3.428 852 HZ PHE 134 HZ PHE 134 3.605 -3.962 -1.142 853 H SER 135 HN SER 135 0.447 -3.898 -7.411 854 HA SER 135 HA SER 135 1.372 -1.585 -6.162 855 1HB SER 135 HB2 SER 135 1.656 -0.713 -8.506 856 2HB SER 135 HB1 SER 135 2.378 -2.296 -8.210 857 HG SER 135 HG SER 135 0.891 -3.245 -9.380 858 H ARG 136 HN ARG 136 -1.630 -2.172 -7.915 859 HA ARG 136 HA ARG 136 -2.398 0.549 -7.891 860 1HB ARG 136 HB2 ARG 136 -4.582 -0.174 -8.661 861 2HB ARG 136 HB1 ARG 136 -3.316 -1.012 -9.539 862 1HG ARG 136 HG2 ARG 136 -3.677 -2.951 -7.996 863 2HG ARG 136 HG1 ARG 136 -5.084 -2.098 -7.369 864 1HD ARG 136 HD2 ARG 136 -4.610 -2.991 -10.199 865 2HD ARG 136 HD1 ARG 136 -5.768 -3.672 -9.061 866 HE ARG 136 HE ARG 136 -5.947 -0.888 -9.995 867 1HH1 ARG 136 1HH1 ARG 136 -7.544 -3.999 -9.393 868 2HH1 ARG 136 2HH1 ARG 136 -9.044 -3.490 -10.010 869 1HH2 ARG 136 1HH2 ARG 136 -8.006 -0.196 -10.770 870 2HH2 ARG 136 2HH2 ARG 136 -9.316 -1.282 -10.803 871 H ASP 137 HN ASP 137 -3.069 -2.119 -5.650 872 HA ASP 137 HA ASP 137 -4.897 -0.564 -4.090 873 1HB ASP 137 HB2 ASP 137 -4.776 -3.112 -4.115 874 2HB ASP 137 HB1 ASP 137 -3.336 -2.964 -3.117 875 H LEU 138 HN LEU 138 -1.501 -1.410 -3.846 876 HA LEU 138 HA LEU 138 -0.820 -0.160 -1.453 877 1HB LEU 138 HB2 LEU 138 0.736 -1.619 -2.472 878 2HB LEU 138 HB1 LEU 138 0.702 -0.731 -3.976 879 HG LEU 138 HG LEU 138 1.976 1.090 -2.951 880 1HD1 LEU 138 HD1 LEU 138 1.195 0.877 -0.664 881 2HD1 LEU 138 HD1 LEU 138 2.072 -0.656 -0.517 882 3HD1 LEU 138 HD1 LEU 138 2.958 0.856 -0.776 883 1HD2 LEU 138 HD2 LEU 138 3.178 -1.631 -2.566 884 2HD2 LEU 138 HD2 LEU 138 3.158 -0.691 -4.056 885 3HD2 LEU 138 HD2 LEU 138 4.082 -0.122 -2.665 886 H ASP 139 HN ASP 139 -0.855 1.119 -4.726 887 HA ASP 139 HA ASP 139 0.122 3.659 -4.109 888 1HB ASP 139 HB2 ASP 139 0.043 2.769 -6.365 889 2HB ASP 139 HB1 ASP 139 -1.711 2.787 -6.331 890 H LYS 140 HN LYS 140 -3.183 2.409 -4.169 891 HA LYS 140 HA LYS 140 -4.312 4.935 -3.505 892 1HB LYS 140 HB2 LYS 140 -5.454 2.159 -3.500 893 2HB LYS 140 HB1 LYS 140 -6.367 3.548 -2.920 894 1HG LYS 140 HG2 LYS 140 -6.126 4.619 -5.107 895 2HG LYS 140 HG1 LYS 140 -5.194 3.231 -5.671 896 1HD LYS 140 HD2 LYS 140 -7.096 1.792 -5.448 897 2HD LYS 140 HD1 LYS 140 -8.034 3.066 -4.674 898 1HE LYS 140 HE2 LYS 140 -8.673 2.790 -7.027 899 2HE LYS 140 HE1 LYS 140 -7.989 4.381 -6.723 900 1HZ LYS 140 HZ1 LYS 140 -6.540 2.087 -7.944 901 2HZ LYS 140 HZ3 LYS 140 -7.189 3.390 -8.778 902 3HZ LYS 140 HZ2 LYS 140 -5.916 3.659 -7.735 903 H LEU 141 HN LEU 141 -3.095 2.270 -1.666 904 HA LEU 141 HA LEU 141 -4.107 2.943 0.882 905 1HB LEU 141 HB2 LEU 141 -2.818 0.823 0.114 906 2HB LEU 141 HB1 LEU 141 -1.376 1.777 0.304 907 HG LEU 141 HG LEU 141 -3.251 1.085 2.587 908 1HD1 LEU 141 HD1 LEU 141 -2.232 -0.890 1.711 909 2HD1 LEU 141 HD1 LEU 141 -0.639 -0.108 1.844 910 3HD1 LEU 141 HD1 LEU 141 -1.590 -0.414 3.295 911 1HD2 LEU 141 HD2 LEU 141 -1.954 3.097 2.957 912 2HD2 LEU 141 HD2 LEU 141 -1.486 1.763 4.012 913 3HD2 LEU 141 HD2 LEU 141 -0.486 2.185 2.620 914 H ILE 142 HN ILE 142 -1.234 3.867 -0.896 915 HA ILE 142 HA ILE 142 -0.268 5.636 1.070 916 HB ILE 142 HB ILE 142 0.362 5.457 -1.889 917 1HG1 ILE 142 2HG1 ILE 142 1.883 4.627 0.588 918 2HG1 ILE 142 1HG1 ILE 142 1.023 3.546 -0.498 919 1HG2 ILE 142 1HG2 ILE 142 1.731 7.153 0.212 920 2HG2 ILE 142 3HG2 ILE 142 2.294 6.918 -1.445 921 3HG2 ILE 142 2HG2 ILE 142 0.765 7.747 -1.143 922 1HD1 ILE 142 HD1 ILE 142 3.422 5.220 -1.209 923 2HD1 ILE 142 HD1 ILE 142 3.428 3.492 -0.851 924 3HD1 ILE 142 HD1 ILE 142 2.574 4.094 -2.272 925 H ASN 143 HN ASN 143 -2.256 6.203 -1.815 926 HA ASN 143 HA ASN 143 -2.548 9.006 -1.511 927 1HB ASN 143 HB2 ASN 143 -4.371 6.956 -2.759 928 2HB ASN 143 HB1 ASN 143 -4.872 8.631 -2.601 929 1HD2 ASN 143 HD2 ASN 143 -2.739 6.440 -4.266 930 2HD2 ASN 143 HD2 ASN 143 -2.231 7.549 -5.471 931 H LYS 144 HN LYS 144 -4.249 6.398 0.036 932 HA LYS 144 HA LYS 144 -6.272 7.726 1.386 933 1HB LYS 144 HB2 LYS 144 -5.957 5.281 1.351 934 2HB LYS 144 HB1 LYS 144 -4.527 5.446 2.348 935 1HG LYS 144 HG2 LYS 144 -6.059 6.478 4.109 936 2HG LYS 144 HG1 LYS 144 -7.395 5.885 3.122 937 1HD LYS 144 HD2 LYS 144 -5.194 4.197 4.339 938 2HD LYS 144 HD1 LYS 144 -6.852 4.304 4.922 939 1HE LYS 144 HE2 LYS 144 -7.633 3.356 2.794 940 2HE LYS 144 HE1 LYS 144 -5.972 3.236 2.240 941 1HZ LYS 144 HZ3 LYS 144 -6.989 1.833 4.668 942 2HZ LYS 144 HZ2 LYS 144 -6.935 1.130 3.155 943 3HZ LYS 144 HZ1 LYS 144 -5.516 1.539 3.927 944 H PHE 145 HN PHE 145 -2.921 7.164 2.360 945 HA PHE 145 HA PHE 145 -3.308 8.725 4.728 946 1HB PHE 145 HB2 PHE 145 -1.045 7.037 3.777 947 2HB PHE 145 HB1 PHE 145 -0.901 8.113 5.169 948 HD1 PHE 145 HD1 PHE 145 -2.409 5.054 3.894 949 HD2 PHE 145 HD2 PHE 145 -2.217 7.777 7.136 950 HE1 PHE 145 HE1 PHE 145 -3.513 3.405 5.331 951 HE2 PHE 145 HE2 PHE 145 -3.329 6.137 8.590 952 HZ PHE 145 HZ PHE 145 -3.979 3.945 7.681 953 H MET 146 HN MET 146 -2.004 9.273 1.621 954 HA MET 146 HA MET 146 -0.292 11.472 2.216 955 1HB MET 146 HB2 MET 146 -1.952 10.967 -0.268 956 2HB MET 146 HB1 MET 146 -0.767 12.240 -0.122 957 1HG MET 146 HG2 MET 146 -0.081 9.334 0.147 958 2HG MET 146 HG1 MET 146 -0.082 10.136 -1.405 959 1HE MET 146 HE1 MET 146 1.732 9.377 1.841 960 2HE MET 146 HE3 MET 146 3.106 10.477 1.854 961 3HE MET 146 HE2 MET 146 1.531 11.091 2.303 962 H ASN 147 HN ASN 147 -3.651 11.080 2.146 963 HA ASN 147 HA ASN 147 -5.413 12.354 2.630 964 1HB ASN 147 HB2 ASN 147 -4.217 12.989 4.674 965 2HB ASN 147 HB1 ASN 147 -3.310 14.211 3.800 966 1HD2 ASN 147 HD2 ASN 147 -4.231 16.161 3.430 967 2HD2 ASN 147 HD2 ASN 147 -5.720 16.668 4.136 968 H VAL 148 HN VAL 148 -5.697 12.432 0.417 969 HA VAL 148 HA VAL 148 -4.888 14.895 -0.930 970 HB VAL 148 HB VAL 148 -6.414 12.578 -2.057 971 1HG1 VAL 148 1HG1 VAL 148 -4.855 14.780 -3.409 972 2HG1 VAL 148 3HG1 VAL 148 -5.623 13.426 -4.245 973 3HG1 VAL 148 2HG1 VAL 148 -6.611 14.590 -3.362 974 1HG2 VAL 148 3HG2 VAL 148 -4.282 11.744 -1.256 975 2HG2 VAL 148 2HG2 VAL 148 -4.278 11.766 -3.025 976 3HG2 VAL 148 1HG2 VAL 148 -3.440 13.028 -2.115 977 H LYS 149 HN LYS 149 -5.969 16.383 -0.287 978 HA LYS 149 HA LYS 149 -8.824 16.392 -0.828 979 1HB LYS 149 HB2 LYS 149 -7.508 17.462 1.691 980 2HB LYS 149 HB1 LYS 149 -9.173 17.773 1.226 981 1HG LYS 149 HG2 LYS 149 -9.537 15.270 1.263 982 2HG LYS 149 HG1 LYS 149 -7.939 15.129 1.976 983 1HD LYS 149 HD2 LYS 149 -10.272 16.648 3.164 984 2HD LYS 149 HD1 LYS 149 -9.724 15.048 3.665 985 1HE LYS 149 HE2 LYS 149 -7.566 16.018 4.303 986 2HE LYS 149 HE1 LYS 149 -8.152 17.610 3.840 987 1HZ LYS 149 HZ3 LYS 149 -9.898 17.367 5.546 988 2HZ LYS 149 HZ2 LYS 149 -9.258 15.892 6.001 989 3HZ LYS 149 HZ1 LYS 149 -8.359 17.301 6.225 990 H ASP 150 HN ASP 150 -6.646 17.165 -2.299 991 HA ASP 150 HA ASP 150 -5.716 18.686 -3.609 992 1HB ASP 150 HB2 ASP 150 -8.058 19.275 -4.095 993 2HB ASP 150 HB1 ASP 150 -7.994 20.506 -2.834 994 H LYS 151 HN LYS 151 -3.844 19.386 -3.067 995 HA LYS 151 HA LYS 151 -3.681 21.427 -0.945 996 1HB LYS 151 HB2 LYS 151 -1.486 20.472 -0.329 997 2HB LYS 151 HB1 LYS 151 -2.814 19.352 -0.089 998 1HG LYS 151 HG2 LYS 151 -2.206 18.269 -2.247 999 2HG LYS 151 HG1 LYS 151 -0.790 19.324 -2.323 1000 1HD LYS 151 HD2 LYS 151 -0.031 18.418 -0.165 1001 2HD LYS 151 HD1 LYS 151 -1.431 17.357 -0.133 1002 1HE LYS 151 HE2 LYS 151 0.493 16.109 -0.892 1003 2HE LYS 151 HE1 LYS 151 -0.646 16.294 -2.220 1004 1HZ LYS 151 HZ1 LYS 151 1.791 17.918 -1.798 1005 2HZ LYS 151 HZ3 LYS 151 1.644 16.641 -2.874 1006 3HZ LYS 151 HZ2 LYS 151 0.750 18.051 -3.127 1007 H VAL 152 HN VAL 152 -3.788 21.665 -3.929 1008 HA VAL 152 HA VAL 152 -1.137 22.630 -4.531 1009 HB VAL 152 HB VAL 152 -2.013 23.267 -6.762 1010 1HG1 VAL 152 3HG1 VAL 152 -2.600 20.449 -5.902 1011 2HG1 VAL 152 2HG1 VAL 152 -2.372 20.993 -7.565 1012 3HG1 VAL 152 1HG1 VAL 152 -1.037 21.089 -6.415 1013 1HG2 VAL 152 2HG2 VAL 152 -4.339 23.740 -6.160 1014 2HG2 VAL 152 1HG2 VAL 152 -4.257 22.535 -7.445 1015 3HG2 VAL 152 3HG2 VAL 152 -4.599 22.038 -5.788 1016 H HIS 153 HN HIS 153 -0.497 24.667 -4.768 1017 HA HIS 153 HA HIS 153 -2.384 26.697 -3.846 1018 1HB HIS 153 HB2 HIS 153 0.609 26.505 -3.369 1019 2HB HIS 153 HB1 HIS 153 -0.379 27.886 -2.909 1020 HD1 HIS 153 HD1 HIS 153 1.078 25.047 -1.333 1021 HD2 HIS 153 HD2 HIS 153 -2.708 26.781 -1.237 1022 HE1 HIS 153 HE1 HIS 153 -0.028 24.206 0.757 1023 H LYS 154 HN LYS 154 -2.166 28.769 -4.868 1024 HA LYS 154 HA LYS 154 -1.410 28.332 -7.563 1025 1HB LYS 154 HB2 LYS 154 -2.850 30.630 -6.284 1026 2HB LYS 154 HB1 LYS 154 -2.288 30.723 -7.942 1027 1HG LYS 154 HG2 LYS 154 -4.092 28.501 -7.009 1028 2HG LYS 154 HG1 LYS 154 -4.728 30.051 -7.537 1029 1HD LYS 154 HD2 LYS 154 -4.817 28.408 -9.368 1030 2HD LYS 154 HD1 LYS 154 -3.700 29.703 -9.769 1031 1HE LYS 154 HE2 LYS 154 -1.824 28.307 -9.335 1032 2HE LYS 154 HE1 LYS 154 -2.845 27.017 -8.659 1033 1HZ LYS 154 HZ2 LYS 154 -3.745 26.782 -10.918 1034 2HZ LYS 154 HZ1 LYS 154 -2.655 27.946 -11.488 1035 3HZ LYS 154 HZ3 LYS 154 -2.101 26.496 -10.814 1036 H LEU 155 HN LEU 155 0.574 28.192 -7.786 1037 HA LEU 155 HA LEU 155 2.345 30.242 -6.758 1038 1HB LEU 155 HB2 LEU 155 2.955 27.633 -8.121 1039 2HB LEU 155 HB1 LEU 155 4.109 28.691 -7.332 1040 HG LEU 155 HG LEU 155 1.892 27.175 -5.952 1041 1HD1 LEU 155 HD1 LEU 155 3.654 25.730 -6.770 1042 2HD1 LEU 155 HD1 LEU 155 4.853 26.749 -5.973 1043 3HD1 LEU 155 HD1 LEU 155 3.690 25.839 -5.005 1044 1HD2 LEU 155 HD2 LEU 155 4.116 28.863 -4.802 1045 2HD2 LEU 155 HD2 LEU 155 2.400 29.274 -4.814 1046 3HD2 LEU 155 HD2 LEU 155 2.970 27.895 -3.876 1047 H GLU 156 HN GLU 156 2.812 31.829 -8.035 1048 HA GLU 156 HA GLU 156 2.856 31.407 -10.913 1049 1HB GLU 156 HB2 GLU 156 1.342 33.233 -10.191 1050 2HB GLU 156 HB1 GLU 156 2.671 34.006 -9.344 1051 1HG GLU 156 HG2 GLU 156 2.169 35.082 -11.504 1052 2HG GLU 156 HG1 GLU 156 3.810 34.442 -11.430 1053 H HIS 157 HN HIS 157 4.691 31.852 -11.968 1054 HA HIS 157 HA HIS 157 7.060 31.742 -10.223 1055 1HB HIS 157 HB2 HIS 157 6.579 30.596 -12.964 1056 2HB HIS 157 HB1 HIS 157 8.143 30.630 -12.168 1057 HD1 HIS 157 HD1 HIS 157 8.636 28.311 -11.386 1058 HD2 HIS 157 HD2 HIS 157 4.635 29.293 -10.898 1059 HE1 HIS 157 HE1 HIS 157 7.538 26.290 -10.374 1060 H HIS 158 HN HIS 158 8.821 32.956 -10.674 1061 HA HIS 158 HA HIS 158 8.471 35.025 -12.672 1062 1HB HIS 158 HB2 HIS 158 10.514 36.076 -11.665 1063 2HB HIS 158 HB1 HIS 158 9.253 35.835 -10.476 1064 HD1 HIS 158 HD1 HIS 158 9.766 33.983 -8.579 1065 HD2 HIS 158 HD2 HIS 158 12.885 34.784 -11.222 1066 HE1 HIS 158 HE1 HIS 158 11.850 33.043 -7.532 1067 H HIS 159 HN HIS 159 9.432 34.919 -14.561 1068 HA HIS 159 HA HIS 159 10.618 34.193 -16.375 1069 1HB HIS 159 HB2 HIS 159 12.143 32.272 -14.557 1070 2HB HIS 159 HB1 HIS 159 12.537 32.635 -16.227 1071 HD1 HIS 159 HD1 HIS 159 13.059 33.754 -12.773 1072 HD2 HIS 159 HD2 HIS 159 13.709 35.213 -16.597 1073 HE1 HIS 159 HE1 HIS 159 14.650 35.700 -12.512 1074 H HIS 160 HN HIS 160 9.791 31.708 -14.094 1075 HA HIS 160 HA HIS 160 8.496 29.905 -14.115 1076 1HB HIS 160 HB2 HIS 160 6.831 31.314 -15.425 1077 2HB HIS 160 HB1 HIS 160 7.505 30.632 -16.896 1078 HD1 HIS 160 HD1 HIS 160 4.567 30.212 -15.073 1079 HD2 HIS 160 HD2 HIS 160 7.449 27.506 -16.376 1080 HE1 HIS 160 HE1 HIS 160 3.476 27.956 -15.051 1081 H HIS 161 HN HIS 161 10.159 28.621 -13.994 1082 HA HIS 161 HA HIS 161 10.591 26.987 -16.341 1083 1HB HIS 161 HB2 HIS 161 13.016 26.786 -15.829 1084 2HB HIS 161 HB1 HIS 161 12.594 28.445 -16.211 1085 HD1 HIS 161 HD1 HIS 161 13.989 26.302 -13.515 1086 HD2 HIS 161 HD2 HIS 161 12.759 30.237 -14.019 1087 HE1 HIS 161 HE1 HIS 161 14.870 27.575 -11.524 1088 H HIS 162 HN HIS 162 11.274 24.837 -15.712 1089 HA HIS 162 HA HIS 162 10.929 24.146 -12.958 1090 1HB HIS 162 HB2 HIS 162 9.183 22.364 -13.565 1091 2HB HIS 162 HB1 HIS 162 8.616 24.021 -13.515 1092 HD1 HIS 162 HD1 HIS 162 8.798 21.079 -15.743 1093 HD2 HIS 162 HD2 HIS 162 8.158 25.163 -16.116 1094 HE1 HIS 162 HE1 HIS 162 7.752 21.422 -18.012 No H/Q in entry = 1094 Start of MODEL 17 1 H1 MET 1 HT2 MET 1 16.332 -16.661 -4.579 2 H2 MET 1 HT1 MET 1 16.156 -15.131 -3.972 3 H3 MET 1 HT3 MET 1 16.754 -15.340 -5.538 4 HA MET 1 HA MET 1 18.683 -16.487 -4.607 5 1HB MET 1 HB2 MET 1 19.021 -14.100 -4.924 6 2HB MET 1 HB1 MET 1 18.185 -13.727 -3.430 7 1HG MET 1 HG2 MET 1 20.561 -13.456 -3.122 8 2HG MET 1 HG1 MET 1 19.984 -14.806 -2.155 9 1HE MET 1 HE2 MET 1 22.084 -13.620 -5.196 10 2HE MET 1 HE1 MET 1 22.521 -15.130 -5.994 11 3HE MET 1 HE3 MET 1 20.852 -14.566 -6.028 12 H GLU 2 HN GLU 2 17.013 -14.852 -1.870 13 HA GLU 2 HA GLU 2 17.247 -17.267 -0.334 14 1HB GLU 2 HB2 GLU 2 19.498 -15.960 -0.295 15 2HB GLU 2 HB1 GLU 2 18.635 -14.767 0.652 16 1HG GLU 2 HG2 GLU 2 19.030 -17.650 1.412 17 2HG GLU 2 HG1 GLU 2 19.986 -16.297 2.007 18 H MET 3 HN MET 3 15.434 -17.340 0.749 19 HA MET 3 HA MET 3 13.428 -15.416 0.640 20 1HB MET 3 HB2 MET 3 12.198 -16.833 2.273 21 2HB MET 3 HB1 MET 3 12.837 -17.722 0.902 22 1HG MET 3 HG2 MET 3 14.699 -18.512 2.282 23 2HG MET 3 HG1 MET 3 14.061 -17.610 3.649 24 1HE MET 3 HE2 MET 3 14.274 -19.885 5.027 25 2HE MET 3 HE1 MET 3 13.466 -21.387 4.565 26 3HE MET 3 HE3 MET 3 14.793 -20.760 3.588 27 H GLY 4 HN GLY 4 15.771 -15.962 3.221 28 1HA GLY 4 HA1 GLY 4 16.165 -14.790 5.144 29 2HA GLY 4 HA2 GLY 4 14.470 -14.313 5.139 30 H GLN 5 HN GLN 5 17.148 -13.832 2.973 31 HA GLN 5 HA GLN 5 17.598 -11.100 3.433 32 1HB GLN 5 HB2 GLN 5 18.013 -12.664 0.896 33 2HB GLN 5 HB1 GLN 5 18.638 -11.054 1.190 34 1HG GLN 5 HG2 GLN 5 20.017 -11.908 3.007 35 2HG GLN 5 HG1 GLN 5 19.367 -13.528 2.736 36 1HE2 GLN 5 1HE2 GLN 5 21.407 -14.333 2.262 37 2HE2 GLN 5 2HE2 GLN 5 22.178 -14.023 0.751 38 H LEU 6 HN LEU 6 15.566 -12.729 1.067 39 HA LEU 6 HA LEU 6 14.631 -10.519 -0.329 40 1HB LEU 6 HB2 LEU 6 14.409 -12.842 -1.105 41 2HB LEU 6 HB1 LEU 6 13.333 -13.195 0.211 42 HG LEU 6 HG LEU 6 12.342 -12.949 -2.151 43 1HD1 LEU 6 HD1 LEU 6 11.134 -11.403 0.129 44 2HD1 LEU 6 HD1 LEU 6 10.286 -11.905 -1.331 45 3HD1 LEU 6 HD1 LEU 6 10.916 -13.119 -0.228 46 1HD2 LEU 6 HD2 LEU 6 12.675 -10.036 -1.470 47 2HD2 LEU 6 HD2 LEU 6 13.470 -10.901 -2.787 48 3HD2 LEU 6 HD2 LEU 6 11.716 -10.681 -2.800 49 H LYS 7 HN LYS 7 13.162 -12.169 2.493 50 HA LYS 7 HA LYS 7 11.054 -10.342 2.600 51 1HB LYS 7 HB2 LYS 7 11.965 -12.575 4.296 52 2HB LYS 7 HB1 LYS 7 11.063 -11.265 5.072 53 1HG LYS 7 HG2 LYS 7 10.084 -12.641 2.615 54 2HG LYS 7 HG1 LYS 7 9.665 -13.158 4.254 55 1HD LYS 7 HD2 LYS 7 9.353 -10.302 3.493 56 2HD LYS 7 HD1 LYS 7 8.090 -11.449 2.984 57 1HE LYS 7 HE2 LYS 7 7.464 -10.347 5.015 58 2HE LYS 7 HE1 LYS 7 7.860 -12.022 5.431 59 1HZ LYS 7 HZ1 LYS 7 9.579 -9.631 5.829 60 2HZ LYS 7 HZ3 LYS 7 8.651 -10.404 7.002 61 3HZ LYS 7 HZ2 LYS 7 9.923 -11.237 6.344 62 H ASN 8 HN ASN 8 14.177 -10.425 4.066 63 HA ASN 8 HA ASN 8 13.697 -8.407 5.918 64 1HB ASN 8 HB2 ASN 8 15.630 -9.853 6.111 65 2HB ASN 8 HB1 ASN 8 16.241 -9.293 4.566 66 1HD2 ASN 8 HD2 ASN 8 18.192 -8.594 5.373 67 2HD2 ASN 8 HD2 ASN 8 18.374 -7.256 6.443 68 H LYS 9 HN LYS 9 14.857 -8.369 2.572 69 HA LYS 9 HA LYS 9 15.331 -5.631 2.254 70 1HB LYS 9 HB2 LYS 9 14.373 -7.706 0.292 71 2HB LYS 9 HB1 LYS 9 14.694 -6.048 -0.174 72 1HG LYS 9 HG2 LYS 9 17.022 -6.312 0.491 73 2HG LYS 9 HG1 LYS 9 16.680 -7.979 0.975 74 1HD LYS 9 HD2 LYS 9 16.099 -8.577 -1.273 75 2HD LYS 9 HD1 LYS 9 16.235 -6.898 -1.798 76 1HE LYS 9 HE2 LYS 9 18.491 -8.558 -0.704 77 2HE LYS 9 HE1 LYS 9 18.194 -8.265 -2.417 78 1HZ LYS 9 HZ2 LYS 9 18.464 -5.898 -2.002 79 2HZ LYS 9 HZ1 LYS 9 18.831 -6.180 -0.385 80 3HZ LYS 9 HZ3 LYS 9 19.849 -6.757 -1.608 81 H ILE 10 HN ILE 10 12.431 -7.495 1.563 82 HA ILE 10 HA ILE 10 10.674 -5.469 0.913 83 HB ILE 10 HB ILE 10 10.152 -8.076 2.359 84 1HG1 ILE 10 2HG1 ILE 10 9.648 -7.226 -0.476 85 2HG1 ILE 10 1HG1 ILE 10 11.031 -8.196 0.046 86 1HG2 ILE 10 1HG2 ILE 10 8.319 -6.560 2.915 87 2HG2 ILE 10 3HG2 ILE 10 8.079 -6.207 1.202 88 3HG2 ILE 10 2HG2 ILE 10 7.774 -7.830 1.816 89 1HD1 ILE 10 HD1 ILE 10 9.452 -9.952 0.724 90 2HD1 ILE 10 HD1 ILE 10 8.121 -8.951 0.143 91 3HD1 ILE 10 HD1 ILE 10 9.327 -9.553 -0.992 92 H GLU 11 HN GLU 11 11.322 -6.746 4.179 93 HA GLU 11 HA GLU 11 9.574 -5.021 5.521 94 1HB GLU 11 HB2 GLU 11 12.120 -6.306 6.516 95 2HB GLU 11 HB1 GLU 11 10.951 -5.486 7.545 96 1HG GLU 11 HG2 GLU 11 10.447 -7.944 5.886 97 2HG GLU 11 HG1 GLU 11 10.662 -7.890 7.635 98 H ASN 12 HN ASN 12 13.029 -4.720 4.893 99 HA ASN 12 HA ASN 12 13.426 -2.247 6.126 100 1HB ASN 12 HB2 ASN 12 15.321 -3.605 5.527 101 2HB ASN 12 HB1 ASN 12 14.888 -3.544 3.823 102 1HD2 ASN 12 HD2 ASN 12 15.525 -1.797 2.612 103 2HD2 ASN 12 HD2 ASN 12 16.527 -0.535 3.221 104 H LYS 13 HN LYS 13 12.564 -3.008 2.795 105 HA LYS 13 HA LYS 13 12.737 -0.371 1.801 106 1HB LYS 13 HB2 LYS 13 12.676 -2.617 0.540 107 2HB LYS 13 HB1 LYS 13 10.938 -2.504 0.709 108 1HG LYS 13 HG2 LYS 13 11.659 -1.691 -1.482 109 2HG LYS 13 HG1 LYS 13 10.925 -0.408 -0.520 110 1HD LYS 13 HD2 LYS 13 12.975 0.294 -1.717 111 2HD LYS 13 HD1 LYS 13 13.066 0.507 0.021 112 1HE LYS 13 HE2 LYS 13 14.346 -1.494 0.235 113 2HE LYS 13 HE1 LYS 13 14.262 -1.803 -1.513 114 1HZ LYS 13 HZ3 LYS 13 15.496 0.509 -0.144 115 2HZ LYS 13 HZ2 LYS 13 16.343 -0.770 -0.898 116 3HZ LYS 13 HZ1 LYS 13 15.422 0.301 -1.834 117 H LYS 14 HN LYS 14 10.017 -2.332 2.895 118 HA LYS 14 HA LYS 14 7.885 -0.655 2.605 119 1HB LYS 14 HB2 LYS 14 7.897 -3.036 3.317 120 2HB LYS 14 HB1 LYS 14 8.559 -2.537 4.860 121 1HG LYS 14 HG2 LYS 14 6.482 -1.322 5.336 122 2HG LYS 14 HG1 LYS 14 5.842 -1.845 3.772 123 1HD LYS 14 HD2 LYS 14 4.972 -3.356 5.443 124 2HD LYS 14 HD1 LYS 14 6.195 -4.220 4.509 125 1HE LYS 14 HE2 LYS 14 7.843 -3.672 6.310 126 2HE LYS 14 HE1 LYS 14 6.498 -2.988 7.220 127 1HZ LYS 14 HZ2 LYS 14 5.477 -5.343 7.158 128 2HZ LYS 14 HZ1 LYS 14 6.891 -5.845 6.415 129 3HZ LYS 14 HZ3 LYS 14 6.952 -5.237 7.953 130 H LYS 15 HN LYS 15 10.130 -1.066 5.338 131 HA LYS 15 HA LYS 15 9.044 0.972 6.932 132 1HB LYS 15 HB2 LYS 15 11.733 -0.386 7.068 133 2HB LYS 15 HB1 LYS 15 11.130 0.730 8.292 134 1HG LYS 15 HG2 LYS 15 9.302 -0.747 8.827 135 2HG LYS 15 HG1 LYS 15 9.691 -1.787 7.469 136 1HD LYS 15 HD2 LYS 15 10.488 -2.944 9.364 137 2HD LYS 15 HD1 LYS 15 11.919 -2.231 8.644 138 1HE LYS 15 HE2 LYS 15 10.409 -1.050 10.984 139 2HE LYS 15 HE1 LYS 15 11.801 -2.110 11.143 140 1HZ LYS 15 HZ1 LYS 15 13.110 -0.422 9.949 141 2HZ LYS 15 HZ3 LYS 15 11.759 0.594 9.918 142 3HZ LYS 15 HZ2 LYS 15 12.440 0.145 11.380 143 H GLU 16 HN GLU 16 11.648 1.045 4.539 144 HA GLU 16 HA GLU 16 12.554 3.676 5.036 145 1HB GLU 16 HB2 GLU 16 12.412 2.163 2.409 146 2HB GLU 16 HB1 GLU 16 13.230 3.711 2.591 147 1HG GLU 16 HG2 GLU 16 14.690 2.490 4.289 148 2HG GLU 16 HG1 GLU 16 13.954 1.011 3.679 149 H LEU 17 HN LEU 17 9.955 2.413 3.089 150 HA LEU 17 HA LEU 17 9.089 4.864 1.995 151 1HB LEU 17 HB2 LEU 17 8.540 2.917 0.804 152 2HB LEU 17 HB1 LEU 17 7.914 2.115 2.216 153 HG LEU 17 HG LEU 17 6.193 2.738 0.473 154 1HD1 LEU 17 HD1 LEU 17 5.594 2.116 2.590 155 2HD1 LEU 17 HD1 LEU 17 5.696 3.779 3.156 156 3HD1 LEU 17 HD1 LEU 17 4.506 3.343 1.909 157 1HD2 LEU 17 HD2 LEU 17 6.727 5.526 1.433 158 2HD2 LEU 17 HD2 LEU 17 7.081 4.902 -0.181 159 3HD2 LEU 17 HD2 LEU 17 5.407 5.013 0.377 160 H ILE 18 HN ILE 18 8.033 2.992 4.774 161 HA ILE 18 HA ILE 18 5.803 4.500 5.390 162 HB ILE 18 HB ILE 18 7.620 3.066 7.363 163 1HG1 ILE 18 2HG1 ILE 18 5.009 2.112 6.183 164 2HG1 ILE 18 1HG1 ILE 18 6.568 1.742 5.452 165 1HG2 ILE 18 3HG2 ILE 18 4.781 4.065 7.622 166 2HG2 ILE 18 2HG2 ILE 18 5.589 3.038 8.817 167 3HG2 ILE 18 1HG2 ILE 18 6.180 4.671 8.491 168 1HD1 ILE 18 HD1 ILE 18 5.787 1.011 8.261 169 2HD1 ILE 18 HD1 ILE 18 5.671 -0.058 6.867 170 3HD1 ILE 18 HD1 ILE 18 7.246 0.526 7.401 171 H GLN 19 HN GLN 19 9.140 4.926 6.328 172 HA GLN 19 HA GLN 19 8.902 7.176 7.992 173 1HB GLN 19 HB2 GLN 19 11.118 6.272 6.180 174 2HB GLN 19 HB1 GLN 19 11.277 7.613 7.307 175 1HG GLN 19 HG2 GLN 19 10.940 6.126 9.170 176 2HG GLN 19 HG1 GLN 19 10.598 4.786 8.077 177 1HE2 GLN 19 1HE2 GLN 19 12.240 3.819 7.020 178 2HE2 GLN 19 2HE2 GLN 19 13.915 4.040 7.402 179 H LEU 20 HN LEU 20 8.971 6.847 4.516 180 HA LEU 20 HA LEU 20 9.362 9.613 4.021 181 1HB LEU 20 HB2 LEU 20 8.505 7.397 2.165 182 2HB LEU 20 HB1 LEU 20 8.821 9.051 1.675 183 HG LEU 20 HG LEU 20 10.871 7.198 2.877 184 1HD1 LEU 20 HD1 LEU 20 10.203 6.494 0.643 185 2HD1 LEU 20 HD1 LEU 20 10.485 8.126 0.037 186 3HD1 LEU 20 HD1 LEU 20 11.834 7.164 0.638 187 1HD2 LEU 20 HD2 LEU 20 11.112 9.972 1.707 188 2HD2 LEU 20 HD2 LEU 20 11.342 9.520 3.398 189 3HD2 LEU 20 HD2 LEU 20 12.462 8.937 2.175 190 H VAL 21 HN VAL 21 6.360 7.473 3.683 191 HA VAL 21 HA VAL 21 4.749 9.661 3.188 192 HB VAL 21 HB VAL 21 2.918 8.340 3.699 193 1HG1 VAL 21 2HG1 VAL 21 5.045 6.635 2.576 194 2HG1 VAL 21 1HG1 VAL 21 3.306 6.269 2.500 195 3HG1 VAL 21 3HG1 VAL 21 3.931 7.727 1.711 196 1HG2 VAL 21 3HG2 VAL 21 3.486 7.547 5.829 197 2HG2 VAL 21 2HG2 VAL 21 2.957 6.202 4.802 198 3HG2 VAL 21 1HG2 VAL 21 4.691 6.433 5.160 199 H ALA 22 HN ALA 22 6.006 8.430 6.182 200 HA ALA 22 HA ALA 22 4.312 9.749 7.952 201 1HB ALA 22 HB1 ALA 22 7.206 9.032 8.306 202 2HB ALA 22 HB3 ALA 22 6.026 9.314 9.609 203 3HB ALA 22 HB2 ALA 22 5.839 7.945 8.497 204 H ARG 23 HN ARG 23 7.459 10.721 6.601 205 HA ARG 23 HA ARG 23 7.412 13.245 7.866 206 1HB ARG 23 HB2 ARG 23 9.354 13.835 6.513 207 2HB ARG 23 HB1 ARG 23 9.541 12.249 7.235 208 1HG ARG 23 HG2 ARG 23 8.890 11.244 5.087 209 2HG ARG 23 HG1 ARG 23 8.825 12.863 4.386 210 1HD ARG 23 HD2 ARG 23 10.958 11.822 3.874 211 2HD ARG 23 HD1 ARG 23 11.187 13.197 4.947 212 HE ARG 23 HE ARG 23 10.931 10.901 6.509 213 1HH1 ARG 23 1HH1 ARG 23 13.199 12.310 4.176 214 2HH1 ARG 23 2HH1 ARG 23 14.581 11.599 4.832 215 1HH2 ARG 23 1HH2 ARG 23 12.868 9.874 7.444 216 2HH2 ARG 23 2HH2 ARG 23 14.390 10.166 6.750 217 H HIS 24 HN HIS 24 5.926 12.086 5.030 218 HA HIS 24 HA HIS 24 5.473 14.419 3.556 219 1HB HIS 24 HB2 HIS 24 4.707 12.165 2.805 220 2HB HIS 24 HB1 HIS 24 3.506 12.151 4.085 221 HD1 HIS 24 HD1 HIS 24 1.277 13.504 3.628 222 HD2 HIS 24 HD2 HIS 24 4.123 13.796 0.617 223 HE1 HIS 24 HE1 HIS 24 0.125 14.560 1.675 224 H GLY 25 HN GLY 25 3.858 13.146 6.409 225 1HA GLY 25 HA1 GLY 25 2.260 15.582 6.598 226 2HA GLY 25 HA2 GLY 25 3.411 15.252 7.885 227 H LEU 26 HN LEU 26 3.128 12.501 8.212 228 HA LEU 26 HA LEU 26 0.283 12.175 8.700 229 1HB LEU 26 HB2 LEU 26 2.573 10.266 8.827 230 2HB LEU 26 HB1 LEU 26 1.034 9.861 9.521 231 HG LEU 26 HG LEU 26 1.732 10.336 6.690 232 1HD1 LEU 26 HD1 LEU 26 0.590 7.940 8.058 233 2HD1 LEU 26 HD1 LEU 26 0.797 8.125 6.318 234 3HD1 LEU 26 HD1 LEU 26 2.212 8.135 7.380 235 1HD2 LEU 26 HD2 LEU 26 -1.011 10.158 7.856 236 2HD2 LEU 26 HD2 LEU 26 -0.310 11.470 6.919 237 3HD2 LEU 26 HD2 LEU 26 -0.656 9.929 6.140 238 H ASP 27 HN ASP 27 -0.572 11.662 10.592 239 HA ASP 27 HA ASP 27 0.574 12.726 13.006 240 1HB ASP 27 HB2 ASP 27 -1.683 10.684 12.851 241 2HB ASP 27 HB1 ASP 27 -1.373 11.856 14.109 242 H HIS 28 HN HIS 28 1.187 11.256 14.841 243 HA HIS 28 HA HIS 28 2.905 9.193 14.032 244 1HB HIS 28 HB2 HIS 28 3.086 10.418 16.216 245 2HB HIS 28 HB1 HIS 28 1.673 9.537 16.784 246 HD1 HIS 28 HD1 HIS 28 2.121 7.289 17.865 247 HD2 HIS 28 HD2 HIS 28 5.380 8.717 15.733 248 HE1 HIS 28 HE1 HIS 28 4.006 5.690 18.323 249 H ASP 29 HN ASP 29 -0.400 9.129 15.168 250 HA ASP 29 HA ASP 29 -0.756 6.334 15.308 251 1HB ASP 29 HB2 ASP 29 -2.743 8.564 14.871 252 2HB ASP 29 HB1 ASP 29 -3.224 6.878 14.962 253 H LYS 30 HN LYS 30 -0.943 8.581 12.653 254 HA LYS 30 HA LYS 30 -2.245 6.908 10.766 255 1HB LYS 30 HB2 LYS 30 -0.402 9.231 10.485 256 2HB LYS 30 HB1 LYS 30 -1.083 8.530 9.056 257 1HG LYS 30 HG2 LYS 30 -2.594 9.713 11.379 258 2HG LYS 30 HG1 LYS 30 -2.254 10.528 9.855 259 1HD LYS 30 HD2 LYS 30 -3.630 8.906 8.682 260 2HD LYS 30 HD1 LYS 30 -3.917 8.034 10.188 261 1HE LYS 30 HE2 LYS 30 -5.780 9.554 9.556 262 2HE LYS 30 HE1 LYS 30 -5.083 9.899 11.136 263 1HZ LYS 30 HZ1 LYS 30 -4.444 11.371 8.636 264 2HZ LYS 30 HZ3 LYS 30 -5.486 11.913 9.843 265 3HZ LYS 30 HZ2 LYS 30 -3.860 11.741 10.192 266 H VAL 31 HN VAL 31 1.139 7.567 11.448 267 HA VAL 31 HA VAL 31 2.315 6.006 9.465 268 HB VAL 31 HB VAL 31 3.375 6.442 12.281 269 1HG1 VAL 31 3HG1 VAL 31 4.637 4.791 11.053 270 2HG1 VAL 31 2HG1 VAL 31 4.830 5.917 9.709 271 3HG1 VAL 31 1HG1 VAL 31 5.579 6.267 11.267 272 1HG2 VAL 31 3HG2 VAL 31 3.658 8.211 9.860 273 2HG2 VAL 31 2HG2 VAL 31 2.739 8.577 11.322 274 3HG2 VAL 31 1HG2 VAL 31 4.496 8.434 11.396 275 H LEU 32 HN LEU 32 1.250 5.187 12.703 276 HA LEU 32 HA LEU 32 2.078 2.458 12.733 277 1HB LEU 32 HB2 LEU 32 -0.128 3.778 14.295 278 2HB LEU 32 HB1 LEU 32 0.678 2.269 14.681 279 HG LEU 32 HG LEU 32 1.927 5.012 14.724 280 1HD1 LEU 32 HD1 LEU 32 0.397 4.635 16.538 281 2HD1 LEU 32 HD1 LEU 32 1.221 3.122 16.929 282 3HD1 LEU 32 HD1 LEU 32 2.067 4.660 17.120 283 1HD2 LEU 32 HD2 LEU 32 3.121 2.327 15.413 284 2HD2 LEU 32 HD2 LEU 32 3.567 3.362 14.050 285 3HD2 LEU 32 HD2 LEU 32 3.879 3.899 15.698 286 H LEU 33 HN LEU 33 -1.108 3.924 12.168 287 HA LEU 33 HA LEU 33 -2.405 1.486 11.642 288 1HB LEU 33 HB2 LEU 33 -3.072 4.236 10.624 289 2HB LEU 33 HB1 LEU 33 -4.125 2.838 10.548 290 HG LEU 33 HG LEU 33 -3.141 4.105 13.109 291 1HD1 LEU 33 HD1 LEU 33 -4.629 5.593 11.906 292 2HD1 LEU 33 HD1 LEU 33 -5.815 4.293 11.755 293 3HD1 LEU 33 HD1 LEU 33 -5.401 4.938 13.347 294 1HD2 LEU 33 HD2 LEU 33 -5.206 1.973 12.589 295 2HD2 LEU 33 HD2 LEU 33 -3.637 1.735 13.368 296 3HD2 LEU 33 HD2 LEU 33 -4.873 2.719 14.153 297 H PHE 34 HN PHE 34 -0.807 3.762 9.504 298 HA PHE 34 HA PHE 34 -1.456 2.586 7.064 299 1HB PHE 34 HB2 PHE 34 -0.576 4.815 7.124 300 2HB PHE 34 HB1 PHE 34 0.888 4.281 7.932 301 HD1 PHE 34 HD1 PHE 34 2.767 3.743 6.708 302 HD2 PHE 34 HD2 PHE 34 -1.012 3.952 4.765 303 HE1 PHE 34 HE1 PHE 34 3.868 3.434 4.512 304 HE2 PHE 34 HE2 PHE 34 0.090 3.652 2.599 305 HZ PHE 34 HZ PHE 34 2.561 3.359 2.513 306 H SER 35 HN SER 35 1.431 2.138 9.108 307 HA SER 35 HA SER 35 2.691 0.376 7.357 308 1HB SER 35 HB2 SER 35 4.086 -0.234 9.389 309 2HB SER 35 HB1 SER 35 4.010 1.476 8.961 310 HG SER 35 HG SER 35 2.743 1.886 10.630 311 H ARG 36 HN ARG 36 0.546 -0.256 10.043 312 HA ARG 36 HA ARG 36 0.752 -3.066 10.100 313 1HB ARG 36 HB2 ARG 36 -1.582 -1.301 10.805 314 2HB ARG 36 HB1 ARG 36 -1.428 -2.998 11.267 315 1HG ARG 36 HG2 ARG 36 0.537 -2.419 12.600 316 2HG ARG 36 HG1 ARG 36 0.353 -0.737 12.069 317 1HD ARG 36 HD2 ARG 36 -0.584 -0.993 14.271 318 2HD ARG 36 HD1 ARG 36 -1.852 -0.637 13.108 319 HE ARG 36 HE ARG 36 -1.282 -3.323 14.168 320 1HH1 ARG 36 1HH1 ARG 36 -3.624 -0.988 12.823 321 2HH1 ARG 36 2HH1 ARG 36 -4.980 -1.870 13.273 322 1HH2 ARG 36 1HH2 ARG 36 -3.212 -4.578 14.726 323 2HH2 ARG 36 2HH2 ARG 36 -4.761 -3.958 14.341 324 H ASP 37 HN ASP 37 -1.371 -0.910 8.303 325 HA ASP 37 HA ASP 37 -3.015 -2.999 7.170 326 1HB ASP 37 HB2 ASP 37 -3.636 -0.551 7.588 327 2HB ASP 37 HB1 ASP 37 -2.672 -0.162 6.177 328 H LEU 38 HN LEU 38 -0.356 -0.978 5.981 329 HA LEU 38 HA LEU 38 -0.355 -1.985 3.361 330 1HB LEU 38 HB2 LEU 38 0.775 0.109 4.165 331 2HB LEU 38 HB1 LEU 38 1.982 -0.880 4.943 332 HG LEU 38 HG LEU 38 1.597 -0.950 1.927 333 1HD1 LEU 38 HD1 LEU 38 2.081 1.336 2.684 334 2HD1 LEU 38 HD1 LEU 38 3.477 0.694 3.566 335 3HD1 LEU 38 HD1 LEU 38 3.434 0.610 1.806 336 1HD2 LEU 38 HD2 LEU 38 3.869 -1.466 3.722 337 2HD2 LEU 38 HD2 LEU 38 2.891 -2.728 2.918 338 3HD2 LEU 38 HD2 LEU 38 3.867 -1.584 1.955 339 H ASP 39 HN ASP 39 1.212 -3.040 6.283 340 HA ASP 39 HA ASP 39 2.860 -5.052 5.267 341 1HB ASP 39 HB2 ASP 39 3.020 -4.211 7.550 342 2HB ASP 39 HB1 ASP 39 1.446 -4.890 7.927 343 H LYS 40 HN LYS 40 -0.596 -5.098 6.089 344 HA LYS 40 HA LYS 40 -0.744 -7.938 5.802 345 1HB LYS 40 HB2 LYS 40 -3.016 -7.840 6.248 346 2HB LYS 40 HB1 LYS 40 -2.346 -6.453 7.127 347 1HG LYS 40 HG2 LYS 40 -3.276 -4.918 5.630 348 2HG LYS 40 HG1 LYS 40 -3.636 -6.165 4.432 349 1HD LYS 40 HD2 LYS 40 -5.212 -7.189 6.023 350 2HD LYS 40 HD1 LYS 40 -4.929 -5.875 7.148 351 1HE LYS 40 HE2 LYS 40 -6.001 -5.505 4.347 352 2HE LYS 40 HE1 LYS 40 -7.028 -5.684 5.759 353 1HZ LYS 40 HZ3 LYS 40 -5.977 -3.675 6.671 354 2HZ LYS 40 HZ2 LYS 40 -5.114 -3.441 5.242 355 3HZ LYS 40 HZ1 LYS 40 -6.779 -3.385 5.234 356 H LEU 41 HN LEU 41 -1.220 -5.210 3.744 357 HA LEU 41 HA LEU 41 -2.481 -6.501 1.590 358 1HB LEU 41 HB2 LEU 41 -2.523 -4.121 1.776 359 2HB LEU 41 HB1 LEU 41 -0.778 -4.029 1.756 360 HG LEU 41 HG LEU 41 -0.744 -4.684 -0.601 361 1HD1 LEU 41 HD1 LEU 41 -2.760 -6.086 -0.600 362 2HD1 LEU 41 HD1 LEU 41 -3.752 -4.629 -0.482 363 3HD1 LEU 41 HD1 LEU 41 -2.741 -4.897 -1.897 364 1HD2 LEU 41 HD2 LEU 41 -2.628 -2.436 0.020 365 2HD2 LEU 41 HD2 LEU 41 -0.865 -2.348 -0.044 366 3HD2 LEU 41 HD2 LEU 41 -1.791 -2.677 -1.512 367 H ILE 42 HN ILE 42 0.783 -6.126 2.548 368 HA ILE 42 HA ILE 42 1.960 -7.078 0.098 369 HB ILE 42 HB ILE 42 3.168 -7.015 2.887 370 1HG1 ILE 42 2HG1 ILE 42 3.458 -5.154 0.533 371 2HG1 ILE 42 1HG1 ILE 42 2.623 -4.805 2.040 372 1HG2 ILE 42 3HG2 ILE 42 4.506 -7.485 0.222 373 2HG2 ILE 42 2HG2 ILE 42 5.348 -7.261 1.755 374 3HG2 ILE 42 1HG2 ILE 42 4.309 -8.669 1.513 375 1HD1 ILE 42 HD1 ILE 42 4.736 -4.966 3.236 376 2HD1 ILE 42 HD1 ILE 42 5.578 -5.278 1.714 377 3HD1 ILE 42 HD1 ILE 42 4.768 -3.728 1.984 378 H ASN 43 HN ASN 43 1.576 -8.582 3.236 379 HA ASN 43 HA ASN 43 2.321 -11.160 2.534 380 1HB ASN 43 HB2 ASN 43 0.452 -10.202 4.690 381 2HB ASN 43 HB1 ASN 43 0.850 -11.901 4.451 382 1HD2 ASN 43 HD2 ASN 43 2.137 -8.769 5.468 383 2HD2 ASN 43 HD2 ASN 43 3.557 -9.420 6.178 384 H LYS 44 HN LYS 44 -0.789 -9.605 2.175 385 HA LYS 44 HA LYS 44 -2.421 -11.768 1.518 386 1HB LYS 44 HB2 LYS 44 -3.210 -9.433 1.820 387 2HB LYS 44 HB1 LYS 44 -2.434 -8.989 0.311 388 1HG LYS 44 HG2 LYS 44 -3.924 -10.779 -0.772 389 2HG LYS 44 HG1 LYS 44 -4.849 -10.725 0.724 390 1HD LYS 44 HD2 LYS 44 -4.308 -8.396 -1.123 391 2HD LYS 44 HD1 LYS 44 -5.825 -9.277 -0.998 392 1HE LYS 44 HE2 LYS 44 -6.019 -8.520 1.348 393 2HE LYS 44 HE1 LYS 44 -4.531 -7.591 1.154 394 1HZ LYS 44 HZ2 LYS 44 -5.674 -6.340 -0.648 395 2HZ LYS 44 HZ1 LYS 44 -7.072 -7.182 -0.338 396 3HZ LYS 44 HZ3 LYS 44 -6.444 -6.143 0.811 397 H PHE 45 HN PHE 45 -0.425 -9.726 -0.548 398 HA PHE 45 HA PHE 45 -1.065 -11.228 -2.883 399 1HB PHE 45 HB2 PHE 45 0.535 -8.806 -2.332 400 2HB PHE 45 HB1 PHE 45 0.807 -9.654 -3.854 401 HD1 PHE 45 HD1 PHE 45 -0.912 -9.832 -5.478 402 HD2 PHE 45 HD2 PHE 45 -1.592 -7.760 -1.848 403 HE1 PHE 45 HE1 PHE 45 -2.990 -8.936 -6.395 404 HE2 PHE 45 HE2 PHE 45 -3.671 -6.817 -2.763 405 HZ PHE 45 HZ PHE 45 -4.377 -7.411 -5.044 406 H MET 46 HN MET 46 1.551 -11.172 -0.664 407 HA MET 46 HA MET 46 3.418 -12.518 -2.288 408 1HB MET 46 HB2 MET 46 3.226 -12.776 0.723 409 2HB MET 46 HB1 MET 46 4.619 -13.143 -0.282 410 1HG MET 46 HG2 MET 46 4.602 -10.671 -0.925 411 2HG MET 46 HG1 MET 46 3.434 -10.480 0.362 412 1HE MET 46 HE3 MET 46 7.009 -11.273 -0.611 413 2HE MET 46 HE2 MET 46 7.808 -11.741 0.891 414 3HE MET 46 HE1 MET 46 6.617 -12.815 0.143 415 H ASN 47 HN ASN 47 0.756 -13.582 -0.335 416 HA ASN 47 HA ASN 47 -0.456 -15.437 -0.196 417 1HB ASN 47 HB2 ASN 47 -0.281 -15.685 -2.625 418 2HB ASN 47 HB1 ASN 47 1.267 -16.489 -2.469 419 1HD2 ASN 47 HD2 ASN 47 -2.183 -16.812 -2.058 420 2HD2 ASN 47 HD2 ASN 47 -2.201 -18.537 -1.986 421 H VAL 48 HN VAL 48 2.498 -15.185 0.681 422 HA VAL 48 HA VAL 48 2.661 -17.850 1.811 423 HB VAL 48 HB VAL 48 4.978 -17.352 2.474 424 1HG1 VAL 48 3HG1 VAL 48 4.417 -16.922 -0.442 425 2HG1 VAL 48 2HG1 VAL 48 5.982 -17.381 0.230 426 3HG1 VAL 48 1HG1 VAL 48 4.600 -18.472 0.377 427 1HG2 VAL 48 3HG2 VAL 48 4.593 -14.759 0.977 428 2HG2 VAL 48 2HG2 VAL 48 4.852 -14.928 2.713 429 3HG2 VAL 48 1HG2 VAL 48 6.138 -15.361 1.584 430 H LYS 49 HN LYS 49 2.687 -18.193 3.861 431 HA LYS 49 HA LYS 49 2.132 -15.924 5.599 432 1HB LYS 49 HB2 LYS 49 1.208 -18.808 5.886 433 2HB LYS 49 HB1 LYS 49 0.697 -17.440 6.884 434 1HG LYS 49 HG2 LYS 49 -0.355 -16.389 4.993 435 2HG LYS 49 HG1 LYS 49 0.197 -17.661 3.919 436 1HD LYS 49 HD2 LYS 49 -1.198 -19.245 5.274 437 2HD LYS 49 HD1 LYS 49 -1.833 -17.841 6.142 438 1HE LYS 49 HE2 LYS 49 -2.041 -18.389 3.174 439 2HE LYS 49 HE1 LYS 49 -3.343 -18.467 4.356 440 1HZ LYS 49 HZ3 LYS 49 -3.102 -16.072 4.713 441 2HZ LYS 49 HZ2 LYS 49 -1.875 -15.990 3.557 442 3HZ LYS 49 HZ1 LYS 49 -3.422 -16.402 3.099 443 H ASP 50 HN ASP 50 4.092 -15.540 6.172 444 HA ASP 50 HA ASP 50 6.188 -17.322 5.986 445 1HB ASP 50 HB2 ASP 50 6.455 -14.877 5.774 446 2HB ASP 50 HB1 ASP 50 6.195 -14.710 7.504 447 H LYS 51 HN LYS 51 7.586 -18.031 7.371 448 HA LYS 51 HA LYS 51 6.630 -19.638 9.509 449 1HB LYS 51 HB2 LYS 51 9.056 -20.292 9.580 450 2HB LYS 51 HB1 LYS 51 8.285 -20.456 8.003 451 1HG LYS 51 HG2 LYS 51 9.233 -18.156 7.460 452 2HG LYS 51 HG1 LYS 51 10.179 -18.330 8.930 453 1HD LYS 51 HD2 LYS 51 11.356 -20.177 8.052 454 2HD LYS 51 HD1 LYS 51 10.237 -20.325 6.693 455 1HE LYS 51 HE2 LYS 51 12.050 -17.980 7.224 456 2HE LYS 51 HE1 LYS 51 12.330 -19.239 6.021 457 1HZ LYS 51 HZ1 LYS 51 10.019 -17.343 6.036 458 2HZ LYS 51 HZ3 LYS 51 11.363 -17.233 5.055 459 3HZ LYS 51 HZ2 LYS 51 10.289 -18.514 4.871 460 H VAL 52 HN VAL 52 6.223 -16.968 10.251 461 HA VAL 52 HA VAL 52 8.298 -16.293 12.110 462 HB VAL 52 HB VAL 52 6.731 -14.391 12.834 463 1HG1 VAL 52 1HG1 VAL 52 7.559 -14.540 9.934 464 2HG1 VAL 52 3HG1 VAL 52 7.178 -13.062 10.815 465 3HG1 VAL 52 2HG1 VAL 52 8.574 -14.031 11.285 466 1HG2 VAL 52 3HG2 VAL 52 4.612 -15.375 12.056 467 2HG2 VAL 52 2HG2 VAL 52 4.901 -13.812 11.292 468 3HG2 VAL 52 1HG2 VAL 52 5.184 -15.299 10.390 469 H HIS 53 HN HIS 53 8.141 -18.327 13.026 470 HA HIS 53 HA HIS 53 6.002 -18.753 14.951 471 1HB HIS 53 HB2 HIS 53 7.091 -20.944 15.401 472 2HB HIS 53 HB1 HIS 53 6.759 -20.724 13.696 473 HD1 HIS 53 HD1 HIS 53 9.597 -21.313 16.111 474 HD2 HIS 53 HD2 HIS 53 9.044 -20.525 12.059 475 HE1 HIS 53 HE1 HIS 53 11.755 -21.862 15.000 476 H LYS 54 HN LYS 54 7.678 -20.047 16.932 477 HA LYS 54 HA LYS 54 8.425 -17.713 18.363 478 1HB LYS 54 HB2 LYS 54 8.720 -20.640 19.098 479 2HB LYS 54 HB1 LYS 54 9.242 -19.345 20.145 480 1HG LYS 54 HG2 LYS 54 7.108 -20.140 20.906 481 2HG LYS 54 HG1 LYS 54 6.888 -18.531 20.232 482 1HD LYS 54 HD2 LYS 54 5.991 -19.484 18.187 483 2HD LYS 54 HD1 LYS 54 6.297 -21.111 18.784 484 1HE LYS 54 HE2 LYS 54 4.411 -19.111 20.047 485 2HE LYS 54 HE1 LYS 54 3.930 -20.439 18.994 486 1HZ LYS 54 HZ2 LYS 54 4.831 -21.992 20.639 487 2HZ LYS 54 HZ1 LYS 54 5.249 -20.702 21.645 488 3HZ LYS 54 HZ3 LYS 54 3.635 -21.030 21.308 489 H LEU 55 HN LEU 55 9.865 -16.930 16.874 490 HA LEU 55 HA LEU 55 12.550 -18.057 16.722 491 1HB LEU 55 HB2 LEU 55 11.331 -15.545 15.551 492 2HB LEU 55 HB1 LEU 55 12.966 -16.092 15.266 493 HG LEU 55 HG LEU 55 10.499 -17.607 14.399 494 1HD1 LEU 55 HD1 LEU 55 10.682 -15.465 13.230 495 2HD1 LEU 55 HD1 LEU 55 12.357 -15.833 12.811 496 3HD1 LEU 55 HD1 LEU 55 11.043 -16.810 12.150 497 1HD2 LEU 55 HD2 LEU 55 13.423 -17.933 13.722 498 2HD2 LEU 55 HD2 LEU 55 12.457 -19.012 14.727 499 3HD2 LEU 55 HD2 LEU 55 12.091 -18.847 13.011 500 H GLU 56 HN GLU 56 14.254 -17.046 17.740 501 HA GLU 56 HA GLU 56 13.497 -15.361 19.941 502 1HB GLU 56 HB2 GLU 56 16.209 -16.482 19.203 503 2HB GLU 56 HB1 GLU 56 15.814 -15.669 20.717 504 1HG GLU 56 HG2 GLU 56 14.135 -17.412 21.185 505 2HG GLU 56 HG1 GLU 56 14.628 -18.246 19.717 506 H HIS 57 HN HIS 57 12.839 -13.967 18.066 507 HA HIS 57 HA HIS 57 14.908 -12.041 17.251 508 1HB HIS 57 HB2 HIS 57 13.177 -12.960 15.608 509 2HB HIS 57 HB1 HIS 57 11.964 -12.105 16.551 510 HD1 HIS 57 HD1 HIS 57 11.353 -9.876 15.527 511 HD2 HIS 57 HD2 HIS 57 15.252 -11.016 14.675 512 HE1 HIS 57 HE1 HIS 57 12.298 -8.070 14.062 513 H HIS 58 HN HIS 58 12.517 -12.638 19.529 514 HA HIS 58 HA HIS 58 12.304 -9.845 20.314 515 1HB HIS 58 HB2 HIS 58 10.216 -11.267 20.010 516 2HB HIS 58 HB1 HIS 58 10.773 -12.257 21.348 517 HD1 HIS 58 HD1 HIS 58 9.382 -11.694 23.344 518 HD2 HIS 58 HD2 HIS 58 10.268 -8.347 21.049 519 HE1 HIS 58 HE1 HIS 58 8.310 -9.729 24.510 520 H HIS 59 HN HIS 59 13.382 -9.243 22.147 521 HA HIS 59 HA HIS 59 15.261 -11.181 23.192 522 1HB HIS 59 HB2 HIS 59 15.080 -8.194 23.602 523 2HB HIS 59 HB1 HIS 59 16.370 -9.218 24.223 524 HD1 HIS 59 HD1 HIS 59 15.215 -7.509 21.105 525 HD2 HIS 59 HD2 HIS 59 18.100 -10.280 22.242 526 HE1 HIS 59 HE1 HIS 59 16.836 -7.637 19.200 527 H HIS 60 HN HIS 60 12.267 -10.285 24.087 528 HA HIS 60 HA HIS 60 12.843 -10.571 26.942 529 1HB HIS 60 HB2 HIS 60 10.264 -9.774 25.560 530 2HB HIS 60 HB1 HIS 60 10.447 -9.956 27.300 531 HD1 HIS 60 HD1 HIS 60 11.448 -7.948 28.577 532 HD2 HIS 60 HD2 HIS 60 11.599 -7.542 24.440 533 HE1 HIS 60 HE1 HIS 60 12.165 -5.590 28.135 534 H HIS 61 HN HIS 61 11.783 -12.183 28.145 535 HA HIS 61 HA HIS 61 11.492 -14.597 26.623 536 1HB HIS 61 HB2 HIS 61 11.430 -14.050 29.586 537 2HB HIS 61 HB1 HIS 61 11.083 -15.637 28.918 538 HD1 HIS 61 HD1 HIS 61 13.071 -17.051 28.170 539 HD2 HIS 61 HD2 HIS 61 14.114 -13.192 29.282 540 HE1 HIS 61 HE1 HIS 61 15.589 -17.024 28.308 541 H HIS 62 HN HIS 62 9.732 -15.974 26.657 542 HA HIS 62 HA HIS 62 7.174 -14.571 26.886 543 1HB HIS 62 HB2 HIS 62 7.983 -16.898 25.112 544 2HB HIS 62 HB1 HIS 62 6.374 -16.199 25.183 545 HD1 HIS 62 HD1 HIS 62 5.968 -14.722 23.187 546 HD2 HIS 62 HD2 HIS 62 9.946 -14.682 24.377 547 HE1 HIS 62 HE1 HIS 62 7.166 -13.226 21.571 548 H1 MET 101 HT2 MET 101 12.477 22.937 -3.138 549 H2 MET 101 HT1 MET 101 12.510 23.707 -1.685 550 H3 MET 101 HT3 MET 101 13.939 22.983 -2.271 551 HA MET 101 HA MET 101 12.945 20.819 -2.086 552 1HB MET 101 HB2 MET 101 13.958 21.731 -0.008 553 2HB MET 101 HB1 MET 101 12.419 22.456 0.417 554 1HG MET 101 HG2 MET 101 11.429 20.236 0.632 555 2HG MET 101 HG1 MET 101 12.973 19.501 0.194 556 1HE MET 101 HE3 MET 101 12.917 18.009 2.401 557 2HE MET 101 HE2 MET 101 12.685 18.660 4.023 558 3HE MET 101 HE1 MET 101 11.368 18.722 2.851 559 H GLU 102 HN GLU 102 11.224 20.237 -3.196 560 HA GLU 102 HA GLU 102 8.635 21.514 -2.649 561 1HB GLU 102 HB2 GLU 102 9.235 19.631 -4.919 562 2HB GLU 102 HB1 GLU 102 7.993 20.858 -4.824 563 1HG GLU 102 HG2 GLU 102 10.939 21.234 -5.300 564 2HG GLU 102 HG1 GLU 102 9.598 21.627 -6.371 565 H MET 103 HN MET 103 6.732 20.067 -2.558 566 HA MET 103 HA MET 103 7.324 17.665 -1.067 567 1HB MET 103 HB2 MET 103 4.929 17.349 -0.788 568 2HB MET 103 HB1 MET 103 5.307 19.034 -0.487 569 1HG MET 103 HG2 MET 103 4.384 19.683 -2.596 570 2HG MET 103 HG1 MET 103 4.213 18.003 -3.099 571 1HE MET 103 HE1 MET 103 2.905 20.839 -0.707 572 2HE MET 103 HE3 MET 103 1.671 19.993 0.226 573 3HE MET 103 HE2 MET 103 3.369 19.591 0.452 574 H GLY 104 HN GLY 104 6.712 18.489 -4.327 575 1HA GLY 104 HA1 GLY 104 6.729 17.241 -6.249 576 2HA GLY 104 HA2 GLY 104 5.816 16.038 -5.347 577 H GLN 105 HN GLN 105 9.026 17.206 -4.598 578 HA GLN 105 HA GLN 105 10.512 15.083 -5.768 579 1HB GLN 105 HB2 GLN 105 11.264 16.813 -3.404 580 2HB GLN 105 HB1 GLN 105 12.368 15.866 -4.388 581 1HG GLN 105 HG2 GLN 105 11.896 17.272 -6.310 582 2HG GLN 105 HG1 GLN 105 10.734 18.197 -5.361 583 1HE2 GLN 105 1HE2 GLN 105 14.066 17.554 -5.949 584 2HE2 GLN 105 2HE2 GLN 105 14.679 18.877 -5.026 585 H LEU 106 HN LEU 106 9.319 15.720 -2.524 586 HA LEU 106 HA LEU 106 10.270 13.420 -1.278 587 1HB LEU 106 HB2 LEU 106 9.596 15.361 -0.025 588 2HB LEU 106 HB1 LEU 106 7.980 15.295 -0.671 589 HG LEU 106 HG LEU 106 8.350 14.673 1.787 590 1HD1 LEU 106 HD1 LEU 106 6.849 12.771 0.018 591 2HD1 LEU 106 HD1 LEU 106 6.643 12.942 1.761 592 3HD1 LEU 106 HD1 LEU 106 6.256 14.288 0.685 593 1HD2 LEU 106 HD2 LEU 106 9.324 12.107 0.528 594 2HD2 LEU 106 HD2 LEU 106 10.280 13.207 1.519 595 3HD2 LEU 106 HD2 LEU 106 8.931 12.324 2.233 596 H LYS 107 HN LYS 107 7.164 14.130 -2.819 597 HA LYS 107 HA LYS 107 5.993 11.626 -2.339 598 1HB LYS 107 HB2 LYS 107 5.101 14.001 -3.314 599 2HB LYS 107 HB1 LYS 107 5.218 13.086 -4.807 600 1HG LYS 107 HG2 LYS 107 3.715 12.154 -2.387 601 2HG LYS 107 HG1 LYS 107 2.966 13.052 -3.688 602 1HD LYS 107 HD2 LYS 107 4.415 10.440 -4.096 603 2HD LYS 107 HD1 LYS 107 2.687 10.533 -3.758 604 1HE LYS 107 HE2 LYS 107 4.033 11.933 -6.060 605 2HE LYS 107 HE1 LYS 107 3.283 10.344 -6.190 606 1HZ LYS 107 HZ1 LYS 107 1.869 12.830 -5.368 607 2HZ LYS 107 HZ3 LYS 107 1.800 12.143 -6.901 608 3HZ LYS 107 HZ2 LYS 107 1.176 11.317 -5.569 609 H ASN 108 HN ASN 108 8.031 12.838 -4.945 610 HA ASN 108 HA ASN 108 7.893 10.607 -6.644 611 1HB ASN 108 HB2 ASN 108 8.820 12.736 -7.400 612 2HB ASN 108 HB1 ASN 108 10.130 12.608 -6.239 613 1HD2 ASN 108 HD2 ASN 108 11.920 11.421 -6.749 614 2HD2 ASN 108 HD2 ASN 108 12.158 10.644 -8.265 615 H LYS 109 HN LYS 109 9.941 11.320 -3.879 616 HA LYS 109 HA LYS 109 11.576 9.002 -4.038 617 1HB LYS 109 HB2 LYS 109 10.760 10.565 -1.579 618 2HB LYS 109 HB1 LYS 109 12.012 9.334 -1.632 619 1HG LYS 109 HG2 LYS 109 13.289 10.729 -3.190 620 2HG LYS 109 HG1 LYS 109 12.042 11.978 -3.077 621 1HD LYS 109 HD2 LYS 109 13.875 12.540 -1.592 622 2HD LYS 109 HD1 LYS 109 12.457 12.110 -0.638 623 1HE LYS 109 HE2 LYS 109 13.376 9.867 -0.256 624 2HE LYS 109 HE1 LYS 109 14.775 10.268 -1.252 625 1HZ LYS 109 HZ2 LYS 109 14.044 11.623 1.293 626 2HZ LYS 109 HZ1 LYS 109 15.217 10.449 1.129 627 3HZ LYS 109 HZ3 LYS 109 15.408 11.925 0.367 628 H ILE 110 HN ILE 110 8.565 9.706 -2.387 629 HA ILE 110 HA ILE 110 8.172 7.259 -1.122 630 HB ILE 110 HB ILE 110 6.225 9.348 -2.109 631 1HG1 ILE 110 2HG1 ILE 110 7.217 8.571 0.617 632 2HG1 ILE 110 1HG1 ILE 110 7.778 9.958 -0.315 633 1HG2 ILE 110 3HG2 ILE 110 5.026 7.200 -2.058 634 2HG2 ILE 110 2HG2 ILE 110 5.562 6.948 -0.396 635 3HG2 ILE 110 1HG2 ILE 110 4.470 8.277 -0.775 636 1HD1 ILE 110 HD1 ILE 110 5.032 9.517 0.799 637 2HD1 ILE 110 HD1 ILE 110 6.262 10.613 1.430 638 3HD1 ILE 110 HD1 ILE 110 5.537 10.912 -0.149 639 H GLU 111 HN GLU 111 7.019 8.366 -4.266 640 HA GLU 111 HA GLU 111 5.817 6.024 -5.114 641 1HB GLU 111 HB2 GLU 111 7.231 8.182 -6.651 642 2HB GLU 111 HB1 GLU 111 6.387 6.853 -7.435 643 1HG GLU 111 HG2 GLU 111 5.127 8.803 -5.533 644 2HG GLU 111 HG1 GLU 111 5.077 8.933 -7.291 645 H ASN 112 HN ASN 112 9.154 7.099 -5.591 646 HA ASN 112 HA ASN 112 10.093 4.871 -6.988 647 1HB ASN 112 HB2 ASN 112 11.463 6.822 -6.989 648 2HB ASN 112 HB1 ASN 112 11.527 6.863 -5.231 649 1HD2 ASN 112 HD2 ASN 112 13.025 5.637 -4.178 650 2HD2 ASN 112 HD2 ASN 112 14.234 4.690 -4.921 651 H LYS 113 HN LYS 113 10.025 5.474 -3.522 652 HA LYS 113 HA LYS 113 11.468 3.163 -2.822 653 1HB LYS 113 HB2 LYS 113 11.104 5.220 -1.402 654 2HB LYS 113 HB1 LYS 113 9.473 4.650 -1.122 655 1HG LYS 113 HG2 LYS 113 10.928 4.084 0.750 656 2HG LYS 113 HG1 LYS 113 10.327 2.642 -0.067 657 1HD LYS 113 HD2 LYS 113 12.682 2.434 0.489 658 2HD LYS 113 HD1 LYS 113 12.434 2.399 -1.248 659 1HE LYS 113 HE2 LYS 113 13.102 4.716 -1.385 660 2HE LYS 113 HE1 LYS 113 13.362 4.770 0.372 661 1HZ LYS 113 HZ3 LYS 113 14.986 2.909 -0.016 662 2HZ LYS 113 HZ2 LYS 113 14.762 3.213 -1.688 663 3HZ LYS 113 HZ1 LYS 113 15.442 4.397 -0.719 664 H LYS 114 HN LYS 114 8.019 3.878 -2.935 665 HA LYS 114 HA LYS 114 6.881 1.492 -2.207 666 1HB LYS 114 HB2 LYS 114 5.691 3.592 -2.642 667 2HB LYS 114 HB1 LYS 114 6.118 3.475 -4.337 668 1HG LYS 114 HG2 LYS 114 4.756 1.421 -4.488 669 2HG LYS 114 HG1 LYS 114 4.251 1.663 -2.817 670 1HD LYS 114 HD2 LYS 114 2.536 2.566 -4.265 671 2HD LYS 114 HD1 LYS 114 3.380 3.915 -3.491 672 1HE LYS 114 HE2 LYS 114 4.714 4.253 -5.461 673 2HE LYS 114 HE1 LYS 114 3.964 2.860 -6.230 674 1HZ LYS 114 HZ3 LYS 114 1.769 4.259 -6.011 675 2HZ LYS 114 HZ2 LYS 114 2.800 5.520 -5.592 676 3HZ LYS 114 HZ1 LYS 114 2.957 4.826 -7.056 677 H LYS 115 HN LYS 115 7.937 2.660 -5.385 678 HA LYS 115 HA LYS 115 7.330 0.352 -6.853 679 1HB LYS 115 HB2 LYS 115 9.144 2.687 -7.390 680 2HB LYS 115 HB1 LYS 115 8.895 1.408 -8.570 681 1HG LYS 115 HG2 LYS 115 6.628 1.948 -8.854 682 2HG LYS 115 HG1 LYS 115 6.579 2.892 -7.367 683 1HD LYS 115 HD2 LYS 115 7.918 4.564 -8.291 684 2HD LYS 115 HD1 LYS 115 8.197 3.670 -9.804 685 1HE LYS 115 HE2 LYS 115 5.722 3.843 -10.192 686 2HE LYS 115 HE1 LYS 115 5.599 4.804 -8.723 687 1HZ LYS 115 HZ1 LYS 115 7.038 6.497 -9.774 688 2HZ LYS 115 HZ3 LYS 115 7.125 5.572 -11.169 689 3HZ LYS 115 HZ2 LYS 115 5.660 6.213 -10.680 690 H GLU 116 HN GLU 116 10.334 1.324 -5.273 691 HA GLU 116 HA GLU 116 11.939 -0.869 -6.010 692 1HB GLU 116 HB2 GLU 116 11.851 0.685 -3.413 693 2HB GLU 116 HB1 GLU 116 13.018 -0.588 -3.725 694 1HG GLU 116 HG2 GLU 116 13.871 0.787 -5.609 695 2HG GLU 116 HG1 GLU 116 12.739 2.055 -5.130 696 H LEU 117 HN LEU 117 9.620 -0.501 -3.401 697 HA LEU 117 HA LEU 117 10.019 -3.040 -2.262 698 1HB LEU 117 HB2 LEU 117 9.083 -1.375 -0.882 699 2HB LEU 117 HB1 LEU 117 7.856 -0.970 -2.054 700 HG LEU 117 HG LEU 117 7.015 -2.113 0.028 701 1HD1 LEU 117 HD1 LEU 117 5.709 -1.882 -1.780 702 2HD1 LEU 117 HD1 LEU 117 6.308 -3.386 -2.491 703 3HD1 LEU 117 HD1 LEU 117 5.426 -3.416 -0.941 704 1HD2 LEU 117 HD2 LEU 117 8.364 -4.513 -1.152 705 2HD2 LEU 117 HD2 LEU 117 8.814 -3.716 0.357 706 3HD2 LEU 117 HD2 LEU 117 7.242 -4.511 0.215 707 H ILE 118 HN ILE 118 7.784 -1.851 -4.660 708 HA ILE 118 HA ILE 118 6.248 -4.116 -4.792 709 HB ILE 118 HB ILE 118 6.872 -2.205 -7.077 710 1HG1 ILE 118 2HG1 ILE 118 4.454 -2.304 -5.274 711 2HG1 ILE 118 1HG1 ILE 118 5.855 -1.298 -4.942 712 1HG2 ILE 118 3HG2 ILE 118 4.663 -4.245 -6.759 713 2HG2 ILE 118 2HG2 ILE 118 4.737 -3.041 -8.052 714 3HG2 ILE 118 1HG2 ILE 118 5.973 -4.302 -7.932 715 1HD1 ILE 118 HD1 ILE 118 4.094 -1.132 -7.367 716 2HD1 ILE 118 HD1 ILE 118 4.087 -0.027 -5.978 717 3HD1 ILE 118 HD1 ILE 118 5.495 -0.126 -7.033 718 H GLN 119 HN GLN 119 9.230 -3.228 -6.482 719 HA GLN 119 HA GLN 119 9.613 -5.467 -8.122 720 1HB GLN 119 HB2 GLN 119 11.670 -3.834 -6.632 721 2HB GLN 119 HB1 GLN 119 12.032 -4.969 -7.913 722 1HG GLN 119 HG2 GLN 119 10.799 -3.616 -9.491 723 2HG GLN 119 HG1 GLN 119 10.347 -2.505 -8.199 724 1HE2 GLN 119 1HE2 GLN 119 11.873 -2.051 -10.647 725 2HE2 GLN 119 2HE2 GLN 119 13.363 -1.344 -10.135 726 H LEU 120 HN LEU 120 10.393 -4.902 -4.763 727 HA LEU 120 HA LEU 120 11.751 -7.305 -4.283 728 1HB LEU 120 HB2 LEU 120 10.572 -5.183 -2.600 729 2HB LEU 120 HB1 LEU 120 10.856 -6.733 -1.852 730 HG LEU 120 HG LEU 120 13.194 -6.570 -2.058 731 1HD1 LEU 120 HD1 LEU 120 12.804 -4.239 -3.911 732 2HD1 LEU 120 HD1 LEU 120 14.332 -4.866 -3.280 733 3HD1 LEU 120 HD1 LEU 120 13.357 -5.869 -4.366 734 1HD2 LEU 120 HD2 LEU 120 12.113 -3.838 -1.534 735 2HD2 LEU 120 HD2 LEU 120 12.329 -5.146 -0.368 736 3HD2 LEU 120 HD2 LEU 120 13.731 -4.396 -1.122 737 H VAL 121 HN VAL 121 8.255 -6.500 -3.451 738 HA VAL 121 HA VAL 121 7.794 -9.124 -2.703 739 HB VAL 121 HB VAL 121 5.555 -8.608 -2.632 740 1HG1 VAL 121 2HG1 VAL 121 6.765 -7.392 -1.016 741 2HG1 VAL 121 1HG1 VAL 121 7.003 -6.070 -2.171 742 3HG1 VAL 121 3HG1 VAL 121 5.384 -6.427 -1.571 743 1HG2 VAL 121 2HG2 VAL 121 5.978 -6.355 -4.564 744 2HG2 VAL 121 1HG2 VAL 121 5.176 -7.916 -4.844 745 3HG2 VAL 121 3HG2 VAL 121 4.449 -6.751 -3.736 746 H ALA 122 HN ALA 122 7.900 -7.643 -5.846 747 HA ALA 122 HA ALA 122 6.451 -9.675 -7.199 748 1HB ALA 122 HB3 ALA 122 8.385 -7.692 -8.347 749 2HB ALA 122 HB2 ALA 122 7.115 -8.573 -9.232 750 3HB ALA 122 HB1 ALA 122 6.682 -7.372 -8.019 751 H ARG 123 HN ARG 123 9.892 -9.096 -6.574 752 HA ARG 123 HA ARG 123 10.767 -11.243 -8.233 753 1HB ARG 123 HB2 ARG 123 12.956 -10.952 -7.268 754 2HB ARG 123 HB1 ARG 123 12.289 -9.370 -7.634 755 1HG ARG 123 HG2 ARG 123 11.789 -9.005 -5.320 756 2HG ARG 123 HG1 ARG 123 12.275 -10.648 -4.920 757 1HD ARG 123 HD2 ARG 123 14.035 -9.132 -4.296 758 2HD ARG 123 HD1 ARG 123 14.569 -10.116 -5.650 759 HE ARG 123 HE ARG 123 13.552 -7.811 -6.738 760 1HH1 ARG 123 1HH1 ARG 123 16.155 -8.683 -4.489 761 2HH1 ARG 123 2HH1 ARG 123 17.178 -7.398 -4.884 762 1HH2 ARG 123 1HH2 ARG 123 14.981 -5.953 -7.318 763 2HH2 ARG 123 2HH2 ARG 123 16.482 -5.808 -6.529 764 H HIS 124 HN HIS 124 9.380 -11.060 -5.171 765 HA HIS 124 HA HIS 124 10.321 -13.455 -4.031 766 1HB HIS 124 HB2 HIS 124 9.039 -11.877 -2.701 767 2HB HIS 124 HB1 HIS 124 7.679 -12.001 -3.775 768 HD1 HIS 124 HD1 HIS 124 9.586 -14.367 -1.373 769 HD2 HIS 124 HD2 HIS 124 5.890 -13.715 -3.085 770 HE1 HIS 124 HE1 HIS 124 8.057 -16.045 -0.316 771 H GLY 125 HN GLY 125 7.833 -12.739 -6.368 772 1HA GLY 125 HA1 GLY 125 7.421 -15.620 -6.722 773 2HA GLY 125 HA2 GLY 125 7.854 -14.613 -8.093 774 H LEU 126 HN LEU 126 6.301 -12.382 -7.767 775 HA LEU 126 HA LEU 126 3.589 -13.347 -7.412 776 1HB LEU 126 HB2 LEU 126 4.659 -10.608 -8.006 777 2HB LEU 126 HB1 LEU 126 2.960 -10.950 -8.024 778 HG LEU 126 HG LEU 126 4.837 -10.972 -5.798 779 1HD1 LEU 126 HD1 LEU 126 3.905 -8.821 -6.316 780 2HD1 LEU 126 HD1 LEU 126 2.264 -9.463 -6.173 781 3HD1 LEU 126 HD1 LEU 126 3.304 -9.394 -4.761 782 1HD2 LEU 126 HD2 LEU 126 2.089 -12.126 -5.792 783 2HD2 LEU 126 HD2 LEU 126 3.605 -12.945 -5.417 784 3HD2 LEU 126 HD2 LEU 126 2.974 -11.713 -4.325 785 H ASP 127 HN ASP 127 2.052 -13.224 -8.902 786 HA ASP 127 HA ASP 127 2.754 -13.892 -11.596 787 1HB ASP 127 HB2 ASP 127 0.032 -12.956 -10.604 788 2HB ASP 127 HB1 ASP 127 0.384 -13.894 -12.038 789 H HIS 128 HN HIS 128 1.826 -12.522 -13.425 790 HA HIS 128 HA HIS 128 2.922 -9.919 -13.283 791 1HB HIS 128 HB2 HIS 128 2.627 -11.191 -15.422 792 2HB HIS 128 HB1 HIS 128 0.889 -10.954 -15.290 793 HD1 HIS 128 HD1 HIS 128 -0.027 -8.827 -16.379 794 HD2 HIS 128 HD2 HIS 128 4.083 -8.699 -15.747 795 HE1 HIS 128 HE1 HIS 128 0.786 -6.744 -17.505 796 H ASP 129 HN ASP 129 -0.338 -11.151 -13.015 797 HA ASP 129 HA ASP 129 -1.607 -8.635 -12.792 798 1HB ASP 129 HB2 ASP 129 -2.552 -11.388 -12.005 799 2HB ASP 129 HB1 ASP 129 -3.555 -9.952 -11.851 800 H LYS 130 HN LYS 130 -0.252 -10.852 -10.455 801 HA LYS 130 HA LYS 130 -1.288 -9.724 -8.098 802 1HB LYS 130 HB2 LYS 130 1.302 -11.110 -8.638 803 2HB LYS 130 HB1 LYS 130 0.952 -10.618 -7.017 804 1HG LYS 130 HG2 LYS 130 -0.576 -12.557 -8.737 805 2HG LYS 130 HG1 LYS 130 0.472 -12.947 -7.374 806 1HD LYS 130 HD2 LYS 130 -1.131 -11.712 -5.923 807 2HD LYS 130 HD1 LYS 130 -2.195 -11.535 -7.328 808 1HE LYS 130 HE2 LYS 130 -1.256 -14.082 -6.032 809 2HE LYS 130 HE1 LYS 130 -2.887 -13.426 -5.993 810 1HZ LYS 130 HZ1 LYS 130 -2.982 -13.737 -8.422 811 2HZ LYS 130 HZ3 LYS 130 -1.454 -14.463 -8.395 812 3HZ LYS 130 HZ2 LYS 130 -2.744 -15.190 -7.613 813 H VAL 131 HN VAL 131 1.673 -8.952 -9.870 814 HA VAL 131 HA VAL 131 2.594 -6.922 -8.174 815 HB VAL 131 HB VAL 131 3.012 -7.058 -11.187 816 1HG1 VAL 131 2HG1 VAL 131 3.740 -4.967 -10.219 817 2HG1 VAL 131 1HG1 VAL 131 4.729 -5.839 -9.053 818 3HG1 VAL 131 3HG1 VAL 131 5.113 -5.927 -10.772 819 1HG2 VAL 131 3HG2 VAL 131 4.561 -8.432 -9.004 820 2HG2 VAL 131 2HG2 VAL 131 3.532 -9.197 -10.221 821 3HG2 VAL 131 1HG2 VAL 131 5.013 -8.375 -10.713 822 H LEU 132 HN LEU 132 0.390 -6.828 -10.927 823 HA LEU 132 HA LEU 132 0.047 -3.995 -11.082 824 1HB LEU 132 HB2 LEU 132 -1.877 -6.157 -11.889 825 2HB LEU 132 HB1 LEU 132 -1.886 -4.494 -12.434 826 HG LEU 132 HG LEU 132 0.190 -6.579 -13.078 827 1HD1 LEU 132 HD1 LEU 132 -1.898 -6.894 -14.228 828 2HD1 LEU 132 HD1 LEU 132 -1.867 -5.214 -14.771 829 3HD1 LEU 132 HD1 LEU 132 -0.640 -6.352 -15.343 830 1HD2 LEU 132 HD2 LEU 132 0.023 -3.694 -13.954 831 2HD2 LEU 132 HD2 LEU 132 1.231 -4.393 -12.874 832 3HD2 LEU 132 HD2 LEU 132 1.162 -4.899 -14.561 833 H LEU 133 HN LEU 133 -1.972 -6.510 -9.643 834 HA LEU 133 HA LEU 133 -3.941 -4.769 -8.638 835 1HB LEU 133 HB2 LEU 133 -3.097 -7.458 -7.628 836 2HB LEU 133 HB1 LEU 133 -4.614 -6.660 -7.252 837 HG LEU 133 HG LEU 133 -3.751 -7.681 -9.961 838 1HD1 LEU 133 HD1 LEU 133 -5.811 -8.706 -8.028 839 2HD1 LEU 133 HD1 LEU 133 -5.535 -9.317 -9.659 840 3HD1 LEU 133 HD1 LEU 133 -4.274 -9.477 -8.434 841 1HD2 LEU 133 HD2 LEU 133 -6.342 -6.429 -9.077 842 2HD2 LEU 133 HD2 LEU 133 -5.155 -5.714 -10.172 843 3HD2 LEU 133 HD2 LEU 133 -6.036 -7.163 -10.650 844 H PHE 134 HN PHE 134 -1.047 -6.170 -7.162 845 HA PHE 134 HA PHE 134 -1.436 -5.118 -4.608 846 1HB PHE 134 HB2 PHE 134 0.138 -6.880 -4.898 847 2HB PHE 134 HB1 PHE 134 1.088 -5.944 -6.047 848 HD1 PHE 134 HD1 PHE 134 2.904 -4.691 -5.297 849 HD2 PHE 134 HD2 PHE 134 -0.022 -6.005 -2.498 850 HE1 PHE 134 HE1 PHE 134 4.310 -3.873 -3.424 851 HE2 PHE 134 HE2 PHE 134 1.393 -5.184 -0.654 852 HZ PHE 134 HZ PHE 134 3.560 -4.117 -1.157 853 H SER 135 HN SER 135 0.515 -3.876 -7.329 854 HA SER 135 HA SER 135 1.513 -1.683 -5.949 855 1HB SER 135 HB2 SER 135 2.007 -0.713 -8.210 856 2HB SER 135 HB1 SER 135 2.572 -2.370 -7.985 857 HG SER 135 HG SER 135 0.975 -3.110 -9.230 858 H ARG 136 HN ARG 136 -1.472 -2.000 -7.764 859 HA ARG 136 HA ARG 136 -1.988 0.789 -7.578 860 1HB ARG 136 HB2 ARG 136 -4.140 0.350 -8.587 861 2HB ARG 136 HB1 ARG 136 -2.855 -0.445 -9.473 862 1HG ARG 136 HG2 ARG 136 -3.488 -2.563 -8.332 863 2HG ARG 136 HG1 ARG 136 -4.866 -1.713 -7.630 864 1HD ARG 136 HD2 ARG 136 -4.281 -2.161 -10.545 865 2HD ARG 136 HD1 ARG 136 -5.583 -2.869 -9.602 866 HE ARG 136 HE ARG 136 -5.670 -0.012 -9.542 867 1HH1 ARG 136 1HH1 ARG 136 -6.684 -2.806 -11.439 868 2HH1 ARG 136 2HH1 ARG 136 -7.882 -1.965 -12.311 869 1HH2 ARG 136 1HH2 ARG 136 -7.289 1.147 -10.714 870 2HH2 ARG 136 2HH2 ARG 136 -8.253 0.344 -11.867 871 H ASP 137 HN ASP 137 -3.075 -2.016 -5.663 872 HA ASP 137 HA ASP 137 -4.911 -0.401 -4.151 873 1HB ASP 137 HB2 ASP 137 -5.066 -2.957 -4.402 874 2HB ASP 137 HB1 ASP 137 -3.748 -3.055 -3.254 875 H LEU 138 HN LEU 138 -1.617 -1.406 -3.884 876 HA LEU 138 HA LEU 138 -0.935 -0.416 -1.350 877 1HB LEU 138 HB2 LEU 138 0.576 -1.831 -2.519 878 2HB LEU 138 HB1 LEU 138 0.578 -0.793 -3.921 879 HG LEU 138 HG LEU 138 1.898 0.869 -2.675 880 1HD1 LEU 138 HD1 LEU 138 1.954 -1.197 -0.493 881 2HD1 LEU 138 HD1 LEU 138 2.918 0.280 -0.597 882 3HD1 LEU 138 HD1 LEU 138 1.162 0.392 -0.433 883 1HD2 LEU 138 HD2 LEU 138 3.025 -1.912 -2.696 884 2HD2 LEU 138 HD2 LEU 138 3.002 -0.773 -4.043 885 3HD2 LEU 138 HD2 LEU 138 3.964 -0.424 -2.609 886 H ASP 139 HN ASP 139 -0.715 1.053 -4.542 887 HA ASP 139 HA ASP 139 0.158 3.597 -3.869 888 1HB ASP 139 HB2 ASP 139 0.079 2.762 -6.152 889 2HB ASP 139 HB1 ASP 139 -1.674 2.677 -6.083 890 H LYS 140 HN LYS 140 -3.130 2.334 -4.155 891 HA LYS 140 HA LYS 140 -4.679 4.511 -3.664 892 1HB LYS 140 HB2 LYS 140 -5.404 2.510 -4.563 893 2HB LYS 140 HB1 LYS 140 -4.755 1.584 -3.242 894 1HG LYS 140 HG2 LYS 140 -6.399 2.552 -1.788 895 2HG LYS 140 HG1 LYS 140 -7.161 3.330 -3.211 896 1HD LYS 140 HD2 LYS 140 -7.528 1.207 -4.257 897 2HD LYS 140 HD1 LYS 140 -6.563 0.380 -3.048 898 1HE LYS 140 HE2 LYS 140 -8.285 0.987 -1.363 899 2HE LYS 140 HE1 LYS 140 -9.274 1.615 -2.689 900 1HZ LYS 140 HZ1 LYS 140 -8.189 -1.126 -2.598 901 2HZ LYS 140 HZ3 LYS 140 -9.741 -0.741 -2.061 902 3HZ LYS 140 HZ2 LYS 140 -9.347 -0.536 -3.686 903 H LEU 141 HN LEU 141 -3.507 1.988 -1.430 904 HA LEU 141 HA LEU 141 -4.535 2.983 0.955 905 1HB LEU 141 HB2 LEU 141 -3.721 0.738 0.775 906 2HB LEU 141 HB1 LEU 141 -2.120 1.289 0.348 907 HG LEU 141 HG LEU 141 -1.735 2.061 2.620 908 1HD1 LEU 141 HD1 LEU 141 -4.545 1.073 3.188 909 2HD1 LEU 141 HD1 LEU 141 -3.379 1.618 4.397 910 3HD1 LEU 141 HD1 LEU 141 -4.007 2.759 3.217 911 1HD2 LEU 141 HD2 LEU 141 -2.859 -0.719 2.491 912 2HD2 LEU 141 HD2 LEU 141 -1.220 -0.225 2.074 913 3HD2 LEU 141 HD2 LEU 141 -1.781 -0.100 3.741 914 H ILE 142 HN ILE 142 -1.546 3.614 -0.690 915 HA ILE 142 HA ILE 142 -0.461 5.218 1.396 916 HB ILE 142 HB ILE 142 0.348 5.054 -1.534 917 1HG1 ILE 142 2HG1 ILE 142 1.486 3.827 0.973 918 2HG1 ILE 142 1HG1 ILE 142 0.626 2.973 -0.299 919 1HG2 ILE 142 3HG2 ILE 142 1.783 6.341 0.789 920 2HG2 ILE 142 2HG2 ILE 142 2.446 6.129 -0.834 921 3HG2 ILE 142 1HG2 ILE 142 1.060 7.189 -0.579 922 1HD1 ILE 142 HD1 ILE 142 3.275 4.364 -0.623 923 2HD1 ILE 142 HD1 ILE 142 3.041 2.627 -0.396 924 3HD1 ILE 142 HD1 ILE 142 2.413 3.414 -1.840 925 H ASN 143 HN ASN 143 -1.900 6.099 -1.709 926 HA ASN 143 HA ASN 143 -1.964 8.873 -1.393 927 1HB ASN 143 HB2 ASN 143 -3.784 7.043 -2.934 928 2HB ASN 143 HB1 ASN 143 -4.100 8.771 -2.844 929 1HD2 ASN 143 HD2 ASN 143 -1.955 6.336 -4.070 930 2HD2 ASN 143 HD2 ASN 143 -1.132 7.324 -5.197 931 H LYS 144 HN LYS 144 -4.107 6.499 -0.056 932 HA LYS 144 HA LYS 144 -6.149 8.183 0.879 933 1HB LYS 144 HB2 LYS 144 -6.330 5.768 0.826 934 2HB LYS 144 HB1 LYS 144 -5.044 5.612 2.007 935 1HG LYS 144 HG2 LYS 144 -6.484 6.754 3.680 936 2HG LYS 144 HG1 LYS 144 -7.775 6.798 2.477 937 1HD LYS 144 HD2 LYS 144 -6.466 4.278 3.468 938 2HD LYS 144 HD1 LYS 144 -7.990 4.923 4.076 939 1HE LYS 144 HE2 LYS 144 -7.447 4.092 1.211 940 2HE LYS 144 HE1 LYS 144 -8.319 3.169 2.434 941 1HZ LYS 144 HZ2 LYS 144 -9.184 5.860 1.548 942 2HZ LYS 144 HZ1 LYS 144 -9.756 4.441 0.860 943 3HZ LYS 144 HZ3 LYS 144 -10.036 4.745 2.486 944 H PHE 145 HN PHE 145 -3.174 7.071 2.438 945 HA PHE 145 HA PHE 145 -3.688 8.666 4.726 946 1HB PHE 145 HB2 PHE 145 -1.433 6.879 3.924 947 2HB PHE 145 HB1 PHE 145 -1.248 7.950 5.306 948 HD1 PHE 145 HD1 PHE 145 -3.346 5.175 3.944 949 HD2 PHE 145 HD2 PHE 145 -2.184 7.406 7.388 950 HE1 PHE 145 HE1 PHE 145 -4.500 3.556 5.389 951 HE2 PHE 145 HE2 PHE 145 -3.346 5.773 8.831 952 HZ PHE 145 HZ PHE 145 -4.501 3.859 7.827 953 H MET 146 HN MET 146 -2.032 9.184 1.788 954 HA MET 146 HA MET 146 -0.364 11.330 2.753 955 1HB MET 146 HB2 MET 146 -1.126 10.778 -0.103 956 2HB MET 146 HB1 MET 146 0.246 11.704 0.481 957 1HG MET 146 HG2 MET 146 1.052 9.517 1.521 958 2HG MET 146 HG1 MET 146 -0.207 8.762 0.572 959 1HE MET 146 HE2 MET 146 3.067 10.492 0.692 960 2HE MET 146 HE1 MET 146 3.517 10.804 -0.989 961 3HE MET 146 HE3 MET 146 2.236 11.752 -0.223 962 H ASN 147 HN ASN 147 -3.464 10.936 1.098 963 HA ASN 147 HA ASN 147 -3.814 13.841 0.973 964 1HB ASN 147 HB2 ASN 147 -2.902 13.029 -1.202 965 2HB ASN 147 HB1 ASN 147 -4.303 11.997 -1.364 966 1HD2 ASN 147 HD2 ASN 147 -3.352 14.066 -3.147 967 2HD2 ASN 147 HD2 ASN 147 -4.615 15.219 -3.297 968 H VAL 148 HN VAL 148 -5.522 11.238 -0.154 969 HA VAL 148 HA VAL 148 -7.988 12.393 0.897 970 HB VAL 148 HB VAL 148 -9.182 10.472 -0.240 971 1HG1 VAL 148 2HG1 VAL 148 -7.667 12.577 -1.840 972 2HG1 VAL 148 1HG1 VAL 148 -9.101 11.729 -2.430 973 3HG1 VAL 148 3HG1 VAL 148 -9.222 12.808 -1.042 974 1HG2 VAL 148 1HG2 VAL 148 -7.284 9.080 -0.650 975 2HG2 VAL 148 3HG2 VAL 148 -7.989 9.532 -2.211 976 3HG2 VAL 148 2HG2 VAL 148 -6.517 10.334 -1.626 977 H LYS 149 HN LYS 149 -7.977 12.147 2.822 978 HA LYS 149 HA LYS 149 -7.563 9.616 4.145 979 1HB LYS 149 HB2 LYS 149 -8.230 12.305 5.325 980 2HB LYS 149 HB1 LYS 149 -7.574 10.931 6.193 981 1HG LYS 149 HG2 LYS 149 -5.468 11.128 5.133 982 2HG LYS 149 HG1 LYS 149 -6.101 12.249 3.929 983 1HD LYS 149 HD2 LYS 149 -5.828 12.819 6.889 984 2HD LYS 149 HD1 LYS 149 -4.746 13.404 5.625 985 1HE LYS 149 HE2 LYS 149 -6.690 14.557 4.575 986 2HE LYS 149 HE1 LYS 149 -7.675 14.067 5.949 987 1HZ LYS 149 HZ1 LYS 149 -6.079 15.308 7.381 988 2HZ LYS 149 HZ3 LYS 149 -5.356 15.910 5.976 989 3HZ LYS 149 HZ2 LYS 149 -6.956 16.257 6.323 990 H ASP 150 HN ASP 150 -9.983 10.816 2.631 991 HA ASP 150 HA ASP 150 -12.152 10.704 4.499 992 1HB ASP 150 HB2 ASP 150 -12.195 10.753 1.471 993 2HB ASP 150 HB1 ASP 150 -13.609 10.914 2.504 994 H LYS 151 HN LYS 151 -13.457 9.033 4.935 995 HA LYS 151 HA LYS 151 -12.654 6.393 3.975 996 1HB LYS 151 HB2 LYS 151 -14.175 5.555 5.748 997 2HB LYS 151 HB1 LYS 151 -12.994 6.688 6.386 998 1HG LYS 151 HG2 LYS 151 -14.654 8.443 6.366 999 2HG LYS 151 HG1 LYS 151 -15.869 7.320 5.736 1000 1HD LYS 151 HD2 LYS 151 -15.560 5.971 7.799 1001 2HD LYS 151 HD1 LYS 151 -14.440 7.196 8.393 1002 1HE LYS 151 HE2 LYS 151 -17.342 7.642 7.696 1003 2HE LYS 151 HE1 LYS 151 -16.681 7.524 9.323 1004 1HZ LYS 151 HZ3 LYS 151 -15.982 9.644 7.342 1005 2HZ LYS 151 HZ2 LYS 151 -17.049 9.809 8.626 1006 3HZ LYS 151 HZ1 LYS 151 -15.415 9.534 8.930 1007 H VAL 152 HN VAL 152 -14.004 8.309 2.278 1008 HA VAL 152 HA VAL 152 -16.700 7.457 1.993 1009 HB VAL 152 HB VAL 152 -16.800 8.959 0.005 1010 1HG1 VAL 152 2HG1 VAL 152 -15.703 10.155 2.534 1011 2HG1 VAL 152 1HG1 VAL 152 -16.549 11.054 1.272 1012 3HG1 VAL 152 3HG1 VAL 152 -17.390 9.795 2.174 1013 1HG2 VAL 152 1HG2 VAL 152 -13.936 9.608 0.731 1014 2HG2 VAL 152 3HG2 VAL 152 -14.482 8.835 -0.758 1015 3HG2 VAL 152 2HG2 VAL 152 -14.924 10.508 -0.420 1016 H HIS 153 HN HIS 153 -16.823 5.447 1.557 1017 HA HIS 153 HA HIS 153 -16.134 4.576 -1.165 1018 1HB HIS 153 HB2 HIS 153 -15.864 2.928 1.378 1019 2HB HIS 153 HB1 HIS 153 -15.789 2.248 -0.237 1020 HD1 HIS 153 HD1 HIS 153 -13.509 2.351 -1.414 1021 HD2 HIS 153 HD2 HIS 153 -13.632 4.548 2.108 1022 HE1 HIS 153 HE1 HIS 153 -11.136 2.965 -0.906 1023 H LYS 154 HN LYS 154 -18.448 5.654 0.475 1024 HA LYS 154 HA LYS 154 -20.477 3.768 -0.381 1025 1HB LYS 154 HB2 LYS 154 -20.442 4.986 2.418 1026 2HB LYS 154 HB1 LYS 154 -21.763 4.083 1.723 1027 1HG LYS 154 HG2 LYS 154 -20.765 2.578 3.197 1028 2HG LYS 154 HG1 LYS 154 -20.138 2.102 1.627 1029 1HD LYS 154 HD2 LYS 154 -18.349 2.043 3.247 1030 2HD LYS 154 HD1 LYS 154 -18.051 3.371 2.129 1031 1HE LYS 154 HE2 LYS 154 -18.869 4.971 3.762 1032 2HE LYS 154 HE1 LYS 154 -19.307 3.666 4.865 1033 1HZ LYS 154 HZ2 LYS 154 -16.938 3.104 5.019 1034 2HZ LYS 154 HZ1 LYS 154 -16.517 4.421 4.054 1035 3HZ LYS 154 HZ3 LYS 154 -17.265 4.640 5.547 1036 H LEU 155 HN LEU 155 -22.031 4.907 -1.382 1037 HA LEU 155 HA LEU 155 -23.217 6.545 -2.272 1038 1HB LEU 155 HB2 LEU 155 -22.820 7.436 0.469 1039 2HB LEU 155 HB1 LEU 155 -23.619 8.584 -0.615 1040 HG LEU 155 HG LEU 155 -25.329 6.692 -0.987 1041 1HD1 LEU 155 HD1 LEU 155 -24.019 4.833 -0.159 1042 2HD1 LEU 155 HD1 LEU 155 -23.998 5.544 1.454 1043 3HD1 LEU 155 HD1 LEU 155 -25.522 4.998 0.749 1044 1HD2 LEU 155 HD2 LEU 155 -25.075 7.892 1.762 1045 2HD2 LEU 155 HD2 LEU 155 -25.846 8.633 0.359 1046 3HD2 LEU 155 HD2 LEU 155 -26.542 7.185 1.086 1047 H GLU 156 HN GLU 156 -22.380 7.506 -3.955 1048 HA GLU 156 HA GLU 156 -20.350 9.561 -3.497 1049 1HB GLU 156 HB2 GLU 156 -19.446 7.608 -4.646 1050 2HB GLU 156 HB1 GLU 156 -20.706 7.719 -5.861 1051 1HG GLU 156 HG2 GLU 156 -18.574 8.564 -6.661 1052 2HG GLU 156 HG1 GLU 156 -19.799 9.833 -6.629 1053 H HIS 157 HN HIS 157 -21.318 11.437 -3.630 1054 HA HIS 157 HA HIS 157 -22.530 13.174 -4.255 1055 1HB HIS 157 HB2 HIS 157 -22.030 11.949 -6.947 1056 2HB HIS 157 HB1 HIS 157 -23.047 13.372 -6.807 1057 HD1 HIS 157 HD1 HIS 157 -19.424 12.278 -6.226 1058 HD2 HIS 157 HD2 HIS 157 -21.740 15.726 -6.470 1059 HE1 HIS 157 HE1 HIS 157 -17.822 14.176 -6.437 1060 H HIS 158 HN HIS 158 -24.118 11.315 -6.730 1061 HA HIS 158 HA HIS 158 -26.572 11.488 -5.117 1062 1HB HIS 158 HB2 HIS 158 -26.283 11.556 -8.139 1063 2HB HIS 158 HB1 HIS 158 -27.815 11.458 -7.285 1064 HD1 HIS 158 HD1 HIS 158 -28.873 13.667 -6.614 1065 HD2 HIS 158 HD2 HIS 158 -24.873 14.025 -7.680 1066 HE1 HIS 158 HE1 HIS 158 -28.375 16.119 -6.621 1067 H HIS 159 HN HIS 159 -24.699 9.659 -7.398 1068 HA HIS 159 HA HIS 159 -24.371 7.549 -7.807 1069 1HB HIS 159 HB2 HIS 159 -24.181 7.350 -5.306 1070 2HB HIS 159 HB1 HIS 159 -25.879 6.913 -5.250 1071 HD1 HIS 159 HD1 HIS 159 -22.495 5.546 -6.184 1072 HD2 HIS 159 HD2 HIS 159 -26.457 4.305 -6.052 1073 HE1 HIS 159 HE1 HIS 159 -22.443 3.050 -6.343 1074 H HIS 160 HN HIS 160 -27.544 7.065 -6.307 1075 HA HIS 160 HA HIS 160 -29.415 6.038 -7.039 1076 1HB HIS 160 HB2 HIS 160 -28.831 7.750 -9.459 1077 2HB HIS 160 HB1 HIS 160 -30.315 6.817 -9.304 1078 HD1 HIS 160 HD1 HIS 160 -32.205 8.307 -8.547 1079 HD2 HIS 160 HD2 HIS 160 -28.538 9.518 -7.024 1080 HE1 HIS 160 HE1 HIS 160 -32.666 10.371 -7.191 1081 H HIS 161 HN HIS 161 -28.073 6.002 -10.291 1082 HA HIS 161 HA HIS 161 -28.238 3.084 -10.208 1083 1HB HIS 161 HB2 HIS 161 -29.562 4.185 -11.991 1084 2HB HIS 161 HB1 HIS 161 -28.112 4.980 -12.580 1085 HD1 HIS 161 HD1 HIS 161 -26.768 3.715 -14.319 1086 HD2 HIS 161 HD2 HIS 161 -29.509 1.306 -12.323 1087 HE1 HIS 161 HE1 HIS 161 -26.724 1.477 -15.489 1088 H HIS 162 HN HIS 162 -26.423 1.883 -10.584 1089 HA HIS 162 HA HIS 162 -23.939 3.375 -10.897 1090 1HB HIS 162 HB2 HIS 162 -24.312 2.509 -8.567 1091 2HB HIS 162 HB1 HIS 162 -24.347 0.881 -9.229 1092 HD1 HIS 162 HD1 HIS 162 -21.944 3.840 -9.250 1093 HD2 HIS 162 HD2 HIS 162 -21.924 -0.310 -9.174 1094 HE1 HIS 162 HE1 HIS 162 -19.557 3.176 -9.015 No H/Q in entry = 1094 Start of MODEL 18 1 H1 MET 1 HT2 MET 1 20.226 -17.256 0.911 2 H2 MET 1 HT1 MET 1 19.867 -17.476 -0.663 3 H3 MET 1 HT3 MET 1 21.276 -16.625 -0.260 4 HA MET 1 HA MET 1 19.973 -14.836 0.665 5 1HB MET 1 HB2 MET 1 18.670 -15.711 -1.935 6 2HB MET 1 HB1 MET 1 18.557 -14.114 -1.220 7 1HG MET 1 HG2 MET 1 20.940 -13.785 -1.549 8 2HG MET 1 HG1 MET 1 21.080 -15.405 -2.227 9 1HE MET 1 HE3 MET 1 19.572 -11.837 -2.649 10 2HE MET 1 HE2 MET 1 18.745 -11.934 -4.202 11 3HE MET 1 HE1 MET 1 18.118 -12.816 -2.805 12 H GLU 2 HN GLU 2 17.640 -17.084 -0.854 13 HA GLU 2 HA GLU 2 15.734 -18.014 -0.119 14 1HB GLU 2 HB2 GLU 2 16.909 -17.380 2.582 15 2HB GLU 2 HB1 GLU 2 15.406 -18.264 2.375 16 1HG GLU 2 HG2 GLU 2 17.290 -19.765 2.831 17 2HG GLU 2 HG1 GLU 2 16.604 -20.066 1.242 18 H MET 3 HN MET 3 13.791 -17.521 1.472 19 HA MET 3 HA MET 3 12.871 -15.043 0.340 20 1HB MET 3 HB2 MET 3 11.423 -17.061 2.067 21 2HB MET 3 HB1 MET 3 10.675 -15.683 1.268 22 1HG MET 3 HG2 MET 3 11.227 -16.612 -0.901 23 2HG MET 3 HG1 MET 3 12.052 -17.965 -0.134 24 1HE MET 3 HE3 MET 3 10.674 -19.700 -1.515 25 2HE MET 3 HE2 MET 3 8.912 -19.700 -1.634 26 3HE MET 3 HE1 MET 3 9.849 -18.382 -2.343 27 H GLY 4 HN GLY 4 14.174 -16.093 3.227 28 1HA GLY 4 HA1 GLY 4 14.470 -15.087 5.314 29 2HA GLY 4 HA2 GLY 4 12.943 -14.269 5.034 30 H GLN 5 HN GLN 5 16.108 -14.170 3.426 31 HA GLN 5 HA GLN 5 16.613 -11.502 4.262 32 1HB GLN 5 HB2 GLN 5 17.872 -13.179 2.129 33 2HB GLN 5 HB1 GLN 5 18.415 -11.542 2.496 34 1HG GLN 5 HG2 GLN 5 18.390 -13.886 4.380 35 2HG GLN 5 HG1 GLN 5 19.810 -13.165 3.620 36 1HE2 GLN 5 1HE2 GLN 5 19.176 -13.482 6.424 37 2HE2 GLN 5 2HE2 GLN 5 19.237 -11.911 7.136 38 H LEU 6 HN LEU 6 15.022 -12.873 1.547 39 HA LEU 6 HA LEU 6 14.927 -10.543 -0.038 40 1HB LEU 6 HB2 LEU 6 14.490 -12.834 -0.889 41 2HB LEU 6 HB1 LEU 6 13.068 -12.937 0.110 42 HG LEU 6 HG LEU 6 12.720 -12.611 -2.385 43 1HD1 LEU 6 HD1 LEU 6 11.428 -10.645 -0.529 44 2HD1 LEU 6 HD1 LEU 6 10.841 -11.101 -2.128 45 3HD1 LEU 6 HD1 LEU 6 10.916 -12.301 -0.836 46 1HD2 LEU 6 HD2 LEU 6 14.429 -10.917 -2.783 47 2HD2 LEU 6 HD2 LEU 6 12.830 -10.318 -3.233 48 3HD2 LEU 6 HD2 LEU 6 13.569 -9.797 -1.721 49 H LYS 7 HN LYS 7 12.720 -11.932 2.363 50 HA LYS 7 HA LYS 7 10.845 -9.843 2.383 51 1HB LYS 7 HB2 LYS 7 11.316 -12.241 3.851 52 2HB LYS 7 HB1 LYS 7 10.973 -10.944 4.987 53 1HG LYS 7 HG2 LYS 7 9.333 -11.578 2.595 54 2HG LYS 7 HG1 LYS 7 8.978 -12.237 4.196 55 1HD LYS 7 HD2 LYS 7 9.129 -9.275 3.539 56 2HD LYS 7 HD1 LYS 7 7.623 -10.189 3.538 57 1HE LYS 7 HE2 LYS 7 9.456 -9.967 5.915 58 2HE LYS 7 HE1 LYS 7 8.112 -8.867 5.625 59 1HZ LYS 7 HZ1 LYS 7 7.843 -11.823 5.953 60 2HZ LYS 7 HZ3 LYS 7 7.593 -10.694 7.163 61 3HZ LYS 7 HZ2 LYS 7 6.582 -10.713 5.815 62 H ASN 8 HN ASN 8 13.812 -10.348 4.097 63 HA ASN 8 HA ASN 8 13.673 -8.268 5.943 64 1HB ASN 8 HB2 ASN 8 15.386 -10.076 5.947 65 2HB ASN 8 HB1 ASN 8 16.119 -9.351 4.524 66 1HD2 ASN 8 HD2 ASN 8 18.053 -9.173 5.645 67 2HD2 ASN 8 HD2 ASN 8 18.314 -7.935 6.812 68 H LYS 9 HN LYS 9 14.688 -8.299 2.566 69 HA LYS 9 HA LYS 9 15.371 -5.527 2.551 70 1HB LYS 9 HB2 LYS 9 15.045 -7.539 0.331 71 2HB LYS 9 HB1 LYS 9 15.535 -5.865 0.061 72 1HG LYS 9 HG2 LYS 9 17.484 -6.188 1.473 73 2HG LYS 9 HG1 LYS 9 16.967 -7.838 1.812 74 1HD LYS 9 HD2 LYS 9 17.299 -8.466 -0.479 75 2HD LYS 9 HD1 LYS 9 17.643 -6.793 -0.927 76 1HE LYS 9 HE2 LYS 9 19.711 -8.095 -0.704 77 2HE LYS 9 HE1 LYS 9 19.620 -6.794 0.476 78 1HZ LYS 9 HZ3 LYS 9 18.964 -8.400 2.156 79 2HZ LYS 9 HZ2 LYS 9 19.063 -9.670 1.030 80 3HZ LYS 9 HZ1 LYS 9 20.430 -8.822 1.467 81 H ILE 10 HN ILE 10 12.550 -7.408 1.622 82 HA ILE 10 HA ILE 10 10.975 -5.376 0.512 83 HB ILE 10 HB ILE 10 10.161 -7.769 2.197 84 1HG1 ILE 10 2HG1 ILE 10 10.019 -7.265 -0.773 85 2HG1 ILE 10 1HG1 ILE 10 11.160 -8.330 0.041 86 1HG2 ILE 10 3HG2 ILE 10 8.394 -6.115 2.424 87 2HG2 ILE 10 2HG2 ILE 10 8.301 -5.951 0.667 88 3HG2 ILE 10 1HG2 ILE 10 7.866 -7.480 1.436 89 1HD1 ILE 10 HD1 ILE 10 9.280 -9.760 0.730 90 2HD1 ILE 10 HD1 ILE 10 8.172 -8.691 -0.137 91 3HD1 ILE 10 HD1 ILE 10 9.405 -9.595 -1.019 92 H GLU 11 HN GLU 11 11.249 -6.402 3.873 93 HA GLU 11 HA GLU 11 9.633 -4.497 5.126 94 1HB GLU 11 HB2 GLU 11 12.125 -5.901 6.042 95 2HB GLU 11 HB1 GLU 11 11.146 -4.883 7.088 96 1HG GLU 11 HG2 GLU 11 10.197 -7.365 5.672 97 2HG GLU 11 HG1 GLU 11 10.638 -7.250 7.377 98 H ASN 12 HN ASN 12 13.053 -4.386 4.432 99 HA ASN 12 HA ASN 12 13.709 -1.923 5.533 100 1HB ASN 12 HB2 ASN 12 15.306 -3.624 4.691 101 2HB ASN 12 HB1 ASN 12 14.856 -3.216 3.046 102 1HD2 ASN 12 HD2 ASN 12 17.445 -3.173 4.290 103 2HD2 ASN 12 HD2 ASN 12 18.049 -1.568 4.170 104 H LYS 13 HN LYS 13 12.765 -2.664 2.193 105 HA LYS 13 HA LYS 13 12.914 0.040 1.347 106 1HB LYS 13 HB2 LYS 13 13.127 -2.101 -0.068 107 2HB LYS 13 HB1 LYS 13 11.378 -2.137 -0.051 108 1HG LYS 13 HG2 LYS 13 12.211 -1.145 -2.114 109 2HG LYS 13 HG1 LYS 13 11.296 0.033 -1.174 110 1HD LYS 13 HD2 LYS 13 13.288 1.071 -2.071 111 2HD LYS 13 HD1 LYS 13 13.433 0.983 -0.323 112 1HE LYS 13 HE2 LYS 13 15.541 0.387 -1.138 113 2HE LYS 13 HE1 LYS 13 14.801 -1.152 -0.747 114 1HZ LYS 13 HZ3 LYS 13 14.244 -1.396 -3.162 115 2HZ LYS 13 HZ2 LYS 13 15.050 0.057 -3.449 116 3HZ LYS 13 HZ1 LYS 13 15.903 -1.266 -2.874 117 H LYS 14 HN LYS 14 10.273 -2.023 2.437 118 HA LYS 14 HA LYS 14 8.047 -0.466 2.006 119 1HB LYS 14 HB2 LYS 14 8.137 -2.824 2.862 120 2HB LYS 14 HB1 LYS 14 8.718 -2.195 4.391 121 1HG LYS 14 HG2 LYS 14 6.583 -0.956 4.633 122 2HG LYS 14 HG1 LYS 14 6.019 -1.717 3.148 123 1HD LYS 14 HD2 LYS 14 5.120 -3.005 4.954 124 2HD LYS 14 HD1 LYS 14 6.439 -3.950 4.258 125 1HE LYS 14 HE2 LYS 14 7.923 -3.115 6.063 126 2HE LYS 14 HE1 LYS 14 6.541 -2.262 6.739 127 1HZ LYS 14 HZ3 LYS 14 5.453 -4.550 7.018 128 2HZ LYS 14 HZ2 LYS 14 6.930 -5.193 6.510 129 3HZ LYS 14 HZ1 LYS 14 6.881 -4.302 7.882 130 H LYS 15 HN LYS 15 10.299 -0.582 4.756 131 HA LYS 15 HA LYS 15 9.007 1.459 6.229 132 1HB LYS 15 HB2 LYS 15 11.780 0.323 6.482 133 2HB LYS 15 HB1 LYS 15 11.058 1.443 7.630 134 1HG LYS 15 HG2 LYS 15 9.306 -0.155 8.130 135 2HG LYS 15 HG1 LYS 15 9.937 -1.257 6.916 136 1HD LYS 15 HD2 LYS 15 10.726 -2.120 8.900 137 2HD LYS 15 HD1 LYS 15 12.098 -1.230 8.274 138 1HE LYS 15 HE2 LYS 15 10.200 -0.208 10.414 139 2HE LYS 15 HE1 LYS 15 11.788 -0.879 10.720 140 1HZ LYS 15 HZ3 LYS 15 12.693 1.035 9.369 141 2HZ LYS 15 HZ2 LYS 15 11.122 1.682 9.367 142 3HZ LYS 15 HZ1 LYS 15 11.922 1.475 10.800 143 H GLU 16 HN GLU 16 11.663 1.487 3.945 144 HA GLU 16 HA GLU 16 12.524 4.131 4.176 145 1HB GLU 16 HB2 GLU 16 12.123 2.463 1.682 146 2HB GLU 16 HB1 GLU 16 12.975 3.997 1.710 147 1HG GLU 16 HG2 GLU 16 13.795 1.566 3.269 148 2HG GLU 16 HG1 GLU 16 14.424 1.995 1.679 149 H LEU 17 HN LEU 17 9.831 2.751 2.446 150 HA LEU 17 HA LEU 17 8.917 5.201 1.385 151 1HB LEU 17 HB2 LEU 17 8.422 3.308 0.115 152 2HB LEU 17 HB1 LEU 17 7.886 2.398 1.499 153 HG LEU 17 HG LEU 17 6.112 3.008 -0.164 154 1HD1 LEU 17 HD1 LEU 17 5.603 2.216 1.932 155 2HD1 LEU 17 HD1 LEU 17 5.625 3.846 2.598 156 3HD1 LEU 17 HD1 LEU 17 4.416 3.409 1.371 157 1HD2 LEU 17 HD2 LEU 17 6.505 5.763 0.935 158 2HD2 LEU 17 HD2 LEU 17 6.804 5.245 -0.727 159 3HD2 LEU 17 HD2 LEU 17 5.159 5.236 -0.083 160 H ILE 18 HN ILE 18 7.999 3.217 4.144 161 HA ILE 18 HA ILE 18 5.755 4.664 4.818 162 HB ILE 18 HB ILE 18 7.601 3.182 6.727 163 1HG1 ILE 18 2HG1 ILE 18 4.934 2.296 5.633 164 2HG1 ILE 18 1HG1 ILE 18 6.437 1.894 4.820 165 1HG2 ILE 18 2HG2 ILE 18 4.784 4.217 7.143 166 2HG2 ILE 18 1HG2 ILE 18 5.636 3.149 8.266 167 3HG2 ILE 18 3HG2 ILE 18 6.224 4.781 7.958 168 1HD1 ILE 18 HD1 ILE 18 5.725 1.147 7.647 169 2HD1 ILE 18 HD1 ILE 18 5.630 0.082 6.233 170 3HD1 ILE 18 HD1 ILE 18 7.188 0.704 6.764 171 H GLN 19 HN GLN 19 9.139 5.086 5.795 172 HA GLN 19 HA GLN 19 8.741 7.272 7.512 173 1HB GLN 19 HB2 GLN 19 11.178 6.485 5.903 174 2HB GLN 19 HB1 GLN 19 11.168 7.722 7.151 175 1HG GLN 19 HG2 GLN 19 10.544 6.062 8.825 176 2HG GLN 19 HG1 GLN 19 10.474 4.821 7.582 177 1HE2 GLN 19 1HE2 GLN 19 12.963 7.298 7.672 178 2HE2 GLN 19 2HE2 GLN 19 14.247 6.232 8.109 179 H LEU 20 HN LEU 20 9.114 7.060 4.059 180 HA LEU 20 HA LEU 20 9.312 9.828 3.534 181 1HB LEU 20 HB2 LEU 20 8.755 7.407 1.923 182 2HB LEU 20 HB1 LEU 20 8.169 8.934 1.316 183 HG LEU 20 HG LEU 20 10.322 9.812 0.976 184 1HD1 LEU 20 HD1 LEU 20 11.441 7.507 2.540 185 2HD1 LEU 20 HD1 LEU 20 12.348 8.774 1.696 186 3HD1 LEU 20 HD1 LEU 20 11.348 9.197 3.089 187 1HD2 LEU 20 HD2 LEU 20 10.390 6.882 0.330 188 2HD2 LEU 20 HD2 LEU 20 9.718 8.175 -0.667 189 3HD2 LEU 20 HD2 LEU 20 11.454 8.102 -0.352 190 H VAL 21 HN VAL 21 6.308 7.660 3.233 191 HA VAL 21 HA VAL 21 4.696 9.851 2.860 192 HB VAL 21 HB VAL 21 2.861 8.504 3.297 193 1HG1 VAL 21 2HG1 VAL 21 4.980 6.829 2.137 194 2HG1 VAL 21 1HG1 VAL 21 3.242 6.486 2.028 195 3HG1 VAL 21 3HG1 VAL 21 3.893 7.960 1.288 196 1HG2 VAL 21 1HG2 VAL 21 4.614 6.536 4.695 197 2HG2 VAL 21 3HG2 VAL 21 3.362 7.584 5.396 198 3HG2 VAL 21 2HG2 VAL 21 2.901 6.305 4.261 199 H ALA 22 HN ALA 22 5.945 8.515 5.798 200 HA ALA 22 HA ALA 22 4.235 9.682 7.650 201 1HB ALA 22 HB2 ALA 22 7.147 9.029 7.941 202 2HB ALA 22 HB1 ALA 22 5.985 9.220 9.275 203 3HB ALA 22 HB3 ALA 22 5.806 7.902 8.107 204 H ARG 23 HN ARG 23 7.304 10.833 6.343 205 HA ARG 23 HA ARG 23 7.257 13.245 7.817 206 1HB ARG 23 HB2 ARG 23 9.113 13.996 6.371 207 2HB ARG 23 HB1 ARG 23 9.392 12.447 7.150 208 1HG ARG 23 HG2 ARG 23 8.752 11.358 5.010 209 2HG ARG 23 HG1 ARG 23 8.659 12.973 4.304 210 1HD ARG 23 HD2 ARG 23 10.818 11.872 3.863 211 2HD ARG 23 HD1 ARG 23 10.984 13.375 4.776 212 HE ARG 23 HE ARG 23 10.833 11.414 6.666 213 1HH1 ARG 23 1HH1 ARG 23 12.952 12.018 3.913 214 2HH1 ARG 23 2HH1 ARG 23 14.323 11.328 4.660 215 1HH2 ARG 23 1HH2 ARG 23 12.733 10.464 7.684 216 2HH2 ARG 23 2HH2 ARG 23 14.191 10.430 6.807 217 H HIS 24 HN HIS 24 5.695 12.347 4.953 218 HA HIS 24 HA HIS 24 5.214 14.764 3.687 219 1HB HIS 24 HB2 HIS 24 4.385 12.777 2.664 220 2HB HIS 24 HB1 HIS 24 3.480 12.321 4.087 221 HD1 HIS 24 HD1 HIS 24 1.024 13.046 4.153 222 HD2 HIS 24 HD2 HIS 24 3.183 14.905 1.146 223 HE1 HIS 24 HE1 HIS 24 -0.649 14.323 2.785 224 H GLY 25 HN GLY 25 3.828 13.461 6.652 225 1HA GLY 25 HA1 GLY 25 1.903 15.633 6.784 226 2HA GLY 25 HA2 GLY 25 3.205 15.685 7.968 227 H LEU 26 HN LEU 26 2.334 12.479 7.160 228 HA LEU 26 HA LEU 26 0.155 11.987 8.673 229 1HB LEU 26 HB2 LEU 26 2.508 10.442 7.857 230 2HB LEU 26 HB1 LEU 26 1.422 9.732 9.035 231 HG LEU 26 HG LEU 26 -0.398 10.088 7.387 232 1HD1 LEU 26 HD1 LEU 26 0.532 11.761 6.010 233 2HD1 LEU 26 HD1 LEU 26 1.807 10.665 5.460 234 3HD1 LEU 26 HD1 LEU 26 0.114 10.322 5.064 235 1HD2 LEU 26 HD2 LEU 26 1.887 8.267 6.754 236 2HD2 LEU 26 HD2 LEU 26 0.468 7.940 7.746 237 3HD2 LEU 26 HD2 LEU 26 0.296 8.124 6.001 238 H ASP 27 HN ASP 27 -0.236 11.558 10.620 239 HA ASP 27 HA ASP 27 1.548 12.303 12.759 240 1HB ASP 27 HB2 ASP 27 -1.233 11.161 12.710 241 2HB ASP 27 HB1 ASP 27 -0.343 11.286 14.213 242 H HIS 28 HN HIS 28 1.980 10.859 14.544 243 HA HIS 28 HA HIS 28 3.375 8.576 13.747 244 1HB HIS 28 HB2 HIS 28 2.362 9.401 16.470 245 2HB HIS 28 HB1 HIS 28 3.467 8.056 16.202 246 HD1 HIS 28 HD1 HIS 28 3.357 11.834 16.238 247 HD2 HIS 28 HD2 HIS 28 6.048 8.740 15.590 248 HE1 HIS 28 HE1 HIS 28 5.649 12.898 16.165 249 H ASP 29 HN ASP 29 0.146 8.950 15.079 250 HA ASP 29 HA ASP 29 -0.469 6.224 15.332 251 1HB ASP 29 HB2 ASP 29 -2.220 8.666 15.034 252 2HB ASP 29 HB1 ASP 29 -2.856 7.052 15.330 253 H LYS 30 HN LYS 30 -0.691 8.504 12.716 254 HA LYS 30 HA LYS 30 -2.227 6.891 10.944 255 1HB LYS 30 HB2 LYS 30 -0.325 9.164 10.437 256 2HB LYS 30 HB1 LYS 30 -1.229 8.375 9.163 257 1HG LYS 30 HG2 LYS 30 -2.451 9.801 11.517 258 2HG LYS 30 HG1 LYS 30 -2.197 10.493 9.913 259 1HD LYS 30 HD2 LYS 30 -3.648 8.709 8.965 260 2HD LYS 30 HD1 LYS 30 -3.975 8.152 10.609 261 1HE LYS 30 HE2 LYS 30 -4.894 10.352 11.160 262 2HE LYS 30 HE1 LYS 30 -4.569 10.895 9.518 263 1HZ LYS 30 HZ1 LYS 30 -6.117 9.208 8.705 264 2HZ LYS 30 HZ3 LYS 30 -6.402 8.698 10.279 265 3HZ LYS 30 HZ2 LYS 30 -6.881 10.240 9.796 266 H VAL 31 HN VAL 31 1.219 7.312 11.554 267 HA VAL 31 HA VAL 31 2.134 5.764 9.405 268 HB VAL 31 HB VAL 31 3.483 6.363 12.073 269 1HG1 VAL 31 3HG1 VAL 31 4.702 5.358 9.511 270 2HG1 VAL 31 2HG1 VAL 31 5.581 5.842 10.962 271 3HG1 VAL 31 1HG1 VAL 31 4.519 4.435 11.002 272 1HG2 VAL 31 3HG2 VAL 31 3.684 7.695 9.387 273 2HG2 VAL 31 2HG2 VAL 31 2.903 8.351 10.822 274 3HG2 VAL 31 1HG2 VAL 31 4.650 8.093 10.807 275 H LEU 32 HN LEU 32 1.274 4.971 12.706 276 HA LEU 32 HA LEU 32 1.896 2.188 12.740 277 1HB LEU 32 HB2 LEU 32 -0.404 3.597 14.052 278 2HB LEU 32 HB1 LEU 32 0.228 2.021 14.479 279 HG LEU 32 HG LEU 32 1.682 4.641 14.782 280 1HD1 LEU 32 HD1 LEU 32 -0.175 4.351 16.304 281 2HD1 LEU 32 HD1 LEU 32 0.471 2.785 16.788 282 3HD1 LEU 32 HD1 LEU 32 1.370 4.258 17.160 283 1HD2 LEU 32 HD2 LEU 32 3.203 2.796 14.301 284 2HD2 LEU 32 HD2 LEU 32 3.352 3.324 15.974 285 3HD2 LEU 32 HD2 LEU 32 2.472 1.844 15.595 286 H LEU 33 HN LEU 33 -1.047 3.853 11.841 287 HA LEU 33 HA LEU 33 -2.511 1.546 11.160 288 1HB LEU 33 HB2 LEU 33 -2.792 4.378 10.165 289 2HB LEU 33 HB1 LEU 33 -3.980 3.105 9.964 290 HG LEU 33 HG LEU 33 -3.093 4.133 12.655 291 1HD1 LEU 33 HD1 LEU 33 -5.512 4.909 11.027 292 2HD1 LEU 33 HD1 LEU 33 -5.197 5.370 12.706 293 3HD1 LEU 33 HD1 LEU 33 -4.135 5.941 11.428 294 1HD2 LEU 33 HD2 LEU 33 -5.438 2.456 11.777 295 2HD2 LEU 33 HD2 LEU 33 -4.030 1.890 12.681 296 3HD2 LEU 33 HD2 LEU 33 -5.149 3.040 13.415 297 H PHE 34 HN PHE 34 -0.634 3.806 9.189 298 HA PHE 34 HA PHE 34 -1.154 2.566 6.742 299 1HB PHE 34 HB2 PHE 34 -0.314 4.849 6.857 300 2HB PHE 34 HB1 PHE 34 1.198 4.282 7.563 301 HD1 PHE 34 HD1 PHE 34 -0.894 4.089 4.510 302 HD2 PHE 34 HD2 PHE 34 2.985 3.651 6.188 303 HE1 PHE 34 HE1 PHE 34 0.049 3.820 2.263 304 HE2 PHE 34 HE2 PHE 34 3.924 3.384 3.937 305 HZ PHE 34 HZ PHE 34 2.471 3.465 1.991 306 H SER 35 HN SER 35 1.597 2.174 8.975 307 HA SER 35 HA SER 35 3.029 0.453 7.313 308 1HB SER 35 HB2 SER 35 4.271 -0.187 9.423 309 2HB SER 35 HB1 SER 35 4.210 1.537 9.070 310 HG SER 35 HG SER 35 2.761 1.847 10.616 311 H ARG 36 HN ARG 36 0.583 -0.268 9.748 312 HA ARG 36 HA ARG 36 1.032 -3.072 9.535 313 1HB ARG 36 HB2 ARG 36 -0.934 -3.355 10.933 314 2HB ARG 36 HB1 ARG 36 0.138 -2.130 11.594 315 1HG ARG 36 HG2 ARG 36 -1.373 -0.410 10.592 316 2HG ARG 36 HG1 ARG 36 -2.478 -1.720 10.177 317 1HD ARG 36 HD2 ARG 36 -1.515 -0.994 12.929 318 2HD ARG 36 HD1 ARG 36 -3.098 -0.624 12.259 319 HE ARG 36 HE ARG 36 -2.474 -3.438 12.220 320 1HH1 ARG 36 1HH1 ARG 36 -3.809 -0.858 14.256 321 2HH1 ARG 36 2HH1 ARG 36 -4.790 -1.911 15.169 322 1HH2 ARG 36 1HH2 ARG 36 -3.881 -4.884 13.520 323 2HH2 ARG 36 2HH2 ARG 36 -4.817 -4.177 14.766 324 H ASP 37 HN ASP 37 -1.265 -0.832 8.072 325 HA ASP 37 HA ASP 37 -2.954 -2.753 6.841 326 1HB ASP 37 HB2 ASP 37 -3.262 -0.177 7.205 327 2HB ASP 37 HB1 ASP 37 -2.345 -0.025 5.724 328 H LEU 38 HN LEU 38 -0.076 -1.040 5.872 329 HA LEU 38 HA LEU 38 0.175 -1.995 3.228 330 1HB LEU 38 HB2 LEU 38 1.302 -0.007 3.919 331 2HB LEU 38 HB1 LEU 38 2.113 -0.845 5.217 332 HG LEU 38 HG LEU 38 3.581 -1.960 3.627 333 1HD1 LEU 38 HD1 LEU 38 2.060 -0.461 1.510 334 2HD1 LEU 38 HD1 LEU 38 3.523 -1.422 1.278 335 3HD1 LEU 38 HD1 LEU 38 2.023 -2.214 1.766 336 1HD2 LEU 38 HD2 LEU 38 3.329 0.992 3.116 337 2HD2 LEU 38 HD2 LEU 38 4.212 0.225 4.439 338 3HD2 LEU 38 HD2 LEU 38 4.746 0.001 2.773 339 H ASP 39 HN ASP 39 1.476 -3.081 6.298 340 HA ASP 39 HA ASP 39 3.126 -5.145 5.361 341 1HB ASP 39 HB2 ASP 39 3.114 -4.182 7.665 342 2HB ASP 39 HB1 ASP 39 1.608 -5.032 7.971 343 H LYS 40 HN LYS 40 -0.250 -5.087 6.323 344 HA LYS 40 HA LYS 40 -0.817 -7.825 5.998 345 1HB LYS 40 HB2 LYS 40 -2.613 -5.410 5.836 346 2HB LYS 40 HB1 LYS 40 -3.177 -7.077 5.852 347 1HG LYS 40 HG2 LYS 40 -2.331 -7.405 8.078 348 2HG LYS 40 HG1 LYS 40 -1.506 -5.851 8.042 349 1HD LYS 40 HD2 LYS 40 -3.522 -5.692 9.387 350 2HD LYS 40 HD1 LYS 40 -3.695 -4.714 7.935 351 1HE LYS 40 HE2 LYS 40 -5.749 -5.926 8.388 352 2HE LYS 40 HE1 LYS 40 -5.006 -6.514 6.903 353 1HZ LYS 40 HZ3 LYS 40 -4.782 -7.850 9.551 354 2HZ LYS 40 HZ2 LYS 40 -5.828 -8.301 8.327 355 3HZ LYS 40 HZ1 LYS 40 -4.169 -8.430 8.090 356 H LEU 41 HN LEU 41 -1.034 -5.091 3.772 357 HA LEU 41 HA LEU 41 -2.245 -6.452 1.635 358 1HB LEU 41 HB2 LEU 41 -2.211 -4.050 1.641 359 2HB LEU 41 HB1 LEU 41 -0.463 -4.019 1.696 360 HG LEU 41 HG LEU 41 -0.341 -4.806 -0.617 361 1HD1 LEU 41 HD1 LEU 41 -2.398 -6.177 -0.627 362 2HD1 LEU 41 HD1 LEU 41 -3.349 -4.682 -0.681 363 3HD1 LEU 41 HD1 LEU 41 -2.261 -5.083 -1.998 364 1HD2 LEU 41 HD2 LEU 41 -2.216 -2.486 -0.253 365 2HD2 LEU 41 HD2 LEU 41 -0.452 -2.420 -0.237 366 3HD2 LEU 41 HD2 LEU 41 -1.313 -2.855 -1.717 367 H ILE 42 HN ILE 42 1.112 -6.025 2.498 368 HA ILE 42 HA ILE 42 2.173 -7.306 0.183 369 HB ILE 42 HB ILE 42 3.442 -6.975 2.930 370 1HG1 ILE 42 2HG1 ILE 42 3.730 -5.355 0.398 371 2HG1 ILE 42 1HG1 ILE 42 2.836 -4.854 1.828 372 1HG2 ILE 42 2HG2 ILE 42 4.711 -7.674 0.273 373 2HG2 ILE 42 1HG2 ILE 42 5.585 -7.351 1.772 374 3HG2 ILE 42 3HG2 ILE 42 4.530 -8.760 1.652 375 1HD1 ILE 42 HD1 ILE 42 5.800 -5.337 1.652 376 2HD1 ILE 42 HD1 ILE 42 4.997 -3.767 1.708 377 3HD1 ILE 42 HD1 ILE 42 4.915 -4.849 3.098 378 H ASN 43 HN ASN 43 1.773 -8.503 3.473 379 HA ASN 43 HA ASN 43 2.465 -11.159 3.076 380 1HB ASN 43 HB2 ASN 43 0.597 -9.882 5.043 381 2HB ASN 43 HB1 ASN 43 0.797 -11.625 5.015 382 1HD2 ASN 43 HD2 ASN 43 2.344 -8.587 5.777 383 2HD2 ASN 43 HD2 ASN 43 3.690 -9.255 6.594 384 H LYS 44 HN LYS 44 -0.592 -9.615 2.449 385 HA LYS 44 HA LYS 44 -2.250 -11.788 1.906 386 1HB LYS 44 HB2 LYS 44 -3.032 -9.508 2.037 387 2HB LYS 44 HB1 LYS 44 -2.090 -9.058 0.631 388 1HG LYS 44 HG2 LYS 44 -3.480 -10.612 -0.740 389 2HG LYS 44 HG1 LYS 44 -4.484 -10.893 0.682 390 1HD LYS 44 HD2 LYS 44 -4.027 -8.208 -0.629 391 2HD LYS 44 HD1 LYS 44 -5.464 -9.205 -0.835 392 1HE LYS 44 HE2 LYS 44 -5.857 -9.059 1.579 393 2HE LYS 44 HE1 LYS 44 -4.477 -7.975 1.734 394 1HZ LYS 44 HZ3 LYS 44 -6.936 -7.422 0.143 395 2HZ LYS 44 HZ2 LYS 44 -6.531 -6.721 1.610 396 3HZ LYS 44 HZ1 LYS 44 -5.602 -6.416 0.263 397 H PHE 45 HN PHE 45 -0.097 -9.988 -0.258 398 HA PHE 45 HA PHE 45 -0.707 -11.693 -2.473 399 1HB PHE 45 HB2 PHE 45 0.914 -9.226 -2.112 400 2HB PHE 45 HB1 PHE 45 1.152 -10.223 -3.547 401 HD1 PHE 45 HD1 PHE 45 -0.373 -10.236 -5.278 402 HD2 PHE 45 HD2 PHE 45 -1.369 -8.294 -1.635 403 HE1 PHE 45 HE1 PHE 45 -2.384 -9.293 -6.330 404 HE2 PHE 45 HE2 PHE 45 -3.370 -7.333 -2.680 405 HZ PHE 45 HZ PHE 45 -3.887 -7.832 -5.026 406 H MET 46 HN MET 46 1.611 -11.645 -0.048 407 HA MET 46 HA MET 46 3.629 -13.129 -1.477 408 1HB MET 46 HB2 MET 46 3.170 -12.883 1.467 409 2HB MET 46 HB1 MET 46 4.638 -13.492 0.710 410 1HG MET 46 HG2 MET 46 4.869 -11.158 -0.307 411 2HG MET 46 HG1 MET 46 3.535 -10.709 0.732 412 1HE MET 46 HE2 MET 46 6.489 -13.145 1.284 413 2HE MET 46 HE1 MET 46 7.274 -11.730 0.574 414 3HE MET 46 HE3 MET 46 7.583 -12.167 2.256 415 H ASN 47 HN ASN 47 0.671 -13.838 0.022 416 HA ASN 47 HA ASN 47 -0.578 -15.695 0.324 417 1HB ASN 47 HB2 ASN 47 0.274 -16.407 -1.920 418 2HB ASN 47 HB1 ASN 47 1.648 -17.172 -1.142 419 1HD2 ASN 47 HD2 ASN 47 1.168 -19.195 -1.949 420 2HD2 ASN 47 HD2 ASN 47 -0.199 -20.111 -1.439 421 H VAL 48 HN VAL 48 1.927 -14.945 1.899 422 HA VAL 48 HA VAL 48 2.455 -17.407 3.284 423 HB VAL 48 HB VAL 48 4.086 -16.213 4.674 424 1HG1 VAL 48 3HG1 VAL 48 4.849 -17.116 2.578 425 2HG1 VAL 48 2HG1 VAL 48 4.414 -15.626 1.741 426 3HG1 VAL 48 1HG1 VAL 48 5.712 -15.618 2.935 427 1HG2 VAL 48 1HG2 VAL 48 3.247 -13.740 3.159 428 2HG2 VAL 48 3HG2 VAL 48 3.076 -14.034 4.888 429 3HG2 VAL 48 2HG2 VAL 48 4.681 -13.849 4.177 430 H LYS 49 HN LYS 49 1.478 -18.067 4.942 431 HA LYS 49 HA LYS 49 -0.311 -16.207 6.238 432 1HB LYS 49 HB2 LYS 49 -0.538 -19.185 5.832 433 2HB LYS 49 HB1 LYS 49 -1.640 -18.260 6.851 434 1HG LYS 49 HG2 LYS 49 -2.384 -16.932 4.998 435 2HG LYS 49 HG1 LYS 49 -1.150 -17.611 3.952 436 1HD LYS 49 HD2 LYS 49 -3.280 -19.296 5.226 437 2HD LYS 49 HD1 LYS 49 -3.532 -18.489 3.679 438 1HE LYS 49 HE2 LYS 49 -1.323 -20.470 4.278 439 2HE LYS 49 HE1 LYS 49 -2.817 -20.841 3.429 440 1HZ LYS 49 HZ3 LYS 49 -2.154 -19.218 1.692 441 2HZ LYS 49 HZ2 LYS 49 -0.677 -18.975 2.470 442 3HZ LYS 49 HZ1 LYS 49 -1.052 -20.469 1.864 443 H ASP 50 HN ASP 50 1.180 -15.411 7.460 444 HA ASP 50 HA ASP 50 2.553 -15.002 9.144 445 1HB ASP 50 HB2 ASP 50 0.537 -16.203 10.359 446 2HB ASP 50 HB1 ASP 50 1.711 -17.492 10.615 447 H LYS 51 HN LYS 51 4.146 -16.417 10.697 448 HA LYS 51 HA LYS 51 5.887 -17.706 8.707 449 1HB LYS 51 HB2 LYS 51 7.751 -16.994 10.076 450 2HB LYS 51 HB1 LYS 51 6.702 -15.617 9.767 451 1HG LYS 51 HG2 LYS 51 5.631 -16.264 12.053 452 2HG LYS 51 HG1 LYS 51 7.142 -17.132 12.305 453 1HD LYS 51 HD2 LYS 51 7.471 -15.017 13.261 454 2HD LYS 51 HD1 LYS 51 8.300 -14.943 11.705 455 1HE LYS 51 HE2 LYS 51 7.018 -12.910 12.032 456 2HE LYS 51 HE1 LYS 51 6.302 -13.843 10.724 457 1HZ LYS 51 HZ3 LYS 51 4.592 -14.665 12.352 458 2HZ LYS 51 HZ2 LYS 51 5.341 -13.723 13.525 459 3HZ LYS 51 HZ1 LYS 51 4.611 -12.975 12.223 460 H VAL 52 HN VAL 52 3.897 -18.357 11.011 461 HA VAL 52 HA VAL 52 5.372 -20.604 12.112 462 HB VAL 52 HB VAL 52 3.529 -20.812 13.833 463 1HG1 VAL 52 1HG1 VAL 52 5.637 -19.690 14.341 464 2HG1 VAL 52 3HG1 VAL 52 4.993 -18.177 13.703 465 3HG1 VAL 52 2HG1 VAL 52 4.298 -18.885 15.158 466 1HG2 VAL 52 1HG2 VAL 52 1.743 -19.627 12.628 467 2HG2 VAL 52 3HG2 VAL 52 2.055 -18.875 14.192 468 3HG2 VAL 52 2HG2 VAL 52 2.669 -18.129 12.718 469 H HIS 53 HN HIS 53 5.241 -21.614 10.105 470 HA HIS 53 HA HIS 53 3.516 -23.770 10.027 471 1HB HIS 53 HB2 HIS 53 1.867 -22.037 9.198 472 2HB HIS 53 HB1 HIS 53 2.953 -21.690 7.859 473 HD1 HIS 53 HD1 HIS 53 2.876 -23.373 5.839 474 HD2 HIS 53 HD2 HIS 53 0.495 -24.468 9.069 475 HE1 HIS 53 HE1 HIS 53 1.403 -25.236 5.020 476 H LYS 54 HN LYS 54 4.356 -25.202 8.421 477 HA LYS 54 HA LYS 54 6.879 -24.293 7.333 478 1HB LYS 54 HB2 LYS 54 5.666 -27.063 7.393 479 2HB LYS 54 HB1 LYS 54 7.264 -26.671 6.782 480 1HG LYS 54 HG2 LYS 54 7.933 -25.903 9.005 481 2HG LYS 54 HG1 LYS 54 6.324 -26.286 9.613 482 1HD LYS 54 HD2 LYS 54 6.654 -28.626 9.084 483 2HD LYS 54 HD1 LYS 54 8.236 -28.266 8.397 484 1HE LYS 54 HE2 LYS 54 8.983 -27.448 10.586 485 2HE LYS 54 HE1 LYS 54 7.405 -27.840 11.258 486 1HZ LYS 54 HZ2 LYS 54 9.264 -29.824 10.055 487 2HZ LYS 54 HZ1 LYS 54 9.050 -29.549 11.709 488 3HZ LYS 54 HZ3 LYS 54 7.786 -30.153 10.786 489 H LEU 55 HN LEU 55 6.151 -22.944 5.757 490 HA LEU 55 HA LEU 55 4.338 -23.814 3.722 491 1HB LEU 55 HB2 LEU 55 6.192 -21.421 3.784 492 2HB LEU 55 HB1 LEU 55 5.078 -21.752 2.478 493 HG LEU 55 HG LEU 55 3.206 -21.533 4.191 494 1HD1 LEU 55 HD1 LEU 55 4.508 -21.797 6.215 495 2HD1 LEU 55 HD1 LEU 55 5.398 -20.317 5.852 496 3HD1 LEU 55 HD1 LEU 55 3.669 -20.245 6.198 497 1HD2 LEU 55 HD2 LEU 55 3.699 -19.817 2.561 498 2HD2 LEU 55 HD2 LEU 55 3.239 -19.105 4.110 499 3HD2 LEU 55 HD2 LEU 55 4.934 -19.142 3.625 500 H GLU 56 HN GLU 56 4.924 -25.436 2.536 501 HA GLU 56 HA GLU 56 5.996 -26.802 1.129 502 1HB GLU 56 HB2 GLU 56 7.426 -24.245 0.406 503 2HB GLU 56 HB1 GLU 56 7.893 -25.766 -0.329 504 1HG GLU 56 HG2 GLU 56 6.405 -24.497 -1.776 505 2HG GLU 56 HG1 GLU 56 5.670 -26.013 -1.284 506 H HIS 57 HN HIS 57 8.777 -24.867 2.063 507 HA HIS 57 HA HIS 57 9.871 -26.790 3.838 508 1HB HIS 57 HB2 HIS 57 10.341 -27.866 1.572 509 2HB HIS 57 HB1 HIS 57 11.231 -26.401 1.169 510 HD1 HIS 57 HD1 HIS 57 11.602 -29.642 2.963 511 HD2 HIS 57 HD2 HIS 57 13.681 -26.065 2.556 512 HE1 HIS 57 HE1 HIS 57 13.919 -30.072 3.828 513 H HIS 58 HN HIS 58 11.173 -25.581 5.149 514 HA HIS 58 HA HIS 58 12.175 -23.106 3.994 515 1HB HIS 58 HB2 HIS 58 10.313 -22.775 5.662 516 2HB HIS 58 HB1 HIS 58 11.332 -23.540 6.870 517 HD1 HIS 58 HD1 HIS 58 12.979 -22.032 8.082 518 HD2 HIS 58 HD2 HIS 58 11.267 -20.250 4.743 519 HE1 HIS 58 HE1 HIS 58 13.674 -19.598 8.140 520 H HIS 59 HN HIS 59 14.261 -22.485 4.728 521 HA HIS 59 HA HIS 59 16.036 -24.678 5.000 522 1HB HIS 59 HB2 HIS 59 17.841 -22.998 5.028 523 2HB HIS 59 HB1 HIS 59 16.703 -22.712 3.719 524 HD1 HIS 59 HD1 HIS 59 18.216 -21.057 6.706 525 HD2 HIS 59 HD2 HIS 59 15.000 -20.453 4.135 526 HE1 HIS 59 HE1 HIS 59 17.443 -18.710 7.089 527 H HIS 60 HN HIS 60 17.311 -25.325 6.628 528 HA HIS 60 HA HIS 60 16.618 -24.482 9.332 529 1HB HIS 60 HB2 HIS 60 16.700 -26.914 8.878 530 2HB HIS 60 HB1 HIS 60 18.350 -26.756 8.294 531 HD1 HIS 60 HD1 HIS 60 16.410 -27.334 11.378 532 HD2 HIS 60 HD2 HIS 60 20.282 -26.238 10.368 533 HE1 HIS 60 HE1 HIS 60 17.796 -27.664 13.447 534 H HIS 61 HN HIS 61 19.437 -24.992 7.247 535 HA HIS 61 HA HIS 61 20.755 -22.692 8.369 536 1HB HIS 61 HB2 HIS 61 21.460 -24.530 9.867 537 2HB HIS 61 HB1 HIS 61 21.982 -25.467 8.474 538 HD1 HIS 61 HD1 HIS 61 22.965 -22.508 10.595 539 HD2 HIS 61 HD2 HIS 61 24.463 -24.788 7.464 540 HE1 HIS 61 HE1 HIS 61 25.390 -21.860 10.346 541 H HIS 62 HN HIS 62 21.535 -21.624 6.674 542 HA HIS 62 HA HIS 62 22.784 -22.968 4.489 543 1HB HIS 62 HB2 HIS 62 20.333 -23.074 3.904 544 2HB HIS 62 HB1 HIS 62 20.281 -21.316 3.982 545 HD1 HIS 62 HD1 HIS 62 20.576 -20.207 1.739 546 HD2 HIS 62 HD2 HIS 62 22.291 -23.983 1.898 547 HE1 HIS 62 HE1 HIS 62 21.480 -20.649 -0.548 548 H1 MET 101 HT2 MET 101 9.335 24.243 1.838 549 H2 MET 101 HT1 MET 101 10.371 24.671 3.116 550 H3 MET 101 HT3 MET 101 10.947 24.386 1.556 551 HA MET 101 HA MET 101 11.452 22.476 2.835 552 1HB MET 101 HB2 MET 101 8.460 22.416 3.331 553 2HB MET 101 HB1 MET 101 9.545 21.089 3.689 554 1HG MET 101 HG2 MET 101 10.721 22.465 5.318 555 2HG MET 101 HG1 MET 101 9.671 23.825 4.929 556 1HE MET 101 HE1 MET 101 7.135 24.013 5.613 557 2HE MET 101 HE3 MET 101 6.794 22.578 4.646 558 3HE MET 101 HE2 MET 101 6.206 22.685 6.304 559 H GLU 102 HN GLU 102 11.679 20.664 1.606 560 HA GLU 102 HA GLU 102 10.408 20.856 -0.969 561 1HB GLU 102 HB2 GLU 102 12.835 20.599 -0.864 562 2HB GLU 102 HB1 GLU 102 12.649 19.081 -0.007 563 1HG GLU 102 HG2 GLU 102 13.170 18.750 -2.378 564 2HG GLU 102 HG1 GLU 102 11.599 18.085 -1.923 565 H MET 103 HN MET 103 8.392 20.085 -0.753 566 HA MET 103 HA MET 103 8.141 17.338 0.221 567 1HB MET 103 HB2 MET 103 6.032 19.498 0.068 568 2HB MET 103 HB1 MET 103 5.673 17.818 0.444 569 1HG MET 103 HG2 MET 103 7.171 17.953 2.390 570 2HG MET 103 HG1 MET 103 7.453 19.650 2.034 571 1HE MET 103 HE1 MET 103 6.479 18.533 4.869 572 2HE MET 103 HE3 MET 103 6.766 20.245 4.550 573 3HE MET 103 HE2 MET 103 5.253 19.726 5.294 574 H GLY 104 HN GLY 104 8.495 18.941 -2.555 575 1HA GLY 104 HA1 GLY 104 7.844 18.563 -4.743 576 2HA GLY 104 HA2 GLY 104 6.581 17.481 -4.153 577 H GLN 105 HN GLN 105 10.107 17.602 -3.808 578 HA GLN 105 HA GLN 105 10.611 15.248 -5.302 579 1HB GLN 105 HB2 GLN 105 12.293 16.499 -3.120 580 2HB GLN 105 HB1 GLN 105 12.806 15.108 -4.056 581 1HG GLN 105 HG2 GLN 105 12.281 17.890 -5.080 582 2HG GLN 105 HG1 GLN 105 13.836 17.072 -4.942 583 1HE2 GLN 105 1HE2 GLN 105 10.973 17.425 -6.763 584 2HE2 GLN 105 2HE2 GLN 105 11.441 16.453 -8.111 585 H LEU 106 HN LEU 106 9.618 15.779 -2.106 586 HA LEU 106 HA LEU 106 10.235 13.335 -0.915 587 1HB LEU 106 HB2 LEU 106 9.585 15.329 0.333 588 2HB LEU 106 HB1 LEU 106 8.013 15.318 -0.412 589 HG LEU 106 HG LEU 106 8.226 14.599 2.043 590 1HD1 LEU 106 HD1 LEU 106 6.770 12.809 0.122 591 2HD1 LEU 106 HD1 LEU 106 6.464 12.932 1.853 592 3HD1 LEU 106 HD1 LEU 106 6.171 14.322 0.806 593 1HD2 LEU 106 HD2 LEU 106 9.199 12.080 0.706 594 2HD2 LEU 106 HD2 LEU 106 10.105 13.101 1.827 595 3HD2 LEU 106 HD2 LEU 106 8.686 12.217 2.388 596 H LYS 107 HN LYS 107 7.312 14.382 -2.654 597 HA LYS 107 HA LYS 107 6.003 11.871 -2.406 598 1HB LYS 107 HB2 LYS 107 5.375 14.458 -3.346 599 2HB LYS 107 HB1 LYS 107 5.035 13.345 -4.661 600 1HG LYS 107 HG2 LYS 107 3.989 12.942 -1.864 601 2HG LYS 107 HG1 LYS 107 3.122 13.848 -3.097 602 1HD LYS 107 HD2 LYS 107 3.991 10.964 -3.420 603 2HD LYS 107 HD1 LYS 107 2.384 11.457 -2.874 604 1HE LYS 107 HE2 LYS 107 2.236 12.789 -5.015 605 2HE LYS 107 HE1 LYS 107 3.706 11.965 -5.529 606 1HZ LYS 107 HZ1 LYS 107 2.524 9.833 -5.299 607 2HZ LYS 107 HZ3 LYS 107 1.142 10.673 -4.823 608 3HZ LYS 107 HZ2 LYS 107 1.729 10.867 -6.376 609 H ASN 108 HN ASN 108 8.071 13.331 -4.769 610 HA ASN 108 HA ASN 108 7.849 11.458 -6.851 611 1HB ASN 108 HB2 ASN 108 8.997 13.663 -7.060 612 2HB ASN 108 HB1 ASN 108 10.271 13.081 -6.003 613 1HD2 ASN 108 HD2 ASN 108 11.823 13.490 -7.580 614 2HD2 ASN 108 HD2 ASN 108 12.002 12.513 -8.984 615 H LYS 109 HN LYS 109 10.007 11.593 -4.042 616 HA LYS 109 HA LYS 109 11.305 9.149 -4.543 617 1HB LYS 109 HB2 LYS 109 10.929 10.673 -1.969 618 2HB LYS 109 HB1 LYS 109 11.893 9.210 -2.098 619 1HG LYS 109 HG2 LYS 109 13.354 10.295 -3.712 620 2HG LYS 109 HG1 LYS 109 12.388 11.767 -3.595 621 1HD LYS 109 HD2 LYS 109 12.946 11.963 -1.230 622 2HD LYS 109 HD1 LYS 109 13.876 10.465 -1.314 623 1HE LYS 109 HE2 LYS 109 15.394 11.460 -2.909 624 2HE LYS 109 HE1 LYS 109 14.444 12.945 -2.923 625 1HZ LYS 109 HZ2 LYS 109 15.939 11.882 -0.567 626 2HZ LYS 109 HZ1 LYS 109 16.394 13.151 -1.570 627 3HZ LYS 109 HZ3 LYS 109 15.027 13.302 -0.624 628 H ILE 110 HN ILE 110 8.519 9.900 -2.479 629 HA ILE 110 HA ILE 110 7.833 7.428 -1.559 630 HB ILE 110 HB ILE 110 6.040 9.655 -2.529 631 1HG1 ILE 110 2HG1 ILE 110 6.689 8.611 0.193 632 2HG1 ILE 110 1HG1 ILE 110 7.495 10.000 -0.552 633 1HG2 ILE 110 3HG2 ILE 110 4.735 7.586 -2.735 634 2HG2 ILE 110 2HG2 ILE 110 5.145 7.159 -1.072 635 3HG2 ILE 110 1HG2 ILE 110 4.143 8.574 -1.395 636 1HD1 ILE 110 HD1 ILE 110 5.315 11.147 -0.563 637 2HD1 ILE 110 HD1 ILE 110 4.611 9.741 0.229 638 3HD1 ILE 110 HD1 ILE 110 5.848 10.689 1.054 639 H GLU 111 HN GLU 111 6.758 8.687 -4.714 640 HA GLU 111 HA GLU 111 5.492 6.323 -5.640 641 1HB GLU 111 HB2 GLU 111 6.918 8.464 -7.225 642 2HB GLU 111 HB1 GLU 111 5.799 7.282 -7.883 643 1HG GLU 111 HG2 GLU 111 5.131 9.397 -5.862 644 2HG GLU 111 HG1 GLU 111 4.730 9.475 -7.570 645 H ASN 112 HN ASN 112 8.757 7.456 -5.976 646 HA ASN 112 HA ASN 112 9.814 5.430 -7.585 647 1HB ASN 112 HB2 ASN 112 11.034 7.483 -7.212 648 2HB ASN 112 HB1 ASN 112 11.085 7.190 -5.482 649 1HD2 ASN 112 HD2 ASN 112 12.592 5.796 -4.663 650 2HD2 ASN 112 HD2 ASN 112 13.870 5.113 -5.571 651 H LYS 113 HN LYS 113 9.626 5.715 -4.086 652 HA LYS 113 HA LYS 113 11.108 3.378 -3.485 653 1HB LYS 113 HB2 LYS 113 10.591 5.535 -2.084 654 2HB LYS 113 HB1 LYS 113 9.156 4.656 -1.616 655 1HG LYS 113 HG2 LYS 113 10.913 4.415 0.043 656 2HG LYS 113 HG1 LYS 113 10.518 2.863 -0.693 657 1HD LYS 113 HD2 LYS 113 12.955 3.205 -0.425 658 2HD LYS 113 HD1 LYS 113 12.487 2.975 -2.105 659 1HE LYS 113 HE2 LYS 113 12.558 5.387 -2.431 660 2HE LYS 113 HE1 LYS 113 13.116 5.617 -0.761 661 1HZ LYS 113 HZ3 LYS 113 15.072 4.256 -1.371 662 2HZ LYS 113 HZ2 LYS 113 14.458 4.144 -2.946 663 3HZ LYS 113 HZ1 LYS 113 14.952 5.640 -2.343 664 H LYS 114 HN LYS 114 7.678 4.168 -3.566 665 HA LYS 114 HA LYS 114 6.417 1.876 -2.789 666 1HB LYS 114 HB2 LYS 114 5.371 4.031 -3.422 667 2HB LYS 114 HB1 LYS 114 5.769 3.727 -5.097 668 1HG LYS 114 HG2 LYS 114 4.265 1.760 -5.045 669 2HG LYS 114 HG1 LYS 114 3.831 2.170 -3.388 670 1HD LYS 114 HD2 LYS 114 2.104 3.116 -4.716 671 2HD LYS 114 HD1 LYS 114 3.158 4.469 -4.306 672 1HE LYS 114 HE2 LYS 114 4.288 4.184 -6.499 673 2HE LYS 114 HE1 LYS 114 3.113 2.916 -6.852 674 1HZ LYS 114 HZ2 LYS 114 1.332 4.725 -6.566 675 2HZ LYS 114 HZ1 LYS 114 2.596 5.832 -6.531 676 3HZ LYS 114 HZ3 LYS 114 2.346 4.889 -7.871 677 H LYS 115 HN LYS 115 7.561 2.796 -5.988 678 HA LYS 115 HA LYS 115 6.900 0.371 -7.284 679 1HB LYS 115 HB2 LYS 115 8.776 2.590 -8.086 680 2HB LYS 115 HB1 LYS 115 8.268 1.287 -9.156 681 1HG LYS 115 HG2 LYS 115 6.014 2.022 -9.136 682 2HG LYS 115 HG1 LYS 115 6.312 3.112 -7.790 683 1HD LYS 115 HD2 LYS 115 6.153 4.429 -9.774 684 2HD LYS 115 HD1 LYS 115 7.822 4.411 -9.251 685 1HE LYS 115 HE2 LYS 115 8.388 2.714 -10.903 686 2HE LYS 115 HE1 LYS 115 6.710 2.656 -11.441 687 1HZ LYS 115 HZ3 LYS 115 8.477 5.028 -11.576 688 2HZ LYS 115 HZ2 LYS 115 8.117 4.035 -12.873 689 3HZ LYS 115 HZ1 LYS 115 6.885 4.949 -12.148 690 H GLU 116 HN GLU 116 9.848 1.501 -5.741 691 HA GLU 116 HA GLU 116 11.506 -0.640 -6.497 692 1HB GLU 116 HB2 GLU 116 11.534 1.076 -3.996 693 2HB GLU 116 HB1 GLU 116 12.728 -0.169 -4.301 694 1HG GLU 116 HG2 GLU 116 13.312 1.069 -6.394 695 2HG GLU 116 HG1 GLU 116 12.234 2.359 -5.832 696 H LEU 117 HN LEU 117 9.244 -0.248 -3.878 697 HA LEU 117 HA LEU 117 9.816 -2.743 -2.683 698 1HB LEU 117 HB2 LEU 117 8.990 -1.142 -1.222 699 2HB LEU 117 HB1 LEU 117 7.713 -0.643 -2.303 700 HG LEU 117 HG LEU 117 6.930 -1.786 -0.221 701 1HD1 LEU 117 HD1 LEU 117 5.541 -1.544 -2.011 702 2HD1 LEU 117 HD1 LEU 117 6.088 -3.068 -2.702 703 3HD1 LEU 117 HD1 LEU 117 5.236 -3.059 -1.142 704 1HD2 LEU 117 HD2 LEU 117 8.182 -4.221 -1.441 705 2HD2 LEU 117 HD2 LEU 117 8.698 -3.421 0.045 706 3HD2 LEU 117 HD2 LEU 117 7.115 -4.198 -0.035 707 H ILE 118 HN ILE 118 7.332 -1.621 -4.914 708 HA ILE 118 HA ILE 118 5.740 -3.845 -4.941 709 HB ILE 118 HB ILE 118 6.422 -2.030 -7.285 710 1HG1 ILE 118 2HG1 ILE 118 3.961 -2.086 -5.551 711 2HG1 ILE 118 1HG1 ILE 118 5.345 -1.051 -5.227 712 1HG2 ILE 118 1HG2 ILE 118 5.521 -4.153 -8.141 713 2HG2 ILE 118 3HG2 ILE 118 4.126 -4.006 -7.076 714 3HG2 ILE 118 2HG2 ILE 118 4.376 -2.844 -8.378 715 1HD1 ILE 118 HD1 ILE 118 3.635 -0.987 -7.697 716 2HD1 ILE 118 HD1 ILE 118 3.566 0.150 -6.345 717 3HD1 ILE 118 HD1 ILE 118 5.010 0.061 -7.353 718 H GLN 119 HN GLN 119 8.638 -3.159 -6.710 719 HA GLN 119 HA GLN 119 8.737 -5.515 -8.265 720 1HB GLN 119 HB2 GLN 119 10.870 -3.558 -7.486 721 2HB GLN 119 HB1 GLN 119 11.117 -4.878 -8.620 722 1HG GLN 119 HG2 GLN 119 9.448 -3.975 -10.105 723 2HG GLN 119 HG1 GLN 119 9.057 -2.710 -8.943 724 1HE2 GLN 119 1HE2 GLN 119 10.438 -1.017 -8.678 725 2HE2 GLN 119 2HE2 GLN 119 11.710 -0.652 -9.773 726 H LEU 120 HN LEU 120 9.665 -4.855 -5.001 727 HA LEU 120 HA LEU 120 11.328 -7.186 -4.784 728 1HB LEU 120 HB2 LEU 120 10.183 -5.391 -2.647 729 2HB LEU 120 HB1 LEU 120 11.249 -6.744 -2.335 730 HG LEU 120 HG LEU 120 11.958 -4.270 -3.893 731 1HD1 LEU 120 HD1 LEU 120 11.743 -3.883 -1.508 732 2HD1 LEU 120 HD1 LEU 120 12.821 -5.238 -1.177 733 3HD1 LEU 120 HD1 LEU 120 13.436 -3.812 -2.004 734 1HD2 LEU 120 HD2 LEU 120 13.619 -6.683 -3.149 735 2HD2 LEU 120 HD2 LEU 120 13.153 -6.182 -4.777 736 3HD2 LEU 120 HD2 LEU 120 14.250 -5.183 -3.835 737 H VAL 121 HN VAL 121 8.062 -6.258 -3.630 738 HA VAL 121 HA VAL 121 7.373 -8.824 -2.726 739 HB VAL 121 HB VAL 121 5.458 -6.892 -4.063 740 1HG1 VAL 121 2HG1 VAL 121 4.498 -9.068 -3.569 741 2HG1 VAL 121 1HG1 VAL 121 5.019 -8.939 -1.891 742 3HG1 VAL 121 3HG1 VAL 121 3.799 -7.832 -2.523 743 1HG2 VAL 121 3HG2 VAL 121 6.468 -6.875 -1.228 744 2HG2 VAL 121 2HG2 VAL 121 6.732 -5.653 -2.479 745 3HG2 VAL 121 1HG2 VAL 121 5.114 -5.910 -1.837 746 H ALA 122 HN ALA 122 7.299 -7.419 -5.935 747 HA ALA 122 HA ALA 122 5.917 -9.418 -7.269 748 1HB ALA 122 HB3 ALA 122 8.046 -7.616 -8.399 749 2HB ALA 122 HB2 ALA 122 6.799 -8.475 -9.326 750 3HB ALA 122 HB1 ALA 122 6.344 -7.211 -8.198 751 H ARG 123 HN ARG 123 9.437 -9.021 -6.813 752 HA ARG 123 HA ARG 123 10.114 -11.342 -8.335 753 1HB ARG 123 HB2 ARG 123 12.406 -10.966 -7.619 754 2HB ARG 123 HB1 ARG 123 11.667 -9.450 -8.106 755 1HG ARG 123 HG2 ARG 123 11.273 -8.926 -5.733 756 2HG ARG 123 HG1 ARG 123 12.141 -10.391 -5.288 757 1HD ARG 123 HD2 ARG 123 13.610 -8.453 -5.162 758 2HD ARG 123 HD1 ARG 123 14.139 -9.550 -6.438 759 HE ARG 123 HE ARG 123 12.417 -7.680 -7.557 760 1HH1 ARG 123 1HH1 ARG 123 15.593 -7.653 -5.988 761 2HH1 ARG 123 2HH1 ARG 123 16.236 -6.423 -6.967 762 1HH2 ARG 123 1HH2 ARG 123 13.342 -5.979 -8.969 763 2HH2 ARG 123 2HH2 ARG 123 14.939 -5.483 -8.685 764 H HIS 124 HN HIS 124 8.814 -11.042 -5.342 765 HA HIS 124 HA HIS 124 9.986 -13.212 -3.960 766 1HB HIS 124 HB2 HIS 124 8.737 -11.640 -2.686 767 2HB HIS 124 HB1 HIS 124 7.337 -11.757 -3.719 768 HD1 HIS 124 HD1 HIS 124 5.630 -13.627 -3.167 769 HD2 HIS 124 HD2 HIS 124 9.071 -13.780 -0.853 770 HE1 HIS 124 HE1 HIS 124 5.186 -15.324 -1.378 771 H GLY 125 HN GLY 125 7.680 -12.987 -6.542 772 1HA GLY 125 HA1 GLY 125 6.891 -15.788 -6.130 773 2HA GLY 125 HA2 GLY 125 7.657 -15.326 -7.649 774 H LEU 126 HN LEU 126 5.848 -12.699 -6.730 775 HA LEU 126 HA LEU 126 3.320 -13.372 -7.364 776 1HB LEU 126 HB2 LEU 126 4.972 -10.984 -7.234 777 2HB LEU 126 HB1 LEU 126 3.431 -10.833 -8.076 778 HG LEU 126 HG LEU 126 2.328 -11.681 -6.117 779 1HD1 LEU 126 HD1 LEU 126 3.930 -12.948 -5.084 780 2HD1 LEU 126 HD1 LEU 126 4.929 -11.528 -4.683 781 3HD1 LEU 126 HD1 LEU 126 3.304 -11.727 -3.977 782 1HD2 LEU 126 HD2 LEU 126 3.953 -9.196 -5.747 783 2HD2 LEU 126 HD2 LEU 126 2.363 -9.320 -6.487 784 3HD2 LEU 126 HD2 LEU 126 2.558 -9.597 -4.753 785 H ASP 127 HN ASP 127 2.215 -13.475 -9.065 786 HA ASP 127 HA ASP 127 3.279 -13.793 -11.706 787 1HB ASP 127 HB2 ASP 127 0.385 -13.326 -10.916 788 2HB ASP 127 HB1 ASP 127 0.992 -14.032 -12.402 789 H HIS 128 HN HIS 128 2.228 -12.399 -13.533 790 HA HIS 128 HA HIS 128 2.867 -9.703 -13.018 791 1HB HIS 128 HB2 HIS 128 1.876 -9.162 -15.252 792 2HB HIS 128 HB1 HIS 128 3.167 -10.375 -15.241 793 HD1 HIS 128 HD1 HIS 128 2.577 -12.634 -16.267 794 HD2 HIS 128 HD2 HIS 128 -0.672 -10.071 -15.965 795 HE1 HIS 128 HE1 HIS 128 0.767 -13.651 -17.675 796 H ASP 129 HN ASP 129 -0.162 -11.255 -13.303 797 HA ASP 129 HA ASP 129 -1.812 -9.011 -12.904 798 1HB ASP 129 HB2 ASP 129 -2.302 -11.871 -12.122 799 2HB ASP 129 HB1 ASP 129 -3.489 -10.609 -11.872 800 H LYS 130 HN LYS 130 -0.222 -11.109 -10.615 801 HA LYS 130 HA LYS 130 -1.280 -10.178 -8.225 802 1HB LYS 130 HB2 LYS 130 1.484 -11.109 -8.901 803 2HB LYS 130 HB1 LYS 130 0.999 -10.681 -7.275 804 1HG LYS 130 HG2 LYS 130 -0.393 -12.823 -8.850 805 2HG LYS 130 HG1 LYS 130 1.067 -13.113 -7.909 806 1HD LYS 130 HD2 LYS 130 -0.068 -12.240 -5.938 807 2HD LYS 130 HD1 LYS 130 -1.569 -12.119 -6.825 808 1HE LYS 130 HE2 LYS 130 0.020 -14.580 -6.088 809 2HE LYS 130 HE1 LYS 130 -1.635 -14.177 -5.651 810 1HZ LYS 130 HZ2 LYS 130 -2.280 -14.501 -7.971 811 2HZ LYS 130 HZ1 LYS 130 -0.697 -14.932 -8.386 812 3HZ LYS 130 HZ3 LYS 130 -1.586 -15.883 -7.311 813 H VAL 131 HN VAL 131 1.506 -9.028 -10.119 814 HA VAL 131 HA VAL 131 2.324 -6.987 -8.380 815 HB VAL 131 HB VAL 131 2.728 -7.077 -11.391 816 1HG1 VAL 131 3HG1 VAL 131 3.316 -4.951 -10.426 817 2HG1 VAL 131 2HG1 VAL 131 4.345 -5.756 -9.243 818 3HG1 VAL 131 1HG1 VAL 131 4.755 -5.820 -10.958 819 1HG2 VAL 131 1HG2 VAL 131 4.383 -8.350 -9.224 820 2HG2 VAL 131 3HG2 VAL 131 3.401 -9.183 -10.430 821 3HG2 VAL 131 2HG2 VAL 131 4.817 -8.253 -10.934 822 H LEU 132 HN LEU 132 0.160 -7.039 -11.159 823 HA LEU 132 HA LEU 132 -0.366 -4.267 -11.290 824 1HB LEU 132 HB2 LEU 132 -2.165 -6.548 -12.087 825 2HB LEU 132 HB1 LEU 132 -2.347 -4.877 -12.584 826 HG LEU 132 HG LEU 132 -0.104 -6.743 -13.332 827 1HD1 LEU 132 HD1 LEU 132 -2.318 -5.539 -14.949 828 2HD1 LEU 132 HD1 LEU 132 -0.986 -6.510 -15.588 829 3HD1 LEU 132 HD1 LEU 132 -2.153 -7.234 -14.476 830 1HD2 LEU 132 HD2 LEU 132 -0.544 -3.859 -14.103 831 2HD2 LEU 132 HD2 LEU 132 0.748 -4.485 -13.072 832 3HD2 LEU 132 HD2 LEU 132 0.683 -4.930 -14.776 833 H LEU 133 HN LEU 133 -2.076 -6.874 -9.636 834 HA LEU 133 HA LEU 133 -4.132 -5.257 -8.580 835 1HB LEU 133 HB2 LEU 133 -3.007 -7.843 -7.533 836 2HB LEU 133 HB1 LEU 133 -4.525 -7.113 -7.032 837 HG LEU 133 HG LEU 133 -3.913 -8.139 -9.807 838 1HD1 LEU 133 HD1 LEU 133 -5.559 -9.373 -7.604 839 2HD1 LEU 133 HD1 LEU 133 -5.451 -9.959 -9.264 840 3HD1 LEU 133 HD1 LEU 133 -4.022 -9.974 -8.235 841 1HD2 LEU 133 HD2 LEU 133 -6.484 -7.154 -8.572 842 2HD2 LEU 133 HD2 LEU 133 -5.541 -6.343 -9.824 843 3HD2 LEU 133 HD2 LEU 133 -6.321 -7.883 -10.170 844 H PHE 134 HN PHE 134 -1.054 -6.384 -7.246 845 HA PHE 134 HA PHE 134 -1.366 -5.256 -4.703 846 1HB PHE 134 HB2 PHE 134 0.254 -6.996 -5.112 847 2HB PHE 134 HB1 PHE 134 1.162 -5.967 -6.217 848 HD1 PHE 134 HD1 PHE 134 2.752 -4.397 -5.379 849 HD2 PHE 134 HD2 PHE 134 0.192 -6.482 -2.700 850 HE1 PHE 134 HE1 PHE 134 4.078 -3.574 -3.459 851 HE2 PHE 134 HE2 PHE 134 1.516 -5.660 -0.800 852 HZ PHE 134 HZ PHE 134 3.451 -4.200 -1.193 853 H SER 135 HN SER 135 0.324 -4.010 -7.586 854 HA SER 135 HA SER 135 1.288 -1.699 -6.368 855 1HB SER 135 HB2 SER 135 1.528 -0.836 -8.706 856 2HB SER 135 HB1 SER 135 2.244 -2.429 -8.434 857 HG SER 135 HG SER 135 0.693 -3.356 -9.552 858 H ARG 136 HN ARG 136 -1.792 -2.330 -7.936 859 HA ARG 136 HA ARG 136 -2.484 0.420 -7.886 860 1HB ARG 136 HB2 ARG 136 -4.593 -0.180 -8.779 861 2HB ARG 136 HB1 ARG 136 -3.381 -1.171 -9.570 862 1HG ARG 136 HG2 ARG 136 -4.026 -2.984 -7.953 863 2HG ARG 136 HG1 ARG 136 -5.421 -1.977 -7.528 864 1HD ARG 136 HD2 ARG 136 -4.732 -3.244 -10.166 865 2HD ARG 136 HD1 ARG 136 -6.210 -3.418 -9.219 866 HE ARG 136 HE ARG 136 -6.211 -0.798 -9.799 867 1HH1 ARG 136 1HH1 ARG 136 -6.075 -3.701 -11.795 868 2HH1 ARG 136 2HH1 ARG 136 -6.397 -2.888 -13.254 869 1HH2 ARG 136 1HH2 ARG 136 -6.703 0.309 -11.795 870 2HH2 ARG 136 2HH2 ARG 136 -6.758 -0.578 -13.260 871 H ASP 137 HN ASP 137 -3.151 -2.323 -5.719 872 HA ASP 137 HA ASP 137 -4.944 -0.713 -4.154 873 1HB ASP 137 HB2 ASP 137 -4.997 -3.268 -4.220 874 2HB ASP 137 HB1 ASP 137 -3.583 -3.227 -3.186 875 H LEU 138 HN LEU 138 -1.572 -1.454 -4.133 876 HA LEU 138 HA LEU 138 -0.913 -0.264 -1.670 877 1HB LEU 138 HB2 LEU 138 0.698 -1.662 -2.742 878 2HB LEU 138 HB1 LEU 138 0.651 -0.709 -4.205 879 HG LEU 138 HG LEU 138 1.831 1.114 -3.097 880 1HD1 LEU 138 HD1 LEU 138 1.853 -0.679 -0.680 881 2HD1 LEU 138 HD1 LEU 138 2.745 0.840 -0.879 882 3HD1 LEU 138 HD1 LEU 138 0.983 0.857 -0.858 883 1HD2 LEU 138 HD2 LEU 138 3.121 -0.615 -4.176 884 2HD2 LEU 138 HD2 LEU 138 3.965 0.003 -2.755 885 3HD2 LEU 138 HD2 LEU 138 3.143 -1.554 -2.680 886 H ASP 139 HN ASP 139 -1.129 1.016 -4.948 887 HA ASP 139 HA ASP 139 -0.376 3.649 -4.306 888 1HB ASP 139 HB2 ASP 139 -0.553 2.752 -6.638 889 2HB ASP 139 HB1 ASP 139 -2.304 2.787 -6.466 890 H LYS 140 HN LYS 140 -3.514 2.033 -4.379 891 HA LYS 140 HA LYS 140 -5.152 4.145 -3.580 892 1HB LYS 140 HB2 LYS 140 -5.311 1.189 -3.021 893 2HB LYS 140 HB1 LYS 140 -6.537 2.310 -2.456 894 1HG LYS 140 HG2 LYS 140 -7.139 2.860 -4.704 895 2HG LYS 140 HG1 LYS 140 -5.769 1.944 -5.326 896 1HD LYS 140 HD2 LYS 140 -7.904 0.734 -5.606 897 2HD LYS 140 HD1 LYS 140 -6.789 -0.154 -4.594 898 1HE LYS 140 HE2 LYS 140 -8.971 1.585 -3.436 899 2HE LYS 140 HE1 LYS 140 -9.267 -0.077 -3.915 900 1HZ LYS 140 HZ1 LYS 140 -7.484 -0.738 -2.290 901 2HZ LYS 140 HZ3 LYS 140 -7.448 0.866 -1.727 902 3HZ LYS 140 HZ2 LYS 140 -8.843 -0.021 -1.616 903 H LEU 141 HN LEU 141 -3.374 1.790 -1.625 904 HA LEU 141 HA LEU 141 -4.191 2.697 0.882 905 1HB LEU 141 HB2 LEU 141 -3.249 0.517 0.619 906 2HB LEU 141 HB1 LEU 141 -1.746 1.182 0.020 907 HG LEU 141 HG LEU 141 -1.166 2.009 2.216 908 1HD1 LEU 141 HD1 LEU 141 -3.398 2.627 2.986 909 2HD1 LEU 141 HD1 LEU 141 -3.825 0.922 3.121 910 3HD1 LEU 141 HD1 LEU 141 -2.568 1.603 4.155 911 1HD2 LEU 141 HD2 LEU 141 -2.190 -0.806 2.292 912 2HD2 LEU 141 HD2 LEU 141 -0.602 -0.283 1.720 913 3HD2 LEU 141 HD2 LEU 141 -1.042 -0.104 3.423 914 H ILE 142 HN ILE 142 -1.367 3.537 -1.014 915 HA ILE 142 HA ILE 142 -0.380 5.319 0.936 916 HB ILE 142 HB ILE 142 0.171 5.156 -2.049 917 1HG1 ILE 142 2HG1 ILE 142 1.717 4.349 0.403 918 2HG1 ILE 142 1HG1 ILE 142 0.925 3.262 -0.729 919 1HG2 ILE 142 3HG2 ILE 142 1.551 6.872 0.020 920 2HG2 ILE 142 2HG2 ILE 142 2.093 6.646 -1.645 921 3HG2 ILE 142 1HG2 ILE 142 0.556 7.456 -1.315 922 1HD1 ILE 142 HD1 ILE 142 3.261 5.054 -1.340 923 2HD1 ILE 142 HD1 ILE 142 3.330 3.316 -1.042 924 3HD1 ILE 142 HD1 ILE 142 2.480 3.931 -2.457 925 H ASN 143 HN ASN 143 -2.450 5.940 -1.890 926 HA ASN 143 HA ASN 143 -2.749 8.682 -1.253 927 1HB ASN 143 HB2 ASN 143 -4.562 6.852 -2.808 928 2HB ASN 143 HB1 ASN 143 -4.954 8.544 -2.530 929 1HD2 ASN 143 HD2 ASN 143 -2.871 6.341 -4.200 930 2HD2 ASN 143 HD2 ASN 143 -2.200 7.479 -5.288 931 H LYS 144 HN LYS 144 -4.264 5.876 0.022 932 HA LYS 144 HA LYS 144 -6.508 6.930 1.303 933 1HB LYS 144 HB2 LYS 144 -5.993 4.503 1.036 934 2HB LYS 144 HB1 LYS 144 -4.720 4.660 2.227 935 1HG LYS 144 HG2 LYS 144 -6.551 5.417 3.845 936 2HG LYS 144 HG1 LYS 144 -7.696 4.806 2.655 937 1HD LYS 144 HD2 LYS 144 -5.498 3.221 3.978 938 2HD LYS 144 HD1 LYS 144 -7.197 3.144 4.442 939 1HE LYS 144 HE2 LYS 144 -7.688 2.284 2.134 940 2HE LYS 144 HE1 LYS 144 -5.962 2.256 1.812 941 1HZ LYS 144 HZ1 LYS 144 -5.771 0.665 3.792 942 2HZ LYS 144 HZ3 LYS 144 -7.439 0.579 3.801 943 3HZ LYS 144 HZ2 LYS 144 -6.573 0.032 2.479 944 H PHE 145 HN PHE 145 -3.184 7.018 2.110 945 HA PHE 145 HA PHE 145 -3.802 8.385 4.623 946 1HB PHE 145 HB2 PHE 145 -1.548 6.686 3.737 947 2HB PHE 145 HB1 PHE 145 -1.268 7.848 5.019 948 HD1 PHE 145 HD1 PHE 145 -2.298 7.579 7.147 949 HD2 PHE 145 HD2 PHE 145 -3.087 4.799 4.029 950 HE1 PHE 145 HE1 PHE 145 -3.334 6.036 8.779 951 HE2 PHE 145 HE2 PHE 145 -4.107 3.260 5.642 952 HZ PHE 145 HZ PHE 145 -4.237 3.871 8.010 953 H MET 146 HN MET 146 -2.314 8.802 1.609 954 HA MET 146 HA MET 146 -0.750 11.143 2.364 955 1HB MET 146 HB2 MET 146 -1.273 9.828 -0.280 956 2HB MET 146 HB1 MET 146 -0.253 11.243 -0.073 957 1HG MET 146 HG2 MET 146 0.172 8.609 1.308 958 2HG MET 146 HG1 MET 146 0.992 9.126 -0.166 959 1HE MET 146 HE3 MET 146 2.734 10.830 -0.346 960 2HE MET 146 HE2 MET 146 1.597 12.083 0.199 961 3HE MET 146 HE1 MET 146 3.202 11.955 0.929 962 H ASN 147 HN ASN 147 -3.815 10.418 0.880 963 HA ASN 147 HA ASN 147 -4.248 13.313 0.572 964 1HB ASN 147 HB2 ASN 147 -4.082 12.243 -1.655 965 2HB ASN 147 HB1 ASN 147 -5.412 11.177 -1.224 966 1HD2 ASN 147 HD2 ASN 147 -6.951 11.826 -2.649 967 2HD2 ASN 147 HD2 ASN 147 -7.597 13.415 -2.732 968 H VAL 148 HN VAL 148 -5.422 10.426 1.515 969 HA VAL 148 HA VAL 148 -8.136 11.406 1.858 970 HB VAL 148 HB VAL 148 -7.161 8.623 2.347 971 1HG1 VAL 148 3HG1 VAL 148 -9.179 9.124 3.627 972 2HG1 VAL 148 2HG1 VAL 148 -9.981 9.699 2.165 973 3HG1 VAL 148 1HG1 VAL 148 -9.548 7.998 2.318 974 1HG2 VAL 148 2HG2 VAL 148 -6.961 9.205 0.003 975 2HG2 VAL 148 1HG2 VAL 148 -8.279 8.055 0.233 976 3HG2 VAL 148 3HG2 VAL 148 -8.635 9.764 -0.019 977 H LYS 149 HN LYS 149 -8.397 12.505 3.338 978 HA LYS 149 HA LYS 149 -8.870 11.357 5.734 979 1HB LYS 149 HB2 LYS 149 -7.662 13.021 7.147 980 2HB LYS 149 HB1 LYS 149 -6.630 11.873 6.293 981 1HG LYS 149 HG2 LYS 149 -5.904 13.521 4.777 982 2HG LYS 149 HG1 LYS 149 -7.094 14.689 5.374 983 1HD LYS 149 HD2 LYS 149 -5.987 14.540 7.625 984 2HD LYS 149 HD1 LYS 149 -4.719 13.571 6.879 985 1HE LYS 149 HE2 LYS 149 -5.460 16.399 6.128 986 2HE LYS 149 HE1 LYS 149 -4.088 15.930 7.123 987 1HZ LYS 149 HZ1 LYS 149 -3.174 14.740 5.212 988 2HZ LYS 149 HZ3 LYS 149 -4.466 15.244 4.246 989 3HZ LYS 149 HZ2 LYS 149 -3.415 16.364 4.898 990 H ASP 150 HN ASP 150 -10.840 11.816 5.409 991 HA ASP 150 HA ASP 150 -12.094 13.532 3.844 992 1HB ASP 150 HB2 ASP 150 -14.089 13.442 5.445 993 2HB ASP 150 HB1 ASP 150 -13.454 11.925 4.832 994 H LYS 151 HN LYS 151 -11.840 15.507 3.466 995 HA LYS 151 HA LYS 151 -11.368 17.369 5.624 996 1HB LYS 151 HB2 LYS 151 -10.887 19.027 3.888 997 2HB LYS 151 HB1 LYS 151 -9.987 17.551 3.605 998 1HG LYS 151 HG2 LYS 151 -11.653 16.905 1.893 999 2HG LYS 151 HG1 LYS 151 -12.454 18.457 2.140 1000 1HD LYS 151 HD2 LYS 151 -10.352 19.601 1.557 1001 2HD LYS 151 HD1 LYS 151 -9.606 18.038 1.225 1002 1HE LYS 151 HE2 LYS 151 -10.307 19.059 -0.835 1003 2HE LYS 151 HE1 LYS 151 -11.320 17.655 -0.512 1004 1HZ LYS 151 HZ1 LYS 151 -12.080 20.456 0.096 1005 2HZ LYS 151 HZ3 LYS 151 -12.544 19.621 -1.282 1006 3HZ LYS 151 HZ2 LYS 151 -13.085 19.098 0.226 1007 H VAL 152 HN VAL 152 -13.881 16.059 4.487 1008 HA VAL 152 HA VAL 152 -15.634 18.355 4.331 1009 HB VAL 152 HB VAL 152 -17.475 16.671 3.995 1010 1HG1 VAL 152 1HG1 VAL 152 -15.105 16.450 2.134 1011 2HG1 VAL 152 3HG1 VAL 152 -16.764 16.022 1.723 1012 3HG1 VAL 152 2HG1 VAL 152 -16.353 17.697 2.082 1013 1HG2 VAL 152 2HG2 VAL 152 -16.439 14.763 5.163 1014 2HG2 VAL 152 1HG2 VAL 152 -16.883 14.339 3.506 1015 3HG2 VAL 152 3HG2 VAL 152 -15.202 14.677 3.911 1016 H HIS 153 HN HIS 153 -16.445 19.268 6.027 1017 HA HIS 153 HA HIS 153 -17.176 19.744 8.089 1018 1HB HIS 153 HB2 HIS 153 -17.795 16.778 8.240 1019 2HB HIS 153 HB1 HIS 153 -18.298 17.948 9.453 1020 HD1 HIS 153 HD1 HIS 153 -19.354 16.457 6.278 1021 HD2 HIS 153 HD2 HIS 153 -20.144 19.918 8.426 1022 HE1 HIS 153 HE1 HIS 153 -21.440 17.433 5.278 1023 H LYS 154 HN LYS 154 -14.466 18.701 7.495 1024 HA LYS 154 HA LYS 154 -13.426 17.554 9.923 1025 1HB LYS 154 HB2 LYS 154 -12.402 17.128 7.710 1026 2HB LYS 154 HB1 LYS 154 -12.041 18.841 7.571 1027 1HG LYS 154 HG2 LYS 154 -10.632 18.557 9.677 1028 2HG LYS 154 HG1 LYS 154 -10.814 16.824 9.448 1029 1HD LYS 154 HD2 LYS 154 -8.701 17.574 8.486 1030 2HD LYS 154 HD1 LYS 154 -9.783 17.043 7.197 1031 1HE LYS 154 HE2 LYS 154 -10.345 19.341 6.660 1032 2HE LYS 154 HE1 LYS 154 -9.453 19.912 8.066 1033 1HZ LYS 154 HZ2 LYS 154 -8.196 18.551 5.737 1034 2HZ LYS 154 HZ1 LYS 154 -8.332 20.224 5.949 1035 3HZ LYS 154 HZ3 LYS 154 -7.416 19.315 7.033 1036 H LEU 155 HN LEU 155 -12.317 18.689 11.523 1037 HA LEU 155 HA LEU 155 -12.683 21.522 11.580 1038 1HB LEU 155 HB2 LEU 155 -11.153 19.667 13.414 1039 2HB LEU 155 HB1 LEU 155 -11.168 21.400 13.634 1040 HG LEU 155 HG LEU 155 -13.681 21.228 13.905 1041 1HD1 LEU 155 HD1 LEU 155 -14.044 19.055 12.895 1042 2HD1 LEU 155 HD1 LEU 155 -13.087 18.292 14.165 1043 3HD1 LEU 155 HD1 LEU 155 -14.614 19.083 14.565 1044 1HD2 LEU 155 HD2 LEU 155 -12.180 21.557 15.768 1045 2HD2 LEU 155 HD2 LEU 155 -13.520 20.502 16.231 1046 3HD2 LEU 155 HD2 LEU 155 -11.927 19.817 15.901 1047 H GLU 156 HN GLU 156 -11.621 22.582 10.110 1048 HA GLU 156 HA GLU 156 -8.785 21.981 9.706 1049 1HB GLU 156 HB2 GLU 156 -10.323 21.742 7.703 1050 2HB GLU 156 HB1 GLU 156 -10.654 23.454 7.841 1051 1HG GLU 156 HG2 GLU 156 -8.425 24.037 7.282 1052 2HG GLU 156 HG1 GLU 156 -7.884 22.365 7.439 1053 H HIS 157 HN HIS 157 -7.797 23.240 11.050 1054 HA HIS 157 HA HIS 157 -8.857 25.820 11.734 1055 1HB HIS 157 HB2 HIS 157 -6.358 24.411 12.699 1056 2HB HIS 157 HB1 HIS 157 -7.012 25.903 13.368 1057 HD1 HIS 157 HD1 HIS 157 -7.556 22.200 13.344 1058 HD2 HIS 157 HD2 HIS 157 -9.311 25.596 14.968 1059 HE1 HIS 157 HE1 HIS 157 -9.226 21.378 15.022 1060 H HIS 158 HN HIS 158 -8.491 27.470 10.535 1061 HA HIS 158 HA HIS 158 -5.876 27.754 9.278 1062 1HB HIS 158 HB2 HIS 158 -7.607 27.416 7.558 1063 2HB HIS 158 HB1 HIS 158 -8.585 28.694 8.256 1064 HD1 HIS 158 HD1 HIS 158 -5.324 28.238 6.315 1065 HD2 HIS 158 HD2 HIS 158 -8.063 31.197 7.305 1066 HE1 HIS 158 HE1 HIS 158 -4.707 30.251 4.952 1067 H HIS 159 HN HIS 159 -5.110 28.736 11.108 1068 HA HIS 159 HA HIS 159 -6.378 31.204 12.012 1069 1HB HIS 159 HB2 HIS 159 -3.866 29.839 13.012 1070 2HB HIS 159 HB1 HIS 159 -4.693 31.180 13.791 1071 HD1 HIS 159 HD1 HIS 159 -4.215 27.823 14.451 1072 HD2 HIS 159 HD2 HIS 159 -7.659 30.130 14.106 1073 HE1 HIS 159 HE1 HIS 159 -6.010 26.596 15.722 1074 H HIS 160 HN HIS 160 -3.937 30.030 10.022 1075 HA HIS 160 HA HIS 160 -3.252 32.509 8.921 1076 1HB HIS 160 HB2 HIS 160 -0.818 32.428 9.458 1077 2HB HIS 160 HB1 HIS 160 -1.755 32.609 10.926 1078 HD1 HIS 160 HD1 HIS 160 0.725 30.376 9.289 1079 HD2 HIS 160 HD2 HIS 160 -1.789 30.298 12.596 1080 HE1 HIS 160 HE1 HIS 160 1.521 28.465 10.726 1081 H HIS 161 HN HIS 161 -0.996 31.575 7.541 1082 HA HIS 161 HA HIS 161 -2.207 29.437 6.046 1083 1HB HIS 161 HB2 HIS 161 -1.012 31.295 4.897 1084 2HB HIS 161 HB1 HIS 161 0.480 30.796 5.677 1085 HD1 HIS 161 HD1 HIS 161 -1.585 30.188 2.700 1086 HD2 HIS 161 HD2 HIS 161 1.458 28.244 4.752 1087 HE1 HIS 161 HE1 HIS 161 -0.668 28.462 1.125 1088 H HIS 162 HN HIS 162 -2.183 27.616 7.188 1089 HA HIS 162 HA HIS 162 0.134 26.755 8.664 1090 1HB HIS 162 HB2 HIS 162 -2.491 25.360 8.071 1091 2HB HIS 162 HB1 HIS 162 -1.229 24.683 9.090 1092 HD1 HIS 162 HD1 HIS 162 -1.544 25.163 11.552 1093 HD2 HIS 162 HD2 HIS 162 -3.555 27.871 9.138 1094 HE1 HIS 162 HE1 HIS 162 -2.917 26.579 13.091 No H/Q in entry = 1094 Start of MODEL 19 1 H1 MET 1 HT3 MET 1 16.091 -17.446 -5.096 2 H2 MET 1 HT2 MET 1 17.423 -17.135 -6.080 3 H3 MET 1 HT1 MET 1 17.510 -18.307 -4.879 4 HA MET 1 HA MET 1 18.630 -16.336 -4.115 5 1HB MET 1 HB2 MET 1 17.366 -14.722 -5.507 6 2HB MET 1 HB1 MET 1 15.914 -15.054 -4.580 7 1HG MET 1 HG2 MET 1 16.961 -14.075 -2.591 8 2HG MET 1 HG1 MET 1 18.420 -13.752 -3.524 9 1HE MET 1 HE3 MET 1 18.333 -11.223 -2.749 10 2HE MET 1 HE2 MET 1 16.943 -10.171 -2.977 11 3HE MET 1 HE1 MET 1 16.854 -11.518 -1.843 12 H GLU 2 HN GLU 2 18.718 -16.206 -1.864 13 HA GLU 2 HA GLU 2 17.104 -17.954 -0.353 14 1HB GLU 2 HB2 GLU 2 19.498 -16.996 0.115 15 2HB GLU 2 HB1 GLU 2 18.653 -15.622 0.802 16 1HG GLU 2 HG2 GLU 2 18.474 -18.482 1.752 17 2HG GLU 2 HG1 GLU 2 19.375 -17.183 2.523 18 H MET 3 HN MET 3 15.095 -17.625 0.358 19 HA MET 3 HA MET 3 13.824 -15.173 -0.368 20 1HB MET 3 HB2 MET 3 11.698 -16.218 0.179 21 2HB MET 3 HB1 MET 3 12.672 -17.252 -0.850 22 1HG MET 3 HG2 MET 3 13.312 -18.579 1.122 23 2HG MET 3 HG1 MET 3 12.284 -17.556 2.120 24 1HE MET 3 HE3 MET 3 9.638 -17.502 1.993 25 2HE MET 3 HE2 MET 3 9.718 -17.067 0.284 26 3HE MET 3 HE1 MET 3 8.693 -18.401 0.805 27 H GLY 4 HN GLY 4 15.012 -16.405 2.618 28 1HA GLY 4 HA1 GLY 4 14.817 -15.626 4.767 29 2HA GLY 4 HA2 GLY 4 13.256 -14.933 4.319 30 H GLN 5 HN GLN 5 16.557 -14.471 3.242 31 HA GLN 5 HA GLN 5 16.773 -11.839 4.291 32 1HB GLN 5 HB2 GLN 5 18.410 -13.105 2.120 33 2HB GLN 5 HB1 GLN 5 18.829 -11.668 3.073 34 1HG GLN 5 HG2 GLN 5 18.821 -13.077 5.108 35 2HG GLN 5 HG1 GLN 5 18.537 -14.483 4.093 36 1HE2 GLN 5 1HE2 GLN 5 20.321 -13.418 1.979 37 2HE2 GLN 5 2HE2 GLN 5 21.915 -13.660 2.566 38 H LEU 6 HN LEU 6 15.421 -13.089 1.453 39 HA LEU 6 HA LEU 6 15.391 -10.650 -0.037 40 1HB LEU 6 HB2 LEU 6 15.212 -12.788 -1.204 41 2HB LEU 6 HB1 LEU 6 13.845 -13.226 -0.225 42 HG LEU 6 HG LEU 6 13.449 -12.656 -2.686 43 1HD1 LEU 6 HD1 LEU 6 11.775 -11.351 -0.555 44 2HD1 LEU 6 HD1 LEU 6 11.285 -11.632 -2.222 45 3HD1 LEU 6 HD1 LEU 6 11.632 -12.990 -1.169 46 1HD2 LEU 6 HD2 LEU 6 13.678 -9.854 -1.594 47 2HD2 LEU 6 HD2 LEU 6 14.720 -10.591 -2.814 48 3HD2 LEU 6 HD2 LEU 6 13.021 -10.284 -3.176 49 H LYS 7 HN LYS 7 13.121 -12.358 2.074 50 HA LYS 7 HA LYS 7 11.001 -10.494 1.952 51 1HB LYS 7 HB2 LYS 7 11.374 -12.963 3.059 52 2HB LYS 7 HB1 LYS 7 11.465 -11.952 4.491 53 1HG LYS 7 HG2 LYS 7 9.190 -11.940 2.550 54 2HG LYS 7 HG1 LYS 7 9.213 -12.915 3.997 55 1HD LYS 7 HD2 LYS 7 9.403 -9.887 3.912 56 2HD LYS 7 HD1 LYS 7 7.913 -10.775 4.210 57 1HE LYS 7 HE2 LYS 7 10.386 -10.959 5.921 58 2HE LYS 7 HE1 LYS 7 9.030 -9.893 6.262 59 1HZ LYS 7 HZ1 LYS 7 7.614 -11.904 6.409 60 2HZ LYS 7 HZ3 LYS 7 8.983 -12.874 6.219 61 3HZ LYS 7 HZ2 LYS 7 8.823 -11.871 7.554 62 H ASN 8 HN ASN 8 13.879 -10.796 3.796 63 HA ASN 8 HA ASN 8 13.736 -8.834 5.753 64 1HB ASN 8 HB2 ASN 8 15.540 -10.445 5.564 65 2HB ASN 8 HB1 ASN 8 16.007 -9.775 4.019 66 1HD2 ASN 8 HD2 ASN 8 16.259 -9.558 7.362 67 2HD2 ASN 8 HD2 ASN 8 17.390 -8.257 7.442 68 H LYS 9 HN LYS 9 14.589 -8.575 2.316 69 HA LYS 9 HA LYS 9 15.300 -5.787 2.488 70 1HB LYS 9 HB2 LYS 9 14.773 -7.475 0.031 71 2HB LYS 9 HB1 LYS 9 15.549 -5.899 0.048 72 1HG LYS 9 HG2 LYS 9 16.616 -8.403 1.325 73 2HG LYS 9 HG1 LYS 9 17.178 -7.697 -0.190 74 1HD LYS 9 HD2 LYS 9 17.997 -5.748 0.960 75 2HD LYS 9 HD1 LYS 9 17.265 -6.272 2.477 76 1HE LYS 9 HE2 LYS 9 19.457 -7.715 0.996 77 2HE LYS 9 HE1 LYS 9 19.675 -6.692 2.419 78 1HZ LYS 9 HZ2 LYS 9 18.058 -9.194 2.349 79 2HZ LYS 9 HZ1 LYS 9 19.590 -9.034 3.026 80 3HZ LYS 9 HZ3 LYS 9 18.300 -8.197 3.690 81 H ILE 10 HN ILE 10 12.529 -7.652 1.572 82 HA ILE 10 HA ILE 10 10.907 -5.632 0.487 83 HB ILE 10 HB ILE 10 10.185 -8.155 2.007 84 1HG1 ILE 10 2HG1 ILE 10 10.270 -7.511 -0.944 85 2HG1 ILE 10 1HG1 ILE 10 11.457 -8.468 -0.066 86 1HG2 ILE 10 1HG2 ILE 10 8.305 -6.581 2.109 87 2HG2 ILE 10 3HG2 ILE 10 8.369 -6.388 0.356 88 3HG2 ILE 10 2HG2 ILE 10 7.933 -7.945 1.058 89 1HD1 ILE 10 HD1 ILE 10 8.571 -9.161 -0.497 90 2HD1 ILE 10 HD1 ILE 10 9.957 -9.848 -1.346 91 3HD1 ILE 10 HD1 ILE 10 9.743 -10.147 0.377 92 H GLU 11 HN GLU 11 11.097 -6.876 3.808 93 HA GLU 11 HA GLU 11 9.418 -5.015 5.081 94 1HB GLU 11 HB2 GLU 11 11.849 -6.487 6.097 95 2HB GLU 11 HB1 GLU 11 10.763 -5.553 7.114 96 1HG GLU 11 HG2 GLU 11 9.927 -7.902 5.441 97 2HG GLU 11 HG1 GLU 11 10.343 -7.988 7.152 98 H ASN 12 HN ASN 12 12.876 -4.948 4.581 99 HA ASN 12 HA ASN 12 13.539 -2.595 5.888 100 1HB ASN 12 HB2 ASN 12 15.123 -4.296 4.916 101 2HB ASN 12 HB1 ASN 12 14.791 -3.611 3.333 102 1HD2 ASN 12 HD2 ASN 12 15.618 -1.516 2.839 103 2HD2 ASN 12 HD2 ASN 12 16.873 -0.834 3.761 104 H LYS 13 HN LYS 13 12.728 -3.035 2.442 105 HA LYS 13 HA LYS 13 13.021 -0.286 1.795 106 1HB LYS 13 HB2 LYS 13 13.190 -2.343 0.240 107 2HB LYS 13 HB1 LYS 13 11.441 -2.278 0.190 108 1HG LYS 13 HG2 LYS 13 12.325 -1.127 -1.772 109 2HG LYS 13 HG1 LYS 13 11.563 0.024 -0.688 110 1HD LYS 13 HD2 LYS 13 13.650 0.836 -1.609 111 2HD LYS 13 HD1 LYS 13 13.736 0.726 0.150 112 1HE LYS 13 HE2 LYS 13 15.800 -0.028 -0.751 113 2HE LYS 13 HE1 LYS 13 14.958 -1.471 -0.204 114 1HZ LYS 13 HZ2 LYS 13 14.303 -1.866 -2.541 115 2HZ LYS 13 HZ1 LYS 13 15.170 -0.473 -2.993 116 3HZ LYS 13 HZ3 LYS 13 15.970 -1.814 -2.355 117 H LYS 14 HN LYS 14 10.262 -2.327 2.609 118 HA LYS 14 HA LYS 14 8.109 -0.657 2.151 119 1HB LYS 14 HB2 LYS 14 8.018 -3.047 2.827 120 2HB LYS 14 HB1 LYS 14 8.583 -2.596 4.420 121 1HG LYS 14 HG2 LYS 14 6.500 -1.241 4.696 122 2HG LYS 14 HG1 LYS 14 5.937 -1.893 3.156 123 1HD LYS 14 HD2 LYS 14 4.958 -3.284 4.845 124 2HD LYS 14 HD1 LYS 14 6.296 -4.202 4.152 125 1HE LYS 14 HE2 LYS 14 7.722 -3.433 6.046 126 2HE LYS 14 HE1 LYS 14 6.274 -2.684 6.723 127 1HZ LYS 14 HZ2 LYS 14 5.275 -4.959 6.914 128 2HZ LYS 14 HZ1 LYS 14 6.686 -5.590 6.227 129 3HZ LYS 14 HZ3 LYS 14 6.736 -4.831 7.697 130 H LYS 15 HN LYS 15 10.219 -1.009 4.982 131 HA LYS 15 HA LYS 15 8.862 0.953 6.500 132 1HB LYS 15 HB2 LYS 15 11.616 -0.220 6.907 133 2HB LYS 15 HB1 LYS 15 10.727 0.784 8.057 134 1HG LYS 15 HG2 LYS 15 8.992 -0.872 8.243 135 2HG LYS 15 HG1 LYS 15 9.761 -1.855 7.007 136 1HD LYS 15 HD2 LYS 15 10.332 -2.889 9.036 137 2HD LYS 15 HD1 LYS 15 11.748 -1.997 8.542 138 1HE LYS 15 HE2 LYS 15 9.789 -0.791 10.487 139 2HE LYS 15 HE1 LYS 15 11.082 -1.851 11.029 140 1HZ LYS 15 HZ2 LYS 15 11.477 0.752 9.586 141 2HZ LYS 15 HZ1 LYS 15 11.690 0.481 11.214 142 3HZ LYS 15 HZ3 LYS 15 12.687 -0.288 10.118 143 H GLU 16 HN GLU 16 11.686 1.066 4.391 144 HA GLU 16 HA GLU 16 12.445 3.744 4.809 145 1HB GLU 16 HB2 GLU 16 12.444 2.099 2.276 146 2HB GLU 16 HB1 GLU 16 13.132 3.707 2.395 147 1HG GLU 16 HG2 GLU 16 14.746 2.855 4.041 148 2HG GLU 16 HG1 GLU 16 14.056 1.238 3.848 149 H LEU 17 HN LEU 17 9.969 2.363 2.782 150 HA LEU 17 HA LEU 17 9.105 4.805 1.686 151 1HB LEU 17 HB2 LEU 17 8.654 2.880 0.426 152 2HB LEU 17 HB1 LEU 17 7.979 2.030 1.790 153 HG LEU 17 HG LEU 17 6.329 2.670 -0.006 154 1HD1 LEU 17 HD1 LEU 17 5.658 1.973 2.075 155 2HD1 LEU 17 HD1 LEU 17 5.686 3.620 2.683 156 3HD1 LEU 17 HD1 LEU 17 4.557 3.181 1.381 157 1HD2 LEU 17 HD2 LEU 17 6.780 5.435 1.045 158 2HD2 LEU 17 HD2 LEU 17 7.170 4.863 -0.579 159 3HD2 LEU 17 HD2 LEU 17 5.485 4.927 -0.049 160 H ILE 18 HN ILE 18 7.944 2.880 4.401 161 HA ILE 18 HA ILE 18 5.698 4.410 4.903 162 HB ILE 18 HB ILE 18 7.370 2.873 6.920 163 1HG1 ILE 18 2HG1 ILE 18 4.696 2.098 5.781 164 2HG1 ILE 18 1HG1 ILE 18 6.152 1.682 4.901 165 1HG2 ILE 18 2HG2 ILE 18 5.989 4.600 8.039 166 2HG2 ILE 18 1HG2 ILE 18 4.565 4.014 7.219 167 3HG2 ILE 18 3HG2 ILE 18 5.380 2.996 8.410 168 1HD1 ILE 18 HD1 ILE 18 5.478 0.855 7.715 169 2HD1 ILE 18 HD1 ILE 18 5.345 -0.155 6.267 170 3HD1 ILE 18 HD1 ILE 18 6.926 0.413 6.817 171 H GLN 19 HN GLN 19 9.011 4.771 6.103 172 HA GLN 19 HA GLN 19 8.608 7.030 7.714 173 1HB GLN 19 HB2 GLN 19 11.003 6.228 6.095 174 2HB GLN 19 HB1 GLN 19 11.011 7.508 7.296 175 1HG GLN 19 HG2 GLN 19 10.500 5.847 9.024 176 2HG GLN 19 HG1 GLN 19 10.500 4.586 7.787 177 1HE2 GLN 19 1HE2 GLN 19 12.457 6.757 9.643 178 2HE2 GLN 19 2HE2 GLN 19 13.978 6.066 9.191 179 H LEU 20 HN LEU 20 8.997 6.670 4.248 180 HA LEU 20 HA LEU 20 9.390 9.417 3.715 181 1HB LEU 20 HB2 LEU 20 8.436 7.228 1.874 182 2HB LEU 20 HB1 LEU 20 8.805 8.862 1.364 183 HG LEU 20 HG LEU 20 10.779 6.877 2.499 184 1HD1 LEU 20 HD1 LEU 20 10.046 6.304 0.263 185 2HD1 LEU 20 HD1 LEU 20 10.407 7.940 -0.285 186 3HD1 LEU 20 HD1 LEU 20 11.711 6.880 0.252 187 1HD2 LEU 20 HD2 LEU 20 11.178 9.684 1.456 188 2HD2 LEU 20 HD2 LEU 20 11.436 9.113 3.109 189 3HD2 LEU 20 HD2 LEU 20 12.472 8.538 1.814 190 H VAL 21 HN VAL 21 6.342 7.379 3.318 191 HA VAL 21 HA VAL 21 4.803 9.605 2.845 192 HB VAL 21 HB VAL 21 2.954 8.302 3.167 193 1HG1 VAL 21 1HG1 VAL 21 5.088 6.426 2.356 194 2HG1 VAL 21 3HG1 VAL 21 3.361 6.129 2.153 195 3HG1 VAL 21 2HG1 VAL 21 4.119 7.495 1.323 196 1HG2 VAL 21 3HG2 VAL 21 4.477 6.484 4.994 197 2HG2 VAL 21 2HG2 VAL 21 3.167 7.617 5.382 198 3HG2 VAL 21 1HG2 VAL 21 2.828 6.190 4.396 199 H ALA 22 HN ALA 22 5.983 8.301 5.854 200 HA ALA 22 HA ALA 22 4.272 9.650 7.610 201 1HB ALA 22 HB3 ALA 22 7.088 8.713 8.037 202 2HB ALA 22 HB2 ALA 22 5.914 9.089 9.317 203 3HB ALA 22 HB1 ALA 22 5.634 7.739 8.201 204 H ARG 23 HN ARG 23 7.538 10.429 6.488 205 HA ARG 23 HA ARG 23 7.818 12.861 7.876 206 1HB ARG 23 HB2 ARG 23 9.778 13.278 6.497 207 2HB ARG 23 HB1 ARG 23 9.741 11.596 6.998 208 1HG ARG 23 HG2 ARG 23 8.636 11.156 4.768 209 2HG ARG 23 HG1 ARG 23 9.186 12.753 4.299 210 1HD ARG 23 HD2 ARG 23 10.880 10.420 5.217 211 2HD ARG 23 HD1 ARG 23 10.770 11.067 3.586 212 HE ARG 23 HE ARG 23 11.652 13.151 5.091 213 1HH1 ARG 23 1HH1 ARG 23 12.778 9.819 4.564 214 2HH1 ARG 23 2HH1 ARG 23 14.421 10.201 4.718 215 1HH2 ARG 23 1HH2 ARG 23 13.961 13.652 5.318 216 2HH2 ARG 23 2HH2 ARG 23 15.092 12.410 5.122 217 H HIS 24 HN HIS 24 6.084 12.125 5.069 218 HA HIS 24 HA HIS 24 5.787 14.585 3.832 219 1HB HIS 24 HB2 HIS 24 4.764 12.670 2.820 220 2HB HIS 24 HB1 HIS 24 3.872 12.273 4.249 221 HD1 HIS 24 HD1 HIS 24 1.463 13.129 4.341 222 HD2 HIS 24 HD2 HIS 24 3.748 15.074 1.464 223 HE1 HIS 24 HE1 HIS 24 -0.122 14.615 3.080 224 H GLY 25 HN GLY 25 4.332 13.383 6.834 225 1HA GLY 25 HA1 GLY 25 2.907 15.940 7.117 226 2HA GLY 25 HA2 GLY 25 4.065 15.448 8.345 227 H LEU 26 HN LEU 26 2.898 12.530 7.650 228 HA LEU 26 HA LEU 26 0.359 12.431 8.606 229 1HB LEU 26 HB2 LEU 26 2.604 10.589 8.251 230 2HB LEU 26 HB1 LEU 26 1.294 10.073 9.289 231 HG LEU 26 HG LEU 26 -0.240 10.566 7.461 232 1HD1 LEU 26 HD1 LEU 26 0.955 12.074 6.111 233 2HD1 LEU 26 HD1 LEU 26 2.181 10.841 5.751 234 3HD1 LEU 26 HD1 LEU 26 0.511 10.629 5.198 235 1HD2 LEU 26 HD2 LEU 26 1.842 8.468 6.997 236 2HD2 LEU 26 HD2 LEU 26 0.351 8.311 7.929 237 3HD2 LEU 26 HD2 LEU 26 0.281 8.518 6.180 238 H ASP 27 HN ASP 27 -0.503 11.882 10.498 239 HA ASP 27 HA ASP 27 0.664 12.649 12.979 240 1HB ASP 27 HB2 ASP 27 -1.657 10.729 12.571 241 2HB ASP 27 HB1 ASP 27 -1.328 11.696 13.986 242 H HIS 28 HN HIS 28 1.175 11.071 14.721 243 HA HIS 28 HA HIS 28 2.844 8.981 13.798 244 1HB HIS 28 HB2 HIS 28 1.754 9.448 16.586 245 2HB HIS 28 HB1 HIS 28 3.032 8.301 16.190 246 HD1 HIS 28 HD1 HIS 28 2.666 11.576 17.512 247 HD2 HIS 28 HD2 HIS 28 5.254 9.826 14.775 248 HE1 HIS 28 HE1 HIS 28 4.654 13.091 17.371 249 H ASP 29 HN ASP 29 -0.415 9.004 15.013 250 HA ASP 29 HA ASP 29 -0.903 6.241 15.136 251 1HB ASP 29 HB2 ASP 29 -2.410 7.780 16.190 252 2HB ASP 29 HB1 ASP 29 -2.726 8.596 14.667 253 H LYS 30 HN LYS 30 -1.143 8.557 12.549 254 HA LYS 30 HA LYS 30 -2.411 6.968 10.606 255 1HB LYS 30 HB2 LYS 30 -0.501 9.268 10.356 256 2HB LYS 30 HB1 LYS 30 -1.339 8.553 8.992 257 1HG LYS 30 HG2 LYS 30 -2.788 9.644 11.366 258 2HG LYS 30 HG1 LYS 30 -2.307 10.665 10.010 259 1HD LYS 30 HD2 LYS 30 -3.604 9.151 8.526 260 2HD LYS 30 HD1 LYS 30 -4.117 8.262 9.955 261 1HE LYS 30 HE2 LYS 30 -5.791 9.897 9.206 262 2HE LYS 30 HE1 LYS 30 -5.213 10.202 10.846 263 1HZ LYS 30 HZ3 LYS 30 -4.198 11.624 8.451 264 2HZ LYS 30 HZ2 LYS 30 -5.431 12.235 9.415 265 3HZ LYS 30 HZ1 LYS 30 -3.880 12.024 10.056 266 H VAL 31 HN VAL 31 1.007 7.469 11.419 267 HA VAL 31 HA VAL 31 2.124 6.013 9.300 268 HB VAL 31 HB VAL 31 3.258 6.402 12.091 269 1HG1 VAL 31 1HG1 VAL 31 4.471 4.731 10.834 270 2HG1 VAL 31 3HG1 VAL 31 4.658 5.852 9.487 271 3HG1 VAL 31 2HG1 VAL 31 5.444 6.190 11.029 272 1HG2 VAL 31 1HG2 VAL 31 2.616 8.541 11.122 273 2HG2 VAL 31 3HG2 VAL 31 4.372 8.392 11.202 274 3HG2 VAL 31 2HG2 VAL 31 3.531 8.172 9.665 275 H LEU 32 HN LEU 32 1.095 5.134 12.534 276 HA LEU 32 HA LEU 32 1.915 2.416 12.490 277 1HB LEU 32 HB2 LEU 32 -0.304 3.730 14.034 278 2HB LEU 32 HB1 LEU 32 0.388 2.155 14.379 279 HG LEU 32 HG LEU 32 1.851 4.792 14.566 280 1HD1 LEU 32 HD1 LEU 32 0.813 2.949 16.684 281 2HD1 LEU 32 HD1 LEU 32 1.839 4.363 16.965 282 3HD1 LEU 32 HD1 LEU 32 0.214 4.562 16.302 283 1HD2 LEU 32 HD2 LEU 32 2.752 1.989 15.245 284 2HD2 LEU 32 HD2 LEU 32 3.369 3.015 13.948 285 3HD2 LEU 32 HD2 LEU 32 3.634 3.469 15.627 286 H LEU 33 HN LEU 33 -1.211 3.938 11.791 287 HA LEU 33 HA LEU 33 -2.598 1.589 11.141 288 1HB LEU 33 HB2 LEU 33 -2.995 4.348 9.996 289 2HB LEU 33 HB1 LEU 33 -4.151 3.038 9.920 290 HG LEU 33 HG LEU 33 -3.241 4.443 12.426 291 1HD1 LEU 33 HD1 LEU 33 -5.843 4.570 10.921 292 2HD1 LEU 33 HD1 LEU 33 -5.504 5.338 12.473 293 3HD1 LEU 33 HD1 LEU 33 -4.623 5.842 11.036 294 1HD2 LEU 33 HD2 LEU 33 -5.338 2.305 12.035 295 2HD2 LEU 33 HD2 LEU 33 -3.796 2.107 12.873 296 3HD2 LEU 33 HD2 LEU 33 -5.027 3.183 13.535 297 H PHE 34 HN PHE 34 -0.827 3.839 9.063 298 HA PHE 34 HA PHE 34 -1.306 2.520 6.641 299 1HB PHE 34 HB2 PHE 34 -0.480 4.801 6.684 300 2HB PHE 34 HB1 PHE 34 1.011 4.280 7.454 301 HD1 PHE 34 HD1 PHE 34 2.863 3.722 6.153 302 HD2 PHE 34 HD2 PHE 34 -0.977 3.858 4.332 303 HE1 PHE 34 HE1 PHE 34 3.896 3.417 3.922 304 HE2 PHE 34 HE2 PHE 34 0.060 3.570 2.129 305 HZ PHE 34 HZ PHE 34 2.499 3.346 1.939 306 H SER 35 HN SER 35 1.455 2.265 8.878 307 HA SER 35 HA SER 35 2.910 0.503 7.288 308 1HB SER 35 HB2 SER 35 4.168 -0.035 9.406 309 2HB SER 35 HB1 SER 35 4.044 1.681 9.014 310 HG SER 35 HG SER 35 2.606 1.970 10.565 311 H ARG 36 HN ARG 36 0.529 -0.175 9.809 312 HA ARG 36 HA ARG 36 1.011 -2.962 9.620 313 1HB ARG 36 HB2 ARG 36 -0.926 -3.262 11.074 314 2HB ARG 36 HB1 ARG 36 0.204 -2.081 11.714 315 1HG ARG 36 HG2 ARG 36 -1.336 -0.313 10.790 316 2HG ARG 36 HG1 ARG 36 -2.488 -1.613 10.465 317 1HD ARG 36 HD2 ARG 36 -1.334 -0.831 13.137 318 2HD ARG 36 HD1 ARG 36 -2.990 -0.596 12.584 319 HE ARG 36 HE ARG 36 -2.599 -3.259 12.318 320 1HH1 ARG 36 1HH1 ARG 36 -2.325 -1.062 15.076 321 2HH1 ARG 36 2HH1 ARG 36 -2.752 -2.218 16.235 322 1HH2 ARG 36 1HH2 ARG 36 -3.171 -4.872 13.896 323 2HH2 ARG 36 2HH2 ARG 36 -3.245 -4.473 15.540 324 H ASP 37 HN ASP 37 -1.304 -0.800 8.045 325 HA ASP 37 HA ASP 37 -2.788 -3.012 6.976 326 1HB ASP 37 HB2 ASP 37 -3.702 -0.639 7.205 327 2HB ASP 37 HB1 ASP 37 -2.748 -0.251 5.782 328 H LEU 38 HN LEU 38 -0.143 -1.069 5.949 329 HA LEU 38 HA LEU 38 0.101 -2.107 3.342 330 1HB LEU 38 HB2 LEU 38 1.168 -0.058 3.989 331 2HB LEU 38 HB1 LEU 38 2.086 -0.868 5.228 332 HG LEU 38 HG LEU 38 3.534 -1.887 3.604 333 1HD1 LEU 38 HD1 LEU 38 1.717 -0.690 1.519 334 2HD1 LEU 38 HD1 LEU 38 3.234 -1.560 1.241 335 3HD1 LEU 38 HD1 LEU 38 1.836 -2.417 1.902 336 1HD2 LEU 38 HD2 LEU 38 2.874 0.910 2.867 337 2HD2 LEU 38 HD2 LEU 38 3.954 0.427 4.175 338 3HD2 LEU 38 HD2 LEU 38 4.398 0.088 2.488 339 H ASP 39 HN ASP 39 1.429 -3.051 6.451 340 HA ASP 39 HA ASP 39 3.003 -5.193 5.580 341 1HB ASP 39 HB2 ASP 39 2.996 -4.244 7.898 342 2HB ASP 39 HB1 ASP 39 1.432 -5.003 8.162 343 H LYS 40 HN LYS 40 -0.358 -5.051 6.635 344 HA LYS 40 HA LYS 40 -1.156 -7.661 6.196 345 1HB LYS 40 HB2 LYS 40 -2.626 -5.060 5.910 346 2HB LYS 40 HB1 LYS 40 -3.420 -6.597 5.622 347 1HG LYS 40 HG2 LYS 40 -3.082 -7.262 7.878 348 2HG LYS 40 HG1 LYS 40 -2.035 -5.877 8.170 349 1HD LYS 40 HD2 LYS 40 -4.290 -5.596 9.143 350 2HD LYS 40 HD1 LYS 40 -3.912 -4.345 7.972 351 1HE LYS 40 HE2 LYS 40 -5.554 -6.791 7.308 352 2HE LYS 40 HE1 LYS 40 -6.266 -5.331 7.975 353 1HZ LYS 40 HZ3 LYS 40 -5.369 -4.120 5.970 354 2HZ LYS 40 HZ2 LYS 40 -4.918 -5.619 5.322 355 3HZ LYS 40 HZ1 LYS 40 -6.516 -5.301 5.631 356 H LEU 41 HN LEU 41 -1.219 -4.943 3.919 357 HA LEU 41 HA LEU 41 -2.299 -6.253 1.723 358 1HB LEU 41 HB2 LEU 41 -2.154 -3.836 1.838 359 2HB LEU 41 HB1 LEU 41 -0.410 -3.909 1.833 360 HG LEU 41 HG LEU 41 -0.424 -4.721 -0.476 361 1HD1 LEU 41 HD1 LEU 41 -3.415 -4.458 -0.295 362 2HD1 LEU 41 HD1 LEU 41 -2.495 -4.778 -1.765 363 3HD1 LEU 41 HD1 LEU 41 -2.500 -5.960 -0.456 364 1HD2 LEU 41 HD2 LEU 41 -2.108 -2.253 -0.065 365 2HD2 LEU 41 HD2 LEU 41 -0.343 -2.318 -0.103 366 3HD2 LEU 41 HD2 LEU 41 -1.278 -2.687 -1.555 367 H ILE 42 HN ILE 42 1.090 -5.778 2.580 368 HA ILE 42 HA ILE 42 2.048 -7.117 0.309 369 HB ILE 42 HB ILE 42 3.433 -6.584 2.964 370 1HG1 ILE 42 2HG1 ILE 42 3.534 -5.228 0.278 371 2HG1 ILE 42 1HG1 ILE 42 2.758 -4.595 1.725 372 1HG2 ILE 42 1HG2 ILE 42 4.505 -8.471 1.795 373 2HG2 ILE 42 3HG2 ILE 42 4.626 -7.483 0.338 374 3HG2 ILE 42 2HG2 ILE 42 5.532 -7.033 1.779 375 1HD1 ILE 42 HD1 ILE 42 5.705 -5.092 1.368 376 2HD1 ILE 42 HD1 ILE 42 4.892 -3.521 1.264 377 3HD1 ILE 42 HD1 ILE 42 4.908 -4.404 2.787 378 H ASN 43 HN ASN 43 1.727 -8.339 3.642 379 HA ASN 43 HA ASN 43 2.444 -11.004 3.154 380 1HB ASN 43 HB2 ASN 43 0.484 -9.906 5.183 381 2HB ASN 43 HB1 ASN 43 0.886 -11.612 5.069 382 1HD2 ASN 43 HD2 ASN 43 2.037 -8.463 5.945 383 2HD2 ASN 43 HD2 ASN 43 3.407 -8.981 6.816 384 H LYS 44 HN LYS 44 -0.583 -9.407 2.581 385 HA LYS 44 HA LYS 44 -2.336 -11.530 2.097 386 1HB LYS 44 HB2 LYS 44 -2.987 -9.165 2.260 387 2HB LYS 44 HB1 LYS 44 -2.159 -8.823 0.758 388 1HG LYS 44 HG2 LYS 44 -3.779 -10.369 -0.381 389 2HG LYS 44 HG1 LYS 44 -4.664 -10.451 1.144 390 1HD LYS 44 HD2 LYS 44 -4.115 -7.950 -0.481 391 2HD LYS 44 HD1 LYS 44 -5.665 -8.773 -0.329 392 1HE LYS 44 HE2 LYS 44 -5.650 -8.296 2.084 393 2HE LYS 44 HE1 LYS 44 -4.131 -7.430 1.903 394 1HZ LYS 44 HZ3 LYS 44 -5.293 -5.846 0.413 395 2HZ LYS 44 HZ2 LYS 44 -6.720 -6.669 0.649 396 3HZ LYS 44 HZ1 LYS 44 -5.982 -5.893 1.944 397 H PHE 45 HN PHE 45 -0.060 -9.885 -0.007 398 HA PHE 45 HA PHE 45 -0.791 -11.524 -2.236 399 1HB PHE 45 HB2 PHE 45 1.005 -9.170 -1.891 400 2HB PHE 45 HB1 PHE 45 1.122 -10.168 -3.335 401 HD1 PHE 45 HD1 PHE 45 -1.259 -8.108 -1.342 402 HD2 PHE 45 HD2 PHE 45 -0.362 -9.944 -5.057 403 HE1 PHE 45 HE1 PHE 45 -3.151 -6.928 -2.375 404 HE2 PHE 45 HE2 PHE 45 -2.255 -8.782 -6.099 405 HZ PHE 45 HZ PHE 45 -3.653 -7.259 -4.754 406 H MET 46 HN MET 46 1.749 -11.391 0.093 407 HA MET 46 HA MET 46 3.642 -12.984 -1.398 408 1HB MET 46 HB2 MET 46 3.562 -12.726 1.604 409 2HB MET 46 HB1 MET 46 4.952 -13.081 0.586 410 1HG MET 46 HG2 MET 46 4.736 -10.764 -0.336 411 2HG MET 46 HG1 MET 46 3.473 -10.495 0.842 412 1HE MET 46 HE1 MET 46 7.083 -10.744 0.064 413 2HE MET 46 HE3 MET 46 7.906 -10.849 1.605 414 3HE MET 46 HE2 MET 46 7.039 -12.262 0.978 415 H ASN 47 HN ASN 47 1.194 -13.499 0.979 416 HA ASN 47 HA ASN 47 0.249 -15.217 1.971 417 1HB ASN 47 HB2 ASN 47 -0.350 -15.900 -0.336 418 2HB ASN 47 HB1 ASN 47 1.143 -16.828 -0.431 419 1HD2 ASN 47 HD2 ASN 47 -2.042 -16.667 0.950 420 2HD2 ASN 47 HD2 ASN 47 -2.103 -18.299 1.494 421 H VAL 48 HN VAL 48 1.715 -14.989 3.591 422 HA VAL 48 HA VAL 48 3.374 -17.319 4.031 423 HB VAL 48 HB VAL 48 4.952 -15.860 5.332 424 1HG1 VAL 48 2HG1 VAL 48 5.575 -16.538 3.071 425 2HG1 VAL 48 1HG1 VAL 48 4.739 -15.136 2.407 426 3HG1 VAL 48 3HG1 VAL 48 6.172 -14.911 3.410 427 1HG2 VAL 48 2HG2 VAL 48 3.478 -13.958 5.723 428 2HG2 VAL 48 1HG2 VAL 48 4.969 -13.434 4.940 429 3HG2 VAL 48 3HG2 VAL 48 3.485 -13.584 4.001 430 H LYS 49 HN LYS 49 3.746 -17.359 6.576 431 HA LYS 49 HA LYS 49 1.084 -16.687 7.607 432 1HB LYS 49 HB2 LYS 49 2.607 -19.194 8.245 433 2HB LYS 49 HB1 LYS 49 0.986 -18.777 8.781 434 1HG LYS 49 HG2 LYS 49 0.177 -18.863 6.510 435 2HG LYS 49 HG1 LYS 49 1.797 -19.202 5.919 436 1HD LYS 49 HD2 LYS 49 1.799 -21.248 7.375 437 2HD LYS 49 HD1 LYS 49 0.093 -20.941 7.701 438 1HE LYS 49 HE2 LYS 49 0.337 -22.566 5.936 439 2HE LYS 49 HE1 LYS 49 -0.373 -21.081 5.294 440 1HZ LYS 49 HZ3 LYS 49 2.481 -21.875 5.076 441 2HZ LYS 49 HZ2 LYS 49 1.357 -22.008 3.848 442 3HZ LYS 49 HZ1 LYS 49 1.824 -20.488 4.402 443 H ASP 50 HN ASP 50 4.134 -15.938 8.051 444 HA ASP 50 HA ASP 50 3.566 -15.516 10.873 445 1HB ASP 50 HB2 ASP 50 5.822 -15.846 11.608 446 2HB ASP 50 HB1 ASP 50 5.453 -17.158 10.506 447 H LYS 51 HN LYS 51 2.828 -13.645 10.988 448 HA LYS 51 HA LYS 51 4.562 -11.387 10.304 449 1HB LYS 51 HB2 LYS 51 2.621 -10.102 9.507 450 2HB LYS 51 HB1 LYS 51 2.839 -11.573 8.567 451 1HG LYS 51 HG2 LYS 51 1.048 -12.650 9.825 452 2HG LYS 51 HG1 LYS 51 0.802 -11.172 10.748 453 1HD LYS 51 HD2 LYS 51 0.499 -11.433 7.751 454 2HD LYS 51 HD1 LYS 51 -0.813 -11.462 8.922 455 1HE LYS 51 HE2 LYS 51 1.065 -9.122 8.467 456 2HE LYS 51 HE1 LYS 51 -0.552 -9.262 7.797 457 1HZ LYS 51 HZ2 LYS 51 -1.450 -9.243 10.061 458 2HZ LYS 51 HZ1 LYS 51 0.105 -9.110 10.696 459 3HZ LYS 51 HZ3 LYS 51 -0.532 -7.879 9.766 460 H VAL 52 HN VAL 52 3.890 -13.007 12.621 461 HA VAL 52 HA VAL 52 2.057 -11.652 14.312 462 HB VAL 52 HB VAL 52 3.004 -13.125 16.127 463 1HG1 VAL 52 3HG1 VAL 52 2.166 -14.476 13.573 464 2HG1 VAL 52 2HG1 VAL 52 2.113 -15.189 15.187 465 3HG1 VAL 52 1HG1 VAL 52 1.088 -13.807 14.798 466 1HG2 VAL 52 1HG2 VAL 52 4.667 -14.227 13.853 467 2HG2 VAL 52 3HG2 VAL 52 5.275 -13.378 15.275 468 3HG2 VAL 52 2HG2 VAL 52 4.503 -14.953 15.449 469 H HIS 53 HN HIS 53 2.442 -10.465 16.132 470 HA HIS 53 HA HIS 53 4.858 -8.863 16.086 471 1HB HIS 53 HB2 HIS 53 2.458 -8.748 17.940 472 2HB HIS 53 HB1 HIS 53 3.804 -7.625 17.982 473 HD1 HIS 53 HD1 HIS 53 3.562 -5.573 16.543 474 HD2 HIS 53 HD2 HIS 53 0.891 -8.577 15.509 475 HE1 HIS 53 HE1 HIS 53 1.977 -4.546 14.882 476 H LYS 54 HN LYS 54 3.349 -11.278 17.885 477 HA LYS 54 HA LYS 54 5.490 -11.381 19.882 478 1HB LYS 54 HB2 LYS 54 3.132 -11.449 20.677 479 2HB LYS 54 HB1 LYS 54 2.862 -12.891 19.716 480 1HG LYS 54 HG2 LYS 54 3.150 -13.553 21.990 481 2HG LYS 54 HG1 LYS 54 4.582 -14.053 21.094 482 1HD LYS 54 HD2 LYS 54 5.758 -12.034 21.924 483 2HD LYS 54 HD1 LYS 54 4.329 -11.626 22.874 484 1HE LYS 54 HE2 LYS 54 6.027 -14.107 23.160 485 2HE LYS 54 HE1 LYS 54 5.991 -12.736 24.253 486 1HZ LYS 54 HZ3 LYS 54 3.666 -14.492 23.695 487 2HZ LYS 54 HZ2 LYS 54 4.649 -14.647 25.025 488 3HZ LYS 54 HZ1 LYS 54 3.722 -13.260 24.832 489 H LEU 55 HN LEU 55 7.161 -12.597 19.196 490 HA LEU 55 HA LEU 55 6.772 -14.503 17.106 491 1HB LEU 55 HB2 LEU 55 9.230 -14.959 17.302 492 2HB LEU 55 HB1 LEU 55 8.808 -13.304 16.947 493 HG LEU 55 HG LEU 55 9.221 -12.828 19.418 494 1HD1 LEU 55 HD1 LEU 55 9.166 -15.094 20.273 495 2HD1 LEU 55 HD1 LEU 55 10.582 -15.507 19.305 496 3HD1 LEU 55 HD1 LEU 55 10.719 -14.326 20.611 497 1HD2 LEU 55 HD2 LEU 55 11.505 -13.712 17.671 498 2HD2 LEU 55 HD2 LEU 55 10.729 -12.128 17.675 499 3HD2 LEU 55 HD2 LEU 55 11.630 -12.671 19.091 500 H GLU 56 HN GLU 56 7.038 -16.704 17.105 501 HA GLU 56 HA GLU 56 6.540 -17.894 19.735 502 1HB GLU 56 HB2 GLU 56 5.798 -18.811 16.970 503 2HB GLU 56 HB1 GLU 56 5.572 -19.781 18.415 504 1HG GLU 56 HG2 GLU 56 4.136 -17.962 19.329 505 2HG GLU 56 HG1 GLU 56 4.271 -17.150 17.769 506 H HIS 57 HN HIS 57 9.148 -17.305 18.534 507 HA HIS 57 HA HIS 57 10.238 -19.992 18.077 508 1HB HIS 57 HB2 HIS 57 11.602 -17.290 17.860 509 2HB HIS 57 HB1 HIS 57 12.330 -18.847 17.502 510 HD1 HIS 57 HD1 HIS 57 12.112 -19.645 15.079 511 HD2 HIS 57 HD2 HIS 57 9.455 -16.603 16.050 512 HE1 HIS 57 HE1 HIS 57 11.054 -18.937 12.934 513 H HIS 58 HN HIS 58 11.898 -20.812 19.350 514 HA HIS 58 HA HIS 58 13.087 -21.282 21.166 515 1HB HIS 58 HB2 HIS 58 14.120 -19.044 20.961 516 2HB HIS 58 HB1 HIS 58 12.789 -18.329 21.849 517 HD1 HIS 58 HD1 HIS 58 13.126 -18.134 24.361 518 HD2 HIS 58 HD2 HIS 58 15.855 -20.698 22.561 519 HE1 HIS 58 HE1 HIS 58 14.855 -18.669 26.118 520 H HIS 59 HN HIS 59 11.465 -22.649 21.806 521 HA HIS 59 HA HIS 59 10.073 -21.894 24.275 522 1HB HIS 59 HB2 HIS 59 8.526 -21.423 22.333 523 2HB HIS 59 HB1 HIS 59 8.631 -23.117 21.891 524 HD1 HIS 59 HD1 HIS 59 6.958 -24.697 23.051 525 HD2 HIS 59 HD2 HIS 59 7.181 -20.935 24.817 526 HE1 HIS 59 HE1 HIS 59 5.089 -24.602 24.719 527 H HIS 60 HN HIS 60 12.234 -23.789 23.106 528 HA HIS 60 HA HIS 60 11.088 -26.397 23.475 529 1HB HIS 60 HB2 HIS 60 13.968 -25.621 22.913 530 2HB HIS 60 HB1 HIS 60 13.345 -27.265 22.957 531 HD1 HIS 60 HD1 HIS 60 12.051 -28.094 20.860 532 HD2 HIS 60 HD2 HIS 60 13.183 -24.096 20.679 533 HE1 HIS 60 HE1 HIS 60 11.594 -27.336 18.504 534 H HIS 61 HN HIS 61 10.502 -26.677 25.447 535 HA HIS 61 HA HIS 61 12.290 -26.179 27.696 536 1HB HIS 61 HB2 HIS 61 10.226 -26.690 29.047 537 2HB HIS 61 HB1 HIS 61 10.048 -25.321 27.959 538 HD1 HIS 61 HD1 HIS 61 8.388 -25.660 25.896 539 HD2 HIS 61 HD2 HIS 61 8.565 -28.855 28.559 540 HE1 HIS 61 HE1 HIS 61 6.445 -27.144 25.338 541 H HIS 62 HN HIS 62 12.658 -28.349 25.740 542 HA HIS 62 HA HIS 62 12.371 -30.687 27.485 543 1HB HIS 62 HB2 HIS 62 12.589 -30.548 24.474 544 2HB HIS 62 HB1 HIS 62 12.611 -32.040 25.402 545 HD1 HIS 62 HD1 HIS 62 10.352 -32.930 26.215 546 HD2 HIS 62 HD2 HIS 62 10.115 -29.264 24.297 547 HE1 HIS 62 HE1 HIS 62 7.892 -32.524 25.770 548 H1 MET 101 HT3 MET 101 8.918 22.655 2.206 549 H2 MET 101 HT2 MET 101 7.427 23.318 1.839 550 H3 MET 101 HT1 MET 101 7.876 23.090 3.465 551 HA MET 101 HA MET 101 7.972 20.722 3.081 552 1HB MET 101 HB2 MET 101 5.810 21.623 3.856 553 2HB MET 101 HB1 MET 101 5.337 21.952 2.196 554 1HG MET 101 HG2 MET 101 5.423 19.536 1.710 555 2HG MET 101 HG1 MET 101 5.835 19.227 3.391 556 1HE MET 101 HE3 MET 101 4.174 19.589 5.426 557 2HE MET 101 HE2 MET 101 3.962 21.281 4.971 558 3HE MET 101 HE1 MET 101 2.554 20.263 5.262 559 H GLU 102 HN GLU 102 9.023 19.672 1.587 560 HA GLU 102 HA GLU 102 8.587 20.359 -1.190 561 1HB GLU 102 HB2 GLU 102 10.746 18.770 0.171 562 2HB GLU 102 HB1 GLU 102 10.632 18.947 -1.572 563 1HG GLU 102 HG2 GLU 102 12.222 20.446 -0.738 564 2HG GLU 102 HG1 GLU 102 10.857 21.377 -1.323 565 H MET 103 HN MET 103 6.654 19.451 -0.837 566 HA MET 103 HA MET 103 6.193 16.670 -0.400 567 1HB MET 103 HB2 MET 103 3.831 17.083 -1.113 568 2HB MET 103 HB1 MET 103 4.398 18.139 0.168 569 1HG MET 103 HG2 MET 103 4.768 19.910 -1.519 570 2HG MET 103 HG1 MET 103 4.084 18.841 -2.745 571 1HE MET 103 HE3 MET 103 2.401 20.794 -3.383 572 2HE MET 103 HE2 MET 103 1.322 21.585 -2.232 573 3HE MET 103 HE1 MET 103 3.067 21.826 -2.120 574 H GLY 104 HN GLY 104 6.621 18.510 -3.320 575 1HA GLY 104 HA1 GLY 104 6.864 17.855 -5.500 576 2HA GLY 104 HA2 GLY 104 5.788 16.505 -5.140 577 H GLN 105 HN GLN 105 8.958 17.402 -3.915 578 HA GLN 105 HA GLN 105 10.353 15.331 -5.290 579 1HB GLN 105 HB2 GLN 105 11.139 17.015 -2.927 580 2HB GLN 105 HB1 GLN 105 12.234 15.943 -3.793 581 1HG GLN 105 HG2 GLN 105 11.932 17.228 -5.806 582 2HG GLN 105 HG1 GLN 105 10.784 18.287 -4.995 583 1HE2 GLN 105 1HE2 GLN 105 11.549 19.754 -3.487 584 2HE2 GLN 105 2HE2 GLN 105 13.224 20.164 -3.361 585 H LEU 106 HN LEU 106 9.007 15.683 -2.091 586 HA LEU 106 HA LEU 106 10.064 13.348 -0.984 587 1HB LEU 106 HB2 LEU 106 9.142 15.183 0.347 588 2HB LEU 106 HB1 LEU 106 7.564 14.918 -0.338 589 HG LEU 106 HG LEU 106 7.997 14.189 2.069 590 1HD1 LEU 106 HD1 LEU 106 6.806 12.259 0.112 591 2HD1 LEU 106 HD1 LEU 106 6.568 12.213 1.856 592 3HD1 LEU 106 HD1 LEU 106 5.981 13.591 0.916 593 1HD2 LEU 106 HD2 LEU 106 9.346 11.914 0.625 594 2HD2 LEU 106 HD2 LEU 106 10.114 13.051 1.737 595 3HD2 LEU 106 HD2 LEU 106 8.901 11.912 2.327 596 H LYS 107 HN LYS 107 6.979 13.965 -2.626 597 HA LYS 107 HA LYS 107 6.066 11.310 -2.442 598 1HB LYS 107 HB2 LYS 107 4.953 13.675 -3.137 599 2HB LYS 107 HB1 LYS 107 5.179 12.978 -4.729 600 1HG LYS 107 HG2 LYS 107 3.779 11.559 -2.496 601 2HG LYS 107 HG1 LYS 107 2.923 12.594 -3.625 602 1HD LYS 107 HD2 LYS 107 4.539 10.141 -4.334 603 2HD LYS 107 HD1 LYS 107 2.784 10.176 -4.172 604 1HE LYS 107 HE2 LYS 107 4.424 11.754 -6.151 605 2HE LYS 107 HE1 LYS 107 3.485 10.311 -6.506 606 1HZ LYS 107 HZ2 LYS 107 2.345 12.903 -5.557 607 2HZ LYS 107 HZ1 LYS 107 2.289 12.304 -7.135 608 3HZ LYS 107 HZ3 LYS 107 1.478 11.512 -5.908 609 H ASN 108 HN ASN 108 8.177 12.967 -4.650 610 HA ASN 108 HA ASN 108 8.301 11.088 -6.770 611 1HB ASN 108 HB2 ASN 108 9.219 13.396 -6.902 612 2HB ASN 108 HB1 ASN 108 10.424 12.982 -5.701 613 1HD2 ASN 108 HD2 ASN 108 10.698 14.044 -8.363 614 2HD2 ASN 108 HD2 ASN 108 11.725 12.987 -9.249 615 H LYS 109 HN LYS 109 10.139 11.446 -3.767 616 HA LYS 109 HA LYS 109 11.804 9.186 -4.088 617 1HB LYS 109 HB2 LYS 109 10.843 10.533 -1.556 618 2HB LYS 109 HB1 LYS 109 12.129 9.339 -1.627 619 1HG LYS 109 HG2 LYS 109 13.449 10.836 -3.016 620 2HG LYS 109 HG1 LYS 109 12.152 12.031 -2.967 621 1HD LYS 109 HD2 LYS 109 12.395 12.175 -0.526 622 2HD LYS 109 HD1 LYS 109 13.692 10.981 -0.591 623 1HE LYS 109 HE2 LYS 109 13.721 13.685 -1.927 624 2HE LYS 109 HE1 LYS 109 14.565 13.276 -0.438 625 1HZ LYS 109 HZ3 LYS 109 15.824 11.611 -1.713 626 2HZ LYS 109 HZ2 LYS 109 15.079 12.104 -3.123 627 3HZ LYS 109 HZ1 LYS 109 16.084 13.169 -2.291 628 H ILE 110 HN ILE 110 8.668 9.660 -2.627 629 HA ILE 110 HA ILE 110 8.256 7.110 -1.597 630 HB ILE 110 HB ILE 110 6.321 9.215 -2.544 631 1HG1 ILE 110 2HG1 ILE 110 7.163 8.239 0.173 632 2HG1 ILE 110 1HG1 ILE 110 7.684 9.732 -0.601 633 1HG2 ILE 110 2HG2 ILE 110 5.181 7.060 -2.785 634 2HG2 ILE 110 1HG2 ILE 110 5.617 6.646 -1.128 635 3HG2 ILE 110 3HG2 ILE 110 4.515 7.987 -1.437 636 1HD1 ILE 110 HD1 ILE 110 5.390 10.540 -0.512 637 2HD1 ILE 110 HD1 ILE 110 4.905 9.047 0.291 638 3HD1 ILE 110 HD1 ILE 110 6.041 10.151 1.078 639 H GLU 111 HN GLU 111 7.213 8.402 -4.755 640 HA GLU 111 HA GLU 111 6.151 6.059 -5.841 641 1HB GLU 111 HB2 GLU 111 7.653 8.296 -7.207 642 2HB GLU 111 HB1 GLU 111 6.793 7.025 -8.063 643 1HG GLU 111 HG2 GLU 111 5.540 8.981 -6.153 644 2HG GLU 111 HG1 GLU 111 5.511 9.113 -7.909 645 H ASN 112 HN ASN 112 9.471 7.214 -5.961 646 HA ASN 112 HA ASN 112 10.464 5.020 -7.378 647 1HB ASN 112 HB2 ASN 112 11.836 6.965 -7.299 648 2HB ASN 112 HB1 ASN 112 11.875 6.951 -5.538 649 1HD2 ASN 112 HD2 ASN 112 13.322 5.669 -4.498 650 2HD2 ASN 112 HD2 ASN 112 14.470 4.652 -5.263 651 H LYS 113 HN LYS 113 10.358 5.539 -3.847 652 HA LYS 113 HA LYS 113 11.754 3.164 -3.198 653 1HB LYS 113 HB2 LYS 113 11.281 5.196 -1.684 654 2HB LYS 113 HB1 LYS 113 9.702 4.475 -1.414 655 1HG LYS 113 HG2 LYS 113 10.832 3.609 0.410 656 2HG LYS 113 HG1 LYS 113 11.192 2.351 -0.776 657 1HD LYS 113 HD2 LYS 113 12.961 4.591 0.237 658 2HD LYS 113 HD1 LYS 113 13.123 2.838 0.363 659 1HE LYS 113 HE2 LYS 113 13.647 2.677 -1.997 660 2HE LYS 113 HE1 LYS 113 13.406 4.409 -2.170 661 1HZ LYS 113 HZ3 LYS 113 15.352 3.370 -0.216 662 2HZ LYS 113 HZ2 LYS 113 15.796 3.602 -1.840 663 3HZ LYS 113 HZ1 LYS 113 15.250 4.899 -0.910 664 H LYS 114 HN LYS 114 8.329 3.939 -3.455 665 HA LYS 114 HA LYS 114 7.056 1.630 -2.729 666 1HB LYS 114 HB2 LYS 114 6.027 3.801 -3.362 667 2HB LYS 114 HB1 LYS 114 6.438 3.488 -5.035 668 1HG LYS 114 HG2 LYS 114 4.936 1.522 -4.978 669 2HG LYS 114 HG1 LYS 114 4.494 1.953 -3.326 670 1HD LYS 114 HD2 LYS 114 2.780 2.849 -4.719 671 2HD LYS 114 HD1 LYS 114 3.789 4.212 -4.238 672 1HE LYS 114 HE2 LYS 114 5.002 3.999 -6.402 673 2HE LYS 114 HE1 LYS 114 3.854 2.731 -6.840 674 1HZ LYS 114 HZ2 LYS 114 2.046 4.488 -6.590 675 2HZ LYS 114 HZ1 LYS 114 3.272 5.607 -6.357 676 3HZ LYS 114 HZ3 LYS 114 3.154 4.791 -7.809 677 H LYS 115 HN LYS 115 8.226 2.604 -5.930 678 HA LYS 115 HA LYS 115 7.599 0.200 -7.255 679 1HB LYS 115 HB2 LYS 115 9.597 2.345 -7.966 680 2HB LYS 115 HB1 LYS 115 9.101 1.040 -9.043 681 1HG LYS 115 HG2 LYS 115 6.845 1.857 -9.094 682 2HG LYS 115 HG1 LYS 115 7.206 3.034 -7.839 683 1HD LYS 115 HD2 LYS 115 7.136 4.169 -9.916 684 2HD LYS 115 HD1 LYS 115 8.800 4.123 -9.368 685 1HE LYS 115 HE2 LYS 115 8.754 3.646 -11.751 686 2HE LYS 115 HE1 LYS 115 9.269 2.215 -10.869 687 1HZ LYS 115 HZ2 LYS 115 6.537 2.692 -11.956 688 2HZ LYS 115 HZ1 LYS 115 7.693 1.676 -12.616 689 3HZ LYS 115 HZ3 LYS 115 7.014 1.315 -11.122 690 H GLU 116 HN GLU 116 10.537 1.278 -5.637 691 HA GLU 116 HA GLU 116 12.156 -0.906 -6.357 692 1HB GLU 116 HB2 GLU 116 12.184 0.854 -3.931 693 2HB GLU 116 HB1 GLU 116 13.370 -0.412 -4.165 694 1HG GLU 116 HG2 GLU 116 13.963 0.734 -6.342 695 2HG GLU 116 HG1 GLU 116 12.943 2.069 -5.793 696 H LEU 117 HN LEU 117 9.880 -0.462 -3.717 697 HA LEU 117 HA LEU 117 10.440 -2.933 -2.507 698 1HB LEU 117 HB2 LEU 117 9.473 -1.354 -1.084 699 2HB LEU 117 HB1 LEU 117 8.265 -0.893 -2.249 700 HG LEU 117 HG LEU 117 7.388 -2.089 -0.190 701 1HD1 LEU 117 HD1 LEU 117 6.099 -1.761 -2.070 702 2HD1 LEU 117 HD1 LEU 117 6.660 -3.274 -2.762 703 3HD1 LEU 117 HD1 LEU 117 5.732 -3.293 -1.249 704 1HD2 LEU 117 HD2 LEU 117 8.633 -4.492 -1.479 705 2HD2 LEU 117 HD2 LEU 117 9.137 -3.772 0.051 706 3HD2 LEU 117 HD2 LEU 117 7.532 -4.496 -0.097 707 H ILE 118 HN ILE 118 8.005 -1.879 -4.820 708 HA ILE 118 HA ILE 118 6.558 -4.224 -4.881 709 HB ILE 118 HB ILE 118 7.031 -2.394 -7.267 710 1HG1 ILE 118 2HG1 ILE 118 4.702 -2.400 -5.347 711 2HG1 ILE 118 1HG1 ILE 118 6.099 -1.358 -5.115 712 1HG2 ILE 118 1HG2 ILE 118 4.885 -4.427 -6.636 713 2HG2 ILE 118 3HG2 ILE 118 4.832 -3.335 -8.021 714 3HG2 ILE 118 2HG2 ILE 118 6.097 -4.567 -7.901 715 1HD1 ILE 118 HD1 ILE 118 4.284 -1.350 -7.512 716 2HD1 ILE 118 HD1 ILE 118 4.237 -0.199 -6.172 717 3HD1 ILE 118 HD1 ILE 118 5.648 -0.275 -7.228 718 H GLN 119 HN GLN 119 9.420 -3.274 -6.717 719 HA GLN 119 HA GLN 119 9.707 -5.525 -8.349 720 1HB GLN 119 HB2 GLN 119 11.781 -3.686 -7.165 721 2HB GLN 119 HB1 GLN 119 12.135 -4.891 -8.394 722 1HG GLN 119 HG2 GLN 119 10.721 -3.786 -9.971 723 2HG GLN 119 HG1 GLN 119 10.128 -2.684 -8.735 724 1HE2 GLN 119 1HE2 GLN 119 11.394 -1.065 -8.049 725 2HE2 GLN 119 2HE2 GLN 119 12.820 -0.508 -8.868 726 H LEU 120 HN LEU 120 10.513 -5.047 -4.990 727 HA LEU 120 HA LEU 120 12.087 -7.455 -4.771 728 1HB LEU 120 HB2 LEU 120 10.963 -5.652 -2.630 729 2HB LEU 120 HB1 LEU 120 12.086 -6.966 -2.356 730 HG LEU 120 HG LEU 120 12.674 -4.475 -3.954 731 1HD1 LEU 120 HD1 LEU 120 12.435 -4.016 -1.581 732 2HD1 LEU 120 HD1 LEU 120 13.580 -5.302 -1.206 733 3HD1 LEU 120 HD1 LEU 120 14.114 -3.873 -2.089 734 1HD2 LEU 120 HD2 LEU 120 14.462 -6.760 -3.114 735 2HD2 LEU 120 HD2 LEU 120 13.948 -6.393 -4.762 736 3HD2 LEU 120 HD2 LEU 120 15.001 -5.275 -3.894 737 H VAL 121 HN VAL 121 8.851 -6.441 -3.541 738 HA VAL 121 HA VAL 121 8.325 -9.061 -2.674 739 HB VAL 121 HB VAL 121 7.168 -7.190 -1.674 740 1HG1 VAL 121 3HG1 VAL 121 5.899 -6.661 -4.297 741 2HG1 VAL 121 2HG1 VAL 121 5.410 -5.968 -2.729 742 3HG1 VAL 121 1HG1 VAL 121 7.022 -5.664 -3.353 743 1HG2 VAL 121 1HG2 VAL 121 5.232 -9.030 -3.053 744 2HG2 VAL 121 3HG2 VAL 121 6.008 -9.276 -1.487 745 3HG2 VAL 121 2HG2 VAL 121 4.832 -7.976 -1.700 746 H ALA 122 HN ALA 122 7.920 -7.578 -5.769 747 HA ALA 122 HA ALA 122 6.274 -9.498 -6.974 748 1HB ALA 122 HB2 ALA 122 8.442 -7.855 -8.284 749 2HB ALA 122 HB1 ALA 122 7.105 -8.673 -9.112 750 3HB ALA 122 HB3 ALA 122 6.782 -7.342 -8.008 751 H ARG 123 HN ARG 123 9.812 -9.323 -6.695 752 HA ARG 123 HA ARG 123 10.236 -11.717 -8.206 753 1HB ARG 123 HB2 ARG 123 12.578 -11.488 -7.669 754 2HB ARG 123 HB1 ARG 123 11.928 -9.917 -8.097 755 1HG ARG 123 HG2 ARG 123 11.731 -9.431 -5.645 756 2HG ARG 123 HG1 ARG 123 12.606 -10.933 -5.353 757 1HD ARG 123 HD2 ARG 123 14.116 -9.015 -5.313 758 2HD ARG 123 HD1 ARG 123 14.495 -10.089 -6.658 759 HE ARG 123 HE ARG 123 12.680 -8.086 -7.439 760 1HH1 ARG 123 1HH1 ARG 123 16.113 -8.458 -6.630 761 2HH1 ARG 123 2HH1 ARG 123 16.621 -7.268 -7.743 762 1HH2 ARG 123 1HH2 ARG 123 13.441 -6.441 -8.979 763 2HH2 ARG 123 2HH2 ARG 123 15.089 -6.112 -9.066 764 H HIS 124 HN HIS 124 9.288 -11.158 -5.056 765 HA HIS 124 HA HIS 124 10.389 -13.394 -3.728 766 1HB HIS 124 HB2 HIS 124 9.351 -11.536 -2.489 767 2HB HIS 124 HB1 HIS 124 7.793 -11.877 -3.185 768 HD1 HIS 124 HD1 HIS 124 10.050 -12.887 -0.378 769 HD2 HIS 124 HD2 HIS 124 6.570 -14.222 -2.159 770 HE1 HIS 124 HE1 HIS 124 9.049 -14.533 1.231 771 H GLY 125 HN GLY 125 7.657 -12.984 -5.872 772 1HA GLY 125 HA1 GLY 125 6.591 -15.594 -5.243 773 2HA GLY 125 HA2 GLY 125 7.456 -15.509 -6.770 774 H LEU 126 HN LEU 126 5.745 -12.636 -5.725 775 HA LEU 126 HA LEU 126 3.291 -12.982 -6.658 776 1HB LEU 126 HB2 LEU 126 5.155 -10.787 -6.348 777 2HB LEU 126 HB1 LEU 126 3.737 -10.458 -7.354 778 HG LEU 126 HG LEU 126 2.372 -11.198 -5.456 779 1HD1 LEU 126 HD1 LEU 126 4.907 -11.276 -3.911 780 2HD1 LEU 126 HD1 LEU 126 3.241 -11.308 -3.264 781 3HD1 LEU 126 HD1 LEU 126 3.781 -12.592 -4.340 782 1HD2 LEU 126 HD2 LEU 126 4.212 -8.880 -4.990 783 2HD2 LEU 126 HD2 LEU 126 2.674 -8.861 -5.853 784 3HD2 LEU 126 HD2 LEU 126 2.705 -9.134 -4.105 785 H ASP 127 HN ASP 127 2.430 -13.364 -8.376 786 HA ASP 127 HA ASP 127 3.751 -13.613 -10.916 787 1HB ASP 127 HB2 ASP 127 1.761 -14.986 -10.096 788 2HB ASP 127 HB1 ASP 127 0.784 -13.557 -10.355 789 H HIS 128 HN HIS 128 2.741 -12.433 -12.869 790 HA HIS 128 HA HIS 128 3.052 -9.692 -12.538 791 1HB HIS 128 HB2 HIS 128 1.888 -11.287 -14.804 792 2HB HIS 128 HB1 HIS 128 1.980 -9.530 -14.858 793 HD1 HIS 128 HD1 HIS 128 4.075 -12.593 -15.301 794 HD2 HIS 128 HD2 HIS 128 4.607 -8.483 -14.935 795 HE1 HIS 128 HE1 HIS 128 6.421 -12.128 -16.024 796 H ASP 129 HN ASP 129 0.122 -11.669 -12.309 797 HA ASP 129 HA ASP 129 -1.633 -9.433 -12.521 798 1HB ASP 129 HB2 ASP 129 -3.415 -10.886 -11.945 799 2HB ASP 129 HB1 ASP 129 -2.264 -11.961 -12.722 800 H LYS 130 HN LYS 130 0.052 -11.005 -10.023 801 HA LYS 130 HA LYS 130 -1.134 -9.795 -7.776 802 1HB LYS 130 HB2 LYS 130 1.575 -11.018 -8.203 803 2HB LYS 130 HB1 LYS 130 0.944 -10.534 -6.639 804 1HG LYS 130 HG2 LYS 130 -0.527 -12.466 -8.389 805 2HG LYS 130 HG1 LYS 130 0.778 -12.981 -7.318 806 1HD LYS 130 HD2 LYS 130 -0.361 -12.330 -5.417 807 2HD LYS 130 HD1 LYS 130 -1.536 -11.365 -6.282 808 1HE LYS 130 HE2 LYS 130 -1.224 -14.368 -6.448 809 2HE LYS 130 HE1 LYS 130 -2.419 -13.547 -5.450 810 1HZ LYS 130 HZ2 LYS 130 -2.384 -13.211 -8.445 811 2HZ LYS 130 HZ1 LYS 130 -3.285 -14.390 -7.624 812 3HZ LYS 130 HZ3 LYS 130 -3.544 -12.779 -7.358 813 H VAL 131 HN VAL 131 1.720 -9.089 -9.720 814 HA VAL 131 HA VAL 131 2.651 -6.914 -8.190 815 HB VAL 131 HB VAL 131 3.075 -7.286 -11.178 816 1HG1 VAL 131 1HG1 VAL 131 3.774 -5.126 -10.387 817 2HG1 VAL 131 3HG1 VAL 131 4.748 -5.884 -9.130 818 3HG1 VAL 131 2HG1 VAL 131 5.166 -6.116 -10.828 819 1HG2 VAL 131 2HG2 VAL 131 4.622 -8.469 -8.888 820 2HG2 VAL 131 1HG2 VAL 131 3.590 -9.328 -10.036 821 3HG2 VAL 131 3HG2 VAL 131 5.073 -8.555 -10.602 822 H LEU 132 HN LEU 132 0.464 -7.103 -10.947 823 HA LEU 132 HA LEU 132 0.040 -4.323 -11.294 824 1HB LEU 132 HB2 LEU 132 -1.910 -6.561 -11.810 825 2HB LEU 132 HB1 LEU 132 -1.992 -4.941 -12.467 826 HG LEU 132 HG LEU 132 0.015 -7.076 -13.133 827 1HD1 LEU 132 HD1 LEU 132 -2.117 -7.371 -14.181 828 2HD1 LEU 132 HD1 LEU 132 -2.078 -5.704 -14.770 829 3HD1 LEU 132 HD1 LEU 132 -0.909 -6.883 -15.375 830 1HD2 LEU 132 HD2 LEU 132 -0.071 -4.206 -14.060 831 2HD2 LEU 132 HD2 LEU 132 1.182 -4.962 -13.073 832 3HD2 LEU 132 HD2 LEU 132 0.950 -5.467 -14.746 833 H LEU 133 HN LEU 133 -1.924 -6.698 -9.579 834 HA LEU 133 HA LEU 133 -3.766 -4.851 -8.563 835 1HB LEU 133 HB2 LEU 133 -2.927 -7.537 -7.537 836 2HB LEU 133 HB1 LEU 133 -4.326 -6.652 -6.949 837 HG LEU 133 HG LEU 133 -3.941 -7.601 -9.783 838 1HD1 LEU 133 HD1 LEU 133 -5.627 -8.725 -7.560 839 2HD1 LEU 133 HD1 LEU 133 -5.696 -9.214 -9.256 840 3HD1 LEU 133 HD1 LEU 133 -4.221 -9.486 -8.335 841 1HD2 LEU 133 HD2 LEU 133 -6.277 -6.309 -8.384 842 2HD2 LEU 133 HD2 LEU 133 -5.315 -5.639 -9.708 843 3HD2 LEU 133 HD2 LEU 133 -6.336 -7.039 -9.990 844 H PHE 134 HN PHE 134 -0.800 -6.128 -7.165 845 HA PHE 134 HA PHE 134 -1.079 -4.916 -4.669 846 1HB PHE 134 HB2 PHE 134 0.466 -6.752 -5.014 847 2HB PHE 134 HB1 PHE 134 1.403 -5.789 -6.148 848 HD1 PHE 134 HD1 PHE 134 3.127 -4.436 -5.414 849 HD2 PHE 134 HD2 PHE 134 0.335 -5.991 -2.614 850 HE1 PHE 134 HE1 PHE 134 4.523 -3.607 -3.559 851 HE2 PHE 134 HE2 PHE 134 1.722 -5.162 -0.770 852 HZ PHE 134 HZ PHE 134 3.835 -3.960 -1.274 853 H SER 135 HN SER 135 0.668 -3.805 -7.597 854 HA SER 135 HA SER 135 1.672 -1.496 -6.356 855 1HB SER 135 HB2 SER 135 2.061 -0.669 -8.717 856 2HB SER 135 HB1 SER 135 2.724 -2.267 -8.366 857 HG SER 135 HG SER 135 1.165 -3.204 -9.500 858 H ARG 136 HN ARG 136 -1.303 -2.103 -8.034 859 HA ARG 136 HA ARG 136 -2.321 0.524 -8.218 860 1HB ARG 136 HB2 ARG 136 -3.716 -2.086 -7.846 861 2HB ARG 136 HB1 ARG 136 -4.551 -0.594 -8.257 862 1HG ARG 136 HG2 ARG 136 -3.459 -0.510 -10.373 863 2HG ARG 136 HG1 ARG 136 -2.403 -1.856 -9.913 864 1HD ARG 136 HD2 ARG 136 -4.283 -3.343 -9.822 865 2HD ARG 136 HD1 ARG 136 -5.409 -2.046 -10.218 866 HE ARG 136 HE ARG 136 -3.390 -2.256 -12.161 867 1HH1 ARG 136 1HH1 ARG 136 -6.313 -3.961 -11.082 868 2HH1 ARG 136 2HH1 ARG 136 -6.563 -4.702 -12.598 869 1HH2 ARG 136 1HH2 ARG 136 -3.793 -3.270 -14.211 870 2HH2 ARG 136 2HH2 ARG 136 -5.147 -4.286 -14.391 871 H ASP 137 HN ASP 137 -2.820 -2.006 -5.761 872 HA ASP 137 HA ASP 137 -4.488 -0.299 -4.196 873 1HB ASP 137 HB2 ASP 137 -4.647 -2.823 -4.356 874 2HB ASP 137 HB1 ASP 137 -3.260 -2.889 -3.284 875 H LEU 138 HN LEU 138 -1.140 -1.236 -4.093 876 HA LEU 138 HA LEU 138 -0.482 -0.049 -1.629 877 1HB LEU 138 HB2 LEU 138 1.075 -1.528 -2.668 878 2HB LEU 138 HB1 LEU 138 1.091 -0.591 -4.139 879 HG LEU 138 HG LEU 138 2.388 1.162 -3.044 880 1HD1 LEU 138 HD1 LEU 138 2.284 -0.586 -0.606 881 2HD1 LEU 138 HD1 LEU 138 3.257 0.878 -0.821 882 3HD1 LEU 138 HD1 LEU 138 1.496 0.991 -0.803 883 1HD2 LEU 138 HD2 LEU 138 3.491 -1.594 -2.587 884 2HD2 LEU 138 HD2 LEU 138 3.573 -0.666 -4.085 885 3HD2 LEU 138 HD2 LEU 138 4.432 -0.105 -2.647 886 H ASP 139 HN ASP 139 -0.596 1.209 -4.917 887 HA ASP 139 HA ASP 139 0.257 3.823 -4.326 888 1HB ASP 139 HB2 ASP 139 0.144 2.884 -6.607 889 2HB ASP 139 HB1 ASP 139 -1.612 2.899 -6.529 890 H LYS 140 HN LYS 140 -2.893 2.292 -4.355 891 HA LYS 140 HA LYS 140 -4.496 4.510 -3.776 892 1HB LYS 140 HB2 LYS 140 -4.813 1.589 -3.143 893 2HB LYS 140 HB1 LYS 140 -6.015 2.771 -2.668 894 1HG LYS 140 HG2 LYS 140 -6.480 3.288 -4.976 895 2HG LYS 140 HG1 LYS 140 -5.139 2.266 -5.500 896 1HD LYS 140 HD2 LYS 140 -7.403 1.203 -5.724 897 2HD LYS 140 HD1 LYS 140 -6.270 0.267 -4.767 898 1HE LYS 140 HE2 LYS 140 -8.450 0.251 -3.721 899 2HE LYS 140 HE1 LYS 140 -7.330 1.145 -2.708 900 1HZ LYS 140 HZ1 LYS 140 -8.282 3.221 -3.598 901 2HZ LYS 140 HZ3 LYS 140 -9.338 2.328 -4.550 902 3HZ LYS 140 HZ2 LYS 140 -9.466 2.275 -2.884 903 H LEU 141 HN LEU 141 -2.968 2.138 -1.616 904 HA LEU 141 HA LEU 141 -3.897 3.044 0.857 905 1HB LEU 141 HB2 LEU 141 -2.285 1.021 0.033 906 2HB LEU 141 HB1 LEU 141 -1.084 2.100 0.687 907 HG LEU 141 HG LEU 141 -3.125 0.465 2.050 908 1HD1 LEU 141 HD1 LEU 141 -1.014 -0.396 1.988 909 2HD1 LEU 141 HD1 LEU 141 -0.337 1.059 2.727 910 3HD1 LEU 141 HD1 LEU 141 -1.446 0.040 3.646 911 1HD2 LEU 141 HD2 LEU 141 -2.217 3.085 3.140 912 2HD2 LEU 141 HD2 LEU 141 -3.865 2.540 2.931 913 3HD2 LEU 141 HD2 LEU 141 -2.847 1.779 4.168 914 H ILE 142 HN ILE 142 -0.992 3.843 -0.937 915 HA ILE 142 HA ILE 142 0.031 5.655 0.918 916 HB ILE 142 HB ILE 142 0.585 5.421 -2.056 917 1HG1 ILE 142 2HG1 ILE 142 2.143 4.569 0.383 918 2HG1 ILE 142 1HG1 ILE 142 1.203 3.494 -0.645 919 1HG2 ILE 142 3HG2 ILE 142 1.986 7.069 0.041 920 2HG2 ILE 142 2HG2 ILE 142 2.619 6.770 -1.582 921 3HG2 ILE 142 1HG2 ILE 142 1.123 7.685 -1.363 922 1HD1 ILE 142 HD1 ILE 142 3.627 5.074 -1.476 923 2HD1 ILE 142 HD1 ILE 142 3.584 3.349 -1.096 924 3HD1 ILE 142 HD1 ILE 142 2.696 3.962 -2.488 925 H ASN 143 HN ASN 143 -1.681 6.401 -2.104 926 HA ASN 143 HA ASN 143 -1.945 9.151 -1.753 927 1HB ASN 143 HB2 ASN 143 -3.796 7.232 -3.156 928 2HB ASN 143 HB1 ASN 143 -4.150 8.951 -3.009 929 1HD2 ASN 143 HD2 ASN 143 -2.018 6.594 -4.421 930 2HD2 ASN 143 HD2 ASN 143 -1.356 7.635 -5.614 931 H LYS 144 HN LYS 144 -3.904 6.609 -0.401 932 HA LYS 144 HA LYS 144 -6.041 8.009 0.715 933 1HB LYS 144 HB2 LYS 144 -5.683 5.524 0.612 934 2HB LYS 144 HB1 LYS 144 -4.509 5.684 1.898 935 1HG LYS 144 HG2 LYS 144 -6.454 6.662 3.289 936 2HG LYS 144 HG1 LYS 144 -7.477 5.993 2.005 937 1HD LYS 144 HD2 LYS 144 -5.502 4.407 3.609 938 2HD LYS 144 HD1 LYS 144 -7.238 4.450 3.887 939 1HE LYS 144 HE2 LYS 144 -5.921 3.513 1.329 940 2HE LYS 144 HE1 LYS 144 -6.474 2.479 2.639 941 1HZ LYS 144 HZ2 LYS 144 -8.735 3.208 2.238 942 2HZ LYS 144 HZ1 LYS 144 -8.226 4.229 0.981 943 3HZ LYS 144 HZ3 LYS 144 -8.070 2.565 0.861 944 H PHE 145 HN PHE 145 -2.941 7.082 2.162 945 HA PHE 145 HA PHE 145 -3.385 8.659 4.492 946 1HB PHE 145 HB2 PHE 145 -1.287 6.769 3.613 947 2HB PHE 145 HB1 PHE 145 -0.927 7.891 4.918 948 HD1 PHE 145 HD1 PHE 145 -3.015 5.056 3.910 949 HD2 PHE 145 HD2 PHE 145 -2.017 7.781 6.990 950 HE1 PHE 145 HE1 PHE 145 -4.238 3.649 5.523 951 HE2 PHE 145 HE2 PHE 145 -3.240 6.382 8.632 952 HZ PHE 145 HZ PHE 145 -4.350 4.315 7.888 953 H MET 146 HN MET 146 -1.811 9.226 1.520 954 HA MET 146 HA MET 146 -0.176 11.360 2.537 955 1HB MET 146 HB2 MET 146 -0.970 10.736 -0.298 956 2HB MET 146 HB1 MET 146 0.216 11.953 0.156 957 1HG MET 146 HG2 MET 146 1.214 9.705 1.354 958 2HG MET 146 HG1 MET 146 0.362 9.052 -0.009 959 1HE MET 146 HE3 MET 146 3.188 11.360 1.140 960 2HE MET 146 HE2 MET 146 3.765 12.102 -0.357 961 3HE MET 146 HE1 MET 146 2.177 12.526 0.286 962 H ASN 147 HN ASN 147 -3.357 11.075 2.341 963 HA ASN 147 HA ASN 147 -5.161 12.350 2.282 964 1HB ASN 147 HB2 ASN 147 -3.061 14.368 2.834 965 2HB ASN 147 HB1 ASN 147 -4.776 14.842 2.797 966 1HD2 ASN 147 HD2 ASN 147 -2.932 15.053 4.970 967 2HD2 ASN 147 HD2 ASN 147 -3.513 14.059 6.251 968 H VAL 148 HN VAL 148 -3.852 11.724 -0.201 969 HA VAL 148 HA VAL 148 -4.343 14.071 -1.849 970 HB VAL 148 HB VAL 148 -3.764 11.284 -2.783 971 1HG1 VAL 148 3HG1 VAL 148 -4.729 12.711 -4.511 972 2HG1 VAL 148 2HG1 VAL 148 -3.511 13.946 -4.202 973 3HG1 VAL 148 1HG1 VAL 148 -3.036 12.394 -4.893 974 1HG2 VAL 148 2HG2 VAL 148 -1.930 12.089 -1.376 975 2HG2 VAL 148 1HG2 VAL 148 -1.409 11.934 -3.065 976 3HG2 VAL 148 3HG2 VAL 148 -1.793 13.519 -2.391 977 H LYS 149 HN LYS 149 -6.228 14.363 -1.305 978 HA LYS 149 HA LYS 149 -8.221 12.768 -2.729 979 1HB LYS 149 HB2 LYS 149 -9.790 13.353 -0.865 980 2HB LYS 149 HB1 LYS 149 -8.495 12.251 -0.394 981 1HG LYS 149 HG2 LYS 149 -7.260 14.088 0.575 982 2HG LYS 149 HG1 LYS 149 -8.481 15.228 0.034 983 1HD LYS 149 HD2 LYS 149 -10.108 14.204 1.519 984 2HD LYS 149 HD1 LYS 149 -8.906 13.006 2.019 985 1HE LYS 149 HE2 LYS 149 -9.096 14.844 3.636 986 2HE LYS 149 HE1 LYS 149 -7.490 14.741 2.924 987 1HZ LYS 149 HZ1 LYS 149 -8.105 16.604 1.416 988 2HZ LYS 149 HZ3 LYS 149 -9.614 16.691 2.166 989 3HZ LYS 149 HZ2 LYS 149 -8.230 17.023 3.040 990 H ASP 150 HN ASP 150 -6.576 15.397 -2.751 991 HA ASP 150 HA ASP 150 -8.772 17.191 -3.464 992 1HB ASP 150 HB2 ASP 150 -6.227 17.989 -2.007 993 2HB ASP 150 HB1 ASP 150 -7.465 19.093 -2.575 994 H LYS 151 HN LYS 151 -8.572 17.023 -5.587 995 HA LYS 151 HA LYS 151 -5.953 17.683 -6.727 996 1HB LYS 151 HB2 LYS 151 -6.665 16.442 -8.753 997 2HB LYS 151 HB1 LYS 151 -6.497 15.421 -7.335 998 1HG LYS 151 HG2 LYS 151 -8.932 15.428 -7.048 999 2HG LYS 151 HG1 LYS 151 -9.091 16.449 -8.478 1000 1HD LYS 151 HD2 LYS 151 -7.846 13.695 -8.446 1001 2HD LYS 151 HD1 LYS 151 -9.507 14.045 -8.918 1002 1HE LYS 151 HE2 LYS 151 -7.039 15.157 -10.272 1003 2HE LYS 151 HE1 LYS 151 -7.977 13.790 -10.854 1004 1HZ LYS 151 HZ1 LYS 151 -9.072 16.549 -10.526 1005 2HZ LYS 151 HZ3 LYS 151 -8.581 15.887 -11.986 1006 3HZ LYS 151 HZ2 LYS 151 -9.870 15.228 -11.181 1007 H VAL 152 HN VAL 152 -8.342 19.160 -5.812 1008 HA VAL 152 HA VAL 152 -9.191 20.506 -8.267 1009 HB VAL 152 HB VAL 152 -11.006 21.473 -6.876 1010 1HG1 VAL 152 2HG1 VAL 152 -10.819 18.468 -6.757 1011 2HG1 VAL 152 1HG1 VAL 152 -12.297 19.408 -6.531 1012 3HG1 VAL 152 3HG1 VAL 152 -11.462 19.439 -8.082 1013 1HG2 VAL 152 3HG2 VAL 152 -9.887 21.466 -4.702 1014 2HG2 VAL 152 2HG2 VAL 152 -11.425 20.612 -4.610 1015 3HG2 VAL 152 1HG2 VAL 152 -9.915 19.702 -4.679 1016 H HIS 153 HN HIS 153 -9.658 22.914 -7.745 1017 HA HIS 153 HA HIS 153 -7.233 24.133 -6.851 1018 1HB HIS 153 HB2 HIS 153 -9.903 25.315 -7.677 1019 2HB HIS 153 HB1 HIS 153 -8.466 26.260 -7.305 1020 HD1 HIS 153 HD1 HIS 153 -10.014 24.205 -10.005 1021 HD2 HIS 153 HD2 HIS 153 -6.418 26.106 -9.191 1022 HE1 HIS 153 HE1 HIS 153 -8.731 24.249 -12.176 1023 H LYS 154 HN LYS 154 -6.850 24.991 -4.895 1024 HA LYS 154 HA LYS 154 -8.583 24.134 -2.819 1025 1HB LYS 154 HB2 LYS 154 -6.064 25.766 -2.660 1026 2HB LYS 154 HB1 LYS 154 -6.963 25.196 -1.265 1027 1HG LYS 154 HG2 LYS 154 -6.614 22.851 -2.210 1028 2HG LYS 154 HG1 LYS 154 -5.416 23.591 -3.275 1029 1HD LYS 154 HD2 LYS 154 -5.409 23.747 -0.260 1030 2HD LYS 154 HD1 LYS 154 -4.428 22.642 -1.210 1031 1HE LYS 154 HE2 LYS 154 -4.282 25.652 -1.445 1032 2HE LYS 154 HE1 LYS 154 -3.245 24.700 -0.386 1033 1HZ LYS 154 HZ1 LYS 154 -3.374 24.407 -3.354 1034 2HZ LYS 154 HZ3 LYS 154 -2.190 25.225 -2.497 1035 3HZ LYS 154 HZ2 LYS 154 -2.358 23.571 -2.314 1036 H LEU 155 HN LEU 155 -10.354 25.064 -2.516 1037 HA LEU 155 HA LEU 155 -10.430 27.968 -2.096 1038 1HB LEU 155 HB2 LEU 155 -12.685 26.056 -2.762 1039 2HB LEU 155 HB1 LEU 155 -12.856 27.775 -2.490 1040 HG LEU 155 HG LEU 155 -11.423 26.488 -4.814 1041 1HD1 LEU 155 HD1 LEU 155 -13.839 26.225 -4.912 1042 2HD1 LEU 155 HD1 LEU 155 -14.043 27.959 -4.658 1043 3HD1 LEU 155 HD1 LEU 155 -13.275 27.367 -6.131 1044 1HD2 LEU 155 HD2 LEU 155 -11.974 29.381 -4.172 1045 2HD2 LEU 155 HD2 LEU 155 -10.387 28.611 -4.249 1046 3HD2 LEU 155 HD2 LEU 155 -11.363 28.790 -5.710 1047 H GLU 156 HN GLU 156 -12.480 28.210 -0.435 1048 HA GLU 156 HA GLU 156 -11.671 26.587 1.762 1049 1HB GLU 156 HB2 GLU 156 -13.368 27.888 3.072 1050 2HB GLU 156 HB1 GLU 156 -12.105 28.859 2.339 1051 1HG GLU 156 HG2 GLU 156 -13.652 29.532 0.582 1052 2HG GLU 156 HG1 GLU 156 -14.918 28.541 1.313 1053 H HIS 157 HN HIS 157 -12.230 24.628 1.716 1054 HA HIS 157 HA HIS 157 -14.714 23.729 0.596 1055 1HB HIS 157 HB2 HIS 157 -12.612 22.183 2.161 1056 2HB HIS 157 HB1 HIS 157 -13.977 21.460 1.315 1057 HD1 HIS 157 HD1 HIS 157 -10.761 21.090 0.684 1058 HD2 HIS 157 HD2 HIS 157 -13.568 23.280 -1.459 1059 HE1 HIS 157 HE1 HIS 157 -9.881 21.245 -1.649 1060 H HIS 158 HN HIS 158 -13.396 24.483 3.625 1061 HA HIS 158 HA HIS 158 -15.864 23.827 5.013 1062 1HB HIS 158 HB2 HIS 158 -13.246 25.050 5.951 1063 2HB HIS 158 HB1 HIS 158 -14.636 24.812 6.992 1064 HD1 HIS 158 HD1 HIS 158 -14.119 22.903 8.496 1065 HD2 HIS 158 HD2 HIS 158 -12.699 22.245 4.653 1066 HE1 HIS 158 HE1 HIS 158 -13.037 20.617 8.528 1067 H HIS 159 HN HIS 159 -17.264 25.243 3.987 1068 HA HIS 159 HA HIS 159 -16.414 27.959 3.617 1069 1HB HIS 159 HB2 HIS 159 -17.630 26.849 1.778 1070 2HB HIS 159 HB1 HIS 159 -19.046 26.699 2.811 1071 HD1 HIS 159 HD1 HIS 159 -16.913 29.852 2.395 1072 HD2 HIS 159 HD2 HIS 159 -20.735 28.416 1.569 1073 HE1 HIS 159 HE1 HIS 159 -18.218 31.808 1.523 1074 H HIS 160 HN HIS 160 -16.164 28.499 5.594 1075 HA HIS 160 HA HIS 160 -18.042 30.147 6.811 1076 1HB HIS 160 HB2 HIS 160 -18.865 27.792 7.584 1077 2HB HIS 160 HB1 HIS 160 -17.345 27.675 8.453 1078 HD1 HIS 160 HD1 HIS 160 -20.756 28.964 8.735 1079 HD2 HIS 160 HD2 HIS 160 -17.100 29.622 10.577 1080 HE1 HIS 160 HE1 HIS 160 -21.266 30.165 10.899 1081 H HIS 161 HN HIS 161 -16.705 31.555 8.025 1082 HA HIS 161 HA HIS 161 -13.957 31.310 7.514 1083 1HB HIS 161 HB2 HIS 161 -15.059 33.523 7.809 1084 2HB HIS 161 HB1 HIS 161 -15.237 33.180 9.527 1085 HD1 HIS 161 HD1 HIS 161 -13.233 33.717 11.027 1086 HD2 HIS 161 HD2 HIS 161 -12.330 33.837 6.973 1087 HE1 HIS 161 HE1 HIS 161 -10.894 34.592 10.868 1088 H HIS 162 HN HIS 162 -15.546 31.189 10.733 1089 HA HIS 162 HA HIS 162 -13.517 29.203 11.376 1090 1HB HIS 162 HB2 HIS 162 -12.862 31.452 12.392 1091 2HB HIS 162 HB1 HIS 162 -14.326 31.355 13.367 1092 HD1 HIS 162 HD1 HIS 162 -10.817 30.581 13.592 1093 HD2 HIS 162 HD2 HIS 162 -14.307 28.783 14.939 1094 HE1 HIS 162 HE1 HIS 162 -10.124 28.942 15.373 No H/Q in entry = 1094 Start of MODEL 20 1 H1 MET 1 HT2 MET 1 17.129 -15.280 -4.103 2 H2 MET 1 HT1 MET 1 18.734 -15.477 -3.657 3 H3 MET 1 HT3 MET 1 18.259 -15.590 -5.296 4 HA MET 1 HA MET 1 16.991 -17.574 -4.845 5 1HB MET 1 HB2 MET 1 19.592 -17.849 -3.306 6 2HB MET 1 HB1 MET 1 18.709 -19.124 -4.124 7 1HG MET 1 HG2 MET 1 20.113 -16.826 -5.466 8 2HG MET 1 HG1 MET 1 20.744 -18.461 -5.310 9 1HE MET 1 HE1 MET 1 20.559 -16.836 -8.041 10 2HE MET 1 HE3 MET 1 21.212 -18.467 -7.914 11 3HE MET 1 HE2 MET 1 19.996 -18.097 -9.135 12 H GLU 2 HN GLU 2 18.414 -16.064 -2.035 13 HA GLU 2 HA GLU 2 17.157 -17.620 -0.032 14 1HB GLU 2 HB2 GLU 2 18.096 -14.847 0.488 15 2HB GLU 2 HB1 GLU 2 18.343 -16.303 1.427 16 1HG GLU 2 HG2 GLU 2 20.421 -15.747 0.749 17 2HG GLU 2 HG1 GLU 2 19.981 -16.990 -0.419 18 H MET 3 HN MET 3 15.073 -17.373 0.499 19 HA MET 3 HA MET 3 13.684 -14.992 -0.458 20 1HB MET 3 HB2 MET 3 11.568 -16.044 0.090 21 2HB MET 3 HB1 MET 3 12.553 -17.122 -0.874 22 1HG MET 3 HG2 MET 3 13.116 -18.412 1.105 23 2HG MET 3 HG1 MET 3 12.197 -17.299 2.112 24 1HE MET 3 HE2 MET 3 9.563 -17.038 2.013 25 2HE MET 3 HE1 MET 3 9.614 -16.707 0.285 26 3HE MET 3 HE3 MET 3 8.524 -17.942 0.913 27 H GLY 4 HN GLY 4 14.794 -16.280 2.516 28 1HA GLY 4 HA1 GLY 4 14.722 -15.465 4.675 29 2HA GLY 4 HA2 GLY 4 13.219 -14.655 4.248 30 H GLN 5 HN GLN 5 16.484 -14.365 2.944 31 HA GLN 5 HA GLN 5 17.016 -11.822 4.073 32 1HB GLN 5 HB2 GLN 5 18.238 -13.022 1.570 33 2HB GLN 5 HB1 GLN 5 18.884 -11.670 2.481 34 1HG GLN 5 HG2 GLN 5 18.655 -14.522 3.419 35 2HG GLN 5 HG1 GLN 5 20.132 -13.656 3.006 36 1HE2 GLN 5 1HE2 GLN 5 20.936 -12.136 4.454 37 2HE2 GLN 5 2HE2 GLN 5 20.397 -12.021 6.084 38 H LEU 6 HN LEU 6 15.472 -12.840 1.141 39 HA LEU 6 HA LEU 6 15.220 -10.328 -0.116 40 1HB LEU 6 HB2 LEU 6 14.920 -12.487 -1.273 41 2HB LEU 6 HB1 LEU 6 13.552 -12.853 -0.268 42 HG LEU 6 HG LEU 6 13.103 -12.233 -2.685 43 1HD1 LEU 6 HD1 LEU 6 11.679 -10.683 -0.559 44 2HD1 LEU 6 HD1 LEU 6 11.089 -10.966 -2.197 45 3HD1 LEU 6 HD1 LEU 6 11.324 -12.324 -1.093 46 1HD2 LEU 6 HD2 LEU 6 14.621 -10.350 -2.876 47 2HD2 LEU 6 HD2 LEU 6 12.960 -9.860 -3.227 48 3HD2 LEU 6 HD2 LEU 6 13.687 -9.460 -1.670 49 H LYS 7 HN LYS 7 13.146 -12.126 2.105 50 HA LYS 7 HA LYS 7 11.107 -10.217 2.349 51 1HB LYS 7 HB2 LYS 7 11.813 -12.702 3.589 52 2HB LYS 7 HB1 LYS 7 11.346 -11.551 4.831 53 1HG LYS 7 HG2 LYS 7 9.671 -12.147 2.398 54 2HG LYS 7 HG1 LYS 7 9.493 -12.996 3.925 55 1HD LYS 7 HD2 LYS 7 9.278 -9.995 3.671 56 2HD LYS 7 HD1 LYS 7 7.876 -11.069 3.555 57 1HE LYS 7 HE2 LYS 7 8.460 -11.922 5.830 58 2HE LYS 7 HE1 LYS 7 9.730 -10.706 5.907 59 1HZ LYS 7 HZ1 LYS 7 6.832 -10.149 5.607 60 2HZ LYS 7 HZ3 LYS 7 7.677 -10.041 7.031 61 3HZ LYS 7 HZ2 LYS 7 8.008 -8.951 5.801 62 H ASN 8 HN ASN 8 14.194 -10.525 3.947 63 HA ASN 8 HA ASN 8 13.789 -8.552 5.936 64 1HB ASN 8 HB2 ASN 8 15.712 -10.123 5.994 65 2HB ASN 8 HB1 ASN 8 16.385 -9.342 4.567 66 1HD2 ASN 8 HD2 ASN 8 18.269 -8.706 5.577 67 2HD2 ASN 8 HD2 ASN 8 18.318 -7.498 6.814 68 H LYS 9 HN LYS 9 15.069 -8.398 2.649 69 HA LYS 9 HA LYS 9 15.565 -5.636 2.570 70 1HB LYS 9 HB2 LYS 9 14.950 -7.618 0.374 71 2HB LYS 9 HB1 LYS 9 15.345 -5.936 0.056 72 1HG LYS 9 HG2 LYS 9 17.148 -7.844 1.532 73 2HG LYS 9 HG1 LYS 9 17.261 -7.498 -0.198 74 1HD LYS 9 HD2 LYS 9 17.657 -5.143 0.289 75 2HD LYS 9 HD1 LYS 9 17.506 -5.449 2.015 76 1HE LYS 9 HE2 LYS 9 19.590 -6.656 0.205 77 2HE LYS 9 HE1 LYS 9 19.846 -5.275 1.266 78 1HZ LYS 9 HZ1 LYS 9 19.337 -6.712 3.162 79 2HZ LYS 9 HZ3 LYS 9 19.166 -8.044 2.123 80 3HZ LYS 9 HZ2 LYS 9 20.645 -7.282 2.265 81 H ILE 10 HN ILE 10 12.735 -7.477 1.533 82 HA ILE 10 HA ILE 10 11.026 -5.410 0.883 83 HB ILE 10 HB ILE 10 10.431 -8.075 2.164 84 1HG1 ILE 10 2HG1 ILE 10 9.951 -6.976 -0.561 85 2HG1 ILE 10 1HG1 ILE 10 11.342 -7.988 -0.139 86 1HG2 ILE 10 2HG2 ILE 10 8.596 -6.576 2.807 87 2HG2 ILE 10 1HG2 ILE 10 8.389 -6.099 1.123 88 3HG2 ILE 10 3HG2 ILE 10 8.052 -7.759 1.617 89 1HD1 ILE 10 HD1 ILE 10 9.752 -9.787 0.386 90 2HD1 ILE 10 HD1 ILE 10 8.431 -8.736 -0.131 91 3HD1 ILE 10 HD1 ILE 10 9.652 -9.253 -1.296 92 H GLU 11 HN GLU 11 11.467 -6.787 4.142 93 HA GLU 11 HA GLU 11 9.704 -5.078 5.464 94 1HB GLU 11 HB2 GLU 11 12.258 -6.328 6.463 95 2HB GLU 11 HB1 GLU 11 11.141 -5.448 7.498 96 1HG GLU 11 HG2 GLU 11 10.578 -7.967 5.964 97 2HG GLU 11 HG1 GLU 11 10.775 -7.797 7.708 98 H ASN 12 HN ASN 12 13.127 -4.714 4.853 99 HA ASN 12 HA ASN 12 13.463 -2.219 6.051 100 1HB ASN 12 HB2 ASN 12 15.362 -3.637 5.445 101 2HB ASN 12 HB1 ASN 12 14.994 -3.422 3.740 102 1HD2 ASN 12 HD2 ASN 12 15.664 -1.564 2.715 103 2HD2 ASN 12 HD2 ASN 12 16.605 -0.350 3.478 104 H LYS 13 HN LYS 13 12.659 -3.057 2.712 105 HA LYS 13 HA LYS 13 12.785 -0.454 1.671 106 1HB LYS 13 HB2 LYS 13 12.713 -2.693 0.399 107 2HB LYS 13 HB1 LYS 13 10.982 -2.627 0.640 108 1HG LYS 13 HG2 LYS 13 11.555 -1.727 -1.598 109 2HG LYS 13 HG1 LYS 13 10.877 -0.490 -0.538 110 1HD LYS 13 HD2 LYS 13 12.796 0.270 -1.824 111 2HD LYS 13 HD1 LYS 13 13.044 0.386 -0.091 112 1HE LYS 13 HE2 LYS 13 14.316 -1.637 -0.114 113 2HE LYS 13 HE1 LYS 13 14.075 -1.822 -1.866 114 1HZ LYS 13 HZ2 LYS 13 15.149 0.379 -2.056 115 2HZ LYS 13 HZ1 LYS 13 15.465 0.304 -0.396 116 3HZ LYS 13 HZ3 LYS 13 16.189 -0.824 -1.441 117 H LYS 14 HN LYS 14 10.094 -2.381 2.842 118 HA LYS 14 HA LYS 14 7.954 -0.696 2.507 119 1HB LYS 14 HB2 LYS 14 7.890 -3.063 3.189 120 2HB LYS 14 HB1 LYS 14 8.621 -2.629 4.720 121 1HG LYS 14 HG2 LYS 14 6.612 -1.383 5.333 122 2HG LYS 14 HG1 LYS 14 5.898 -1.784 3.769 123 1HD LYS 14 HD2 LYS 14 5.031 -3.308 5.463 124 2HD LYS 14 HD1 LYS 14 6.059 -4.184 4.327 125 1HE LYS 14 HE2 LYS 14 7.911 -4.038 5.910 126 2HE LYS 14 HE1 LYS 14 6.859 -3.189 7.037 127 1HZ LYS 14 HZ2 LYS 14 5.472 -5.342 7.127 128 2HZ LYS 14 HZ1 LYS 14 6.563 -5.992 6.038 129 3HZ LYS 14 HZ3 LYS 14 7.095 -5.592 7.536 130 H LYS 15 HN LYS 15 10.200 -1.076 5.218 131 HA LYS 15 HA LYS 15 9.143 0.942 6.828 132 1HB LYS 15 HB2 LYS 15 11.772 -0.493 6.798 133 2HB LYS 15 HB1 LYS 15 11.457 0.796 7.956 134 1HG LYS 15 HG2 LYS 15 9.808 -0.407 9.054 135 2HG LYS 15 HG1 LYS 15 9.519 -1.464 7.673 136 1HD LYS 15 HD2 LYS 15 11.480 -2.644 8.031 137 2HD LYS 15 HD1 LYS 15 12.122 -1.498 9.220 138 1HE LYS 15 HE2 LYS 15 9.666 -3.244 9.520 139 2HE LYS 15 HE1 LYS 15 11.247 -3.605 10.198 140 1HZ LYS 15 HZ3 LYS 15 9.573 -1.248 10.897 141 2HZ LYS 15 HZ2 LYS 15 9.767 -2.619 11.832 142 3HZ LYS 15 HZ1 LYS 15 11.092 -1.611 11.543 143 H GLU 16 HN GLU 16 11.839 0.989 4.500 144 HA GLU 16 HA GLU 16 12.698 3.617 4.800 145 1HB GLU 16 HB2 GLU 16 12.492 1.967 2.261 146 2HB GLU 16 HB1 GLU 16 13.215 3.561 2.309 147 1HG GLU 16 HG2 GLU 16 14.870 2.603 3.946 148 2HG GLU 16 HG1 GLU 16 14.176 1.019 3.580 149 H LEU 17 HN LEU 17 10.042 2.318 2.907 150 HA LEU 17 HA LEU 17 9.274 4.758 1.744 151 1HB LEU 17 HB2 LEU 17 8.606 2.854 0.567 152 2HB LEU 17 HB1 LEU 17 8.010 2.057 1.997 153 HG LEU 17 HG LEU 17 6.244 2.739 0.312 154 1HD1 LEU 17 HD1 LEU 17 5.661 2.070 2.416 155 2HD1 LEU 17 HD1 LEU 17 5.888 3.703 3.041 156 3HD1 LEU 17 HD1 LEU 17 4.623 3.385 1.834 157 1HD2 LEU 17 HD2 LEU 17 7.139 4.917 -0.329 158 2HD2 LEU 17 HD2 LEU 17 5.485 5.027 0.277 159 3HD2 LEU 17 HD2 LEU 17 6.836 5.504 1.308 160 H ILE 18 HN ILE 18 8.131 2.989 4.558 161 HA ILE 18 HA ILE 18 6.022 4.666 5.147 162 HB ILE 18 HB ILE 18 7.737 3.202 7.192 163 1HG1 ILE 18 2HG1 ILE 18 5.084 2.363 6.028 164 2HG1 ILE 18 1HG1 ILE 18 6.618 1.860 5.321 165 1HG2 ILE 18 2HG2 ILE 18 4.951 4.393 7.364 166 2HG2 ILE 18 1HG2 ILE 18 5.678 3.378 8.621 167 3HG2 ILE 18 3HG2 ILE 18 6.368 4.953 8.223 168 1HD1 ILE 18 HD1 ILE 18 5.714 1.296 8.134 169 2HD1 ILE 18 HD1 ILE 18 5.667 0.163 6.771 170 3HD1 ILE 18 HD1 ILE 18 7.218 0.770 7.361 171 H GLN 19 HN GLN 19 9.416 4.917 5.982 172 HA GLN 19 HA GLN 19 9.329 7.195 7.560 173 1HB GLN 19 HB2 GLN 19 11.436 6.333 5.596 174 2HB GLN 19 HB1 GLN 19 11.647 7.619 6.776 175 1HG GLN 19 HG2 GLN 19 11.321 6.047 8.581 176 2HG GLN 19 HG1 GLN 19 11.028 4.754 7.431 177 1HE2 GLN 19 1HE2 GLN 19 13.121 4.949 9.460 178 2HE2 GLN 19 2HE2 GLN 19 14.614 4.860 8.612 179 H LEU 20 HN LEU 20 9.440 6.998 3.981 180 HA LEU 20 HA LEU 20 9.502 9.829 3.661 181 1HB LEU 20 HB2 LEU 20 8.643 7.732 1.647 182 2HB LEU 20 HB1 LEU 20 8.649 9.444 1.326 183 HG LEU 20 HG LEU 20 10.518 8.883 0.318 184 1HD1 LEU 20 HD1 LEU 20 11.161 10.543 1.827 185 2HD1 LEU 20 HD1 LEU 20 11.566 9.338 3.053 186 3HD1 LEU 20 HD1 LEU 20 12.502 9.428 1.562 187 1HD2 LEU 20 HD2 LEU 20 11.020 6.695 2.317 188 2HD2 LEU 20 HD2 LEU 20 10.530 6.544 0.628 189 3HD2 LEU 20 HD2 LEU 20 12.141 7.135 1.021 190 H VAL 21 HN VAL 21 6.754 7.508 3.390 191 HA VAL 21 HA VAL 21 4.980 9.661 2.998 192 HB VAL 21 HB VAL 21 4.358 7.521 2.154 193 1HG1 VAL 21 1HG1 VAL 21 4.395 6.495 4.928 194 2HG1 VAL 21 3HG1 VAL 21 3.719 5.668 3.516 195 3HG1 VAL 21 2HG1 VAL 21 5.427 6.066 3.531 196 1HG2 VAL 21 3HG2 VAL 21 2.478 8.934 2.727 197 2HG2 VAL 21 2HG2 VAL 21 2.069 7.234 2.978 198 3HG2 VAL 21 1HG2 VAL 21 2.452 8.263 4.358 199 H ALA 22 HN ALA 22 6.076 8.170 5.921 200 HA ALA 22 HA ALA 22 4.202 9.201 7.712 201 1HB ALA 22 HB3 ALA 22 7.151 8.757 8.186 202 2HB ALA 22 HB2 ALA 22 5.912 8.921 9.446 203 3HB ALA 22 HB1 ALA 22 5.883 7.549 8.346 204 H ARG 23 HN ARG 23 7.254 10.604 6.550 205 HA ARG 23 HA ARG 23 6.970 12.965 8.102 206 1HB ARG 23 HB2 ARG 23 8.897 13.843 6.864 207 2HB ARG 23 HB1 ARG 23 9.202 12.227 7.465 208 1HG ARG 23 HG2 ARG 23 8.775 11.337 5.219 209 2HG ARG 23 HG1 ARG 23 8.485 12.981 4.647 210 1HD ARG 23 HD2 ARG 23 11.066 11.982 5.848 211 2HD ARG 23 HD1 ARG 23 10.759 12.195 4.127 212 HE ARG 23 HE ARG 23 10.192 14.607 5.341 213 1HH1 ARG 23 1HH1 ARG 23 13.042 12.567 4.821 214 2HH1 ARG 23 2HH1 ARG 23 14.155 13.840 4.865 215 1HH2 ARG 23 1HH2 ARG 23 11.740 16.395 5.413 216 2HH2 ARG 23 2HH2 ARG 23 13.389 16.069 5.194 217 H HIS 24 HN HIS 24 5.684 11.971 5.124 218 HA HIS 24 HA HIS 24 5.235 14.312 3.720 219 1HB HIS 24 HB2 HIS 24 4.569 12.201 2.771 220 2HB HIS 24 HB1 HIS 24 3.420 11.881 4.052 221 HD1 HIS 24 HD1 HIS 24 1.075 13.187 3.844 222 HD2 HIS 24 HD2 HIS 24 3.740 13.839 0.731 223 HE1 HIS 24 HE1 HIS 24 -0.233 14.317 2.028 224 H GLY 25 HN GLY 25 3.141 12.895 6.195 225 1HA GLY 25 HA1 GLY 25 1.365 15.125 6.260 226 2HA GLY 25 HA2 GLY 25 2.556 15.228 7.550 227 H LEU 26 HN LEU 26 2.435 12.052 7.453 228 HA LEU 26 HA LEU 26 -0.067 11.550 8.547 229 1HB LEU 26 HB2 LEU 26 2.462 10.083 8.098 230 2HB LEU 26 HB1 LEU 26 1.250 9.408 9.170 231 HG LEU 26 HG LEU 26 -0.359 9.612 7.343 232 1HD1 LEU 26 HD1 LEU 26 0.612 11.214 5.940 233 2HD1 LEU 26 HD1 LEU 26 1.972 10.131 5.562 234 3HD1 LEU 26 HD1 LEU 26 0.326 9.703 5.070 235 1HD2 LEU 26 HD2 LEU 26 1.998 7.827 6.966 236 2HD2 LEU 26 HD2 LEU 26 0.522 7.514 7.903 237 3HD2 LEU 26 HD2 LEU 26 0.454 7.596 6.140 238 H ASP 27 HN ASP 27 -0.555 11.118 10.552 239 HA ASP 27 HA ASP 27 0.993 12.383 12.671 240 1HB ASP 27 HB2 ASP 27 -1.487 10.676 13.026 241 2HB ASP 27 HB1 ASP 27 -0.842 11.860 14.135 242 H HIS 28 HN HIS 28 1.127 10.973 14.732 243 HA HIS 28 HA HIS 28 2.773 8.754 14.266 244 1HB HIS 28 HB2 HIS 28 2.614 8.283 16.664 245 2HB HIS 28 HB1 HIS 28 2.831 10.016 16.395 246 HD1 HIS 28 HD1 HIS 28 0.690 11.538 17.051 247 HD2 HIS 28 HD2 HIS 28 0.391 7.495 17.982 248 HE1 HIS 28 HE1 HIS 28 -1.275 11.314 18.603 249 H ASP 29 HN ASP 29 -0.580 8.975 15.129 250 HA ASP 29 HA ASP 29 -1.189 6.236 15.233 251 1HB ASP 29 HB2 ASP 29 -3.529 6.850 15.077 252 2HB ASP 29 HB1 ASP 29 -2.693 7.936 16.181 253 H LYS 30 HN LYS 30 -1.101 8.486 12.644 254 HA LYS 30 HA LYS 30 -2.331 6.823 10.689 255 1HB LYS 30 HB2 LYS 30 -0.451 9.128 10.333 256 2HB LYS 30 HB1 LYS 30 -1.271 8.327 9.005 257 1HG LYS 30 HG2 LYS 30 -2.513 9.874 11.266 258 2HG LYS 30 HG1 LYS 30 -2.389 10.373 9.578 259 1HD LYS 30 HD2 LYS 30 -3.823 8.547 8.919 260 2HD LYS 30 HD1 LYS 30 -3.939 7.995 10.594 261 1HE LYS 30 HE2 LYS 30 -4.968 10.575 9.434 262 2HE LYS 30 HE1 LYS 30 -5.907 9.258 10.128 263 1HZ LYS 30 HZ1 LYS 30 -4.745 9.730 12.290 264 2HZ LYS 30 HZ3 LYS 30 -4.108 11.132 11.587 265 3HZ LYS 30 HZ2 LYS 30 -5.767 10.960 11.752 266 H VAL 31 HN VAL 31 1.036 7.351 11.599 267 HA VAL 31 HA VAL 31 2.113 5.756 9.552 268 HB VAL 31 HB VAL 31 3.282 6.352 12.306 269 1HG1 VAL 31 1HG1 VAL 31 4.387 4.457 11.245 270 2HG1 VAL 31 3HG1 VAL 31 4.658 5.429 9.799 271 3HG1 VAL 31 2HG1 VAL 31 5.444 5.867 11.313 272 1HG2 VAL 31 3HG2 VAL 31 2.718 8.354 11.014 273 2HG2 VAL 31 2HG2 VAL 31 4.463 8.166 11.203 274 3HG2 VAL 31 1HG2 VAL 31 3.681 7.750 9.673 275 H LEU 32 HN LEU 32 0.970 5.057 12.784 276 HA LEU 32 HA LEU 32 1.685 2.324 12.843 277 1HB LEU 32 HB2 LEU 32 -0.562 3.729 14.274 278 2HB LEU 32 HB1 LEU 32 0.070 2.143 14.671 279 HG LEU 32 HG LEU 32 1.547 4.759 14.911 280 1HD1 LEU 32 HD1 LEU 32 0.479 2.879 16.985 281 2HD1 LEU 32 HD1 LEU 32 1.460 4.315 17.304 282 3HD1 LEU 32 HD1 LEU 32 -0.146 4.483 16.588 283 1HD2 LEU 32 HD2 LEU 32 2.446 1.953 15.579 284 2HD2 LEU 32 HD2 LEU 32 3.091 2.994 14.305 285 3HD2 LEU 32 HD2 LEU 32 3.308 3.433 15.997 286 H LEU 33 HN LEU 33 -1.351 3.976 12.005 287 HA LEU 33 HA LEU 33 -2.826 1.679 11.333 288 1HB LEU 33 HB2 LEU 33 -3.086 4.508 10.345 289 2HB LEU 33 HB1 LEU 33 -4.251 3.246 9.992 290 HG LEU 33 HG LEU 33 -3.597 4.311 12.739 291 1HD1 LEU 33 HD1 LEU 33 -5.980 4.785 10.959 292 2HD1 LEU 33 HD1 LEU 33 -5.816 5.329 12.629 293 3HD1 LEU 33 HD1 LEU 33 -4.740 5.964 11.392 294 1HD2 LEU 33 HD2 LEU 33 -5.704 2.363 11.804 295 2HD2 LEU 33 HD2 LEU 33 -4.310 1.985 12.815 296 3HD2 LEU 33 HD2 LEU 33 -5.588 3.030 13.428 297 H PHE 34 HN PHE 34 -0.844 3.825 9.360 298 HA PHE 34 HA PHE 34 -1.389 2.623 6.911 299 1HB PHE 34 HB2 PHE 34 -0.390 4.804 6.961 300 2HB PHE 34 HB1 PHE 34 1.015 4.197 7.829 301 HD1 PHE 34 HD1 PHE 34 -0.831 3.544 4.607 302 HD2 PHE 34 HD2 PHE 34 2.928 3.817 6.613 303 HE1 PHE 34 HE1 PHE 34 0.284 3.188 2.527 304 HE2 PHE 34 HE2 PHE 34 4.068 3.429 4.440 305 HZ PHE 34 HZ PHE 34 2.765 3.123 2.429 306 H SER 35 HN SER 35 1.367 2.128 9.113 307 HA SER 35 HA SER 35 2.609 0.279 7.467 308 1HB SER 35 HB2 SER 35 3.882 -0.385 9.533 309 2HB SER 35 HB1 SER 35 3.895 1.338 9.153 310 HG SER 35 HG SER 35 2.547 1.739 10.786 311 H ARG 36 HN ARG 36 0.180 -0.231 9.951 312 HA ARG 36 HA ARG 36 0.430 -3.068 9.825 313 1HB ARG 36 HB2 ARG 36 -1.464 -3.177 11.307 314 2HB ARG 36 HB1 ARG 36 -0.431 -1.860 11.836 315 1HG ARG 36 HG2 ARG 36 -1.997 -0.370 10.465 316 2HG ARG 36 HG1 ARG 36 -3.101 -1.741 10.505 317 1HD ARG 36 HD2 ARG 36 -1.956 -0.254 12.858 318 2HD ARG 36 HD1 ARG 36 -3.615 -0.214 12.288 319 HE ARG 36 HE ARG 36 -2.531 -2.777 13.154 320 1HH1 ARG 36 1HH1 ARG 36 -4.790 -0.113 13.765 321 2HH1 ARG 36 2HH1 ARG 36 -5.400 -0.800 15.204 322 1HH2 ARG 36 1HH2 ARG 36 -3.375 -3.689 15.063 323 2HH2 ARG 36 2HH2 ARG 36 -4.595 -2.897 15.966 324 H ASP 37 HN ASP 37 -1.643 -0.713 8.187 325 HA ASP 37 HA ASP 37 -3.394 -2.680 7.039 326 1HB ASP 37 HB2 ASP 37 -3.852 -0.144 7.498 327 2HB ASP 37 HB1 ASP 37 -2.970 0.135 6.010 328 H LEU 38 HN LEU 38 -0.646 -0.816 6.027 329 HA LEU 38 HA LEU 38 -0.235 -1.682 3.404 330 1HB LEU 38 HB2 LEU 38 0.983 0.155 4.183 331 2HB LEU 38 HB1 LEU 38 1.481 -0.669 5.631 332 HG LEU 38 HG LEU 38 3.045 -2.030 4.255 333 1HD1 LEU 38 HD1 LEU 38 2.279 -0.136 2.065 334 2HD1 LEU 38 HD1 LEU 38 3.637 -1.266 2.092 335 3HD1 LEU 38 HD1 LEU 38 1.983 -1.889 2.124 336 1HD2 LEU 38 HD2 LEU 38 3.335 0.955 4.173 337 2HD2 LEU 38 HD2 LEU 38 3.829 -0.130 5.472 338 3HD2 LEU 38 HD2 LEU 38 4.644 -0.199 3.913 339 H ASP 39 HN ASP 39 1.078 -2.926 6.460 340 HA ASP 39 HA ASP 39 2.595 -5.016 5.406 341 1HB ASP 39 HB2 ASP 39 2.743 -4.138 7.735 342 2HB ASP 39 HB1 ASP 39 1.231 -4.953 8.100 343 H LYS 40 HN LYS 40 -0.788 -4.947 6.432 344 HA LYS 40 HA LYS 40 -1.296 -7.716 6.100 345 1HB LYS 40 HB2 LYS 40 -3.163 -5.366 5.944 346 2HB LYS 40 HB1 LYS 40 -3.703 -7.034 5.846 347 1HG LYS 40 HG2 LYS 40 -2.767 -7.426 8.104 348 2HG LYS 40 HG1 LYS 40 -2.326 -5.718 8.183 349 1HD LYS 40 HD2 LYS 40 -5.124 -6.791 7.841 350 2HD LYS 40 HD1 LYS 40 -4.442 -6.213 9.360 351 1HE LYS 40 HE2 LYS 40 -4.155 -3.993 8.384 352 2HE LYS 40 HE1 LYS 40 -4.827 -4.560 6.851 353 1HZ LYS 40 HZ1 LYS 40 -6.902 -5.040 8.045 354 2HZ LYS 40 HZ3 LYS 40 -6.227 -4.396 9.458 355 3HZ LYS 40 HZ2 LYS 40 -6.474 -3.409 8.121 356 H LEU 41 HN LEU 41 -1.610 -4.976 3.898 357 HA LEU 41 HA LEU 41 -2.715 -6.367 1.732 358 1HB LEU 41 HB2 LEU 41 -2.724 -3.945 1.835 359 2HB LEU 41 HB1 LEU 41 -0.973 -3.910 1.815 360 HG LEU 41 HG LEU 41 -0.982 -4.781 -0.482 361 1HD1 LEU 41 HD1 LEU 41 -3.981 -4.561 -0.270 362 2HD1 LEU 41 HD1 LEU 41 -3.069 -4.834 -1.758 363 3HD1 LEU 41 HD1 LEU 41 -3.032 -6.035 -0.472 364 1HD2 LEU 41 HD2 LEU 41 -2.656 -2.311 -0.063 365 2HD2 LEU 41 HD2 LEU 41 -0.895 -2.391 -0.106 366 3HD2 LEU 41 HD2 LEU 41 -1.836 -2.751 -1.557 367 H ILE 42 HN ILE 42 0.597 -5.685 2.639 368 HA ILE 42 HA ILE 42 1.788 -6.895 0.395 369 HB ILE 42 HB ILE 42 2.948 -6.399 3.161 370 1HG1 ILE 42 2HG1 ILE 42 3.179 -4.904 0.554 371 2HG1 ILE 42 1HG1 ILE 42 2.298 -4.379 1.981 372 1HG2 ILE 42 2HG2 ILE 42 4.377 -7.170 0.609 373 2HG2 ILE 42 1HG2 ILE 42 5.157 -6.685 2.113 374 3HG2 ILE 42 3HG2 ILE 42 4.213 -8.169 2.055 375 1HD1 ILE 42 HD1 ILE 42 5.276 -4.769 1.821 376 2HD1 ILE 42 HD1 ILE 42 4.429 -3.221 1.722 377 3HD1 ILE 42 HD1 ILE 42 4.352 -4.168 3.203 378 H ASN 43 HN ASN 43 1.324 -8.186 3.670 379 HA ASN 43 HA ASN 43 2.259 -10.782 3.230 380 1HB ASN 43 HB2 ASN 43 0.038 -9.912 5.100 381 2HB ASN 43 HB1 ASN 43 0.799 -11.492 5.132 382 1HD2 ASN 43 HD2 ASN 43 0.652 -9.581 7.223 383 2HD2 ASN 43 HD2 ASN 43 2.243 -9.074 7.624 384 H LYS 44 HN LYS 44 -0.776 -9.372 2.391 385 HA LYS 44 HA LYS 44 -2.263 -11.710 1.856 386 1HB LYS 44 HB2 LYS 44 -3.168 -9.372 2.082 387 2HB LYS 44 HB1 LYS 44 -2.489 -9.025 0.511 388 1HG LYS 44 HG2 LYS 44 -3.948 -10.784 -0.479 389 2HG LYS 44 HG1 LYS 44 -4.658 -11.007 1.123 390 1HD LYS 44 HD2 LYS 44 -4.681 -8.426 -0.407 391 2HD LYS 44 HD1 LYS 44 -6.018 -9.567 -0.329 392 1HE LYS 44 HE2 LYS 44 -4.805 -8.096 2.026 393 2HE LYS 44 HE1 LYS 44 -6.313 -7.712 1.215 394 1HZ LYS 44 HZ1 LYS 44 -7.177 -9.900 1.915 395 2HZ LYS 44 HZ3 LYS 44 -5.749 -10.197 2.767 396 3HZ LYS 44 HZ2 LYS 44 -6.755 -8.935 3.220 397 H PHE 45 HN PHE 45 -0.246 -9.641 -0.168 398 HA PHE 45 HA PHE 45 -0.665 -11.324 -2.438 399 1HB PHE 45 HB2 PHE 45 0.820 -8.775 -2.008 400 2HB PHE 45 HB1 PHE 45 1.118 -9.726 -3.462 401 HD1 PHE 45 HD1 PHE 45 -1.479 -7.874 -1.566 402 HD2 PHE 45 HD2 PHE 45 -0.455 -9.815 -5.218 403 HE1 PHE 45 HE1 PHE 45 -3.481 -6.932 -2.633 404 HE2 PHE 45 HE2 PHE 45 -2.452 -8.870 -6.284 405 HZ PHE 45 HZ PHE 45 -3.972 -7.428 -4.990 406 H MET 46 HN MET 46 1.808 -10.919 -0.050 407 HA MET 46 HA MET 46 3.883 -12.394 -1.398 408 1HB MET 46 HB2 MET 46 3.481 -12.224 1.584 409 2HB MET 46 HB1 MET 46 4.969 -12.608 0.737 410 1HG MET 46 HG2 MET 46 4.681 -10.212 -0.262 411 2HG MET 46 HG1 MET 46 3.573 -10.013 1.074 412 1HE MET 46 HE3 MET 46 7.086 -10.567 -0.080 413 2HE MET 46 HE2 MET 46 8.035 -10.828 1.386 414 3HE MET 46 HE1 MET 46 6.902 -12.065 0.827 415 H ASN 47 HN ASN 47 1.034 -13.212 0.149 416 HA ASN 47 HA ASN 47 -0.118 -15.019 0.562 417 1HB ASN 47 HB2 ASN 47 0.611 -15.961 -1.584 418 2HB ASN 47 HB1 ASN 47 2.062 -16.609 -0.832 419 1HD2 ASN 47 HD2 ASN 47 1.518 -18.702 -1.424 420 2HD2 ASN 47 HD2 ASN 47 0.273 -19.607 -0.656 421 H VAL 48 HN VAL 48 0.564 -14.168 2.605 422 HA VAL 48 HA VAL 48 1.869 -16.256 4.222 423 HB VAL 48 HB VAL 48 1.017 -13.486 5.041 424 1HG1 VAL 48 2HG1 VAL 48 2.844 -15.475 6.398 425 2HG1 VAL 48 1HG1 VAL 48 2.517 -13.846 6.982 426 3HG1 VAL 48 3HG1 VAL 48 1.213 -15.031 6.907 427 1HG2 VAL 48 3HG2 VAL 48 2.739 -13.278 3.353 428 2HG2 VAL 48 2HG2 VAL 48 3.394 -12.827 4.932 429 3HG2 VAL 48 1HG2 VAL 48 3.758 -14.415 4.233 430 H LYS 49 HN LYS 49 0.539 -17.541 5.166 431 HA LYS 49 HA LYS 49 -2.259 -16.883 4.943 432 1HB LYS 49 HB2 LYS 49 -0.914 -19.506 5.570 433 2HB LYS 49 HB1 LYS 49 -2.640 -19.286 5.301 434 1HG LYS 49 HG2 LYS 49 -2.305 -18.671 3.020 435 2HG LYS 49 HG1 LYS 49 -0.561 -18.582 3.244 436 1HD LYS 49 HD2 LYS 49 -2.223 -21.101 3.454 437 2HD LYS 49 HD1 LYS 49 -1.271 -20.626 2.049 438 1HE LYS 49 HE2 LYS 49 0.767 -20.654 3.480 439 2HE LYS 49 HE1 LYS 49 -0.219 -21.246 4.816 440 1HZ LYS 49 HZ3 LYS 49 -0.785 -23.179 3.396 441 2HZ LYS 49 HZ2 LYS 49 0.313 -22.622 2.253 442 3HZ LYS 49 HZ1 LYS 49 0.857 -23.075 3.766 443 H ASP 50 HN ASP 50 -0.067 -16.402 7.084 444 HA ASP 50 HA ASP 50 -1.479 -17.222 9.481 445 1HB ASP 50 HB2 ASP 50 1.060 -15.611 9.179 446 2HB ASP 50 HB1 ASP 50 0.357 -16.093 10.712 447 H LYS 51 HN LYS 51 -3.213 -16.070 9.875 448 HA LYS 51 HA LYS 51 -3.054 -13.148 9.638 449 1HB LYS 51 HB2 LYS 51 -5.516 -13.151 9.747 450 2HB LYS 51 HB1 LYS 51 -4.932 -14.136 8.416 451 1HG LYS 51 HG2 LYS 51 -5.392 -16.155 9.647 452 2HG LYS 51 HG1 LYS 51 -5.839 -15.226 11.079 453 1HD LYS 51 HD2 LYS 51 -7.714 -14.244 9.864 454 2HD LYS 51 HD1 LYS 51 -7.250 -15.140 8.413 455 1HE LYS 51 HE2 LYS 51 -7.627 -17.244 9.597 456 2HE LYS 51 HE1 LYS 51 -8.087 -16.351 11.046 457 1HZ LYS 51 HZ3 LYS 51 -9.504 -16.210 8.446 458 2HZ LYS 51 HZ2 LYS 51 -9.975 -17.158 9.758 459 3HZ LYS 51 HZ1 LYS 51 -9.989 -15.471 9.890 460 H VAL 52 HN VAL 52 -2.119 -15.101 11.714 461 HA VAL 52 HA VAL 52 -3.656 -14.466 14.036 462 HB VAL 52 HB VAL 52 -1.865 -15.582 15.366 463 1HG1 VAL 52 1HG1 VAL 52 -2.845 -17.149 12.996 464 2HG1 VAL 52 3HG1 VAL 52 -2.183 -17.847 14.471 465 3HG1 VAL 52 2HG1 VAL 52 -3.688 -16.932 14.533 466 1HG2 VAL 52 2HG2 VAL 52 0.067 -15.013 13.988 467 2HG2 VAL 52 1HG2 VAL 52 -0.044 -16.758 14.212 468 3HG2 VAL 52 3HG2 VAL 52 -0.551 -16.033 12.688 469 H HIS 53 HN HIS 53 -3.135 -13.162 15.706 470 HA HIS 53 HA HIS 53 -0.941 -11.240 15.289 471 1HB HIS 53 HB2 HIS 53 -3.727 -10.638 16.349 472 2HB HIS 53 HB1 HIS 53 -2.392 -9.503 16.352 473 HD1 HIS 53 HD1 HIS 53 -1.999 -8.175 14.180 474 HD2 HIS 53 HD2 HIS 53 -4.843 -11.182 13.802 475 HE1 HIS 53 HE1 HIS 53 -3.118 -7.801 11.967 476 H LYS 54 HN LYS 54 -0.474 -10.119 17.439 477 HA LYS 54 HA LYS 54 -0.349 -12.132 19.527 478 1HB LYS 54 HB2 LYS 54 1.702 -10.943 19.072 479 2HB LYS 54 HB1 LYS 54 0.900 -9.391 19.215 480 1HG LYS 54 HG2 LYS 54 2.260 -9.824 21.169 481 2HG LYS 54 HG1 LYS 54 0.557 -9.798 21.607 482 1HD LYS 54 HD2 LYS 54 0.509 -12.216 21.666 483 2HD LYS 54 HD1 LYS 54 2.190 -12.287 21.120 484 1HE LYS 54 HE2 LYS 54 1.224 -11.027 23.685 485 2HE LYS 54 HE1 LYS 54 1.996 -12.607 23.551 486 1HZ LYS 54 HZ1 LYS 54 3.963 -11.496 22.655 487 2HZ LYS 54 HZ3 LYS 54 3.266 -9.982 22.898 488 3HZ LYS 54 HZ2 LYS 54 3.609 -10.982 24.203 489 H LEU 55 HN LEU 55 -1.896 -12.204 21.044 490 HA LEU 55 HA LEU 55 -3.709 -9.991 21.181 491 1HB LEU 55 HB2 LEU 55 -5.150 -11.415 22.567 492 2HB LEU 55 HB1 LEU 55 -4.733 -12.165 21.053 493 HG LEU 55 HG LEU 55 -2.980 -13.488 22.458 494 1HD1 LEU 55 HD1 LEU 55 -3.144 -12.173 24.492 495 2HD1 LEU 55 HD1 LEU 55 -4.834 -12.637 24.665 496 3HD1 LEU 55 HD1 LEU 55 -3.568 -13.864 24.780 497 1HD2 LEU 55 HD2 LEU 55 -4.947 -14.461 21.409 498 2HD2 LEU 55 HD2 LEU 55 -4.641 -15.185 22.987 499 3HD2 LEU 55 HD2 LEU 55 -5.927 -13.990 22.795 500 H GLU 56 HN GLU 56 -3.920 -8.552 22.650 501 HA GLU 56 HA GLU 56 -2.417 -8.853 25.164 502 1HB GLU 56 HB2 GLU 56 -3.214 -6.281 23.786 503 2HB GLU 56 HB1 GLU 56 -2.298 -6.417 25.273 504 1HG GLU 56 HG2 GLU 56 -0.481 -7.489 24.026 505 2HG GLU 56 HG1 GLU 56 -1.413 -7.294 22.539 506 H HIS 57 HN HIS 57 -4.996 -6.685 24.012 507 HA HIS 57 HA HIS 57 -6.911 -7.959 25.761 508 1HB HIS 57 HB2 HIS 57 -5.768 -6.053 27.064 509 2HB HIS 57 HB1 HIS 57 -6.481 -4.996 25.837 510 HD1 HIS 57 HD1 HIS 57 -7.413 -6.979 28.880 511 HD2 HIS 57 HD2 HIS 57 -9.242 -4.657 25.971 512 HE1 HIS 57 HE1 HIS 57 -9.724 -6.500 29.733 513 H HIS 58 HN HIS 58 -8.047 -8.534 23.981 514 HA HIS 58 HA HIS 58 -8.593 -6.365 22.148 515 1HB HIS 58 HB2 HIS 58 -8.675 -9.338 21.575 516 2HB HIS 58 HB1 HIS 58 -9.130 -8.099 20.411 517 HD1 HIS 58 HD1 HIS 58 -7.139 -7.113 18.997 518 HD2 HIS 58 HD2 HIS 58 -5.942 -9.199 22.394 519 HE1 HIS 58 HE1 HIS 58 -4.657 -7.177 18.939 520 H HIS 59 HN HIS 59 -10.296 -5.438 22.686 521 HA HIS 59 HA HIS 59 -12.853 -6.731 22.513 522 1HB HIS 59 HB2 HIS 59 -12.259 -7.127 24.923 523 2HB HIS 59 HB1 HIS 59 -12.123 -5.388 25.145 524 HD1 HIS 59 HD1 HIS 59 -14.175 -4.524 26.348 525 HD2 HIS 59 HD2 HIS 59 -15.059 -7.664 23.766 526 HE1 HIS 59 HE1 HIS 59 -16.636 -4.911 26.549 527 H HIS 60 HN HIS 60 -11.107 -3.818 23.537 528 HA HIS 60 HA HIS 60 -13.094 -1.969 22.612 529 1HB HIS 60 HB2 HIS 60 -10.117 -1.495 23.006 530 2HB HIS 60 HB1 HIS 60 -11.350 -0.257 22.873 531 HD1 HIS 60 HD1 HIS 60 -12.441 0.471 25.047 532 HD2 HIS 60 HD2 HIS 60 -10.220 -3.003 25.398 533 HE1 HIS 60 HE1 HIS 60 -12.336 -0.029 27.501 534 H HIS 61 HN HIS 61 -10.332 -3.544 21.358 535 HA HIS 61 HA HIS 61 -10.979 -2.936 18.648 536 1HB HIS 61 HB2 HIS 61 -8.478 -2.410 18.256 537 2HB HIS 61 HB1 HIS 61 -9.426 -1.129 19.000 538 HD1 HIS 61 HD1 HIS 61 -8.817 -0.461 21.427 539 HD2 HIS 61 HD2 HIS 61 -6.542 -3.601 19.924 540 HE1 HIS 61 HE1 HIS 61 -6.996 -0.866 23.103 541 H HIS 62 HN HIS 62 -10.406 -4.641 17.405 542 HA HIS 62 HA HIS 62 -9.141 -6.858 18.809 543 1HB HIS 62 HB2 HIS 62 -11.236 -6.916 16.617 544 2HB HIS 62 HB1 HIS 62 -10.357 -8.338 17.161 545 HD1 HIS 62 HD1 HIS 62 -11.288 -9.531 19.190 546 HD2 HIS 62 HD2 HIS 62 -12.956 -5.773 18.617 547 HE1 HIS 62 HE1 HIS 62 -13.167 -9.336 20.866 548 H1 MET 101 HT3 MET 101 8.893 23.358 1.577 549 H2 MET 101 HT2 MET 101 9.793 22.007 1.922 550 H3 MET 101 HT1 MET 101 10.457 23.540 2.175 551 HA MET 101 HA MET 101 10.354 23.967 -0.205 552 1HB MET 101 HB2 MET 101 11.708 21.312 0.437 553 2HB MET 101 HB1 MET 101 12.046 22.311 -0.961 554 1HG MET 101 HG2 MET 101 12.855 24.088 0.487 555 2HG MET 101 HG1 MET 101 12.511 23.091 1.903 556 1HE MET 101 HE3 MET 101 15.336 24.423 1.401 557 2HE MET 101 HE2 MET 101 14.994 23.382 2.784 558 3HE MET 101 HE1 MET 101 16.420 23.085 1.787 559 H GLU 102 HN GLU 102 10.638 21.968 -2.164 560 HA GLU 102 HA GLU 102 7.995 21.615 -2.916 561 1HB GLU 102 HB2 GLU 102 10.472 20.222 -3.876 562 2HB GLU 102 HB1 GLU 102 8.895 20.050 -4.631 563 1HG GLU 102 HG2 GLU 102 10.486 22.581 -4.355 564 2HG GLU 102 HG1 GLU 102 10.228 21.647 -5.828 565 H MET 103 HN MET 103 6.530 20.167 -2.517 566 HA MET 103 HA MET 103 7.264 17.800 -1.009 567 1HB MET 103 HB2 MET 103 4.558 18.821 -1.906 568 2HB MET 103 HB1 MET 103 4.784 17.318 -1.033 569 1HG MET 103 HG2 MET 103 5.661 18.573 0.881 570 2HG MET 103 HG1 MET 103 5.422 20.078 -0.004 571 1HE MET 103 HE1 MET 103 3.068 21.114 -0.598 572 2HE MET 103 HE3 MET 103 2.640 19.653 -1.490 573 3HE MET 103 HE2 MET 103 1.530 20.312 -0.294 574 H GLY 104 HN GLY 104 6.811 18.757 -4.196 575 1HA GLY 104 HA1 GLY 104 6.995 17.601 -6.173 576 2HA GLY 104 HA2 GLY 104 5.938 16.405 -5.429 577 H GLN 105 HN GLN 105 9.145 17.423 -4.463 578 HA GLN 105 HA GLN 105 10.527 15.156 -5.461 579 1HB GLN 105 HB2 GLN 105 12.419 15.954 -4.089 580 2HB GLN 105 HB1 GLN 105 11.669 17.245 -5.038 581 1HG GLN 105 HG2 GLN 105 10.509 18.015 -3.044 582 2HG GLN 105 HG1 GLN 105 11.278 16.736 -2.111 583 1HE2 GLN 105 1HE2 GLN 105 13.442 16.904 -1.617 584 2HE2 GLN 105 2HE2 GLN 105 14.321 18.384 -1.776 585 H LEU 106 HN LEU 106 9.081 15.941 -2.384 586 HA LEU 106 HA LEU 106 10.088 13.740 -0.937 587 1HB LEU 106 HB2 LEU 106 9.279 15.768 0.164 588 2HB LEU 106 HB1 LEU 106 7.688 15.544 -0.509 589 HG LEU 106 HG LEU 106 7.971 15.077 1.975 590 1HD1 LEU 106 HD1 LEU 106 6.823 12.884 0.279 591 2HD1 LEU 106 HD1 LEU 106 6.494 13.143 1.996 592 3HD1 LEU 106 HD1 LEU 106 5.997 14.342 0.800 593 1HD2 LEU 106 HD2 LEU 106 9.346 12.608 0.927 594 2HD2 LEU 106 HD2 LEU 106 10.086 13.885 1.893 595 3HD2 LEU 106 HD2 LEU 106 8.832 12.860 2.592 596 H LYS 107 HN LYS 107 7.112 14.367 -2.671 597 HA LYS 107 HA LYS 107 5.881 11.886 -2.145 598 1HB LYS 107 HB2 LYS 107 5.096 14.264 -3.229 599 2HB LYS 107 HB1 LYS 107 5.221 13.274 -4.671 600 1HG LYS 107 HG2 LYS 107 3.610 12.542 -2.247 601 2HG LYS 107 HG1 LYS 107 2.952 13.368 -3.644 602 1HD LYS 107 HD2 LYS 107 4.297 10.661 -3.746 603 2HD LYS 107 HD1 LYS 107 2.559 10.877 -3.577 604 1HE LYS 107 HE2 LYS 107 4.203 11.953 -5.856 605 2HE LYS 107 HE1 LYS 107 3.320 10.432 -5.913 606 1HZ LYS 107 HZ1 LYS 107 2.085 13.120 -5.508 607 2HZ LYS 107 HZ3 LYS 107 2.061 12.233 -6.933 608 3HZ LYS 107 HZ2 LYS 107 1.255 11.676 -5.576 609 H ASN 108 HN ASN 108 8.101 13.044 -4.570 610 HA ASN 108 HA ASN 108 7.932 10.899 -6.381 611 1HB ASN 108 HB2 ASN 108 8.957 13.065 -6.953 612 2HB ASN 108 HB1 ASN 108 10.262 12.745 -5.817 613 1HD2 ASN 108 HD2 ASN 108 11.929 11.423 -6.435 614 2HD2 ASN 108 HD2 ASN 108 12.075 10.769 -8.017 615 H LYS 109 HN LYS 109 9.953 11.432 -3.528 616 HA LYS 109 HA LYS 109 11.460 9.051 -3.848 617 1HB LYS 109 HB2 LYS 109 10.905 10.651 -1.348 618 2HB LYS 109 HB1 LYS 109 12.040 9.312 -1.451 619 1HG LYS 109 HG2 LYS 109 13.323 10.592 -3.152 620 2HG LYS 109 HG1 LYS 109 12.217 11.944 -2.914 621 1HD LYS 109 HD2 LYS 109 14.235 12.294 -1.606 622 2HD LYS 109 HD1 LYS 109 12.865 12.017 -0.529 623 1HE LYS 109 HE2 LYS 109 13.564 9.663 -0.264 624 2HE LYS 109 HE1 LYS 109 14.925 9.961 -1.340 625 1HZ LYS 109 HZ3 LYS 109 14.475 11.312 1.253 626 2HZ LYS 109 HZ2 LYS 109 15.523 10.019 1.012 627 3HZ LYS 109 HZ1 LYS 109 15.818 11.495 0.257 628 H ILE 110 HN ILE 110 8.465 9.805 -2.227 629 HA ILE 110 HA ILE 110 7.947 7.353 -0.948 630 HB ILE 110 HB ILE 110 6.041 9.361 -2.199 631 1HG1 ILE 110 2HG1 ILE 110 6.876 8.883 0.650 632 2HG1 ILE 110 1HG1 ILE 110 7.451 10.201 -0.371 633 1HG2 ILE 110 1HG2 ILE 110 4.918 7.201 -2.033 634 2HG2 ILE 110 3HG2 ILE 110 5.370 7.085 -0.329 635 3HG2 ILE 110 2HG2 ILE 110 4.252 8.343 -0.862 636 1HD1 ILE 110 HD1 ILE 110 5.137 11.049 -0.436 637 2HD1 ILE 110 HD1 ILE 110 4.675 9.748 0.660 638 3HD1 ILE 110 HD1 ILE 110 5.814 10.984 1.190 639 H GLU 111 HN GLU 111 6.984 8.523 -4.126 640 HA GLU 111 HA GLU 111 5.807 6.269 -5.244 641 1HB GLU 111 HB2 GLU 111 7.506 8.415 -6.506 642 2HB GLU 111 HB1 GLU 111 6.597 7.214 -7.409 643 1HG GLU 111 HG2 GLU 111 5.313 9.075 -5.454 644 2HG GLU 111 HG1 GLU 111 5.531 9.478 -7.155 645 H ASN 112 HN ASN 112 9.173 7.292 -5.504 646 HA ASN 112 HA ASN 112 9.994 5.068 -6.969 647 1HB ASN 112 HB2 ASN 112 11.360 7.020 -7.062 648 2HB ASN 112 HB1 ASN 112 11.607 7.007 -5.318 649 1HD2 ASN 112 HD2 ASN 112 13.191 5.773 -4.472 650 2HD2 ASN 112 HD2 ASN 112 14.222 4.732 -5.366 651 H LYS 113 HN LYS 113 10.126 5.576 -3.424 652 HA LYS 113 HA LYS 113 11.562 3.187 -2.946 653 1HB LYS 113 HB2 LYS 113 11.307 5.207 -1.430 654 2HB LYS 113 HB1 LYS 113 9.702 4.609 -1.055 655 1HG LYS 113 HG2 LYS 113 11.263 3.986 0.668 656 2HG LYS 113 HG1 LYS 113 10.670 2.556 -0.170 657 1HD LYS 113 HD2 LYS 113 13.083 2.435 0.270 658 2HD LYS 113 HD1 LYS 113 12.735 2.417 -1.454 659 1HE LYS 113 HE2 LYS 113 13.384 4.724 -1.640 660 2HE LYS 113 HE1 LYS 113 13.549 4.856 0.109 661 1HZ LYS 113 HZ3 LYS 113 15.174 3.053 -1.609 662 2HZ LYS 113 HZ2 LYS 113 15.694 4.562 -1.071 663 3HZ LYS 113 HZ1 LYS 113 15.404 3.333 0.040 664 H LYS 114 HN LYS 114 8.126 3.967 -2.982 665 HA LYS 114 HA LYS 114 6.920 1.599 -2.280 666 1HB LYS 114 HB2 LYS 114 5.831 3.770 -2.739 667 2HB LYS 114 HB1 LYS 114 6.232 3.600 -4.432 668 1HG LYS 114 HG2 LYS 114 4.762 1.589 -4.486 669 2HG LYS 114 HG1 LYS 114 4.255 1.960 -2.842 670 1HD LYS 114 HD2 LYS 114 2.610 2.956 -4.243 671 2HD LYS 114 HD1 LYS 114 3.657 4.290 -3.739 672 1HE LYS 114 HE2 LYS 114 4.939 3.976 -5.878 673 2HE LYS 114 HE1 LYS 114 3.711 2.774 -6.293 674 1HZ LYS 114 HZ1 LYS 114 2.023 4.645 -6.213 675 2HZ LYS 114 HZ3 LYS 114 3.296 5.720 -5.963 676 3HZ LYS 114 HZ2 LYS 114 3.202 4.826 -7.357 677 H LYS 115 HN LYS 115 7.968 2.774 -5.443 678 HA LYS 115 HA LYS 115 7.368 0.496 -6.957 679 1HB LYS 115 HB2 LYS 115 9.296 2.758 -7.431 680 2HB LYS 115 HB1 LYS 115 8.967 1.522 -8.639 681 1HG LYS 115 HG2 LYS 115 6.705 2.174 -8.839 682 2HG LYS 115 HG1 LYS 115 6.789 3.167 -7.390 683 1HD LYS 115 HD2 LYS 115 6.788 4.576 -9.371 684 2HD LYS 115 HD1 LYS 115 8.333 4.681 -8.528 685 1HE LYS 115 HE2 LYS 115 9.358 3.196 -10.124 686 2HE LYS 115 HE1 LYS 115 7.819 2.964 -10.954 687 1HZ LYS 115 HZ3 LYS 115 9.252 5.551 -10.695 688 2HZ LYS 115 HZ2 LYS 115 9.248 4.600 -12.075 689 3HZ LYS 115 HZ1 LYS 115 7.811 5.299 -11.526 690 H GLU 116 HN GLU 116 10.371 1.394 -5.320 691 HA GLU 116 HA GLU 116 11.953 -0.802 -6.136 692 1HB GLU 116 HB2 GLU 116 11.984 0.807 -3.578 693 2HB GLU 116 HB1 GLU 116 13.192 -0.414 -3.945 694 1HG GLU 116 HG2 GLU 116 13.883 0.913 -5.908 695 2HG GLU 116 HG1 GLU 116 12.670 2.122 -5.499 696 H LEU 117 HN LEU 117 9.667 -0.445 -3.512 697 HA LEU 117 HA LEU 117 10.085 -2.998 -2.385 698 1HB LEU 117 HB2 LEU 117 9.154 -1.358 -0.978 699 2HB LEU 117 HB1 LEU 117 7.928 -0.927 -2.137 700 HG LEU 117 HG LEU 117 7.110 -2.092 -0.060 701 1HD1 LEU 117 HD1 LEU 117 5.788 -1.826 -1.878 702 2HD1 LEU 117 HD1 LEU 117 6.371 -3.327 -2.597 703 3HD1 LEU 117 HD1 LEU 117 5.477 -3.368 -1.056 704 1HD2 LEU 117 HD2 LEU 117 8.412 -4.490 -1.297 705 2HD2 LEU 117 HD2 LEU 117 8.900 -3.714 0.212 706 3HD2 LEU 117 HD2 LEU 117 7.316 -4.496 0.093 707 H ILE 118 HN ILE 118 7.779 -1.799 -4.727 708 HA ILE 118 HA ILE 118 6.207 -4.065 -4.838 709 HB ILE 118 HB ILE 118 6.801 -2.152 -7.127 710 1HG1 ILE 118 2HG1 ILE 118 4.436 -2.198 -5.252 711 2HG1 ILE 118 1HG1 ILE 118 5.864 -1.230 -4.940 712 1HG2 ILE 118 3HG2 ILE 118 5.816 -4.284 -7.898 713 2HG2 ILE 118 2HG2 ILE 118 4.514 -4.109 -6.744 714 3HG2 ILE 118 1HG2 ILE 118 4.667 -2.958 -8.083 715 1HD1 ILE 118 HD1 ILE 118 5.474 -0.029 -7.035 716 2HD1 ILE 118 HD1 ILE 118 4.019 -0.987 -7.299 717 3HD1 ILE 118 HD1 ILE 118 4.121 0.106 -5.914 718 H GLN 119 HN GLN 119 9.143 -3.198 -6.566 719 HA GLN 119 HA GLN 119 9.390 -5.391 -8.284 720 1HB GLN 119 HB2 GLN 119 11.494 -3.704 -6.935 721 2HB GLN 119 HB1 GLN 119 11.850 -4.875 -8.193 722 1HG GLN 119 HG2 GLN 119 10.456 -3.625 -9.755 723 2HG GLN 119 HG1 GLN 119 10.060 -2.474 -8.480 724 1HE2 GLN 119 1HE2 GLN 119 11.353 -2.080 -11.043 725 2HE2 GLN 119 2HE2 GLN 119 12.876 -1.337 -10.725 726 H LEU 120 HN LEU 120 10.354 -4.950 -4.939 727 HA LEU 120 HA LEU 120 11.685 -7.404 -4.627 728 1HB LEU 120 HB2 LEU 120 10.644 -5.346 -2.760 729 2HB LEU 120 HB1 LEU 120 10.916 -6.965 -2.151 730 HG LEU 120 HG LEU 120 13.269 -6.838 -2.576 731 1HD1 LEU 120 HD1 LEU 120 12.752 -4.167 -3.813 732 2HD1 LEU 120 HD1 LEU 120 14.317 -4.888 -3.432 733 3HD1 LEU 120 HD1 LEU 120 13.281 -5.641 -4.667 734 1HD2 LEU 120 HD2 LEU 120 12.247 -4.305 -1.361 735 2HD2 LEU 120 HD2 LEU 120 12.541 -5.848 -0.548 736 3HD2 LEU 120 HD2 LEU 120 13.890 -4.930 -1.210 737 H VAL 121 HN VAL 121 8.261 -6.543 -3.500 738 HA VAL 121 HA VAL 121 7.728 -9.155 -2.777 739 HB VAL 121 HB VAL 121 5.489 -8.571 -2.675 740 1HG1 VAL 121 1HG1 VAL 121 7.079 -6.133 -2.146 741 2HG1 VAL 121 3HG1 VAL 121 5.444 -6.417 -1.542 742 3HG1 VAL 121 2HG1 VAL 121 6.770 -7.482 -1.029 743 1HG2 VAL 121 3HG2 VAL 121 6.013 -6.276 -4.522 744 2HG2 VAL 121 2HG2 VAL 121 5.111 -7.768 -4.850 745 3HG2 VAL 121 1HG2 VAL 121 4.482 -6.598 -3.675 746 H ALA 122 HN ALA 122 7.742 -7.685 -5.908 747 HA ALA 122 HA ALA 122 6.140 -9.567 -7.250 748 1HB ALA 122 HB2 ALA 122 8.299 -7.777 -8.314 749 2HB ALA 122 HB1 ALA 122 7.037 -8.560 -9.287 750 3HB ALA 122 HB3 ALA 122 6.616 -7.341 -8.074 751 H ARG 123 HN ARG 123 9.641 -9.222 -6.864 752 HA ARG 123 HA ARG 123 10.224 -11.586 -8.347 753 1HB ARG 123 HB2 ARG 123 12.539 -11.267 -7.667 754 2HB ARG 123 HB1 ARG 123 11.833 -9.754 -8.221 755 1HG ARG 123 HG2 ARG 123 11.481 -9.137 -5.837 756 2HG ARG 123 HG1 ARG 123 12.378 -10.588 -5.388 757 1HD ARG 123 HD2 ARG 123 13.813 -8.633 -5.354 758 2HD ARG 123 HD1 ARG 123 14.329 -9.760 -6.613 759 HE ARG 123 HE ARG 123 12.811 -8.174 -8.028 760 1HH1 ARG 123 1HH1 ARG 123 15.200 -7.269 -5.592 761 2HH1 ARG 123 2HH1 ARG 123 15.576 -5.768 -6.287 762 1HH2 ARG 123 1HH2 ARG 123 13.311 -6.088 -9.002 763 2HH2 ARG 123 2HH2 ARG 123 14.466 -5.081 -8.277 764 H HIS 124 HN HIS 124 9.107 -11.076 -5.233 765 HA HIS 124 HA HIS 124 10.154 -13.294 -3.853 766 1HB HIS 124 HB2 HIS 124 8.831 -11.554 -2.724 767 2HB HIS 124 HB1 HIS 124 7.393 -12.004 -3.623 768 HD1 HIS 124 HD1 HIS 124 6.297 -14.419 -2.893 769 HD2 HIS 124 HD2 HIS 124 9.320 -12.947 -0.458 770 HE1 HIS 124 HE1 HIS 124 6.206 -15.754 -0.793 771 H GLY 125 HN GLY 125 7.491 -12.903 -6.084 772 1HA GLY 125 HA1 GLY 125 6.865 -15.752 -5.980 773 2HA GLY 125 HA2 GLY 125 7.507 -15.127 -7.492 774 H LEU 126 HN LEU 126 6.129 -12.555 -7.398 775 HA LEU 126 HA LEU 126 3.353 -13.346 -7.346 776 1HB LEU 126 HB2 LEU 126 4.681 -10.727 -7.859 777 2HB LEU 126 HB1 LEU 126 2.983 -10.947 -8.130 778 HG LEU 126 HG LEU 126 4.492 -11.056 -5.607 779 1HD1 LEU 126 HD1 LEU 126 3.912 -8.861 -6.268 780 2HD1 LEU 126 HD1 LEU 126 2.216 -9.314 -6.458 781 3HD1 LEU 126 HD1 LEU 126 2.962 -9.327 -4.858 782 1HD2 LEU 126 HD2 LEU 126 1.669 -11.978 -6.025 783 2HD2 LEU 126 HD2 LEU 126 3.027 -12.895 -5.396 784 3HD2 LEU 126 HD2 LEU 126 2.351 -11.579 -4.446 785 H ASP 127 HN ASP 127 1.996 -13.200 -8.976 786 HA ASP 127 HA ASP 127 2.984 -13.792 -11.626 787 1HB ASP 127 HB2 ASP 127 0.134 -13.090 -10.818 788 2HB ASP 127 HB1 ASP 127 0.647 -13.999 -12.228 789 H HIS 128 HN HIS 128 2.247 -12.283 -13.467 790 HA HIS 128 HA HIS 128 3.158 -9.692 -12.851 791 1HB HIS 128 HB2 HIS 128 3.272 -10.761 -15.137 792 2HB HIS 128 HB1 HIS 128 1.548 -10.434 -15.294 793 HD1 HIS 128 HD1 HIS 128 1.252 -8.453 -16.795 794 HD2 HIS 128 HD2 HIS 128 4.528 -8.056 -14.277 795 HE1 HIS 128 HE1 HIS 128 2.236 -6.179 -17.275 796 H ASP 129 HN ASP 129 -0.070 -10.991 -13.207 797 HA ASP 129 HA ASP 129 -1.414 -8.520 -12.952 798 1HB ASP 129 HB2 ASP 129 -2.355 -11.350 -12.527 799 2HB ASP 129 HB1 ASP 129 -3.409 -9.968 -12.243 800 H LYS 130 HN LYS 130 -0.053 -10.684 -10.655 801 HA LYS 130 HA LYS 130 -1.356 -9.674 -8.336 802 1HB LYS 130 HB2 LYS 130 1.259 -11.076 -8.749 803 2HB LYS 130 HB1 LYS 130 0.747 -10.653 -7.148 804 1HG LYS 130 HG2 LYS 130 -0.790 -12.399 -9.070 805 2HG LYS 130 HG1 LYS 130 0.295 -12.995 -7.815 806 1HD LYS 130 HD2 LYS 130 -1.139 -12.041 -6.105 807 2HD LYS 130 HD1 LYS 130 -2.183 -11.342 -7.343 808 1HE LYS 130 HE2 LYS 130 -3.074 -13.447 -6.369 809 2HE LYS 130 HE1 LYS 130 -2.839 -13.511 -8.114 810 1HZ LYS 130 HZ2 LYS 130 -0.948 -14.634 -6.109 811 2HZ LYS 130 HZ1 LYS 130 -2.103 -15.514 -6.967 812 3HZ LYS 130 HZ3 LYS 130 -0.839 -14.778 -7.805 813 H VAL 131 HN VAL 131 1.708 -8.961 -9.943 814 HA VAL 131 HA VAL 131 2.620 -6.945 -8.248 815 HB VAL 131 HB VAL 131 3.037 -7.077 -11.254 816 1HG1 VAL 131 3HG1 VAL 131 3.781 -4.987 -10.287 817 2HG1 VAL 131 2HG1 VAL 131 4.740 -5.867 -9.099 818 3HG1 VAL 131 1HG1 VAL 131 5.158 -5.958 -10.808 819 1HG2 VAL 131 3HG2 VAL 131 3.568 -9.236 -10.258 820 2HG2 VAL 131 2HG2 VAL 131 5.040 -8.411 -10.774 821 3HG2 VAL 131 1HG2 VAL 131 4.598 -8.442 -9.069 822 H LEU 132 HN LEU 132 0.562 -6.807 -11.114 823 HA LEU 132 HA LEU 132 0.133 -3.995 -11.231 824 1HB LEU 132 HB2 LEU 132 -1.747 -6.187 -12.070 825 2HB LEU 132 HB1 LEU 132 -1.778 -4.519 -12.603 826 HG LEU 132 HG LEU 132 0.328 -6.571 -13.242 827 1HD1 LEU 132 HD1 LEU 132 -1.711 -5.206 -14.954 828 2HD1 LEU 132 HD1 LEU 132 -0.447 -6.303 -15.530 829 3HD1 LEU 132 HD1 LEU 132 -1.712 -6.901 -14.449 830 1HD2 LEU 132 HD2 LEU 132 0.176 -3.664 -14.049 831 2HD2 LEU 132 HD2 LEU 132 1.383 -4.415 -12.996 832 3HD2 LEU 132 HD2 LEU 132 1.306 -4.853 -14.701 833 H LEU 133 HN LEU 133 -1.921 -6.513 -9.805 834 HA LEU 133 HA LEU 133 -3.802 -4.691 -8.796 835 1HB LEU 133 HB2 LEU 133 -3.159 -7.484 -7.874 836 2HB LEU 133 HB1 LEU 133 -4.575 -6.575 -7.390 837 HG LEU 133 HG LEU 133 -3.950 -7.421 -10.220 838 1HD1 LEU 133 HD1 LEU 133 -5.914 -8.562 -8.241 839 2HD1 LEU 133 HD1 LEU 133 -5.793 -8.995 -9.950 840 3HD1 LEU 133 HD1 LEU 133 -4.455 -9.342 -8.862 841 1HD2 LEU 133 HD2 LEU 133 -6.404 -6.126 -9.028 842 2HD2 LEU 133 HD2 LEU 133 -5.273 -5.386 -10.166 843 3HD2 LEU 133 HD2 LEU 133 -6.274 -6.744 -10.672 844 H PHE 134 HN PHE 134 -0.919 -6.093 -7.330 845 HA PHE 134 HA PHE 134 -1.348 -5.003 -4.774 846 1HB PHE 134 HB2 PHE 134 0.210 -6.813 -5.027 847 2HB PHE 134 HB1 PHE 134 1.202 -5.885 -6.145 848 HD1 PHE 134 HD1 PHE 134 0.017 -5.993 -2.625 849 HD2 PHE 134 HD2 PHE 134 2.955 -4.566 -5.349 850 HE1 PHE 134 HE1 PHE 134 1.372 -5.169 -0.746 851 HE2 PHE 134 HE2 PHE 134 4.311 -3.747 -3.451 852 HZ PHE 134 HZ PHE 134 3.532 -4.040 -1.196 853 H SER 135 HN SER 135 0.651 -3.849 -7.494 854 HA SER 135 HA SER 135 1.682 -1.643 -6.161 855 1HB SER 135 HB2 SER 135 2.195 -0.750 -8.463 856 2HB SER 135 HB1 SER 135 2.748 -2.395 -8.145 857 HG SER 135 HG SER 135 1.211 -3.200 -9.375 858 H ARG 136 HN ARG 136 -1.291 -1.932 -7.980 859 HA ARG 136 HA ARG 136 -1.822 0.862 -7.837 860 1HB ARG 136 HB2 ARG 136 -4.084 0.304 -8.662 861 2HB ARG 136 HB1 ARG 136 -2.804 -0.366 -9.659 862 1HG ARG 136 HG2 ARG 136 -3.123 -2.539 -8.550 863 2HG ARG 136 HG1 ARG 136 -4.464 -1.846 -7.640 864 1HD ARG 136 HD2 ARG 136 -4.259 -1.957 -10.610 865 2HD ARG 136 HD1 ARG 136 -5.135 -3.139 -9.647 866 HE ARG 136 HE ARG 136 -6.005 -0.518 -9.028 867 1HH1 ARG 136 1HH1 ARG 136 -6.275 -2.898 -11.621 868 2HH1 ARG 136 2HH1 ARG 136 -7.867 -2.490 -12.065 869 1HH2 ARG 136 1HH2 ARG 136 -8.180 0.098 -9.627 870 2HH2 ARG 136 2HH2 ARG 136 -8.980 -0.719 -10.889 871 H ASP 137 HN ASP 137 -2.939 -1.946 -5.906 872 HA ASP 137 HA ASP 137 -4.694 -0.283 -4.399 873 1HB ASP 137 HB2 ASP 137 -4.906 -2.843 -4.629 874 2HB ASP 137 HB1 ASP 137 -3.642 -2.936 -3.409 875 H LEU 138 HN LEU 138 -1.406 -1.281 -4.119 876 HA LEU 138 HA LEU 138 -0.827 -0.309 -1.546 877 1HB LEU 138 HB2 LEU 138 0.740 -1.721 -2.665 878 2HB LEU 138 HB1 LEU 138 0.845 -0.628 -4.025 879 HG LEU 138 HG LEU 138 2.020 1.011 -2.604 880 1HD1 LEU 138 HD1 LEU 138 1.919 -1.121 -0.512 881 2HD1 LEU 138 HD1 LEU 138 2.858 0.381 -0.470 882 3HD1 LEU 138 HD1 LEU 138 1.097 0.454 -0.479 883 1HD2 LEU 138 HD2 LEU 138 3.224 -1.741 -2.616 884 2HD2 LEU 138 HD2 LEU 138 3.289 -0.567 -3.931 885 3HD2 LEU 138 HD2 LEU 138 4.108 -0.231 -2.406 886 H ASP 139 HN ASP 139 -0.594 1.211 -4.723 887 HA ASP 139 HA ASP 139 0.334 3.748 -3.939 888 1HB ASP 139 HB2 ASP 139 0.293 2.959 -6.248 889 2HB ASP 139 HB1 ASP 139 -1.464 2.947 -6.233 890 H LYS 140 HN LYS 140 -2.904 2.459 -4.337 891 HA LYS 140 HA LYS 140 -4.409 4.674 -3.710 892 1HB LYS 140 HB2 LYS 140 -5.275 2.999 -4.919 893 2HB LYS 140 HB1 LYS 140 -4.655 1.737 -3.889 894 1HG LYS 140 HG2 LYS 140 -6.258 2.189 -2.256 895 2HG LYS 140 HG1 LYS 140 -6.904 3.575 -3.170 896 1HD LYS 140 HD2 LYS 140 -7.657 2.165 -4.930 897 2HD LYS 140 HD1 LYS 140 -6.762 0.782 -4.302 898 1HE LYS 140 HE2 LYS 140 -9.093 2.097 -2.927 899 2HE LYS 140 HE1 LYS 140 -9.201 0.654 -3.939 900 1HZ LYS 140 HZ3 LYS 140 -7.597 -0.413 -2.395 901 2HZ LYS 140 HZ2 LYS 140 -7.716 0.941 -1.394 902 3HZ LYS 140 HZ1 LYS 140 -9.065 -0.010 -1.654 903 H LEU 141 HN LEU 141 -3.138 1.996 -1.737 904 HA LEU 141 HA LEU 141 -4.358 2.578 0.697 905 1HB LEU 141 HB2 LEU 141 -3.032 0.523 -0.062 906 2HB LEU 141 HB1 LEU 141 -1.590 1.444 0.257 907 HG LEU 141 HG LEU 141 -2.093 -0.154 2.086 908 1HD1 LEU 141 HD1 LEU 141 -2.251 2.658 2.911 909 2HD1 LEU 141 HD1 LEU 141 -1.988 1.255 3.970 910 3HD1 LEU 141 HD1 LEU 141 -0.834 1.620 2.697 911 1HD2 LEU 141 HD2 LEU 141 -4.509 -0.098 1.798 912 2HD2 LEU 141 HD2 LEU 141 -3.944 0.145 3.475 913 3HD2 LEU 141 HD2 LEU 141 -4.459 1.529 2.520 914 H ILE 142 HN ILE 142 -1.456 3.623 -0.842 915 HA ILE 142 HA ILE 142 -0.501 5.115 1.401 916 HB ILE 142 HB ILE 142 0.367 5.264 -1.515 917 1HG1 ILE 142 2HG1 ILE 142 1.586 3.911 0.894 918 2HG1 ILE 142 1HG1 ILE 142 0.782 3.103 -0.444 919 1HG2 ILE 142 3HG2 ILE 142 1.675 6.438 0.942 920 2HG2 ILE 142 2HG2 ILE 142 2.354 6.436 -0.691 921 3HG2 ILE 142 1HG2 ILE 142 0.884 7.347 -0.347 922 1HD1 ILE 142 HD1 ILE 142 3.335 4.685 -0.607 923 2HD1 ILE 142 HD1 ILE 142 3.196 2.925 -0.606 924 3HD1 ILE 142 HD1 ILE 142 2.540 3.861 -1.948 925 H ASN 143 HN ASN 143 -2.026 6.068 -1.632 926 HA ASN 143 HA ASN 143 -2.319 8.785 -1.183 927 1HB ASN 143 HB2 ASN 143 -4.093 6.863 -2.656 928 2HB ASN 143 HB1 ASN 143 -4.445 8.587 -2.574 929 1HD2 ASN 143 HD2 ASN 143 -3.748 6.898 -4.888 930 2HD2 ASN 143 HD2 ASN 143 -2.354 7.621 -5.575 931 H LYS 144 HN LYS 144 -4.203 6.169 0.136 932 HA LYS 144 HA LYS 144 -6.400 7.511 1.227 933 1HB LYS 144 HB2 LYS 144 -6.129 5.065 1.209 934 2HB LYS 144 HB1 LYS 144 -4.827 5.193 2.380 935 1HG LYS 144 HG2 LYS 144 -6.558 6.316 3.911 936 2HG LYS 144 HG1 LYS 144 -7.766 5.676 2.801 937 1HD LYS 144 HD2 LYS 144 -5.729 4.063 4.356 938 2HD LYS 144 HD1 LYS 144 -7.447 4.184 4.720 939 1HE LYS 144 HE2 LYS 144 -7.929 3.149 2.528 940 2HE LYS 144 HE1 LYS 144 -6.201 2.960 2.258 941 1HZ LYS 144 HZ1 LYS 144 -7.718 1.746 4.504 942 2HZ LYS 144 HZ3 LYS 144 -7.275 0.926 3.142 943 3HZ LYS 144 HZ2 LYS 144 -6.106 1.428 4.217 944 H PHE 145 HN PHE 145 -3.135 7.076 2.384 945 HA PHE 145 HA PHE 145 -3.739 8.435 4.844 946 1HB PHE 145 HB2 PHE 145 -1.404 6.841 3.874 947 2HB PHE 145 HB1 PHE 145 -1.286 7.848 5.317 948 HD1 PHE 145 HD1 PHE 145 -2.734 4.728 3.893 949 HD2 PHE 145 HD2 PHE 145 -2.575 7.392 7.228 950 HE1 PHE 145 HE1 PHE 145 -3.793 3.036 5.283 951 HE2 PHE 145 HE2 PHE 145 -3.655 5.664 8.637 952 HZ PHE 145 HZ PHE 145 -4.260 3.486 7.655 953 H MET 146 HN MET 146 -2.350 9.161 1.857 954 HA MET 146 HA MET 146 -0.735 11.378 2.847 955 1HB MET 146 HB2 MET 146 -1.527 10.862 0.003 956 2HB MET 146 HB1 MET 146 -0.167 11.799 0.597 957 1HG MET 146 HG2 MET 146 0.787 9.672 1.485 958 2HG MET 146 HG1 MET 146 -0.537 8.837 0.691 959 1HE MET 146 HE2 MET 146 2.771 10.523 0.412 960 2HE MET 146 HE1 MET 146 2.958 10.927 -1.295 961 3HE MET 146 HE3 MET 146 1.815 11.832 -0.295 962 H ASN 147 HN ASN 147 -3.850 10.882 1.303 963 HA ASN 147 HA ASN 147 -4.388 13.737 1.527 964 1HB ASN 147 HB2 ASN 147 -3.114 13.515 -0.536 965 2HB ASN 147 HB1 ASN 147 -4.284 12.350 -1.116 966 1HD2 ASN 147 HD2 ASN 147 -4.781 13.544 -2.899 967 2HD2 ASN 147 HD2 ASN 147 -5.731 14.989 -2.831 968 H VAL 148 HN VAL 148 -5.462 10.964 0.078 969 HA VAL 148 HA VAL 148 -8.295 11.764 0.289 970 HB VAL 148 HB VAL 148 -7.290 9.160 -0.703 971 1HG1 VAL 148 2HG1 VAL 148 -9.697 9.232 -0.295 972 2HG1 VAL 148 1HG1 VAL 148 -9.847 10.680 -1.291 973 3HG1 VAL 148 3HG1 VAL 148 -9.417 9.139 -2.034 974 1HG2 VAL 148 2HG2 VAL 148 -7.651 11.689 -2.273 975 2HG2 VAL 148 1HG2 VAL 148 -6.144 10.828 -1.979 976 3HG2 VAL 148 3HG2 VAL 148 -7.379 10.107 -3.024 977 H LYS 149 HN LYS 149 -8.509 11.766 2.310 978 HA LYS 149 HA LYS 149 -7.843 9.536 3.957 979 1HB LYS 149 HB2 LYS 149 -9.261 12.102 4.629 980 2HB LYS 149 HB1 LYS 149 -8.704 10.904 5.781 981 1HG LYS 149 HG2 LYS 149 -6.891 12.319 3.875 982 2HG LYS 149 HG1 LYS 149 -7.230 12.946 5.497 983 1HD LYS 149 HD2 LYS 149 -6.388 10.704 6.358 984 2HD LYS 149 HD1 LYS 149 -5.862 10.373 4.708 985 1HE LYS 149 HE2 LYS 149 -4.016 11.237 6.032 986 2HE LYS 149 HE1 LYS 149 -4.450 12.368 4.750 987 1HZ LYS 149 HZ3 LYS 149 -5.307 12.615 7.596 988 2HZ LYS 149 HZ2 LYS 149 -4.056 13.484 6.884 989 3HZ LYS 149 HZ1 LYS 149 -5.631 13.709 6.362 990 H ASP 150 HN ASP 150 -9.228 8.001 2.976 991 HA ASP 150 HA ASP 150 -11.029 6.642 2.798 992 1HB ASP 150 HB2 ASP 150 -10.667 6.533 5.236 993 2HB ASP 150 HB1 ASP 150 -11.801 7.861 5.458 994 H LYS 151 HN LYS 151 -12.100 7.446 1.002 995 HA LYS 151 HA LYS 151 -14.169 9.452 1.597 996 1HB LYS 151 HB2 LYS 151 -14.149 10.188 -0.691 997 2HB LYS 151 HB1 LYS 151 -12.498 10.179 -0.101 998 1HG LYS 151 HG2 LYS 151 -12.002 8.188 -1.350 999 2HG LYS 151 HG1 LYS 151 -13.701 7.992 -1.790 1000 1HD LYS 151 HD2 LYS 151 -13.584 10.209 -2.940 1001 2HD LYS 151 HD1 LYS 151 -11.853 10.222 -2.625 1002 1HE LYS 151 HE2 LYS 151 -13.303 8.092 -4.196 1003 2HE LYS 151 HE1 LYS 151 -12.458 9.459 -4.912 1004 1HZ LYS 151 HZ1 LYS 151 -10.405 8.637 -3.940 1005 2HZ LYS 151 HZ3 LYS 151 -11.218 7.297 -3.283 1006 3HZ LYS 151 HZ2 LYS 151 -11.105 7.500 -4.946 1007 H VAL 152 HN VAL 152 -14.062 6.423 1.577 1008 HA VAL 152 HA VAL 152 -16.093 5.766 -0.324 1009 HB VAL 152 HB VAL 152 -16.109 3.467 0.798 1010 1HG1 VAL 152 1HG1 VAL 152 -13.517 4.555 -0.289 1011 2HG1 VAL 152 3HG1 VAL 152 -13.904 2.843 -0.136 1012 3HG1 VAL 152 2HG1 VAL 152 -14.842 3.860 -1.225 1013 1HG2 VAL 152 3HG2 VAL 152 -13.736 4.637 2.282 1014 2HG2 VAL 152 2HG2 VAL 152 -15.255 4.126 3.003 1015 3HG2 VAL 152 1HG2 VAL 152 -14.191 2.932 2.260 1016 H HIS 153 HN HIS 153 -17.688 7.264 0.283 1017 HA HIS 153 HA HIS 153 -19.085 6.588 2.717 1018 1HB HIS 153 HB2 HIS 153 -20.665 8.444 2.207 1019 2HB HIS 153 HB1 HIS 153 -19.001 8.991 2.200 1020 HD1 HIS 153 HD1 HIS 153 -18.264 10.259 0.117 1021 HD2 HIS 153 HD2 HIS 153 -21.825 8.183 -0.401 1022 HE1 HIS 153 HE1 HIS 153 -19.180 10.974 -2.112 1023 H LYS 154 HN LYS 154 -19.189 5.968 -0.563 1024 HA LYS 154 HA LYS 154 -21.591 4.316 -0.250 1025 1HB LYS 154 HB2 LYS 154 -19.885 4.920 -2.698 1026 2HB LYS 154 HB1 LYS 154 -21.228 3.794 -2.691 1027 1HG LYS 154 HG2 LYS 154 -21.468 6.743 -2.112 1028 2HG LYS 154 HG1 LYS 154 -21.799 5.982 -3.669 1029 1HD LYS 154 HD2 LYS 154 -23.538 4.603 -2.605 1030 2HD LYS 154 HD1 LYS 154 -23.231 5.407 -1.069 1031 1HE LYS 154 HE2 LYS 154 -24.186 6.745 -3.602 1032 2HE LYS 154 HE1 LYS 154 -25.197 6.323 -2.224 1033 1HZ LYS 154 HZ3 LYS 154 -23.823 7.853 -0.867 1034 2HZ LYS 154 HZ2 LYS 154 -22.980 8.314 -2.256 1035 3HZ LYS 154 HZ1 LYS 154 -24.591 8.643 -2.132 1036 H LEU 155 HN LEU 155 -21.378 2.127 -0.163 1037 HA LEU 155 HA LEU 155 -18.808 1.258 0.715 1038 1HB LEU 155 HB2 LEU 155 -21.418 -0.226 0.414 1039 2HB LEU 155 HB1 LEU 155 -19.944 -1.007 0.934 1040 HG LEU 155 HG LEU 155 -19.900 0.554 2.906 1041 1HD1 LEU 155 HD1 LEU 155 -22.685 1.271 2.008 1042 2HD1 LEU 155 HD1 LEU 155 -21.956 1.694 3.558 1043 3HD1 LEU 155 HD1 LEU 155 -21.297 2.353 2.062 1044 1HD2 LEU 155 HD2 LEU 155 -22.304 -1.227 2.607 1045 2HD2 LEU 155 HD2 LEU 155 -20.684 -1.718 3.115 1046 3HD2 LEU 155 HD2 LEU 155 -21.645 -0.645 4.133 1047 H GLU 156 HN GLU 156 -17.693 -0.581 -0.087 1048 HA GLU 156 HA GLU 156 -17.583 -0.583 -2.954 1049 1HB GLU 156 HB2 GLU 156 -15.949 -2.030 -0.867 1050 2HB GLU 156 HB1 GLU 156 -15.684 -2.197 -2.595 1051 1HG GLU 156 HG2 GLU 156 -15.479 0.382 -1.050 1052 2HG GLU 156 HG1 GLU 156 -14.118 -0.623 -1.539 1053 H HIS 157 HN HIS 157 -19.446 -1.493 -3.616 1054 HA HIS 157 HA HIS 157 -19.507 -4.349 -3.535 1055 1HB HIS 157 HB2 HIS 157 -21.808 -4.547 -2.870 1056 2HB HIS 157 HB1 HIS 157 -20.860 -3.863 -1.547 1057 HD1 HIS 157 HD1 HIS 157 -24.131 -3.621 -2.737 1058 HD2 HIS 157 HD2 HIS 157 -21.244 -0.733 -1.941 1059 HE1 HIS 157 HE1 HIS 157 -25.369 -1.476 -2.381 1060 H HIS 158 HN HIS 158 -21.886 -4.834 -4.698 1061 HA HIS 158 HA HIS 158 -21.332 -3.645 -7.230 1062 1HB HIS 158 HB2 HIS 158 -21.580 -6.124 -6.992 1063 2HB HIS 158 HB1 HIS 158 -23.268 -5.874 -6.579 1064 HD1 HIS 158 HD1 HIS 158 -21.671 -7.233 -9.217 1065 HD2 HIS 158 HD2 HIS 158 -24.234 -3.974 -9.016 1066 HE1 HIS 158 HE1 HIS 158 -22.623 -6.943 -11.533 1067 H HIS 159 HN HIS 159 -22.176 -1.603 -6.864 1068 HA HIS 159 HA HIS 159 -24.943 -1.447 -7.572 1069 1HB HIS 159 HB2 HIS 159 -25.102 -1.192 -5.100 1070 2HB HIS 159 HB1 HIS 159 -23.918 0.110 -5.163 1071 HD1 HIS 159 HD1 HIS 159 -25.414 2.088 -4.453 1072 HD2 HIS 159 HD2 HIS 159 -27.047 -0.162 -7.545 1073 HE1 HIS 159 HE1 HIS 159 -27.377 3.399 -5.333 1074 H HIS 160 HN HIS 160 -24.663 -0.521 -9.412 1075 HA HIS 160 HA HIS 160 -22.826 1.741 -9.540 1076 1HB HIS 160 HB2 HIS 160 -23.559 -0.218 -11.731 1077 2HB HIS 160 HB1 HIS 160 -22.505 1.177 -11.928 1078 HD1 HIS 160 HD1 HIS 160 -21.833 -2.101 -12.134 1079 HD2 HIS 160 HD2 HIS 160 -20.634 0.686 -9.304 1080 HE1 HIS 160 HE1 HIS 160 -19.776 -3.050 -11.049 1081 H HIS 161 HN HIS 161 -23.586 3.571 -10.493 1082 HA HIS 161 HA HIS 161 -26.430 3.776 -10.738 1083 1HB HIS 161 HB2 HIS 161 -24.262 5.823 -11.324 1084 2HB HIS 161 HB1 HIS 161 -25.989 6.161 -11.311 1085 HD1 HIS 161 HD1 HIS 161 -23.256 6.787 -9.247 1086 HD2 HIS 161 HD2 HIS 161 -27.002 5.135 -8.551 1087 HE1 HIS 161 HE1 HIS 161 -23.680 7.032 -6.777 1088 H HIS 162 HN HIS 162 -23.719 3.315 -12.789 1089 HA HIS 162 HA HIS 162 -25.524 2.799 -14.969 1090 1HB HIS 162 HB2 HIS 162 -24.719 5.133 -15.341 1091 2HB HIS 162 HB1 HIS 162 -23.062 4.540 -15.286 1092 HD1 HIS 162 HD1 HIS 162 -26.200 3.800 -17.346 1093 HD2 HIS 162 HD2 HIS 162 -22.069 4.020 -17.726 1094 HE1 HIS 162 HE1 HIS 162 -25.699 3.324 -19.762 No H/Q in entry = 1094 Start of MODEL 21 1 H1 MET 1 HT1 MET 1 19.587 -14.355 -1.297 2 H2 MET 1 HT3 MET 1 20.557 -15.482 -0.495 3 H3 MET 1 HT2 MET 1 21.035 -14.824 -1.972 4 HA MET 1 HA MET 1 19.240 -15.940 -3.128 5 1HB MET 1 HB2 MET 1 20.568 -17.867 -1.207 6 2HB MET 1 HB1 MET 1 19.854 -18.280 -2.753 7 1HG MET 1 HG2 MET 1 21.610 -17.010 -3.898 8 2HG MET 1 HG1 MET 1 22.307 -16.587 -2.332 9 1HE MET 1 HE2 MET 1 23.389 -18.370 -0.652 10 2HE MET 1 HE1 MET 1 21.933 -19.363 -0.684 11 3HE MET 1 HE3 MET 1 23.507 -20.092 -0.999 12 H GLU 2 HN GLU 2 19.404 -16.663 0.287 13 HA GLU 2 HA GLU 2 17.140 -18.181 0.646 14 1HB GLU 2 HB2 GLU 2 18.119 -16.276 2.745 15 2HB GLU 2 HB1 GLU 2 17.519 -17.911 2.932 16 1HG GLU 2 HG2 GLU 2 19.778 -18.157 3.374 17 2HG GLU 2 HG1 GLU 2 19.690 -18.586 1.667 18 H MET 3 HN MET 3 15.057 -17.691 1.129 19 HA MET 3 HA MET 3 14.053 -15.245 0.164 20 1HB MET 3 HB2 MET 3 11.832 -16.035 0.839 21 2HB MET 3 HB1 MET 3 12.717 -17.274 -0.030 22 1HG MET 3 HG2 MET 3 13.234 -18.380 2.103 23 2HG MET 3 HG1 MET 3 12.324 -17.136 2.954 24 1HE MET 3 HE1 MET 3 9.710 -16.793 2.723 25 2HE MET 3 HE3 MET 3 9.825 -16.685 0.965 26 3HE MET 3 HE2 MET 3 8.672 -17.789 1.708 27 H GLY 4 HN GLY 4 15.095 -16.219 3.268 28 1HA GLY 4 HA1 GLY 4 15.306 -15.068 5.238 29 2HA GLY 4 HA2 GLY 4 13.722 -14.394 4.890 30 H GLN 5 HN GLN 5 16.762 -14.023 3.075 31 HA GLN 5 HA GLN 5 17.105 -11.346 4.008 32 1HB GLN 5 HB2 GLN 5 18.507 -12.853 1.798 33 2HB GLN 5 HB1 GLN 5 18.856 -11.170 2.152 34 1HG GLN 5 HG2 GLN 5 19.337 -11.939 4.531 35 2HG GLN 5 HG1 GLN 5 19.336 -13.580 3.878 36 1HE2 GLN 5 1HE2 GLN 5 21.121 -14.271 2.650 37 2HE2 GLN 5 2HE2 GLN 5 22.494 -13.266 2.414 38 H LEU 6 HN LEU 6 15.663 -12.813 1.236 39 HA LEU 6 HA LEU 6 15.147 -10.493 -0.271 40 1HB LEU 6 HB2 LEU 6 14.955 -12.769 -1.192 41 2HB LEU 6 HB1 LEU 6 13.678 -13.142 -0.072 42 HG LEU 6 HG LEU 6 13.003 -12.818 -2.498 43 1HD1 LEU 6 HD1 LEU 6 11.617 -11.095 -0.478 44 2HD1 LEU 6 HD1 LEU 6 10.948 -11.633 -2.018 45 3HD1 LEU 6 HD1 LEU 6 11.339 -12.810 -0.765 46 1HD2 LEU 6 HD2 LEU 6 13.520 -9.919 -1.845 47 2HD2 LEU 6 HD2 LEU 6 14.399 -10.894 -3.023 48 3HD2 LEU 6 HD2 LEU 6 12.694 -10.515 -3.282 49 H LYS 7 HN LYS 7 13.299 -12.154 2.217 50 HA LYS 7 HA LYS 7 11.058 -10.482 2.317 51 1HB LYS 7 HB2 LYS 7 12.002 -12.759 3.629 52 2HB LYS 7 HB1 LYS 7 11.810 -11.565 4.898 53 1HG LYS 7 HG2 LYS 7 9.647 -12.182 2.926 54 2HG LYS 7 HG1 LYS 7 9.846 -13.109 4.398 55 1HD LYS 7 HD2 LYS 7 9.362 -10.115 4.270 56 2HD LYS 7 HD1 LYS 7 8.120 -11.320 4.597 57 1HE LYS 7 HE2 LYS 7 9.569 -12.051 6.572 58 2HE LYS 7 HE1 LYS 7 10.501 -10.591 6.292 59 1HZ LYS 7 HZ3 LYS 7 8.436 -9.288 6.628 60 2HZ LYS 7 HZ2 LYS 7 7.617 -10.719 6.965 61 3HZ LYS 7 HZ1 LYS 7 8.848 -10.215 7.974 62 H ASN 8 HN ASN 8 14.183 -10.334 3.923 63 HA ASN 8 HA ASN 8 13.653 -8.124 5.585 64 1HB ASN 8 HB2 ASN 8 15.626 -9.406 6.032 65 2HB ASN 8 HB1 ASN 8 16.247 -9.127 4.413 66 1HD2 ASN 8 HD2 ASN 8 17.421 -7.326 3.999 67 2HD2 ASN 8 HD2 ASN 8 17.763 -6.099 5.161 68 H LYS 9 HN LYS 9 14.838 -8.325 2.295 69 HA LYS 9 HA LYS 9 15.204 -5.534 1.966 70 1HB LYS 9 HB2 LYS 9 14.679 -7.651 -0.124 71 2HB LYS 9 HB1 LYS 9 15.129 -5.995 -0.497 72 1HG LYS 9 HG2 LYS 9 16.805 -8.021 0.987 73 2HG LYS 9 HG1 LYS 9 17.050 -7.467 -0.667 74 1HD LYS 9 HD2 LYS 9 17.233 -5.739 1.814 75 2HD LYS 9 HD1 LYS 9 18.601 -6.388 0.923 76 1HE LYS 9 HE2 LYS 9 17.945 -5.093 -1.057 77 2HE LYS 9 HE1 LYS 9 16.545 -4.467 -0.189 78 1HZ LYS 9 HZ3 LYS 9 19.383 -3.987 0.556 79 2HZ LYS 9 HZ2 LYS 9 18.380 -2.879 -0.207 80 3HZ LYS 9 HZ1 LYS 9 18.043 -3.372 1.364 81 H ILE 10 HN ILE 10 12.447 -7.640 1.365 82 HA ILE 10 HA ILE 10 10.669 -5.692 0.371 83 HB ILE 10 HB ILE 10 10.075 -8.137 2.085 84 1HG1 ILE 10 2HG1 ILE 10 9.812 -7.697 -0.885 85 2HG1 ILE 10 1HG1 ILE 10 11.091 -8.633 -0.106 86 1HG2 ILE 10 3HG2 ILE 10 8.137 -6.408 0.537 87 2HG2 ILE 10 2HG2 ILE 10 7.732 -7.943 1.306 88 3HG2 ILE 10 1HG2 ILE 10 8.232 -6.565 2.291 89 1HD1 ILE 10 HD1 ILE 10 9.373 -10.226 0.660 90 2HD1 ILE 10 HD1 ILE 10 8.150 -9.269 -0.189 91 3HD1 ILE 10 HD1 ILE 10 9.443 -10.064 -1.095 92 H GLU 11 HN GLU 11 11.260 -6.803 3.662 93 HA GLU 11 HA GLU 11 9.531 -5.096 4.985 94 1HB GLU 11 HB2 GLU 11 12.136 -6.281 5.887 95 2HB GLU 11 HB1 GLU 11 11.089 -5.346 6.942 96 1HG GLU 11 HG2 GLU 11 10.361 -7.889 5.539 97 2HG GLU 11 HG1 GLU 11 10.778 -7.717 7.245 98 H ASN 12 HN ASN 12 12.964 -4.626 4.295 99 HA ASN 12 HA ASN 12 13.078 -2.165 5.648 100 1HB ASN 12 HB2 ASN 12 15.056 -3.637 5.109 101 2HB ASN 12 HB1 ASN 12 14.957 -3.020 3.461 102 1HD2 ASN 12 HD2 ASN 12 16.908 -1.971 3.541 103 2HD2 ASN 12 HD2 ASN 12 17.171 -0.559 4.500 104 H LYS 13 HN LYS 13 12.543 -2.970 2.215 105 HA LYS 13 HA LYS 13 12.784 -0.310 1.356 106 1HB LYS 13 HB2 LYS 13 12.914 -2.463 -0.007 107 2HB LYS 13 HB1 LYS 13 11.161 -2.462 0.034 108 1HG LYS 13 HG2 LYS 13 11.996 -1.530 -2.043 109 2HG LYS 13 HG1 LYS 13 11.103 -0.331 -1.113 110 1HD LYS 13 HD2 LYS 13 13.165 0.589 -2.106 111 2HD LYS 13 HD1 LYS 13 13.171 0.674 -0.350 112 1HE LYS 13 HE2 LYS 13 14.603 -1.220 -0.225 113 2HE LYS 13 HE1 LYS 13 14.555 -1.457 -1.986 114 1HZ LYS 13 HZ1 LYS 13 15.601 0.731 -2.208 115 2HZ LYS 13 HZ3 LYS 13 15.667 0.856 -0.498 116 3HZ LYS 13 HZ2 LYS 13 16.555 -0.346 -1.295 117 H LYS 14 HN LYS 14 10.026 -2.323 2.245 118 HA LYS 14 HA LYS 14 7.931 -0.543 1.894 119 1HB LYS 14 HB2 LYS 14 7.595 -2.875 2.262 120 2HB LYS 14 HB1 LYS 14 8.441 -2.814 3.805 121 1HG LYS 14 HG2 LYS 14 6.570 -1.343 4.648 122 2HG LYS 14 HG1 LYS 14 5.716 -1.690 3.144 123 1HD LYS 14 HD2 LYS 14 4.900 -3.234 4.816 124 2HD LYS 14 HD1 LYS 14 5.935 -4.123 3.691 125 1HE LYS 14 HE2 LYS 14 7.801 -3.927 5.276 126 2HE LYS 14 HE1 LYS 14 6.701 -3.104 6.381 127 1HZ LYS 14 HZ3 LYS 14 6.252 -5.857 5.364 128 2HZ LYS 14 HZ2 LYS 14 7.070 -5.521 6.773 129 3HZ LYS 14 HZ1 LYS 14 5.438 -5.139 6.653 130 H LYS 15 HN LYS 15 10.050 -1.180 4.668 131 HA LYS 15 HA LYS 15 8.885 0.704 6.394 132 1HB LYS 15 HB2 LYS 15 11.516 -0.741 6.391 133 2HB LYS 15 HB1 LYS 15 11.171 0.491 7.600 134 1HG LYS 15 HG2 LYS 15 9.436 -0.749 8.559 135 2HG LYS 15 HG1 LYS 15 9.263 -1.789 7.147 136 1HD LYS 15 HD2 LYS 15 11.242 -2.962 7.651 137 2HD LYS 15 HD1 LYS 15 11.763 -1.764 8.834 138 1HE LYS 15 HE2 LYS 15 10.950 -3.846 9.886 139 2HE LYS 15 HE1 LYS 15 9.978 -2.456 10.341 140 1HZ LYS 15 HZ2 LYS 15 9.148 -4.539 8.314 141 2HZ LYS 15 HZ1 LYS 15 8.645 -4.407 9.888 142 3HZ LYS 15 HZ3 LYS 15 8.251 -3.184 8.836 143 H GLU 16 HN GLU 16 11.649 1.009 4.184 144 HA GLU 16 HA GLU 16 12.333 3.663 4.699 145 1HB GLU 16 HB2 GLU 16 12.318 2.168 2.051 146 2HB GLU 16 HB1 GLU 16 12.955 3.790 2.234 147 1HG GLU 16 HG2 GLU 16 14.598 2.816 3.869 148 2HG GLU 16 HG1 GLU 16 14.003 1.222 3.388 149 H LEU 17 HN LEU 17 9.781 2.306 2.750 150 HA LEU 17 HA LEU 17 8.878 4.747 1.657 151 1HB LEU 17 HB2 LEU 17 8.403 2.785 0.439 152 2HB LEU 17 HB1 LEU 17 7.730 1.977 1.830 153 HG LEU 17 HG LEU 17 6.052 2.613 0.066 154 1HD1 LEU 17 HD1 LEU 17 5.387 2.000 2.164 155 2HD1 LEU 17 HD1 LEU 17 5.497 3.662 2.727 156 3HD1 LEU 17 HD1 LEU 17 4.330 3.239 1.457 157 1HD2 LEU 17 HD2 LEU 17 6.604 5.402 1.008 158 2HD2 LEU 17 HD2 LEU 17 6.975 4.761 -0.594 159 3HD2 LEU 17 HD2 LEU 17 5.293 4.897 -0.064 160 H ILE 18 HN ILE 18 7.838 2.793 4.392 161 HA ILE 18 HA ILE 18 5.593 4.246 5.055 162 HB ILE 18 HB ILE 18 7.478 2.842 6.989 163 1HG1 ILE 18 2HG1 ILE 18 4.868 1.874 5.831 164 2HG1 ILE 18 1HG1 ILE 18 6.428 1.507 5.108 165 1HG2 ILE 18 1HG2 ILE 18 6.006 4.435 8.184 166 2HG2 ILE 18 3HG2 ILE 18 4.591 3.699 7.446 167 3HG2 ILE 18 2HG2 ILE 18 5.586 2.778 8.567 168 1HD1 ILE 18 HD1 ILE 18 5.523 0.725 7.866 169 2HD1 ILE 18 HD1 ILE 18 5.638 -0.335 6.453 170 3HD1 ILE 18 HD1 ILE 18 7.095 0.372 7.148 171 H GLN 19 HN GLN 19 8.935 4.706 5.898 172 HA GLN 19 HA GLN 19 8.669 6.904 7.643 173 1HB GLN 19 HB2 GLN 19 10.977 6.107 5.883 174 2HB GLN 19 HB1 GLN 19 11.070 7.260 7.202 175 1HG GLN 19 HG2 GLN 19 10.422 5.491 8.773 176 2HG GLN 19 HG1 GLN 19 10.389 4.344 7.437 177 1HE2 GLN 19 1HE2 GLN 19 11.991 4.276 9.796 178 2HE2 GLN 19 2HE2 GLN 19 13.634 4.284 9.290 179 H LEU 20 HN LEU 20 8.875 6.662 4.164 180 HA LEU 20 HA LEU 20 9.163 9.450 3.692 181 1HB LEU 20 HB2 LEU 20 8.177 7.258 1.877 182 2HB LEU 20 HB1 LEU 20 8.459 8.909 1.367 183 HG LEU 20 HG LEU 20 10.574 7.013 2.389 184 1HD1 LEU 20 HD1 LEU 20 9.708 6.397 0.203 185 2HD1 LEU 20 HD1 LEU 20 9.992 8.040 -0.375 186 3HD1 LEU 20 HD1 LEU 20 11.353 7.022 0.088 187 1HD2 LEU 20 HD2 LEU 20 10.784 9.799 1.248 188 2HD2 LEU 20 HD2 LEU 20 11.090 9.339 2.921 189 3HD2 LEU 20 HD2 LEU 20 12.142 8.744 1.640 190 H VAL 21 HN VAL 21 6.337 7.229 3.461 191 HA VAL 21 HA VAL 21 4.437 9.275 3.078 192 HB VAL 21 HB VAL 21 3.914 6.749 4.675 193 1HG1 VAL 21 3HG1 VAL 21 2.088 8.355 4.690 194 2HG1 VAL 21 2HG1 VAL 21 2.092 8.397 2.929 195 3HG1 VAL 21 1HG1 VAL 21 1.652 6.912 3.773 196 1HG2 VAL 21 1HG2 VAL 21 3.943 7.096 1.682 197 2HG2 VAL 21 3HG2 VAL 21 5.065 6.142 2.658 198 3HG2 VAL 21 2HG2 VAL 21 3.370 5.665 2.553 199 H ALA 22 HN ALA 22 5.936 8.085 5.992 200 HA ALA 22 HA ALA 22 4.323 9.397 7.877 201 1HB ALA 22 HB3 ALA 22 7.204 8.583 8.138 202 2HB ALA 22 HB2 ALA 22 6.085 8.920 9.474 203 3HB ALA 22 HB1 ALA 22 5.811 7.541 8.408 204 H ARG 23 HN ARG 23 7.440 10.369 6.418 205 HA ARG 23 HA ARG 23 7.599 12.792 7.865 206 1HB ARG 23 HB2 ARG 23 9.409 13.441 6.374 207 2HB ARG 23 HB1 ARG 23 9.618 11.775 6.904 208 1HG ARG 23 HG2 ARG 23 8.657 11.061 4.735 209 2HG ARG 23 HG1 ARG 23 8.637 12.751 4.239 210 1HD ARG 23 HD2 ARG 23 10.614 11.634 3.386 211 2HD ARG 23 HD1 ARG 23 11.063 12.872 4.561 212 HE ARG 23 HE ARG 23 10.828 10.516 5.970 213 1HH1 ARG 23 1HH1 ARG 23 12.849 11.685 3.282 214 2HH1 ARG 23 2HH1 ARG 23 14.170 10.685 3.709 215 1HH2 ARG 23 1HH2 ARG 23 12.677 9.211 6.541 216 2HH2 ARG 23 2HH2 ARG 23 14.072 9.270 5.554 217 H HIS 24 HN HIS 24 5.870 11.907 5.098 218 HA HIS 24 HA HIS 24 5.357 14.345 3.851 219 1HB HIS 24 HB2 HIS 24 4.580 12.264 2.865 220 2HB HIS 24 HB1 HIS 24 3.595 11.917 4.274 221 HD1 HIS 24 HD1 HIS 24 1.197 12.631 4.142 222 HD2 HIS 24 HD2 HIS 24 3.577 14.559 1.348 223 HE1 HIS 24 HE1 HIS 24 -0.360 13.984 2.718 224 H GLY 25 HN GLY 25 4.198 13.042 6.860 225 1HA GLY 25 HA1 GLY 25 2.552 15.461 7.202 226 2HA GLY 25 HA2 GLY 25 3.713 14.951 8.422 227 H LEU 26 HN LEU 26 3.219 12.183 8.358 228 HA LEU 26 HA LEU 26 0.411 12.019 9.107 229 1HB LEU 26 HB2 LEU 26 2.510 9.937 8.711 230 2HB LEU 26 HB1 LEU 26 1.014 9.541 9.487 231 HG LEU 26 HG LEU 26 1.561 10.368 6.739 232 1HD1 LEU 26 HD1 LEU 26 0.264 7.907 7.873 233 2HD1 LEU 26 HD1 LEU 26 0.368 8.262 6.148 234 3HD1 LEU 26 HD1 LEU 26 1.840 8.038 7.090 235 1HD2 LEU 26 HD2 LEU 26 -1.184 10.253 7.973 236 2HD2 LEU 26 HD2 LEU 26 -0.390 11.639 7.216 237 3HD2 LEU 26 HD2 LEU 26 -0.880 10.263 6.239 238 H ASP 27 HN ASP 27 -0.248 11.438 11.013 239 HA ASP 27 HA ASP 27 1.305 12.125 13.344 240 1HB ASP 27 HB2 ASP 27 -1.259 10.501 13.285 241 2HB ASP 27 HB1 ASP 27 -0.558 11.313 14.657 242 H HIS 28 HN HIS 28 1.585 10.509 15.109 243 HA HIS 28 HA HIS 28 2.981 8.235 14.323 244 1HB HIS 28 HB2 HIS 28 3.222 9.296 16.537 245 2HB HIS 28 HB1 HIS 28 1.597 8.792 16.963 246 HD1 HIS 28 HD1 HIS 28 1.686 6.867 18.556 247 HD2 HIS 28 HD2 HIS 28 4.778 6.754 15.783 248 HE1 HIS 28 HE1 HIS 28 3.054 4.836 19.118 249 H ASP 29 HN ASP 29 -0.387 8.637 15.345 250 HA ASP 29 HA ASP 29 -1.116 5.940 15.193 251 1HB ASP 29 HB2 ASP 29 -3.468 6.711 15.077 252 2HB ASP 29 HB1 ASP 29 -2.578 7.471 16.387 253 H LYS 30 HN LYS 30 -1.099 8.442 12.802 254 HA LYS 30 HA LYS 30 -2.407 7.031 10.739 255 1HB LYS 30 HB2 LYS 30 -0.364 9.199 10.609 256 2HB LYS 30 HB1 LYS 30 -1.203 8.685 9.174 257 1HG LYS 30 HG2 LYS 30 -2.260 10.069 11.633 258 2HG LYS 30 HG1 LYS 30 -2.180 10.689 9.987 259 1HD LYS 30 HD2 LYS 30 -3.874 9.055 9.317 260 2HD LYS 30 HD1 LYS 30 -3.935 8.451 10.978 261 1HE LYS 30 HE2 LYS 30 -4.629 11.215 10.033 262 2HE LYS 30 HE1 LYS 30 -5.754 9.995 10.635 263 1HZ LYS 30 HZ1 LYS 30 -4.458 10.120 12.795 264 2HZ LYS 30 HZ3 LYS 30 -3.686 11.499 12.165 265 3HZ LYS 30 HZ2 LYS 30 -5.348 11.502 12.393 266 H VAL 31 HN VAL 31 1.078 7.416 11.449 267 HA VAL 31 HA VAL 31 2.072 5.875 9.376 268 HB VAL 31 HB VAL 31 3.238 6.224 12.167 269 1HG1 VAL 31 3HG1 VAL 31 4.305 4.404 10.968 270 2HG1 VAL 31 2HG1 VAL 31 4.596 5.471 9.594 271 3HG1 VAL 31 1HG1 VAL 31 5.396 5.779 11.135 272 1HG2 VAL 31 1HG2 VAL 31 2.786 8.365 11.105 273 2HG2 VAL 31 3HG2 VAL 31 4.521 8.064 11.202 274 3HG2 VAL 31 2HG2 VAL 31 3.671 7.854 9.670 275 H LEU 32 HN LEU 32 1.001 4.975 12.619 276 HA LEU 32 HA LEU 32 1.719 2.222 12.442 277 1HB LEU 32 HB2 LEU 32 -0.404 3.501 14.147 278 2HB LEU 32 HB1 LEU 32 0.279 1.903 14.372 279 HG LEU 32 HG LEU 32 1.674 4.541 14.723 280 1HD1 LEU 32 HD1 LEU 32 0.960 2.389 16.668 281 2HD1 LEU 32 HD1 LEU 32 1.911 3.835 17.022 282 3HD1 LEU 32 HD1 LEU 32 0.227 3.996 16.523 283 1HD2 LEU 32 HD2 LEU 32 2.817 1.753 14.922 284 2HD2 LEU 32 HD2 LEU 32 3.236 3.003 13.745 285 3HD2 LEU 32 HD2 LEU 32 3.630 3.233 15.448 286 H LEU 33 HN LEU 33 -1.348 3.873 11.869 287 HA LEU 33 HA LEU 33 -2.802 1.569 11.180 288 1HB LEU 33 HB2 LEU 33 -3.143 4.408 10.217 289 2HB LEU 33 HB1 LEU 33 -4.294 3.118 9.947 290 HG LEU 33 HG LEU 33 -3.515 4.140 12.684 291 1HD1 LEU 33 HD1 LEU 33 -5.934 4.791 11.002 292 2HD1 LEU 33 HD1 LEU 33 -5.682 5.275 12.682 293 3HD1 LEU 33 HD1 LEU 33 -4.620 5.895 11.419 294 1HD2 LEU 33 HD2 LEU 33 -4.360 1.835 12.653 295 2HD2 LEU 33 HD2 LEU 33 -5.506 2.937 13.415 296 3HD2 LEU 33 HD2 LEU 33 -5.790 2.375 11.770 297 H PHE 34 HN PHE 34 -0.989 3.845 9.179 298 HA PHE 34 HA PHE 34 -1.514 2.622 6.729 299 1HB PHE 34 HB2 PHE 34 -0.628 4.877 6.817 300 2HB PHE 34 HB1 PHE 34 0.844 4.311 7.593 301 HD1 PHE 34 HD1 PHE 34 2.693 3.707 6.307 302 HD2 PHE 34 HD2 PHE 34 -1.132 4.012 4.463 303 HE1 PHE 34 HE1 PHE 34 3.723 3.366 4.077 304 HE2 PHE 34 HE2 PHE 34 -0.090 3.675 2.260 305 HZ PHE 34 HZ PHE 34 2.344 3.342 2.098 306 H SER 35 HN SER 35 1.299 2.245 8.888 307 HA SER 35 HA SER 35 2.654 0.463 7.236 308 1HB SER 35 HB2 SER 35 3.954 -0.131 9.315 309 2HB SER 35 HB1 SER 35 3.877 1.588 8.928 310 HG SER 35 HG SER 35 2.490 1.924 10.516 311 H ARG 36 HN ARG 36 0.324 -0.211 9.822 312 HA ARG 36 HA ARG 36 0.793 -3.009 9.651 313 1HB ARG 36 HB2 ARG 36 -1.128 -3.293 11.099 314 2HB ARG 36 HB1 ARG 36 -0.058 -2.044 11.725 315 1HG ARG 36 HG2 ARG 36 -1.640 -0.375 10.703 316 2HG ARG 36 HG1 ARG 36 -2.724 -1.726 10.380 317 1HD ARG 36 HD2 ARG 36 -1.683 -0.873 13.069 318 2HD ARG 36 HD1 ARG 36 -3.306 -0.589 12.448 319 HE ARG 36 HE ARG 36 -2.649 -3.367 12.426 320 1HH1 ARG 36 1HH1 ARG 36 -3.721 -0.795 14.585 321 2HH1 ARG 36 2HH1 ARG 36 -4.540 -1.840 15.650 322 1HH2 ARG 36 1HH2 ARG 36 -3.763 -4.808 13.889 323 2HH2 ARG 36 2HH2 ARG 36 -4.567 -4.167 15.250 324 H ASP 37 HN ASP 37 -1.542 -0.842 8.126 325 HA ASP 37 HA ASP 37 -3.133 -2.932 7.014 326 1HB ASP 37 HB2 ASP 37 -3.759 -0.426 7.291 327 2HB ASP 37 HB1 ASP 37 -2.809 -0.174 5.842 328 H LEU 38 HN LEU 38 -0.458 -0.983 5.936 329 HA LEU 38 HA LEU 38 -0.120 -1.920 3.322 330 1HB LEU 38 HB2 LEU 38 0.971 0.061 4.033 331 2HB LEU 38 HB1 LEU 38 1.753 -0.759 5.361 332 HG LEU 38 HG LEU 38 3.213 -1.933 3.785 333 1HD1 LEU 38 HD1 LEU 38 1.820 -0.302 1.682 334 2HD1 LEU 38 HD1 LEU 38 3.275 -1.281 1.468 335 3HD1 LEU 38 HD1 LEU 38 1.749 -2.063 1.884 336 1HD2 LEU 38 HD2 LEU 38 3.118 1.045 3.423 337 2HD2 LEU 38 HD2 LEU 38 3.937 0.164 4.713 338 3HD2 LEU 38 HD2 LEU 38 4.499 0.013 3.049 339 H ASP 39 HN ASP 39 1.325 -2.969 6.363 340 HA ASP 39 HA ASP 39 3.010 -4.970 5.410 341 1HB ASP 39 HB2 ASP 39 2.993 -4.066 7.726 342 2HB ASP 39 HB1 ASP 39 1.487 -4.928 8.020 343 H LYS 40 HN LYS 40 -0.316 -5.182 6.578 344 HA LYS 40 HA LYS 40 -0.607 -7.911 5.991 345 1HB LYS 40 HB2 LYS 40 -2.577 -5.743 6.573 346 2HB LYS 40 HB1 LYS 40 -3.092 -7.370 6.143 347 1HG LYS 40 HG2 LYS 40 -1.864 -8.277 8.041 348 2HG LYS 40 HG1 LYS 40 -1.294 -6.660 8.457 349 1HD LYS 40 HD2 LYS 40 -3.510 -5.940 8.979 350 2HD LYS 40 HD1 LYS 40 -4.207 -7.429 8.343 351 1HE LYS 40 HE2 LYS 40 -4.150 -7.454 10.784 352 2HE LYS 40 HE1 LYS 40 -3.117 -8.708 10.110 353 1HZ LYS 40 HZ1 LYS 40 -1.198 -7.278 10.517 354 2HZ LYS 40 HZ3 LYS 40 -2.192 -6.100 11.215 355 3HZ LYS 40 HZ2 LYS 40 -2.019 -7.614 11.926 356 H LEU 41 HN LEU 41 -1.160 -5.065 4.025 357 HA LEU 41 HA LEU 41 -2.527 -6.367 1.915 358 1HB LEU 41 HB2 LEU 41 -2.466 -3.934 2.034 359 2HB LEU 41 HB1 LEU 41 -0.726 -3.946 1.888 360 HG LEU 41 HG LEU 41 -0.905 -4.766 -0.412 361 1HD1 LEU 41 HD1 LEU 41 -3.882 -4.590 0.029 362 2HD1 LEU 41 HD1 LEU 41 -3.094 -4.789 -1.535 363 3HD1 LEU 41 HD1 LEU 41 -2.927 -6.045 -0.316 364 1HD2 LEU 41 HD2 LEU 41 -0.816 -2.373 -0.002 365 2HD2 LEU 41 HD2 LEU 41 -1.820 -2.732 -1.407 366 3HD2 LEU 41 HD2 LEU 41 -2.575 -2.315 0.135 367 H ILE 42 HN ILE 42 0.828 -5.767 2.575 368 HA ILE 42 HA ILE 42 1.783 -6.954 0.195 369 HB ILE 42 HB ILE 42 3.209 -6.350 2.794 370 1HG1 ILE 42 2HG1 ILE 42 3.226 -5.043 0.090 371 2HG1 ILE 42 1HG1 ILE 42 2.330 -4.460 1.488 372 1HG2 ILE 42 3HG2 ILE 42 4.397 -7.251 0.153 373 2HG2 ILE 42 2HG2 ILE 42 5.314 -6.703 1.556 374 3HG2 ILE 42 1HG2 ILE 42 4.372 -8.191 1.644 375 1HD1 ILE 42 HD1 ILE 42 5.315 -4.693 1.282 376 2HD1 ILE 42 HD1 ILE 42 4.360 -3.209 1.104 377 3HD1 ILE 42 HD1 ILE 42 4.377 -4.070 2.638 378 H ASN 43 HN ASN 43 1.455 -8.163 3.482 379 HA ASN 43 HA ASN 43 2.479 -10.725 2.969 380 1HB ASN 43 HB2 ASN 43 0.515 -9.841 5.089 381 2HB ASN 43 HB1 ASN 43 1.056 -11.503 4.963 382 1HD2 ASN 43 HD2 ASN 43 3.017 -8.553 4.547 383 2HD2 ASN 43 HD2 ASN 43 4.052 -8.846 5.879 384 H LYS 44 HN LYS 44 -0.691 -9.402 2.477 385 HA LYS 44 HA LYS 44 -2.183 -11.678 1.855 386 1HB LYS 44 HB2 LYS 44 -3.054 -9.368 2.032 387 2HB LYS 44 HB1 LYS 44 -2.258 -8.967 0.525 388 1HG LYS 44 HG2 LYS 44 -3.683 -10.721 -0.601 389 2HG LYS 44 HG1 LYS 44 -4.560 -10.865 0.924 390 1HD LYS 44 HD2 LYS 44 -4.301 -8.365 -0.719 391 2HD LYS 44 HD1 LYS 44 -5.729 -9.390 -0.602 392 1HE LYS 44 HE2 LYS 44 -4.459 -7.787 1.626 393 2HE LYS 44 HE1 LYS 44 -5.975 -7.465 0.801 394 1HZ LYS 44 HZ2 LYS 44 -6.901 -9.475 1.715 395 2HZ LYS 44 HZ1 LYS 44 -5.440 -9.843 2.509 396 3HZ LYS 44 HZ3 LYS 44 -6.327 -8.476 2.933 397 H PHE 45 HN PHE 45 -0.193 -9.622 -0.229 398 HA PHE 45 HA PHE 45 -0.575 -11.346 -2.424 399 1HB PHE 45 HB2 PHE 45 1.061 -8.865 -2.056 400 2HB PHE 45 HB1 PHE 45 1.242 -9.847 -3.510 401 HD1 PHE 45 HD1 PHE 45 -1.078 -7.716 -1.601 402 HD2 PHE 45 HD2 PHE 45 -0.476 -9.978 -5.154 403 HE1 PHE 45 HE1 PHE 45 -3.076 -6.684 -2.596 404 HE2 PHE 45 HE2 PHE 45 -2.468 -8.941 -6.155 405 HZ PHE 45 HZ PHE 45 -3.772 -7.296 -4.874 406 H MET 46 HN MET 46 1.605 -11.228 0.156 407 HA MET 46 HA MET 46 3.660 -12.870 -1.043 408 1HB MET 46 HB2 MET 46 3.135 -12.407 1.898 409 2HB MET 46 HB1 MET 46 4.576 -13.122 1.201 410 1HG MET 46 HG2 MET 46 4.851 -10.851 -0.025 411 2HG MET 46 HG1 MET 46 3.640 -10.287 1.095 412 1HE MET 46 HE1 MET 46 7.157 -11.752 0.672 413 2HE MET 46 HE3 MET 46 7.741 -11.911 2.331 414 3HE MET 46 HE2 MET 46 6.425 -12.936 1.750 415 H ASN 47 HN ASN 47 0.713 -13.461 -0.527 416 HA ASN 47 HA ASN 47 -0.536 -15.264 -0.905 417 1HB ASN 47 HB2 ASN 47 1.654 -16.308 -1.825 418 2HB ASN 47 HB1 ASN 47 1.713 -17.185 -0.305 419 1HD2 ASN 47 HD2 ASN 47 0.029 -16.746 -3.287 420 2HD2 ASN 47 HD2 ASN 47 -0.872 -18.220 -3.258 421 H VAL 48 HN VAL 48 0.291 -14.097 1.782 422 HA VAL 48 HA VAL 48 -0.724 -16.149 3.571 423 HB VAL 48 HB VAL 48 -0.441 -13.178 4.060 424 1HG1 VAL 48 3HG1 VAL 48 -1.957 -14.261 5.631 425 2HG1 VAL 48 2HG1 VAL 48 -0.731 -15.470 6.010 426 3HG1 VAL 48 1HG1 VAL 48 -0.475 -13.785 6.460 427 1HG2 VAL 48 2HG2 VAL 48 1.739 -14.127 3.536 428 2HG2 VAL 48 1HG2 VAL 48 1.660 -13.693 5.248 429 3HG2 VAL 48 3HG2 VAL 48 1.483 -15.377 4.758 430 H LYS 49 HN LYS 49 -2.676 -16.642 3.412 431 HA LYS 49 HA LYS 49 -4.395 -14.760 2.088 432 1HB LYS 49 HB2 LYS 49 -4.729 -17.713 2.451 433 2HB LYS 49 HB1 LYS 49 -5.879 -16.671 1.628 434 1HG LYS 49 HG2 LYS 49 -4.240 -16.104 -0.042 435 2HG LYS 49 HG1 LYS 49 -2.998 -17.020 0.814 436 1HD LYS 49 HD2 LYS 49 -4.305 -19.070 0.466 437 2HD LYS 49 HD1 LYS 49 -5.514 -18.136 -0.416 438 1HE LYS 49 HE2 LYS 49 -2.613 -18.414 -1.203 439 2HE LYS 49 HE1 LYS 49 -3.939 -19.332 -1.902 440 1HZ LYS 49 HZ2 LYS 49 -4.901 -17.265 -2.716 441 2HZ LYS 49 HZ1 LYS 49 -3.624 -16.363 -2.066 442 3HZ LYS 49 HZ3 LYS 49 -3.366 -17.481 -3.304 443 H ASP 50 HN ASP 50 -5.011 -13.423 3.698 444 HA ASP 50 HA ASP 50 -6.977 -14.564 5.510 445 1HB ASP 50 HB2 ASP 50 -5.846 -11.732 5.400 446 2HB ASP 50 HB1 ASP 50 -7.183 -12.208 6.431 447 H LYS 51 HN LYS 51 -8.258 -15.135 3.773 448 HA LYS 51 HA LYS 51 -9.243 -12.933 2.151 449 1HB LYS 51 HB2 LYS 51 -9.986 -14.642 0.538 450 2HB LYS 51 HB1 LYS 51 -8.264 -14.698 0.844 451 1HG LYS 51 HG2 LYS 51 -8.739 -16.575 2.457 452 2HG LYS 51 HG1 LYS 51 -10.375 -16.595 1.793 453 1HD LYS 51 HD2 LYS 51 -7.817 -16.992 0.228 454 2HD LYS 51 HD1 LYS 51 -8.937 -18.256 0.718 455 1HE LYS 51 HE2 LYS 51 -9.642 -15.956 -1.118 456 2HE LYS 51 HE1 LYS 51 -9.159 -17.553 -1.665 457 1HZ LYS 51 HZ1 LYS 51 -11.103 -18.446 -0.452 458 2HZ LYS 51 HZ3 LYS 51 -11.617 -16.866 -0.125 459 3HZ LYS 51 HZ2 LYS 51 -11.494 -17.419 -1.712 460 H VAL 52 HN VAL 52 -10.004 -13.669 4.838 461 HA VAL 52 HA VAL 52 -12.876 -14.085 4.506 462 HB VAL 52 HB VAL 52 -12.948 -14.154 7.002 463 1HG1 VAL 52 2HG1 VAL 52 -10.984 -16.031 5.710 464 2HG1 VAL 52 1HG1 VAL 52 -11.809 -16.318 7.246 465 3HG1 VAL 52 3HG1 VAL 52 -12.737 -16.210 5.750 466 1HG2 VAL 52 3HG2 VAL 52 -11.006 -12.740 7.465 467 2HG2 VAL 52 2HG2 VAL 52 -10.845 -14.304 8.264 468 3HG2 VAL 52 1HG2 VAL 52 -9.939 -13.970 6.787 469 H HIS 53 HN HIS 53 -10.922 -11.679 4.097 470 HA HIS 53 HA HIS 53 -12.360 -9.635 5.561 471 1HB HIS 53 HB2 HIS 53 -10.049 -9.481 3.589 472 2HB HIS 53 HB1 HIS 53 -10.821 -8.054 4.270 473 HD1 HIS 53 HD1 HIS 53 -8.944 -7.170 5.789 474 HD2 HIS 53 HD2 HIS 53 -9.671 -11.235 6.302 475 HE1 HIS 53 HE1 HIS 53 -7.608 -7.880 7.788 476 H LYS 54 HN LYS 54 -14.297 -9.332 4.847 477 HA LYS 54 HA LYS 54 -16.091 -9.068 3.593 478 1HB LYS 54 HB2 LYS 54 -14.121 -8.259 1.458 479 2HB LYS 54 HB1 LYS 54 -15.856 -8.275 1.177 480 1HG LYS 54 HG2 LYS 54 -14.506 -6.716 3.340 481 2HG LYS 54 HG1 LYS 54 -14.911 -6.047 1.748 482 1HD LYS 54 HD2 LYS 54 -17.291 -6.631 2.203 483 2HD LYS 54 HD1 LYS 54 -16.816 -7.140 3.820 484 1HE LYS 54 HE2 LYS 54 -16.019 -4.902 4.316 485 2HE LYS 54 HE1 LYS 54 -16.426 -4.381 2.682 486 1HZ LYS 54 HZ2 LYS 54 -18.751 -4.844 3.160 487 2HZ LYS 54 HZ1 LYS 54 -18.369 -5.328 4.728 488 3HZ LYS 54 HZ3 LYS 54 -18.122 -3.740 4.250 489 H LEU 55 HN LEU 55 -16.498 -11.111 3.920 490 HA LEU 55 HA LEU 55 -15.987 -12.878 1.662 491 1HB LEU 55 HB2 LEU 55 -16.677 -14.786 3.061 492 2HB LEU 55 HB1 LEU 55 -15.329 -13.932 3.758 493 HG LEU 55 HG LEU 55 -18.167 -13.567 4.752 494 1HD1 LEU 55 HD1 LEU 55 -16.038 -15.477 5.723 495 2HD1 LEU 55 HD1 LEU 55 -17.585 -15.173 6.511 496 3HD1 LEU 55 HD1 LEU 55 -17.541 -15.929 4.919 497 1HD2 LEU 55 HD2 LEU 55 -15.464 -13.074 6.008 498 2HD2 LEU 55 HD2 LEU 55 -16.571 -11.824 5.453 499 3HD2 LEU 55 HD2 LEU 55 -17.011 -12.860 6.812 500 H GLU 56 HN GLU 56 -17.993 -14.525 1.529 501 HA GLU 56 HA GLU 56 -20.003 -14.819 0.636 502 1HB GLU 56 HB2 GLU 56 -20.997 -13.806 2.684 503 2HB GLU 56 HB1 GLU 56 -20.819 -12.208 1.972 504 1HG GLU 56 HG2 GLU 56 -23.115 -13.031 1.811 505 2HG GLU 56 HG1 GLU 56 -22.390 -12.791 0.220 506 H HIS 57 HN HIS 57 -19.846 -14.773 -1.426 507 HA HIS 57 HA HIS 57 -19.094 -12.270 -2.726 508 1HB HIS 57 HB2 HIS 57 -18.903 -15.118 -3.745 509 2HB HIS 57 HB1 HIS 57 -18.338 -13.681 -4.591 510 HD1 HIS 57 HD1 HIS 57 -16.067 -12.672 -3.793 511 HD2 HIS 57 HD2 HIS 57 -17.312 -15.965 -1.587 512 HE1 HIS 57 HE1 HIS 57 -14.098 -13.355 -2.384 513 H HIS 58 HN HIS 58 -21.828 -14.028 -2.121 514 HA HIS 58 HA HIS 58 -23.069 -13.813 -4.717 515 1HB HIS 58 HB2 HIS 58 -23.663 -15.595 -3.000 516 2HB HIS 58 HB1 HIS 58 -24.402 -14.327 -2.034 517 HD1 HIS 58 HD1 HIS 58 -25.204 -16.777 -4.614 518 HD2 HIS 58 HD2 HIS 58 -26.658 -13.043 -3.484 519 HE1 HIS 58 HE1 HIS 58 -27.485 -16.575 -5.638 520 H HIS 59 HN HIS 59 -24.139 -12.084 -5.465 521 HA HIS 59 HA HIS 59 -24.226 -9.820 -3.715 522 1HB HIS 59 HB2 HIS 59 -24.931 -8.509 -5.780 523 2HB HIS 59 HB1 HIS 59 -23.317 -9.176 -5.801 524 HD1 HIS 59 HD1 HIS 59 -22.714 -10.509 -7.874 525 HD2 HIS 59 HD2 HIS 59 -26.819 -9.957 -7.457 526 HE1 HIS 59 HE1 HIS 59 -23.756 -11.343 -10.006 527 H HIS 60 HN HIS 60 -25.691 -10.300 -2.307 528 HA HIS 60 HA HIS 60 -28.455 -10.679 -3.207 529 1HB HIS 60 HB2 HIS 60 -27.591 -12.313 -1.570 530 2HB HIS 60 HB1 HIS 60 -27.207 -11.013 -0.459 531 HD1 HIS 60 HD1 HIS 60 -28.892 -10.953 1.419 532 HD2 HIS 60 HD2 HIS 60 -30.598 -12.123 -2.193 533 HE1 HIS 60 HE1 HIS 60 -31.299 -11.400 1.902 534 H HIS 61 HN HIS 61 -26.785 -8.903 -0.638 535 HA HIS 61 HA HIS 61 -28.799 -6.782 -0.815 536 1HB HIS 61 HB2 HIS 61 -28.358 -7.770 1.414 537 2HB HIS 61 HB1 HIS 61 -26.663 -7.323 1.277 538 HD1 HIS 61 HD1 HIS 61 -26.067 -5.103 2.306 539 HD2 HIS 61 HD2 HIS 61 -30.122 -5.424 1.447 540 HE1 HIS 61 HE1 HIS 61 -27.146 -3.030 3.238 541 H HIS 62 HN HIS 62 -25.436 -7.516 -1.259 542 HA HIS 62 HA HIS 62 -24.977 -4.854 -2.337 543 1HB HIS 62 HB2 HIS 62 -23.657 -5.208 -0.273 544 2HB HIS 62 HB1 HIS 62 -23.033 -6.716 -0.922 545 HD1 HIS 62 HD1 HIS 62 -22.801 -2.952 -1.545 546 HD2 HIS 62 HD2 HIS 62 -20.771 -6.471 -2.408 547 HE1 HIS 62 HE1 HIS 62 -20.617 -2.259 -2.565 548 H1 MET 101 HT2 MET 101 8.476 24.018 2.357 549 H2 MET 101 HT1 MET 101 7.010 23.558 2.991 550 H3 MET 101 HT3 MET 101 8.345 23.716 4.017 551 HA MET 101 HA MET 101 9.431 21.908 2.821 552 1HB MET 101 HB2 MET 101 6.647 21.228 3.816 553 2HB MET 101 HB1 MET 101 7.903 20.051 3.493 554 1HG MET 101 HG2 MET 101 8.063 22.244 5.541 555 2HG MET 101 HG1 MET 101 7.668 20.559 5.874 556 1HE MET 101 HE3 MET 101 9.386 18.549 5.604 557 2HE MET 101 HE2 MET 101 9.694 18.997 3.924 558 3HE MET 101 HE1 MET 101 11.043 18.745 5.027 559 H GLU 102 HN GLU 102 9.527 20.643 1.000 560 HA GLU 102 HA GLU 102 7.534 21.295 -0.979 561 1HB GLU 102 HB2 GLU 102 9.051 20.290 -2.613 562 2HB GLU 102 HB1 GLU 102 9.840 21.540 -1.681 563 1HG GLU 102 HG2 GLU 102 11.441 19.841 -1.950 564 2HG GLU 102 HG1 GLU 102 10.866 19.654 -0.301 565 H MET 103 HN MET 103 6.308 19.751 -2.086 566 HA MET 103 HA MET 103 6.480 17.099 -0.908 567 1HB MET 103 HB2 MET 103 4.039 16.790 -1.173 568 2HB MET 103 HB1 MET 103 4.490 18.029 -0.026 569 1HG MET 103 HG2 MET 103 2.657 18.765 -1.167 570 2HG MET 103 HG1 MET 103 3.998 19.731 -1.767 571 1HE MET 103 HE3 MET 103 1.327 16.979 -2.561 572 2HE MET 103 HE2 MET 103 1.797 16.413 -4.162 573 3HE MET 103 HE1 MET 103 2.810 16.047 -2.764 574 H GLY 104 HN GLY 104 7.040 18.699 -3.598 575 1HA GLY 104 HA1 GLY 104 6.975 18.263 -5.879 576 2HA GLY 104 HA2 GLY 104 5.743 17.055 -5.555 577 H GLN 105 HN GLN 105 9.032 17.304 -4.262 578 HA GLN 105 HA GLN 105 9.893 15.100 -5.913 579 1HB GLN 105 HB2 GLN 105 11.281 16.675 -3.748 580 2HB GLN 105 HB1 GLN 105 12.062 15.430 -4.717 581 1HG GLN 105 HG2 GLN 105 10.878 18.001 -5.762 582 2HG GLN 105 HG1 GLN 105 12.592 17.700 -5.495 583 1HE2 GLN 105 1HE2 GLN 105 12.483 14.960 -6.535 584 2HE2 GLN 105 2HE2 GLN 105 12.328 15.126 -8.238 585 H LEU 106 HN LEU 106 8.927 15.862 -2.684 586 HA LEU 106 HA LEU 106 9.516 13.500 -1.372 587 1HB LEU 106 HB2 LEU 106 8.628 15.546 -0.280 588 2HB LEU 106 HB1 LEU 106 7.090 15.259 -1.055 589 HG LEU 106 HG LEU 106 7.288 14.747 1.445 590 1HD1 LEU 106 HD1 LEU 106 6.217 12.634 -0.394 591 2HD1 LEU 106 HD1 LEU 106 5.809 12.818 1.311 592 3HD1 LEU 106 HD1 LEU 106 5.373 14.081 0.157 593 1HD2 LEU 106 HD2 LEU 106 8.666 12.288 0.369 594 2HD2 LEU 106 HD2 LEU 106 9.391 13.515 1.406 595 3HD2 LEU 106 HD2 LEU 106 8.089 12.497 2.018 596 H LYS 107 HN LYS 107 6.581 14.232 -3.286 597 HA LYS 107 HA LYS 107 5.443 11.687 -3.066 598 1HB LYS 107 HB2 LYS 107 4.974 14.045 -4.676 599 2HB LYS 107 HB1 LYS 107 4.717 12.580 -5.610 600 1HG LYS 107 HG2 LYS 107 3.453 13.140 -2.937 601 2HG LYS 107 HG1 LYS 107 2.682 13.466 -4.481 602 1HD LYS 107 HD2 LYS 107 3.721 10.718 -3.864 603 2HD LYS 107 HD1 LYS 107 2.119 11.207 -3.278 604 1HE LYS 107 HE2 LYS 107 1.562 11.726 -5.671 605 2HE LYS 107 HE1 LYS 107 3.121 11.041 -6.125 606 1HZ LYS 107 HZ2 LYS 107 0.959 9.511 -4.713 607 2HZ LYS 107 HZ1 LYS 107 1.284 9.490 -6.361 608 3HZ LYS 107 HZ3 LYS 107 2.422 8.883 -5.302 609 H ASN 108 HN ASN 108 7.814 12.933 -5.302 610 HA ASN 108 HA ASN 108 7.845 10.754 -7.088 611 1HB ASN 108 HB2 ASN 108 8.893 12.960 -7.567 612 2HB ASN 108 HB1 ASN 108 10.136 12.608 -6.376 613 1HD2 ASN 108 HD2 ASN 108 11.834 12.619 -7.719 614 2HD2 ASN 108 HD2 ASN 108 12.104 11.507 -9.002 615 H LYS 109 HN LYS 109 9.706 11.468 -4.169 616 HA LYS 109 HA LYS 109 11.415 9.227 -4.115 617 1HB LYS 109 HB2 LYS 109 10.205 10.723 -1.776 618 2HB LYS 109 HB1 LYS 109 11.597 9.652 -1.700 619 1HG LYS 109 HG2 LYS 109 12.927 11.153 -2.956 620 2HG LYS 109 HG1 LYS 109 11.525 12.122 -3.400 621 1HD LYS 109 HD2 LYS 109 11.238 12.650 -0.952 622 2HD LYS 109 HD1 LYS 109 12.778 11.844 -0.674 623 1HE LYS 109 HE2 LYS 109 13.947 13.394 -2.030 624 2HE LYS 109 HE1 LYS 109 12.446 14.111 -2.619 625 1HZ LYS 109 HZ2 LYS 109 13.443 14.230 0.176 626 2HZ LYS 109 HZ1 LYS 109 13.533 15.469 -0.965 627 3HZ LYS 109 HZ3 LYS 109 12.035 14.961 -0.397 628 H ILE 110 HN ILE 110 8.216 9.779 -2.729 629 HA ILE 110 HA ILE 110 7.859 7.283 -1.537 630 HB ILE 110 HB ILE 110 5.839 9.268 -2.602 631 1HG1 ILE 110 2HG1 ILE 110 6.715 8.537 0.195 632 2HG1 ILE 110 1HG1 ILE 110 7.148 10.003 -0.676 633 1HG2 ILE 110 2HG2 ILE 110 4.789 7.066 -2.686 634 2HG2 ILE 110 1HG2 ILE 110 5.247 6.777 -1.006 635 3HG2 ILE 110 3HG2 ILE 110 4.089 8.048 -1.396 636 1HD1 ILE 110 HD1 ILE 110 4.805 10.681 -0.654 637 2HD1 ILE 110 HD1 ILE 110 4.391 9.213 0.229 638 3HD1 ILE 110 HD1 ILE 110 5.431 10.424 0.976 639 H GLU 111 HN GLU 111 6.833 8.407 -4.736 640 HA GLU 111 HA GLU 111 5.742 6.019 -5.725 641 1HB GLU 111 HB2 GLU 111 7.249 8.181 -7.198 642 2HB GLU 111 HB1 GLU 111 6.275 6.931 -7.960 643 1HG GLU 111 HG2 GLU 111 5.249 9.007 -6.043 644 2HG GLU 111 HG1 GLU 111 5.108 9.104 -7.792 645 H ASN 112 HN ASN 112 9.036 7.225 -6.023 646 HA ASN 112 HA ASN 112 10.057 5.042 -7.422 647 1HB ASN 112 HB2 ASN 112 11.295 7.074 -7.403 648 2HB ASN 112 HB1 ASN 112 11.410 7.064 -5.647 649 1HD2 ASN 112 HD2 ASN 112 13.013 5.954 -4.691 650 2HD2 ASN 112 HD2 ASN 112 14.218 5.053 -5.507 651 H LYS 113 HN LYS 113 10.023 5.634 -3.926 652 HA LYS 113 HA LYS 113 11.509 3.317 -3.282 653 1HB LYS 113 HB2 LYS 113 11.126 5.398 -1.840 654 2HB LYS 113 HB1 LYS 113 9.551 4.729 -1.484 655 1HG LYS 113 HG2 LYS 113 11.144 4.263 0.306 656 2HG LYS 113 HG1 LYS 113 10.564 2.779 -0.453 657 1HD LYS 113 HD2 LYS 113 12.962 2.681 -0.043 658 2HD LYS 113 HD1 LYS 113 12.632 2.633 -1.769 659 1HE LYS 113 HE2 LYS 113 14.491 4.052 -1.440 660 2HE LYS 113 HE1 LYS 113 13.130 5.110 -1.792 661 1HZ LYS 113 HZ3 LYS 113 12.945 5.489 0.658 662 2HZ LYS 113 HZ2 LYS 113 14.371 4.543 0.829 663 3HZ LYS 113 HZ1 LYS 113 14.414 5.973 -0.021 664 H LYS 114 HN LYS 114 8.093 4.034 -3.490 665 HA LYS 114 HA LYS 114 6.889 1.697 -2.595 666 1HB LYS 114 HB2 LYS 114 5.733 3.794 -3.205 667 2HB LYS 114 HB1 LYS 114 6.158 3.533 -4.880 668 1HG LYS 114 HG2 LYS 114 4.707 1.551 -4.919 669 2HG LYS 114 HG1 LYS 114 4.260 1.850 -3.239 670 1HD LYS 114 HD2 LYS 114 2.511 2.798 -4.595 671 2HD LYS 114 HD1 LYS 114 3.470 4.141 -3.975 672 1HE LYS 114 HE2 LYS 114 4.736 4.145 -6.134 673 2HE LYS 114 HE1 LYS 114 3.604 2.911 -6.690 674 1HZ LYS 114 HZ3 LYS 114 1.772 4.581 -6.478 675 2HZ LYS 114 HZ2 LYS 114 2.916 5.724 -5.953 676 3HZ LYS 114 HZ1 LYS 114 3.024 5.106 -7.461 677 H LYS 115 HN LYS 115 8.007 2.610 -5.770 678 HA LYS 115 HA LYS 115 7.372 0.203 -7.113 679 1HB LYS 115 HB2 LYS 115 9.327 2.366 -7.865 680 2HB LYS 115 HB1 LYS 115 8.811 1.063 -8.930 681 1HG LYS 115 HG2 LYS 115 6.532 1.859 -8.873 682 2HG LYS 115 HG1 LYS 115 6.961 3.088 -7.689 683 1HD LYS 115 HD2 LYS 115 6.815 4.152 -9.797 684 2HD LYS 115 HD1 LYS 115 8.513 4.062 -9.366 685 1HE LYS 115 HE2 LYS 115 8.816 2.099 -10.794 686 2HE LYS 115 HE1 LYS 115 7.113 2.148 -11.243 687 1HZ LYS 115 HZ2 LYS 115 7.527 4.382 -12.149 688 2HZ LYS 115 HZ1 LYS 115 9.163 4.201 -11.839 689 3HZ LYS 115 HZ3 LYS 115 8.391 3.186 -12.957 690 H GLU 116 HN GLU 116 10.365 1.318 -5.608 691 HA GLU 116 HA GLU 116 11.970 -0.859 -6.333 692 1HB GLU 116 HB2 GLU 116 12.001 0.836 -3.839 693 2HB GLU 116 HB1 GLU 116 13.181 -0.431 -4.126 694 1HG GLU 116 HG2 GLU 116 13.881 0.786 -6.178 695 2HG GLU 116 HG1 GLU 116 12.769 2.080 -5.730 696 H LEU 117 HN LEU 117 9.673 -0.442 -3.721 697 HA LEU 117 HA LEU 117 10.153 -2.896 -2.395 698 1HB LEU 117 HB2 LEU 117 9.032 -1.239 -1.203 699 2HB LEU 117 HB1 LEU 117 7.802 -1.039 -2.453 700 HG LEU 117 HG LEU 117 7.343 -3.575 -1.863 701 1HD1 LEU 117 HD1 LEU 117 8.654 -2.753 0.587 702 2HD1 LEU 117 HD1 LEU 117 7.545 -4.119 0.371 703 3HD1 LEU 117 HD1 LEU 117 9.043 -4.054 -0.554 704 1HD2 LEU 117 HD2 LEU 117 5.810 -1.795 -1.747 705 2HD2 LEU 117 HD2 LEU 117 5.669 -2.968 -0.424 706 3HD2 LEU 117 HD2 LEU 117 6.384 -1.359 -0.113 707 H ILE 118 HN ILE 118 7.755 -1.854 -4.760 708 HA ILE 118 HA ILE 118 6.289 -4.188 -4.971 709 HB ILE 118 HB ILE 118 6.953 -2.245 -7.222 710 1HG1 ILE 118 2HG1 ILE 118 4.492 -2.361 -5.471 711 2HG1 ILE 118 1HG1 ILE 118 5.862 -1.308 -5.149 712 1HG2 ILE 118 3HG2 ILE 118 4.700 -4.284 -7.031 713 2HG2 ILE 118 2HG2 ILE 118 4.888 -3.094 -8.307 714 3HG2 ILE 118 1HG2 ILE 118 6.082 -4.371 -8.115 715 1HD1 ILE 118 HD1 ILE 118 4.125 -1.245 -7.600 716 2HD1 ILE 118 HD1 ILE 118 4.072 -0.115 -6.241 717 3HD1 ILE 118 HD1 ILE 118 5.501 -0.194 -7.274 718 H GLN 119 HN GLN 119 9.249 -3.251 -6.578 719 HA GLN 119 HA GLN 119 9.622 -5.480 -8.167 720 1HB GLN 119 HB2 GLN 119 11.621 -3.720 -6.793 721 2HB GLN 119 HB1 GLN 119 12.072 -4.978 -7.938 722 1HG GLN 119 HG2 GLN 119 10.780 -3.859 -9.676 723 2HG GLN 119 HG1 GLN 119 10.282 -2.637 -8.515 724 1HE2 GLN 119 1HE2 GLN 119 11.213 -1.033 -9.806 725 2HE2 GLN 119 2HE2 GLN 119 12.921 -0.784 -9.828 726 H LEU 120 HN LEU 120 10.465 -5.078 -4.698 727 HA LEU 120 HA LEU 120 11.669 -7.658 -4.558 728 1HB LEU 120 HB2 LEU 120 10.651 -5.910 -2.297 729 2HB LEU 120 HB1 LEU 120 11.350 -7.492 -2.062 730 HG LEU 120 HG LEU 120 13.070 -6.221 -1.516 731 1HD1 LEU 120 HD1 LEU 120 13.528 -6.519 -4.432 732 2HD1 LEU 120 HD1 LEU 120 14.767 -6.125 -3.241 733 3HD1 LEU 120 HD1 LEU 120 13.908 -7.663 -3.142 734 1HD2 LEU 120 HD2 LEU 120 12.284 -4.161 -3.560 735 2HD2 LEU 120 HD2 LEU 120 12.192 -4.048 -1.796 736 3HD2 LEU 120 HD2 LEU 120 13.756 -4.095 -2.593 737 H VAL 121 HN VAL 121 8.425 -6.413 -3.615 738 HA VAL 121 HA VAL 121 7.477 -8.885 -2.670 739 HB VAL 121 HB VAL 121 5.779 -6.750 -3.986 740 1HG1 VAL 121 1HG1 VAL 121 4.609 -8.811 -3.463 741 2HG1 VAL 121 3HG1 VAL 121 5.178 -8.706 -1.791 742 3HG1 VAL 121 2HG1 VAL 121 4.074 -7.478 -2.414 743 1HG2 VAL 121 3HG2 VAL 121 6.780 -6.852 -1.151 744 2HG2 VAL 121 2HG2 VAL 121 7.246 -5.687 -2.398 745 3HG2 VAL 121 1HG2 VAL 121 5.591 -5.704 -1.784 746 H ALA 122 HN ALA 122 7.576 -7.531 -5.900 747 HA ALA 122 HA ALA 122 5.927 -9.420 -7.153 748 1HB ALA 122 HB2 ALA 122 8.133 -7.766 -8.347 749 2HB ALA 122 HB1 ALA 122 6.829 -8.560 -9.246 750 3HB ALA 122 HB3 ALA 122 6.466 -7.249 -8.119 751 H ARG 123 HN ARG 123 9.455 -9.257 -6.742 752 HA ARG 123 HA ARG 123 9.856 -11.659 -8.243 753 1HB ARG 123 HB2 ARG 123 12.205 -11.462 -7.703 754 2HB ARG 123 HB1 ARG 123 11.581 -9.893 -8.172 755 1HG ARG 123 HG2 ARG 123 11.440 -9.281 -5.795 756 2HG ARG 123 HG1 ARG 123 12.174 -10.826 -5.371 757 1HD ARG 123 HD2 ARG 123 13.420 -8.655 -7.070 758 2HD ARG 123 HD1 ARG 123 13.863 -9.066 -5.414 759 HE ARG 123 HE ARG 123 14.127 -11.375 -6.885 760 1HH1 ARG 123 1HH1 ARG 123 15.616 -8.168 -6.848 761 2HH1 ARG 123 2HH1 ARG 123 17.103 -8.662 -7.494 762 1HH2 ARG 123 1HH2 ARG 123 16.171 -12.088 -7.797 763 2HH2 ARG 123 2HH2 ARG 123 17.433 -10.972 -8.053 764 H HIS 124 HN HIS 124 8.749 -11.108 -5.198 765 HA HIS 124 HA HIS 124 9.712 -13.415 -3.858 766 1HB HIS 124 HB2 HIS 124 8.639 -11.707 -2.529 767 2HB HIS 124 HB1 HIS 124 7.179 -11.775 -3.510 768 HD1 HIS 124 HD1 HIS 124 5.377 -13.399 -2.745 769 HD2 HIS 124 HD2 HIS 124 9.026 -14.027 -0.861 770 HE1 HIS 124 HE1 HIS 124 4.962 -15.151 -0.990 771 H GLY 125 HN GLY 125 7.061 -12.759 -6.044 772 1HA GLY 125 HA1 GLY 125 6.123 -15.505 -5.848 773 2HA GLY 125 HA2 GLY 125 6.854 -15.045 -7.373 774 H LEU 126 HN LEU 126 5.820 -12.343 -7.469 775 HA LEU 126 HA LEU 126 2.979 -12.926 -7.593 776 1HB LEU 126 HB2 LEU 126 4.399 -10.322 -7.958 777 2HB LEU 126 HB1 LEU 126 2.681 -10.508 -8.107 778 HG LEU 126 HG LEU 126 4.380 -10.873 -5.796 779 1HD1 LEU 126 HD1 LEU 126 2.105 -8.946 -6.322 780 2HD1 LEU 126 HD1 LEU 126 2.925 -9.060 -4.768 781 3HD1 LEU 126 HD1 LEU 126 3.819 -8.539 -6.198 782 1HD2 LEU 126 HD2 LEU 126 2.792 -12.616 -5.595 783 2HD2 LEU 126 HD2 LEU 126 2.420 -11.399 -4.401 784 3HD2 LEU 126 HD2 LEU 126 1.430 -11.526 -5.839 785 H ASP 127 HN ASP 127 2.186 -13.523 -9.178 786 HA ASP 127 HA ASP 127 3.581 -13.702 -11.699 787 1HB ASP 127 HB2 ASP 127 0.943 -14.669 -10.802 788 2HB ASP 127 HB1 ASP 127 1.423 -14.763 -12.476 789 H HIS 128 HN HIS 128 3.583 -11.341 -11.740 790 HA HIS 128 HA HIS 128 3.201 -9.455 -12.830 791 1HB HIS 128 HB2 HIS 128 1.814 -11.251 -14.810 792 2HB HIS 128 HB1 HIS 128 2.246 -9.574 -15.131 793 HD1 HIS 128 HD1 HIS 128 4.980 -9.082 -14.897 794 HD2 HIS 128 HD2 HIS 128 3.749 -13.031 -15.312 795 HE1 HIS 128 HE1 HIS 128 7.014 -10.384 -15.544 796 H ASP 129 HN ASP 129 0.076 -11.117 -12.982 797 HA ASP 129 HA ASP 129 -1.470 -8.706 -13.078 798 1HB ASP 129 HB2 ASP 129 -2.305 -10.904 -13.893 799 2HB ASP 129 HB1 ASP 129 -2.246 -11.509 -12.243 800 H LYS 130 HN LYS 130 -0.308 -10.897 -10.719 801 HA LYS 130 HA LYS 130 -1.487 -9.847 -8.397 802 1HB LYS 130 HB2 LYS 130 1.113 -11.284 -8.863 803 2HB LYS 130 HB1 LYS 130 0.624 -10.773 -7.281 804 1HG LYS 130 HG2 LYS 130 -1.023 -12.590 -9.043 805 2HG LYS 130 HG1 LYS 130 0.145 -13.169 -7.856 806 1HD LYS 130 HD2 LYS 130 -1.124 -11.991 -6.085 807 2HD LYS 130 HD1 LYS 130 -2.319 -11.505 -7.284 808 1HE LYS 130 HE2 LYS 130 -1.626 -14.355 -6.528 809 2HE LYS 130 HE1 LYS 130 -3.043 -13.465 -5.984 810 1HZ LYS 130 HZ1 LYS 130 -3.793 -13.353 -8.290 811 2HZ LYS 130 HZ3 LYS 130 -2.442 -14.207 -8.804 812 3HZ LYS 130 HZ2 LYS 130 -3.575 -14.946 -7.833 813 H VAL 131 HN VAL 131 1.519 -8.953 -10.115 814 HA VAL 131 HA VAL 131 2.507 -7.088 -8.265 815 HB VAL 131 HB VAL 131 2.875 -7.108 -11.279 816 1HG1 VAL 131 3HG1 VAL 131 3.675 -5.061 -10.265 817 2HG1 VAL 131 2HG1 VAL 131 4.640 -5.983 -9.115 818 3HG1 VAL 131 1HG1 VAL 131 5.034 -6.030 -10.829 819 1HG2 VAL 131 3HG2 VAL 131 3.406 -9.303 -10.367 820 2HG2 VAL 131 2HG2 VAL 131 4.867 -8.483 -10.912 821 3HG2 VAL 131 1HG2 VAL 131 4.485 -8.560 -9.190 822 H LEU 132 HN LEU 132 0.496 -6.837 -11.142 823 HA LEU 132 HA LEU 132 0.130 -4.057 -11.210 824 1HB LEU 132 HB2 LEU 132 -1.782 -6.212 -12.072 825 2HB LEU 132 HB1 LEU 132 -1.862 -4.525 -12.537 826 HG LEU 132 HG LEU 132 0.307 -6.484 -13.295 827 1HD1 LEU 132 HD1 LEU 132 -1.848 -5.166 -14.901 828 2HD1 LEU 132 HD1 LEU 132 -0.562 -6.188 -15.551 829 3HD1 LEU 132 HD1 LEU 132 -1.770 -6.870 -14.453 830 1HD2 LEU 132 HD2 LEU 132 -0.029 -3.572 -14.026 831 2HD2 LEU 132 HD2 LEU 132 1.253 -4.263 -13.026 832 3HD2 LEU 132 HD2 LEU 132 1.152 -4.676 -14.734 833 H LEU 133 HN LEU 133 -2.025 -6.518 -9.862 834 HA LEU 133 HA LEU 133 -3.858 -4.698 -8.784 835 1HB LEU 133 HB2 LEU 133 -3.197 -7.487 -7.892 836 2HB LEU 133 HB1 LEU 133 -4.622 -6.583 -7.409 837 HG LEU 133 HG LEU 133 -3.971 -7.401 -10.235 838 1HD1 LEU 133 HD1 LEU 133 -5.956 -8.506 -8.278 839 2HD1 LEU 133 HD1 LEU 133 -5.800 -8.962 -9.981 840 3HD1 LEU 133 HD1 LEU 133 -4.479 -9.290 -8.864 841 1HD2 LEU 133 HD2 LEU 133 -6.419 -6.098 -9.047 842 2HD2 LEU 133 HD2 LEU 133 -5.269 -5.351 -10.154 843 3HD2 LEU 133 HD2 LEU 133 -6.273 -6.688 -10.703 844 H PHE 134 HN PHE 134 -0.989 -6.166 -7.374 845 HA PHE 134 HA PHE 134 -1.292 -5.161 -4.793 846 1HB PHE 134 HB2 PHE 134 0.346 -6.870 -5.207 847 2HB PHE 134 HB1 PHE 134 1.198 -5.850 -6.362 848 HD1 PHE 134 HD1 PHE 134 0.107 -5.793 -2.802 849 HD2 PHE 134 HD2 PHE 134 3.101 -4.803 -5.648 850 HE1 PHE 134 HE1 PHE 134 1.524 -4.943 -1.005 851 HE2 PHE 134 HE2 PHE 134 4.537 -3.947 -3.851 852 HZ PHE 134 HZ PHE 134 3.762 -4.009 -1.533 853 H SER 135 HN SER 135 0.534 -3.822 -7.538 854 HA SER 135 HA SER 135 1.378 -1.535 -6.201 855 1HB SER 135 HB2 SER 135 1.858 -0.600 -8.473 856 2HB SER 135 HB1 SER 135 2.480 -2.229 -8.223 857 HG SER 135 HG SER 135 0.241 -2.766 -9.231 858 H ARG 136 HN ARG 136 -1.586 -2.148 -7.931 859 HA ARG 136 HA ARG 136 -2.525 0.520 -8.082 860 1HB ARG 136 HB2 ARG 136 -4.007 -2.099 -8.053 861 2HB ARG 136 HB1 ARG 136 -4.747 -0.547 -8.440 862 1HG ARG 136 HG2 ARG 136 -3.349 -0.313 -10.359 863 2HG ARG 136 HG1 ARG 136 -2.438 -1.751 -9.864 864 1HD ARG 136 HD2 ARG 136 -4.351 -3.143 -10.206 865 2HD ARG 136 HD1 ARG 136 -5.367 -1.765 -10.639 866 HE ARG 136 HE ARG 136 -3.176 -1.773 -12.319 867 1HH1 ARG 136 1HH1 ARG 136 -6.010 -3.811 -11.687 868 2HH1 ARG 136 2HH1 ARG 136 -6.004 -4.538 -13.227 869 1HH2 ARG 136 1HH2 ARG 136 -3.212 -2.760 -14.476 870 2HH2 ARG 136 2HH2 ARG 136 -4.390 -3.940 -14.835 871 H ASP 137 HN ASP 137 -3.053 -2.072 -5.742 872 HA ASP 137 HA ASP 137 -4.883 -0.513 -4.179 873 1HB ASP 137 HB2 ASP 137 -4.750 -3.057 -4.379 874 2HB ASP 137 HB1 ASP 137 -3.385 -2.988 -3.284 875 H LEU 138 HN LEU 138 -1.486 -1.383 -4.003 876 HA LEU 138 HA LEU 138 -0.801 -0.157 -1.590 877 1HB LEU 138 HB2 LEU 138 0.721 -1.643 -2.671 878 2HB LEU 138 HB1 LEU 138 0.716 -0.690 -4.133 879 HG LEU 138 HG LEU 138 2.042 1.043 -3.049 880 1HD1 LEU 138 HD1 LEU 138 1.972 -0.735 -0.627 881 2HD1 LEU 138 HD1 LEU 138 2.954 0.720 -0.841 882 3HD1 LEU 138 HD1 LEU 138 1.197 0.849 -0.798 883 1HD2 LEU 138 HD2 LEU 138 3.144 -1.728 -2.665 884 2HD2 LEU 138 HD2 LEU 138 3.203 -0.774 -4.143 885 3HD2 LEU 138 HD2 LEU 138 4.099 -0.249 -2.720 886 H ASP 139 HN ASP 139 -0.878 1.103 -4.883 887 HA ASP 139 HA ASP 139 0.069 3.684 -4.409 888 1HB ASP 139 HB2 ASP 139 -0.205 2.669 -6.642 889 2HB ASP 139 HB1 ASP 139 -1.949 2.759 -6.465 890 H LYS 140 HN LYS 140 -3.175 2.328 -4.212 891 HA LYS 140 HA LYS 140 -4.341 4.891 -3.743 892 1HB LYS 140 HB2 LYS 140 -6.448 3.852 -3.625 893 2HB LYS 140 HB1 LYS 140 -5.474 2.990 -4.836 894 1HG LYS 140 HG2 LYS 140 -5.152 1.170 -3.274 895 2HG LYS 140 HG1 LYS 140 -6.166 2.008 -2.101 896 1HD LYS 140 HD2 LYS 140 -8.068 1.967 -3.597 897 2HD LYS 140 HD1 LYS 140 -7.092 1.266 -4.880 898 1HE LYS 140 HE2 LYS 140 -8.511 -0.416 -3.842 899 2HE LYS 140 HE1 LYS 140 -6.816 -0.781 -3.548 900 1HZ LYS 140 HZ1 LYS 140 -7.070 0.181 -1.334 901 2HZ LYS 140 HZ3 LYS 140 -8.702 0.468 -1.624 902 3HZ LYS 140 HZ2 LYS 140 -8.100 -1.110 -1.570 903 H LEU 141 HN LEU 141 -3.272 2.277 -1.756 904 HA LEU 141 HA LEU 141 -4.373 3.159 0.673 905 1HB LEU 141 HB2 LEU 141 -3.422 0.944 0.378 906 2HB LEU 141 HB1 LEU 141 -1.839 1.627 0.122 907 HG LEU 141 HG LEU 141 -1.734 2.396 2.440 908 1HD1 LEU 141 HD1 LEU 141 -4.428 1.115 2.725 909 2HD1 LEU 141 HD1 LEU 141 -3.442 1.720 4.056 910 3HD1 LEU 141 HD1 LEU 141 -4.071 2.831 2.836 911 1HD2 LEU 141 HD2 LEU 141 -2.506 -0.497 2.169 912 2HD2 LEU 141 HD2 LEU 141 -0.889 0.186 1.956 913 3HD2 LEU 141 HD2 LEU 141 -1.663 0.201 3.547 914 H ILE 142 HN ILE 142 -1.518 3.965 -1.041 915 HA ILE 142 HA ILE 142 -0.360 5.509 1.086 916 HB ILE 142 HB ILE 142 0.364 5.435 -1.862 917 1HG1 ILE 142 2HG1 ILE 142 1.686 4.300 0.588 918 2HG1 ILE 142 1HG1 ILE 142 0.781 3.365 -0.597 919 1HG2 ILE 142 1HG2 ILE 142 1.811 6.792 0.423 920 2HG2 ILE 142 3HG2 ILE 142 2.421 6.629 -1.224 921 3HG2 ILE 142 2HG2 ILE 142 0.989 7.609 -0.909 922 1HD1 ILE 142 HD1 ILE 142 3.336 4.868 -1.093 923 2HD1 ILE 142 HD1 ILE 142 3.188 3.123 -0.870 924 3HD1 ILE 142 HD1 ILE 142 2.450 3.906 -2.274 925 H ASN 143 HN ASN 143 -1.708 6.456 -2.019 926 HA ASN 143 HA ASN 143 -1.823 9.187 -1.577 927 1HB ASN 143 HB2 ASN 143 -3.614 7.464 -3.292 928 2HB ASN 143 HB1 ASN 143 -3.671 9.216 -3.309 929 1HD2 ASN 143 HD2 ASN 143 -3.031 7.281 -5.387 930 2HD2 ASN 143 HD2 ASN 143 -1.476 7.686 -6.002 931 H LYS 144 HN LYS 144 -4.061 6.707 -0.547 932 HA LYS 144 HA LYS 144 -6.203 8.267 0.343 933 1HB LYS 144 HB2 LYS 144 -6.225 5.817 0.201 934 2HB LYS 144 HB1 LYS 144 -5.063 5.728 1.511 935 1HG LYS 144 HG2 LYS 144 -6.698 6.621 3.063 936 2HG LYS 144 HG1 LYS 144 -7.852 6.834 1.753 937 1HD LYS 144 HD2 LYS 144 -8.467 4.827 2.850 938 2HD LYS 144 HD1 LYS 144 -7.646 4.394 1.329 939 1HE LYS 144 HE2 LYS 144 -5.666 3.974 2.473 940 2HE LYS 144 HE1 LYS 144 -6.389 4.446 4.012 941 1HZ LYS 144 HZ3 LYS 144 -7.975 2.580 3.787 942 2HZ LYS 144 HZ2 LYS 144 -7.245 2.072 2.366 943 3HZ LYS 144 HZ1 LYS 144 -6.411 2.002 3.809 944 H PHE 145 HN PHE 145 -3.452 7.036 2.172 945 HA PHE 145 HA PHE 145 -4.038 8.601 4.480 946 1HB PHE 145 HB2 PHE 145 -1.760 6.849 3.711 947 2HB PHE 145 HB1 PHE 145 -1.561 7.955 5.065 948 HD1 PHE 145 HD1 PHE 145 -2.488 7.491 7.166 949 HD2 PHE 145 HD2 PHE 145 -3.663 5.131 3.792 950 HE1 PHE 145 HE1 PHE 145 -3.608 5.906 8.654 951 HE2 PHE 145 HE2 PHE 145 -4.758 3.555 5.293 952 HZ PHE 145 HZ PHE 145 -4.739 3.931 7.723 953 H MET 146 HN MET 146 -2.152 9.211 1.681 954 HA MET 146 HA MET 146 -0.766 11.479 2.740 955 1HB MET 146 HB2 MET 146 -1.513 10.962 -0.137 956 2HB MET 146 HB1 MET 146 -0.315 12.110 0.436 957 1HG MET 146 HG2 MET 146 0.924 10.040 1.371 958 2HG MET 146 HG1 MET 146 -0.206 9.131 0.410 959 1HE MET 146 HE3 MET 146 2.622 11.744 0.374 960 2HE MET 146 HE2 MET 146 2.863 12.061 -1.336 961 3HE MET 146 HE1 MET 146 1.401 12.635 -0.529 962 H ASN 147 HN ASN 147 -3.776 10.991 0.986 963 HA ASN 147 HA ASN 147 -5.625 12.206 0.642 964 1HB ASN 147 HB2 ASN 147 -5.482 12.515 3.174 965 2HB ASN 147 HB1 ASN 147 -4.687 14.054 2.870 966 1HD2 ASN 147 HD2 ASN 147 -6.293 15.280 3.804 967 2HD2 ASN 147 HD2 ASN 147 -7.868 15.450 3.095 968 H VAL 148 HN VAL 148 -3.206 12.735 -0.747 969 HA VAL 148 HA VAL 148 -3.118 15.567 -1.144 970 HB VAL 148 HB VAL 148 -1.452 15.089 -2.975 971 1HG1 VAL 148 1HG1 VAL 148 -0.879 13.996 -0.232 972 2HG1 VAL 148 3HG1 VAL 148 0.342 14.445 -1.422 973 3HG1 VAL 148 2HG1 VAL 148 -0.736 15.674 -0.755 974 1HG2 VAL 148 3HG2 VAL 148 -2.190 12.834 -3.521 975 2HG2 VAL 148 2HG2 VAL 148 -0.470 12.843 -3.098 976 3HG2 VAL 148 1HG2 VAL 148 -1.673 12.262 -1.936 977 H LYS 149 HN LYS 149 -4.538 16.493 -2.063 978 HA LYS 149 HA LYS 149 -5.849 15.350 -4.429 979 1HB LYS 149 HB2 LYS 149 -6.841 17.454 -2.499 980 2HB LYS 149 HB1 LYS 149 -7.698 16.894 -3.929 981 1HG LYS 149 HG2 LYS 149 -7.987 14.710 -2.997 982 2HG LYS 149 HG1 LYS 149 -6.917 15.092 -1.646 983 1HD LYS 149 HD2 LYS 149 -9.234 15.182 -0.929 984 2HD LYS 149 HD1 LYS 149 -8.512 16.786 -0.882 985 1HE LYS 149 HE2 LYS 149 -9.580 17.306 -3.048 986 2HE LYS 149 HE1 LYS 149 -10.330 15.707 -3.035 987 1HZ LYS 149 HZ1 LYS 149 -10.760 17.825 -1.003 988 2HZ LYS 149 HZ3 LYS 149 -11.820 17.452 -2.248 989 3HZ LYS 149 HZ2 LYS 149 -11.529 16.321 -1.036 990 H ASP 150 HN ASP 150 -4.369 16.056 -5.910 991 HA ASP 150 HA ASP 150 -3.438 18.774 -5.885 992 1HB ASP 150 HB2 ASP 150 -1.913 17.009 -6.653 993 2HB ASP 150 HB1 ASP 150 -3.049 16.527 -7.899 994 H LYS 151 HN LYS 151 -3.570 19.949 -8.016 995 HA LYS 151 HA LYS 151 -6.261 20.717 -8.532 996 1HB LYS 151 HB2 LYS 151 -5.259 22.319 -10.053 997 2HB LYS 151 HB1 LYS 151 -4.340 22.252 -8.556 998 1HG LYS 151 HG2 LYS 151 -2.764 20.661 -9.712 999 2HG LYS 151 HG1 LYS 151 -3.619 21.026 -11.207 1000 1HD LYS 151 HD2 LYS 151 -1.682 22.374 -11.140 1001 2HD LYS 151 HD1 LYS 151 -3.056 23.436 -10.828 1002 1HE LYS 151 HE2 LYS 151 -1.186 23.927 -9.340 1003 2HE LYS 151 HE1 LYS 151 -2.574 23.360 -8.419 1004 1HZ LYS 151 HZ1 LYS 151 -1.471 21.136 -8.311 1005 2HZ LYS 151 HZ3 LYS 151 -0.154 21.773 -9.153 1006 3HZ LYS 151 HZ2 LYS 151 -0.562 22.348 -7.623 1007 H VAL 152 HN VAL 152 -5.242 17.984 -9.379 1008 HA VAL 152 HA VAL 152 -5.159 17.738 -12.162 1009 HB VAL 152 HB VAL 152 -5.722 15.313 -11.829 1010 1HG1 VAL 152 3HG1 VAL 152 -3.604 16.445 -10.017 1011 2HG1 VAL 152 2HG1 VAL 152 -3.699 14.764 -10.543 1012 3HG1 VAL 152 1HG1 VAL 152 -3.425 16.047 -11.723 1013 1HG2 VAL 152 3HG2 VAL 152 -7.222 15.513 -9.897 1014 2HG2 VAL 152 2HG2 VAL 152 -5.887 14.421 -9.543 1015 3HG2 VAL 152 1HG2 VAL 152 -5.875 16.065 -8.900 1016 H HIS 153 HN HIS 153 -6.595 17.888 -13.621 1017 HA HIS 153 HA HIS 153 -9.274 18.517 -12.805 1018 1HB HIS 153 HB2 HIS 153 -9.644 19.213 -15.081 1019 2HB HIS 153 HB1 HIS 153 -8.129 19.903 -14.514 1020 HD1 HIS 153 HD1 HIS 153 -9.563 18.285 -17.397 1021 HD2 HIS 153 HD2 HIS 153 -5.828 18.256 -15.556 1022 HE1 HIS 153 HE1 HIS 153 -7.964 17.380 -19.087 1023 H LYS 154 HN LYS 154 -11.088 17.423 -13.423 1024 HA LYS 154 HA LYS 154 -10.646 14.713 -14.307 1025 1HB LYS 154 HB2 LYS 154 -13.164 16.195 -13.506 1026 2HB LYS 154 HB1 LYS 154 -13.139 14.531 -14.074 1027 1HG LYS 154 HG2 LYS 154 -11.677 13.951 -12.153 1028 2HG LYS 154 HG1 LYS 154 -11.860 15.602 -11.566 1029 1HD LYS 154 HD2 LYS 154 -13.401 14.075 -10.426 1030 2HD LYS 154 HD1 LYS 154 -14.275 15.278 -11.370 1031 1HE LYS 154 HE2 LYS 154 -15.235 13.020 -11.576 1032 2HE LYS 154 HE1 LYS 154 -14.702 13.650 -13.127 1033 1HZ LYS 154 HZ3 LYS 154 -12.680 12.283 -12.902 1034 2HZ LYS 154 HZ2 LYS 154 -13.232 11.676 -11.439 1035 3HZ LYS 154 HZ1 LYS 154 -14.067 11.337 -12.850 1036 H LEU 155 HN LEU 155 -11.515 14.029 -16.297 1037 HA LEU 155 HA LEU 155 -11.081 15.934 -18.293 1038 1HB LEU 155 HB2 LEU 155 -12.400 13.237 -18.506 1039 2HB LEU 155 HB1 LEU 155 -11.919 14.217 -19.877 1040 HG LEU 155 HG LEU 155 -10.059 13.035 -17.813 1041 1HD1 LEU 155 HD1 LEU 155 -10.526 12.357 -20.699 1042 2HD1 LEU 155 HD1 LEU 155 -9.249 11.682 -19.686 1043 3HD1 LEU 155 HD1 LEU 155 -10.943 11.362 -19.307 1044 1HD2 LEU 155 HD2 LEU 155 -9.451 14.659 -20.284 1045 2HD2 LEU 155 HD2 LEU 155 -9.203 15.172 -18.614 1046 3HD2 LEU 155 HD2 LEU 155 -8.257 13.842 -19.276 1047 H GLU 156 HN GLU 156 -12.143 17.474 -18.874 1048 HA GLU 156 HA GLU 156 -14.399 18.557 -17.984 1049 1HB GLU 156 HB2 GLU 156 -13.283 18.907 -20.754 1050 2HB GLU 156 HB1 GLU 156 -14.505 19.934 -20.040 1051 1HG GLU 156 HG2 GLU 156 -12.424 21.059 -19.874 1052 2HG GLU 156 HG1 GLU 156 -12.861 20.519 -18.259 1053 H HIS 157 HN HIS 157 -14.309 16.179 -20.495 1054 HA HIS 157 HA HIS 157 -15.721 15.218 -21.837 1055 1HB HIS 157 HB2 HIS 157 -17.980 14.574 -21.116 1056 2HB HIS 157 HB1 HIS 157 -16.846 14.369 -19.801 1057 HD1 HIS 157 HD1 HIS 157 -17.582 15.410 -17.567 1058 HD2 HIS 157 HD2 HIS 157 -19.711 16.885 -20.824 1059 HE1 HIS 157 HE1 HIS 157 -19.424 16.812 -16.618 1060 H HIS 158 HN HIS 158 -17.989 15.439 -23.027 1061 HA HIS 158 HA HIS 158 -19.037 16.493 -24.672 1062 1HB HIS 158 HB2 HIS 158 -19.808 18.182 -23.028 1063 2HB HIS 158 HB1 HIS 158 -18.318 19.089 -23.247 1064 HD1 HIS 158 HD1 HIS 158 -21.720 18.673 -24.664 1065 HD2 HIS 158 HD2 HIS 158 -18.112 20.392 -25.796 1066 HE1 HIS 158 HE1 HIS 158 -22.243 20.191 -26.592 1067 H HIS 159 HN HIS 159 -18.282 16.435 -26.594 1068 HA HIS 159 HA HIS 159 -15.523 17.192 -26.982 1069 1HB HIS 159 HB2 HIS 159 -17.367 15.573 -28.752 1070 2HB HIS 159 HB1 HIS 159 -15.652 15.869 -29.066 1071 HD1 HIS 159 HD1 HIS 159 -17.910 13.625 -27.223 1072 HD2 HIS 159 HD2 HIS 159 -13.915 14.750 -27.052 1073 HE1 HIS 159 HE1 HIS 159 -16.776 11.972 -25.687 1074 H HIS 160 HN HIS 160 -14.970 18.928 -27.869 1075 HA HIS 160 HA HIS 160 -16.984 20.600 -29.066 1076 1HB HIS 160 HB2 HIS 160 -15.163 22.405 -28.928 1077 2HB HIS 160 HB1 HIS 160 -15.806 21.812 -27.409 1078 HD1 HIS 160 HD1 HIS 160 -14.129 20.763 -25.782 1079 HD2 HIS 160 HD2 HIS 160 -12.495 21.600 -29.503 1080 HE1 HIS 160 HE1 HIS 160 -11.631 20.434 -25.545 1081 H HIS 161 HN HIS 161 -17.300 19.722 -30.937 1082 HA HIS 161 HA HIS 161 -15.071 19.328 -32.753 1083 1HB HIS 161 HB2 HIS 161 -16.754 18.270 -34.273 1084 2HB HIS 161 HB1 HIS 161 -16.627 17.500 -32.699 1085 HD1 HIS 161 HD1 HIS 161 -19.069 19.112 -34.980 1086 HD2 HIS 161 HD2 HIS 161 -18.849 18.016 -30.980 1087 HE1 HIS 161 HE1 HIS 161 -21.432 19.119 -34.120 1088 H HIS 162 HN HIS 162 -16.720 21.978 -31.976 1089 HA HIS 162 HA HIS 162 -16.634 22.915 -34.747 1090 1HB HIS 162 HB2 HIS 162 -18.964 22.838 -33.786 1091 2HB HIS 162 HB1 HIS 162 -18.449 24.002 -32.572 1092 HD1 HIS 162 HD1 HIS 162 -18.636 26.434 -33.229 1093 HD2 HIS 162 HD2 HIS 162 -18.883 23.863 -36.481 1094 HE1 HIS 162 HE1 HIS 162 -19.321 27.856 -35.187 No H/Q in entry = 1094 Start of MODEL 22 1 H1 MET 1 HT2 MET 1 19.513 -20.316 -1.451 2 H2 MET 1 HT1 MET 1 19.274 -19.898 -3.083 3 H3 MET 1 HT3 MET 1 19.475 -18.716 -1.886 4 HA MET 1 HA MET 1 17.190 -18.826 -2.440 5 1HB MET 1 HB2 MET 1 17.433 -21.703 -1.552 6 2HB MET 1 HB1 MET 1 15.910 -20.862 -1.759 7 1HG MET 1 HG2 MET 1 16.461 -20.545 -4.148 8 2HG MET 1 HG1 MET 1 17.923 -21.497 -3.899 9 1HE MET 1 HE2 MET 1 17.936 -24.057 -3.220 10 2HE MET 1 HE1 MET 1 16.907 -23.737 -1.826 11 3HE MET 1 HE3 MET 1 16.481 -25.018 -2.962 12 H GLU 2 HN GLU 2 17.016 -17.363 -0.931 13 HA GLU 2 HA GLU 2 16.481 -18.286 1.747 14 1HB GLU 2 HB2 GLU 2 18.810 -17.645 1.822 15 2HB GLU 2 HB1 GLU 2 18.465 -16.134 0.996 16 1HG GLU 2 HG2 GLU 2 18.810 -15.703 3.334 17 2HG GLU 2 HG1 GLU 2 17.131 -15.423 2.912 18 H MET 3 HN MET 3 14.455 -17.627 1.906 19 HA MET 3 HA MET 3 13.694 -15.216 0.500 20 1HB MET 3 HB2 MET 3 11.376 -15.718 1.086 21 2HB MET 3 HB1 MET 3 12.134 -17.154 0.423 22 1HG MET 3 HG2 MET 3 12.454 -17.996 2.744 23 2HG MET 3 HG1 MET 3 11.593 -16.582 3.331 24 1HE MET 3 HE1 MET 3 9.014 -16.106 2.854 25 2HE MET 3 HE3 MET 3 9.277 -16.245 1.114 26 3HE MET 3 HE2 MET 3 7.985 -17.161 1.887 27 H GLY 4 HN GLY 4 14.793 -16.038 3.545 28 1HA GLY 4 HA1 GLY 4 15.061 -14.810 5.444 29 2HA GLY 4 HA2 GLY 4 13.495 -14.078 5.103 30 H GLN 5 HN GLN 5 16.286 -14.028 3.017 31 HA GLN 5 HA GLN 5 17.141 -11.411 3.813 32 1HB GLN 5 HB2 GLN 5 18.837 -11.594 2.105 33 2HB GLN 5 HB1 GLN 5 18.665 -13.146 2.937 34 1HG GLN 5 HG2 GLN 5 17.467 -14.070 1.090 35 2HG GLN 5 HG1 GLN 5 17.474 -12.514 0.267 36 1HE2 GLN 5 1HE2 GLN 5 20.265 -11.943 1.023 37 2HE2 GLN 5 2HE2 GLN 5 21.205 -12.964 0.000 38 H LEU 6 HN LEU 6 15.227 -12.782 1.267 39 HA LEU 6 HA LEU 6 15.055 -10.449 -0.324 40 1HB LEU 6 HB2 LEU 6 14.704 -12.793 -1.132 41 2HB LEU 6 HB1 LEU 6 13.240 -12.877 -0.193 42 HG LEU 6 HG LEU 6 12.970 -12.574 -2.692 43 1HD1 LEU 6 HD1 LEU 6 11.698 -10.514 -0.935 44 2HD1 LEU 6 HD1 LEU 6 11.138 -10.994 -2.536 45 3HD1 LEU 6 HD1 LEU 6 11.126 -12.160 -1.212 46 1HD2 LEU 6 HD2 LEU 6 14.756 -10.968 -3.065 47 2HD2 LEU 6 HD2 LEU 6 13.204 -10.312 -3.587 48 3HD2 LEU 6 HD2 LEU 6 13.913 -9.783 -2.065 49 H LYS 7 HN LYS 7 12.975 -11.958 2.080 50 HA LYS 7 HA LYS 7 11.023 -9.946 2.118 51 1HB LYS 7 HB2 LYS 7 11.603 -12.344 3.605 52 2HB LYS 7 HB1 LYS 7 11.043 -11.062 4.674 53 1HG LYS 7 HG2 LYS 7 9.601 -11.843 2.153 54 2HG LYS 7 HG1 LYS 7 9.259 -12.596 3.708 55 1HD LYS 7 HD2 LYS 7 9.154 -9.614 3.265 56 2HD LYS 7 HD1 LYS 7 7.732 -10.650 3.052 57 1HE LYS 7 HE2 LYS 7 8.051 -11.394 5.424 58 2HE LYS 7 HE1 LYS 7 9.357 -10.228 5.571 59 1HZ LYS 7 HZ2 LYS 7 6.519 -9.502 4.964 60 2HZ LYS 7 HZ1 LYS 7 7.251 -9.440 6.452 61 3HZ LYS 7 HZ3 LYS 7 7.794 -8.421 5.247 62 H ASN 8 HN ASN 8 14.056 -10.282 3.844 63 HA ASN 8 HA ASN 8 13.615 -8.187 5.667 64 1HB ASN 8 HB2 ASN 8 15.411 -9.859 5.963 65 2HB ASN 8 HB1 ASN 8 16.240 -9.222 4.551 66 1HD2 ASN 8 HD2 ASN 8 18.106 -8.807 5.766 67 2HD2 ASN 8 HD2 ASN 8 18.190 -7.513 6.898 68 H LYS 9 HN LYS 9 14.976 -8.268 2.405 69 HA LYS 9 HA LYS 9 15.663 -5.540 2.201 70 1HB LYS 9 HB2 LYS 9 14.720 -7.440 0.041 71 2HB LYS 9 HB1 LYS 9 15.412 -5.854 -0.249 72 1HG LYS 9 HG2 LYS 9 17.537 -6.585 0.683 73 2HG LYS 9 HG1 LYS 9 16.834 -8.157 1.075 74 1HD LYS 9 HD2 LYS 9 16.423 -8.571 -1.301 75 2HD LYS 9 HD1 LYS 9 17.107 -6.998 -1.700 76 1HE LYS 9 HE2 LYS 9 18.582 -9.258 -0.347 77 2HE LYS 9 HE1 LYS 9 18.700 -8.854 -2.054 78 1HZ LYS 9 HZ3 LYS 9 19.504 -7.073 0.192 79 2HZ LYS 9 HZ2 LYS 9 20.545 -7.933 -0.823 80 3HZ LYS 9 HZ1 LYS 9 19.604 -6.701 -1.445 81 H ILE 10 HN ILE 10 12.749 -7.277 1.252 82 HA ILE 10 HA ILE 10 11.070 -5.214 0.551 83 HB ILE 10 HB ILE 10 10.443 -7.805 1.980 84 1HG1 ILE 10 2HG1 ILE 10 9.978 -6.929 -0.830 85 2HG1 ILE 10 1HG1 ILE 10 11.400 -7.865 -0.324 86 1HG2 ILE 10 2HG2 ILE 10 8.624 -6.221 2.471 87 2HG2 ILE 10 1HG2 ILE 10 8.442 -5.907 0.750 88 3HG2 ILE 10 3HG2 ILE 10 8.085 -7.509 1.392 89 1HD1 ILE 10 HD1 ILE 10 9.848 -9.672 0.330 90 2HD1 ILE 10 HD1 ILE 10 8.510 -8.697 -0.277 91 3HD1 ILE 10 HD1 ILE 10 9.768 -9.262 -1.379 92 H GLU 11 HN GLU 11 11.513 -6.524 3.848 93 HA GLU 11 HA GLU 11 9.775 -4.774 5.153 94 1HB GLU 11 HB2 GLU 11 12.324 -6.011 6.199 95 2HB GLU 11 HB1 GLU 11 11.123 -5.203 7.194 96 1HG GLU 11 HG2 GLU 11 10.699 -7.696 5.569 97 2HG GLU 11 HG1 GLU 11 10.885 -7.607 7.321 98 H ASN 12 HN ASN 12 13.245 -4.472 4.651 99 HA ASN 12 HA ASN 12 13.585 -1.980 5.866 100 1HB ASN 12 HB2 ASN 12 15.433 -3.517 5.263 101 2HB ASN 12 HB1 ASN 12 15.154 -3.172 3.565 102 1HD2 ASN 12 HD2 ASN 12 17.303 -2.438 3.366 103 2HD2 ASN 12 HD2 ASN 12 17.783 -0.893 3.988 104 H LYS 13 HN LYS 13 12.844 -2.790 2.510 105 HA LYS 13 HA LYS 13 12.987 -0.153 1.496 106 1HB LYS 13 HB2 LYS 13 13.058 -2.354 0.203 107 2HB LYS 13 HB1 LYS 13 11.320 -2.390 0.381 108 1HG LYS 13 HG2 LYS 13 11.990 -1.517 -1.796 109 2HG LYS 13 HG1 LYS 13 11.093 -0.327 -0.851 110 1HD LYS 13 HD2 LYS 13 13.065 0.639 -1.999 111 2HD LYS 13 HD1 LYS 13 13.145 0.816 -0.254 112 1HE LYS 13 HE2 LYS 13 14.613 -1.095 -0.123 113 2HE LYS 13 HE1 LYS 13 14.570 -1.294 -1.888 114 1HZ LYS 13 HZ1 LYS 13 15.604 1.009 -0.345 115 2HZ LYS 13 HZ3 LYS 13 16.529 -0.147 -1.137 116 3HZ LYS 13 HZ2 LYS 13 15.600 0.909 -2.060 117 H LYS 14 HN LYS 14 10.228 -2.159 2.431 118 HA LYS 14 HA LYS 14 8.149 -0.402 2.055 119 1HB LYS 14 HB2 LYS 14 7.798 -2.689 2.407 120 2HB LYS 14 HB1 LYS 14 8.647 -2.706 3.957 121 1HG LYS 14 HG2 LYS 14 6.728 -1.198 4.783 122 2HG LYS 14 HG1 LYS 14 5.906 -1.658 3.287 123 1HD LYS 14 HD2 LYS 14 5.119 -3.187 4.941 124 2HD LYS 14 HD1 LYS 14 6.291 -4.077 3.968 125 1HE LYS 14 HE2 LYS 14 8.010 -3.563 5.729 126 2HE LYS 14 HE1 LYS 14 6.699 -2.865 6.674 127 1HZ LYS 14 HZ3 LYS 14 5.609 -5.206 6.580 128 2HZ LYS 14 HZ2 LYS 14 7.063 -5.713 5.900 129 3HZ LYS 14 HZ1 LYS 14 7.070 -5.106 7.406 130 H LYS 15 HN LYS 15 10.253 -0.913 4.887 131 HA LYS 15 HA LYS 15 9.023 1.024 6.531 132 1HB LYS 15 HB2 LYS 15 11.781 -0.175 6.604 133 2HB LYS 15 HB1 LYS 15 11.169 0.922 7.839 134 1HG LYS 15 HG2 LYS 15 9.455 -0.631 8.466 135 2HG LYS 15 HG1 LYS 15 9.831 -1.670 7.090 136 1HD LYS 15 HD2 LYS 15 10.749 -2.638 9.074 137 2HD LYS 15 HD1 LYS 15 12.060 -2.074 8.050 138 1HE LYS 15 HE2 LYS 15 12.558 -1.480 10.343 139 2HE LYS 15 HE1 LYS 15 12.221 -0.013 9.431 140 1HZ LYS 15 HZ3 LYS 15 10.327 -1.417 11.225 141 2HZ LYS 15 HZ2 LYS 15 11.151 0.020 11.571 142 3HZ LYS 15 HZ1 LYS 15 9.985 0.003 10.370 143 H GLU 16 HN GLU 16 11.706 1.266 4.227 144 HA GLU 16 HA GLU 16 12.479 3.919 4.729 145 1HB GLU 16 HB2 GLU 16 12.403 2.357 2.131 146 2HB GLU 16 HB1 GLU 16 12.978 4.011 2.210 147 1HG GLU 16 HG2 GLU 16 14.740 3.203 3.782 148 2HG GLU 16 HG1 GLU 16 14.161 1.558 3.478 149 H LEU 17 HN LEU 17 9.887 2.583 2.845 150 HA LEU 17 HA LEU 17 9.001 5.046 1.786 151 1HB LEU 17 HB2 LEU 17 8.550 3.164 0.479 152 2HB LEU 17 HB1 LEU 17 7.943 2.246 1.832 153 HG LEU 17 HG LEU 17 6.247 2.912 0.088 154 1HD1 LEU 17 HD1 LEU 17 5.615 2.091 2.148 155 2HD1 LEU 17 HD1 LEU 17 5.642 3.707 2.845 156 3HD1 LEU 17 HD1 LEU 17 4.488 3.322 1.553 157 1HD2 LEU 17 HD2 LEU 17 6.618 5.635 1.273 158 2HD2 LEU 17 HD2 LEU 17 7.004 5.148 -0.381 159 3HD2 LEU 17 HD2 LEU 17 5.326 5.140 0.173 160 H ILE 18 HN ILE 18 7.944 3.024 4.482 161 HA ILE 18 HA ILE 18 5.681 4.490 5.068 162 HB ILE 18 HB ILE 18 7.443 3.038 7.084 163 1HG1 ILE 18 2HG1 ILE 18 4.890 2.065 5.804 164 2HG1 ILE 18 1HG1 ILE 18 6.460 1.715 5.102 165 1HG2 ILE 18 1HG2 ILE 18 4.575 3.997 7.251 166 2HG2 ILE 18 3HG2 ILE 18 5.350 2.967 8.458 167 3HG2 ILE 18 2HG2 ILE 18 5.928 4.612 8.177 168 1HD1 ILE 18 HD1 ILE 18 5.547 0.914 7.856 169 2HD1 ILE 18 HD1 ILE 18 5.630 -0.138 6.437 170 3HD1 ILE 18 HD1 ILE 18 7.107 0.547 7.120 171 H GLN 19 HN GLN 19 9.022 4.884 6.147 172 HA GLN 19 HA GLN 19 8.573 7.077 7.834 173 1HB GLN 19 HB2 GLN 19 11.083 6.315 6.341 174 2HB GLN 19 HB1 GLN 19 10.990 7.466 7.668 175 1HG GLN 19 HG2 GLN 19 10.217 5.665 9.156 176 2HG GLN 19 HG1 GLN 19 10.361 4.524 7.824 177 1HE2 GLN 19 1HE2 GLN 19 12.598 7.132 8.465 178 2HE2 GLN 19 2HE2 GLN 19 13.929 6.132 8.884 179 H LEU 20 HN LEU 20 9.035 6.829 4.377 180 HA LEU 20 HA LEU 20 9.398 9.599 3.926 181 1HB LEU 20 HB2 LEU 20 8.462 7.433 2.048 182 2HB LEU 20 HB1 LEU 20 8.712 9.099 1.571 183 HG LEU 20 HG LEU 20 10.868 7.252 2.594 184 1HD1 LEU 20 HD1 LEU 20 10.052 6.588 0.397 185 2HD1 LEU 20 HD1 LEU 20 10.269 8.238 -0.189 186 3HD1 LEU 20 HD1 LEU 20 11.668 7.279 0.288 187 1HD2 LEU 20 HD2 LEU 20 11.006 10.041 1.444 188 2HD2 LEU 20 HD2 LEU 20 11.344 9.591 3.118 189 3HD2 LEU 20 HD2 LEU 20 12.390 9.021 1.821 190 H VAL 21 HN VAL 21 6.335 7.563 3.488 191 HA VAL 21 HA VAL 21 4.789 9.819 3.111 192 HB VAL 21 HB VAL 21 2.922 8.514 3.477 193 1HG1 VAL 21 3HG1 VAL 21 5.036 6.786 2.362 194 2HG1 VAL 21 2HG1 VAL 21 3.298 6.455 2.230 195 3HG1 VAL 21 1HG1 VAL 21 3.987 7.921 1.502 196 1HG2 VAL 21 1HG2 VAL 21 3.362 7.634 5.612 197 2HG2 VAL 21 3HG2 VAL 21 2.842 6.336 4.533 198 3HG2 VAL 21 2HG2 VAL 21 4.567 6.501 4.963 199 H ALA 22 HN ALA 22 5.968 8.373 6.045 200 HA ALA 22 HA ALA 22 4.254 9.629 7.857 201 1HB ALA 22 HB3 ALA 22 7.080 8.714 8.281 202 2HB ALA 22 HB2 ALA 22 5.859 8.988 9.549 203 3HB ALA 22 HB1 ALA 22 5.640 7.708 8.348 204 H ARG 23 HN ARG 23 7.436 10.558 6.610 205 HA ARG 23 HA ARG 23 7.693 12.876 8.213 206 1HB ARG 23 HB2 ARG 23 9.599 13.462 6.892 207 2HB ARG 23 HB1 ARG 23 9.631 11.719 7.110 208 1HG ARG 23 HG2 ARG 23 8.779 11.428 4.848 209 2HG ARG 23 HG1 ARG 23 8.693 13.177 4.653 210 1HD ARG 23 HD2 ARG 23 10.692 12.444 3.597 211 2HD ARG 23 HD1 ARG 23 11.147 13.266 5.083 212 HE ARG 23 HE ARG 23 10.874 10.403 5.259 213 1HH1 ARG 23 1HH1 ARG 23 13.093 13.172 4.975 214 2HH1 ARG 23 2HH1 ARG 23 14.500 12.229 5.138 215 1HH2 ARG 23 1HH2 ARG 23 12.934 9.090 5.416 216 2HH2 ARG 23 2HH2 ARG 23 14.400 9.944 5.375 217 H HIS 24 HN HIS 24 5.930 12.232 5.388 218 HA HIS 24 HA HIS 24 5.650 14.762 4.224 219 1HB HIS 24 HB2 HIS 24 4.863 12.801 3.083 220 2HB HIS 24 HB1 HIS 24 3.765 12.382 4.380 221 HD1 HIS 24 HD1 HIS 24 1.397 13.597 4.332 222 HD2 HIS 24 HD2 HIS 24 4.025 14.796 1.333 223 HE1 HIS 24 HE1 HIS 24 0.027 14.829 2.661 224 H GLY 25 HN GLY 25 4.306 13.353 7.086 225 1HA GLY 25 HA1 GLY 25 2.619 15.728 7.472 226 2HA GLY 25 HA2 GLY 25 3.730 15.189 8.720 227 H LEU 26 HN LEU 26 3.279 12.368 8.463 228 HA LEU 26 HA LEU 26 0.452 12.142 9.071 229 1HB LEU 26 HB2 LEU 26 2.655 10.134 8.918 230 2HB LEU 26 HB1 LEU 26 1.102 9.703 9.546 231 HG LEU 26 HG LEU 26 1.883 10.497 6.833 232 1HD1 LEU 26 HD1 LEU 26 2.213 8.181 7.339 233 2HD1 LEU 26 HD1 LEU 26 0.542 8.025 7.871 234 3HD1 LEU 26 HD1 LEU 26 0.899 8.341 6.173 235 1HD2 LEU 26 HD2 LEU 26 -0.952 10.344 7.852 236 2HD2 LEU 26 HD2 LEU 26 -0.131 11.702 7.091 237 3HD2 LEU 26 HD2 LEU 26 -0.519 10.282 6.140 238 H ASP 27 HN ASP 27 -0.315 11.484 10.939 239 HA ASP 27 HA ASP 27 1.056 12.211 13.389 240 1HB ASP 27 HB2 ASP 27 -1.399 10.429 13.135 241 2HB ASP 27 HB1 ASP 27 -0.847 11.246 14.575 242 H HIS 28 HN HIS 28 1.443 10.516 15.109 243 HA HIS 28 HA HIS 28 2.959 8.337 14.123 244 1HB HIS 28 HB2 HIS 28 3.208 9.318 16.438 245 2HB HIS 28 HB1 HIS 28 1.660 8.606 16.863 246 HD1 HIS 28 HD1 HIS 28 1.829 6.373 17.988 247 HD2 HIS 28 HD2 HIS 28 5.141 7.226 15.628 248 HE1 HIS 28 HE1 HIS 28 3.458 4.484 18.346 249 H ASP 29 HN ASP 29 -0.296 8.749 15.208 250 HA ASP 29 HA ASP 29 -1.408 6.217 15.102 251 1HB ASP 29 HB2 ASP 29 -2.698 7.983 15.980 252 2HB ASP 29 HB1 ASP 29 -2.439 8.989 14.566 253 H LYS 30 HN LYS 30 -0.934 8.568 12.561 254 HA LYS 30 HA LYS 30 -2.298 7.076 10.577 255 1HB LYS 30 HB2 LYS 30 -0.420 9.356 10.476 256 2HB LYS 30 HB1 LYS 30 -1.100 8.771 8.980 257 1HG LYS 30 HG2 LYS 30 -2.430 10.054 11.372 258 2HG LYS 30 HG1 LYS 30 -2.340 10.685 9.731 259 1HD LYS 30 HD2 LYS 30 -3.866 8.982 8.953 260 2HD LYS 30 HD1 LYS 30 -3.854 8.200 10.535 261 1HE LYS 30 HE2 LYS 30 -4.873 10.953 9.921 262 2HE LYS 30 HE1 LYS 30 -5.854 9.530 10.281 263 1HZ LYS 30 HZ2 LYS 30 -4.723 9.455 12.498 264 2HZ LYS 30 HZ1 LYS 30 -3.990 10.930 12.130 265 3HZ LYS 30 HZ3 LYS 30 -5.662 10.841 12.250 266 H VAL 31 HN VAL 31 1.067 7.470 11.450 267 HA VAL 31 HA VAL 31 2.170 5.931 9.399 268 HB VAL 31 HB VAL 31 3.197 6.223 12.246 269 1HG1 VAL 31 1HG1 VAL 31 4.664 5.541 9.714 270 2HG1 VAL 31 3HG1 VAL 31 5.398 5.816 11.293 271 3HG1 VAL 31 2HG1 VAL 31 4.317 4.444 11.052 272 1HG2 VAL 31 3HG2 VAL 31 2.770 8.383 11.227 273 2HG2 VAL 31 2HG2 VAL 31 4.506 8.102 11.409 274 3HG2 VAL 31 1HG2 VAL 31 3.734 7.928 9.829 275 H LEU 32 HN LEU 32 0.907 5.068 12.588 276 HA LEU 32 HA LEU 32 1.549 2.334 12.498 277 1HB LEU 32 HB2 LEU 32 -0.706 3.669 13.981 278 2HB LEU 32 HB1 LEU 32 -0.101 2.055 14.281 279 HG LEU 32 HG LEU 32 1.353 4.648 14.744 280 1HD1 LEU 32 HD1 LEU 32 -0.325 4.170 16.382 281 2HD1 LEU 32 HD1 LEU 32 0.356 2.558 16.637 282 3HD1 LEU 32 HD1 LEU 32 1.292 3.994 17.072 283 1HD2 LEU 32 HD2 LEU 32 2.336 1.819 15.127 284 2HD2 LEU 32 HD2 LEU 32 2.937 3.007 13.963 285 3HD2 LEU 32 HD2 LEU 32 3.161 3.276 15.691 286 H LEU 33 HN LEU 33 -1.459 4.041 11.735 287 HA LEU 33 HA LEU 33 -3.011 1.843 10.978 288 1HB LEU 33 HB2 LEU 33 -3.060 4.668 9.961 289 2HB LEU 33 HB1 LEU 33 -4.305 3.479 9.634 290 HG LEU 33 HG LEU 33 -3.589 4.463 12.394 291 1HD1 LEU 33 HD1 LEU 33 -5.822 5.281 10.544 292 2HD1 LEU 33 HD1 LEU 33 -5.634 5.776 12.230 293 3HD1 LEU 33 HD1 LEU 33 -4.447 6.276 11.029 294 1HD2 LEU 33 HD2 LEU 33 -4.643 2.246 12.314 295 2HD2 LEU 33 HD2 LEU 33 -5.718 3.464 13.010 296 3HD2 LEU 33 HD2 LEU 33 -5.956 2.916 11.351 297 H PHE 34 HN PHE 34 -0.930 3.939 9.054 298 HA PHE 34 HA PHE 34 -1.454 2.725 6.591 299 1HB PHE 34 HB2 PHE 34 -0.466 4.935 6.708 300 2HB PHE 34 HB1 PHE 34 0.959 4.295 7.516 301 HD1 PHE 34 HD1 PHE 34 -0.960 4.106 4.349 302 HD2 PHE 34 HD2 PHE 34 2.788 3.609 6.282 303 HE1 PHE 34 HE1 PHE 34 0.117 3.758 2.168 304 HE2 PHE 34 HE2 PHE 34 3.866 3.265 4.092 305 HZ PHE 34 HZ PHE 34 2.541 3.333 2.061 306 H SER 35 HN SER 35 1.220 2.220 8.888 307 HA SER 35 HA SER 35 2.519 0.327 7.274 308 1HB SER 35 HB2 SER 35 3.790 -0.249 9.376 309 2HB SER 35 HB1 SER 35 3.824 1.452 8.903 310 HG SER 35 HG SER 35 2.388 1.918 10.496 311 H ARG 36 HN ARG 36 0.056 -0.056 9.738 312 HA ARG 36 HA ARG 36 0.377 -2.870 9.799 313 1HB ARG 36 HB2 ARG 36 -1.589 -2.976 11.207 314 2HB ARG 36 HB1 ARG 36 -0.561 -1.658 11.737 315 1HG ARG 36 HG2 ARG 36 -2.101 -0.182 10.353 316 2HG ARG 36 HG1 ARG 36 -3.211 -1.552 10.346 317 1HD ARG 36 HD2 ARG 36 -2.192 0.037 12.703 318 2HD ARG 36 HD1 ARG 36 -3.849 -0.166 12.151 319 HE ARG 36 HE ARG 36 -2.313 -2.420 13.246 320 1HH1 ARG 36 1HH1 ARG 36 -5.211 -0.390 13.348 321 2HH1 ARG 36 2HH1 ARG 36 -5.913 -1.214 14.666 322 1HH2 ARG 36 1HH2 ARG 36 -3.275 -3.511 15.104 323 2HH2 ARG 36 2HH2 ARG 36 -4.790 -2.985 15.686 324 H ASP 37 HN ASP 37 -1.872 -0.750 8.033 325 HA ASP 37 HA ASP 37 -3.386 -2.869 6.862 326 1HB ASP 37 HB2 ASP 37 -4.029 -0.415 6.958 327 2HB ASP 37 HB1 ASP 37 -2.851 -0.121 5.689 328 H LEU 38 HN LEU 38 -0.630 -0.975 5.833 329 HA LEU 38 HA LEU 38 -0.143 -1.967 3.294 330 1HB LEU 38 HB2 LEU 38 0.961 -0.025 4.075 331 2HB LEU 38 HB1 LEU 38 1.646 -0.876 5.432 332 HG LEU 38 HG LEU 38 3.181 -2.061 3.935 333 1HD1 LEU 38 HD1 LEU 38 1.942 -0.386 1.770 334 2HD1 LEU 38 HD1 LEU 38 3.384 -1.396 1.630 335 3HD1 LEU 38 HD1 LEU 38 1.817 -2.148 1.941 336 1HD2 LEU 38 HD2 LEU 38 3.145 0.924 3.602 337 2HD2 LEU 38 HD2 LEU 38 3.890 0.016 4.916 338 3HD2 LEU 38 HD2 LEU 38 4.524 -0.117 3.273 339 H ASP 39 HN ASP 39 1.012 -3.165 6.402 340 HA ASP 39 HA ASP 39 2.730 -5.086 5.253 341 1HB ASP 39 HB2 ASP 39 2.958 -4.194 7.553 342 2HB ASP 39 HB1 ASP 39 1.556 -5.155 8.026 343 H LYS 40 HN LYS 40 -0.604 -5.257 6.400 344 HA LYS 40 HA LYS 40 -0.902 -8.032 5.941 345 1HB LYS 40 HB2 LYS 40 -2.861 -5.785 6.274 346 2HB LYS 40 HB1 LYS 40 -3.426 -7.353 5.728 347 1HG LYS 40 HG2 LYS 40 -3.735 -7.113 8.114 348 2HG LYS 40 HG1 LYS 40 -2.548 -8.376 7.775 349 1HD LYS 40 HD2 LYS 40 -0.758 -6.724 8.271 350 2HD LYS 40 HD1 LYS 40 -2.001 -5.557 8.666 351 1HE LYS 40 HE2 LYS 40 -1.634 -8.193 10.069 352 2HE LYS 40 HE1 LYS 40 -1.082 -6.635 10.676 353 1HZ LYS 40 HZ2 LYS 40 -3.403 -5.889 10.712 354 2HZ LYS 40 HZ1 LYS 40 -3.905 -7.384 10.134 355 3HZ LYS 40 HZ3 LYS 40 -3.184 -7.284 11.647 356 H LEU 41 HN LEU 41 -1.440 -5.210 3.931 357 HA LEU 41 HA LEU 41 -2.483 -6.471 1.668 358 1HB LEU 41 HB2 LEU 41 -2.482 -4.081 1.799 359 2HB LEU 41 HB1 LEU 41 -0.742 -4.028 1.972 360 HG LEU 41 HG LEU 41 -0.479 -4.754 -0.357 361 1HD1 LEU 41 HD1 LEU 41 -3.478 -4.610 -0.489 362 2HD1 LEU 41 HD1 LEU 41 -2.390 -4.830 -1.858 363 3HD1 LEU 41 HD1 LEU 41 -2.487 -6.070 -0.615 364 1HD2 LEU 41 HD2 LEU 41 -2.288 -2.374 0.001 365 2HD2 LEU 41 HD2 LEU 41 -0.530 -2.384 0.137 366 3HD2 LEU 41 HD2 LEU 41 -1.297 -2.702 -1.419 367 H ILE 42 HN ILE 42 0.840 -5.838 2.596 368 HA ILE 42 HA ILE 42 1.987 -7.116 0.381 369 HB ILE 42 HB ILE 42 3.150 -6.504 3.115 370 1HG1 ILE 42 2HG1 ILE 42 3.426 -5.209 0.412 371 2HG1 ILE 42 1HG1 ILE 42 2.502 -4.582 1.770 372 1HG2 ILE 42 2HG2 ILE 42 4.598 -7.455 0.638 373 2HG2 ILE 42 1HG2 ILE 42 5.366 -6.907 2.130 374 3HG2 ILE 42 3HG2 ILE 42 4.385 -8.378 2.127 375 1HD1 ILE 42 HD1 ILE 42 5.482 -4.950 1.677 376 2HD1 ILE 42 HD1 ILE 42 4.603 -3.426 1.491 377 3HD1 ILE 42 HD1 ILE 42 4.533 -4.295 3.018 378 H ASN 43 HN ASN 43 1.264 -8.343 3.641 379 HA ASN 43 HA ASN 43 2.264 -10.943 3.352 380 1HB ASN 43 HB2 ASN 43 -0.254 -10.138 4.838 381 2HB ASN 43 HB1 ASN 43 0.528 -11.709 4.924 382 1HD2 ASN 43 HD2 ASN 43 -0.069 -9.867 7.010 383 2HD2 ASN 43 HD2 ASN 43 1.404 -9.434 7.787 384 H LYS 44 HN LYS 44 -0.784 -9.603 2.349 385 HA LYS 44 HA LYS 44 -2.178 -11.855 1.505 386 1HB LYS 44 HB2 LYS 44 -3.122 -9.616 1.718 387 2HB LYS 44 HB1 LYS 44 -2.157 -9.063 0.365 388 1HG LYS 44 HG2 LYS 44 -3.401 -10.742 -1.056 389 2HG LYS 44 HG1 LYS 44 -4.473 -10.979 0.325 390 1HD LYS 44 HD2 LYS 44 -3.980 -8.385 -1.147 391 2HD LYS 44 HD1 LYS 44 -5.452 -9.352 -1.196 392 1HE LYS 44 HE2 LYS 44 -5.738 -8.974 1.217 393 2HE LYS 44 HE1 LYS 44 -4.306 -7.962 1.220 394 1HZ LYS 44 HZ1 LYS 44 -5.435 -6.452 -0.329 395 2HZ LYS 44 HZ3 LYS 44 -6.832 -7.388 -0.247 396 3HZ LYS 44 HZ2 LYS 44 -6.234 -6.602 1.120 397 H PHE 45 HN PHE 45 -0.009 -9.752 -0.333 398 HA PHE 45 HA PHE 45 -0.287 -11.423 -2.627 399 1HB PHE 45 HB2 PHE 45 1.179 -8.867 -2.133 400 2HB PHE 45 HB1 PHE 45 1.435 -9.777 -3.620 401 HD1 PHE 45 HD1 PHE 45 -1.038 -7.867 -1.643 402 HD2 PHE 45 HD2 PHE 45 -0.268 -9.939 -5.279 403 HE1 PHE 45 HE1 PHE 45 -3.069 -6.918 -2.617 404 HE2 PHE 45 HE2 PHE 45 -2.314 -8.986 -6.250 405 HZ PHE 45 HZ PHE 45 -3.715 -7.473 -4.918 406 H MET 46 HN MET 46 2.012 -11.000 -0.115 407 HA MET 46 HA MET 46 4.126 -12.493 -1.344 408 1HB MET 46 HB2 MET 46 3.558 -11.887 1.555 409 2HB MET 46 HB1 MET 46 5.044 -12.653 0.995 410 1HG MET 46 HG2 MET 46 4.051 -9.897 0.297 411 2HG MET 46 HG1 MET 46 5.338 -10.284 1.435 412 1HE MET 46 HE3 MET 46 7.687 -11.091 0.776 413 2HE MET 46 HE2 MET 46 6.967 -12.526 0.018 414 3HE MET 46 HE1 MET 46 8.137 -11.545 -0.871 415 H ASN 47 HN ASN 47 1.180 -13.216 0.089 416 HA ASN 47 HA ASN 47 -0.076 -15.052 0.328 417 1HB ASN 47 HB2 ASN 47 1.235 -15.789 -1.787 418 2HB ASN 47 HB1 ASN 47 2.190 -16.779 -0.692 419 1HD2 ASN 47 HD2 ASN 47 1.231 -18.602 0.212 420 2HD2 ASN 47 HD2 ASN 47 -0.275 -19.232 -0.371 421 H VAL 48 HN VAL 48 2.034 -14.106 2.197 422 HA VAL 48 HA VAL 48 2.435 -16.517 3.750 423 HB VAL 48 HB VAL 48 3.875 -15.152 5.270 424 1HG1 VAL 48 3HG1 VAL 48 4.654 -15.168 2.351 425 2HG1 VAL 48 2HG1 VAL 48 5.778 -15.001 3.700 426 3HG1 VAL 48 1HG1 VAL 48 4.861 -16.493 3.495 427 1HG2 VAL 48 1HG2 VAL 48 3.488 -13.038 3.161 428 2HG2 VAL 48 3HG2 VAL 48 2.982 -12.942 4.849 429 3HG2 VAL 48 2HG2 VAL 48 4.702 -12.972 4.437 430 H LYS 49 HN LYS 49 1.176 -17.084 5.186 431 HA LYS 49 HA LYS 49 -0.663 -15.150 6.368 432 1HB LYS 49 HB2 LYS 49 -0.923 -18.157 6.069 433 2HB LYS 49 HB1 LYS 49 -2.144 -17.086 6.751 434 1HG LYS 49 HG2 LYS 49 -2.406 -15.951 4.651 435 2HG LYS 49 HG1 LYS 49 -1.090 -16.877 3.941 436 1HD LYS 49 HD2 LYS 49 -2.451 -18.933 4.255 437 2HD LYS 49 HD1 LYS 49 -3.777 -17.919 4.844 438 1HE LYS 49 HE2 LYS 49 -3.789 -16.696 2.730 439 2HE LYS 49 HE1 LYS 49 -2.465 -17.690 2.137 440 1HZ LYS 49 HZ1 LYS 49 -5.184 -18.658 2.835 441 2HZ LYS 49 HZ3 LYS 49 -4.565 -18.418 1.276 442 3HZ LYS 49 HZ2 LYS 49 -3.911 -19.614 2.266 443 H ASP 50 HN ASP 50 2.100 -15.795 7.037 444 HA ASP 50 HA ASP 50 3.419 -15.731 8.829 445 1HB ASP 50 HB2 ASP 50 1.943 -14.209 9.829 446 2HB ASP 50 HB1 ASP 50 0.787 -15.471 10.230 447 H LYS 51 HN LYS 51 4.563 -17.135 10.132 448 HA LYS 51 HA LYS 51 3.458 -19.812 9.964 449 1HB LYS 51 HB2 LYS 51 5.796 -20.640 10.075 450 2HB LYS 51 HB1 LYS 51 5.428 -19.649 8.671 451 1HG LYS 51 HG2 LYS 51 6.541 -17.765 9.652 452 2HG LYS 51 HG1 LYS 51 6.816 -18.658 11.144 453 1HD LYS 51 HD2 LYS 51 8.858 -18.668 9.962 454 2HD LYS 51 HD1 LYS 51 8.186 -20.278 9.789 455 1HE LYS 51 HE2 LYS 51 7.967 -18.112 7.688 456 2HE LYS 51 HE1 LYS 51 9.243 -19.317 7.718 457 1HZ LYS 51 HZ2 LYS 51 7.390 -21.023 7.559 458 2HZ LYS 51 HZ1 LYS 51 6.340 -19.760 7.211 459 3HZ LYS 51 HZ3 LYS 51 7.644 -20.085 6.204 460 H VAL 52 HN VAL 52 3.316 -17.775 12.295 461 HA VAL 52 HA VAL 52 4.271 -19.674 14.282 462 HB VAL 52 HB VAL 52 3.855 -18.135 16.016 463 1HG1 VAL 52 3HG1 VAL 52 4.978 -16.575 13.740 464 2HG1 VAL 52 2HG1 VAL 52 5.071 -16.094 15.434 465 3HG1 VAL 52 1HG1 VAL 52 5.844 -17.583 14.897 466 1HG2 VAL 52 3HG2 VAL 52 1.641 -17.315 15.444 467 2HG2 VAL 52 2HG2 VAL 52 2.708 -15.956 15.797 468 3HG2 VAL 52 1HG2 VAL 52 2.313 -16.359 14.124 469 H HIS 53 HN HIS 53 2.575 -19.969 16.173 470 HA HIS 53 HA HIS 53 0.517 -21.549 15.152 471 1HB HIS 53 HB2 HIS 53 1.440 -21.758 17.452 472 2HB HIS 53 HB1 HIS 53 0.676 -20.231 17.872 473 HD1 HIS 53 HD1 HIS 53 -1.462 -20.593 19.164 474 HD2 HIS 53 HD2 HIS 53 -0.704 -23.624 16.432 475 HE1 HIS 53 HE1 HIS 53 -3.331 -22.229 19.418 476 H LYS 54 HN LYS 54 -1.536 -21.122 14.521 477 HA LYS 54 HA LYS 54 -2.326 -18.347 14.338 478 1HB LYS 54 HB2 LYS 54 -3.649 -20.881 13.349 479 2HB LYS 54 HB1 LYS 54 -4.212 -19.261 13.022 480 1HG LYS 54 HG2 LYS 54 -1.471 -20.143 12.148 481 2HG LYS 54 HG1 LYS 54 -2.897 -20.529 11.196 482 1HD LYS 54 HD2 LYS 54 -2.095 -18.553 10.212 483 2HD LYS 54 HD1 LYS 54 -3.382 -18.002 11.262 484 1HE LYS 54 HE2 LYS 54 -1.512 -16.513 11.387 485 2HE LYS 54 HE1 LYS 54 -1.665 -17.303 12.942 486 1HZ LYS 54 HZ2 LYS 54 0.280 -18.029 10.808 487 2HZ LYS 54 HZ1 LYS 54 0.627 -17.136 12.162 488 3HZ LYS 54 HZ3 LYS 54 0.207 -18.746 12.345 489 H LEU 55 HN LEU 55 -4.382 -17.602 15.114 490 HA LEU 55 HA LEU 55 -4.882 -18.191 17.736 491 1HB LEU 55 HB2 LEU 55 -5.373 -16.067 16.920 492 2HB LEU 55 HB1 LEU 55 -6.268 -16.693 15.552 493 HG LEU 55 HG LEU 55 -7.962 -17.454 17.033 494 1HD1 LEU 55 HD1 LEU 55 -6.767 -17.621 19.150 495 2HD1 LEU 55 HD1 LEU 55 -6.484 -15.877 19.160 496 3HD1 LEU 55 HD1 LEU 55 -8.119 -16.510 19.351 497 1HD2 LEU 55 HD2 LEU 55 -8.259 -15.398 15.867 498 2HD2 LEU 55 HD2 LEU 55 -8.973 -15.232 17.472 499 3HD2 LEU 55 HD2 LEU 55 -7.404 -14.506 17.121 500 H GLU 56 HN GLU 56 -6.190 -19.548 18.675 501 HA GLU 56 HA GLU 56 -7.217 -21.827 17.415 502 1HB GLU 56 HB2 GLU 56 -7.864 -20.648 20.098 503 2HB GLU 56 HB1 GLU 56 -8.220 -22.292 19.588 504 1HG GLU 56 HG2 GLU 56 -5.935 -22.847 19.475 505 2HG GLU 56 HG1 GLU 56 -5.442 -21.169 19.655 506 H HIS 57 HN HIS 57 -9.252 -22.419 16.888 507 HA HIS 57 HA HIS 57 -11.277 -20.328 16.698 508 1HB HIS 57 HB2 HIS 57 -11.218 -23.156 15.613 509 2HB HIS 57 HB1 HIS 57 -12.560 -22.043 15.413 510 HD1 HIS 57 HD1 HIS 57 -12.351 -20.285 13.535 511 HD2 HIS 57 HD2 HIS 57 -8.907 -22.527 14.141 512 HE1 HIS 57 HE1 HIS 57 -10.843 -19.780 11.600 513 H HIS 58 HN HIS 58 -10.451 -23.232 18.295 514 HA HIS 58 HA HIS 58 -12.740 -22.907 20.084 515 1HB HIS 58 HB2 HIS 58 -12.996 -24.945 18.689 516 2HB HIS 58 HB1 HIS 58 -11.399 -25.478 19.180 517 HD1 HIS 58 HD1 HIS 58 -14.834 -24.841 20.758 518 HD2 HIS 58 HD2 HIS 58 -11.362 -27.047 21.368 519 HE1 HIS 58 HE1 HIS 58 -15.315 -26.370 22.679 520 H HIS 59 HN HIS 59 -11.863 -22.043 21.855 521 HA HIS 59 HA HIS 59 -9.102 -22.529 22.552 522 1HB HIS 59 HB2 HIS 59 -11.263 -21.094 24.132 523 2HB HIS 59 HB1 HIS 59 -9.538 -21.035 24.447 524 HD1 HIS 59 HD1 HIS 59 -12.157 -19.123 22.871 525 HD2 HIS 59 HD2 HIS 59 -8.111 -19.750 22.149 526 HE1 HIS 59 HE1 HIS 59 -11.419 -17.237 21.410 527 H HIS 60 HN HIS 60 -8.451 -24.026 24.002 528 HA HIS 60 HA HIS 60 -10.452 -25.897 24.955 529 1HB HIS 60 HB2 HIS 60 -7.431 -25.976 24.990 530 2HB HIS 60 HB1 HIS 60 -8.426 -27.219 25.738 531 HD1 HIS 60 HD1 HIS 60 -9.001 -29.150 24.222 532 HD2 HIS 60 HD2 HIS 60 -8.055 -25.690 22.132 533 HE1 HIS 60 HE1 HIS 60 -9.060 -29.768 21.786 534 H HIS 61 HN HIS 61 -10.363 -23.295 26.147 535 HA HIS 61 HA HIS 61 -10.399 -24.100 28.891 536 1HB HIS 61 HB2 HIS 61 -8.927 -22.294 29.694 537 2HB HIS 61 HB1 HIS 61 -8.046 -23.382 28.633 538 HD1 HIS 61 HD1 HIS 61 -8.797 -19.844 29.128 539 HD2 HIS 61 HD2 HIS 61 -7.667 -22.268 25.956 540 HE1 HIS 61 HE1 HIS 61 -7.924 -18.298 27.336 541 H HIS 62 HN HIS 62 -11.919 -22.905 29.999 542 HA HIS 62 HA HIS 62 -12.677 -20.349 29.032 543 1HB HIS 62 HB2 HIS 62 -15.139 -20.860 28.897 544 2HB HIS 62 HB1 HIS 62 -14.207 -21.644 27.644 545 HD1 HIS 62 HD1 HIS 62 -16.743 -22.333 30.212 546 HD2 HIS 62 HD2 HIS 62 -13.829 -24.489 28.185 547 HE1 HIS 62 HE1 HIS 62 -17.400 -24.741 30.422 548 H1 MET 101 HT3 MET 101 9.723 21.173 3.508 549 H2 MET 101 HT2 MET 101 11.365 21.167 3.849 550 H3 MET 101 HT1 MET 101 10.717 22.248 2.709 551 HA MET 101 HA MET 101 11.785 20.475 1.522 552 1HB MET 101 HB2 MET 101 11.077 18.176 1.796 553 2HB MET 101 HB1 MET 101 11.498 18.788 3.388 554 1HG MET 101 HG2 MET 101 9.067 19.175 3.810 555 2HG MET 101 HG1 MET 101 8.724 18.402 2.269 556 1HE MET 101 HE1 MET 101 9.810 18.000 5.962 557 2HE MET 101 HE3 MET 101 10.408 16.344 6.018 558 3HE MET 101 HE2 MET 101 11.324 17.577 5.154 559 H GLU 102 HN GLU 102 10.834 19.897 -0.535 560 HA GLU 102 HA GLU 102 8.181 21.028 -0.830 561 1HB GLU 102 HB2 GLU 102 10.218 20.214 -2.914 562 2HB GLU 102 HB1 GLU 102 8.622 20.858 -3.281 563 1HG GLU 102 HG2 GLU 102 10.873 22.271 -1.873 564 2HG GLU 102 HG1 GLU 102 10.216 22.626 -3.470 565 H MET 103 HN MET 103 6.444 19.833 -1.053 566 HA MET 103 HA MET 103 6.735 17.092 -0.608 567 1HB MET 103 HB2 MET 103 4.296 16.865 -0.682 568 2HB MET 103 HB1 MET 103 4.881 18.094 0.412 569 1HG MET 103 HG2 MET 103 2.931 18.799 -0.581 570 2HG MET 103 HG1 MET 103 4.209 19.808 -1.244 571 1HE MET 103 HE3 MET 103 2.259 20.572 -3.005 572 2HE MET 103 HE2 MET 103 1.448 19.458 -4.102 573 3HE MET 103 HE1 MET 103 1.124 19.382 -2.370 574 H GLY 104 HN GLY 104 6.406 18.806 -3.547 575 1HA GLY 104 HA1 GLY 104 6.409 18.049 -5.734 576 2HA GLY 104 HA2 GLY 104 5.521 16.651 -5.149 577 H GLN 105 HN GLN 105 8.727 17.748 -4.198 578 HA GLN 105 HA GLN 105 10.171 15.795 -5.703 579 1HB GLN 105 HB2 GLN 105 11.049 17.326 -3.238 580 2HB GLN 105 HB1 GLN 105 12.087 16.410 -4.319 581 1HG GLN 105 HG2 GLN 105 11.569 17.984 -6.137 582 2HG GLN 105 HG1 GLN 105 10.549 18.905 -5.031 583 1HE2 GLN 105 1HE2 GLN 105 11.850 20.762 -5.256 584 2HE2 GLN 105 2HE2 GLN 105 13.419 20.867 -4.539 585 H LEU 106 HN LEU 106 9.012 16.068 -2.426 586 HA LEU 106 HA LEU 106 10.104 13.747 -1.325 587 1HB LEU 106 HB2 LEU 106 9.230 15.571 0.028 588 2HB LEU 106 HB1 LEU 106 7.644 15.359 -0.657 589 HG LEU 106 HG LEU 106 7.993 14.663 1.763 590 1HD1 LEU 106 HD1 LEU 106 6.824 12.656 -0.139 591 2HD1 LEU 106 HD1 LEU 106 6.534 12.709 1.598 592 3HD1 LEU 106 HD1 LEU 106 6.002 14.041 0.568 593 1HD2 LEU 106 HD2 LEU 106 10.109 13.493 1.512 594 2HD2 LEU 106 HD2 LEU 106 8.867 12.422 2.158 595 3HD2 LEU 106 HD2 LEU 106 9.340 12.295 0.463 596 H LYS 107 HN LYS 107 6.932 14.268 -2.842 597 HA LYS 107 HA LYS 107 5.955 11.641 -2.502 598 1HB LYS 107 HB2 LYS 107 4.945 14.019 -3.487 599 2HB LYS 107 HB1 LYS 107 5.067 13.030 -4.933 600 1HG LYS 107 HG2 LYS 107 3.583 12.241 -2.441 601 2HG LYS 107 HG1 LYS 107 2.839 12.956 -3.863 602 1HD LYS 107 HD2 LYS 107 4.287 10.292 -3.730 603 2HD LYS 107 HD1 LYS 107 2.537 10.513 -3.795 604 1HE LYS 107 HE2 LYS 107 4.542 11.289 -5.884 605 2HE LYS 107 HE1 LYS 107 3.490 9.892 -5.956 606 1HZ LYS 107 HZ3 LYS 107 1.578 11.424 -6.002 607 2HZ LYS 107 HZ2 LYS 107 2.618 12.747 -6.029 608 3HZ LYS 107 HZ1 LYS 107 2.608 11.661 -7.293 609 H ASN 108 HN ASN 108 7.907 13.165 -4.955 610 HA ASN 108 HA ASN 108 7.862 11.168 -6.931 611 1HB ASN 108 HB2 ASN 108 8.684 13.446 -7.358 612 2HB ASN 108 HB1 ASN 108 10.026 13.182 -6.258 613 1HD2 ASN 108 HD2 ASN 108 11.814 12.084 -6.981 614 2HD2 ASN 108 HD2 ASN 108 12.023 11.559 -8.602 615 H LYS 109 HN LYS 109 9.878 11.612 -4.089 616 HA LYS 109 HA LYS 109 11.645 9.416 -4.563 617 1HB LYS 109 HB2 LYS 109 10.901 10.808 -1.983 618 2HB LYS 109 HB1 LYS 109 12.233 9.675 -2.186 619 1HG LYS 109 HG2 LYS 109 13.360 11.197 -3.675 620 2HG LYS 109 HG1 LYS 109 11.966 12.283 -3.654 621 1HD LYS 109 HD2 LYS 109 13.739 13.124 -2.207 622 2HD LYS 109 HD1 LYS 109 12.308 12.689 -1.276 623 1HE LYS 109 HE2 LYS 109 13.357 10.573 -0.643 624 2HE LYS 109 HE1 LYS 109 14.776 10.990 -1.607 625 1HZ LYS 109 HZ1 LYS 109 13.802 12.500 0.759 626 2HZ LYS 109 HZ3 LYS 109 15.106 11.433 0.743 627 3HZ LYS 109 HZ2 LYS 109 15.168 12.861 -0.138 628 H ILE 110 HN ILE 110 8.649 9.878 -2.817 629 HA ILE 110 HA ILE 110 8.417 7.368 -1.614 630 HB ILE 110 HB ILE 110 6.376 9.401 -2.494 631 1HG1 ILE 110 2HG1 ILE 110 7.388 8.499 0.185 632 2HG1 ILE 110 1HG1 ILE 110 7.835 9.984 -0.646 633 1HG2 ILE 110 3HG2 ILE 110 5.242 7.236 -2.625 634 2HG2 ILE 110 2HG2 ILE 110 5.767 6.861 -0.982 635 3HG2 ILE 110 1HG2 ILE 110 4.641 8.188 -1.263 636 1HD1 ILE 110 HD1 ILE 110 5.109 9.269 0.368 637 2HD1 ILE 110 HD1 ILE 110 6.249 10.379 1.138 638 3HD1 ILE 110 HD1 ILE 110 5.558 10.765 -0.443 639 H GLU 111 HN GLU 111 7.275 8.530 -4.714 640 HA GLU 111 HA GLU 111 6.092 6.257 -5.732 641 1HB GLU 111 HB2 GLU 111 7.721 8.387 -7.076 642 2HB GLU 111 HB1 GLU 111 6.911 7.103 -7.965 643 1HG GLU 111 HG2 GLU 111 5.549 9.008 -6.109 644 2HG GLU 111 HG1 GLU 111 5.604 9.210 -7.856 645 H ASN 112 HN ASN 112 9.457 7.205 -6.141 646 HA ASN 112 HA ASN 112 10.373 4.918 -7.399 647 1HB ASN 112 HB2 ASN 112 11.752 6.883 -7.314 648 2HB ASN 112 HB1 ASN 112 11.831 6.819 -5.557 649 1HD2 ASN 112 HD2 ASN 112 13.325 5.493 -4.591 650 2HD2 ASN 112 HD2 ASN 112 14.466 4.546 -5.429 651 H LYS 113 HN LYS 113 10.217 5.621 -3.938 652 HA LYS 113 HA LYS 113 11.564 3.293 -3.079 653 1HB LYS 113 HB2 LYS 113 11.040 5.472 -1.794 654 2HB LYS 113 HB1 LYS 113 9.484 4.743 -1.474 655 1HG LYS 113 HG2 LYS 113 11.018 4.398 0.399 656 2HG LYS 113 HG1 LYS 113 10.552 2.870 -0.348 657 1HD LYS 113 HD2 LYS 113 12.972 3.018 0.193 658 2HD LYS 113 HD1 LYS 113 12.654 2.716 -1.505 659 1HE LYS 113 HE2 LYS 113 12.994 5.047 -1.997 660 2HE LYS 113 HE1 LYS 113 13.325 5.401 -0.287 661 1HZ LYS 113 HZ1 LYS 113 15.236 3.881 -0.477 662 2HZ LYS 113 HZ3 LYS 113 14.843 3.649 -2.123 663 3HZ LYS 113 HZ2 LYS 113 15.337 5.166 -1.588 664 H LYS 114 HN LYS 114 8.165 4.081 -3.367 665 HA LYS 114 HA LYS 114 6.881 1.784 -2.489 666 1HB LYS 114 HB2 LYS 114 5.820 3.917 -3.113 667 2HB LYS 114 HB1 LYS 114 6.240 3.635 -4.789 668 1HG LYS 114 HG2 LYS 114 4.747 1.658 -4.768 669 2HG LYS 114 HG1 LYS 114 4.271 2.075 -3.122 670 1HD LYS 114 HD2 LYS 114 2.593 3.007 -4.531 671 2HD LYS 114 HD1 LYS 114 3.613 4.359 -4.038 672 1HE LYS 114 HE2 LYS 114 4.869 4.061 -6.209 673 2HE LYS 114 HE1 LYS 114 3.629 2.878 -6.627 674 1HZ LYS 114 HZ1 LYS 114 1.947 4.749 -6.393 675 2HZ LYS 114 HZ3 LYS 114 3.246 5.811 -6.212 676 3HZ LYS 114 HZ2 LYS 114 3.052 4.953 -7.608 677 H LYS 115 HN LYS 115 8.084 2.675 -5.607 678 HA LYS 115 HA LYS 115 7.327 0.297 -6.959 679 1HB LYS 115 HB2 LYS 115 9.066 2.622 -7.742 680 2HB LYS 115 HB1 LYS 115 8.740 1.274 -8.831 681 1HG LYS 115 HG2 LYS 115 6.460 1.754 -8.966 682 2HG LYS 115 HG1 LYS 115 6.488 2.725 -7.500 683 1HD LYS 115 HD2 LYS 115 7.591 4.488 -8.590 684 2HD LYS 115 HD1 LYS 115 7.895 3.568 -10.050 685 1HE LYS 115 HE2 LYS 115 5.393 3.413 -10.347 686 2HE LYS 115 HE1 LYS 115 5.201 4.410 -8.913 687 1HZ LYS 115 HZ2 LYS 115 6.366 6.208 -10.103 688 2HZ LYS 115 HZ1 LYS 115 6.466 5.238 -11.474 689 3HZ LYS 115 HZ3 LYS 115 4.973 5.729 -10.879 690 H GLU 116 HN GLU 116 10.404 1.406 -5.617 691 HA GLU 116 HA GLU 116 12.012 -0.769 -6.293 692 1HB GLU 116 HB2 GLU 116 11.941 0.841 -3.727 693 2HB GLU 116 HB1 GLU 116 13.114 -0.435 -4.006 694 1HG GLU 116 HG2 GLU 116 13.926 0.891 -5.953 695 2HG GLU 116 HG1 GLU 116 12.816 2.177 -5.464 696 H LEU 117 HN LEU 117 9.702 -0.406 -3.668 697 HA LEU 117 HA LEU 117 10.139 -2.882 -2.388 698 1HB LEU 117 HB2 LEU 117 9.005 -1.120 -1.248 699 2HB LEU 117 HB1 LEU 117 7.746 -1.079 -2.472 700 HG LEU 117 HG LEU 117 7.430 -3.602 -1.711 701 1HD1 LEU 117 HD1 LEU 117 8.766 -2.584 0.621 702 2HD1 LEU 117 HD1 LEU 117 7.675 -3.999 0.494 703 3HD1 LEU 117 HD1 LEU 117 9.149 -3.926 -0.473 704 1HD2 LEU 117 HD2 LEU 117 5.808 -1.924 -1.685 705 2HD2 LEU 117 HD2 LEU 117 5.761 -2.982 -0.263 706 3HD2 LEU 117 HD2 LEU 117 6.389 -1.309 -0.114 707 H ILE 118 HN ILE 118 7.791 -1.822 -4.795 708 HA ILE 118 HA ILE 118 6.297 -4.152 -4.870 709 HB ILE 118 HB ILE 118 6.768 -2.250 -7.197 710 1HG1 ILE 118 2HG1 ILE 118 4.440 -2.315 -5.275 711 2HG1 ILE 118 1HG1 ILE 118 5.855 -1.308 -5.004 712 1HG2 ILE 118 1HG2 ILE 118 4.596 -4.302 -6.693 713 2HG2 ILE 118 3HG2 ILE 118 4.587 -3.148 -8.031 714 3HG2 ILE 118 2HG2 ILE 118 5.831 -4.397 -7.928 715 1HD1 ILE 118 HD1 ILE 118 4.005 -1.152 -7.373 716 2HD1 ILE 118 HD1 ILE 118 4.023 -0.055 -5.988 717 3HD1 ILE 118 HD1 ILE 118 5.404 -0.122 -7.078 718 H GLN 119 HN GLN 119 9.116 -3.200 -6.772 719 HA GLN 119 HA GLN 119 9.303 -5.466 -8.399 720 1HB GLN 119 HB2 GLN 119 11.483 -3.695 -7.305 721 2HB GLN 119 HB1 GLN 119 11.710 -4.869 -8.593 722 1HG GLN 119 HG2 GLN 119 10.161 -3.653 -10.019 723 2HG GLN 119 HG1 GLN 119 9.827 -2.519 -8.714 724 1HE2 GLN 119 1HE2 GLN 119 12.617 -2.427 -7.866 725 2HE2 GLN 119 2HE2 GLN 119 13.457 -1.497 -9.043 726 H LEU 120 HN LEU 120 10.393 -4.882 -5.127 727 HA LEU 120 HA LEU 120 11.846 -7.275 -4.799 728 1HB LEU 120 HB2 LEU 120 10.819 -5.162 -3.000 729 2HB LEU 120 HB1 LEU 120 11.086 -6.744 -2.308 730 HG LEU 120 HG LEU 120 13.428 -6.655 -2.685 731 1HD1 LEU 120 HD1 LEU 120 12.964 -4.136 -4.231 732 2HD1 LEU 120 HD1 LEU 120 14.515 -4.847 -3.769 733 3HD1 LEU 120 HD1 LEU 120 13.461 -5.712 -4.905 734 1HD2 LEU 120 HD2 LEU 120 12.442 -3.975 -1.784 735 2HD2 LEU 120 HD2 LEU 120 12.691 -5.415 -0.794 736 3HD2 LEU 120 HD2 LEU 120 14.068 -4.611 -1.537 737 H VAL 121 HN VAL 121 8.424 -6.460 -3.643 738 HA VAL 121 HA VAL 121 8.006 -9.067 -2.802 739 HB VAL 121 HB VAL 121 5.840 -8.442 -2.382 740 1HG1 VAL 121 3HG1 VAL 121 7.226 -7.102 -1.088 741 2HG1 VAL 121 2HG1 VAL 121 7.273 -5.871 -2.364 742 3HG1 VAL 121 1HG1 VAL 121 5.757 -6.220 -1.527 743 1HG2 VAL 121 3HG2 VAL 121 5.161 -8.009 -4.606 744 2HG2 VAL 121 2HG2 VAL 121 4.545 -6.763 -3.494 745 3HG2 VAL 121 1HG2 VAL 121 5.928 -6.410 -4.567 746 H ALA 122 HN ALA 122 7.809 -7.603 -5.936 747 HA ALA 122 HA ALA 122 6.205 -9.594 -7.147 748 1HB ALA 122 HB3 ALA 122 6.773 -8.553 -9.259 749 2HB ALA 122 HB2 ALA 122 6.438 -7.324 -8.036 750 3HB ALA 122 HB1 ALA 122 8.103 -7.679 -8.484 751 H ARG 123 HN ARG 123 9.714 -9.053 -6.978 752 HA ARG 123 HA ARG 123 10.348 -11.242 -8.652 753 1HB ARG 123 HB2 ARG 123 12.641 -10.980 -7.968 754 2HB ARG 123 HB1 ARG 123 11.939 -9.395 -8.257 755 1HG ARG 123 HG2 ARG 123 11.704 -9.102 -5.835 756 2HG ARG 123 HG1 ARG 123 12.454 -10.670 -5.564 757 1HD ARG 123 HD2 ARG 123 13.686 -8.230 -6.841 758 2HD ARG 123 HD1 ARG 123 14.152 -8.999 -5.322 759 HE ARG 123 HE ARG 123 14.436 -10.959 -7.169 760 1HH1 ARG 123 1HH1 ARG 123 15.881 -7.784 -6.650 761 2HH1 ARG 123 2HH1 ARG 123 17.232 -8.060 -7.637 762 1HH2 ARG 123 1HH2 ARG 123 16.276 -11.361 -8.572 763 2HH2 ARG 123 2HH2 ARG 123 17.449 -10.136 -8.779 764 H HIS 124 HN HIS 124 9.377 -11.073 -5.441 765 HA HIS 124 HA HIS 124 10.311 -13.444 -4.327 766 1HB HIS 124 HB2 HIS 124 9.055 -11.923 -2.956 767 2HB HIS 124 HB1 HIS 124 7.718 -11.925 -4.073 768 HD1 HIS 124 HD1 HIS 124 5.815 -13.465 -3.544 769 HD2 HIS 124 HD2 HIS 124 9.281 -14.483 -1.498 770 HE1 HIS 124 HE1 HIS 124 5.187 -15.353 -2.019 771 H GLY 125 HN GLY 125 7.869 -12.834 -6.736 772 1HA GLY 125 HA1 GLY 125 7.303 -15.698 -6.870 773 2HA GLY 125 HA2 GLY 125 7.788 -14.823 -8.310 774 H LEU 126 HN LEU 126 6.276 -12.417 -7.798 775 HA LEU 126 HA LEU 126 3.576 -13.298 -7.478 776 1HB LEU 126 HB2 LEU 126 4.782 -10.667 -8.170 777 2HB LEU 126 HB1 LEU 126 3.069 -10.905 -8.272 778 HG LEU 126 HG LEU 126 4.829 -10.969 -5.914 779 1HD1 LEU 126 HD1 LEU 126 2.422 -9.301 -6.576 780 2HD1 LEU 126 HD1 LEU 126 3.289 -9.254 -5.039 781 3HD1 LEU 126 HD1 LEU 126 4.106 -8.777 -6.525 782 1HD2 LEU 126 HD2 LEU 126 2.017 -12.004 -6.057 783 2HD2 LEU 126 HD2 LEU 126 3.476 -12.815 -5.496 784 3HD2 LEU 126 HD2 LEU 126 2.796 -11.513 -4.548 785 H ASP 127 HN ASP 127 2.076 -13.452 -8.878 786 HA ASP 127 HA ASP 127 2.593 -14.036 -11.629 787 1HB ASP 127 HB2 ASP 127 -0.072 -13.206 -10.409 788 2HB ASP 127 HB1 ASP 127 0.178 -14.101 -11.887 789 H HIS 128 HN HIS 128 1.626 -12.643 -13.411 790 HA HIS 128 HA HIS 128 2.589 -10.011 -13.260 791 1HB HIS 128 HB2 HIS 128 0.501 -11.099 -15.164 792 2HB HIS 128 HB1 HIS 128 1.346 -9.574 -15.363 793 HD1 HIS 128 HD1 HIS 128 1.475 -12.963 -16.505 794 HD2 HIS 128 HD2 HIS 128 4.305 -10.095 -15.496 795 HE1 HIS 128 HE1 HIS 128 3.596 -13.647 -17.660 796 H ASP 129 HN ASP 129 -0.675 -11.268 -12.892 797 HA ASP 129 HA ASP 129 -1.984 -8.790 -12.582 798 1HB ASP 129 HB2 ASP 129 -2.759 -11.489 -11.467 799 2HB ASP 129 HB1 ASP 129 -3.775 -10.061 -11.401 800 H LYS 130 HN LYS 130 -0.299 -10.840 -10.372 801 HA LYS 130 HA LYS 130 -1.262 -9.747 -7.957 802 1HB LYS 130 HB2 LYS 130 1.277 -11.152 -8.653 803 2HB LYS 130 HB1 LYS 130 0.919 -10.743 -7.001 804 1HG LYS 130 HG2 LYS 130 -0.829 -12.427 -8.786 805 2HG LYS 130 HG1 LYS 130 0.399 -13.097 -7.710 806 1HD LYS 130 HD2 LYS 130 -0.841 -12.207 -5.801 807 2HD LYS 130 HD1 LYS 130 -2.018 -11.481 -6.897 808 1HE LYS 130 HE2 LYS 130 -2.795 -13.632 -5.936 809 2HE LYS 130 HE1 LYS 130 -2.710 -13.641 -7.690 810 1HZ LYS 130 HZ3 LYS 130 -0.673 -14.811 -5.865 811 2HZ LYS 130 HZ2 LYS 130 -1.817 -15.692 -6.717 812 3HZ LYS 130 HZ1 LYS 130 -0.612 -14.871 -7.547 813 H VAL 131 HN VAL 131 1.571 -9.008 -9.929 814 HA VAL 131 HA VAL 131 2.653 -6.999 -8.268 815 HB VAL 131 HB VAL 131 2.852 -7.066 -11.285 816 1HG1 VAL 131 1HG1 VAL 131 3.762 -5.072 -10.303 817 2HG1 VAL 131 3HG1 VAL 131 4.765 -6.035 -9.216 818 3HG1 VAL 131 2HG1 VAL 131 5.053 -6.081 -10.955 819 1HG2 VAL 131 1HG2 VAL 131 4.472 -8.649 -9.301 820 2HG2 VAL 131 3HG2 VAL 131 3.337 -9.288 -10.493 821 3HG2 VAL 131 2HG2 VAL 131 4.827 -8.505 -11.024 822 H LEU 132 HN LEU 132 0.408 -6.923 -10.963 823 HA LEU 132 HA LEU 132 0.126 -4.111 -11.123 824 1HB LEU 132 HB2 LEU 132 -1.764 -6.265 -12.027 825 2HB LEU 132 HB1 LEU 132 -1.812 -4.584 -12.520 826 HG LEU 132 HG LEU 132 0.389 -6.552 -13.143 827 1HD1 LEU 132 HD1 LEU 132 -1.704 -5.296 -14.870 828 2HD1 LEU 132 HD1 LEU 132 -0.349 -6.278 -15.446 829 3HD1 LEU 132 HD1 LEU 132 -1.579 -6.996 -14.405 830 1HD2 LEU 132 HD2 LEU 132 0.090 -3.650 -13.921 831 2HD2 LEU 132 HD2 LEU 132 1.325 -4.351 -12.867 832 3HD2 LEU 132 HD2 LEU 132 1.290 -4.768 -14.576 833 H LEU 133 HN LEU 133 -1.868 -6.583 -9.549 834 HA LEU 133 HA LEU 133 -3.770 -4.728 -8.580 835 1HB LEU 133 HB2 LEU 133 -3.086 -7.478 -7.572 836 2HB LEU 133 HB1 LEU 133 -4.471 -6.536 -7.060 837 HG LEU 133 HG LEU 133 -3.987 -7.581 -9.856 838 1HD1 LEU 133 HD1 LEU 133 -4.494 -9.357 -8.288 839 2HD1 LEU 133 HD1 LEU 133 -5.918 -8.475 -7.729 840 3HD1 LEU 133 HD1 LEU 133 -5.850 -9.082 -9.385 841 1HD2 LEU 133 HD2 LEU 133 -6.364 -6.134 -8.678 842 2HD2 LEU 133 HD2 LEU 133 -5.243 -5.482 -9.873 843 3HD2 LEU 133 HD2 LEU 133 -6.286 -6.839 -10.292 844 H PHE 134 HN PHE 134 -0.838 -6.109 -7.179 845 HA PHE 134 HA PHE 134 -1.181 -4.994 -4.630 846 1HB PHE 134 HB2 PHE 134 0.417 -6.780 -4.960 847 2HB PHE 134 HB1 PHE 134 1.342 -5.804 -6.090 848 HD1 PHE 134 HD1 PHE 134 0.261 -5.971 -2.544 849 HD2 PHE 134 HD2 PHE 134 3.094 -4.472 -5.336 850 HE1 PHE 134 HE1 PHE 134 1.640 -5.140 -0.695 851 HE2 PHE 134 HE2 PHE 134 4.480 -3.640 -3.488 852 HZ PHE 134 HZ PHE 134 3.764 -3.966 -1.176 853 H SER 135 HN SER 135 0.638 -3.811 -7.453 854 HA SER 135 HA SER 135 1.681 -1.567 -6.218 855 1HB SER 135 HB2 SER 135 1.974 -0.687 -8.575 856 2HB SER 135 HB1 SER 135 2.628 -2.296 -8.265 857 HG SER 135 HG SER 135 1.079 -3.199 -9.384 858 H ARG 136 HN ARG 136 -1.349 -1.871 -8.008 859 HA ARG 136 HA ARG 136 -1.940 0.897 -7.740 860 1HB ARG 136 HB2 ARG 136 -4.138 0.379 -8.666 861 2HB ARG 136 HB1 ARG 136 -2.850 -0.359 -9.610 862 1HG ARG 136 HG2 ARG 136 -3.336 -2.488 -8.356 863 2HG ARG 136 HG1 ARG 136 -4.766 -1.675 -7.715 864 1HD ARG 136 HD2 ARG 136 -4.136 -2.140 -10.626 865 2HD ARG 136 HD1 ARG 136 -5.308 -3.030 -9.664 866 HE ARG 136 HE ARG 136 -6.008 -0.376 -9.454 867 1HH1 ARG 136 1HH1 ARG 136 -5.752 -2.726 -12.100 868 2HH1 ARG 136 2HH1 ARG 136 -6.989 -2.022 -13.034 869 1HH2 ARG 136 1HH2 ARG 136 -7.694 0.589 -10.737 870 2HH2 ARG 136 2HH2 ARG 136 -8.134 -0.108 -12.216 871 H ASP 137 HN ASP 137 -2.682 -1.896 -5.739 872 HA ASP 137 HA ASP 137 -4.674 -0.489 -4.179 873 1HB ASP 137 HB2 ASP 137 -4.453 -3.047 -4.424 874 2HB ASP 137 HB1 ASP 137 -3.115 -2.932 -3.298 875 H LEU 138 HN LEU 138 -1.295 -1.339 -3.877 876 HA LEU 138 HA LEU 138 -0.697 -0.163 -1.424 877 1HB LEU 138 HB2 LEU 138 0.900 -1.583 -2.442 878 2HB LEU 138 HB1 LEU 138 0.880 -0.677 -3.932 879 HG LEU 138 HG LEU 138 2.132 1.135 -2.872 880 1HD1 LEU 138 HD1 LEU 138 1.294 0.925 -0.612 881 2HD1 LEU 138 HD1 LEU 138 2.153 -0.612 -0.430 882 3HD1 LEU 138 HD1 LEU 138 3.057 0.891 -0.673 883 1HD2 LEU 138 HD2 LEU 138 3.345 -1.578 -2.443 884 2HD2 LEU 138 HD2 LEU 138 3.347 -0.651 -3.943 885 3HD2 LEU 138 HD2 LEU 138 4.232 -0.059 -2.541 886 H ASP 139 HN ASP 139 -0.644 1.134 -4.689 887 HA ASP 139 HA ASP 139 0.262 3.696 -4.084 888 1HB ASP 139 HB2 ASP 139 0.165 2.799 -6.364 889 2HB ASP 139 HB1 ASP 139 -1.594 2.862 -6.306 890 H LYS 140 HN LYS 140 -3.051 2.448 -4.257 891 HA LYS 140 HA LYS 140 -4.210 4.992 -3.797 892 1HB LYS 140 HB2 LYS 140 -6.279 3.949 -3.731 893 2HB LYS 140 HB1 LYS 140 -5.302 2.945 -4.828 894 1HG LYS 140 HG2 LYS 140 -5.012 1.315 -3.075 895 2HG LYS 140 HG1 LYS 140 -5.962 2.310 -1.975 896 1HD LYS 140 HD2 LYS 140 -7.882 2.120 -3.536 897 2HD LYS 140 HD1 LYS 140 -6.920 1.023 -4.528 898 1HE LYS 140 HE2 LYS 140 -6.688 -0.480 -2.601 899 2HE LYS 140 HE1 LYS 140 -7.696 0.610 -1.655 900 1HZ LYS 140 HZ2 LYS 140 -8.560 -0.822 -4.105 901 2HZ LYS 140 HZ1 LYS 140 -8.959 -1.249 -2.528 902 3HZ LYS 140 HZ3 LYS 140 -9.518 0.197 -3.168 903 H LEU 141 HN LEU 141 -3.181 2.405 -1.705 904 HA LEU 141 HA LEU 141 -4.305 3.347 0.696 905 1HB LEU 141 HB2 LEU 141 -3.445 1.093 0.456 906 2HB LEU 141 HB1 LEU 141 -1.836 1.703 0.161 907 HG LEU 141 HG LEU 141 -1.740 2.566 2.469 908 1HD1 LEU 141 HD1 LEU 141 -4.403 1.204 2.812 909 2HD1 LEU 141 HD1 LEU 141 -3.401 1.863 4.106 910 3HD1 LEU 141 HD1 LEU 141 -4.080 2.940 2.888 911 1HD2 LEU 141 HD2 LEU 141 -0.830 0.381 1.945 912 2HD2 LEU 141 HD2 LEU 141 -1.522 0.395 3.569 913 3HD2 LEU 141 HD2 LEU 141 -2.402 -0.364 2.242 914 H ILE 142 HN ILE 142 -1.399 3.989 -1.023 915 HA ILE 142 HA ILE 142 -0.198 5.574 1.038 916 HB ILE 142 HB ILE 142 0.445 5.353 -1.923 917 1HG1 ILE 142 2HG1 ILE 142 1.845 4.394 0.561 918 2HG1 ILE 142 1HG1 ILE 142 0.942 3.387 -0.567 919 1HG2 ILE 142 1HG2 ILE 142 1.948 6.923 0.176 920 2HG2 ILE 142 3HG2 ILE 142 2.519 6.594 -1.460 921 3HG2 ILE 142 2HG2 ILE 142 1.085 7.591 -1.217 922 1HD1 ILE 142 HD1 ILE 142 3.474 4.892 -1.163 923 2HD1 ILE 142 HD1 ILE 142 3.340 3.157 -0.867 924 3HD1 ILE 142 HD1 ILE 142 2.587 3.873 -2.293 925 H ASN 143 HN ASN 143 -1.735 6.406 -1.979 926 HA ASN 143 HA ASN 143 -1.901 9.161 -1.731 927 1HB ASN 143 HB2 ASN 143 -3.762 7.214 -3.063 928 2HB ASN 143 HB1 ASN 143 -4.117 8.938 -3.024 929 1HD2 ASN 143 HD2 ASN 143 -1.919 6.506 -4.235 930 2HD2 ASN 143 HD2 ASN 143 -1.216 7.481 -5.453 931 H LYS 144 HN LYS 144 -4.035 6.751 -0.349 932 HA LYS 144 HA LYS 144 -6.030 8.336 0.755 933 1HB LYS 144 HB2 LYS 144 -6.067 5.888 0.796 934 2HB LYS 144 HB1 LYS 144 -4.710 5.876 1.909 935 1HG LYS 144 HG2 LYS 144 -6.131 7.093 3.555 936 2HG LYS 144 HG1 LYS 144 -7.489 6.890 2.450 937 1HD LYS 144 HD2 LYS 144 -5.879 4.673 3.727 938 2HD LYS 144 HD1 LYS 144 -7.503 5.175 4.196 939 1HE LYS 144 HE2 LYS 144 -8.267 4.589 1.906 940 2HE LYS 144 HE1 LYS 144 -6.658 3.964 1.573 941 1HZ LYS 144 HZ1 LYS 144 -8.457 2.979 3.711 942 2HZ LYS 144 HZ3 LYS 144 -8.190 2.215 2.236 943 3HZ LYS 144 HZ2 LYS 144 -6.934 2.355 3.347 944 H PHE 145 HN PHE 145 -3.020 7.238 2.263 945 HA PHE 145 HA PHE 145 -3.473 8.841 4.533 946 1HB PHE 145 HB2 PHE 145 -1.259 7.032 3.696 947 2HB PHE 145 HB1 PHE 145 -1.043 8.085 5.089 948 HD1 PHE 145 HD1 PHE 145 -3.002 5.264 3.718 949 HD2 PHE 145 HD2 PHE 145 -2.230 7.714 7.117 950 HE1 PHE 145 HE1 PHE 145 -4.235 3.692 5.136 951 HE2 PHE 145 HE2 PHE 145 -3.464 6.142 8.526 952 HZ PHE 145 HZ PHE 145 -4.471 4.124 7.537 953 H MET 146 HN MET 146 -1.838 9.320 1.564 954 HA MET 146 HA MET 146 -0.244 11.524 2.479 955 1HB MET 146 HB2 MET 146 -0.968 10.780 -0.346 956 2HB MET 146 HB1 MET 146 0.252 11.957 0.113 957 1HG MET 146 HG2 MET 146 1.148 9.756 1.422 958 2HG MET 146 HG1 MET 146 0.281 9.033 0.101 959 1HE MET 146 HE3 MET 146 3.160 11.285 1.146 960 2HE MET 146 HE2 MET 146 3.793 11.924 -0.368 961 3HE MET 146 HE1 MET 146 2.209 12.441 0.219 962 H ASN 147 HN ASN 147 -3.450 11.167 2.014 963 HA ASN 147 HA ASN 147 -5.247 12.545 2.024 964 1HB ASN 147 HB2 ASN 147 -3.735 13.931 3.574 965 2HB ASN 147 HB1 ASN 147 -3.320 14.901 2.168 966 1HD2 ASN 147 HD2 ASN 147 -4.804 16.388 1.441 967 2HD2 ASN 147 HD2 ASN 147 -6.241 16.801 2.299 968 H VAL 148 HN VAL 148 -4.037 11.660 -0.385 969 HA VAL 148 HA VAL 148 -4.506 13.861 -2.242 970 HB VAL 148 HB VAL 148 -3.559 11.073 -2.864 971 1HG1 VAL 148 3HG1 VAL 148 -3.588 13.584 -4.554 972 2HG1 VAL 148 2HG1 VAL 148 -2.886 12.041 -5.049 973 3HG1 VAL 148 1HG1 VAL 148 -4.619 12.169 -4.763 974 1HG2 VAL 148 2HG2 VAL 148 -1.899 12.249 -1.485 975 2HG2 VAL 148 1HG2 VAL 148 -1.301 12.020 -3.135 976 3HG2 VAL 148 3HG2 VAL 148 -1.910 13.592 -2.621 977 H LYS 149 HN LYS 149 -6.402 14.131 -2.648 978 HA LYS 149 HA LYS 149 -8.132 11.911 -3.392 979 1HB LYS 149 HB2 LYS 149 -9.986 13.254 -2.226 980 2HB LYS 149 HB1 LYS 149 -8.857 12.367 -1.207 981 1HG LYS 149 HG2 LYS 149 -7.606 14.384 -0.794 982 2HG LYS 149 HG1 LYS 149 -8.693 15.315 -1.826 983 1HD LYS 149 HD2 LYS 149 -9.269 15.653 0.505 984 2HD LYS 149 HD1 LYS 149 -10.564 14.764 -0.291 985 1HE LYS 149 HE2 LYS 149 -9.713 12.671 0.657 986 2HE LYS 149 HE1 LYS 149 -8.382 13.546 1.417 987 1HZ LYS 149 HZ1 LYS 149 -10.027 14.776 2.711 988 2HZ LYS 149 HZ3 LYS 149 -11.275 13.870 2.016 989 3HZ LYS 149 HZ2 LYS 149 -10.125 13.120 2.997 990 H ASP 150 HN ASP 150 -6.500 13.944 -4.720 991 HA ASP 150 HA ASP 150 -8.407 15.747 -5.927 992 1HB ASP 150 HB2 ASP 150 -5.429 15.397 -6.373 993 2HB ASP 150 HB1 ASP 150 -6.423 16.555 -7.252 994 H LYS 151 HN LYS 151 -9.745 14.567 -7.054 995 HA LYS 151 HA LYS 151 -8.900 12.403 -8.755 996 1HB LYS 151 HB2 LYS 151 -11.274 12.143 -9.273 997 2HB LYS 151 HB1 LYS 151 -11.003 12.251 -7.543 998 1HG LYS 151 HG2 LYS 151 -11.697 14.582 -7.542 999 2HG LYS 151 HG1 LYS 151 -11.918 14.532 -9.283 1000 1HD LYS 151 HD2 LYS 151 -13.470 12.782 -7.364 1001 2HD LYS 151 HD1 LYS 151 -13.991 14.381 -7.859 1002 1HE LYS 151 HE2 LYS 151 -15.170 12.808 -9.234 1003 2HE LYS 151 HE1 LYS 151 -13.964 13.583 -10.236 1004 1HZ LYS 151 HZ3 LYS 151 -13.680 10.862 -9.044 1005 2HZ LYS 151 HZ2 LYS 151 -14.170 11.187 -10.609 1006 3HZ LYS 151 HZ1 LYS 151 -12.614 11.569 -10.144 1007 H VAL 152 HN VAL 152 -8.557 15.426 -9.187 1008 HA VAL 152 HA VAL 152 -9.716 15.651 -11.824 1009 HB VAL 152 HB VAL 152 -8.877 18.057 -11.790 1010 1HG1 VAL 152 2HG1 VAL 152 -10.782 17.174 -9.619 1011 2HG1 VAL 152 1HG1 VAL 152 -10.665 18.805 -10.278 1012 3HG1 VAL 152 3HG1 VAL 152 -11.195 17.476 -11.308 1013 1HG2 VAL 152 3HG2 VAL 152 -7.134 17.796 -10.065 1014 2HG2 VAL 152 2HG2 VAL 152 -8.314 19.020 -9.599 1015 3HG2 VAL 152 1HG2 VAL 152 -8.374 17.414 -8.872 1016 H HIS 153 HN HIS 153 -8.614 14.443 -13.168 1017 HA HIS 153 HA HIS 153 -5.757 14.859 -13.457 1018 1HB HIS 153 HB2 HIS 153 -7.684 13.026 -14.899 1019 2HB HIS 153 HB1 HIS 153 -6.008 13.210 -15.402 1020 HD1 HIS 153 HD1 HIS 153 -7.912 10.861 -13.606 1021 HD2 HIS 153 HD2 HIS 153 -4.318 12.806 -12.860 1022 HE1 HIS 153 HE1 HIS 153 -6.682 9.435 -11.944 1023 H LYS 154 HN LYS 154 -8.680 15.820 -14.704 1024 HA LYS 154 HA LYS 154 -7.375 17.623 -16.634 1025 1HB LYS 154 HB2 LYS 154 -10.195 16.516 -16.597 1026 2HB LYS 154 HB1 LYS 154 -9.677 17.852 -17.610 1027 1HG LYS 154 HG2 LYS 154 -8.129 16.376 -18.782 1028 2HG LYS 154 HG1 LYS 154 -8.621 15.029 -17.750 1029 1HD LYS 154 HD2 LYS 154 -9.766 15.002 -19.956 1030 2HD LYS 154 HD1 LYS 154 -10.892 15.159 -18.607 1031 1HE LYS 154 HE2 LYS 154 -11.068 17.554 -18.999 1032 2HE LYS 154 HE1 LYS 154 -9.883 17.454 -20.301 1033 1HZ LYS 154 HZ2 LYS 154 -12.516 16.066 -20.324 1034 2HZ LYS 154 HZ1 LYS 154 -12.206 17.562 -21.029 1035 3HZ LYS 154 HZ3 LYS 154 -11.422 16.197 -21.598 1036 H LEU 155 HN LEU 155 -8.824 19.709 -16.785 1037 HA LEU 155 HA LEU 155 -9.213 20.490 -14.055 1038 1HB LEU 155 HB2 LEU 155 -9.564 22.787 -14.891 1039 2HB LEU 155 HB1 LEU 155 -8.049 22.107 -15.407 1040 HG LEU 155 HG LEU 155 -9.175 21.697 -17.673 1041 1HD1 LEU 155 HD1 LEU 155 -11.209 23.595 -16.540 1042 2HD1 LEU 155 HD1 LEU 155 -11.071 23.122 -18.234 1043 3HD1 LEU 155 HD1 LEU 155 -11.490 21.921 -17.012 1044 1HD2 LEU 155 HD2 LEU 155 -8.791 24.514 -16.687 1045 2HD2 LEU 155 HD2 LEU 155 -7.537 23.438 -17.307 1046 3HD2 LEU 155 HD2 LEU 155 -8.817 24.011 -18.378 1047 H GLU 156 HN GLU 156 -11.040 21.388 -13.219 1048 HA GLU 156 HA GLU 156 -13.535 21.483 -14.497 1049 1HB GLU 156 HB2 GLU 156 -13.356 18.963 -14.029 1050 2HB GLU 156 HB1 GLU 156 -13.299 19.370 -12.316 1051 1HG GLU 156 HG2 GLU 156 -15.497 20.407 -12.464 1052 2HG GLU 156 HG1 GLU 156 -15.552 20.076 -14.188 1053 H HIS 157 HN HIS 157 -11.837 20.940 -11.459 1054 HA HIS 157 HA HIS 157 -13.081 23.116 -10.095 1055 1HB HIS 157 HB2 HIS 157 -10.303 21.915 -9.727 1056 2HB HIS 157 HB1 HIS 157 -11.040 23.081 -8.647 1057 HD1 HIS 157 HD1 HIS 157 -10.087 20.370 -7.535 1058 HD2 HIS 157 HD2 HIS 157 -13.946 21.123 -8.888 1059 HE1 HIS 157 HE1 HIS 157 -11.580 18.691 -6.392 1060 H HIS 158 HN HIS 158 -12.381 25.252 -10.137 1061 HA HIS 158 HA HIS 158 -10.987 25.807 -12.523 1062 1HB HIS 158 HB2 HIS 158 -12.307 27.669 -10.567 1063 2HB HIS 158 HB1 HIS 158 -11.417 28.236 -11.978 1064 HD1 HIS 158 HD1 HIS 158 -14.748 27.940 -11.150 1065 HD2 HIS 158 HD2 HIS 158 -12.508 26.397 -14.285 1066 HE1 HIS 158 HE1 HIS 158 -16.388 27.391 -12.974 1067 H HIS 159 HN HIS 159 -9.052 25.145 -12.332 1068 HA HIS 159 HA HIS 159 -7.144 26.274 -10.476 1069 1HB HIS 159 HB2 HIS 159 -6.681 24.917 -13.170 1070 2HB HIS 159 HB1 HIS 159 -5.438 25.233 -11.974 1071 HD1 HIS 159 HD1 HIS 159 -6.932 22.402 -13.235 1072 HD2 HIS 159 HD2 HIS 159 -6.624 23.875 -9.356 1073 HE1 HIS 159 HE1 HIS 159 -7.309 20.450 -11.724 1074 H HIS 160 HN HIS 160 -8.701 27.038 -13.353 1075 HA HIS 160 HA HIS 160 -8.266 29.729 -13.366 1076 1HB HIS 160 HB2 HIS 160 -6.945 30.066 -15.408 1077 2HB HIS 160 HB1 HIS 160 -5.974 29.099 -14.311 1078 HD1 HIS 160 HD1 HIS 160 -7.393 29.114 -17.725 1079 HD2 HIS 160 HD2 HIS 160 -5.777 26.333 -15.087 1080 HE1 HIS 160 HE1 HIS 160 -6.861 27.069 -19.102 1081 H HIS 161 HN HIS 161 -9.512 30.566 -15.262 1082 HA HIS 161 HA HIS 161 -10.994 28.483 -16.651 1083 1HB HIS 161 HB2 HIS 161 -12.444 29.344 -14.786 1084 2HB HIS 161 HB1 HIS 161 -12.306 30.961 -15.468 1085 HD1 HIS 161 HD1 HIS 161 -13.987 27.638 -16.060 1086 HD2 HIS 161 HD2 HIS 161 -13.933 31.468 -17.662 1087 HE1 HIS 161 HE1 HIS 161 -15.889 27.736 -17.695 1088 H HIS 162 HN HIS 162 -9.899 28.749 -18.475 1089 HA HIS 162 HA HIS 162 -10.151 31.309 -19.834 1090 1HB HIS 162 HB2 HIS 162 -7.646 29.597 -19.726 1091 2HB HIS 162 HB1 HIS 162 -7.884 30.908 -20.868 1092 HD1 HIS 162 HD1 HIS 162 -5.717 30.600 -18.348 1093 HD2 HIS 162 HD2 HIS 162 -8.975 33.161 -18.739 1094 HE1 HIS 162 HE1 HIS 162 -5.280 32.525 -16.813 No H/Q in entry = 1094 Start of MODEL 23 1 H1 MET 1 HT2 MET 1 15.777 -15.747 -4.074 2 H2 MET 1 HT1 MET 1 16.822 -14.705 -3.296 3 H3 MET 1 HT3 MET 1 17.031 -15.057 -4.945 4 HA MET 1 HA MET 1 17.418 -17.384 -4.383 5 1HB MET 1 HB2 MET 1 19.220 -15.505 -2.844 6 2HB MET 1 HB1 MET 1 19.585 -17.188 -3.169 7 1HG MET 1 HG2 MET 1 19.540 -16.715 -5.583 8 2HG MET 1 HG1 MET 1 19.237 -15.018 -5.222 9 1HE MET 1 HE1 MET 1 20.984 -13.420 -4.006 10 2HE MET 1 HE3 MET 1 21.126 -14.540 -2.650 11 3HE MET 1 HE2 MET 1 22.574 -13.945 -3.458 12 H GLU 2 HN GLU 2 17.312 -15.517 -1.311 13 HA GLU 2 HA GLU 2 16.293 -17.975 -0.108 14 1HB GLU 2 HB2 GLU 2 18.704 -17.167 0.478 15 2HB GLU 2 HB1 GLU 2 17.909 -15.861 1.332 16 1HG GLU 2 HG2 GLU 2 17.529 -18.796 1.928 17 2HG GLU 2 HG1 GLU 2 18.645 -17.740 2.775 18 H MET 3 HN MET 3 14.269 -17.678 0.455 19 HA MET 3 HA MET 3 12.971 -15.225 0.061 20 1HB MET 3 HB2 MET 3 11.929 -17.750 1.324 21 2HB MET 3 HB1 MET 3 10.933 -16.350 0.956 22 1HG MET 3 HG2 MET 3 12.478 -18.003 -1.023 23 2HG MET 3 HG1 MET 3 10.731 -18.008 -0.789 24 1HE MET 3 HE3 MET 3 10.509 -17.648 -3.434 25 2HE MET 3 HE2 MET 3 11.229 -16.291 -4.300 26 3HE MET 3 HE1 MET 3 12.258 -17.545 -3.613 27 H GLY 4 HN GLY 4 14.282 -16.615 2.967 28 1HA GLY 4 HA1 GLY 4 14.378 -15.789 5.095 29 2HA GLY 4 HA2 GLY 4 12.845 -14.976 4.784 30 H GLN 5 HN GLN 5 15.987 -14.736 3.216 31 HA GLN 5 HA GLN 5 16.705 -12.243 4.309 32 1HB GLN 5 HB2 GLN 5 17.564 -13.334 1.627 33 2HB GLN 5 HB1 GLN 5 18.351 -12.056 2.538 34 1HG GLN 5 HG2 GLN 5 18.863 -13.668 4.313 35 2HG GLN 5 HG1 GLN 5 18.144 -14.947 3.340 36 1HE2 GLN 5 1HE2 GLN 5 20.819 -14.746 4.300 37 2HE2 GLN 5 2HE2 GLN 5 21.862 -14.773 2.931 38 H LEU 6 HN LEU 6 15.117 -13.145 1.345 39 HA LEU 6 HA LEU 6 14.720 -10.656 0.198 40 1HB LEU 6 HB2 LEU 6 14.365 -12.749 -0.987 41 2HB LEU 6 HB1 LEU 6 13.093 -13.196 0.114 42 HG LEU 6 HG LEU 6 12.431 -12.540 -2.248 43 1HD1 LEU 6 HD1 LEU 6 11.114 -11.132 0.048 44 2HD1 LEU 6 HD1 LEU 6 10.401 -11.375 -1.549 45 3HD1 LEU 6 HD1 LEU 6 10.786 -12.761 -0.529 46 1HD2 LEU 6 HD2 LEU 6 13.846 -10.573 -2.505 47 2HD2 LEU 6 HD2 LEU 6 12.147 -10.141 -2.700 48 3HD2 LEU 6 HD2 LEU 6 12.982 -9.766 -1.194 49 H LYS 7 HN LYS 7 12.688 -12.390 2.528 50 HA LYS 7 HA LYS 7 10.600 -10.542 2.727 51 1HB LYS 7 HB2 LYS 7 11.433 -12.893 4.053 52 2HB LYS 7 HB1 LYS 7 11.139 -11.662 5.279 53 1HG LYS 7 HG2 LYS 7 9.173 -12.430 3.111 54 2HG LYS 7 HG1 LYS 7 9.153 -13.119 4.723 55 1HD LYS 7 HD2 LYS 7 8.877 -10.159 4.137 56 2HD LYS 7 HD1 LYS 7 7.507 -11.240 4.367 57 1HE LYS 7 HE2 LYS 7 8.382 -11.781 6.629 58 2HE LYS 7 HE1 LYS 7 9.664 -10.601 6.383 59 1HZ LYS 7 HZ3 LYS 7 6.769 -9.964 6.333 60 2HZ LYS 7 HZ2 LYS 7 7.737 -9.742 7.656 61 3HZ LYS 7 HZ1 LYS 7 7.999 -8.832 6.274 62 H ASN 8 HN ASN 8 13.607 -10.788 4.515 63 HA ASN 8 HA ASN 8 13.083 -8.564 6.174 64 1HB ASN 8 HB2 ASN 8 15.627 -10.047 5.552 65 2HB ASN 8 HB1 ASN 8 15.618 -8.597 6.557 66 1HD2 ASN 8 HD2 ASN 8 14.696 -11.968 6.358 67 2HD2 ASN 8 HD2 ASN 8 14.290 -12.143 8.013 68 H LYS 9 HN LYS 9 14.641 -8.838 3.042 69 HA LYS 9 HA LYS 9 15.509 -6.144 2.801 70 1HB LYS 9 HB2 LYS 9 14.562 -8.084 0.680 71 2HB LYS 9 HB1 LYS 9 15.277 -6.519 0.335 72 1HG LYS 9 HG2 LYS 9 16.646 -8.787 1.769 73 2HG LYS 9 HG1 LYS 9 16.860 -8.374 0.068 74 1HD LYS 9 HD2 LYS 9 17.635 -6.120 0.767 75 2HD LYS 9 HD1 LYS 9 17.533 -6.649 2.446 76 1HE LYS 9 HE2 LYS 9 19.177 -8.372 2.047 77 2HE LYS 9 HE1 LYS 9 19.242 -7.958 0.336 78 1HZ LYS 9 HZ3 LYS 9 20.061 -5.761 0.960 79 2HZ LYS 9 HZ2 LYS 9 20.043 -6.211 2.591 80 3HZ LYS 9 HZ1 LYS 9 21.081 -6.997 1.512 81 H ILE 10 HN ILE 10 12.485 -7.748 2.025 82 HA ILE 10 HA ILE 10 11.091 -5.540 1.051 83 HB ILE 10 HB ILE 10 10.150 -8.061 2.421 84 1HG1 ILE 10 2HG1 ILE 10 10.035 -7.113 -0.441 85 2HG1 ILE 10 1HG1 ILE 10 11.148 -8.309 0.213 86 1HG2 ILE 10 3HG2 ILE 10 8.387 -5.941 1.204 87 2HG2 ILE 10 2HG2 ILE 10 7.856 -7.538 1.724 88 3HG2 ILE 10 1HG2 ILE 10 8.467 -6.381 2.910 89 1HD1 ILE 10 HD1 ILE 10 8.159 -8.580 0.048 90 2HD1 ILE 10 HD1 ILE 10 9.341 -9.336 -1.028 91 3HD1 ILE 10 HD1 ILE 10 9.286 -9.781 0.674 92 H GLU 11 HN GLU 11 11.304 -6.842 4.335 93 HA GLU 11 HA GLU 11 9.731 -5.008 5.682 94 1HB GLU 11 HB2 GLU 11 12.289 -6.317 6.610 95 2HB GLU 11 HB1 GLU 11 11.228 -5.399 7.662 96 1HG GLU 11 HG2 GLU 11 10.519 -7.921 6.187 97 2HG GLU 11 HG1 GLU 11 10.867 -7.779 7.911 98 H ASN 12 HN ASN 12 13.191 -4.819 5.052 99 HA ASN 12 HA ASN 12 13.620 -2.327 6.224 100 1HB ASN 12 HB2 ASN 12 15.476 -3.795 5.712 101 2HB ASN 12 HB1 ASN 12 15.147 -3.672 3.988 102 1HD2 ASN 12 HD2 ASN 12 15.823 -1.860 2.879 103 2HD2 ASN 12 HD2 ASN 12 16.824 -0.652 3.578 104 H LYS 13 HN LYS 13 12.902 -3.098 2.824 105 HA LYS 13 HA LYS 13 13.140 -0.400 1.954 106 1HB LYS 13 HB2 LYS 13 13.292 -2.540 0.523 107 2HB LYS 13 HB1 LYS 13 11.545 -2.558 0.570 108 1HG LYS 13 HG2 LYS 13 12.340 -1.567 -1.520 109 2HG LYS 13 HG1 LYS 13 11.467 -0.384 -0.548 110 1HD LYS 13 HD2 LYS 13 13.452 0.625 -1.498 111 2HD LYS 13 HD1 LYS 13 13.620 0.535 0.245 112 1HE LYS 13 HE2 LYS 13 15.712 -0.085 -0.636 113 2HE LYS 13 HE1 LYS 13 14.966 -1.606 -0.164 114 1HZ LYS 13 HZ1 LYS 13 14.348 -1.914 -2.564 115 2HZ LYS 13 HZ3 LYS 13 15.166 -0.466 -2.888 116 3HZ LYS 13 HZ2 LYS 13 16.003 -1.777 -2.304 117 H LYS 14 HN LYS 14 10.427 -2.376 3.004 118 HA LYS 14 HA LYS 14 8.271 -0.688 2.582 119 1HB LYS 14 HB2 LYS 14 8.129 -3.045 3.256 120 2HB LYS 14 HB1 LYS 14 8.875 -2.651 4.791 121 1HG LYS 14 HG2 LYS 14 6.896 -1.285 5.352 122 2HG LYS 14 HG1 LYS 14 6.134 -1.797 3.852 123 1HD LYS 14 HD2 LYS 14 5.291 -3.249 5.544 124 2HD LYS 14 HD1 LYS 14 6.488 -4.186 4.647 125 1HE LYS 14 HE2 LYS 14 8.166 -3.589 6.402 126 2HE LYS 14 HE1 LYS 14 6.849 -2.798 7.266 127 1HZ LYS 14 HZ1 LYS 14 5.731 -5.076 7.351 128 2HZ LYS 14 HZ3 LYS 14 7.175 -5.716 6.737 129 3HZ LYS 14 HZ2 LYS 14 7.154 -4.920 8.187 130 H LYS 15 HN LYS 15 10.507 -1.046 5.310 131 HA LYS 15 HA LYS 15 9.334 0.952 6.913 132 1HB LYS 15 HB2 LYS 15 12.105 -0.251 7.020 133 2HB LYS 15 HB1 LYS 15 11.423 0.840 8.227 134 1HG LYS 15 HG2 LYS 15 9.745 -0.725 8.835 135 2HG LYS 15 HG1 LYS 15 10.151 -1.767 7.478 136 1HD LYS 15 HD2 LYS 15 11.047 -2.801 9.407 137 2HD LYS 15 HD1 LYS 15 12.410 -2.101 8.546 138 1HE LYS 15 HE2 LYS 15 11.045 -0.783 10.899 139 2HE LYS 15 HE1 LYS 15 12.427 -1.852 11.057 140 1HZ LYS 15 HZ3 LYS 15 13.740 -0.252 9.753 141 2HZ LYS 15 HZ2 LYS 15 12.419 0.785 9.637 142 3HZ LYS 15 HZ1 LYS 15 13.087 0.434 11.124 143 H GLU 16 HN GLU 16 12.038 1.060 4.629 144 HA GLU 16 HA GLU 16 12.783 3.736 4.939 145 1HB GLU 16 HB2 GLU 16 12.588 2.095 2.425 146 2HB GLU 16 HB1 GLU 16 13.295 3.698 2.476 147 1HG GLU 16 HG2 GLU 16 15.011 2.858 4.007 148 2HG GLU 16 HG1 GLU 16 14.287 1.249 3.906 149 H LEU 17 HN LEU 17 10.180 2.306 3.119 150 HA LEU 17 HA LEU 17 9.248 4.730 2.016 151 1HB LEU 17 HB2 LEU 17 8.727 2.810 0.815 152 2HB LEU 17 HB1 LEU 17 8.139 1.947 2.221 153 HG LEU 17 HG LEU 17 6.411 2.566 0.524 154 1HD1 LEU 17 HD1 LEU 17 5.825 1.924 2.632 155 2HD1 LEU 17 HD1 LEU 17 5.896 3.591 3.208 156 3HD1 LEU 17 HD1 LEU 17 4.724 3.129 1.952 157 1HD2 LEU 17 HD2 LEU 17 6.938 5.360 1.462 158 2HD2 LEU 17 HD2 LEU 17 7.238 4.729 -0.162 159 3HD2 LEU 17 HD2 LEU 17 5.585 4.841 0.452 160 H ILE 18 HN ILE 18 8.241 2.808 4.801 161 HA ILE 18 HA ILE 18 6.081 4.285 5.510 162 HB ILE 18 HB ILE 18 8.069 2.830 7.295 163 1HG1 ILE 18 2HG1 ILE 18 5.208 2.081 6.813 164 2HG1 ILE 18 1HG1 ILE 18 6.389 1.591 5.637 165 1HG2 ILE 18 3HG2 ILE 18 7.026 4.574 8.681 166 2HG2 ILE 18 2HG2 ILE 18 5.432 4.038 8.192 167 3HG2 ILE 18 1HG2 ILE 18 6.447 2.981 9.155 168 1HD1 ILE 18 HD1 ILE 18 7.592 0.399 7.444 169 2HD1 ILE 18 HD1 ILE 18 6.278 0.840 8.538 170 3HD1 ILE 18 HD1 ILE 18 5.965 -0.190 7.132 171 H GLN 19 HN GLN 19 9.492 4.750 6.278 172 HA GLN 19 HA GLN 19 9.463 7.027 7.902 173 1HB GLN 19 HB2 GLN 19 11.455 6.270 5.772 174 2HB GLN 19 HB1 GLN 19 11.725 7.463 7.026 175 1HG GLN 19 HG2 GLN 19 11.571 5.741 8.729 176 2HG GLN 19 HG1 GLN 19 11.203 4.546 7.496 177 1HE2 GLN 19 1HE2 GLN 19 13.108 5.655 5.588 178 2HE2 GLN 19 2HE2 GLN 19 14.671 5.179 6.117 179 H LEU 20 HN LEU 20 9.494 6.737 4.383 180 HA LEU 20 HA LEU 20 9.637 9.509 3.874 181 1HB LEU 20 HB2 LEU 20 8.671 7.293 2.075 182 2HB LEU 20 HB1 LEU 20 8.972 8.941 1.562 183 HG LEU 20 HG LEU 20 11.031 6.977 2.561 184 1HD1 LEU 20 HD1 LEU 20 10.247 6.509 0.326 185 2HD1 LEU 20 HD1 LEU 20 10.563 8.175 -0.155 186 3HD1 LEU 20 HD1 LEU 20 11.903 7.120 0.294 187 1HD2 LEU 20 HD2 LEU 20 11.354 9.844 1.663 188 2HD2 LEU 20 HD2 LEU 20 11.649 9.196 3.281 189 3HD2 LEU 20 HD2 LEU 20 12.673 8.707 1.943 190 H VAL 21 HN VAL 21 6.868 7.240 3.843 191 HA VAL 21 HA VAL 21 4.881 9.146 3.410 192 HB VAL 21 HB VAL 21 4.710 6.660 5.147 193 1HG1 VAL 21 2HG1 VAL 21 2.821 8.233 5.385 194 2HG1 VAL 21 1HG1 VAL 21 2.525 8.099 3.662 195 3HG1 VAL 21 3HG1 VAL 21 2.344 6.677 4.696 196 1HG2 VAL 21 1HG2 VAL 21 4.258 7.034 2.204 197 2HG2 VAL 21 3HG2 VAL 21 5.576 6.156 2.992 198 3HG2 VAL 21 2HG2 VAL 21 3.913 5.567 3.130 199 H ALA 22 HN ALA 22 6.399 8.136 6.425 200 HA ALA 22 HA ALA 22 4.853 9.572 8.245 201 1HB ALA 22 HB2 ALA 22 7.744 8.800 8.422 202 2HB ALA 22 HB1 ALA 22 6.700 9.206 9.800 203 3HB ALA 22 HB3 ALA 22 6.377 7.767 8.816 204 H ARG 23 HN ARG 23 7.969 10.470 6.756 205 HA ARG 23 HA ARG 23 8.095 13.003 7.977 206 1HB ARG 23 HB2 ARG 23 9.884 13.545 6.381 207 2HB ARG 23 HB1 ARG 23 10.122 11.976 7.134 208 1HG ARG 23 HG2 ARG 23 9.241 10.907 5.138 209 2HG ARG 23 HG1 ARG 23 9.043 12.484 4.381 210 1HD ARG 23 HD2 ARG 23 11.667 11.376 5.358 211 2HD ARG 23 HD1 ARG 23 11.119 11.300 3.685 212 HE ARG 23 HE ARG 23 10.951 13.903 4.176 213 1HH1 ARG 23 1HH1 ARG 23 13.633 11.691 4.969 214 2HH1 ARG 23 2HH1 ARG 23 14.832 12.848 4.589 215 1HH2 ARG 23 1HH2 ARG 23 12.608 15.441 3.711 216 2HH2 ARG 23 2HH2 ARG 23 14.256 15.022 3.912 217 H HIS 24 HN HIS 24 6.284 11.925 5.281 218 HA HIS 24 HA HIS 24 5.930 14.334 3.915 219 1HB HIS 24 HB2 HIS 24 5.126 12.225 2.972 220 2HB HIS 24 HB1 HIS 24 4.011 11.986 4.281 221 HD1 HIS 24 HD1 HIS 24 4.248 13.477 0.897 222 HD2 HIS 24 HD2 HIS 24 1.837 13.804 4.215 223 HE1 HIS 24 HE1 HIS 24 2.166 14.644 0.100 224 H GLY 25 HN GLY 25 4.639 13.238 6.962 225 1HA GLY 25 HA1 GLY 25 2.915 15.613 7.073 226 2HA GLY 25 HA2 GLY 25 4.198 15.437 8.261 227 H LEU 26 HN LEU 26 3.041 12.389 7.564 228 HA LEU 26 HA LEU 26 0.705 12.228 8.987 229 1HB LEU 26 HB2 LEU 26 2.817 10.298 8.244 230 2HB LEU 26 HB1 LEU 26 1.540 9.813 9.336 231 HG LEU 26 HG LEU 26 -0.068 10.534 7.589 232 1HD1 LEU 26 HD1 LEU 26 1.283 11.940 6.235 233 2HD1 LEU 26 HD1 LEU 26 2.329 10.577 5.801 234 3HD1 LEU 26 HD1 LEU 26 0.635 10.589 5.292 235 1HD2 LEU 26 HD2 LEU 26 1.810 8.270 7.074 236 2HD2 LEU 26 HD2 LEU 26 0.355 8.241 8.045 237 3HD2 LEU 26 HD2 LEU 26 0.235 8.441 6.293 238 H ASP 27 HN ASP 27 0.174 11.675 10.930 239 HA ASP 27 HA ASP 27 1.971 12.129 13.161 240 1HB ASP 27 HB2 ASP 27 -0.304 12.875 13.497 241 2HB ASP 27 HB1 ASP 27 -0.947 11.325 12.978 242 H HIS 28 HN HIS 28 2.169 10.493 14.868 243 HA HIS 28 HA HIS 28 3.294 8.118 14.050 244 1HB HIS 28 HB2 HIS 28 2.032 8.775 16.722 245 2HB HIS 28 HB1 HIS 28 3.030 7.365 16.419 246 HD1 HIS 28 HD1 HIS 28 3.274 11.054 17.119 247 HD2 HIS 28 HD2 HIS 28 5.770 7.890 16.070 248 HE1 HIS 28 HE1 HIS 28 5.615 11.855 17.497 249 H ASP 29 HN ASP 29 -0.116 8.777 14.959 250 HA ASP 29 HA ASP 29 -0.871 6.027 15.038 251 1HB ASP 29 HB2 ASP 29 -2.244 7.645 16.164 252 2HB ASP 29 HB1 ASP 29 -2.499 8.539 14.668 253 H LYS 30 HN LYS 30 -0.878 8.506 12.631 254 HA LYS 30 HA LYS 30 -2.246 7.063 10.612 255 1HB LYS 30 HB2 LYS 30 -0.345 9.383 10.446 256 2HB LYS 30 HB1 LYS 30 -1.236 8.751 9.078 257 1HG LYS 30 HG2 LYS 30 -2.467 9.921 11.567 258 2HG LYS 30 HG1 LYS 30 -2.131 10.816 10.096 259 1HD LYS 30 HD2 LYS 30 -4.334 10.352 9.870 260 2HD LYS 30 HD1 LYS 30 -3.611 9.048 8.942 261 1HE LYS 30 HE2 LYS 30 -5.449 8.284 10.302 262 2HE LYS 30 HE1 LYS 30 -3.989 7.490 10.854 263 1HZ LYS 30 HZ1 LYS 30 -3.936 9.371 12.580 264 2HZ LYS 30 HZ3 LYS 30 -5.551 9.639 12.161 265 3HZ LYS 30 HZ2 LYS 30 -5.009 8.154 12.791 266 H VAL 31 HN VAL 31 1.212 7.470 11.373 267 HA VAL 31 HA VAL 31 2.217 6.046 9.215 268 HB VAL 31 HB VAL 31 3.346 6.470 12.009 269 1HG1 VAL 31 3HG1 VAL 31 4.489 4.635 10.859 270 2HG1 VAL 31 2HG1 VAL 31 4.776 5.694 9.476 271 3HG1 VAL 31 1HG1 VAL 31 5.536 6.047 11.023 272 1HG2 VAL 31 1HG2 VAL 31 2.842 8.542 10.856 273 2HG2 VAL 31 3HG2 VAL 31 4.587 8.308 10.993 274 3HG2 VAL 31 2HG2 VAL 31 3.770 8.005 9.458 275 H LEU 32 HN LEU 32 1.264 5.076 12.490 276 HA LEU 32 HA LEU 32 2.030 2.380 12.249 277 1HB LEU 32 HB2 LEU 32 -0.105 3.576 14.007 278 2HB LEU 32 HB1 LEU 32 0.584 1.977 14.190 279 HG LEU 32 HG LEU 32 1.967 4.618 14.595 280 1HD1 LEU 32 HD1 LEU 32 1.317 2.396 16.492 281 2HD1 LEU 32 HD1 LEU 32 2.285 3.827 16.873 282 3HD1 LEU 32 HD1 LEU 32 0.587 4.003 16.431 283 1HD2 LEU 32 HD2 LEU 32 3.160 1.850 14.680 284 2HD2 LEU 32 HD2 LEU 32 3.533 3.148 13.535 285 3HD2 LEU 32 HD2 LEU 32 3.946 3.335 15.235 286 H LEU 33 HN LEU 33 -1.173 3.882 11.846 287 HA LEU 33 HA LEU 33 -2.566 1.538 11.183 288 1HB LEU 33 HB2 LEU 33 -3.020 4.385 10.348 289 2HB LEU 33 HB1 LEU 33 -4.135 3.087 9.968 290 HG LEU 33 HG LEU 33 -3.377 3.889 12.775 291 1HD1 LEU 33 HD1 LEU 33 -5.781 4.608 11.098 292 2HD1 LEU 33 HD1 LEU 33 -5.604 4.886 12.838 293 3HD1 LEU 33 HD1 LEU 33 -4.527 5.697 11.717 294 1HD2 LEU 33 HD2 LEU 33 -5.535 2.113 11.661 295 2HD2 LEU 33 HD2 LEU 33 -4.119 1.585 12.577 296 3HD2 LEU 33 HD2 LEU 33 -5.358 2.575 13.355 297 H PHE 34 HN PHE 34 -0.884 3.841 9.155 298 HA PHE 34 HA PHE 34 -1.467 2.747 6.675 299 1HB PHE 34 HB2 PHE 34 -0.514 4.923 6.804 300 2HB PHE 34 HB1 PHE 34 0.882 4.338 7.693 301 HD1 PHE 34 HD1 PHE 34 -0.800 4.224 4.406 302 HD2 PHE 34 HD2 PHE 34 2.798 3.640 6.595 303 HE1 PHE 34 HE1 PHE 34 0.438 3.953 2.306 304 HE2 PHE 34 HE2 PHE 34 4.034 3.366 4.491 305 HZ PHE 34 HZ PHE 34 2.882 3.521 2.379 306 H SER 35 HN SER 35 1.303 2.150 8.825 307 HA SER 35 HA SER 35 2.555 0.366 7.048 308 1HB SER 35 HB2 SER 35 3.009 0.562 10.033 309 2HB SER 35 HB1 SER 35 4.097 -0.087 8.818 310 HG SER 35 HG SER 35 3.252 2.587 9.162 311 H ARG 36 HN ARG 36 0.219 -0.097 9.597 312 HA ARG 36 HA ARG 36 0.441 -2.931 9.793 313 1HB ARG 36 HB2 ARG 36 -1.914 -1.132 10.417 314 2HB ARG 36 HB1 ARG 36 -1.752 -2.813 10.939 315 1HG ARG 36 HG2 ARG 36 0.142 -2.257 12.283 316 2HG ARG 36 HG1 ARG 36 0.153 -0.634 11.579 317 1HD ARG 36 HD2 ARG 36 -0.795 -0.429 13.777 318 2HD ARG 36 HD1 ARG 36 -2.069 -0.238 12.597 319 HE ARG 36 HE ARG 36 -2.878 -2.373 13.137 320 1HH1 ARG 36 1HH1 ARG 36 -0.253 -1.280 15.247 321 2HH1 ARG 36 2HH1 ARG 36 -0.777 -2.140 16.622 322 1HH2 ARG 36 1HH2 ARG 36 -3.616 -3.594 15.073 323 2HH2 ARG 36 2HH2 ARG 36 -2.740 -3.454 16.522 324 H ASP 37 HN ASP 37 -1.536 -0.769 7.862 325 HA ASP 37 HA ASP 37 -3.081 -2.829 6.613 326 1HB ASP 37 HB2 ASP 37 -3.679 -0.382 6.812 327 2HB ASP 37 HB1 ASP 37 -2.486 -0.055 5.571 328 H LEU 38 HN LEU 38 -0.281 -0.918 5.736 329 HA LEU 38 HA LEU 38 0.351 -1.904 3.221 330 1HB LEU 38 HB2 LEU 38 1.404 0.045 4.032 331 2HB LEU 38 HB1 LEU 38 1.963 -0.774 5.468 332 HG LEU 38 HG LEU 38 3.642 -1.977 4.153 333 1HD1 LEU 38 HD1 LEU 38 2.477 -2.124 2.034 334 2HD1 LEU 38 HD1 LEU 38 2.638 -0.371 1.814 335 3HD1 LEU 38 HD1 LEU 38 4.076 -1.397 1.860 336 1HD2 LEU 38 HD2 LEU 38 3.618 0.998 3.746 337 2HD2 LEU 38 HD2 LEU 38 4.233 0.130 5.152 338 3HD2 LEU 38 HD2 LEU 38 5.036 -0.034 3.589 339 H ASP 39 HN ASP 39 1.515 -3.042 6.397 340 HA ASP 39 HA ASP 39 3.210 -5.060 5.481 341 1HB ASP 39 HB2 ASP 39 3.096 -4.195 7.833 342 2HB ASP 39 HB1 ASP 39 1.595 -5.087 8.042 343 H LYS 40 HN LYS 40 -0.177 -5.189 6.449 344 HA LYS 40 HA LYS 40 -0.564 -7.919 5.916 345 1HB LYS 40 HB2 LYS 40 -2.527 -5.654 6.025 346 2HB LYS 40 HB1 LYS 40 -2.979 -7.348 5.882 347 1HG LYS 40 HG2 LYS 40 -1.906 -7.835 7.990 348 2HG LYS 40 HG1 LYS 40 -1.385 -6.156 8.132 349 1HD LYS 40 HD2 LYS 40 -3.704 -5.436 8.203 350 2HD LYS 40 HD1 LYS 40 -4.237 -7.110 8.013 351 1HE LYS 40 HE2 LYS 40 -2.600 -6.034 10.301 352 2HE LYS 40 HE1 LYS 40 -4.328 -6.385 10.341 353 1HZ LYS 40 HZ3 LYS 40 -3.768 -8.723 9.814 354 2HZ LYS 40 HZ2 LYS 40 -2.130 -8.358 9.964 355 3HZ LYS 40 HZ1 LYS 40 -3.151 -8.203 11.290 356 H LEU 41 HN LEU 41 -0.819 -5.088 3.872 357 HA LEU 41 HA LEU 41 -2.083 -6.311 1.668 358 1HB LEU 41 HB2 LEU 41 -1.893 -3.895 1.821 359 2HB LEU 41 HB1 LEU 41 -0.151 -4.001 1.821 360 HG LEU 41 HG LEU 41 -0.173 -4.734 -0.513 361 1HD1 LEU 41 HD1 LEU 41 -2.324 -5.900 -0.514 362 2HD1 LEU 41 HD1 LEU 41 -3.153 -4.350 -0.376 363 3HD1 LEU 41 HD1 LEU 41 -2.211 -4.717 -1.819 364 1HD2 LEU 41 HD2 LEU 41 -1.786 -2.251 0.005 365 2HD2 LEU 41 HD2 LEU 41 -0.026 -2.369 -0.016 366 3HD2 LEU 41 HD2 LEU 41 -0.948 -2.639 -1.496 367 H ILE 42 HN ILE 42 1.254 -5.976 2.615 368 HA ILE 42 HA ILE 42 2.352 -7.253 0.342 369 HB ILE 42 HB ILE 42 3.506 -6.929 3.140 370 1HG1 ILE 42 2HG1 ILE 42 3.960 -5.349 0.614 371 2HG1 ILE 42 1HG1 ILE 42 2.983 -4.810 1.977 372 1HG2 ILE 42 2HG2 ILE 42 4.878 -7.674 0.552 373 2HG2 ILE 42 1HG2 ILE 42 5.684 -7.336 2.085 374 3HG2 ILE 42 3HG2 ILE 42 4.626 -8.738 1.936 375 1HD1 ILE 42 HD1 ILE 42 5.946 -5.337 1.992 376 2HD1 ILE 42 HD1 ILE 42 5.162 -3.755 1.979 377 3HD1 ILE 42 HD1 ILE 42 4.983 -4.818 3.376 378 H ASN 43 HN ASN 43 1.771 -8.441 3.619 379 HA ASN 43 HA ASN 43 2.396 -11.135 3.298 380 1HB ASN 43 HB2 ASN 43 0.119 -10.091 5.015 381 2HB ASN 43 HB1 ASN 43 0.944 -11.642 5.164 382 1HD2 ASN 43 HD2 ASN 43 0.609 -9.471 7.104 383 2HD2 ASN 43 HD2 ASN 43 2.182 -8.943 7.562 384 H LYS 44 HN LYS 44 -0.516 -9.454 2.458 385 HA LYS 44 HA LYS 44 -2.240 -11.582 1.835 386 1HB LYS 44 HB2 LYS 44 -2.977 -9.283 2.096 387 2HB LYS 44 HB1 LYS 44 -2.043 -8.786 0.703 388 1HG LYS 44 HG2 LYS 44 -3.528 -10.292 -0.691 389 2HG LYS 44 HG1 LYS 44 -4.523 -10.476 0.762 390 1HD LYS 44 HD2 LYS 44 -3.855 -7.830 -0.488 391 2HD LYS 44 HD1 LYS 44 -5.340 -8.728 -0.789 392 1HE LYS 44 HE2 LYS 44 -4.420 -7.783 1.934 393 2HE LYS 44 HE1 LYS 44 -5.557 -6.937 0.898 394 1HZ LYS 44 HZ1 LYS 44 -7.042 -8.852 1.026 395 2HZ LYS 44 HZ3 LYS 44 -5.983 -9.642 2.082 396 3HZ LYS 44 HZ2 LYS 44 -6.722 -8.205 2.532 397 H PHE 45 HN PHE 45 -0.012 -9.728 -0.206 398 HA PHE 45 HA PHE 45 -0.617 -11.379 -2.460 399 1HB PHE 45 HB2 PHE 45 1.082 -8.968 -2.080 400 2HB PHE 45 HB1 PHE 45 1.296 -9.961 -3.519 401 HD1 PHE 45 HD1 PHE 45 -0.335 -10.026 -5.224 402 HD2 PHE 45 HD2 PHE 45 -1.058 -7.826 -1.661 403 HE1 PHE 45 HE1 PHE 45 -2.264 -8.954 -6.285 404 HE2 PHE 45 HE2 PHE 45 -2.993 -6.741 -2.723 405 HZ PHE 45 HZ PHE 45 -3.593 -7.312 -5.041 406 H MET 46 HN MET 46 1.872 -11.234 -0.092 407 HA MET 46 HA MET 46 3.696 -12.927 -1.496 408 1HB MET 46 HB2 MET 46 3.423 -12.717 1.520 409 2HB MET 46 HB1 MET 46 4.834 -13.270 0.628 410 1HG MET 46 HG2 MET 46 4.840 -10.851 -0.349 411 2HG MET 46 HG1 MET 46 3.746 -10.521 0.965 412 1HE MET 46 HE2 MET 46 7.277 -11.284 -0.116 413 2HE MET 46 HE1 MET 46 8.136 -11.715 1.370 414 3HE MET 46 HE3 MET 46 6.926 -12.813 0.684 415 H ASN 47 HN ASN 47 0.929 -13.257 0.500 416 HA ASN 47 HA ASN 47 -0.408 -14.808 1.235 417 1HB ASN 47 HB2 ASN 47 -0.596 -15.498 -1.146 418 2HB ASN 47 HB1 ASN 47 0.733 -16.627 -0.913 419 1HD2 ASN 47 HD2 ASN 47 -1.787 -16.079 1.498 420 2HD2 ASN 47 HD2 ASN 47 -2.530 -17.628 1.319 421 H VAL 48 HN VAL 48 0.680 -14.758 3.143 422 HA VAL 48 HA VAL 48 2.601 -16.928 3.606 423 HB VAL 48 HB VAL 48 1.983 -14.647 5.450 424 1HG1 VAL 48 3HG1 VAL 48 2.983 -16.584 6.538 425 2HG1 VAL 48 2HG1 VAL 48 4.315 -16.565 5.385 426 3HG1 VAL 48 1HG1 VAL 48 4.123 -15.238 6.524 427 1HG2 VAL 48 3HG2 VAL 48 4.217 -14.855 3.440 428 2HG2 VAL 48 2HG2 VAL 48 2.875 -13.709 3.405 429 3HG2 VAL 48 1HG2 VAL 48 4.093 -13.600 4.679 430 H LYS 49 HN LYS 49 1.636 -18.575 3.971 431 HA LYS 49 HA LYS 49 -0.047 -18.744 6.355 432 1HB LYS 49 HB2 LYS 49 -0.475 -20.199 3.735 433 2HB LYS 49 HB1 LYS 49 -1.270 -20.597 5.249 434 1HG LYS 49 HG2 LYS 49 -2.299 -18.351 5.265 435 2HG LYS 49 HG1 LYS 49 -1.542 -18.019 3.709 436 1HD LYS 49 HD2 LYS 49 -3.842 -18.676 3.363 437 2HD LYS 49 HD1 LYS 49 -2.775 -19.928 2.733 438 1HE LYS 49 HE2 LYS 49 -4.658 -20.900 3.926 439 2HE LYS 49 HE1 LYS 49 -3.158 -21.264 4.772 440 1HZ LYS 49 HZ3 LYS 49 -3.715 -19.457 6.342 441 2HZ LYS 49 HZ2 LYS 49 -5.166 -19.191 5.503 442 3HZ LYS 49 HZ1 LYS 49 -4.906 -20.646 6.281 443 H ASP 50 HN ASP 50 2.760 -19.058 5.648 444 HA ASP 50 HA ASP 50 3.429 -21.861 5.649 445 1HB ASP 50 HB2 ASP 50 4.818 -19.956 4.634 446 2HB ASP 50 HB1 ASP 50 5.225 -19.487 6.273 447 H LYS 51 HN LYS 51 5.192 -22.332 7.521 448 HA LYS 51 HA LYS 51 3.596 -22.162 9.963 449 1HB LYS 51 HB2 LYS 51 4.965 -24.086 10.712 450 2HB LYS 51 HB1 LYS 51 4.029 -24.406 9.264 451 1HG LYS 51 HG2 LYS 51 6.072 -24.011 7.910 452 2HG LYS 51 HG1 LYS 51 6.981 -23.833 9.413 453 1HD LYS 51 HD2 LYS 51 5.395 -26.284 8.665 454 2HD LYS 51 HD1 LYS 51 7.126 -26.092 8.394 455 1HE LYS 51 HE2 LYS 51 7.539 -25.932 10.751 456 2HE LYS 51 HE1 LYS 51 5.817 -25.893 11.107 457 1HZ LYS 51 HZ3 LYS 51 7.186 -28.165 9.804 458 2HZ LYS 51 HZ2 LYS 51 6.900 -28.074 11.448 459 3HZ LYS 51 HZ1 LYS 51 5.594 -28.122 10.355 460 H VAL 52 HN VAL 52 5.373 -20.089 8.961 461 HA VAL 52 HA VAL 52 7.737 -20.003 10.530 462 HB VAL 52 HB VAL 52 7.920 -17.621 9.841 463 1HG1 VAL 52 3HG1 VAL 52 7.275 -19.554 7.619 464 2HG1 VAL 52 2HG1 VAL 52 8.170 -18.048 7.435 465 3HG1 VAL 52 1HG1 VAL 52 8.835 -19.356 8.416 466 1HG2 VAL 52 3HG2 VAL 52 5.545 -17.041 9.796 467 2HG2 VAL 52 2HG2 VAL 52 6.298 -16.697 8.240 468 3HG2 VAL 52 1HG2 VAL 52 5.294 -18.133 8.435 469 H HIS 53 HN HIS 53 4.512 -19.457 11.395 470 HA HIS 53 HA HIS 53 5.441 -18.023 13.762 471 1HB HIS 53 HB2 HIS 53 3.978 -16.564 12.385 472 2HB HIS 53 HB1 HIS 53 2.704 -17.771 12.465 473 HD1 HIS 53 HD1 HIS 53 4.373 -15.073 14.537 474 HD2 HIS 53 HD2 HIS 53 1.256 -17.815 14.840 475 HE1 HIS 53 HE1 HIS 53 3.115 -14.461 16.596 476 H LYS 54 HN LYS 54 5.847 -19.881 14.861 477 HA LYS 54 HA LYS 54 3.477 -21.320 15.833 478 1HB LYS 54 HB2 LYS 54 5.140 -22.580 14.201 479 2HB LYS 54 HB1 LYS 54 6.225 -22.559 15.573 480 1HG LYS 54 HG2 LYS 54 3.500 -23.853 15.531 481 2HG LYS 54 HG1 LYS 54 5.022 -24.691 15.291 482 1HD LYS 54 HD2 LYS 54 5.703 -23.995 17.573 483 2HD LYS 54 HD1 LYS 54 4.116 -23.263 17.791 484 1HE LYS 54 HE2 LYS 54 4.685 -26.178 17.252 485 2HE LYS 54 HE1 LYS 54 4.202 -25.472 18.790 486 1HZ LYS 54 HZ3 LYS 54 2.542 -25.484 16.326 487 2HZ LYS 54 HZ2 LYS 54 2.344 -26.512 17.641 488 3HZ LYS 54 HZ1 LYS 54 2.079 -24.872 17.823 489 H LEU 55 HN LEU 55 3.434 -19.744 17.464 490 HA LEU 55 HA LEU 55 4.030 -18.458 19.199 491 1HB LEU 55 HB2 LEU 55 5.318 -21.056 19.732 492 2HB LEU 55 HB1 LEU 55 5.433 -19.775 20.948 493 HG LEU 55 HG LEU 55 2.936 -21.163 19.926 494 1HD1 LEU 55 HD1 LEU 55 4.300 -21.205 22.599 495 2HD1 LEU 55 HD1 LEU 55 2.746 -21.946 22.230 496 3HD1 LEU 55 HD1 LEU 55 4.211 -22.533 21.437 497 1HD2 LEU 55 HD2 LEU 55 3.204 -18.955 21.970 498 2HD2 LEU 55 HD2 LEU 55 2.420 -18.831 20.393 499 3HD2 LEU 55 HD2 LEU 55 1.734 -19.867 21.636 500 H GLU 56 HN GLU 56 6.351 -18.162 20.699 501 HA GLU 56 HA GLU 56 8.368 -17.811 18.678 502 1HB GLU 56 HB2 GLU 56 7.246 -15.615 18.936 503 2HB GLU 56 HB1 GLU 56 7.648 -15.612 20.646 504 1HG GLU 56 HG2 GLU 56 9.991 -15.466 20.153 505 2HG GLU 56 HG1 GLU 56 9.692 -15.699 18.434 506 H HIS 57 HN HIS 57 9.185 -19.622 19.455 507 HA HIS 57 HA HIS 57 10.584 -19.451 22.023 508 1HB HIS 57 HB2 HIS 57 9.647 -21.870 20.445 509 2HB HIS 57 HB1 HIS 57 10.724 -21.968 21.825 510 HD1 HIS 57 HD1 HIS 57 7.604 -23.047 21.375 511 HD2 HIS 57 HD2 HIS 57 9.044 -20.051 23.856 512 HE1 HIS 57 HE1 HIS 57 5.969 -22.869 23.272 513 H HIS 58 HN HIS 58 12.591 -21.036 21.798 514 HA HIS 58 HA HIS 58 14.611 -21.497 20.960 515 1HB HIS 58 HB2 HIS 58 13.469 -22.495 19.018 516 2HB HIS 58 HB1 HIS 58 13.328 -20.919 18.265 517 HD1 HIS 58 HD1 HIS 58 15.472 -23.889 18.367 518 HD2 HIS 58 HD2 HIS 58 15.915 -19.873 17.396 519 HE1 HIS 58 HE1 HIS 58 17.522 -23.733 16.935 520 H HIS 59 HN HIS 59 13.336 -18.729 19.217 521 HA HIS 59 HA HIS 59 15.907 -17.369 19.328 522 1HB HIS 59 HB2 HIS 59 13.276 -16.422 18.139 523 2HB HIS 59 HB1 HIS 59 14.858 -15.699 17.895 524 HD1 HIS 59 HD1 HIS 59 16.266 -16.667 15.937 525 HD2 HIS 59 HD2 HIS 59 12.890 -18.925 16.833 526 HE1 HIS 59 HE1 HIS 59 16.043 -18.359 14.095 527 H HIS 60 HN HIS 60 16.345 -16.202 21.095 528 HA HIS 60 HA HIS 60 14.157 -14.698 22.298 529 1HB HIS 60 HB2 HIS 60 14.659 -16.544 23.813 530 2HB HIS 60 HB1 HIS 60 16.374 -16.158 23.762 531 HD1 HIS 60 HD1 HIS 60 13.100 -14.673 25.092 532 HD2 HIS 60 HD2 HIS 60 17.207 -14.430 25.637 533 HE1 HIS 60 HE1 HIS 60 13.448 -13.163 27.066 534 H HIS 61 HN HIS 61 14.515 -12.600 22.513 535 HA HIS 61 HA HIS 61 16.988 -11.348 22.921 536 1HB HIS 61 HB2 HIS 61 17.141 -10.162 20.711 537 2HB HIS 61 HB1 HIS 61 17.503 -11.877 20.590 538 HD1 HIS 61 HD1 HIS 61 15.478 -9.272 18.987 539 HD2 HIS 61 HD2 HIS 61 15.192 -13.385 19.536 540 HE1 HIS 61 HE1 HIS 61 13.868 -10.098 17.260 541 H HIS 62 HN HIS 62 16.668 -8.949 22.881 542 HA HIS 62 HA HIS 62 13.859 -8.196 22.724 543 1HB HIS 62 HB2 HIS 62 15.749 -7.412 24.968 544 2HB HIS 62 HB1 HIS 62 14.184 -6.662 24.692 545 HD1 HIS 62 HD1 HIS 62 12.056 -8.166 25.291 546 HD2 HIS 62 HD2 HIS 62 15.748 -9.771 26.298 547 HE1 HIS 62 HE1 HIS 62 11.590 -10.039 26.908 548 H1 MET 101 HT2 MET 101 10.323 23.826 0.299 549 H2 MET 101 HT1 MET 101 11.735 23.267 1.051 550 H3 MET 101 HT3 MET 101 11.252 22.663 -0.437 551 HA MET 101 HA MET 101 10.783 21.082 1.256 552 1HB MET 101 HB2 MET 101 9.274 23.366 2.483 553 2HB MET 101 HB1 MET 101 8.917 21.693 2.884 554 1HG MET 101 HG2 MET 101 11.529 23.109 3.276 555 2HG MET 101 HG1 MET 101 10.374 22.658 4.525 556 1HE MET 101 HE3 MET 101 9.739 20.101 5.102 557 2HE MET 101 HE2 MET 101 9.473 19.707 3.405 558 3HE MET 101 HE1 MET 101 10.549 18.712 4.377 559 H GLU 102 HN GLU 102 9.787 22.122 -1.373 560 HA GLU 102 HA GLU 102 7.043 21.784 -1.571 561 1HB GLU 102 HB2 GLU 102 9.015 20.918 -3.699 562 2HB GLU 102 HB1 GLU 102 7.365 21.473 -3.921 563 1HG GLU 102 HG2 GLU 102 8.679 23.241 -4.671 564 2HG GLU 102 HG1 GLU 102 8.221 23.724 -3.036 565 H MET 103 HN MET 103 5.856 20.030 -1.243 566 HA MET 103 HA MET 103 7.189 17.562 -0.576 567 1HB MET 103 HB2 MET 103 5.055 16.778 0.271 568 2HB MET 103 HB1 MET 103 5.429 18.385 0.873 569 1HG MET 103 HG2 MET 103 3.883 19.345 -0.776 570 2HG MET 103 HG1 MET 103 3.493 17.722 -1.338 571 1HE MET 103 HE1 MET 103 3.348 20.261 1.612 572 2HE MET 103 HE3 MET 103 2.495 19.351 2.854 573 3HE MET 103 HE2 MET 103 4.131 18.888 2.404 574 H GLY 104 HN GLY 104 6.116 18.728 -3.440 575 1HA GLY 104 HA1 GLY 104 5.611 17.740 -5.457 576 2HA GLY 104 HA2 GLY 104 4.800 16.482 -4.531 577 H GLN 105 HN GLN 105 8.144 17.552 -4.588 578 HA GLN 105 HA GLN 105 9.249 15.354 -5.936 579 1HB GLN 105 HB2 GLN 105 10.489 17.180 -3.872 580 2HB GLN 105 HB1 GLN 105 11.401 16.025 -4.830 581 1HG GLN 105 HG2 GLN 105 10.733 17.194 -6.868 582 2HG GLN 105 HG1 GLN 105 9.819 18.351 -5.905 583 1HE2 GLN 105 1HE2 GLN 105 10.915 19.899 -4.719 584 2HE2 GLN 105 2HE2 GLN 105 12.598 20.200 -4.946 585 H LEU 106 HN LEU 106 8.599 15.923 -2.566 586 HA LEU 106 HA LEU 106 9.779 13.651 -1.439 587 1HB LEU 106 HB2 LEU 106 9.052 15.584 -0.119 588 2HB LEU 106 HB1 LEU 106 7.397 15.316 -0.579 589 HG LEU 106 HG LEU 106 8.039 14.766 1.810 590 1HD1 LEU 106 HD1 LEU 106 6.668 12.640 0.174 591 2HD1 LEU 106 HD1 LEU 106 6.676 12.725 1.933 592 3HD1 LEU 106 HD1 LEU 106 5.938 14.006 1.005 593 1HD2 LEU 106 HD2 LEU 106 9.341 12.383 0.498 594 2HD2 LEU 106 HD2 LEU 106 10.157 13.654 1.413 595 3HD2 LEU 106 HD2 LEU 106 9.036 12.561 2.227 596 H LYS 107 HN LYS 107 6.517 14.167 -2.691 597 HA LYS 107 HA LYS 107 5.477 11.609 -2.157 598 1HB LYS 107 HB2 LYS 107 4.595 13.963 -3.366 599 2HB LYS 107 HB1 LYS 107 4.516 12.711 -4.611 600 1HG LYS 107 HG2 LYS 107 3.321 12.342 -1.860 601 2HG LYS 107 HG1 LYS 107 2.411 13.098 -3.150 602 1HD LYS 107 HD2 LYS 107 3.634 10.342 -3.405 603 2HD LYS 107 HD1 LYS 107 2.013 10.601 -2.760 604 1HE LYS 107 HE2 LYS 107 1.462 11.770 -4.911 605 2HE LYS 107 HE1 LYS 107 3.045 11.278 -5.512 606 1HZ LYS 107 HZ1 LYS 107 2.356 8.923 -5.195 607 2HZ LYS 107 HZ3 LYS 107 0.836 9.458 -4.672 608 3HZ LYS 107 HZ2 LYS 107 1.332 9.763 -6.227 609 H ASN 108 HN ASN 108 7.290 12.890 -4.861 610 HA ASN 108 HA ASN 108 7.018 10.580 -6.489 611 1HB ASN 108 HB2 ASN 108 8.888 12.937 -6.633 612 2HB ASN 108 HB1 ASN 108 9.091 11.517 -7.653 613 1HD2 ASN 108 HD2 ASN 108 7.071 14.297 -7.000 614 2HD2 ASN 108 HD2 ASN 108 6.171 14.189 -8.462 615 H LYS 109 HN LYS 109 9.232 11.460 -3.965 616 HA LYS 109 HA LYS 109 11.045 9.277 -4.455 617 1HB LYS 109 HB2 LYS 109 10.600 10.924 -1.950 618 2HB LYS 109 HB1 LYS 109 11.913 9.782 -2.172 619 1HG LYS 109 HG2 LYS 109 11.459 12.295 -3.776 620 2HG LYS 109 HG1 LYS 109 12.650 12.089 -2.491 621 1HD LYS 109 HD2 LYS 109 12.583 10.549 -5.100 622 2HD LYS 109 HD1 LYS 109 13.652 11.891 -4.738 623 1HE LYS 109 HE2 LYS 109 14.599 10.575 -2.853 624 2HE LYS 109 HE1 LYS 109 13.584 9.220 -3.346 625 1HZ LYS 109 HZ1 LYS 109 14.737 9.204 -5.495 626 2HZ LYS 109 HZ3 LYS 109 15.682 10.500 -4.991 627 3HZ LYS 109 HZ2 LYS 109 15.827 9.024 -4.222 628 H ILE 110 HN ILE 110 8.189 9.817 -2.541 629 HA ILE 110 HA ILE 110 8.117 7.333 -1.210 630 HB ILE 110 HB ILE 110 5.939 9.247 -2.076 631 1HG1 ILE 110 2HG1 ILE 110 7.113 8.602 0.629 632 2HG1 ILE 110 1HG1 ILE 110 7.471 10.033 -0.331 633 1HG2 ILE 110 2HG2 ILE 110 5.599 6.769 -0.400 634 2HG2 ILE 110 1HG2 ILE 110 4.368 8.013 -0.661 635 3HG2 ILE 110 3HG2 ILE 110 4.958 7.053 -2.021 636 1HD1 ILE 110 HD1 ILE 110 5.138 10.747 -0.085 637 2HD1 ILE 110 HD1 ILE 110 4.810 9.311 0.877 638 3HD1 ILE 110 HD1 ILE 110 5.928 10.540 1.471 639 H GLU 111 HN GLU 111 6.782 8.415 -4.298 640 HA GLU 111 HA GLU 111 5.716 6.028 -5.291 641 1HB GLU 111 HB2 GLU 111 7.250 8.153 -6.810 642 2HB GLU 111 HB1 GLU 111 6.242 6.899 -7.515 643 1HG GLU 111 HG2 GLU 111 5.245 9.047 -5.676 644 2HG GLU 111 HG1 GLU 111 5.139 9.120 -7.431 645 H ASN 112 HN ASN 112 8.943 7.298 -5.566 646 HA ASN 112 HA ASN 112 10.218 5.333 -6.990 647 1HB ASN 112 HB2 ASN 112 11.182 7.511 -6.422 648 2HB ASN 112 HB1 ASN 112 11.274 7.046 -4.737 649 1HD2 ASN 112 HD2 ASN 112 12.727 6.913 -7.792 650 2HD2 ASN 112 HD2 ASN 112 14.140 6.046 -7.343 651 H LYS 113 HN LYS 113 9.976 5.617 -3.461 652 HA LYS 113 HA LYS 113 11.413 3.246 -2.875 653 1HB LYS 113 HB2 LYS 113 10.975 5.272 -1.375 654 2HB LYS 113 HB1 LYS 113 9.400 4.571 -1.085 655 1HG LYS 113 HG2 LYS 113 10.923 3.994 0.731 656 2HG LYS 113 HG1 LYS 113 10.440 2.559 -0.177 657 1HD LYS 113 HD2 LYS 113 12.823 2.571 0.377 658 2HD LYS 113 HD1 LYS 113 12.541 2.544 -1.358 659 1HE LYS 113 HE2 LYS 113 12.967 4.921 -1.471 660 2HE LYS 113 HE1 LYS 113 13.246 4.985 0.281 661 1HZ LYS 113 HZ1 LYS 113 14.757 3.442 -1.721 662 2HZ LYS 113 HZ3 LYS 113 15.295 4.873 -1.007 663 3HZ LYS 113 HZ2 LYS 113 15.112 3.482 -0.048 664 H LYS 114 HN LYS 114 7.983 3.996 -3.066 665 HA LYS 114 HA LYS 114 6.760 1.644 -2.370 666 1HB LYS 114 HB2 LYS 114 5.640 3.783 -2.922 667 2HB LYS 114 HB1 LYS 114 6.105 3.587 -4.598 668 1HG LYS 114 HG2 LYS 114 4.641 1.622 -4.752 669 2HG LYS 114 HG1 LYS 114 4.183 1.849 -3.062 670 1HD LYS 114 HD2 LYS 114 2.435 2.831 -4.405 671 2HD LYS 114 HD1 LYS 114 3.360 4.157 -3.700 672 1HE LYS 114 HE2 LYS 114 4.637 4.313 -5.834 673 2HE LYS 114 HE1 LYS 114 3.558 3.077 -6.479 674 1HZ LYS 114 HZ1 LYS 114 2.681 5.745 -5.465 675 2HZ LYS 114 HZ3 LYS 114 2.946 5.438 -7.043 676 3HZ LYS 114 HZ2 LYS 114 1.660 4.697 -6.288 677 H LYS 115 HN LYS 115 7.951 2.719 -5.511 678 HA LYS 115 HA LYS 115 7.389 0.407 -6.988 679 1HB LYS 115 HB2 LYS 115 9.358 2.641 -7.437 680 2HB LYS 115 HB1 LYS 115 9.046 1.382 -8.621 681 1HG LYS 115 HG2 LYS 115 6.816 2.087 -8.944 682 2HG LYS 115 HG1 LYS 115 6.848 3.088 -7.492 683 1HD LYS 115 HD2 LYS 115 6.966 4.498 -9.420 684 2HD LYS 115 HD1 LYS 115 8.499 4.550 -8.574 685 1HE LYS 115 HE2 LYS 115 8.934 4.419 -10.946 686 2HE LYS 115 HE1 LYS 115 9.432 2.917 -10.177 687 1HZ LYS 115 HZ1 LYS 115 7.362 1.895 -10.960 688 2HZ LYS 115 HZ3 LYS 115 6.924 3.363 -11.688 689 3HZ LYS 115 HZ2 LYS 115 8.281 2.520 -12.224 690 H GLU 116 HN GLU 116 10.359 1.420 -5.318 691 HA GLU 116 HA GLU 116 12.009 -0.725 -6.008 692 1HB GLU 116 HB2 GLU 116 11.891 0.771 -3.371 693 2HB GLU 116 HB1 GLU 116 13.123 -0.408 -3.770 694 1HG GLU 116 HG2 GLU 116 13.622 1.161 -5.761 695 2HG GLU 116 HG1 GLU 116 12.696 2.347 -4.830 696 H LEU 117 HN LEU 117 9.687 -0.430 -3.410 697 HA LEU 117 HA LEU 117 10.186 -2.962 -2.288 698 1HB LEU 117 HB2 LEU 117 9.324 -1.366 -0.823 699 2HB LEU 117 HB1 LEU 117 8.084 -0.864 -1.935 700 HG LEU 117 HG LEU 117 7.264 -2.047 0.129 701 1HD1 LEU 117 HD1 LEU 117 5.889 -1.725 -1.675 702 2HD1 LEU 117 HD1 LEU 117 6.432 -3.225 -2.420 703 3HD1 LEU 117 HD1 LEU 117 5.559 -3.271 -0.874 704 1HD2 LEU 117 HD2 LEU 117 8.461 -4.464 -1.171 705 2HD2 LEU 117 HD2 LEU 117 8.986 -3.736 0.352 706 3HD2 LEU 117 HD2 LEU 117 7.375 -4.455 0.221 707 H ILE 118 HN ILE 118 7.797 -1.800 -4.596 708 HA ILE 118 HA ILE 118 6.254 -4.094 -4.603 709 HB ILE 118 HB ILE 118 6.741 -2.251 -6.971 710 1HG1 ILE 118 2HG1 ILE 118 4.356 -2.295 -5.132 711 2HG1 ILE 118 1HG1 ILE 118 5.769 -1.309 -4.771 712 1HG2 ILE 118 3HG2 ILE 118 4.643 -4.352 -6.429 713 2HG2 ILE 118 2HG2 ILE 118 4.510 -3.178 -7.750 714 3HG2 ILE 118 1HG2 ILE 118 5.829 -4.364 -7.714 715 1HD1 ILE 118 HD1 ILE 118 4.123 -1.112 -7.285 716 2HD1 ILE 118 HD1 ILE 118 3.967 -0.060 -5.868 717 3HD1 ILE 118 HD1 ILE 118 5.459 -0.075 -6.800 718 H GLN 119 HN GLN 119 9.131 -3.257 -6.444 719 HA GLN 119 HA GLN 119 9.258 -5.551 -8.052 720 1HB GLN 119 HB2 GLN 119 11.458 -3.750 -7.051 721 2HB GLN 119 HB1 GLN 119 11.675 -4.991 -8.279 722 1HG GLN 119 HG2 GLN 119 10.017 -3.868 -9.687 723 2HG GLN 119 HG1 GLN 119 9.850 -2.613 -8.469 724 1HE2 GLN 119 1HE2 GLN 119 12.726 -2.559 -7.873 725 2HE2 GLN 119 2HE2 GLN 119 13.447 -1.794 -9.236 726 H LEU 120 HN LEU 120 10.087 -5.021 -4.741 727 HA LEU 120 HA LEU 120 11.612 -7.426 -4.516 728 1HB LEU 120 HB2 LEU 120 10.477 -5.631 -2.378 729 2HB LEU 120 HB1 LEU 120 11.481 -7.031 -2.064 730 HG LEU 120 HG LEU 120 12.334 -4.546 -3.551 731 1HD1 LEU 120 HD1 LEU 120 13.071 -5.595 -0.830 732 2HD1 LEU 120 HD1 LEU 120 13.774 -4.181 -1.616 733 3HD1 LEU 120 HD1 LEU 120 12.069 -4.182 -1.167 734 1HD2 LEU 120 HD2 LEU 120 13.885 -7.028 -2.804 735 2HD2 LEU 120 HD2 LEU 120 13.479 -6.505 -4.435 736 3HD2 LEU 120 HD2 LEU 120 14.590 -5.548 -3.454 737 H VAL 121 HN VAL 121 8.233 -6.528 -3.363 738 HA VAL 121 HA VAL 121 7.761 -9.174 -2.631 739 HB VAL 121 HB VAL 121 5.689 -8.609 -2.176 740 1HG1 VAL 121 1HG1 VAL 121 6.884 -7.056 -0.979 741 2HG1 VAL 121 3HG1 VAL 121 6.848 -5.900 -2.315 742 3HG1 VAL 121 2HG1 VAL 121 5.354 -6.327 -1.475 743 1HG2 VAL 121 2HG2 VAL 121 5.450 -6.839 -4.586 744 2HG2 VAL 121 1HG2 VAL 121 4.799 -8.465 -4.297 745 3HG2 VAL 121 3HG2 VAL 121 4.163 -7.106 -3.374 746 H ALA 122 HN ALA 122 7.675 -7.630 -5.713 747 HA ALA 122 HA ALA 122 6.150 -9.554 -7.094 748 1HB ALA 122 HB2 ALA 122 8.254 -7.699 -8.197 749 2HB ALA 122 HB1 ALA 122 7.021 -8.549 -9.144 750 3HB ALA 122 HB3 ALA 122 6.553 -7.315 -7.976 751 H ARG 123 HN ARG 123 9.654 -9.220 -6.577 752 HA ARG 123 HA ARG 123 10.257 -11.471 -8.198 753 1HB ARG 123 HB2 ARG 123 12.550 -11.280 -7.401 754 2HB ARG 123 HB1 ARG 123 11.907 -9.714 -7.870 755 1HG ARG 123 HG2 ARG 123 11.537 -9.183 -5.516 756 2HG ARG 123 HG1 ARG 123 12.222 -10.738 -5.056 757 1HD ARG 123 HD2 ARG 123 13.888 -8.960 -4.877 758 2HD ARG 123 HD1 ARG 123 14.339 -10.134 -6.113 759 HE ARG 123 HE ARG 123 12.865 -7.952 -7.190 760 1HH1 ARG 123 1HH1 ARG 123 16.111 -8.976 -6.238 761 2HH1 ARG 123 2HH1 ARG 123 16.897 -7.787 -7.172 762 1HH2 ARG 123 1HH2 ARG 123 13.967 -6.400 -8.533 763 2HH2 ARG 123 2HH2 ARG 123 15.657 -6.293 -8.500 764 H HIS 124 HN HIS 124 8.994 -11.219 -5.165 765 HA HIS 124 HA HIS 124 9.915 -13.579 -3.932 766 1HB HIS 124 HB2 HIS 124 8.707 -11.963 -2.632 767 2HB HIS 124 HB1 HIS 124 7.318 -12.003 -3.684 768 HD1 HIS 124 HD1 HIS 124 5.502 -13.741 -3.074 769 HD2 HIS 124 HD2 HIS 124 9.045 -14.259 -0.982 770 HE1 HIS 124 HE1 HIS 124 5.040 -15.487 -1.339 771 H GLY 125 HN GLY 125 7.711 -12.956 -6.531 772 1HA GLY 125 HA1 GLY 125 6.988 -15.805 -6.615 773 2HA GLY 125 HA2 GLY 125 7.690 -15.016 -8.014 774 H LEU 126 HN LEU 126 6.228 -12.510 -7.796 775 HA LEU 126 HA LEU 126 3.484 -13.422 -8.022 776 1HB LEU 126 HB2 LEU 126 4.678 -10.684 -8.086 777 2HB LEU 126 HB1 LEU 126 2.999 -10.966 -8.422 778 HG LEU 126 HG LEU 126 4.492 -11.336 -5.923 779 1HD1 LEU 126 HD1 LEU 126 2.161 -9.573 -6.592 780 2HD1 LEU 126 HD1 LEU 126 2.855 -9.758 -4.978 781 3HD1 LEU 126 HD1 LEU 126 3.826 -9.088 -6.285 782 1HD2 LEU 126 HD2 LEU 126 1.686 -12.301 -6.457 783 2HD2 LEU 126 HD2 LEU 126 3.085 -13.249 -5.948 784 3HD2 LEU 126 HD2 LEU 126 2.356 -12.090 -4.846 785 H ASP 127 HN ASP 127 2.272 -13.083 -9.736 786 HA ASP 127 HA ASP 127 3.529 -13.178 -12.356 787 1HB ASP 127 HB2 ASP 127 0.585 -12.940 -11.638 788 2HB ASP 127 HB1 ASP 127 1.232 -13.343 -13.220 789 H HIS 128 HN HIS 128 2.821 -11.545 -14.017 790 HA HIS 128 HA HIS 128 3.262 -8.918 -13.242 791 1HB HIS 128 HB2 HIS 128 1.717 -9.901 -15.653 792 2HB HIS 128 HB1 HIS 128 2.173 -8.220 -15.410 793 HD1 HIS 128 HD1 HIS 128 3.375 -11.307 -16.918 794 HD2 HIS 128 HD2 HIS 128 5.075 -7.895 -15.273 795 HE1 HIS 128 HE1 HIS 128 5.726 -11.224 -17.783 796 H ASP 129 HN ASP 129 0.246 -10.632 -13.530 797 HA ASP 129 HA ASP 129 -1.551 -8.553 -13.134 798 1HB ASP 129 HB2 ASP 129 -2.343 -10.648 -13.908 799 2HB ASP 129 HB1 ASP 129 -1.667 -11.493 -12.523 800 H LYS 130 HN LYS 130 -0.011 -10.711 -10.822 801 HA LYS 130 HA LYS 130 -1.290 -9.749 -8.546 802 1HB LYS 130 HB2 LYS 130 1.259 -11.206 -9.036 803 2HB LYS 130 HB1 LYS 130 0.763 -10.850 -7.413 804 1HG LYS 130 HG2 LYS 130 -0.945 -12.380 -9.386 805 2HG LYS 130 HG1 LYS 130 0.264 -13.156 -8.377 806 1HD LYS 130 HD2 LYS 130 -1.608 -13.479 -7.133 807 2HD LYS 130 HD1 LYS 130 -0.943 -11.996 -6.466 808 1HE LYS 130 HE2 LYS 130 -3.349 -11.933 -6.670 809 2HE LYS 130 HE1 LYS 130 -2.630 -10.657 -7.627 810 1HZ LYS 130 HZ1 LYS 130 -3.552 -13.269 -8.780 811 2HZ LYS 130 HZ3 LYS 130 -4.518 -11.951 -8.600 812 3HZ LYS 130 HZ2 LYS 130 -3.271 -11.820 -9.651 813 H VAL 131 HN VAL 131 1.742 -8.894 -10.111 814 HA VAL 131 HA VAL 131 2.662 -7.006 -8.253 815 HB VAL 131 HB VAL 131 3.086 -6.919 -11.255 816 1HG1 VAL 131 2HG1 VAL 131 3.847 -4.917 -10.137 817 2HG1 VAL 131 1HG1 VAL 131 4.800 -5.888 -9.015 818 3HG1 VAL 131 3HG1 VAL 131 5.214 -5.865 -10.729 819 1HG2 VAL 131 1HG2 VAL 131 4.610 -8.483 -9.186 820 2HG2 VAL 131 3HG2 VAL 131 3.554 -9.120 -10.445 821 3HG2 VAL 131 2HG2 VAL 131 5.059 -8.311 -10.892 822 H LEU 132 HN LEU 132 0.603 -6.675 -11.122 823 HA LEU 132 HA LEU 132 0.254 -3.865 -11.015 824 1HB LEU 132 HB2 LEU 132 -1.650 -5.917 -12.120 825 2HB LEU 132 HB1 LEU 132 -1.661 -4.201 -12.465 826 HG LEU 132 HG LEU 132 0.395 -6.221 -13.306 827 1HD1 LEU 132 HD1 LEU 132 -1.521 -4.528 -14.859 828 2HD1 LEU 132 HD1 LEU 132 -0.279 -5.575 -15.557 829 3HD1 LEU 132 HD1 LEU 132 -1.599 -6.273 -14.612 830 1HD2 LEU 132 HD2 LEU 132 0.434 -3.223 -13.660 831 2HD2 LEU 132 HD2 LEU 132 1.562 -4.210 -12.725 832 3HD2 LEU 132 HD2 LEU 132 1.512 -4.362 -14.478 833 H LEU 133 HN LEU 133 -1.670 -6.476 -9.681 834 HA LEU 133 HA LEU 133 -3.661 -4.809 -8.590 835 1HB LEU 133 HB2 LEU 133 -2.778 -7.569 -7.811 836 2HB LEU 133 HB1 LEU 133 -4.198 -6.764 -7.167 837 HG LEU 133 HG LEU 133 -3.788 -7.397 -10.089 838 1HD1 LEU 133 HD1 LEU 133 -5.335 -8.878 -7.976 839 2HD1 LEU 133 HD1 LEU 133 -5.440 -9.153 -9.723 840 3HD1 LEU 133 HD1 LEU 133 -3.923 -9.439 -8.887 841 1HD2 LEU 133 HD2 LEU 133 -6.191 -6.458 -8.527 842 2HD2 LEU 133 HD2 LEU 133 -5.299 -5.545 -9.750 843 3HD2 LEU 133 HD2 LEU 133 -6.210 -6.984 -10.204 844 H PHE 134 HN PHE 134 -0.675 -6.107 -7.225 845 HA PHE 134 HA PHE 134 -1.086 -5.127 -4.626 846 1HB PHE 134 HB2 PHE 134 0.591 -6.836 -5.079 847 2HB PHE 134 HB1 PHE 134 1.493 -5.725 -6.100 848 HD1 PHE 134 HD1 PHE 134 3.054 -4.231 -5.163 849 HD2 PHE 134 HD2 PHE 134 0.416 -6.386 -2.630 850 HE1 PHE 134 HE1 PHE 134 4.333 -3.487 -3.190 851 HE2 PHE 134 HE2 PHE 134 1.691 -5.639 -0.668 852 HZ PHE 134 HZ PHE 134 3.647 -4.184 -0.960 853 H SER 135 HN SER 135 0.637 -3.771 -7.400 854 HA SER 135 HA SER 135 1.573 -1.517 -6.071 855 1HB SER 135 HB2 SER 135 1.931 -0.594 -8.411 856 2HB SER 135 HB1 SER 135 2.672 -2.157 -8.056 857 HG SER 135 HG SER 135 1.246 -3.164 -9.249 858 H ARG 136 HN ARG 136 -1.435 -2.017 -7.808 859 HA ARG 136 HA ARG 136 -2.137 0.741 -7.656 860 1HB ARG 136 HB2 ARG 136 -4.397 0.031 -8.412 861 2HB ARG 136 HB1 ARG 136 -3.090 -0.510 -9.456 862 1HG ARG 136 HG2 ARG 136 -3.210 -2.713 -8.286 863 2HG ARG 136 HG1 ARG 136 -4.673 -2.132 -7.489 864 1HD ARG 136 HD2 ARG 136 -4.253 -2.286 -10.462 865 2HD ARG 136 HD1 ARG 136 -5.106 -3.492 -9.513 866 HE ARG 136 HE ARG 136 -6.546 -1.513 -8.830 867 1HH1 ARG 136 1HH1 ARG 136 -5.094 -1.817 -12.057 868 2HH1 ARG 136 2HH1 ARG 136 -6.413 -1.135 -12.872 869 1HH2 ARG 136 1HH2 ARG 136 -8.349 -0.544 -9.960 870 2HH2 ARG 136 2HH2 ARG 136 -8.309 -0.363 -11.645 871 H ASP 137 HN ASP 137 -2.873 -2.045 -5.589 872 HA ASP 137 HA ASP 137 -4.785 -0.638 -3.986 873 1HB ASP 137 HB2 ASP 137 -4.462 -3.173 -4.053 874 2HB ASP 137 HB1 ASP 137 -3.035 -2.928 -3.056 875 H LEU 138 HN LEU 138 -1.357 -1.263 -3.795 876 HA LEU 138 HA LEU 138 -0.770 0.065 -1.396 877 1HB LEU 138 HB2 LEU 138 0.778 -1.492 -2.330 878 2HB LEU 138 HB1 LEU 138 0.860 -0.608 -3.832 879 HG LEU 138 HG LEU 138 2.156 1.151 -2.771 880 1HD1 LEU 138 HD1 LEU 138 1.155 1.083 -0.562 881 2HD1 LEU 138 HD1 LEU 138 1.938 -0.479 -0.250 882 3HD1 LEU 138 HD1 LEU 138 2.916 0.978 -0.511 883 1HD2 LEU 138 HD2 LEU 138 3.177 -1.600 -2.137 884 2HD2 LEU 138 HD2 LEU 138 3.333 -0.751 -3.677 885 3HD2 LEU 138 HD2 LEU 138 4.157 -0.137 -2.245 886 H ASP 139 HN ASP 139 -0.828 1.173 -4.741 887 HA ASP 139 HA ASP 139 0.168 3.758 -4.360 888 1HB ASP 139 HB2 ASP 139 -0.126 2.760 -6.578 889 2HB ASP 139 HB1 ASP 139 -1.873 2.797 -6.367 890 H LYS 140 HN LYS 140 -3.141 2.566 -4.393 891 HA LYS 140 HA LYS 140 -4.320 5.038 -3.767 892 1HB LYS 140 HB2 LYS 140 -5.365 2.242 -3.412 893 2HB LYS 140 HB1 LYS 140 -6.305 3.715 -3.189 894 1HG LYS 140 HG2 LYS 140 -5.960 4.319 -5.512 895 2HG LYS 140 HG1 LYS 140 -4.938 2.900 -5.750 896 1HD LYS 140 HD2 LYS 140 -6.881 1.471 -5.220 897 2HD LYS 140 HD1 LYS 140 -7.879 2.916 -5.073 898 1HE LYS 140 HE2 LYS 140 -6.385 2.040 -7.546 899 2HE LYS 140 HE1 LYS 140 -8.116 1.867 -7.281 900 1HZ LYS 140 HZ3 LYS 140 -6.655 4.470 -7.460 901 2HZ LYS 140 HZ2 LYS 140 -7.622 3.783 -8.654 902 3HZ LYS 140 HZ1 LYS 140 -8.310 4.280 -7.209 903 H LEU 141 HN LEU 141 -3.136 2.406 -1.771 904 HA LEU 141 HA LEU 141 -4.150 3.288 0.702 905 1HB LEU 141 HB2 LEU 141 -3.185 1.075 0.454 906 2HB LEU 141 HB1 LEU 141 -1.633 1.768 0.040 907 HG LEU 141 HG LEU 141 -1.415 2.659 2.317 908 1HD1 LEU 141 HD1 LEU 141 -4.003 1.220 2.855 909 2HD1 LEU 141 HD1 LEU 141 -2.951 1.936 4.076 910 3HD1 LEU 141 HD1 LEU 141 -3.743 2.963 2.885 911 1HD2 LEU 141 HD2 LEU 141 -1.997 -0.293 2.185 912 2HD2 LEU 141 HD2 LEU 141 -0.468 0.490 1.789 913 3HD2 LEU 141 HD2 LEU 141 -1.066 0.516 3.446 914 H ILE 142 HN ILE 142 -1.197 3.972 -0.998 915 HA ILE 142 HA ILE 142 -0.175 5.637 1.050 916 HB ILE 142 HB ILE 142 0.708 5.259 -1.818 917 1HG1 ILE 142 2HG1 ILE 142 1.903 4.532 0.855 918 2HG1 ILE 142 1HG1 ILE 142 1.148 3.420 -0.277 919 1HG2 ILE 142 2HG2 ILE 142 1.988 7.038 0.269 920 2HG2 ILE 142 1HG2 ILE 142 2.682 6.629 -1.302 921 3HG2 ILE 142 3HG2 ILE 142 1.201 7.581 -1.212 922 1HD1 ILE 142 HD1 ILE 142 3.669 4.983 -0.769 923 2HD1 ILE 142 HD1 ILE 142 3.595 3.296 -0.265 924 3HD1 ILE 142 HD1 ILE 142 2.953 3.778 -1.840 925 H ASN 143 HN ASN 143 -1.695 6.369 -2.068 926 HA ASN 143 HA ASN 143 -1.614 9.151 -1.703 927 1HB ASN 143 HB2 ASN 143 -3.433 7.457 -3.407 928 2HB ASN 143 HB1 ASN 143 -3.486 9.215 -3.416 929 1HD2 ASN 143 HD2 ASN 143 -2.801 7.370 -5.548 930 2HD2 ASN 143 HD2 ASN 143 -1.208 7.729 -6.066 931 H LYS 144 HN LYS 144 -3.806 6.776 -0.533 932 HA LYS 144 HA LYS 144 -5.921 8.338 0.409 933 1HB LYS 144 HB2 LYS 144 -5.781 5.877 0.348 934 2HB LYS 144 HB1 LYS 144 -4.635 5.913 1.670 935 1HG LYS 144 HG2 LYS 144 -6.415 6.956 3.083 936 2HG LYS 144 HG1 LYS 144 -7.543 6.696 1.751 937 1HD LYS 144 HD2 LYS 144 -6.014 4.574 3.272 938 2HD LYS 144 HD1 LYS 144 -7.747 4.871 3.336 939 1HE LYS 144 HE2 LYS 144 -7.865 4.294 0.895 940 2HE LYS 144 HE1 LYS 144 -6.161 3.884 0.959 941 1HZ LYS 144 HZ2 LYS 144 -6.729 2.202 2.678 942 2HZ LYS 144 HZ1 LYS 144 -8.348 2.564 2.451 943 3HZ LYS 144 HZ3 LYS 144 -7.457 1.894 1.190 944 H PHE 145 HN PHE 145 -2.967 7.240 2.055 945 HA PHE 145 HA PHE 145 -3.425 8.887 4.326 946 1HB PHE 145 HB2 PHE 145 -1.257 7.008 3.533 947 2HB PHE 145 HB1 PHE 145 -0.994 8.125 4.871 948 HD1 PHE 145 HD1 PHE 145 -3.156 5.357 3.664 949 HD2 PHE 145 HD2 PHE 145 -1.965 7.767 6.957 950 HE1 PHE 145 HE1 PHE 145 -4.362 3.849 5.193 951 HE2 PHE 145 HE2 PHE 145 -3.179 6.249 8.503 952 HZ PHE 145 HZ PHE 145 -4.374 4.299 7.611 953 H MET 146 HN MET 146 -1.753 9.338 1.387 954 HA MET 146 HA MET 146 -0.201 11.649 2.161 955 1HB MET 146 HB2 MET 146 -1.336 10.966 -0.568 956 2HB MET 146 HB1 MET 146 -0.133 12.182 -0.220 957 1HG MET 146 HG2 MET 146 0.341 9.262 0.232 958 2HG MET 146 HG1 MET 146 0.633 10.045 -1.309 959 1HE MET 146 HE2 MET 146 1.874 9.251 2.209 960 2HE MET 146 HE1 MET 146 3.182 10.423 2.474 961 3HE MET 146 HE3 MET 146 1.505 10.939 2.577 962 H ASN 147 HN ASN 147 -3.461 10.967 1.635 963 HA ASN 147 HA ASN 147 -5.382 12.091 1.640 964 1HB ASN 147 HB2 ASN 147 -4.319 13.212 3.661 965 2HB ASN 147 HB1 ASN 147 -3.792 14.506 2.598 966 1HD2 ASN 147 HD2 ASN 147 -4.972 16.015 3.783 967 2HD2 ASN 147 HD2 ASN 147 -6.686 16.123 3.735 968 H VAL 148 HN VAL 148 -3.553 12.054 -0.634 969 HA VAL 148 HA VAL 148 -4.119 14.529 -2.063 970 HB VAL 148 HB VAL 148 -2.597 12.123 -3.031 971 1HG1 VAL 148 2HG1 VAL 148 -3.510 13.440 -4.873 972 2HG1 VAL 148 1HG1 VAL 148 -2.813 14.910 -4.202 973 3HG1 VAL 148 3HG1 VAL 148 -1.758 13.638 -4.820 974 1HG2 VAL 148 3HG2 VAL 148 -1.490 13.237 -1.150 975 2HG2 VAL 148 2HG2 VAL 148 -0.543 13.401 -2.634 976 3HG2 VAL 148 1HG2 VAL 148 -1.509 14.753 -2.030 977 H LYS 149 HN LYS 149 -6.001 14.534 -2.598 978 HA LYS 149 HA LYS 149 -7.160 12.381 -4.178 979 1HB LYS 149 HB2 LYS 149 -9.317 12.980 -2.986 980 2HB LYS 149 HB1 LYS 149 -8.092 12.219 -1.962 981 1HG LYS 149 HG2 LYS 149 -7.372 14.383 -1.189 982 2HG LYS 149 HG1 LYS 149 -8.603 15.180 -2.165 983 1HD LYS 149 HD2 LYS 149 -10.308 13.950 -0.847 984 2HD LYS 149 HD1 LYS 149 -9.003 13.320 0.170 985 1HE LYS 149 HE2 LYS 149 -9.729 16.217 -0.245 986 2HE LYS 149 HE1 LYS 149 -9.971 15.274 1.222 987 1HZ LYS 149 HZ3 LYS 149 -7.309 15.905 0.031 988 2HZ LYS 149 HZ2 LYS 149 -7.969 16.708 1.317 989 3HZ LYS 149 HZ1 LYS 149 -7.572 15.074 1.462 990 H ASP 150 HN ASP 150 -5.789 14.996 -4.628 991 HA ASP 150 HA ASP 150 -7.497 17.112 -4.944 992 1HB ASP 150 HB2 ASP 150 -4.857 16.611 -6.278 993 2HB ASP 150 HB1 ASP 150 -5.828 18.054 -6.568 994 H LYS 151 HN LYS 151 -8.472 18.118 -6.544 995 HA LYS 151 HA LYS 151 -9.411 16.353 -8.662 996 1HB LYS 151 HB2 LYS 151 -11.261 17.970 -8.896 997 2HB LYS 151 HB1 LYS 151 -11.143 17.322 -7.269 998 1HG LYS 151 HG2 LYS 151 -9.937 19.392 -6.588 999 2HG LYS 151 HG1 LYS 151 -10.226 20.038 -8.201 1000 1HD LYS 151 HD2 LYS 151 -12.354 19.196 -6.235 1001 2HD LYS 151 HD1 LYS 151 -11.849 20.853 -6.558 1002 1HE LYS 151 HE2 LYS 151 -12.585 20.611 -8.893 1003 2HE LYS 151 HE1 LYS 151 -13.077 18.952 -8.553 1004 1HZ LYS 151 HZ3 LYS 151 -14.676 19.792 -6.960 1005 2HZ LYS 151 HZ2 LYS 151 -14.228 21.387 -7.317 1006 3HZ LYS 151 HZ1 LYS 151 -14.947 20.424 -8.497 1007 H VAL 152 HN VAL 152 -6.994 18.192 -8.403 1008 HA VAL 152 HA VAL 152 -7.277 19.654 -10.929 1009 HB VAL 152 HB VAL 152 -5.276 20.903 -10.334 1010 1HG1 VAL 152 1HG1 VAL 152 -7.167 20.772 -8.002 1011 2HG1 VAL 152 3HG1 VAL 152 -6.020 22.073 -8.310 1012 3HG1 VAL 152 2HG1 VAL 152 -7.341 21.774 -9.440 1013 1HG2 VAL 152 2HG2 VAL 152 -4.006 19.133 -9.210 1014 2HG2 VAL 152 1HG2 VAL 152 -4.080 20.589 -8.213 1015 3HG2 VAL 152 3HG2 VAL 152 -5.113 19.212 -7.840 1016 H HIS 153 HN HIS 153 -4.984 19.639 -12.134 1017 HA HIS 153 HA HIS 153 -4.532 16.920 -12.813 1018 1HB HIS 153 HB2 HIS 153 -4.312 18.718 -14.503 1019 2HB HIS 153 HB1 HIS 153 -2.952 19.387 -13.617 1020 HD1 HIS 153 HD1 HIS 153 -3.813 16.083 -15.422 1021 HD2 HIS 153 HD2 HIS 153 -0.563 18.509 -14.483 1022 HE1 HIS 153 HE1 HIS 153 -1.826 15.040 -16.519 1023 H LYS 154 HN LYS 154 -3.511 15.608 -11.658 1024 HA LYS 154 HA LYS 154 -1.460 16.416 -9.722 1025 1HB LYS 154 HB2 LYS 154 -3.085 13.908 -10.119 1026 2HB LYS 154 HB1 LYS 154 -1.910 14.107 -8.837 1027 1HG LYS 154 HG2 LYS 154 -3.211 15.852 -7.833 1028 2HG LYS 154 HG1 LYS 154 -4.331 15.861 -9.193 1029 1HD LYS 154 HD2 LYS 154 -3.897 13.535 -7.309 1030 2HD LYS 154 HD1 LYS 154 -5.241 14.672 -7.222 1031 1HE LYS 154 HE2 LYS 154 -5.860 13.996 -9.554 1032 2HE LYS 154 HE1 LYS 154 -4.626 12.742 -9.463 1033 1HZ LYS 154 HZ3 LYS 154 -5.873 11.841 -7.493 1034 2HZ LYS 154 HZ2 LYS 154 -7.068 12.988 -7.814 1035 3HZ LYS 154 HZ1 LYS 154 -6.743 11.816 -8.937 1036 H LEU 155 HN LEU 155 -0.035 14.149 -9.482 1037 HA LEU 155 HA LEU 155 1.620 13.968 -11.741 1038 1HB LEU 155 HB2 LEU 155 1.189 12.031 -9.477 1039 2HB LEU 155 HB1 LEU 155 2.396 11.805 -10.718 1040 HG LEU 155 HG LEU 155 2.327 14.045 -8.697 1041 1HD1 LEU 155 HD1 LEU 155 4.046 11.587 -8.980 1042 2HD1 LEU 155 HD1 LEU 155 4.338 12.885 -7.826 1043 3HD1 LEU 155 HD1 LEU 155 2.869 11.905 -7.710 1044 1HD2 LEU 155 HD2 LEU 155 4.358 13.354 -10.830 1045 2HD2 LEU 155 HD2 LEU 155 3.329 14.785 -10.804 1046 3HD2 LEU 155 HD2 LEU 155 4.573 14.569 -9.572 1047 H GLU 156 HN GLU 156 1.516 12.756 -13.496 1048 HA GLU 156 HA GLU 156 -0.812 11.244 -14.114 1049 1HB GLU 156 HB2 GLU 156 0.539 12.540 -15.776 1050 2HB GLU 156 HB1 GLU 156 1.881 11.449 -15.498 1051 1HG GLU 156 HG2 GLU 156 0.554 9.607 -16.407 1052 2HG GLU 156 HG1 GLU 156 -0.778 10.731 -16.703 1053 H HIS 157 HN HIS 157 -0.950 9.600 -12.678 1054 HA HIS 157 HA HIS 157 1.412 7.977 -12.225 1055 1HB HIS 157 HB2 HIS 157 0.248 7.139 -10.167 1056 2HB HIS 157 HB1 HIS 157 0.631 8.850 -10.156 1057 HD1 HIS 157 HD1 HIS 157 -1.446 10.514 -10.280 1058 HD2 HIS 157 HD2 HIS 157 -2.425 6.483 -9.984 1059 HE1 HIS 157 HE1 HIS 157 -3.866 10.426 -9.589 1060 H HIS 158 HN HIS 158 1.612 6.037 -12.867 1061 HA HIS 158 HA HIS 158 -0.530 4.209 -13.224 1062 1HB HIS 158 HB2 HIS 158 -0.572 5.620 -15.355 1063 2HB HIS 158 HB1 HIS 158 1.085 5.114 -15.649 1064 HD1 HIS 158 HD1 HIS 158 1.321 3.028 -17.093 1065 HD2 HIS 158 HD2 HIS 158 -2.409 3.333 -15.283 1066 HE1 HIS 158 HE1 HIS 158 -0.060 1.176 -18.040 1067 H HIS 159 HN HIS 159 0.619 2.117 -14.026 1068 HA HIS 159 HA HIS 159 3.131 1.940 -12.648 1069 1HB HIS 159 HB2 HIS 159 3.054 -0.483 -13.262 1070 2HB HIS 159 HB1 HIS 159 1.610 0.048 -12.423 1071 HD1 HIS 159 HD1 HIS 159 -0.625 -0.325 -13.649 1072 HD2 HIS 159 HD2 HIS 159 2.700 -1.020 -16.048 1073 HE1 HIS 159 HE1 HIS 159 -1.490 -1.416 -15.740 1074 H HIS 160 HN HIS 160 5.133 1.597 -13.569 1075 HA HIS 160 HA HIS 160 5.311 2.367 -16.363 1076 1HB HIS 160 HB2 HIS 160 6.900 3.312 -14.582 1077 2HB HIS 160 HB1 HIS 160 7.611 1.706 -14.494 1078 HD1 HIS 160 HD1 HIS 160 9.542 1.278 -16.141 1079 HD2 HIS 160 HD2 HIS 160 7.118 4.475 -17.253 1080 HE1 HIS 160 HE1 HIS 160 10.629 2.327 -18.139 1081 H HIS 161 HN HIS 161 5.100 0.849 -17.774 1082 HA HIS 161 HA HIS 161 5.315 -1.886 -17.045 1083 1HB HIS 161 HB2 HIS 161 4.568 -2.366 -19.362 1084 2HB HIS 161 HB1 HIS 161 3.526 -1.210 -18.558 1085 HD1 HIS 161 HD1 HIS 161 3.340 1.167 -19.657 1086 HD2 HIS 161 HD2 HIS 161 6.063 -1.367 -21.526 1087 HE1 HIS 161 HE1 HIS 161 3.962 2.274 -21.813 1088 H HIS 162 HN HIS 162 6.827 -3.295 -17.497 1089 HA HIS 162 HA HIS 162 9.140 -2.415 -19.062 1090 1HB HIS 162 HB2 HIS 162 9.217 -4.159 -16.564 1091 2HB HIS 162 HB1 HIS 162 10.585 -3.812 -17.602 1092 HD1 HIS 162 HD1 HIS 162 9.788 -3.037 -14.400 1093 HD2 HIS 162 HD2 HIS 162 10.496 -0.613 -17.703 1094 HE1 HIS 162 HE1 HIS 162 10.454 -0.802 -13.488 No H/Q in entry = 1094 Start of MODEL 24 1 H1 MET 1 HT2 MET 1 19.039 -17.094 -3.087 2 H2 MET 1 HT1 MET 1 17.527 -17.435 -3.728 3 H3 MET 1 HT3 MET 1 18.668 -16.583 -4.631 4 HA MET 1 HA MET 1 18.619 -14.767 -3.035 5 1HB MET 1 HB2 MET 1 15.880 -15.572 -4.015 6 2HB MET 1 HB1 MET 1 16.258 -14.001 -3.346 7 1HG MET 1 HG2 MET 1 17.454 -15.157 -5.867 8 2HG MET 1 HG1 MET 1 16.135 -14.001 -5.805 9 1HE MET 1 HE2 MET 1 19.950 -14.465 -6.084 10 2HE MET 1 HE1 MET 1 20.629 -13.063 -5.271 11 3HE MET 1 HE3 MET 1 19.933 -14.375 -4.328 12 H GLU 2 HN GLU 2 16.391 -17.375 -2.154 13 HA GLU 2 HA GLU 2 15.719 -18.194 -0.243 14 1HB GLU 2 HB2 GLU 2 17.980 -16.550 0.917 15 2HB GLU 2 HB1 GLU 2 17.040 -17.711 1.849 16 1HG GLU 2 HG2 GLU 2 17.795 -19.530 0.530 17 2HG GLU 2 HG1 GLU 2 18.505 -18.461 -0.671 18 H MET 3 HN MET 3 13.845 -17.835 0.604 19 HA MET 3 HA MET 3 12.629 -15.335 0.385 20 1HB MET 3 HB2 MET 3 10.661 -16.237 1.437 21 2HB MET 3 HB1 MET 3 11.330 -17.446 0.357 22 1HG MET 3 HG2 MET 3 12.230 -18.676 2.224 23 2HG MET 3 HG1 MET 3 11.717 -17.419 3.349 24 1HE MET 3 HE3 MET 3 9.130 -16.872 3.840 25 2HE MET 3 HE2 MET 3 8.762 -16.735 2.120 26 3HE MET 3 HE1 MET 3 7.790 -17.782 3.146 27 H GLY 4 HN GLY 4 14.301 -16.769 3.063 28 1HA GLY 4 HA1 GLY 4 14.942 -15.911 5.105 29 2HA GLY 4 HA2 GLY 4 13.356 -15.157 5.160 30 H GLN 5 HN GLN 5 16.156 -14.668 3.041 31 HA GLN 5 HA GLN 5 16.830 -12.117 4.159 32 1HB GLN 5 HB2 GLN 5 17.680 -13.411 1.561 33 2HB GLN 5 HB1 GLN 5 18.341 -11.917 2.205 34 1HG GLN 5 HG2 GLN 5 19.217 -13.102 4.128 35 2HG GLN 5 HG1 GLN 5 18.501 -14.604 3.546 36 1HE2 GLN 5 1HE2 GLN 5 20.966 -12.247 3.020 37 2HE2 GLN 5 2HE2 GLN 5 21.946 -13.168 1.954 38 H LEU 6 HN LEU 6 15.191 -13.256 1.306 39 HA LEU 6 HA LEU 6 14.737 -10.889 -0.055 40 1HB LEU 6 HB2 LEU 6 14.389 -13.068 -1.056 41 2HB LEU 6 HB1 LEU 6 13.192 -13.460 0.145 42 HG LEU 6 HG LEU 6 12.390 -13.069 -2.225 43 1HD1 LEU 6 HD1 LEU 6 10.857 -13.192 -0.375 44 2HD1 LEU 6 HD1 LEU 6 11.104 -11.490 -0.017 45 3HD1 LEU 6 HD1 LEU 6 10.337 -11.962 -1.533 46 1HD2 LEU 6 HD2 LEU 6 12.872 -10.186 -1.472 47 2HD2 LEU 6 HD2 LEU 6 13.673 -11.080 -2.763 48 3HD2 LEU 6 HD2 LEU 6 11.946 -10.733 -2.867 49 H LYS 7 HN LYS 7 12.689 -12.457 2.400 50 HA LYS 7 HA LYS 7 10.587 -10.644 2.425 51 1HB LYS 7 HB2 LYS 7 11.010 -13.003 3.561 52 2HB LYS 7 HB1 LYS 7 11.529 -12.008 4.908 53 1HG LYS 7 HG2 LYS 7 8.905 -11.692 3.569 54 2HG LYS 7 HG1 LYS 7 9.101 -12.834 4.894 55 1HD LYS 7 HD2 LYS 7 9.577 -9.839 5.002 56 2HD LYS 7 HD1 LYS 7 8.116 -10.638 5.583 57 1HE LYS 7 HE2 LYS 7 10.898 -11.141 6.639 58 2HE LYS 7 HE1 LYS 7 9.735 -10.049 7.375 59 1HZ LYS 7 HZ2 LYS 7 9.357 -12.999 7.051 60 2HZ LYS 7 HZ1 LYS 7 9.749 -12.206 8.466 61 3HZ LYS 7 HZ3 LYS 7 8.263 -11.936 7.755 62 H ASN 8 HN ASN 8 13.622 -10.746 4.208 63 HA ASN 8 HA ASN 8 13.031 -8.534 5.859 64 1HB ASN 8 HB2 ASN 8 15.646 -9.859 5.207 65 2HB ASN 8 HB1 ASN 8 15.536 -8.445 6.250 66 1HD2 ASN 8 HD2 ASN 8 16.447 -11.054 6.917 67 2HD2 ASN 8 HD2 ASN 8 15.436 -11.643 8.187 68 H LYS 9 HN LYS 9 14.550 -8.767 2.712 69 HA LYS 9 HA LYS 9 15.364 -6.042 2.672 70 1HB LYS 9 HB2 LYS 9 14.762 -7.824 0.298 71 2HB LYS 9 HB1 LYS 9 15.643 -6.306 0.252 72 1HG LYS 9 HG2 LYS 9 16.524 -8.885 1.552 73 2HG LYS 9 HG1 LYS 9 17.190 -8.149 0.100 74 1HD LYS 9 HD2 LYS 9 17.334 -7.009 2.904 75 2HD LYS 9 HD1 LYS 9 18.650 -7.799 2.044 76 1HE LYS 9 HE2 LYS 9 18.511 -5.998 0.317 77 2HE LYS 9 HE1 LYS 9 17.300 -5.206 1.323 78 1HZ LYS 9 HZ3 LYS 9 18.949 -5.026 3.102 79 2HZ LYS 9 HZ2 LYS 9 20.084 -5.800 2.124 80 3HZ LYS 9 HZ1 LYS 9 19.507 -4.285 1.694 81 H ILE 10 HN ILE 10 12.470 -7.755 1.622 82 HA ILE 10 HA ILE 10 11.006 -5.618 0.530 83 HB ILE 10 HB ILE 10 10.077 -8.047 2.103 84 1HG1 ILE 10 2HG1 ILE 10 10.065 -7.478 -0.862 85 2HG1 ILE 10 1HG1 ILE 10 11.177 -8.559 -0.030 86 1HG2 ILE 10 1HG2 ILE 10 8.363 -6.326 2.273 87 2HG2 ILE 10 3HG2 ILE 10 8.364 -6.143 0.516 88 3HG2 ILE 10 2HG2 ILE 10 7.821 -7.655 1.245 89 1HD1 ILE 10 HD1 ILE 10 8.198 -8.908 -0.280 90 2HD1 ILE 10 HD1 ILE 10 9.435 -9.779 -1.187 91 3HD1 ILE 10 HD1 ILE 10 9.295 -10.011 0.556 92 H GLU 11 HN GLU 11 11.067 -6.853 3.839 93 HA GLU 11 HA GLU 11 9.509 -5.000 5.139 94 1HB GLU 11 HB2 GLU 11 12.007 -6.404 6.047 95 2HB GLU 11 HB1 GLU 11 11.023 -5.423 7.119 96 1HG GLU 11 HG2 GLU 11 10.034 -7.813 5.598 97 2HG GLU 11 HG1 GLU 11 10.564 -7.839 7.283 98 H ASN 12 HN ASN 12 12.971 -4.836 4.578 99 HA ASN 12 HA ASN 12 13.480 -2.404 5.823 100 1HB ASN 12 HB2 ASN 12 15.296 -3.873 5.309 101 2HB ASN 12 HB1 ASN 12 14.925 -3.820 3.592 102 1HD2 ASN 12 HD2 ASN 12 15.711 -2.170 2.375 103 2HD2 ASN 12 HD2 ASN 12 16.714 -0.920 2.980 104 H LYS 13 HN LYS 13 12.786 -3.025 2.400 105 HA LYS 13 HA LYS 13 13.130 -0.296 1.635 106 1HB LYS 13 HB2 LYS 13 13.339 -2.369 0.156 107 2HB LYS 13 HB1 LYS 13 11.590 -2.417 0.151 108 1HG LYS 13 HG2 LYS 13 12.444 -1.379 -1.876 109 2HG LYS 13 HG1 LYS 13 11.499 -0.236 -0.920 110 1HD LYS 13 HD2 LYS 13 13.489 0.840 -1.775 111 2HD LYS 13 HD1 LYS 13 13.599 0.723 -0.024 112 1HE LYS 13 HE2 LYS 13 15.733 0.189 -0.870 113 2HE LYS 13 HE1 LYS 13 15.013 -1.352 -0.419 114 1HZ LYS 13 HZ3 LYS 13 14.459 -1.675 -2.822 115 2HZ LYS 13 HZ2 LYS 13 15.199 -0.193 -3.131 116 3HZ LYS 13 HZ1 LYS 13 16.118 -1.460 -2.568 117 H LYS 14 HN LYS 14 10.371 -2.283 2.447 118 HA LYS 14 HA LYS 14 8.269 -0.498 1.979 119 1HB LYS 14 HB2 LYS 14 7.815 -2.743 2.417 120 2HB LYS 14 HB1 LYS 14 8.699 -2.749 3.952 121 1HG LYS 14 HG2 LYS 14 6.863 -1.065 4.692 122 2HG LYS 14 HG1 LYS 14 5.976 -1.658 3.289 123 1HD LYS 14 HD2 LYS 14 5.235 -2.983 5.131 124 2HD LYS 14 HD1 LYS 14 6.360 -3.991 4.216 125 1HE LYS 14 HE2 LYS 14 8.157 -3.408 5.789 126 2HE LYS 14 HE1 LYS 14 7.013 -2.431 6.694 127 1HZ LYS 14 HZ2 LYS 14 5.714 -4.574 7.069 128 2HZ LYS 14 HZ1 LYS 14 6.994 -5.397 6.380 129 3HZ LYS 14 HZ3 LYS 14 7.225 -4.511 7.774 130 H LYS 15 HN LYS 15 10.305 -1.000 4.786 131 HA LYS 15 HA LYS 15 9.100 0.945 6.445 132 1HB LYS 15 HB2 LYS 15 11.747 -0.472 6.584 133 2HB LYS 15 HB1 LYS 15 11.242 0.692 7.801 134 1HG LYS 15 HG2 LYS 15 9.369 -0.639 8.428 135 2HG LYS 15 HG1 LYS 15 9.569 -1.686 7.033 136 1HD LYS 15 HD2 LYS 15 10.308 -2.887 8.946 137 2HD LYS 15 HD1 LYS 15 11.722 -2.468 8.006 138 1HE LYS 15 HE2 LYS 15 10.809 -0.940 10.463 139 2HE LYS 15 HE1 LYS 15 11.981 -2.244 10.500 140 1HZ LYS 15 HZ1 LYS 15 13.383 -0.888 8.988 141 2HZ LYS 15 HZ3 LYS 15 12.301 0.412 9.194 142 3HZ LYS 15 HZ2 LYS 15 13.142 -0.234 10.495 143 H GLU 16 HN GLU 16 11.875 1.110 4.268 144 HA GLU 16 HA GLU 16 12.702 3.735 4.791 145 1HB GLU 16 HB2 GLU 16 12.576 2.240 2.167 146 2HB GLU 16 HB1 GLU 16 13.346 3.805 2.341 147 1HG GLU 16 HG2 GLU 16 14.974 2.810 3.879 148 2HG GLU 16 HG1 GLU 16 14.182 1.243 3.692 149 H LEU 17 HN LEU 17 10.077 2.460 2.872 150 HA LEU 17 HA LEU 17 9.239 4.894 1.683 151 1HB LEU 17 HB2 LEU 17 8.638 2.869 0.646 152 2HB LEU 17 HB1 LEU 17 7.855 2.266 2.104 153 HG LEU 17 HG LEU 17 6.342 4.407 1.741 154 1HD1 LEU 17 HD1 LEU 17 7.362 4.100 -0.960 155 2HD1 LEU 17 HD1 LEU 17 5.894 4.937 -0.425 156 3HD1 LEU 17 HD1 LEU 17 7.464 5.473 0.172 157 1HD2 LEU 17 HD2 LEU 17 5.672 2.124 1.775 158 2HD2 LEU 17 HD2 LEU 17 4.798 3.188 0.690 159 3HD2 LEU 17 HD2 LEU 17 5.983 2.007 0.015 160 H ILE 18 HN ILE 18 8.132 3.014 4.478 161 HA ILE 18 HA ILE 18 5.936 4.586 5.116 162 HB ILE 18 HB ILE 18 7.714 3.083 7.078 163 1HG1 ILE 18 2HG1 ILE 18 5.096 2.219 5.852 164 2HG1 ILE 18 1HG1 ILE 18 6.652 1.790 5.161 165 1HG2 ILE 18 3HG2 ILE 18 6.275 4.735 8.265 166 2HG2 ILE 18 2HG2 ILE 18 4.857 4.096 7.472 167 3HG2 ILE 18 1HG2 ILE 18 5.744 3.096 8.605 168 1HD1 ILE 18 HD1 ILE 18 7.229 0.627 7.210 169 2HD1 ILE 18 HD1 ILE 18 5.652 1.033 7.894 170 3HD1 ILE 18 HD1 ILE 18 5.766 -0.019 6.472 171 H GLN 19 HN GLN 19 9.277 4.905 6.104 172 HA GLN 19 HA GLN 19 8.967 7.136 7.766 173 1HB GLN 19 HB2 GLN 19 11.292 6.320 6.053 174 2HB GLN 19 HB1 GLN 19 11.373 7.547 7.313 175 1HG GLN 19 HG2 GLN 19 10.806 5.793 8.959 176 2HG GLN 19 HG1 GLN 19 10.824 4.606 7.650 177 1HE2 GLN 19 1HE2 GLN 19 12.710 6.693 9.611 178 2HE2 GLN 19 2HE2 GLN 19 14.259 6.065 9.211 179 H LEU 20 HN LEU 20 9.235 6.877 4.267 180 HA LEU 20 HA LEU 20 9.529 9.677 3.803 181 1HB LEU 20 HB2 LEU 20 8.710 7.441 1.951 182 2HB LEU 20 HB1 LEU 20 8.862 9.109 1.441 183 HG LEU 20 HG LEU 20 11.127 7.423 2.515 184 1HD1 LEU 20 HD1 LEU 20 10.341 6.634 0.349 185 2HD1 LEU 20 HD1 LEU 20 10.462 8.269 -0.299 186 3HD1 LEU 20 HD1 LEU 20 11.917 7.412 0.210 187 1HD2 LEU 20 HD2 LEU 20 11.093 10.168 1.251 188 2HD2 LEU 20 HD2 LEU 20 11.437 9.815 2.944 189 3HD2 LEU 20 HD2 LEU 20 12.535 9.255 1.687 190 H VAL 21 HN VAL 21 6.754 7.416 3.481 191 HA VAL 21 HA VAL 21 4.814 9.304 2.853 192 HB VAL 21 HB VAL 21 4.468 6.766 4.490 193 1HG1 VAL 21 3HG1 VAL 21 2.494 8.317 4.359 194 2HG1 VAL 21 2HG1 VAL 21 2.564 8.060 2.599 195 3HG1 VAL 21 1HG1 VAL 21 2.239 6.702 3.653 196 1HG2 VAL 21 3HG2 VAL 21 5.709 6.326 2.481 197 2HG2 VAL 21 2HG2 VAL 21 4.083 5.642 2.371 198 3HG2 VAL 21 1HG2 VAL 21 4.478 7.133 1.506 199 H ALA 22 HN ALA 22 6.073 8.244 5.960 200 HA ALA 22 HA ALA 22 4.275 9.612 7.617 201 1HB ALA 22 HB2 ALA 22 7.118 8.808 8.167 202 2HB ALA 22 HB1 ALA 22 5.897 9.211 9.386 203 3HB ALA 22 HB3 ALA 22 5.700 7.785 8.360 204 H ARG 23 HN ARG 23 7.579 10.492 6.550 205 HA ARG 23 HA ARG 23 7.601 12.968 7.906 206 1HB ARG 23 HB2 ARG 23 9.645 13.478 6.775 207 2HB ARG 23 HB1 ARG 23 9.665 11.765 7.146 208 1HG ARG 23 HG2 ARG 23 9.056 11.260 4.854 209 2HG ARG 23 HG1 ARG 23 9.027 12.971 4.452 210 1HD ARG 23 HD2 ARG 23 11.140 12.143 3.740 211 2HD ARG 23 HD1 ARG 23 11.429 13.076 5.205 212 HE ARG 23 HE ARG 23 11.257 10.135 5.159 213 1HH1 ARG 23 1HH1 ARG 23 12.774 13.097 6.461 214 2HH1 ARG 23 2HH1 ARG 23 13.986 12.242 7.274 215 1HH2 ARG 23 1HH2 ARG 23 12.984 9.024 6.253 216 2HH2 ARG 23 2HH2 ARG 23 14.129 9.921 7.150 217 H HIS 24 HN HIS 24 6.169 12.034 4.961 218 HA HIS 24 HA HIS 24 6.022 14.428 3.543 219 1HB HIS 24 HB2 HIS 24 5.261 12.270 2.657 220 2HB HIS 24 HB1 HIS 24 3.927 12.208 3.771 221 HD1 HIS 24 HD1 HIS 24 4.687 13.064 0.349 222 HD2 HIS 24 HD2 HIS 24 2.096 14.563 3.222 223 HE1 HIS 24 HE1 HIS 24 2.931 14.360 -0.903 224 H GLY 25 HN GLY 25 4.052 13.189 6.171 225 1HA GLY 25 HA1 GLY 25 2.513 15.646 6.233 226 2HA GLY 25 HA2 GLY 25 3.600 15.381 7.587 227 H LEU 26 HN LEU 26 3.248 12.518 7.763 228 HA LEU 26 HA LEU 26 0.402 12.305 8.324 229 1HB LEU 26 HB2 LEU 26 2.603 10.269 8.512 230 2HB LEU 26 HB1 LEU 26 0.981 9.952 9.045 231 HG LEU 26 HG LEU 26 1.960 10.467 6.337 232 1HD1 LEU 26 HD1 LEU 26 0.705 8.049 7.589 233 2HD1 LEU 26 HD1 LEU 26 0.957 8.243 5.850 234 3HD1 LEU 26 HD1 LEU 26 2.338 8.240 6.938 235 1HD2 LEU 26 HD2 LEU 26 -0.898 10.303 7.216 236 2HD2 LEU 26 HD2 LEU 26 -0.084 11.641 6.413 237 3HD2 LEU 26 HD2 LEU 26 -0.374 10.142 5.539 238 H ASP 27 HN ASP 27 -0.377 11.853 10.223 239 HA ASP 27 HA ASP 27 1.058 12.784 12.559 240 1HB ASP 27 HB2 ASP 27 -1.420 13.136 12.336 241 2HB ASP 27 HB1 ASP 27 -1.643 11.394 12.342 242 H HIS 28 HN HIS 28 1.428 11.313 14.383 243 HA HIS 28 HA HIS 28 2.757 8.976 13.738 244 1HB HIS 28 HB2 HIS 28 2.957 10.258 15.867 245 2HB HIS 28 HB1 HIS 28 1.411 9.609 16.366 246 HD1 HIS 28 HD1 HIS 28 2.080 8.070 18.289 247 HD2 HIS 28 HD2 HIS 28 4.419 7.521 14.894 248 HE1 HIS 28 HE1 HIS 28 3.510 6.058 18.737 249 H ASP 29 HN ASP 29 -0.618 9.499 14.504 250 HA ASP 29 HA ASP 29 -1.419 6.798 14.838 251 1HB ASP 29 HB2 ASP 29 -2.797 8.740 15.504 252 2HB ASP 29 HB1 ASP 29 -2.998 9.163 13.811 253 H LYS 30 HN LYS 30 -1.344 8.934 12.050 254 HA LYS 30 HA LYS 30 -2.397 7.173 10.140 255 1HB LYS 30 HB2 LYS 30 -0.617 9.582 9.918 256 2HB LYS 30 HB1 LYS 30 -1.014 8.708 8.477 257 1HG LYS 30 HG2 LYS 30 -3.023 9.935 10.375 258 2HG LYS 30 HG1 LYS 30 -2.423 10.701 8.904 259 1HD LYS 30 HD2 LYS 30 -3.345 8.837 7.577 260 2HD LYS 30 HD1 LYS 30 -3.969 8.098 9.053 261 1HE LYS 30 HE2 LYS 30 -5.726 9.281 7.867 262 2HE LYS 30 HE1 LYS 30 -5.401 10.070 9.403 263 1HZ LYS 30 HZ1 LYS 30 -4.052 11.712 8.190 264 2HZ LYS 30 HZ3 LYS 30 -4.490 11.036 6.709 265 3HZ LYS 30 HZ2 LYS 30 -5.638 11.730 7.704 266 H VAL 31 HN VAL 31 0.996 7.754 11.105 267 HA VAL 31 HA VAL 31 2.203 5.994 9.315 268 HB VAL 31 HB VAL 31 3.166 6.514 12.139 269 1HG1 VAL 31 1HG1 VAL 31 4.386 4.781 11.015 270 2HG1 VAL 31 3HG1 VAL 31 4.679 5.847 9.641 271 3HG1 VAL 31 2HG1 VAL 31 5.392 6.217 11.210 272 1HG2 VAL 31 1HG2 VAL 31 3.603 8.224 9.693 273 2HG2 VAL 31 3HG2 VAL 31 2.658 8.663 11.116 274 3HG2 VAL 31 2HG2 VAL 31 4.400 8.442 11.251 275 H LEU 32 HN LEU 32 0.847 5.427 12.544 276 HA LEU 32 HA LEU 32 1.644 2.691 12.808 277 1HB LEU 32 HB2 LEU 32 -0.768 4.035 14.008 278 2HB LEU 32 HB1 LEU 32 -0.034 2.537 14.539 279 HG LEU 32 HG LEU 32 1.083 5.313 14.779 280 1HD1 LEU 32 HD1 LEU 32 0.265 3.274 16.813 281 2HD1 LEU 32 HD1 LEU 32 1.018 4.833 17.166 282 3HD1 LEU 32 HD1 LEU 32 -0.575 4.771 16.409 283 1HD2 LEU 32 HD2 LEU 32 2.412 2.691 15.452 284 2HD2 LEU 32 HD2 LEU 32 2.895 3.836 14.195 285 3HD2 LEU 32 HD2 LEU 32 3.014 4.296 15.892 286 H LEU 33 HN LEU 33 -1.297 4.149 11.638 287 HA LEU 33 HA LEU 33 -2.595 1.701 11.044 288 1HB LEU 33 HB2 LEU 33 -2.912 4.374 9.755 289 2HB LEU 33 HB1 LEU 33 -4.066 3.056 9.662 290 HG LEU 33 HG LEU 33 -3.335 4.560 12.168 291 1HD1 LEU 33 HD1 LEU 33 -4.448 5.963 10.515 292 2HD1 LEU 33 HD1 LEU 33 -5.761 4.794 10.392 293 3HD1 LEU 33 HD1 LEU 33 -5.469 5.666 11.904 294 1HD2 LEU 33 HD2 LEU 33 -5.531 2.569 11.587 295 2HD2 LEU 33 HD2 LEU 33 -4.110 2.279 12.591 296 3HD2 LEU 33 HD2 LEU 33 -5.319 3.460 13.095 297 H PHE 34 HN PHE 34 -0.713 3.950 9.078 298 HA PHE 34 HA PHE 34 -1.036 2.614 6.660 299 1HB PHE 34 HB2 PHE 34 -0.291 4.900 6.693 300 2HB PHE 34 HB1 PHE 34 1.158 4.462 7.588 301 HD1 PHE 34 HD1 PHE 34 -0.565 3.477 4.395 302 HD2 PHE 34 HD2 PHE 34 3.097 4.352 6.397 303 HE1 PHE 34 HE1 PHE 34 0.610 3.191 2.337 304 HE2 PHE 34 HE2 PHE 34 4.302 4.038 4.269 305 HZ PHE 34 HZ PHE 34 3.069 3.463 2.240 306 H SER 35 HN SER 35 1.602 2.400 9.038 307 HA SER 35 HA SER 35 3.199 0.692 7.558 308 1HB SER 35 HB2 SER 35 4.225 0.069 9.791 309 2HB SER 35 HB1 SER 35 4.158 1.793 9.443 310 HG SER 35 HG SER 35 2.543 2.053 10.827 311 H ARG 36 HN ARG 36 0.644 -0.113 9.876 312 HA ARG 36 HA ARG 36 1.159 -2.909 9.619 313 1HB ARG 36 HB2 ARG 36 -0.849 -3.235 10.972 314 2HB ARG 36 HB1 ARG 36 0.247 -2.065 11.686 315 1HG ARG 36 HG2 ARG 36 -1.206 -0.267 10.716 316 2HG ARG 36 HG1 ARG 36 -2.346 -1.537 10.268 317 1HD ARG 36 HD2 ARG 36 -1.368 -0.875 13.024 318 2HD ARG 36 HD1 ARG 36 -2.965 -0.521 12.375 319 HE ARG 36 HE ARG 36 -2.836 -3.153 12.010 320 1HH1 ARG 36 1HH1 ARG 36 -2.133 -1.236 14.898 321 2HH1 ARG 36 2HH1 ARG 36 -2.647 -2.435 15.985 322 1HH2 ARG 36 1HH2 ARG 36 -3.548 -4.827 13.561 323 2HH2 ARG 36 2HH2 ARG 36 -3.470 -4.467 15.220 324 H ASP 37 HN ASP 37 -0.942 -0.664 7.972 325 HA ASP 37 HA ASP 37 -2.641 -2.670 6.814 326 1HB ASP 37 HB2 ASP 37 -3.025 -0.083 7.128 327 2HB ASP 37 HB1 ASP 37 -2.191 0.025 5.586 328 H LEU 38 HN LEU 38 0.054 -0.687 5.720 329 HA LEU 38 HA LEU 38 0.373 -1.715 3.147 330 1HB LEU 38 HB2 LEU 38 1.496 0.271 3.705 331 2HB LEU 38 HB1 LEU 38 2.202 -0.426 5.140 332 HG LEU 38 HG LEU 38 3.805 -1.667 3.797 333 1HD1 LEU 38 HD1 LEU 38 2.413 -2.106 1.834 334 2HD1 LEU 38 HD1 LEU 38 2.492 -0.385 1.426 335 3HD1 LEU 38 HD1 LEU 38 3.957 -1.366 1.397 336 1HD2 LEU 38 HD2 LEU 38 3.565 1.209 3.010 337 2HD2 LEU 38 HD2 LEU 38 4.353 0.582 4.457 338 3HD2 LEU 38 HD2 LEU 38 5.025 0.233 2.859 339 H ASP 39 HN ASP 39 1.718 -2.699 6.223 340 HA ASP 39 HA ASP 39 3.346 -4.785 5.340 341 1HB ASP 39 HB2 ASP 39 3.423 -3.840 7.606 342 2HB ASP 39 HB1 ASP 39 1.846 -4.527 7.950 343 H LYS 40 HN LYS 40 -0.132 -4.705 6.033 344 HA LYS 40 HA LYS 40 -0.274 -7.561 5.759 345 1HB LYS 40 HB2 LYS 40 -2.461 -7.498 6.361 346 2HB LYS 40 HB1 LYS 40 -1.822 -6.049 7.159 347 1HG LYS 40 HG2 LYS 40 -2.875 -4.623 5.569 348 2HG LYS 40 HG1 LYS 40 -3.299 -5.988 4.533 349 1HD LYS 40 HD2 LYS 40 -4.690 -6.873 6.421 350 2HD LYS 40 HD1 LYS 40 -4.391 -5.364 7.274 351 1HE LYS 40 HE2 LYS 40 -5.693 -5.576 4.556 352 2HE LYS 40 HE1 LYS 40 -6.571 -5.448 6.074 353 1HZ LYS 40 HZ2 LYS 40 -5.552 -3.285 6.418 354 2HZ LYS 40 HZ1 LYS 40 -4.725 -3.368 4.964 355 3HZ LYS 40 HZ3 LYS 40 -6.398 -3.342 4.974 356 H LEU 41 HN LEU 41 -0.772 -4.786 3.765 357 HA LEU 41 HA LEU 41 -2.136 -5.961 1.617 358 1HB LEU 41 HB2 LEU 41 -1.576 -3.487 2.110 359 2HB LEU 41 HB1 LEU 41 -0.036 -3.813 1.360 360 HG LEU 41 HG LEU 41 -2.706 -4.045 -0.058 361 1HD1 LEU 41 HD1 LEU 41 -0.636 -1.943 -0.136 362 2HD1 LEU 41 HD1 LEU 41 -2.086 -2.055 -1.164 363 3HD1 LEU 41 HD1 LEU 41 -2.255 -1.787 0.585 364 1HD2 LEU 41 HD2 LEU 41 -0.963 -5.407 -1.037 365 2HD2 LEU 41 HD2 LEU 41 -1.446 -4.062 -2.073 366 3HD2 LEU 41 HD2 LEU 41 0.064 -3.982 -1.161 367 H ILE 42 HN ILE 42 1.162 -5.791 2.476 368 HA ILE 42 HA ILE 42 2.213 -7.036 0.091 369 HB ILE 42 HB ILE 42 3.491 -6.890 2.846 370 1HG1 ILE 42 2HG1 ILE 42 3.853 -5.144 0.411 371 2HG1 ILE 42 1HG1 ILE 42 2.992 -4.687 1.875 372 1HG2 ILE 42 2HG2 ILE 42 4.716 -7.495 0.149 373 2HG2 ILE 42 1HG2 ILE 42 5.603 -7.296 1.661 374 3HG2 ILE 42 3HG2 ILE 42 4.489 -8.650 1.464 375 1HD1 ILE 42 HD1 ILE 42 5.050 -4.933 3.132 376 2HD1 ILE 42 HD1 ILE 42 5.920 -5.309 1.647 377 3HD1 ILE 42 HD1 ILE 42 5.183 -3.714 1.864 378 H ASN 43 HN ASN 43 1.788 -8.279 3.341 379 HA ASN 43 HA ASN 43 2.202 -11.001 2.871 380 1HB ASN 43 HB2 ASN 43 0.561 -9.537 4.921 381 2HB ASN 43 HB1 ASN 43 0.592 -11.292 4.890 382 1HD2 ASN 43 HD2 ASN 43 2.526 -8.400 5.489 383 2HD2 ASN 43 HD2 ASN 43 3.864 -9.211 6.184 384 H LYS 44 HN LYS 44 -0.627 -9.104 2.267 385 HA LYS 44 HA LYS 44 -2.562 -11.039 1.719 386 1HB LYS 44 HB2 LYS 44 -2.941 -8.606 1.894 387 2HB LYS 44 HB1 LYS 44 -2.064 -8.361 0.403 388 1HG LYS 44 HG2 LYS 44 -3.847 -9.812 -0.704 389 2HG LYS 44 HG1 LYS 44 -4.770 -9.605 0.785 390 1HD LYS 44 HD2 LYS 44 -3.766 -7.374 -1.004 391 2HD LYS 44 HD1 LYS 44 -5.428 -7.941 -0.901 392 1HE LYS 44 HE2 LYS 44 -5.562 -7.202 1.402 393 2HE LYS 44 HE1 LYS 44 -3.877 -6.713 1.390 394 1HZ LYS 44 HZ3 LYS 44 -4.544 -5.009 -0.402 395 2HZ LYS 44 HZ2 LYS 44 -6.108 -5.539 -0.165 396 3HZ LYS 44 HZ1 LYS 44 -5.320 -4.809 1.089 397 H PHE 45 HN PHE 45 -0.153 -9.513 -0.371 398 HA PHE 45 HA PHE 45 -0.891 -11.163 -2.600 399 1HB PHE 45 HB2 PHE 45 1.001 -8.887 -2.231 400 2HB PHE 45 HB1 PHE 45 1.096 -9.880 -3.681 401 HD1 PHE 45 HD1 PHE 45 -1.003 -7.546 -1.765 402 HD2 PHE 45 HD2 PHE 45 -0.609 -9.819 -5.330 403 HE1 PHE 45 HE1 PHE 45 -2.892 -6.316 -2.750 404 HE2 PHE 45 HE2 PHE 45 -2.494 -8.609 -6.318 405 HZ PHE 45 HZ PHE 45 -3.643 -6.846 -5.029 406 H MET 46 HN MET 46 1.572 -11.116 -0.212 407 HA MET 46 HA MET 46 3.352 -12.965 -1.494 408 1HB MET 46 HB2 MET 46 2.951 -12.606 1.485 409 2HB MET 46 HB1 MET 46 4.338 -13.332 0.698 410 1HG MET 46 HG2 MET 46 4.836 -11.112 -0.334 411 2HG MET 46 HG1 MET 46 3.493 -10.460 0.581 412 1HE MET 46 HE3 MET 46 6.281 -13.070 1.510 413 2HE MET 46 HE2 MET 46 7.131 -11.758 0.687 414 3HE MET 46 HE1 MET 46 7.394 -12.033 2.409 415 H ASN 47 HN ASN 47 0.402 -13.223 0.285 416 HA ASN 47 HA ASN 47 -0.960 -14.821 0.913 417 1HB ASN 47 HB2 ASN 47 0.564 -16.208 -1.212 418 2HB ASN 47 HB1 ASN 47 -0.696 -17.097 -0.327 419 1HD2 ASN 47 HD2 ASN 47 0.029 -14.655 -2.698 420 2HD2 ASN 47 HD2 ASN 47 -1.585 -14.367 -3.208 421 H VAL 48 HN VAL 48 1.426 -14.309 2.242 422 HA VAL 48 HA VAL 48 1.813 -16.800 3.762 423 HB VAL 48 HB VAL 48 3.807 -14.535 3.406 424 1HG1 VAL 48 3HG1 VAL 48 4.125 -17.222 4.741 425 2HG1 VAL 48 2HG1 VAL 48 5.408 -16.035 4.509 426 3HG1 VAL 48 1HG1 VAL 48 4.028 -15.649 5.537 427 1HG2 VAL 48 2HG2 VAL 48 3.894 -17.276 2.148 428 2HG2 VAL 48 1HG2 VAL 48 3.647 -15.736 1.315 429 3HG2 VAL 48 3HG2 VAL 48 5.194 -16.079 2.090 430 H LYS 49 HN LYS 49 1.298 -16.621 5.791 431 HA LYS 49 HA LYS 49 0.949 -13.921 6.875 432 1HB LYS 49 HB2 LYS 49 -0.821 -16.337 7.287 433 2HB LYS 49 HB1 LYS 49 -0.939 -14.848 8.206 434 1HG LYS 49 HG2 LYS 49 -1.368 -15.118 5.233 435 2HG LYS 49 HG1 LYS 49 -2.647 -14.990 6.443 436 1HD LYS 49 HD2 LYS 49 -1.705 -12.767 7.088 437 2HD LYS 49 HD1 LYS 49 -0.569 -12.913 5.747 438 1HE LYS 49 HE2 LYS 49 -3.580 -12.851 5.531 439 2HE LYS 49 HE1 LYS 49 -2.488 -11.529 5.149 440 1HZ LYS 49 HZ1 LYS 49 -1.549 -12.917 3.342 441 2HZ LYS 49 HZ3 LYS 49 -2.664 -14.133 3.729 442 3HZ LYS 49 HZ2 LYS 49 -3.213 -12.675 3.178 443 H ASP 50 HN ASP 50 2.911 -16.306 6.946 444 HA ASP 50 HA ASP 50 2.885 -16.883 9.782 445 1HB ASP 50 HB2 ASP 50 4.798 -17.906 7.682 446 2HB ASP 50 HB1 ASP 50 4.754 -18.420 9.362 447 H LYS 51 HN LYS 51 3.274 -14.625 10.238 448 HA LYS 51 HA LYS 51 6.176 -14.157 10.254 449 1HB LYS 51 HB2 LYS 51 5.710 -11.819 10.882 450 2HB LYS 51 HB1 LYS 51 4.949 -12.254 9.363 451 1HG LYS 51 HG2 LYS 51 2.803 -12.396 10.418 452 2HG LYS 51 HG1 LYS 51 3.534 -12.172 12.011 453 1HD LYS 51 HD2 LYS 51 2.536 -10.099 11.228 454 2HD LYS 51 HD1 LYS 51 4.285 -9.936 11.355 455 1HE LYS 51 HE2 LYS 51 3.525 -8.881 9.313 456 2HE LYS 51 HE1 LYS 51 4.449 -10.317 8.904 457 1HZ LYS 51 HZ2 LYS 51 2.310 -11.494 8.608 458 2HZ LYS 51 HZ1 LYS 51 1.501 -10.075 8.941 459 3HZ LYS 51 HZ3 LYS 51 2.477 -10.163 7.581 460 H VAL 52 HN VAL 52 4.151 -15.737 11.799 461 HA VAL 52 HA VAL 52 4.726 -14.942 14.531 462 HB VAL 52 HB VAL 52 3.206 -16.782 15.175 463 1HG1 VAL 52 2HG1 VAL 52 2.217 -14.615 14.710 464 2HG1 VAL 52 1HG1 VAL 52 2.047 -15.040 13.007 465 3HG1 VAL 52 3HG1 VAL 52 1.120 -15.911 14.228 466 1HG2 VAL 52 1HG2 VAL 52 3.722 -18.368 13.375 467 2HG2 VAL 52 3HG2 VAL 52 1.985 -18.081 13.475 468 3HG2 VAL 52 2HG2 VAL 52 2.935 -17.313 12.203 469 H HIS 53 HN HIS 53 5.254 -17.088 15.907 470 HA HIS 53 HA HIS 53 7.463 -18.334 14.469 471 1HB HIS 53 HB2 HIS 53 7.198 -17.861 17.455 472 2HB HIS 53 HB1 HIS 53 8.543 -18.674 16.661 473 HD1 HIS 53 HD1 HIS 53 7.811 -15.511 18.049 474 HD2 HIS 53 HD2 HIS 53 9.609 -16.761 14.518 475 HE1 HIS 53 HE1 HIS 53 9.142 -13.543 17.210 476 H LYS 54 HN LYS 54 6.451 -20.036 13.651 477 HA LYS 54 HA LYS 54 5.033 -21.761 15.512 478 1HB LYS 54 HB2 LYS 54 3.658 -20.908 13.663 479 2HB LYS 54 HB1 LYS 54 4.803 -21.556 12.504 480 1HG LYS 54 HG2 LYS 54 2.838 -22.968 12.664 481 2HG LYS 54 HG1 LYS 54 4.267 -23.827 13.242 482 1HD LYS 54 HD2 LYS 54 3.620 -23.371 15.549 483 2HD LYS 54 HD1 LYS 54 2.211 -22.465 14.986 484 1HE LYS 54 HE2 LYS 54 2.748 -25.393 14.504 485 2HE LYS 54 HE1 LYS 54 1.616 -24.734 15.683 486 1HZ LYS 54 HZ1 LYS 54 0.373 -23.744 13.854 487 2HZ LYS 54 HZ3 LYS 54 1.413 -24.439 12.723 488 3HZ LYS 54 HZ2 LYS 54 0.463 -25.405 13.709 489 H LEU 55 HN LEU 55 6.791 -22.864 16.283 490 HA LEU 55 HA LEU 55 8.237 -24.502 14.353 491 1HB LEU 55 HB2 LEU 55 8.748 -24.027 17.305 492 2HB LEU 55 HB1 LEU 55 9.695 -25.084 16.280 493 HG LEU 55 HG LEU 55 9.490 -22.082 15.978 494 1HD1 LEU 55 HD1 LEU 55 11.734 -23.819 16.982 495 2HD1 LEU 55 HD1 LEU 55 11.816 -22.077 16.720 496 3HD1 LEU 55 HD1 LEU 55 10.735 -22.731 17.951 497 1HD2 LEU 55 HD2 LEU 55 11.179 -24.106 14.501 498 2HD2 LEU 55 HD2 LEU 55 9.840 -23.172 13.829 499 3HD2 LEU 55 HD2 LEU 55 11.309 -22.353 14.349 500 H GLU 56 HN GLU 56 8.169 -26.740 14.561 501 HA GLU 56 HA GLU 56 5.648 -27.596 15.671 502 1HB GLU 56 HB2 GLU 56 7.564 -28.957 13.785 503 2HB GLU 56 HB1 GLU 56 6.010 -29.606 14.291 504 1HG GLU 56 HG2 GLU 56 4.870 -27.701 13.280 505 2HG GLU 56 HG1 GLU 56 6.423 -27.035 12.784 506 H HIS 57 HN HIS 57 5.432 -29.164 17.125 507 HA HIS 57 HA HIS 57 7.844 -30.045 18.555 508 1HB HIS 57 HB2 HIS 57 4.972 -29.828 19.503 509 2HB HIS 57 HB1 HIS 57 6.295 -30.469 20.462 510 HD1 HIS 57 HD1 HIS 57 4.544 -27.332 19.666 511 HD2 HIS 57 HD2 HIS 57 8.265 -28.448 21.147 512 HE1 HIS 57 HE1 HIS 57 5.485 -25.293 20.784 513 H HIS 58 HN HIS 58 8.343 -32.053 17.837 514 HA HIS 58 HA HIS 58 6.143 -33.682 16.901 515 1HB HIS 58 HB2 HIS 58 9.116 -34.024 16.519 516 2HB HIS 58 HB1 HIS 58 7.940 -35.229 16.013 517 HD1 HIS 58 HD1 HIS 58 9.563 -32.119 14.865 518 HD2 HIS 58 HD2 HIS 58 6.123 -34.285 13.981 519 HE1 HIS 58 HE1 HIS 58 8.739 -31.261 12.656 520 H HIS 59 HN HIS 59 7.815 -33.361 19.729 521 HA HIS 59 HA HIS 59 6.934 -36.046 20.482 522 1HB HIS 59 HB2 HIS 59 9.482 -35.673 20.594 523 2HB HIS 59 HB1 HIS 59 9.163 -34.562 21.916 524 HD1 HIS 59 HD1 HIS 59 9.428 -38.191 21.113 525 HD2 HIS 59 HD2 HIS 59 8.279 -35.818 24.331 526 HE1 HIS 59 HE1 HIS 59 9.326 -39.724 23.110 527 H HIS 60 HN HIS 60 4.978 -34.883 20.628 528 HA HIS 60 HA HIS 60 4.578 -33.309 23.063 529 1HB HIS 60 HB2 HIS 60 3.677 -32.378 20.955 530 2HB HIS 60 HB1 HIS 60 2.774 -33.857 20.680 531 HD1 HIS 60 HD1 HIS 60 0.377 -33.704 21.351 532 HD2 HIS 60 HD2 HIS 60 2.759 -31.032 23.456 533 HE1 HIS 60 HE1 HIS 60 -1.191 -32.358 22.783 534 H HIS 61 HN HIS 61 3.908 -36.312 21.470 535 HA HIS 61 HA HIS 61 2.861 -37.401 23.950 536 1HB HIS 61 HB2 HIS 61 1.683 -37.821 21.185 537 2HB HIS 61 HB1 HIS 61 1.371 -38.907 22.526 538 HD1 HIS 61 HD1 HIS 61 -0.378 -36.459 20.809 539 HD2 HIS 61 HD2 HIS 61 0.439 -37.003 24.844 540 HE1 HIS 61 HE1 HIS 61 -2.192 -35.253 22.049 541 H HIS 62 HN HIS 62 2.870 -39.873 23.642 542 HA HIS 62 HA HIS 62 5.102 -40.803 22.051 543 1HB HIS 62 HB2 HIS 62 6.102 -40.230 24.258 544 2HB HIS 62 HB1 HIS 62 4.895 -41.229 25.060 545 HD1 HIS 62 HD1 HIS 62 5.385 -43.757 25.178 546 HD2 HIS 62 HD2 HIS 62 8.089 -41.661 22.827 547 HE1 HIS 62 HE1 HIS 62 7.235 -45.376 24.633 548 H1 MET 101 HT2 MET 101 10.288 24.514 -0.391 549 H2 MET 101 HT1 MET 101 11.580 24.715 0.670 550 H3 MET 101 HT3 MET 101 11.612 23.536 -0.547 551 HA MET 101 HA MET 101 11.126 22.430 1.482 552 1HB MET 101 HB2 MET 101 8.759 24.321 1.558 553 2HB MET 101 HB1 MET 101 8.901 22.899 2.576 554 1HG MET 101 HG2 MET 101 10.921 23.846 3.594 555 2HG MET 101 HG1 MET 101 10.740 25.286 2.599 556 1HE MET 101 HE3 MET 101 8.695 26.982 2.812 557 2HE MET 101 HE2 MET 101 7.519 25.674 2.661 558 3HE MET 101 HE1 MET 101 7.397 26.815 3.997 559 H GLU 102 HN GLU 102 9.957 20.509 1.231 560 HA GLU 102 HA GLU 102 8.502 20.475 -1.301 561 1HB GLU 102 HB2 GLU 102 10.803 18.837 -0.502 562 2HB GLU 102 HB1 GLU 102 9.553 18.098 -1.496 563 1HG GLU 102 HG2 GLU 102 11.085 20.585 -2.101 564 2HG GLU 102 HG1 GLU 102 11.255 19.018 -2.900 565 H MET 103 HN MET 103 7.202 18.896 -1.770 566 HA MET 103 HA MET 103 6.599 16.803 0.028 567 1HB MET 103 HB2 MET 103 4.123 17.150 0.100 568 2HB MET 103 HB1 MET 103 5.000 18.374 0.987 569 1HG MET 103 HG2 MET 103 4.618 19.987 -0.744 570 2HG MET 103 HG1 MET 103 3.922 18.750 -1.796 571 1HE MET 103 HE1 MET 103 1.551 17.735 -1.550 572 2HE MET 103 HE3 MET 103 2.019 17.067 0.014 573 3HE MET 103 HE2 MET 103 0.512 17.967 -0.144 574 H GLY 104 HN GLY 104 6.134 18.469 -3.009 575 1HA GLY 104 HA1 GLY 104 5.738 17.700 -5.093 576 2HA GLY 104 HA2 GLY 104 4.952 16.296 -4.375 577 H GLN 105 HN GLN 105 8.277 17.569 -4.206 578 HA GLN 105 HA GLN 105 9.396 15.448 -5.751 579 1HB GLN 105 HB2 GLN 105 10.705 17.268 -3.750 580 2HB GLN 105 HB1 GLN 105 11.576 16.248 -4.885 581 1HG GLN 105 HG2 GLN 105 9.795 18.588 -5.556 582 2HG GLN 105 HG1 GLN 105 11.551 18.542 -5.672 583 1HE2 GLN 105 1HE2 GLN 105 12.495 17.394 -7.345 584 2HE2 GLN 105 2HE2 GLN 105 11.602 16.925 -8.747 585 H LEU 106 HN LEU 106 8.526 15.826 -2.484 586 HA LEU 106 HA LEU 106 10.027 13.641 -1.449 587 1HB LEU 106 HB2 LEU 106 9.210 15.469 -0.005 588 2HB LEU 106 HB1 LEU 106 7.566 15.061 -0.410 589 HG LEU 106 HG LEU 106 8.405 14.429 1.907 590 1HD1 LEU 106 HD1 LEU 106 7.173 12.307 0.177 591 2HD1 LEU 106 HD1 LEU 106 7.194 12.281 1.934 592 3HD1 LEU 106 HD1 LEU 106 6.322 13.546 1.080 593 1HD2 LEU 106 HD2 LEU 106 10.570 13.493 1.283 594 2HD2 LEU 106 HD2 LEU 106 9.563 12.283 2.097 595 3HD2 LEU 106 HD2 LEU 106 9.748 12.236 0.349 596 H LYS 107 HN LYS 107 6.697 14.083 -2.563 597 HA LYS 107 HA LYS 107 5.869 11.422 -2.187 598 1HB LYS 107 HB2 LYS 107 4.660 13.779 -2.844 599 2HB LYS 107 HB1 LYS 107 4.616 12.953 -4.389 600 1HG LYS 107 HG2 LYS 107 3.592 11.706 -1.851 601 2HG LYS 107 HG1 LYS 107 2.586 12.727 -2.855 602 1HD LYS 107 HD2 LYS 107 3.939 10.159 -3.742 603 2HD LYS 107 HD1 LYS 107 2.247 10.296 -3.259 604 1HE LYS 107 HE2 LYS 107 1.957 11.969 -5.110 605 2HE LYS 107 HE1 LYS 107 3.596 11.585 -5.623 606 1HZ LYS 107 HZ3 LYS 107 2.769 9.186 -5.800 607 2HZ LYS 107 HZ2 LYS 107 1.227 9.821 -5.617 608 3HZ LYS 107 HZ1 LYS 107 2.131 10.292 -6.924 609 H ASN 108 HN ASN 108 7.473 13.092 -4.803 610 HA ASN 108 HA ASN 108 7.523 11.149 -6.808 611 1HB ASN 108 HB2 ASN 108 8.426 13.386 -7.172 612 2HB ASN 108 HB1 ASN 108 9.664 13.113 -5.958 613 1HD2 ASN 108 HD2 ASN 108 11.365 13.468 -7.306 614 2HD2 ASN 108 HD2 ASN 108 11.795 12.398 -8.594 615 H LYS 109 HN LYS 109 9.689 11.577 -4.023 616 HA LYS 109 HA LYS 109 11.238 9.266 -4.616 617 1HB LYS 109 HB2 LYS 109 11.022 10.945 -2.127 618 2HB LYS 109 HB1 LYS 109 12.055 9.525 -2.213 619 1HG LYS 109 HG2 LYS 109 13.289 10.537 -4.076 620 2HG LYS 109 HG1 LYS 109 12.266 11.969 -3.964 621 1HD LYS 109 HD2 LYS 109 13.918 10.941 -1.662 622 2HD LYS 109 HD1 LYS 109 14.535 12.108 -2.830 623 1HE LYS 109 HE2 LYS 109 12.037 12.523 -1.179 624 2HE LYS 109 HE1 LYS 109 13.631 13.106 -0.715 625 1HZ LYS 109 HZ1 LYS 109 12.200 13.889 -3.218 626 2HZ LYS 109 HZ3 LYS 109 12.344 14.819 -1.813 627 3HZ LYS 109 HZ2 LYS 109 13.699 14.453 -2.698 628 H ILE 110 HN ILE 110 8.419 9.879 -2.680 629 HA ILE 110 HA ILE 110 8.163 7.385 -1.422 630 HB ILE 110 HB ILE 110 6.055 9.336 -2.400 631 1HG1 ILE 110 2HG1 ILE 110 7.105 8.674 0.351 632 2HG1 ILE 110 1HG1 ILE 110 7.459 10.127 -0.578 633 1HG2 ILE 110 3HG2 ILE 110 5.035 7.111 -2.378 634 2HG2 ILE 110 2HG2 ILE 110 5.557 6.893 -0.704 635 3HG2 ILE 110 1HG2 ILE 110 4.370 8.133 -1.097 636 1HD1 ILE 110 HD1 ILE 110 5.094 10.770 -0.411 637 2HD1 ILE 110 HD1 ILE 110 4.783 9.326 0.553 638 3HD1 ILE 110 HD1 ILE 110 5.868 10.581 1.160 639 H GLU 111 HN GLU 111 6.948 8.492 -4.569 640 HA GLU 111 HA GLU 111 5.849 6.140 -5.504 641 1HB GLU 111 HB2 GLU 111 7.427 8.198 -7.062 642 2HB GLU 111 HB1 GLU 111 6.470 6.921 -7.796 643 1HG GLU 111 HG2 GLU 111 5.450 9.158 -6.078 644 2HG GLU 111 HG1 GLU 111 5.263 9.006 -7.828 645 H ASN 112 HN ASN 112 9.141 7.272 -5.989 646 HA ASN 112 HA ASN 112 10.232 5.068 -7.215 647 1HB ASN 112 HB2 ASN 112 11.583 7.028 -7.100 648 2HB ASN 112 HB1 ASN 112 11.509 7.065 -5.343 649 1HD2 ASN 112 HD2 ASN 112 12.933 5.849 -4.177 650 2HD2 ASN 112 HD2 ASN 112 14.177 4.885 -4.845 651 H LYS 113 HN LYS 113 10.071 5.643 -3.722 652 HA LYS 113 HA LYS 113 11.507 3.307 -3.031 653 1HB LYS 113 HB2 LYS 113 11.155 5.418 -1.640 654 2HB LYS 113 HB1 LYS 113 9.573 4.775 -1.263 655 1HG LYS 113 HG2 LYS 113 11.131 4.262 0.539 656 2HG LYS 113 HG1 LYS 113 10.597 2.792 -0.270 657 1HD LYS 113 HD2 LYS 113 13.005 2.792 0.207 658 2HD LYS 113 HD1 LYS 113 12.653 2.668 -1.512 659 1HE LYS 113 HE2 LYS 113 13.114 5.002 -1.797 660 2HE LYS 113 HE1 LYS 113 13.452 5.198 -0.063 661 1HZ LYS 113 HZ3 LYS 113 15.270 3.558 -0.395 662 2HZ LYS 113 HZ2 LYS 113 14.910 3.601 -2.074 663 3HZ LYS 113 HZ1 LYS 113 15.468 4.984 -1.304 664 H LYS 114 HN LYS 114 8.089 4.091 -3.055 665 HA LYS 114 HA LYS 114 6.956 1.729 -2.120 666 1HB LYS 114 HB2 LYS 114 5.697 3.686 -2.348 667 2HB LYS 114 HB1 LYS 114 6.070 3.861 -4.061 668 1HG LYS 114 HG2 LYS 114 4.718 1.710 -4.396 669 2HG LYS 114 HG1 LYS 114 4.158 1.922 -2.738 670 1HD LYS 114 HD2 LYS 114 2.490 2.958 -4.120 671 2HD LYS 114 HD1 LYS 114 3.446 4.271 -3.434 672 1HE LYS 114 HE2 LYS 114 4.790 4.294 -5.555 673 2HE LYS 114 HE1 LYS 114 3.636 3.119 -6.182 674 1HZ LYS 114 HZ1 LYS 114 2.929 5.880 -5.278 675 2HZ LYS 114 HZ3 LYS 114 3.153 5.443 -6.838 676 3HZ LYS 114 HZ2 LYS 114 1.854 4.822 -6.027 677 H LYS 115 HN LYS 115 7.906 2.718 -5.331 678 HA LYS 115 HA LYS 115 7.062 0.301 -6.580 679 1HB LYS 115 HB2 LYS 115 8.725 2.591 -7.623 680 2HB LYS 115 HB1 LYS 115 8.230 1.212 -8.600 681 1HG LYS 115 HG2 LYS 115 5.922 1.749 -8.362 682 2HG LYS 115 HG1 LYS 115 6.265 2.946 -7.127 683 1HD LYS 115 HD2 LYS 115 5.766 4.181 -9.075 684 2HD LYS 115 HD1 LYS 115 7.503 4.237 -8.899 685 1HE LYS 115 HE2 LYS 115 6.120 2.269 -10.718 686 2HE LYS 115 HE1 LYS 115 6.601 3.871 -11.251 687 1HZ LYS 115 HZ3 LYS 115 8.903 3.279 -10.761 688 2HZ LYS 115 HZ2 LYS 115 8.429 1.687 -10.329 689 3HZ LYS 115 HZ1 LYS 115 8.190 2.258 -11.879 690 H GLU 116 HN GLU 116 10.125 1.432 -5.295 691 HA GLU 116 HA GLU 116 11.739 -0.680 -6.196 692 1HB GLU 116 HB2 GLU 116 11.841 0.862 -3.579 693 2HB GLU 116 HB1 GLU 116 13.020 -0.357 -4.020 694 1HG GLU 116 HG2 GLU 116 13.606 1.058 -5.979 695 2HG GLU 116 HG1 GLU 116 12.500 2.287 -5.346 696 H LEU 117 HN LEU 117 9.551 -0.365 -3.493 697 HA LEU 117 HA LEU 117 10.060 -2.880 -2.309 698 1HB LEU 117 HB2 LEU 117 9.038 -1.262 -0.983 699 2HB LEU 117 HB1 LEU 117 7.732 -0.988 -2.143 700 HG LEU 117 HG LEU 117 7.285 -3.532 -1.653 701 1HD1 LEU 117 HD1 LEU 117 8.821 -2.834 0.705 702 2HD1 LEU 117 HD1 LEU 117 7.651 -4.172 0.555 703 3HD1 LEU 117 HD1 LEU 117 9.062 -4.095 -0.505 704 1HD2 LEU 117 HD2 LEU 117 5.811 -1.706 -1.300 705 2HD2 LEU 117 HD2 LEU 117 5.694 -3.012 -0.121 706 3HD2 LEU 117 HD2 LEU 117 6.486 -1.444 0.323 707 H ILE 118 HN ILE 118 7.607 -1.705 -4.550 708 HA ILE 118 HA ILE 118 6.101 -4.020 -4.794 709 HB ILE 118 HB ILE 118 6.683 -1.908 -6.891 710 1HG1 ILE 118 2HG1 ILE 118 4.182 -2.309 -5.252 711 2HG1 ILE 118 1HG1 ILE 118 5.478 -1.253 -4.725 712 1HG2 ILE 118 2HG2 ILE 118 4.567 -4.097 -7.014 713 2HG2 ILE 118 1HG2 ILE 118 4.680 -2.727 -8.112 714 3HG2 ILE 118 3HG2 ILE 118 5.957 -3.929 -8.059 715 1HD1 ILE 118 HD1 ILE 118 3.851 -0.977 -7.229 716 2HD1 ILE 118 HD1 ILE 118 3.711 -0.003 -5.753 717 3HD1 ILE 118 HD1 ILE 118 5.178 0.071 -6.736 718 H GLN 119 HN GLN 119 8.963 -3.072 -6.535 719 HA GLN 119 HA GLN 119 9.084 -5.367 -8.159 720 1HB GLN 119 HB2 GLN 119 11.316 -3.572 -7.242 721 2HB GLN 119 HB1 GLN 119 11.413 -4.725 -8.568 722 1HG GLN 119 HG2 GLN 119 9.637 -3.472 -9.735 723 2HG GLN 119 HG1 GLN 119 9.640 -2.304 -8.417 724 1HE2 GLN 119 1HE2 GLN 119 11.323 -3.519 -11.130 725 2HE2 GLN 119 2HE2 GLN 119 12.499 -2.260 -11.244 726 H LEU 120 HN LEU 120 10.128 -4.782 -4.882 727 HA LEU 120 HA LEU 120 11.655 -7.178 -4.681 728 1HB LEU 120 HB2 LEU 120 10.585 -5.317 -2.571 729 2HB LEU 120 HB1 LEU 120 11.469 -6.778 -2.184 730 HG LEU 120 HG LEU 120 12.587 -4.486 -3.798 731 1HD1 LEU 120 HD1 LEU 120 13.054 -5.310 -0.940 732 2HD1 LEU 120 HD1 LEU 120 13.913 -4.033 -1.803 733 3HD1 LEU 120 HD1 LEU 120 12.187 -3.872 -1.475 734 1HD2 LEU 120 HD2 LEU 120 13.837 -6.985 -2.671 735 2HD2 LEU 120 HD2 LEU 120 13.618 -6.603 -4.377 736 3HD2 LEU 120 HD2 LEU 120 14.729 -5.648 -3.391 737 H VAL 121 HN VAL 121 8.392 -6.227 -3.522 738 HA VAL 121 HA VAL 121 7.621 -8.749 -2.567 739 HB VAL 121 HB VAL 121 5.847 -6.670 -3.889 740 1HG1 VAL 121 1HG1 VAL 121 4.710 -8.774 -3.434 741 2HG1 VAL 121 3HG1 VAL 121 5.260 -8.692 -1.751 742 3HG1 VAL 121 2HG1 VAL 121 4.146 -7.470 -2.361 743 1HG2 VAL 121 3HG2 VAL 121 6.806 -6.818 -1.047 744 2HG2 VAL 121 2HG2 VAL 121 7.232 -5.607 -2.266 745 3HG2 VAL 121 1HG2 VAL 121 5.574 -5.705 -1.663 746 H ALA 122 HN ALA 122 7.677 -7.386 -5.787 747 HA ALA 122 HA ALA 122 6.235 -9.405 -7.101 748 1HB ALA 122 HB3 ALA 122 8.380 -7.604 -8.189 749 2HB ALA 122 HB2 ALA 122 7.194 -8.501 -9.151 750 3HB ALA 122 HB1 ALA 122 6.669 -7.210 -8.059 751 H ARG 123 HN ARG 123 9.738 -8.994 -6.476 752 HA ARG 123 HA ARG 123 10.335 -11.391 -7.906 753 1HB ARG 123 HB2 ARG 123 12.648 -11.051 -7.324 754 2HB ARG 123 HB1 ARG 123 11.954 -9.542 -7.875 755 1HG ARG 123 HG2 ARG 123 11.728 -8.860 -5.523 756 2HG ARG 123 HG1 ARG 123 12.569 -10.335 -5.047 757 1HD ARG 123 HD2 ARG 123 14.188 -8.548 -5.145 758 2HD ARG 123 HD1 ARG 123 14.479 -9.668 -6.470 759 HE ARG 123 HE ARG 123 13.095 -7.082 -6.784 760 1HH1 ARG 123 1HH1 ARG 123 15.299 -9.540 -8.070 761 2HH1 ARG 123 2HH1 ARG 123 15.746 -8.636 -9.441 762 1HH2 ARG 123 1HH2 ARG 123 13.719 -5.845 -8.642 763 2HH2 ARG 123 2HH2 ARG 123 14.818 -6.465 -9.781 764 H HIS 124 HN HIS 124 8.984 -10.943 -5.021 765 HA HIS 124 HA HIS 124 9.974 -13.150 -3.540 766 1HB HIS 124 HB2 HIS 124 8.567 -11.582 -2.388 767 2HB HIS 124 HB1 HIS 124 7.309 -11.675 -3.591 768 HD1 HIS 124 HD1 HIS 124 5.468 -13.449 -3.164 769 HD2 HIS 124 HD2 HIS 124 8.731 -13.825 -0.625 770 HE1 HIS 124 HE1 HIS 124 4.821 -15.164 -1.445 771 H GLY 125 HN GLY 125 7.942 -12.765 -6.279 772 1HA GLY 125 HA1 GLY 125 7.379 -15.654 -6.301 773 2HA GLY 125 HA2 GLY 125 7.968 -14.802 -7.722 774 H LEU 126 HN LEU 126 6.312 -12.403 -7.220 775 HA LEU 126 HA LEU 126 3.637 -13.370 -7.237 776 1HB LEU 126 HB2 LEU 126 4.779 -10.656 -7.780 777 2HB LEU 126 HB1 LEU 126 3.096 -10.997 -8.045 778 HG LEU 126 HG LEU 126 4.607 -10.986 -5.513 779 1HD1 LEU 126 HD1 LEU 126 2.302 -9.336 -6.463 780 2HD1 LEU 126 HD1 LEU 126 2.942 -9.312 -4.824 781 3HD1 LEU 126 HD1 LEU 126 3.960 -8.809 -6.175 782 1HD2 LEU 126 HD2 LEU 126 1.814 -11.997 -5.945 783 2HD2 LEU 126 HD2 LEU 126 3.185 -12.887 -5.309 784 3HD2 LEU 126 HD2 LEU 126 2.475 -11.583 -4.365 785 H ASP 127 HN ASP 127 2.283 -13.455 -8.802 786 HA ASP 127 HA ASP 127 3.169 -13.928 -11.481 787 1HB ASP 127 HB2 ASP 127 0.442 -13.589 -10.236 788 2HB ASP 127 HB1 ASP 127 0.640 -13.752 -11.969 789 H HIS 128 HN HIS 128 2.429 -12.622 -13.301 790 HA HIS 128 HA HIS 128 3.264 -9.986 -13.177 791 1HB HIS 128 HB2 HIS 128 2.884 -11.585 -15.197 792 2HB HIS 128 HB1 HIS 128 1.247 -10.959 -15.184 793 HD1 HIS 128 HD1 HIS 128 4.085 -10.539 -17.051 794 HD2 HIS 128 HD2 HIS 128 1.641 -7.832 -15.072 795 HE1 HIS 128 HE1 HIS 128 4.429 -8.338 -18.199 796 H ASP 129 HN ASP 129 0.005 -11.353 -13.088 797 HA ASP 129 HA ASP 129 -1.432 -8.939 -12.989 798 1HB ASP 129 HB2 ASP 129 -3.327 -10.273 -12.175 799 2HB ASP 129 HB1 ASP 129 -2.555 -11.023 -13.576 800 H LYS 130 HN LYS 130 0.005 -10.883 -10.534 801 HA LYS 130 HA LYS 130 -1.210 -9.625 -8.308 802 1HB LYS 130 HB2 LYS 130 1.311 -11.219 -8.563 803 2HB LYS 130 HB1 LYS 130 0.834 -10.626 -7.013 804 1HG LYS 130 HG2 LYS 130 -0.642 -12.565 -8.813 805 2HG LYS 130 HG1 LYS 130 0.111 -12.915 -7.256 806 1HD LYS 130 HD2 LYS 130 -1.547 -11.501 -6.143 807 2HD LYS 130 HD1 LYS 130 -2.273 -11.104 -7.700 808 1HE LYS 130 HE2 LYS 130 -2.152 -13.808 -6.396 809 2HE LYS 130 HE1 LYS 130 -3.573 -12.789 -6.614 810 1HZ LYS 130 HZ2 LYS 130 -3.039 -12.987 -9.108 811 2HZ LYS 130 HZ1 LYS 130 -2.024 -14.224 -8.674 812 3HZ LYS 130 HZ3 LYS 130 -3.665 -14.367 -8.336 813 H VAL 131 HN VAL 131 1.862 -9.019 -9.927 814 HA VAL 131 HA VAL 131 2.717 -6.960 -8.249 815 HB VAL 131 HB VAL 131 3.196 -7.101 -11.234 816 1HG1 VAL 131 2HG1 VAL 131 3.971 -5.057 -10.205 817 2HG1 VAL 131 1HG1 VAL 131 4.872 -5.979 -9.005 818 3HG1 VAL 131 3HG1 VAL 131 5.339 -6.053 -10.703 819 1HG2 VAL 131 1HG2 VAL 131 4.639 -8.579 -9.039 820 2HG2 VAL 131 3HG2 VAL 131 3.624 -9.289 -10.292 821 3HG2 VAL 131 2HG2 VAL 131 5.151 -8.513 -10.729 822 H LEU 132 HN LEU 132 0.764 -6.922 -11.189 823 HA LEU 132 HA LEU 132 0.266 -4.143 -11.432 824 1HB LEU 132 HB2 LEU 132 -1.565 -6.425 -12.124 825 2HB LEU 132 HB1 LEU 132 -1.655 -4.792 -12.750 826 HG LEU 132 HG LEU 132 0.576 -6.753 -13.277 827 1HD1 LEU 132 HD1 LEU 132 -1.497 -7.344 -14.365 828 2HD1 LEU 132 HD1 LEU 132 -1.595 -5.721 -15.052 829 3HD1 LEU 132 HD1 LEU 132 -0.285 -6.803 -15.536 830 1HD2 LEU 132 HD2 LEU 132 0.108 -3.979 -14.367 831 2HD2 LEU 132 HD2 LEU 132 1.396 -4.484 -13.267 832 3HD2 LEU 132 HD2 LEU 132 1.353 -5.111 -14.911 833 H LEU 133 HN LEU 133 -1.747 -6.602 -9.885 834 HA LEU 133 HA LEU 133 -3.641 -4.779 -8.911 835 1HB LEU 133 HB2 LEU 133 -2.869 -7.513 -7.929 836 2HB LEU 133 HB1 LEU 133 -4.272 -6.630 -7.348 837 HG LEU 133 HG LEU 133 -3.842 -7.544 -10.198 838 1HD1 LEU 133 HD1 LEU 133 -5.588 -8.687 -8.027 839 2HD1 LEU 133 HD1 LEU 133 -5.580 -9.191 -9.719 840 3HD1 LEU 133 HD1 LEU 133 -4.148 -9.432 -8.724 841 1HD2 LEU 133 HD2 LEU 133 -6.250 -6.325 -8.836 842 2HD2 LEU 133 HD2 LEU 133 -5.251 -5.555 -10.073 843 3HD2 LEU 133 HD2 LEU 133 -6.219 -6.970 -10.474 844 H PHE 134 HN PHE 134 -0.715 -6.113 -7.417 845 HA PHE 134 HA PHE 134 -1.029 -4.968 -4.891 846 1HB PHE 134 HB2 PHE 134 0.590 -6.747 -5.319 847 2HB PHE 134 HB1 PHE 134 1.497 -5.697 -6.394 848 HD1 PHE 134 HD1 PHE 134 3.271 -4.471 -5.556 849 HD2 PHE 134 HD2 PHE 134 0.401 -6.004 -2.822 850 HE1 PHE 134 HE1 PHE 134 4.676 -3.773 -3.642 851 HE2 PHE 134 HE2 PHE 134 1.806 -5.327 -0.964 852 HZ PHE 134 HZ PHE 134 3.951 -4.206 -1.374 853 H SER 135 HN SER 135 0.745 -3.748 -7.749 854 HA SER 135 HA SER 135 1.611 -1.408 -6.529 855 1HB SER 135 HB2 SER 135 1.948 -0.561 -8.889 856 2HB SER 135 HB1 SER 135 2.679 -2.119 -8.540 857 HG SER 135 HG SER 135 0.206 -2.567 -9.487 858 H ARG 136 HN ARG 136 -1.430 -2.146 -7.993 859 HA ARG 136 HA ARG 136 -2.437 0.536 -8.150 860 1HB ARG 136 HB2 ARG 136 -3.707 -2.150 -8.096 861 2HB ARG 136 HB1 ARG 136 -4.631 -0.669 -8.322 862 1HG ARG 136 HG2 ARG 136 -3.507 -0.266 -10.408 863 2HG ARG 136 HG1 ARG 136 -2.440 -1.654 -10.102 864 1HD ARG 136 HD2 ARG 136 -4.166 -3.191 -10.311 865 2HD ARG 136 HD1 ARG 136 -5.430 -1.955 -10.222 866 HE ARG 136 HE ARG 136 -3.797 -1.502 -12.433 867 1HH1 ARG 136 1HH1 ARG 136 -6.200 -3.881 -11.323 868 2HH1 ARG 136 2HH1 ARG 136 -6.711 -4.298 -12.896 869 1HH2 ARG 136 1HH2 ARG 136 -4.636 -1.996 -14.587 870 2HH2 ARG 136 2HH2 ARG 136 -5.836 -3.196 -14.763 871 H ASP 137 HN ASP 137 -2.974 -2.224 -5.996 872 HA ASP 137 HA ASP 137 -4.877 -1.052 -4.277 873 1HB ASP 137 HB2 ASP 137 -4.167 -3.529 -4.639 874 2HB ASP 137 HB1 ASP 137 -2.924 -3.183 -3.467 875 H LEU 138 HN LEU 138 -1.422 -1.374 -4.162 876 HA LEU 138 HA LEU 138 -1.058 -0.170 -1.636 877 1HB LEU 138 HB2 LEU 138 0.534 -1.724 -2.445 878 2HB LEU 138 HB1 LEU 138 0.769 -0.818 -3.916 879 HG LEU 138 HG LEU 138 2.076 0.841 -2.776 880 1HD1 LEU 138 HD1 LEU 138 1.341 -0.612 -0.245 881 2HD1 LEU 138 HD1 LEU 138 2.470 0.749 -0.403 882 3HD1 LEU 138 HD1 LEU 138 0.748 0.986 -0.726 883 1HD2 LEU 138 HD2 LEU 138 2.699 -1.893 -1.783 884 2HD2 LEU 138 HD2 LEU 138 3.167 -1.236 -3.355 885 3HD2 LEU 138 HD2 LEU 138 3.854 -0.556 -1.865 886 H ASP 139 HN ASP 139 -1.022 1.047 -4.943 887 HA ASP 139 HA ASP 139 0.012 3.595 -4.301 888 1HB ASP 139 HB2 ASP 139 -0.141 2.730 -6.611 889 2HB ASP 139 HB1 ASP 139 -1.890 2.894 -6.571 890 H LYS 140 HN LYS 140 -3.237 2.323 -4.520 891 HA LYS 140 HA LYS 140 -4.571 4.702 -3.805 892 1HB LYS 140 HB2 LYS 140 -5.436 1.840 -3.539 893 2HB LYS 140 HB1 LYS 140 -6.476 3.234 -3.260 894 1HG LYS 140 HG2 LYS 140 -6.047 3.950 -5.568 895 2HG LYS 140 HG1 LYS 140 -5.136 2.459 -5.823 896 1HD LYS 140 HD2 LYS 140 -7.092 1.147 -5.356 897 2HD LYS 140 HD1 LYS 140 -8.019 2.593 -4.967 898 1HE LYS 140 HE2 LYS 140 -6.825 1.850 -7.626 899 2HE LYS 140 HE1 LYS 140 -8.537 1.885 -7.210 900 1HZ LYS 140 HZ2 LYS 140 -8.351 4.301 -6.897 901 2HZ LYS 140 HZ1 LYS 140 -6.724 4.247 -7.343 902 3HZ LYS 140 HZ3 LYS 140 -7.922 3.851 -8.449 903 H LEU 141 HN LEU 141 -3.339 1.995 -1.878 904 HA LEU 141 HA LEU 141 -4.421 2.720 0.574 905 1HB LEU 141 HB2 LEU 141 -3.304 0.553 -0.060 906 2HB LEU 141 HB1 LEU 141 -1.770 1.377 -0.014 907 HG LEU 141 HG LEU 141 -2.254 -0.091 1.984 908 1HD1 LEU 141 HD1 LEU 141 -1.747 2.753 2.571 909 2HD1 LEU 141 HD1 LEU 141 -1.478 1.373 3.646 910 3HD1 LEU 141 HD1 LEU 141 -0.578 1.496 2.142 911 1HD2 LEU 141 HD2 LEU 141 -4.633 0.415 2.187 912 2HD2 LEU 141 HD2 LEU 141 -3.724 0.704 3.675 913 3HD2 LEU 141 HD2 LEU 141 -4.200 2.072 2.665 914 H ILE 142 HN ILE 142 -1.450 3.655 -1.039 915 HA ILE 142 HA ILE 142 -0.611 5.338 1.078 916 HB ILE 142 HB ILE 142 0.365 5.121 -1.777 917 1HG1 ILE 142 2HG1 ILE 142 1.511 4.257 0.867 918 2HG1 ILE 142 1HG1 ILE 142 0.730 3.201 -0.307 919 1HG2 ILE 142 1HG2 ILE 142 1.550 6.752 0.491 920 2HG2 ILE 142 3HG2 ILE 142 2.303 6.476 -1.080 921 3HG2 ILE 142 2HG2 ILE 142 0.811 7.406 -0.972 922 1HD1 ILE 142 HD1 ILE 142 3.282 4.732 -0.702 923 2HD1 ILE 142 HD1 ILE 142 3.118 2.998 -0.366 924 3HD1 ILE 142 HD1 ILE 142 2.499 3.662 -1.870 925 H ASN 143 HN ASN 143 -2.247 5.981 -2.007 926 HA ASN 143 HA ASN 143 -2.375 8.778 -1.820 927 1HB ASN 143 HB2 ASN 143 -4.363 6.856 -3.057 928 2HB ASN 143 HB1 ASN 143 -4.485 8.605 -3.204 929 1HD2 ASN 143 HD2 ASN 143 -4.132 6.557 -5.240 930 2HD2 ASN 143 HD2 ASN 143 -2.672 6.900 -6.075 931 H LYS 144 HN LYS 144 -4.310 6.339 -0.350 932 HA LYS 144 HA LYS 144 -6.392 7.843 0.750 933 1HB LYS 144 HB2 LYS 144 -6.218 5.366 0.571 934 2HB LYS 144 HB1 LYS 144 -5.023 5.387 1.852 935 1HG LYS 144 HG2 LYS 144 -6.786 6.359 3.355 936 2HG LYS 144 HG1 LYS 144 -7.934 6.094 2.036 937 1HD LYS 144 HD2 LYS 144 -6.282 3.966 3.351 938 2HD LYS 144 HD1 LYS 144 -7.988 4.255 3.641 939 1HE LYS 144 HE2 LYS 144 -6.701 3.348 1.045 940 2HE LYS 144 HE1 LYS 144 -7.721 2.413 2.126 941 1HZ LYS 144 HZ3 LYS 144 -9.579 3.905 1.588 942 2HZ LYS 144 HZ2 LYS 144 -8.606 4.734 0.490 943 3HZ LYS 144 HZ1 LYS 144 -8.968 3.125 0.232 944 H PHE 145 HN PHE 145 -3.247 6.856 2.100 945 HA PHE 145 HA PHE 145 -3.637 8.387 4.488 946 1HB PHE 145 HB2 PHE 145 -1.365 6.711 3.475 947 2HB PHE 145 HB1 PHE 145 -1.181 7.722 4.906 948 HD1 PHE 145 HD1 PHE 145 -2.273 7.215 6.928 949 HD2 PHE 145 HD2 PHE 145 -2.969 4.796 3.495 950 HE1 PHE 145 HE1 PHE 145 -3.391 5.555 8.322 951 HE2 PHE 145 HE2 PHE 145 -4.063 3.119 4.892 952 HZ PHE 145 HZ PHE 145 -4.286 3.487 7.313 953 H MET 146 HN MET 146 -2.041 8.931 1.480 954 HA MET 146 HA MET 146 -0.639 11.316 2.207 955 1HB MET 146 HB2 MET 146 -1.856 10.549 -0.459 956 2HB MET 146 HB1 MET 146 -0.770 11.896 -0.218 957 1HG MET 146 HG2 MET 146 0.078 9.085 0.373 958 2HG MET 146 HG1 MET 146 0.092 9.702 -1.266 959 1HE MET 146 HE3 MET 146 1.682 9.764 2.272 960 2HE MET 146 HE2 MET 146 2.960 10.980 2.111 961 3HE MET 146 HE1 MET 146 1.276 11.483 2.241 962 H ASN 147 HN ASN 147 -3.896 10.497 1.845 963 HA ASN 147 HA ASN 147 -5.829 11.488 1.634 964 1HB ASN 147 HB2 ASN 147 -4.326 13.486 3.262 965 2HB ASN 147 HB1 ASN 147 -6.042 13.751 2.898 966 1HD2 ASN 147 HD2 ASN 147 -7.540 12.287 3.851 967 2HD2 ASN 147 HD2 ASN 147 -7.109 11.317 5.207 968 H VAL 148 HN VAL 148 -4.969 11.441 -0.601 969 HA VAL 148 HA VAL 148 -4.417 13.945 -1.860 970 HB VAL 148 HB VAL 148 -5.448 11.452 -3.177 971 1HG1 VAL 148 3HG1 VAL 148 -3.944 13.813 -4.312 972 2HG1 VAL 148 2HG1 VAL 148 -4.367 12.360 -5.222 973 3HG1 VAL 148 1HG1 VAL 148 -5.638 13.411 -4.593 974 1HG2 VAL 148 1HG2 VAL 148 -2.585 12.288 -2.715 975 2HG2 VAL 148 3HG2 VAL 148 -3.408 10.918 -1.971 976 3HG2 VAL 148 2HG2 VAL 148 -3.087 10.917 -3.707 977 H LYS 149 HN LYS 149 -5.755 15.386 -1.757 978 HA LYS 149 HA LYS 149 -8.571 14.810 -2.132 979 1HB LYS 149 HB2 LYS 149 -7.182 17.249 -1.034 980 2HB LYS 149 HB1 LYS 149 -8.926 17.100 -1.204 981 1HG LYS 149 HG2 LYS 149 -9.035 15.346 0.417 982 2HG LYS 149 HG1 LYS 149 -7.283 15.177 0.440 983 1HD LYS 149 HD2 LYS 149 -8.803 17.621 1.388 984 2HD LYS 149 HD1 LYS 149 -8.187 16.348 2.443 985 1HE LYS 149 HE2 LYS 149 -5.908 16.823 1.669 986 2HE LYS 149 HE1 LYS 149 -6.535 18.090 0.626 987 1HZ LYS 149 HZ2 LYS 149 -7.329 19.239 2.639 988 2HZ LYS 149 HZ1 LYS 149 -6.573 18.068 3.603 989 3HZ LYS 149 HZ3 LYS 149 -5.669 19.067 2.586 990 H ASP 150 HN ASP 150 -6.071 15.509 -3.869 991 HA ASP 150 HA ASP 150 -7.122 17.562 -5.613 992 1HB ASP 150 HB2 ASP 150 -4.688 15.769 -5.914 993 2HB ASP 150 HB1 ASP 150 -5.142 17.013 -7.069 994 H LYS 151 HN LYS 151 -8.720 17.085 -6.869 995 HA LYS 151 HA LYS 151 -9.083 14.347 -7.808 996 1HB LYS 151 HB2 LYS 151 -11.330 15.149 -8.553 997 2HB LYS 151 HB1 LYS 151 -11.053 15.306 -6.825 998 1HG LYS 151 HG2 LYS 151 -10.558 17.692 -7.133 999 2HG LYS 151 HG1 LYS 151 -10.896 17.533 -8.858 1000 1HD LYS 151 HD2 LYS 151 -12.867 16.929 -6.653 1001 2HD LYS 151 HD1 LYS 151 -12.754 18.470 -7.496 1002 1HE LYS 151 HE2 LYS 151 -13.331 15.815 -8.823 1003 2HE LYS 151 HE1 LYS 151 -14.550 16.995 -8.353 1004 1HZ LYS 151 HZ3 LYS 151 -13.482 18.597 -9.850 1005 2HZ LYS 151 HZ2 LYS 151 -12.394 17.428 -10.363 1006 3HZ LYS 151 HZ1 LYS 151 -14.033 17.236 -10.670 1007 H VAL 152 HN VAL 152 -7.290 16.597 -8.765 1008 HA VAL 152 HA VAL 152 -8.038 16.555 -11.593 1009 HB VAL 152 HB VAL 152 -6.532 18.529 -11.867 1010 1HG1 VAL 152 1HG1 VAL 152 -8.815 18.830 -9.924 1011 2HG1 VAL 152 3HG1 VAL 152 -8.089 20.141 -10.849 1012 3HG1 VAL 152 2HG1 VAL 152 -8.927 18.833 -11.685 1013 1HG2 VAL 152 1HG2 VAL 152 -6.504 18.518 -8.842 1014 2HG2 VAL 152 3HG2 VAL 152 -5.120 18.225 -9.894 1015 3HG2 VAL 152 2HG2 VAL 152 -5.885 19.814 -9.867 1016 H HIS 153 HN HIS 153 -6.498 16.232 -13.129 1017 HA HIS 153 HA HIS 153 -4.776 15.299 -14.180 1018 1HB HIS 153 HB2 HIS 153 -3.268 15.567 -11.560 1019 2HB HIS 153 HB1 HIS 153 -2.539 15.016 -13.062 1020 HD1 HIS 153 HD1 HIS 153 -3.283 18.057 -11.164 1021 HD2 HIS 153 HD2 HIS 153 -2.511 17.058 -15.123 1022 HE1 HIS 153 HE1 HIS 153 -2.748 20.215 -12.345 1023 H LYS 154 HN LYS 154 -4.080 13.334 -14.746 1024 HA LYS 154 HA LYS 154 -3.940 11.143 -14.919 1025 1HB LYS 154 HB2 LYS 154 -4.219 11.017 -11.912 1026 2HB LYS 154 HB1 LYS 154 -4.031 9.593 -12.916 1027 1HG LYS 154 HG2 LYS 154 -1.891 10.009 -12.142 1028 2HG LYS 154 HG1 LYS 154 -1.888 10.723 -13.755 1029 1HD LYS 154 HD2 LYS 154 -2.406 12.922 -12.687 1030 2HD LYS 154 HD1 LYS 154 -2.156 12.152 -11.118 1031 1HE LYS 154 HE2 LYS 154 -0.136 13.219 -11.723 1032 2HE LYS 154 HE1 LYS 154 0.094 11.476 -11.912 1033 1HZ LYS 154 HZ1 LYS 154 -0.353 11.776 -14.330 1034 2HZ LYS 154 HZ3 LYS 154 -0.422 13.426 -14.074 1035 3HZ LYS 154 HZ2 LYS 154 1.015 12.593 -13.830 1036 H LEU 155 HN LEU 155 -5.436 10.181 -16.004 1037 HA LEU 155 HA LEU 155 -8.155 10.183 -14.935 1038 1HB LEU 155 HB2 LEU 155 -7.194 9.309 -17.673 1039 2HB LEU 155 HB1 LEU 155 -8.857 9.330 -17.149 1040 HG LEU 155 HG LEU 155 -8.537 11.867 -16.873 1041 1HD1 LEU 155 HD1 LEU 155 -6.201 11.281 -18.673 1042 2HD1 LEU 155 HD1 LEU 155 -6.870 12.877 -18.337 1043 3HD1 LEU 155 HD1 LEU 155 -6.126 11.943 -17.039 1044 1HD2 LEU 155 HD2 LEU 155 -8.522 10.574 -19.583 1045 2HD2 LEU 155 HD2 LEU 155 -9.920 10.843 -18.542 1046 3HD2 LEU 155 HD2 LEU 155 -9.062 12.226 -19.233 1047 H GLU 156 HN GLU 156 -8.104 8.706 -13.448 1048 HA GLU 156 HA GLU 156 -8.108 6.704 -12.364 1049 1HB GLU 156 HB2 GLU 156 -9.536 5.945 -14.240 1050 2HB GLU 156 HB1 GLU 156 -8.104 5.526 -15.163 1051 1HG GLU 156 HG2 GLU 156 -9.069 3.537 -14.294 1052 2HG GLU 156 HG1 GLU 156 -7.560 3.830 -13.437 1053 H HIS 157 HN HIS 157 -6.114 5.861 -15.141 1054 HA HIS 157 HA HIS 157 -3.710 5.811 -13.471 1055 1HB HIS 157 HB2 HIS 157 -4.684 3.487 -13.484 1056 2HB HIS 157 HB1 HIS 157 -4.529 3.485 -15.236 1057 HD1 HIS 157 HD1 HIS 157 -2.331 2.619 -16.145 1058 HD2 HIS 157 HD2 HIS 157 -2.112 3.641 -12.126 1059 HE1 HIS 157 HE1 HIS 157 -0.033 1.917 -15.362 1060 H HIS 158 HN HIS 158 -5.253 6.809 -16.220 1061 HA HIS 158 HA HIS 158 -3.053 6.494 -18.061 1062 1HB HIS 158 HB2 HIS 158 -5.661 8.014 -18.372 1063 2HB HIS 158 HB1 HIS 158 -4.476 7.753 -19.642 1064 HD1 HIS 158 HD1 HIS 158 -4.514 5.430 -20.817 1065 HD2 HIS 158 HD2 HIS 158 -7.226 5.821 -17.697 1066 HE1 HIS 158 HE1 HIS 158 -6.081 3.467 -21.002 1067 H HIS 159 HN HIS 159 -1.745 8.136 -18.755 1068 HA HIS 159 HA HIS 159 -0.474 9.958 -18.615 1069 1HB HIS 159 HB2 HIS 159 -3.016 11.326 -17.638 1070 2HB HIS 159 HB1 HIS 159 -1.553 12.168 -18.145 1071 HD1 HIS 159 HD1 HIS 159 -1.121 12.330 -20.728 1072 HD2 HIS 159 HD2 HIS 159 -4.535 10.202 -19.702 1073 HE1 HIS 159 HE1 HIS 159 -2.369 11.945 -22.871 1074 H HIS 160 HN HIS 160 -0.144 8.208 -16.776 1075 HA HIS 160 HA HIS 160 -0.228 9.295 -14.129 1076 1HB HIS 160 HB2 HIS 160 1.054 7.216 -13.486 1077 2HB HIS 160 HB1 HIS 160 -0.496 6.916 -14.253 1078 HD1 HIS 160 HD1 HIS 160 -0.464 5.343 -16.200 1079 HD2 HIS 160 HD2 HIS 160 3.321 6.768 -15.261 1080 HE1 HIS 160 HE1 HIS 160 1.151 4.054 -17.657 1081 H HIS 161 HN HIS 161 1.767 9.280 -12.780 1082 HA HIS 161 HA HIS 161 3.712 10.183 -12.187 1083 1HB HIS 161 HB2 HIS 161 4.500 9.937 -15.108 1084 2HB HIS 161 HB1 HIS 161 5.577 10.569 -13.872 1085 HD1 HIS 161 HD1 HIS 161 6.268 8.003 -15.520 1086 HD2 HIS 161 HD2 HIS 161 4.495 8.041 -11.758 1087 HE1 HIS 161 HE1 HIS 161 6.792 5.770 -14.467 1088 H HIS 162 HN HIS 162 4.442 12.187 -11.771 1089 HA HIS 162 HA HIS 162 3.947 14.371 -13.500 1090 1HB HIS 162 HB2 HIS 162 1.663 13.940 -12.462 1091 2HB HIS 162 HB1 HIS 162 2.374 14.272 -10.889 1092 HD1 HIS 162 HD1 HIS 162 0.696 15.938 -13.725 1093 HD2 HIS 162 HD2 HIS 162 3.322 17.040 -10.676 1094 HE1 HIS 162 HE1 HIS 162 0.545 18.417 -13.533 No H/Q in entry = 1094 Start of MODEL 25 1 H1 MET 1 HT1 MET 1 17.830 -16.547 -3.985 2 H2 MET 1 HT3 MET 1 19.470 -16.162 -3.941 3 H3 MET 1 HT2 MET 1 18.906 -17.625 -3.295 4 HA MET 1 HA MET 1 19.372 -16.132 -1.524 5 1HB MET 1 HB2 MET 1 17.981 -14.062 -1.307 6 2HB MET 1 HB1 MET 1 19.115 -14.000 -2.646 7 1HG MET 1 HG2 MET 1 17.265 -14.600 -4.176 8 2HG MET 1 HG1 MET 1 16.157 -14.547 -2.805 9 1HE MET 1 HE1 MET 1 14.687 -12.885 -4.322 10 2HE MET 1 HE3 MET 1 15.303 -11.371 -4.983 11 3HE MET 1 HE2 MET 1 15.906 -12.908 -5.597 12 H GLU 2 HN GLU 2 18.072 -16.151 0.376 13 HA GLU 2 HA GLU 2 15.842 -18.016 0.185 14 1HB GLU 2 HB2 GLU 2 17.583 -17.012 2.398 15 2HB GLU 2 HB1 GLU 2 15.996 -17.654 2.787 16 1HG GLU 2 HG2 GLU 2 17.802 -19.318 3.020 17 2HG GLU 2 HG1 GLU 2 16.570 -19.798 1.864 18 H MET 3 HN MET 3 13.800 -17.656 0.843 19 HA MET 3 HA MET 3 12.654 -15.225 0.217 20 1HB MET 3 HB2 MET 3 11.525 -17.443 1.938 21 2HB MET 3 HB1 MET 3 10.587 -16.087 1.339 22 1HG MET 3 HG2 MET 3 10.154 -18.005 -0.025 23 2HG MET 3 HG1 MET 3 11.070 -16.840 -0.976 24 1HE MET 3 HE1 MET 3 11.588 -18.709 -2.777 25 2HE MET 3 HE3 MET 3 12.302 -20.273 -2.398 26 3HE MET 3 HE2 MET 3 10.673 -19.893 -1.843 27 H GLY 4 HN GLY 4 13.698 -16.430 3.309 28 1HA GLY 4 HA1 GLY 4 13.905 -15.417 5.382 29 2HA GLY 4 HA2 GLY 4 12.512 -14.439 4.942 30 H GLN 5 HN GLN 5 15.526 -14.536 3.177 31 HA GLN 5 HA GLN 5 16.456 -12.070 4.380 32 1HB GLN 5 HB2 GLN 5 17.636 -13.690 2.135 33 2HB GLN 5 HB1 GLN 5 18.417 -12.334 2.941 34 1HG GLN 5 HG2 GLN 5 18.300 -13.599 5.058 35 2HG GLN 5 HG1 GLN 5 17.673 -14.978 4.156 36 1HE2 GLN 5 1HE2 GLN 5 20.401 -13.013 4.846 37 2HE2 GLN 5 2HE2 GLN 5 21.575 -14.034 4.096 38 H LEU 6 HN LEU 6 14.879 -13.157 1.537 39 HA LEU 6 HA LEU 6 15.066 -10.743 0.067 40 1HB LEU 6 HB2 LEU 6 14.470 -12.880 -0.993 41 2HB LEU 6 HB1 LEU 6 13.065 -13.030 0.025 42 HG LEU 6 HG LEU 6 12.672 -12.467 -2.415 43 1HD1 LEU 6 HD1 LEU 6 10.938 -12.197 -0.741 44 2HD1 LEU 6 HD1 LEU 6 11.525 -10.576 -0.387 45 3HD1 LEU 6 HD1 LEU 6 10.846 -10.939 -1.976 46 1HD2 LEU 6 HD2 LEU 6 14.449 -10.824 -2.706 47 2HD2 LEU 6 HD2 LEU 6 12.876 -10.114 -3.077 48 3HD2 LEU 6 HD2 LEU 6 13.664 -9.758 -1.540 49 H LYS 7 HN LYS 7 12.793 -12.095 2.377 50 HA LYS 7 HA LYS 7 10.998 -10.023 2.589 51 1HB LYS 7 HB2 LYS 7 11.800 -12.306 4.218 52 2HB LYS 7 HB1 LYS 7 11.149 -10.965 5.150 53 1HG LYS 7 HG2 LYS 7 9.814 -12.167 2.767 54 2HG LYS 7 HG1 LYS 7 9.485 -12.676 4.412 55 1HD LYS 7 HD2 LYS 7 9.342 -9.784 3.692 56 2HD LYS 7 HD1 LYS 7 7.931 -10.820 3.356 57 1HE LYS 7 HE2 LYS 7 7.991 -11.411 5.801 58 2HE LYS 7 HE1 LYS 7 9.274 -10.225 5.996 59 1HZ LYS 7 HZ2 LYS 7 6.531 -9.588 5.001 60 2HZ LYS 7 HZ1 LYS 7 7.104 -9.386 6.569 61 3HZ LYS 7 HZ3 LYS 7 7.781 -8.473 5.349 62 H ASN 8 HN ASN 8 14.093 -10.488 4.108 63 HA ASN 8 HA ASN 8 13.985 -8.400 5.906 64 1HB ASN 8 HB2 ASN 8 15.756 -10.096 5.956 65 2HB ASN 8 HB1 ASN 8 16.394 -9.511 4.431 66 1HD2 ASN 8 HD2 ASN 8 18.414 -9.095 5.237 67 2HD2 ASN 8 HD2 ASN 8 18.740 -7.825 6.343 68 H LYS 9 HN LYS 9 14.980 -8.437 2.506 69 HA LYS 9 HA LYS 9 15.732 -5.701 2.255 70 1HB LYS 9 HB2 LYS 9 14.591 -7.572 0.163 71 2HB LYS 9 HB1 LYS 9 15.324 -6.011 -0.156 72 1HG LYS 9 HG2 LYS 9 16.734 -8.419 0.992 73 2HG LYS 9 HG1 LYS 9 16.812 -7.879 -0.685 74 1HD LYS 9 HD2 LYS 9 17.751 -5.716 0.126 75 2HD LYS 9 HD1 LYS 9 17.806 -6.408 1.748 76 1HE LYS 9 HE2 LYS 9 19.983 -6.600 0.721 77 2HE LYS 9 HE1 LYS 9 19.276 -8.199 0.909 78 1HZ LYS 9 HZ1 LYS 9 19.300 -6.617 -1.606 79 2HZ LYS 9 HZ3 LYS 9 20.341 -7.884 -1.258 80 3HZ LYS 9 HZ2 LYS 9 18.698 -8.183 -1.458 81 H ILE 10 HN ILE 10 12.733 -7.449 1.632 82 HA ILE 10 HA ILE 10 11.166 -5.312 0.804 83 HB ILE 10 HB ILE 10 10.409 -7.904 2.143 84 1HG1 ILE 10 2HG1 ILE 10 10.169 -6.873 -0.678 85 2HG1 ILE 10 1HG1 ILE 10 11.301 -8.092 -0.097 86 1HG2 ILE 10 1HG2 ILE 10 8.668 -6.305 2.741 87 2HG2 ILE 10 3HG2 ILE 10 8.491 -5.846 1.045 88 3HG2 ILE 10 2HG2 ILE 10 8.063 -7.475 1.564 89 1HD1 ILE 10 HD1 ILE 10 9.417 -9.558 0.397 90 2HD1 ILE 10 HD1 ILE 10 8.310 -8.338 -0.231 91 3HD1 ILE 10 HD1 ILE 10 9.482 -9.105 -1.312 92 H GLU 11 HN GLU 11 11.532 -6.647 4.057 93 HA GLU 11 HA GLU 11 9.809 -4.939 5.383 94 1HB GLU 11 HB2 GLU 11 12.366 -6.187 6.391 95 2HB GLU 11 HB1 GLU 11 11.215 -5.350 7.421 96 1HG GLU 11 HG2 GLU 11 10.675 -7.829 5.802 97 2HG GLU 11 HG1 GLU 11 10.914 -7.747 7.547 98 H ASN 12 HN ASN 12 13.287 -4.511 4.857 99 HA ASN 12 HA ASN 12 13.399 -1.982 6.074 100 1HB ASN 12 HB2 ASN 12 15.469 -3.161 5.727 101 2HB ASN 12 HB1 ASN 12 15.211 -3.212 3.989 102 1HD2 ASN 12 HD2 ASN 12 15.736 -1.455 2.768 103 2HD2 ASN 12 HD2 ASN 12 16.522 -0.042 3.361 104 H LYS 13 HN LYS 13 12.924 -2.862 2.669 105 HA LYS 13 HA LYS 13 12.965 -0.220 1.666 106 1HB LYS 13 HB2 LYS 13 13.159 -2.475 0.390 107 2HB LYS 13 HB1 LYS 13 11.413 -2.503 0.445 108 1HG LYS 13 HG2 LYS 13 12.210 -1.633 -1.733 109 2HG LYS 13 HG1 LYS 13 11.307 -0.423 -0.821 110 1HD LYS 13 HD2 LYS 13 13.320 0.487 -1.883 111 2HD LYS 13 HD1 LYS 13 13.343 0.657 -0.133 112 1HE LYS 13 HE2 LYS 13 15.518 0.021 -0.872 113 2HE LYS 13 HE1 LYS 13 14.816 -1.338 -0.018 114 1HZ LYS 13 HZ1 LYS 13 14.274 -2.349 -2.207 115 2HZ LYS 13 HZ3 LYS 13 14.993 -1.030 -2.972 116 3HZ LYS 13 HZ2 LYS 13 15.911 -2.047 -2.036 117 H LYS 14 HN LYS 14 10.363 -2.299 2.761 118 HA LYS 14 HA LYS 14 8.086 -0.783 2.299 119 1HB LYS 14 HB2 LYS 14 8.197 -3.134 3.111 120 2HB LYS 14 HB1 LYS 14 8.782 -2.547 4.650 121 1HG LYS 14 HG2 LYS 14 6.621 -1.395 4.984 122 2HG LYS 14 HG1 LYS 14 6.051 -2.086 3.463 123 1HD LYS 14 HD2 LYS 14 5.228 -3.534 5.179 124 2HD LYS 14 HD1 LYS 14 6.597 -4.371 4.445 125 1HE LYS 14 HE2 LYS 14 8.024 -3.442 6.312 126 2HE LYS 14 HE1 LYS 14 6.512 -2.862 7.018 127 1HZ LYS 14 HZ1 LYS 14 5.773 -5.270 7.161 128 2HZ LYS 14 HZ3 LYS 14 7.270 -5.709 6.536 129 3HZ LYS 14 HZ2 LYS 14 7.175 -4.972 8.002 130 H LYS 15 HN LYS 15 10.174 -0.934 5.113 131 HA LYS 15 HA LYS 15 8.836 1.059 6.627 132 1HB LYS 15 HB2 LYS 15 11.629 -0.021 6.975 133 2HB LYS 15 HB1 LYS 15 10.765 0.963 8.144 134 1HG LYS 15 HG2 LYS 15 9.078 -0.802 8.393 135 2HG LYS 15 HG1 LYS 15 9.920 -1.770 7.192 136 1HD LYS 15 HD2 LYS 15 10.694 -2.705 9.158 137 2HD LYS 15 HD1 LYS 15 11.956 -1.532 8.808 138 1HE LYS 15 HE2 LYS 15 9.676 -1.199 10.766 139 2HE LYS 15 HE1 LYS 15 11.353 -1.521 11.179 140 1HZ LYS 15 HZ2 LYS 15 11.910 0.692 10.229 141 2HZ LYS 15 HZ1 LYS 15 10.270 0.948 9.938 142 3HZ LYS 15 HZ3 LYS 15 10.825 0.779 11.507 143 H GLU 16 HN GLU 16 11.566 1.211 4.432 144 HA GLU 16 HA GLU 16 12.244 3.892 4.952 145 1HB GLU 16 HB2 GLU 16 12.424 2.299 2.412 146 2HB GLU 16 HB1 GLU 16 13.105 3.908 2.585 147 1HG GLU 16 HG2 GLU 16 14.442 2.911 4.500 148 2HG GLU 16 HG1 GLU 16 13.916 1.339 3.878 149 H LEU 17 HN LEU 17 9.910 2.433 2.780 150 HA LEU 17 HA LEU 17 8.983 4.799 1.559 151 1HB LEU 17 HB2 LEU 17 8.446 2.711 0.599 152 2HB LEU 17 HB1 LEU 17 7.682 2.148 2.080 153 HG LEU 17 HG LEU 17 6.154 4.292 1.588 154 1HD1 LEU 17 HD1 LEU 17 7.159 3.779 -1.044 155 2HD1 LEU 17 HD1 LEU 17 5.605 4.569 -0.592 156 3HD1 LEU 17 HD1 LEU 17 7.125 5.229 -0.018 157 1HD2 LEU 17 HD2 LEU 17 5.804 1.616 0.311 158 2HD2 LEU 17 HD2 LEU 17 5.416 2.140 1.965 159 3HD2 LEU 17 HD2 LEU 17 4.565 2.887 0.602 160 H ILE 18 HN ILE 18 7.879 2.922 4.329 161 HA ILE 18 HA ILE 18 5.650 4.377 4.986 162 HB ILE 18 HB ILE 18 7.550 2.949 6.888 163 1HG1 ILE 18 2HG1 ILE 18 4.897 2.021 5.789 164 2HG1 ILE 18 1HG1 ILE 18 6.441 1.626 5.045 165 1HG2 ILE 18 3HG2 ILE 18 4.711 3.887 7.400 166 2HG2 ILE 18 2HG2 ILE 18 5.665 2.889 8.492 167 3HG2 ILE 18 1HG2 ILE 18 6.165 4.540 8.142 168 1HD1 ILE 18 HD1 ILE 18 5.666 0.922 7.858 169 2HD1 ILE 18 HD1 ILE 18 5.533 -0.165 6.472 170 3HD1 ILE 18 HD1 ILE 18 7.114 0.416 7.002 171 H GLN 19 HN GLN 19 8.981 4.857 6.013 172 HA GLN 19 HA GLN 19 8.658 7.075 7.674 173 1HB GLN 19 HB2 GLN 19 10.945 6.294 5.878 174 2HB GLN 19 HB1 GLN 19 11.019 7.632 7.008 175 1HG GLN 19 HG2 GLN 19 10.728 6.155 8.865 176 2HG GLN 19 HG1 GLN 19 10.442 4.791 7.784 177 1HE2 GLN 19 1HE2 GLN 19 12.128 3.852 6.773 178 2HE2 GLN 19 2HE2 GLN 19 13.789 4.149 7.160 179 H LEU 20 HN LEU 20 9.027 6.886 4.185 180 HA LEU 20 HA LEU 20 9.173 9.676 3.730 181 1HB LEU 20 HB2 LEU 20 8.427 7.424 1.873 182 2HB LEU 20 HB1 LEU 20 8.723 9.077 1.367 183 HG LEU 20 HG LEU 20 10.774 7.282 2.667 184 1HD1 LEU 20 HD1 LEU 20 10.173 6.502 0.449 185 2HD1 LEU 20 HD1 LEU 20 10.445 8.117 -0.203 186 3HD1 LEU 20 HD1 LEU 20 11.797 7.198 0.458 187 1HD2 LEU 20 HD2 LEU 20 10.992 10.026 1.430 188 2HD2 LEU 20 HD2 LEU 20 11.219 9.617 3.135 189 3HD2 LEU 20 HD2 LEU 20 12.353 9.024 1.921 190 H VAL 21 HN VAL 21 6.448 7.335 3.405 191 HA VAL 21 HA VAL 21 4.534 9.251 2.745 192 HB VAL 21 HB VAL 21 4.077 6.682 4.301 193 1HG1 VAL 21 2HG1 VAL 21 2.312 8.197 2.407 194 2HG1 VAL 21 1HG1 VAL 21 1.944 6.635 3.144 195 3HG1 VAL 21 3HG1 VAL 21 2.091 8.077 4.166 196 1HG2 VAL 21 1HG2 VAL 21 5.432 6.211 2.373 197 2HG2 VAL 21 3HG2 VAL 21 3.801 5.570 2.161 198 3HG2 VAL 21 2HG2 VAL 21 4.280 7.058 1.326 199 H ALA 22 HN ALA 22 5.750 8.118 5.852 200 HA ALA 22 HA ALA 22 3.868 9.324 7.495 201 1HB ALA 22 HB3 ALA 22 6.722 8.652 8.155 202 2HB ALA 22 HB2 ALA 22 5.408 8.907 9.316 203 3HB ALA 22 HB1 ALA 22 5.362 7.538 8.213 204 H ARG 23 HN ARG 23 7.116 10.459 6.521 205 HA ARG 23 HA ARG 23 7.054 12.838 8.027 206 1HB ARG 23 HB2 ARG 23 8.930 13.634 6.604 207 2HB ARG 23 HB1 ARG 23 9.197 12.034 7.270 208 1HG ARG 23 HG2 ARG 23 8.598 11.042 5.134 209 2HG ARG 23 HG1 ARG 23 8.299 12.644 4.465 210 1HD ARG 23 HD2 ARG 23 10.955 11.754 5.585 211 2HD ARG 23 HD1 ARG 23 10.537 11.647 3.876 212 HE ARG 23 HE ARG 23 10.089 14.259 4.770 213 1HH1 ARG 23 1HH1 ARG 23 12.894 12.135 4.216 214 2HH1 ARG 23 2HH1 ARG 23 13.917 13.388 3.712 215 1HH2 ARG 23 1HH2 ARG 23 11.501 15.962 4.142 216 2HH2 ARG 23 2HH2 ARG 23 13.107 15.663 3.686 217 H HIS 24 HN HIS 24 5.521 12.035 5.135 218 HA HIS 24 HA HIS 24 5.133 14.490 3.904 219 1HB HIS 24 HB2 HIS 24 4.530 12.474 2.797 220 2HB HIS 24 HB1 HIS 24 3.389 11.984 4.010 221 HD1 HIS 24 HD1 HIS 24 0.969 13.129 3.820 222 HD2 HIS 24 HD2 HIS 24 3.716 14.381 0.982 223 HE1 HIS 24 HE1 HIS 24 -0.325 14.466 2.131 224 H GLY 25 HN GLY 25 3.713 13.223 6.853 225 1HA GLY 25 HA1 GLY 25 1.705 15.345 6.845 226 2HA GLY 25 HA2 GLY 25 2.973 15.456 8.054 227 H LEU 26 HN LEU 26 2.366 12.204 7.557 228 HA LEU 26 HA LEU 26 0.028 11.775 8.893 229 1HB LEU 26 HB2 LEU 26 2.455 10.216 8.334 230 2HB LEU 26 HB1 LEU 26 1.249 9.551 9.406 231 HG LEU 26 HG LEU 26 -0.413 9.829 7.617 232 1HD1 LEU 26 HD1 LEU 26 0.525 11.523 6.288 233 2HD1 LEU 26 HD1 LEU 26 1.888 10.479 5.837 234 3HD1 LEU 26 HD1 LEU 26 0.237 10.073 5.330 235 1HD2 LEU 26 HD2 LEU 26 1.943 8.066 7.052 236 2HD2 LEU 26 HD2 LEU 26 0.515 7.676 8.013 237 3HD2 LEU 26 HD2 LEU 26 0.383 7.900 6.263 238 H ASP 27 HN ASP 27 -0.436 11.102 10.818 239 HA ASP 27 HA ASP 27 1.063 12.130 13.082 240 1HB ASP 27 HB2 ASP 27 -1.547 10.583 13.052 241 2HB ASP 27 HB1 ASP 27 -0.907 11.570 14.354 242 H HIS 28 HN HIS 28 0.965 10.449 15.033 243 HA HIS 28 HA HIS 28 2.629 8.294 14.237 244 1HB HIS 28 HB2 HIS 28 1.364 8.947 16.898 245 2HB HIS 28 HB1 HIS 28 2.373 7.521 16.661 246 HD1 HIS 28 HD1 HIS 28 4.672 7.986 17.551 247 HD2 HIS 28 HD2 HIS 28 2.991 11.323 15.744 248 HE1 HIS 28 HE1 HIS 28 6.387 9.828 17.737 249 H ASP 29 HN ASP 29 -0.732 8.404 15.252 250 HA ASP 29 HA ASP 29 -1.232 5.637 15.158 251 1HB ASP 29 HB2 ASP 29 -3.062 8.008 14.872 252 2HB ASP 29 HB1 ASP 29 -3.659 6.360 14.719 253 H LYS 30 HN LYS 30 -1.108 8.048 12.762 254 HA LYS 30 HA LYS 30 -2.431 6.702 10.656 255 1HB LYS 30 HB2 LYS 30 -0.339 8.856 10.628 256 2HB LYS 30 HB1 LYS 30 -1.224 8.315 9.208 257 1HG LYS 30 HG2 LYS 30 -2.564 9.408 11.654 258 2HG LYS 30 HG1 LYS 30 -2.041 10.414 10.303 259 1HD LYS 30 HD2 LYS 30 -3.478 9.166 8.806 260 2HD LYS 30 HD1 LYS 30 -3.962 8.105 10.131 261 1HE LYS 30 HE2 LYS 30 -5.592 9.884 9.610 262 2HE LYS 30 HE1 LYS 30 -5.015 9.904 11.283 263 1HZ LYS 30 HZ2 LYS 30 -4.002 11.692 9.118 264 2HZ LYS 30 HZ1 LYS 30 -5.160 12.115 10.260 265 3HZ LYS 30 HZ3 LYS 30 -3.599 11.772 10.755 266 H VAL 31 HN VAL 31 0.995 7.006 11.590 267 HA VAL 31 HA VAL 31 2.041 5.518 9.458 268 HB VAL 31 HB VAL 31 3.195 5.934 12.243 269 1HG1 VAL 31 2HG1 VAL 31 4.572 5.126 9.700 270 2HG1 VAL 31 1HG1 VAL 31 5.367 5.498 11.233 271 3HG1 VAL 31 3HG1 VAL 31 4.299 4.098 11.101 272 1HG2 VAL 31 2HG2 VAL 31 3.569 7.488 9.703 273 2HG2 VAL 31 1HG2 VAL 31 2.723 8.035 11.147 274 3HG2 VAL 31 3HG2 VAL 31 4.465 7.751 11.198 275 H LEU 32 HN LEU 32 0.958 4.644 12.675 276 HA LEU 32 HA LEU 32 1.623 1.893 12.615 277 1HB LEU 32 HB2 LEU 32 -0.674 3.228 14.034 278 2HB LEU 32 HB1 LEU 32 -0.029 1.638 14.385 279 HG LEU 32 HG LEU 32 1.372 4.276 14.804 280 1HD1 LEU 32 HD1 LEU 32 0.333 2.223 16.724 281 2HD1 LEU 32 HD1 LEU 32 1.281 3.645 17.159 282 3HD1 LEU 32 HD1 LEU 32 -0.325 3.835 16.443 283 1HD2 LEU 32 HD2 LEU 32 2.371 1.468 15.307 284 2HD2 LEU 32 HD2 LEU 32 2.997 2.612 14.114 285 3HD2 LEU 32 HD2 LEU 32 3.166 2.952 15.834 286 H LEU 33 HN LEU 33 -1.463 3.480 11.842 287 HA LEU 33 HA LEU 33 -2.783 1.135 11.032 288 1HB LEU 33 HB2 LEU 33 -3.268 4.000 10.261 289 2HB LEU 33 HB1 LEU 33 -4.329 2.661 9.861 290 HG LEU 33 HG LEU 33 -3.656 3.431 12.702 291 1HD1 LEU 33 HD1 LEU 33 -6.040 4.209 11.033 292 2HD1 LEU 33 HD1 LEU 33 -5.849 4.494 12.766 293 3HD1 LEU 33 HD1 LEU 33 -4.774 5.288 11.621 294 1HD2 LEU 33 HD2 LEU 33 -4.438 1.135 12.384 295 2HD2 LEU 33 HD2 LEU 33 -5.644 2.107 13.226 296 3HD2 LEU 33 HD2 LEU 33 -5.849 1.730 11.516 297 H PHE 34 HN PHE 34 -0.950 3.504 9.177 298 HA PHE 34 HA PHE 34 -1.461 2.425 6.642 299 1HB PHE 34 HB2 PHE 34 -0.603 4.645 6.836 300 2HB PHE 34 HB1 PHE 34 0.841 4.096 7.680 301 HD1 PHE 34 HD1 PHE 34 2.762 3.464 6.471 302 HD2 PHE 34 HD2 PHE 34 -0.921 4.035 4.430 303 HE1 PHE 34 HE1 PHE 34 3.933 3.287 4.316 304 HE2 PHE 34 HE2 PHE 34 0.247 3.856 2.276 305 HZ PHE 34 HZ PHE 34 2.685 3.476 2.227 306 H SER 35 HN SER 35 1.282 1.919 8.866 307 HA SER 35 HA SER 35 2.576 0.194 7.082 308 1HB SER 35 HB2 SER 35 4.071 -0.364 8.983 309 2HB SER 35 HB1 SER 35 3.873 1.365 8.711 310 HG SER 35 HG SER 35 2.635 1.536 10.474 311 H ARG 36 HN ARG 36 0.349 -0.438 9.734 312 HA ARG 36 HA ARG 36 0.773 -3.228 9.623 313 1HB ARG 36 HB2 ARG 36 -1.261 -3.487 10.952 314 2HB ARG 36 HB1 ARG 36 -0.160 -2.300 11.647 315 1HG ARG 36 HG2 ARG 36 -1.593 -0.540 10.655 316 2HG ARG 36 HG1 ARG 36 -2.721 -1.792 10.150 317 1HD ARG 36 HD2 ARG 36 -1.865 -1.155 12.960 318 2HD ARG 36 HD1 ARG 36 -3.431 -0.791 12.235 319 HE ARG 36 HE ARG 36 -2.705 -3.584 12.207 320 1HH1 ARG 36 1HH1 ARG 36 -4.379 -1.046 14.051 321 2HH1 ARG 36 2HH1 ARG 36 -5.424 -2.123 14.856 322 1HH2 ARG 36 1HH2 ARG 36 -4.114 -5.088 13.405 323 2HH2 ARG 36 2HH2 ARG 36 -5.244 -4.464 14.496 324 H ASP 37 HN ASP 37 -1.456 -1.133 7.851 325 HA ASP 37 HA ASP 37 -2.867 -3.353 6.712 326 1HB ASP 37 HB2 ASP 37 -3.757 -1.021 6.730 327 2HB ASP 37 HB1 ASP 37 -2.546 -0.579 5.533 328 H LEU 38 HN LEU 38 -0.284 -1.253 5.655 329 HA LEU 38 HA LEU 38 0.313 -2.262 3.163 330 1HB LEU 38 HB2 LEU 38 1.279 -0.230 3.928 331 2HB LEU 38 HB1 LEU 38 2.023 -1.025 5.293 332 HG LEU 38 HG LEU 38 3.635 -2.113 3.828 333 1HD1 LEU 38 HD1 LEU 38 2.216 -0.669 1.619 334 2HD1 LEU 38 HD1 LEU 38 3.750 -1.548 1.479 335 3HD1 LEU 38 HD1 LEU 38 2.262 -2.418 1.875 336 1HD2 LEU 38 HD2 LEU 38 3.376 0.837 3.302 337 2HD2 LEU 38 HD2 LEU 38 4.161 0.087 4.692 338 3HD2 LEU 38 HD2 LEU 38 4.831 -0.129 3.074 339 H ASP 39 HN ASP 39 1.704 -3.204 6.261 340 HA ASP 39 HA ASP 39 3.475 -5.138 5.339 341 1HB ASP 39 HB2 ASP 39 3.622 -4.276 7.571 342 2HB ASP 39 HB1 ASP 39 2.022 -4.895 7.963 343 H LYS 40 HN LYS 40 0.152 -5.502 6.478 344 HA LYS 40 HA LYS 40 0.043 -8.306 6.088 345 1HB LYS 40 HB2 LYS 40 -2.181 -6.280 6.163 346 2HB LYS 40 HB1 LYS 40 -2.394 -8.022 6.157 347 1HG LYS 40 HG2 LYS 40 -1.285 -8.181 8.327 348 2HG LYS 40 HG1 LYS 40 -0.972 -6.442 8.310 349 1HD LYS 40 HD2 LYS 40 -3.443 -6.081 8.173 350 2HD LYS 40 HD1 LYS 40 -3.653 -7.815 8.396 351 1HE LYS 40 HE2 LYS 40 -2.261 -5.977 10.340 352 2HE LYS 40 HE1 LYS 40 -3.931 -6.501 10.490 353 1HZ LYS 40 HZ2 LYS 40 -3.078 -8.808 10.606 354 2HZ LYS 40 HZ1 LYS 40 -1.497 -8.221 10.654 355 3HZ LYS 40 HZ3 LYS 40 -2.591 -7.834 11.870 356 H LEU 41 HN LEU 41 -0.705 -5.555 4.041 357 HA LEU 41 HA LEU 41 -1.931 -6.854 1.886 358 1HB LEU 41 HB2 LEU 41 -1.939 -4.438 2.103 359 2HB LEU 41 HB1 LEU 41 -0.199 -4.388 2.004 360 HG LEU 41 HG LEU 41 -0.346 -5.183 -0.338 361 1HD1 LEU 41 HD1 LEU 41 -2.476 -6.314 -0.255 362 2HD1 LEU 41 HD1 LEU 41 -3.304 -4.779 0.014 363 3HD1 LEU 41 HD1 LEU 41 -2.470 -5.074 -1.508 364 1HD2 LEU 41 HD2 LEU 41 -0.095 -2.822 0.167 365 2HD2 LEU 41 HD2 LEU 41 -1.113 -3.045 -1.255 366 3HD2 LEU 41 HD2 LEU 41 -1.843 -2.647 0.299 367 H ILE 42 HN ILE 42 1.424 -6.144 2.567 368 HA ILE 42 HA ILE 42 2.479 -7.161 0.133 369 HB ILE 42 HB ILE 42 3.855 -6.792 2.816 370 1HG1 ILE 42 2HG1 ILE 42 3.825 -5.124 0.317 371 2HG1 ILE 42 1HG1 ILE 42 3.005 -4.725 1.821 372 1HG2 ILE 42 3HG2 ILE 42 5.058 -7.327 0.100 373 2HG2 ILE 42 2HG2 ILE 42 5.968 -6.902 1.550 374 3HG2 ILE 42 1HG2 ILE 42 5.077 -8.424 1.482 375 1HD1 ILE 42 HD1 ILE 42 5.980 -4.943 1.429 376 2HD1 ILE 42 HD1 ILE 42 5.052 -3.446 1.529 377 3HD1 ILE 42 HD1 ILE 42 5.154 -4.513 2.931 378 H ASN 43 HN ASN 43 2.483 -8.507 3.347 379 HA ASN 43 HA ASN 43 3.447 -11.040 2.765 380 1HB ASN 43 HB2 ASN 43 1.580 -10.148 4.957 381 2HB ASN 43 HB1 ASN 43 2.338 -11.731 4.919 382 1HD2 ASN 43 HD2 ASN 43 2.565 -9.450 6.780 383 2HD2 ASN 43 HD2 ASN 43 4.215 -9.015 6.888 384 H LYS 44 HN LYS 44 0.216 -9.792 2.428 385 HA LYS 44 HA LYS 44 -1.241 -12.175 1.964 386 1HB LYS 44 HB2 LYS 44 -2.256 -10.000 2.360 387 2HB LYS 44 HB1 LYS 44 -1.610 -9.391 0.845 388 1HG LYS 44 HG2 LYS 44 -2.997 -11.309 -0.256 389 2HG LYS 44 HG1 LYS 44 -3.841 -11.339 1.294 390 1HD LYS 44 HD2 LYS 44 -3.557 -8.915 -0.453 391 2HD LYS 44 HD1 LYS 44 -4.980 -9.942 -0.352 392 1HE LYS 44 HE2 LYS 44 -3.784 -8.395 1.952 393 2HE LYS 44 HE1 LYS 44 -5.160 -7.905 0.967 394 1HZ LYS 44 HZ3 LYS 44 -6.372 -9.855 1.751 395 2HZ LYS 44 HZ2 LYS 44 -5.061 -10.293 2.736 396 3HZ LYS 44 HZ1 LYS 44 -5.879 -8.860 3.012 397 H PHE 45 HN PHE 45 0.358 -9.912 -0.242 398 HA PHE 45 HA PHE 45 -0.203 -11.515 -2.520 399 1HB PHE 45 HB2 PHE 45 1.301 -8.976 -2.112 400 2HB PHE 45 HB1 PHE 45 1.488 -9.882 -3.613 401 HD1 PHE 45 HD1 PHE 45 -0.901 -8.038 -1.504 402 HD2 PHE 45 HD2 PHE 45 -0.227 -10.003 -5.202 403 HE1 PHE 45 HE1 PHE 45 -2.992 -7.082 -2.389 404 HE2 PHE 45 HE2 PHE 45 -2.314 -9.052 -6.100 405 HZ PHE 45 HZ PHE 45 -3.695 -7.585 -4.686 406 H MET 46 HN MET 46 2.492 -11.165 -0.424 407 HA MET 46 HA MET 46 4.392 -12.637 -1.980 408 1HB MET 46 HB2 MET 46 4.153 -12.507 1.011 409 2HB MET 46 HB1 MET 46 5.569 -12.994 0.093 410 1HG MET 46 HG2 MET 46 5.581 -10.596 -0.822 411 2HG MET 46 HG1 MET 46 4.346 -10.289 0.366 412 1HE MET 46 HE3 MET 46 7.913 -11.511 -0.216 413 2HE MET 46 HE2 MET 46 8.622 -11.563 1.387 414 3HE MET 46 HE1 MET 46 7.407 -12.759 0.913 415 H ASN 47 HN ASN 47 1.920 -13.498 0.342 416 HA ASN 47 HA ASN 47 1.002 -15.330 1.047 417 1HB ASN 47 HB2 ASN 47 0.763 -16.190 -1.197 418 2HB ASN 47 HB1 ASN 47 2.437 -16.721 -1.245 419 1HD2 ASN 47 HD2 ASN 47 -0.779 -17.449 -0.020 420 2HD2 ASN 47 HD2 ASN 47 -0.401 -19.046 0.479 421 H VAL 48 HN VAL 48 2.051 -14.801 2.830 422 HA VAL 48 HA VAL 48 4.361 -16.466 3.591 423 HB VAL 48 HB VAL 48 3.287 -13.950 4.898 424 1HG1 VAL 48 1HG1 VAL 48 5.830 -15.485 5.449 425 2HG1 VAL 48 3HG1 VAL 48 5.390 -13.947 6.194 426 3HG1 VAL 48 2HG1 VAL 48 4.417 -15.391 6.498 427 1HG2 VAL 48 3HG2 VAL 48 4.252 -13.420 2.750 428 2HG2 VAL 48 2HG2 VAL 48 5.284 -12.803 4.043 429 3HG2 VAL 48 1HG2 VAL 48 5.738 -14.269 3.169 430 H LYS 49 HN LYS 49 4.083 -17.920 5.105 431 HA LYS 49 HA LYS 49 1.547 -17.916 6.596 432 1HB LYS 49 HB2 LYS 49 2.924 -20.383 5.495 433 2HB LYS 49 HB1 LYS 49 1.367 -20.285 6.282 434 1HG LYS 49 HG2 LYS 49 0.804 -20.561 4.021 435 2HG LYS 49 HG1 LYS 49 0.662 -18.815 4.295 436 1HD LYS 49 HD2 LYS 49 1.738 -19.210 2.180 437 2HD LYS 49 HD1 LYS 49 2.892 -18.518 3.310 438 1HE LYS 49 HE2 LYS 49 3.784 -20.799 3.722 439 2HE LYS 49 HE1 LYS 49 2.667 -21.418 2.511 440 1HZ LYS 49 HZ3 LYS 49 3.756 -20.005 0.850 441 2HZ LYS 49 HZ2 LYS 49 4.836 -19.447 2.021 442 3HZ LYS 49 HZ1 LYS 49 4.855 -21.059 1.579 443 H ASP 50 HN ASP 50 4.538 -17.366 6.739 444 HA ASP 50 HA ASP 50 5.575 -19.274 8.641 445 1HB ASP 50 HB2 ASP 50 6.916 -16.844 7.432 446 2HB ASP 50 HB1 ASP 50 7.683 -18.256 8.149 447 H LYS 51 HN LYS 51 4.342 -18.683 10.473 448 HA LYS 51 HA LYS 51 4.464 -15.909 11.246 449 1HB LYS 51 HB2 LYS 51 2.854 -16.448 13.060 450 2HB LYS 51 HB1 LYS 51 2.255 -16.846 11.462 451 1HG LYS 51 HG2 LYS 51 2.796 -19.194 11.858 452 2HG LYS 51 HG1 LYS 51 3.365 -18.779 13.479 453 1HD LYS 51 HD2 LYS 51 1.107 -17.894 13.999 454 2HD LYS 51 HD1 LYS 51 0.568 -18.416 12.402 455 1HE LYS 51 HE2 LYS 51 -0.069 -20.024 14.109 456 2HE LYS 51 HE1 LYS 51 1.084 -20.732 12.985 457 1HZ LYS 51 HZ1 LYS 51 2.843 -20.336 14.620 458 2HZ LYS 51 HZ3 LYS 51 1.718 -19.680 15.695 459 3HZ LYS 51 HZ2 LYS 51 1.631 -21.304 15.257 460 H VAL 52 HN VAL 52 6.325 -18.358 11.619 461 HA VAL 52 HA VAL 52 7.363 -17.671 14.245 462 HB VAL 52 HB VAL 52 9.300 -19.173 13.722 463 1HG1 VAL 52 1HG1 VAL 52 6.584 -20.383 13.245 464 2HG1 VAL 52 3HG1 VAL 52 8.039 -21.286 13.667 465 3HG1 VAL 52 2HG1 VAL 52 7.365 -20.123 14.804 466 1HG2 VAL 52 2HG2 VAL 52 7.865 -19.582 11.096 467 2HG2 VAL 52 1HG2 VAL 52 9.457 -18.861 11.328 468 3HG2 VAL 52 3HG2 VAL 52 9.203 -20.572 11.672 469 H HIS 53 HN HIS 53 7.421 -16.340 11.280 470 HA HIS 53 HA HIS 53 9.855 -14.773 11.790 471 1HB HIS 53 HB2 HIS 53 8.352 -15.354 9.233 472 2HB HIS 53 HB1 HIS 53 9.493 -14.030 9.358 473 HD1 HIS 53 HD1 HIS 53 11.917 -14.595 8.977 474 HD2 HIS 53 HD2 HIS 53 9.528 -17.960 9.453 475 HE1 HIS 53 HE1 HIS 53 13.367 -16.564 8.387 476 H LYS 54 HN LYS 54 6.749 -14.613 12.626 477 HA LYS 54 HA LYS 54 6.610 -11.779 12.029 478 1HB LYS 54 HB2 LYS 54 5.416 -13.260 10.273 479 2HB LYS 54 HB1 LYS 54 4.201 -13.481 11.519 480 1HG LYS 54 HG2 LYS 54 3.587 -11.700 9.973 481 2HG LYS 54 HG1 LYS 54 3.840 -11.067 11.605 482 1HD LYS 54 HD2 LYS 54 5.962 -10.173 11.038 483 2HD LYS 54 HD1 LYS 54 6.018 -11.086 9.530 484 1HE LYS 54 HE2 LYS 54 5.572 -8.737 9.135 485 2HE LYS 54 HE1 LYS 54 4.204 -9.732 8.663 486 1HZ LYS 54 HZ1 LYS 54 4.411 -8.126 11.154 487 2HZ LYS 54 HZ3 LYS 54 3.547 -7.783 9.744 488 3HZ LYS 54 HZ2 LYS 54 3.070 -9.081 10.681 489 H LEU 55 HN LEU 55 6.329 -10.856 13.929 490 HA LEU 55 HA LEU 55 4.466 -12.080 15.799 491 1HB LEU 55 HB2 LEU 55 5.777 -11.192 17.680 492 2HB LEU 55 HB1 LEU 55 6.687 -12.320 16.705 493 HG LEU 55 HG LEU 55 7.047 -9.333 16.444 494 1HD1 LEU 55 HD1 LEU 55 8.544 -11.246 18.227 495 2HD1 LEU 55 HD1 LEU 55 8.980 -9.567 17.929 496 3HD1 LEU 55 HD1 LEU 55 7.469 -9.956 18.758 497 1HD2 LEU 55 HD2 LEU 55 8.811 -11.689 15.752 498 2HD2 LEU 55 HD2 LEU 55 7.938 -10.677 14.602 499 3HD2 LEU 55 HD2 LEU 55 9.254 -9.996 15.559 500 H GLU 56 HN GLU 56 2.714 -10.988 15.725 501 HA GLU 56 HA GLU 56 2.821 -8.041 15.838 502 1HB GLU 56 HB2 GLU 56 0.845 -9.809 14.386 503 2HB GLU 56 HB1 GLU 56 0.588 -8.098 14.675 504 1HG GLU 56 HG2 GLU 56 2.450 -7.542 13.270 505 2HG GLU 56 HG1 GLU 56 2.872 -9.245 13.095 506 H HIS 57 HN HIS 57 0.470 -10.626 16.117 507 HA HIS 57 HA HIS 57 -0.972 -11.305 17.566 508 1HB HIS 57 HB2 HIS 57 0.722 -9.894 19.607 509 2HB HIS 57 HB1 HIS 57 -0.707 -10.843 19.999 510 HD1 HIS 57 HD1 HIS 57 -0.380 -13.414 20.172 511 HD2 HIS 57 HD2 HIS 57 2.865 -11.447 18.463 512 HE1 HIS 57 HE1 HIS 57 1.419 -15.131 19.916 513 H HIS 58 HN HIS 58 -2.949 -10.801 17.741 514 HA HIS 58 HA HIS 58 -3.538 -8.057 17.487 515 1HB HIS 58 HB2 HIS 58 -5.971 -8.805 17.138 516 2HB HIS 58 HB1 HIS 58 -4.788 -9.289 15.934 517 HD1 HIS 58 HD1 HIS 58 -4.639 -11.802 15.445 518 HD2 HIS 58 HD2 HIS 58 -6.748 -10.963 18.935 519 HE1 HIS 58 HE1 HIS 58 -5.644 -13.966 16.192 520 H HIS 59 HN HIS 59 -2.755 -7.589 19.578 521 HA HIS 59 HA HIS 59 -4.802 -7.871 21.682 522 1HB HIS 59 HB2 HIS 59 -1.947 -6.855 21.870 523 2HB HIS 59 HB1 HIS 59 -3.070 -6.897 23.220 524 HD1 HIS 59 HD1 HIS 59 -3.680 -9.317 24.139 525 HD2 HIS 59 HD2 HIS 59 -0.692 -9.189 21.277 526 HE1 HIS 59 HE1 HIS 59 -2.527 -11.560 24.243 527 H HIS 60 HN HIS 60 -4.294 -6.019 19.208 528 HA HIS 60 HA HIS 60 -4.946 -4.014 18.442 529 1HB HIS 60 HB2 HIS 60 -6.208 -3.577 21.174 530 2HB HIS 60 HB1 HIS 60 -6.451 -2.533 19.780 531 HD1 HIS 60 HD1 HIS 60 -8.228 -3.322 18.029 532 HD2 HIS 60 HD2 HIS 60 -7.420 -6.100 21.020 533 HE1 HIS 60 HE1 HIS 60 -9.945 -5.139 17.788 534 H HIS 61 HN HIS 61 -3.685 -3.780 21.658 535 HA HIS 61 HA HIS 61 -2.362 -1.258 21.187 536 1HB HIS 61 HB2 HIS 61 -2.038 -3.253 23.452 537 2HB HIS 61 HB1 HIS 61 -1.443 -1.597 23.439 538 HD1 HIS 61 HD1 HIS 61 -4.514 -3.627 24.121 539 HD2 HIS 61 HD2 HIS 61 -3.441 0.375 23.719 540 HE1 HIS 61 HE1 HIS 61 -6.443 -2.299 24.995 541 H HIS 62 HN HIS 62 -0.523 -1.169 20.044 542 HA HIS 62 HA HIS 62 1.498 -3.189 20.391 543 1HB HIS 62 HB2 HIS 62 0.009 -3.946 18.466 544 2HB HIS 62 HB1 HIS 62 0.462 -2.473 17.623 545 HD1 HIS 62 HD1 HIS 62 1.698 -5.900 18.462 546 HD2 HIS 62 HD2 HIS 62 3.121 -2.452 16.618 547 HE1 HIS 62 HE1 HIS 62 3.802 -6.563 17.266 548 H1 MET 101 HT1 MET 101 9.810 24.887 -0.810 549 H2 MET 101 HT3 MET 101 9.029 24.263 0.544 550 H3 MET 101 HT2 MET 101 10.642 24.775 0.646 551 HA MET 101 HA MET 101 11.320 23.022 -0.861 552 1HB MET 101 HB2 MET 101 11.171 22.537 1.614 553 2HB MET 101 HB1 MET 101 9.538 21.959 1.356 554 1HG MET 101 HG2 MET 101 10.992 20.076 1.517 555 2HG MET 101 HG1 MET 101 10.418 20.212 -0.144 556 1HE MET 101 HE1 MET 101 13.422 20.580 2.309 557 2HE MET 101 HE3 MET 101 14.680 21.266 1.286 558 3HE MET 101 HE2 MET 101 13.286 22.245 1.741 559 H GLU 102 HN GLU 102 10.710 21.701 -2.528 560 HA GLU 102 HA GLU 102 7.941 21.815 -3.301 561 1HB GLU 102 HB2 GLU 102 9.690 22.176 -4.984 562 2HB GLU 102 HB1 GLU 102 10.358 20.587 -4.650 563 1HG GLU 102 HG2 GLU 102 9.023 20.728 -6.739 564 2HG GLU 102 HG1 GLU 102 8.463 19.506 -5.600 565 H MET 103 HN MET 103 6.511 20.222 -3.191 566 HA MET 103 HA MET 103 7.218 17.913 -1.587 567 1HB MET 103 HB2 MET 103 4.811 17.349 -1.617 568 2HB MET 103 HB1 MET 103 5.081 18.987 -1.058 569 1HG MET 103 HG2 MET 103 4.403 19.848 -3.237 570 2HG MET 103 HG1 MET 103 4.199 18.202 -3.831 571 1HE MET 103 HE1 MET 103 1.733 18.864 -4.630 572 2HE MET 103 HE3 MET 103 0.517 19.560 -3.560 573 3HE MET 103 HE2 MET 103 1.949 20.495 -3.992 574 H GLY 104 HN GLY 104 6.932 18.713 -4.825 575 1HA GLY 104 HA1 GLY 104 7.422 17.500 -6.712 576 2HA GLY 104 HA2 GLY 104 6.337 16.288 -6.038 577 H GLN 105 HN GLN 105 9.367 17.385 -4.567 578 HA GLN 105 HA GLN 105 10.845 15.136 -5.548 579 1HB GLN 105 HB2 GLN 105 12.697 15.877 -4.178 580 2HB GLN 105 HB1 GLN 105 11.943 17.288 -4.906 581 1HG GLN 105 HG2 GLN 105 10.937 17.906 -2.857 582 2HG GLN 105 HG1 GLN 105 11.382 16.374 -2.109 583 1HE2 GLN 105 1HE2 GLN 105 12.544 19.481 -3.188 584 2HE2 GLN 105 2HE2 GLN 105 14.020 19.403 -2.317 585 H LEU 106 HN LEU 106 9.002 15.852 -2.711 586 HA LEU 106 HA LEU 106 9.897 13.669 -1.141 587 1HB LEU 106 HB2 LEU 106 8.847 15.732 -0.219 588 2HB LEU 106 HB1 LEU 106 7.338 15.301 -0.977 589 HG LEU 106 HG LEU 106 7.464 14.949 1.526 590 1HD1 LEU 106 HD1 LEU 106 6.823 12.529 -0.110 591 2HD1 LEU 106 HD1 LEU 106 6.316 12.823 1.552 592 3HD1 LEU 106 HD1 LEU 106 5.741 13.871 0.252 593 1HD2 LEU 106 HD2 LEU 106 9.740 14.097 1.663 594 2HD2 LEU 106 HD2 LEU 106 8.594 12.948 2.348 595 3HD2 LEU 106 HD2 LEU 106 9.269 12.663 0.749 596 H LYS 107 HN LYS 107 7.088 14.242 -3.190 597 HA LYS 107 HA LYS 107 5.980 11.678 -2.965 598 1HB LYS 107 HB2 LYS 107 5.504 14.034 -4.576 599 2HB LYS 107 HB1 LYS 107 5.294 12.563 -5.515 600 1HG LYS 107 HG2 LYS 107 4.004 12.986 -2.839 601 2HG LYS 107 HG1 LYS 107 3.235 13.452 -4.354 602 1HD LYS 107 HD2 LYS 107 4.274 10.660 -3.933 603 2HD LYS 107 HD1 LYS 107 2.644 11.102 -3.382 604 1HE LYS 107 HE2 LYS 107 2.212 11.838 -5.742 605 2HE LYS 107 HE1 LYS 107 3.777 11.162 -6.178 606 1HZ LYS 107 HZ2 LYS 107 1.528 9.591 -4.999 607 2HZ LYS 107 HZ1 LYS 107 1.948 9.650 -6.619 608 3HZ LYS 107 HZ3 LYS 107 3.000 8.967 -5.508 609 H ASN 108 HN ASN 108 8.398 12.995 -5.125 610 HA ASN 108 HA ASN 108 8.623 10.822 -6.844 611 1HB ASN 108 HB2 ASN 108 9.735 12.938 -7.340 612 2HB ASN 108 HB1 ASN 108 10.757 12.760 -5.918 613 1HD2 ASN 108 HD2 ASN 108 12.515 11.375 -5.996 614 2HD2 ASN 108 HD2 ASN 108 13.060 10.650 -7.456 615 H LYS 109 HN LYS 109 10.203 11.487 -3.740 616 HA LYS 109 HA LYS 109 11.865 9.217 -3.663 617 1HB LYS 109 HB2 LYS 109 10.567 10.656 -1.339 618 2HB LYS 109 HB1 LYS 109 11.886 9.509 -1.221 619 1HG LYS 109 HG2 LYS 109 13.349 11.040 -2.427 620 2HG LYS 109 HG1 LYS 109 12.008 12.176 -2.623 621 1HD LYS 109 HD2 LYS 109 11.832 12.312 -0.153 622 2HD LYS 109 HD1 LYS 109 13.244 11.271 -0.022 623 1HE LYS 109 HE2 LYS 109 13.164 13.991 -1.330 624 2HE LYS 109 HE1 LYS 109 13.815 13.627 0.265 625 1HZ LYS 109 HZ3 LYS 109 15.463 12.170 -0.852 626 2HZ LYS 109 HZ2 LYS 109 14.880 12.714 -2.352 627 3HZ LYS 109 HZ1 LYS 109 15.583 13.790 -1.293 628 H ILE 110 HN ILE 110 8.602 9.795 -2.445 629 HA ILE 110 HA ILE 110 8.088 7.285 -1.348 630 HB ILE 110 HB ILE 110 6.161 9.246 -2.634 631 1HG1 ILE 110 2HG1 ILE 110 6.850 8.721 0.264 632 2HG1 ILE 110 1HG1 ILE 110 7.349 10.118 -0.681 633 1HG2 ILE 110 3HG2 ILE 110 5.141 7.021 -2.618 634 2HG2 ILE 110 2HG2 ILE 110 5.498 6.859 -0.899 635 3HG2 ILE 110 1HG2 ILE 110 4.354 8.083 -1.446 636 1HD1 ILE 110 HD1 ILE 110 5.002 10.799 -0.879 637 2HD1 ILE 110 HD1 ILE 110 4.529 9.405 0.098 638 3HD1 ILE 110 HD1 ILE 110 5.532 10.677 0.797 639 H GLU 111 HN GLU 111 7.384 8.478 -4.620 640 HA GLU 111 HA GLU 111 6.286 6.139 -5.655 641 1HB GLU 111 HB2 GLU 111 7.898 8.255 -7.087 642 2HB GLU 111 HB1 GLU 111 6.963 7.005 -7.892 643 1HG GLU 111 HG2 GLU 111 5.903 9.177 -6.115 644 2HG GLU 111 HG1 GLU 111 5.729 9.098 -7.863 645 H ASN 112 HN ASN 112 9.609 7.260 -5.819 646 HA ASN 112 HA ASN 112 10.735 5.136 -7.239 647 1HB ASN 112 HB2 ASN 112 11.886 7.279 -6.791 648 2HB ASN 112 HB1 ASN 112 12.011 6.847 -5.095 649 1HD2 ASN 112 HD2 ASN 112 14.181 6.960 -5.087 650 2HD2 ASN 112 HD2 ASN 112 15.217 5.794 -5.818 651 H LYS 113 HN LYS 113 10.470 5.613 -3.742 652 HA LYS 113 HA LYS 113 11.822 3.254 -2.994 653 1HB LYS 113 HB2 LYS 113 11.437 5.291 -1.588 654 2HB LYS 113 HB1 LYS 113 9.765 4.793 -1.429 655 1HG LYS 113 HG2 LYS 113 10.997 4.174 0.540 656 2HG LYS 113 HG1 LYS 113 10.486 2.732 -0.333 657 1HD LYS 113 HD2 LYS 113 12.782 2.518 0.476 658 2HD LYS 113 HD1 LYS 113 12.722 2.495 -1.281 659 1HE LYS 113 HE2 LYS 113 13.491 4.709 -1.410 660 2HE LYS 113 HE1 LYS 113 13.363 4.960 0.342 661 1HZ LYS 113 HZ3 LYS 113 15.104 3.115 0.508 662 2HZ LYS 113 HZ2 LYS 113 15.264 3.240 -1.156 663 3HZ LYS 113 HZ1 LYS 113 15.641 4.556 -0.206 664 H LYS 114 HN LYS 114 8.368 4.037 -3.200 665 HA LYS 114 HA LYS 114 7.240 1.644 -2.449 666 1HB LYS 114 HB2 LYS 114 5.977 3.614 -2.591 667 2HB LYS 114 HB1 LYS 114 6.367 3.881 -4.294 668 1HG LYS 114 HG2 LYS 114 5.006 1.746 -4.724 669 2HG LYS 114 HG1 LYS 114 4.483 1.891 -3.046 670 1HD LYS 114 HD2 LYS 114 2.788 2.963 -4.343 671 2HD LYS 114 HD1 LYS 114 3.743 4.248 -3.602 672 1HE LYS 114 HE2 LYS 114 5.039 4.407 -5.750 673 2HE LYS 114 HE1 LYS 114 3.901 3.240 -6.417 674 1HZ LYS 114 HZ2 LYS 114 2.075 4.917 -6.072 675 2HZ LYS 114 HZ1 LYS 114 3.212 5.964 -5.418 676 3HZ LYS 114 HZ3 LYS 114 3.337 5.526 -6.998 677 H LYS 115 HN LYS 115 8.255 2.762 -5.706 678 HA LYS 115 HA LYS 115 7.440 0.372 -6.984 679 1HB LYS 115 HB2 LYS 115 9.398 2.482 -7.922 680 2HB LYS 115 HB1 LYS 115 8.763 1.185 -8.924 681 1HG LYS 115 HG2 LYS 115 6.486 2.074 -8.605 682 2HG LYS 115 HG1 LYS 115 7.145 3.379 -7.627 683 1HD LYS 115 HD2 LYS 115 6.900 4.408 -9.685 684 2HD LYS 115 HD1 LYS 115 8.574 3.887 -9.743 685 1HE LYS 115 HE2 LYS 115 6.250 2.396 -10.986 686 2HE LYS 115 HE1 LYS 115 7.338 3.460 -11.859 687 1HZ LYS 115 HZ3 LYS 115 9.162 1.908 -11.252 688 2HZ LYS 115 HZ2 LYS 115 8.029 0.871 -10.563 689 3HZ LYS 115 HZ1 LYS 115 7.972 1.194 -12.197 690 H GLU 116 HN GLU 116 10.499 1.388 -5.571 691 HA GLU 116 HA GLU 116 11.999 -0.880 -6.323 692 1HB GLU 116 HB2 GLU 116 12.260 1.023 -3.985 693 2HB GLU 116 HB1 GLU 116 13.318 -0.366 -4.169 694 1HG GLU 116 HG2 GLU 116 12.968 1.868 -6.154 695 2HG GLU 116 HG1 GLU 116 14.330 1.658 -5.052 696 H LEU 117 HN LEU 117 9.748 -0.389 -3.757 697 HA LEU 117 HA LEU 117 10.234 -2.896 -2.548 698 1HB LEU 117 HB2 LEU 117 9.352 -1.238 -1.140 699 2HB LEU 117 HB1 LEU 117 8.109 -0.797 -2.282 700 HG LEU 117 HG LEU 117 7.292 -1.945 -0.190 701 1HD1 LEU 117 HD1 LEU 117 5.946 -1.687 -2.010 702 2HD1 LEU 117 HD1 LEU 117 6.521 -3.198 -2.707 703 3HD1 LEU 117 HD1 LEU 117 5.640 -3.214 -1.163 704 1HD2 LEU 117 HD2 LEU 117 8.583 -4.353 -1.421 705 2HD2 LEU 117 HD2 LEU 117 9.066 -3.573 0.088 706 3HD2 LEU 117 HD2 LEU 117 7.481 -4.350 -0.042 707 H ILE 118 HN ILE 118 7.822 -1.699 -4.831 708 HA ILE 118 HA ILE 118 6.221 -3.930 -4.939 709 HB ILE 118 HB ILE 118 6.880 -2.049 -7.237 710 1HG1 ILE 118 2HG1 ILE 118 4.479 -2.085 -5.407 711 2HG1 ILE 118 1HG1 ILE 118 5.899 -1.091 -5.120 712 1HG2 ILE 118 2HG2 ILE 118 5.899 -4.144 -8.097 713 2HG2 ILE 118 1HG2 ILE 118 4.557 -3.994 -6.975 714 3HG2 ILE 118 3HG2 ILE 118 4.764 -2.813 -8.266 715 1HD1 ILE 118 HD1 ILE 118 4.103 -0.937 -7.525 716 2HD1 ILE 118 HD1 ILE 118 4.103 0.173 -6.145 717 3HD1 ILE 118 HD1 ILE 118 5.506 0.077 -7.206 718 H GLN 119 HN GLN 119 9.102 -3.198 -6.764 719 HA GLN 119 HA GLN 119 9.302 -5.478 -8.383 720 1HB GLN 119 HB2 GLN 119 11.436 -3.760 -7.147 721 2HB GLN 119 HB1 GLN 119 11.755 -5.012 -8.335 722 1HG GLN 119 HG2 GLN 119 10.586 -3.838 -10.018 723 2HG GLN 119 HG1 GLN 119 9.898 -2.712 -8.840 724 1HE2 GLN 119 1HE2 GLN 119 11.107 -1.167 -8.031 725 2HE2 GLN 119 2HE2 GLN 119 12.657 -0.670 -8.605 726 H LEU 120 HN LEU 120 10.325 -4.940 -5.042 727 HA LEU 120 HA LEU 120 11.672 -7.434 -4.772 728 1HB LEU 120 HB2 LEU 120 10.526 -5.619 -2.658 729 2HB LEU 120 HB1 LEU 120 11.527 -7.019 -2.337 730 HG LEU 120 HG LEU 120 12.407 -4.542 -3.821 731 1HD1 LEU 120 HD1 LEU 120 13.041 -5.529 -1.049 732 2HD1 LEU 120 HD1 LEU 120 13.777 -4.136 -1.838 733 3HD1 LEU 120 HD1 LEU 120 12.054 -4.128 -1.457 734 1HD2 LEU 120 HD2 LEU 120 13.942 -6.998 -2.959 735 2HD2 LEU 120 HD2 LEU 120 13.594 -6.503 -4.619 736 3HD2 LEU 120 HD2 LEU 120 14.654 -5.524 -3.616 737 H VAL 121 HN VAL 121 8.396 -6.366 -3.708 738 HA VAL 121 HA VAL 121 7.553 -8.862 -2.812 739 HB VAL 121 HB VAL 121 5.815 -6.822 -4.229 740 1HG1 VAL 121 2HG1 VAL 121 4.701 -8.944 -3.804 741 2HG1 VAL 121 1HG1 VAL 121 5.134 -8.843 -2.099 742 3HG1 VAL 121 3HG1 VAL 121 4.021 -7.664 -2.796 743 1HG2 VAL 121 3HG2 VAL 121 6.700 -6.898 -1.352 744 2HG2 VAL 121 2HG2 VAL 121 7.079 -5.673 -2.565 745 3HG2 VAL 121 1HG2 VAL 121 5.425 -5.851 -1.992 746 H ALA 122 HN ALA 122 7.487 -7.466 -6.037 747 HA ALA 122 HA ALA 122 5.988 -9.402 -7.326 748 1HB ALA 122 HB1 ALA 122 8.125 -7.643 -8.494 749 2HB ALA 122 HB3 ALA 122 6.857 -8.469 -9.412 750 3HB ALA 122 HB2 ALA 122 6.433 -7.207 -8.261 751 H ARG 123 HN ARG 123 9.522 -9.112 -7.062 752 HA ARG 123 HA ARG 123 10.064 -11.451 -8.584 753 1HB ARG 123 HB2 ARG 123 12.369 -11.268 -7.794 754 2HB ARG 123 HB1 ARG 123 11.754 -9.732 -8.396 755 1HG ARG 123 HG2 ARG 123 11.371 -9.037 -6.073 756 2HG ARG 123 HG1 ARG 123 12.088 -10.545 -5.510 757 1HD ARG 123 HD2 ARG 123 13.711 -8.726 -5.463 758 2HD ARG 123 HD1 ARG 123 14.176 -9.960 -6.631 759 HE ARG 123 HE ARG 123 12.821 -8.241 -8.164 760 1HH1 ARG 123 1HH1 ARG 123 15.438 -7.693 -5.831 761 2HH1 ARG 123 2HH1 ARG 123 16.065 -6.358 -6.650 762 1HH2 ARG 123 1HH2 ARG 123 13.703 -6.410 -9.296 763 2HH2 ARG 123 2HH2 ARG 123 15.046 -5.591 -8.673 764 H HIS 124 HN HIS 124 8.920 -11.114 -5.476 765 HA HIS 124 HA HIS 124 10.081 -13.387 -4.292 766 1HB HIS 124 HB2 HIS 124 9.022 -11.759 -2.909 767 2HB HIS 124 HB1 HIS 124 7.474 -11.911 -3.671 768 HD1 HIS 124 HD1 HIS 124 5.988 -14.011 -2.833 769 HD2 HIS 124 HD2 HIS 124 9.773 -13.794 -1.163 770 HE1 HIS 124 HE1 HIS 124 6.031 -15.692 -0.987 771 H GLY 125 HN GLY 125 7.495 -12.994 -6.589 772 1HA GLY 125 HA1 GLY 125 6.670 -15.789 -6.202 773 2HA GLY 125 HA2 GLY 125 7.406 -15.359 -7.741 774 H LEU 126 HN LEU 126 5.755 -12.646 -6.928 775 HA LEU 126 HA LEU 126 3.145 -13.248 -7.451 776 1HB LEU 126 HB2 LEU 126 4.882 -10.883 -7.600 777 2HB LEU 126 HB1 LEU 126 3.272 -10.787 -8.283 778 HG LEU 126 HG LEU 126 2.361 -11.449 -6.128 779 1HD1 LEU 126 HD1 LEU 126 4.108 -12.639 -5.161 780 2HD1 LEU 126 HD1 LEU 126 5.116 -11.178 -5.032 781 3HD1 LEU 126 HD1 LEU 126 3.594 -11.316 -4.120 782 1HD2 LEU 126 HD2 LEU 126 4.050 -8.972 -6.123 783 2HD2 LEU 126 HD2 LEU 126 2.402 -9.126 -6.732 784 3HD2 LEU 126 HD2 LEU 126 2.732 -9.278 -5.001 785 H ASP 127 HN ASP 127 1.941 -13.023 -9.204 786 HA ASP 127 HA ASP 127 3.122 -13.451 -11.818 787 1HB ASP 127 HB2 ASP 127 0.224 -13.163 -10.938 788 2HB ASP 127 HB1 ASP 127 0.728 -13.516 -12.581 789 H HIS 128 HN HIS 128 2.199 -11.982 -13.621 790 HA HIS 128 HA HIS 128 2.905 -9.327 -13.056 791 1HB HIS 128 HB2 HIS 128 1.410 -10.478 -15.422 792 2HB HIS 128 HB1 HIS 128 1.847 -8.782 -15.302 793 HD1 HIS 128 HD1 HIS 128 3.291 -12.138 -16.149 794 HD2 HIS 128 HD2 HIS 128 4.622 -8.261 -15.447 795 HE1 HIS 128 HE1 HIS 128 5.616 -12.019 -17.069 796 H ASP 129 HN ASP 129 -0.223 -10.890 -13.224 797 HA ASP 129 HA ASP 129 -1.795 -8.578 -12.889 798 1HB ASP 129 HB2 ASP 129 -2.393 -11.442 -12.106 799 2HB ASP 129 HB1 ASP 129 -3.570 -10.142 -12.025 800 H LYS 130 HN LYS 130 -0.294 -10.751 -10.654 801 HA LYS 130 HA LYS 130 -1.351 -9.806 -8.239 802 1HB LYS 130 HB2 LYS 130 1.270 -11.097 -8.930 803 2HB LYS 130 HB1 LYS 130 0.856 -10.650 -7.281 804 1HG LYS 130 HG2 LYS 130 -1.017 -12.357 -8.842 805 2HG LYS 130 HG1 LYS 130 0.444 -13.075 -8.165 806 1HD LYS 130 HD2 LYS 130 -0.156 -12.477 -5.979 807 2HD LYS 130 HD1 LYS 130 -1.476 -11.447 -6.493 808 1HE LYS 130 HE2 LYS 130 -2.626 -13.468 -7.376 809 2HE LYS 130 HE1 LYS 130 -1.275 -14.452 -6.816 810 1HZ LYS 130 HZ1 LYS 130 -3.039 -12.829 -5.056 811 2HZ LYS 130 HZ3 LYS 130 -3.152 -14.490 -5.295 812 3HZ LYS 130 HZ2 LYS 130 -1.798 -13.845 -4.554 813 H VAL 131 HN VAL 131 1.520 -8.780 -10.069 814 HA VAL 131 HA VAL 131 2.442 -6.849 -8.266 815 HB VAL 131 HB VAL 131 2.737 -6.818 -11.290 816 1HG1 VAL 131 3HG1 VAL 131 3.392 -4.732 -10.280 817 2HG1 VAL 131 2HG1 VAL 131 4.456 -5.588 -9.164 818 3HG1 VAL 131 1HG1 VAL 131 4.799 -5.601 -10.891 819 1HG2 VAL 131 2HG2 VAL 131 4.434 -8.196 -9.224 820 2HG2 VAL 131 1HG2 VAL 131 3.419 -8.962 -10.447 821 3HG2 VAL 131 3HG2 VAL 131 4.838 -8.035 -10.940 822 H LEU 132 HN LEU 132 0.278 -6.642 -11.048 823 HA LEU 132 HA LEU 132 -0.210 -3.846 -11.036 824 1HB LEU 132 HB2 LEU 132 -2.068 -6.038 -11.929 825 2HB LEU 132 HB1 LEU 132 -2.144 -4.349 -12.382 826 HG LEU 132 HG LEU 132 -0.020 -6.330 -13.174 827 1HD1 LEU 132 HD1 LEU 132 -2.125 -4.903 -14.754 828 2HD1 LEU 132 HD1 LEU 132 -0.857 -5.932 -15.429 829 3HD1 LEU 132 HD1 LEU 132 -2.083 -6.622 -14.361 830 1HD2 LEU 132 HD2 LEU 132 -0.237 -3.386 -13.791 831 2HD2 LEU 132 HD2 LEU 132 1.015 -4.181 -12.837 832 3HD2 LEU 132 HD2 LEU 132 0.891 -4.507 -14.561 833 H LEU 133 HN LEU 133 -1.953 -6.475 -9.485 834 HA LEU 133 HA LEU 133 -3.959 -4.790 -8.388 835 1HB LEU 133 HB2 LEU 133 -3.055 -7.501 -7.452 836 2HB LEU 133 HB1 LEU 133 -4.530 -6.662 -6.999 837 HG LEU 133 HG LEU 133 -3.864 -7.635 -9.780 838 1HD1 LEU 133 HD1 LEU 133 -5.733 -8.785 -7.724 839 2HD1 LEU 133 HD1 LEU 133 -5.574 -9.330 -9.396 840 3HD1 LEU 133 HD1 LEU 133 -4.218 -9.493 -8.284 841 1HD2 LEU 133 HD2 LEU 133 -6.398 -6.455 -8.645 842 2HD2 LEU 133 HD2 LEU 133 -5.333 -5.696 -9.826 843 3HD2 LEU 133 HD2 LEU 133 -6.232 -7.151 -10.259 844 H PHE 134 HN PHE 134 -0.913 -6.068 -7.172 845 HA PHE 134 HA PHE 134 -1.213 -5.168 -4.537 846 1HB PHE 134 HB2 PHE 134 0.434 -6.863 -5.018 847 2HB PHE 134 HB1 PHE 134 1.276 -5.795 -6.138 848 HD1 PHE 134 HD1 PHE 134 3.033 -4.475 -5.392 849 HD2 PHE 134 HD2 PHE 134 0.321 -6.134 -2.570 850 HE1 PHE 134 HE1 PHE 134 4.439 -3.633 -3.527 851 HE2 PHE 134 HE2 PHE 134 1.729 -5.299 -0.733 852 HZ PHE 134 HZ PHE 134 3.777 -4.043 -1.241 853 H SER 135 HN SER 135 0.480 -3.711 -7.324 854 HA SER 135 HA SER 135 1.505 -1.554 -5.911 855 1HB SER 135 HB2 SER 135 1.823 -0.537 -8.175 856 2HB SER 135 HB1 SER 135 2.460 -2.175 -8.004 857 HG SER 135 HG SER 135 1.347 -2.520 -9.699 858 H ARG 136 HN ARG 136 -1.564 -1.941 -7.558 859 HA ARG 136 HA ARG 136 -2.196 0.824 -7.304 860 1HB ARG 136 HB2 ARG 136 -4.459 0.257 -8.023 861 2HB ARG 136 HB1 ARG 136 -3.246 -0.394 -9.110 862 1HG ARG 136 HG2 ARG 136 -3.576 -2.589 -7.911 863 2HG ARG 136 HG1 ARG 136 -4.954 -1.832 -7.106 864 1HD ARG 136 HD2 ARG 136 -4.553 -2.144 -10.066 865 2HD ARG 136 HD1 ARG 136 -5.671 -3.074 -9.077 866 HE ARG 136 HE ARG 136 -6.279 -0.381 -8.701 867 1HH1 ARG 136 1HH1 ARG 136 -6.359 -2.680 -11.377 868 2HH1 ARG 136 2HH1 ARG 136 -7.674 -1.970 -12.165 869 1HH2 ARG 136 1HH2 ARG 136 -8.122 0.645 -9.812 870 2HH2 ARG 136 2HH2 ARG 136 -8.695 -0.032 -11.255 871 H ASP 137 HN ASP 137 -2.924 -2.020 -5.328 872 HA ASP 137 HA ASP 137 -4.695 -0.617 -3.592 873 1HB ASP 137 HB2 ASP 137 -4.509 -3.122 -3.751 874 2HB ASP 137 HB1 ASP 137 -2.993 -3.009 -2.854 875 H LEU 138 HN LEU 138 -1.292 -1.426 -3.491 876 HA LEU 138 HA LEU 138 -0.504 -0.230 -1.124 877 1HB LEU 138 HB2 LEU 138 1.007 -1.619 -2.282 878 2HB LEU 138 HB1 LEU 138 0.843 -0.711 -3.759 879 HG LEU 138 HG LEU 138 2.189 1.100 -2.838 880 1HD1 LEU 138 HD1 LEU 138 1.550 0.909 -0.501 881 2HD1 LEU 138 HD1 LEU 138 2.437 -0.621 -0.394 882 3HD1 LEU 138 HD1 LEU 138 3.304 0.883 -0.712 883 1HD2 LEU 138 HD2 LEU 138 3.405 -1.625 -2.511 884 2HD2 LEU 138 HD2 LEU 138 3.302 -0.682 -3.996 885 3HD2 LEU 138 HD2 LEU 138 4.307 -0.116 -2.663 886 H ASP 139 HN ASP 139 -0.563 1.149 -4.376 887 HA ASP 139 HA ASP 139 0.306 3.714 -3.734 888 1HB ASP 139 HB2 ASP 139 0.220 2.828 -6.020 889 2HB ASP 139 HB1 ASP 139 -1.532 2.827 -5.962 890 H LYS 140 HN LYS 140 -2.963 2.336 -3.764 891 HA LYS 140 HA LYS 140 -4.234 4.851 -3.335 892 1HB LYS 140 HB2 LYS 140 -6.210 3.791 -3.368 893 2HB LYS 140 HB1 LYS 140 -5.253 2.565 -4.212 894 1HG LYS 140 HG2 LYS 140 -5.084 1.325 -2.063 895 2HG LYS 140 HG1 LYS 140 -6.106 2.543 -1.308 896 1HD LYS 140 HD2 LYS 140 -7.815 1.964 -3.116 897 2HD LYS 140 HD1 LYS 140 -6.823 0.537 -3.424 898 1HE LYS 140 HE2 LYS 140 -8.139 1.298 -0.816 899 2HE LYS 140 HE1 LYS 140 -8.619 -0.013 -1.887 900 1HZ LYS 140 HZ1 LYS 140 -6.019 0.105 -0.404 901 2HZ LYS 140 HZ3 LYS 140 -7.376 -0.759 0.037 902 3HZ LYS 140 HZ2 LYS 140 -6.570 -1.186 -1.344 903 H LEU 141 HN LEU 141 -3.006 2.337 -1.244 904 HA LEU 141 HA LEU 141 -4.157 3.164 1.184 905 1HB LEU 141 HB2 LEU 141 -3.041 1.002 0.848 906 2HB LEU 141 HB1 LEU 141 -1.520 1.821 0.616 907 HG LEU 141 HG LEU 141 -1.554 2.586 2.948 908 1HD1 LEU 141 HD1 LEU 141 -3.949 2.663 3.323 909 2HD1 LEU 141 HD1 LEU 141 -4.041 0.904 3.212 910 3HD1 LEU 141 HD1 LEU 141 -3.150 1.661 4.533 911 1HD2 LEU 141 HD2 LEU 141 -0.405 0.530 2.359 912 2HD2 LEU 141 HD2 LEU 141 -1.108 0.412 3.969 913 3HD2 LEU 141 HD2 LEU 141 -1.891 -0.386 2.606 914 H ILE 142 HN ILE 142 -1.369 4.042 -0.587 915 HA ILE 142 HA ILE 142 -0.222 5.745 1.383 916 HB ILE 142 HB ILE 142 0.237 5.623 -1.615 917 1HG1 ILE 142 2HG1 ILE 142 1.862 4.604 0.712 918 2HG1 ILE 142 1HG1 ILE 142 0.872 3.609 -0.353 919 1HG2 ILE 142 2HG2 ILE 142 0.810 7.844 -0.767 920 2HG2 ILE 142 1HG2 ILE 142 1.813 7.121 0.490 921 3HG2 ILE 142 3HG2 ILE 142 2.265 6.950 -1.209 922 1HD1 ILE 142 HD1 ILE 142 2.292 4.220 -2.215 923 2HD1 ILE 142 HD1 ILE 142 3.302 5.191 -1.136 924 3HD1 ILE 142 HD1 ILE 142 3.204 3.439 -0.925 925 H ASN 143 HN ASN 143 -1.956 6.391 -1.608 926 HA ASN 143 HA ASN 143 -2.313 9.125 -1.410 927 1HB ASN 143 HB2 ASN 143 -4.354 7.151 -2.495 928 2HB ASN 143 HB1 ASN 143 -4.338 8.884 -2.805 929 1HD2 ASN 143 HD2 ASN 143 -4.183 6.644 -4.661 930 2HD2 ASN 143 HD2 ASN 143 -2.698 6.821 -5.527 931 H LYS 144 HN LYS 144 -4.294 6.582 -0.011 932 HA LYS 144 HA LYS 144 -6.350 8.061 1.151 933 1HB LYS 144 HB2 LYS 144 -6.379 5.616 1.020 934 2HB LYS 144 HB1 LYS 144 -5.030 5.519 2.138 935 1HG LYS 144 HG2 LYS 144 -6.493 6.562 3.889 936 2HG LYS 144 HG1 LYS 144 -7.830 6.453 2.740 937 1HD LYS 144 HD2 LYS 144 -6.235 4.071 3.655 938 2HD LYS 144 HD1 LYS 144 -7.727 4.603 4.421 939 1HE LYS 144 HE2 LYS 144 -7.430 3.742 1.534 940 2HE LYS 144 HE1 LYS 144 -8.111 2.788 2.847 941 1HZ LYS 144 HZ1 LYS 144 -9.864 4.518 3.080 942 2HZ LYS 144 HZ3 LYS 144 -9.245 5.287 1.706 943 3HZ LYS 144 HZ2 LYS 144 -9.884 3.754 1.597 944 H PHE 145 HN PHE 145 -3.220 7.110 2.524 945 HA PHE 145 HA PHE 145 -3.779 8.556 4.919 946 1HB PHE 145 HB2 PHE 145 -1.507 6.843 4.051 947 2HB PHE 145 HB1 PHE 145 -1.332 7.929 5.434 948 HD1 PHE 145 HD1 PHE 145 -2.416 7.550 7.449 949 HD2 PHE 145 HD2 PHE 145 -3.180 5.020 4.134 950 HE1 PHE 145 HE1 PHE 145 -3.593 5.965 8.936 951 HE2 PHE 145 HE2 PHE 145 -4.344 3.428 5.603 952 HZ PHE 145 HZ PHE 145 -4.552 3.908 8.009 953 H MET 146 HN MET 146 -2.102 9.243 2.012 954 HA MET 146 HA MET 146 -0.627 11.521 2.944 955 1HB MET 146 HB2 MET 146 -1.775 11.096 0.174 956 2HB MET 146 HB1 MET 146 -0.523 12.238 0.632 957 1HG MET 146 HG2 MET 146 0.898 10.224 1.242 958 2HG MET 146 HG1 MET 146 -0.367 9.259 0.519 959 1HE MET 146 HE3 MET 146 2.469 11.781 -0.070 960 2HE MET 146 HE2 MET 146 2.274 12.250 -1.759 961 3HE MET 146 HE1 MET 146 1.082 12.752 -0.555 962 H ASN 147 HN ASN 147 -3.924 10.887 2.274 963 HA ASN 147 HA ASN 147 -5.853 12.050 2.548 964 1HB ASN 147 HB2 ASN 147 -4.711 12.863 4.673 965 2HB ASN 147 HB1 ASN 147 -4.095 14.227 3.765 966 1HD2 ASN 147 HD2 ASN 147 -5.426 15.971 3.420 967 2HD2 ASN 147 HD2 ASN 147 -6.989 16.121 4.141 968 H VAL 148 HN VAL 148 -4.185 12.189 0.235 969 HA VAL 148 HA VAL 148 -4.437 14.860 -0.805 970 HB VAL 148 HB VAL 148 -3.440 13.982 -2.905 971 1HG1 VAL 148 3HG1 VAL 148 -1.915 13.375 -0.391 972 2HG1 VAL 148 2HG1 VAL 148 -1.190 13.505 -1.993 973 3HG1 VAL 148 1HG1 VAL 148 -1.968 14.908 -1.252 974 1HG2 VAL 148 2HG2 VAL 148 -3.264 11.364 -1.404 975 2HG2 VAL 148 1HG2 VAL 148 -4.242 11.687 -2.835 976 3HG2 VAL 148 3HG2 VAL 148 -2.481 11.708 -2.948 977 H LYS 149 HN LYS 149 -5.671 15.455 -2.465 978 HA LYS 149 HA LYS 149 -7.893 13.661 -3.166 979 1HB LYS 149 HB2 LYS 149 -8.060 16.597 -2.447 980 2HB LYS 149 HB1 LYS 149 -9.411 15.569 -2.907 981 1HG LYS 149 HG2 LYS 149 -9.073 14.230 -0.884 982 2HG LYS 149 HG1 LYS 149 -7.721 15.246 -0.427 983 1HD LYS 149 HD2 LYS 149 -9.233 17.202 -0.368 984 2HD LYS 149 HD1 LYS 149 -10.585 16.149 -0.780 985 1HE LYS 149 HE2 LYS 149 -10.190 14.873 1.290 986 2HE LYS 149 HE1 LYS 149 -8.881 15.979 1.704 987 1HZ LYS 149 HZ3 LYS 149 -10.513 17.798 1.693 988 2HZ LYS 149 HZ2 LYS 149 -11.743 16.679 1.392 989 3HZ LYS 149 HZ1 LYS 149 -10.900 16.617 2.829 990 H ASP 150 HN ASP 150 -5.361 14.542 -4.244 991 HA ASP 150 HA ASP 150 -5.850 16.500 -6.231 992 1HB ASP 150 HB2 ASP 150 -3.425 14.779 -5.704 993 2HB ASP 150 HB1 ASP 150 -3.491 16.111 -6.857 994 H LYS 151 HN LYS 151 -7.314 15.809 -7.465 995 HA LYS 151 HA LYS 151 -6.736 13.627 -9.328 996 1HB LYS 151 HB2 LYS 151 -9.234 13.299 -9.415 997 2HB LYS 151 HB1 LYS 151 -8.511 12.904 -7.862 998 1HG LYS 151 HG2 LYS 151 -9.234 15.110 -7.010 999 2HG LYS 151 HG1 LYS 151 -10.052 15.398 -8.544 1000 1HD LYS 151 HD2 LYS 151 -11.476 13.461 -8.170 1001 2HD LYS 151 HD1 LYS 151 -10.618 13.105 -6.668 1002 1HE LYS 151 HE2 LYS 151 -11.321 15.271 -5.769 1003 2HE LYS 151 HE1 LYS 151 -12.196 15.601 -7.256 1004 1HZ LYS 151 HZ3 LYS 151 -13.591 13.652 -6.796 1005 2HZ LYS 151 HZ2 LYS 151 -12.761 13.414 -5.340 1006 3HZ LYS 151 HZ1 LYS 151 -13.673 14.812 -5.571 1007 H VAL 152 HN VAL 152 -5.779 16.012 -9.643 1008 HA VAL 152 HA VAL 152 -7.186 18.084 -10.725 1009 HB VAL 152 HB VAL 152 -5.088 18.808 -11.820 1010 1HG1 VAL 152 1HG1 VAL 152 -4.778 17.795 -8.998 1011 2HG1 VAL 152 3HG1 VAL 152 -3.771 19.027 -9.759 1012 3HG1 VAL 152 2HG1 VAL 152 -5.483 19.338 -9.485 1013 1HG2 VAL 152 2HG2 VAL 152 -4.002 16.166 -10.831 1014 2HG2 VAL 152 1HG2 VAL 152 -4.216 16.632 -12.517 1015 3HG2 VAL 152 3HG2 VAL 152 -3.036 17.476 -11.512 1016 H HIS 153 HN HIS 153 -7.649 18.810 -12.676 1017 HA HIS 153 HA HIS 153 -7.745 16.901 -14.896 1018 1HB HIS 153 HB2 HIS 153 -9.938 17.997 -15.516 1019 2HB HIS 153 HB1 HIS 153 -10.003 17.064 -14.025 1020 HD1 HIS 153 HD1 HIS 153 -10.863 20.386 -15.366 1021 HD2 HIS 153 HD2 HIS 153 -9.898 18.757 -11.664 1022 HE1 HIS 153 HE1 HIS 153 -11.540 22.076 -13.658 1023 H LYS 154 HN LYS 154 -7.414 17.818 -16.934 1024 HA LYS 154 HA LYS 154 -6.455 19.182 -18.436 1025 1HB LYS 154 HB2 LYS 154 -7.408 21.399 -16.589 1026 2HB LYS 154 HB1 LYS 154 -6.641 21.685 -18.140 1027 1HG LYS 154 HG2 LYS 154 -8.490 20.774 -19.319 1028 2HG LYS 154 HG1 LYS 154 -9.181 20.103 -17.840 1029 1HD LYS 154 HD2 LYS 154 -10.365 22.138 -18.572 1030 2HD LYS 154 HD1 LYS 154 -9.626 22.327 -16.988 1031 1HE LYS 154 HE2 LYS 154 -9.281 24.345 -18.252 1032 2HE LYS 154 HE1 LYS 154 -7.738 23.534 -18.065 1033 1HZ LYS 154 HZ2 LYS 154 -9.423 23.477 -20.526 1034 2HZ LYS 154 HZ1 LYS 154 -8.058 24.409 -20.271 1035 3HZ LYS 154 HZ3 LYS 154 -7.919 22.748 -20.367 1036 H LEU 155 HN LEU 155 -4.441 18.267 -17.925 1037 HA LEU 155 HA LEU 155 -2.862 19.645 -15.967 1038 1HB LEU 155 HB2 LEU 155 -1.034 18.086 -16.411 1039 2HB LEU 155 HB1 LEU 155 -2.516 17.246 -16.045 1040 HG LEU 155 HG LEU 155 -1.521 17.577 -18.877 1041 1HD1 LEU 155 HD1 LEU 155 -0.955 15.377 -16.913 1042 2HD1 LEU 155 HD1 LEU 155 -0.529 15.364 -18.635 1043 3HD1 LEU 155 HD1 LEU 155 0.202 16.550 -17.549 1044 1HD2 LEU 155 HD2 LEU 155 -3.382 15.594 -17.551 1045 2HD2 LEU 155 HD2 LEU 155 -3.855 16.865 -18.684 1046 3HD2 LEU 155 HD2 LEU 155 -2.852 15.524 -19.226 1047 H GLU 156 HN GLU 156 -2.783 21.519 -16.673 1048 HA GLU 156 HA GLU 156 -1.507 22.150 -19.238 1049 1HB GLU 156 HB2 GLU 156 -3.700 23.158 -18.674 1050 2HB GLU 156 HB1 GLU 156 -2.969 23.915 -17.272 1051 1HG GLU 156 HG2 GLU 156 -1.545 25.249 -18.721 1052 2HG GLU 156 HG1 GLU 156 -2.234 24.458 -20.139 1053 H HIS 157 HN HIS 157 -1.332 22.567 -15.787 1054 HA HIS 157 HA HIS 157 0.228 23.162 -14.316 1055 1HB HIS 157 HB2 HIS 157 2.176 22.717 -16.601 1056 2HB HIS 157 HB1 HIS 157 2.631 22.898 -14.918 1057 HD1 HIS 157 HD1 HIS 157 2.820 20.337 -17.053 1058 HD2 HIS 157 HD2 HIS 157 0.557 20.739 -13.597 1059 HE1 HIS 157 HE1 HIS 157 2.273 17.988 -16.299 1060 H HIS 158 HN HIS 158 2.378 24.808 -14.307 1061 HA HIS 158 HA HIS 158 1.224 27.093 -15.603 1062 1HB HIS 158 HB2 HIS 158 2.580 28.578 -14.070 1063 2HB HIS 158 HB1 HIS 158 1.379 27.589 -13.285 1064 HD1 HIS 158 HD1 HIS 158 2.172 26.336 -11.239 1065 HD2 HIS 158 HD2 HIS 158 5.314 27.507 -13.705 1066 HE1 HIS 158 HE1 HIS 158 4.273 25.787 -10.001 1067 H HIS 159 HN HIS 159 1.889 26.280 -17.515 1068 HA HIS 159 HA HIS 159 4.619 26.206 -18.338 1069 1HB HIS 159 HB2 HIS 159 2.871 24.964 -19.561 1070 2HB HIS 159 HB1 HIS 159 2.038 26.466 -19.929 1071 HD1 HIS 159 HD1 HIS 159 2.700 27.611 -22.117 1072 HD2 HIS 159 HD2 HIS 159 5.404 24.676 -20.934 1073 HE1 HIS 159 HE1 HIS 159 4.297 27.341 -24.015 1074 H HIS 160 HN HIS 160 1.966 28.466 -18.680 1075 HA HIS 160 HA HIS 160 3.859 30.560 -19.373 1076 1HB HIS 160 HB2 HIS 160 1.890 30.242 -20.878 1077 2HB HIS 160 HB1 HIS 160 0.826 30.547 -19.515 1078 HD1 HIS 160 HD1 HIS 160 3.415 32.368 -21.640 1079 HD2 HIS 160 HD2 HIS 160 0.218 33.155 -19.115 1080 HE1 HIS 160 HE1 HIS 160 2.931 34.821 -21.865 1081 H HIS 161 HN HIS 161 4.603 30.381 -17.215 1082 HA HIS 161 HA HIS 161 2.821 31.265 -15.109 1083 1HB HIS 161 HB2 HIS 161 4.801 30.890 -13.609 1084 2HB HIS 161 HB1 HIS 161 4.286 29.459 -14.482 1085 HD1 HIS 161 HD1 HIS 161 6.010 28.322 -15.959 1086 HD2 HIS 161 HD2 HIS 161 7.234 32.024 -14.537 1087 HE1 HIS 161 HE1 HIS 161 8.448 28.543 -16.591 1088 H HIS 162 HN HIS 162 3.378 33.035 -13.741 1089 HA HIS 162 HA HIS 162 4.872 35.115 -15.153 1090 1HB HIS 162 HB2 HIS 162 2.438 35.449 -13.361 1091 2HB HIS 162 HB1 HIS 162 3.334 36.756 -14.120 1092 HD1 HIS 162 HD1 HIS 162 0.477 34.567 -14.649 1093 HD2 HIS 162 HD2 HIS 162 3.114 36.695 -17.046 1094 HE1 HIS 162 HE1 HIS 162 -0.618 34.745 -16.927 No H/Q in entry = 1094 Start of MODEL 26 1 H1 MET 1 HT2 MET 1 15.407 -17.703 -4.267 2 H2 MET 1 HT1 MET 1 16.278 -16.315 -3.966 3 H3 MET 1 HT3 MET 1 16.506 -17.162 -5.407 4 HA MET 1 HA MET 1 17.361 -19.051 -4.205 5 1HB MET 1 HB2 MET 1 18.744 -16.468 -3.446 6 2HB MET 1 HB1 MET 1 19.452 -18.059 -3.250 7 1HG MET 1 HG2 MET 1 19.327 -18.380 -5.688 8 2HG MET 1 HG1 MET 1 18.689 -16.741 -5.842 9 1HE MET 1 HE3 MET 1 20.640 -16.156 -7.561 10 2HE MET 1 HE2 MET 1 22.354 -16.389 -7.215 11 3HE MET 1 HE1 MET 1 21.294 -17.786 -7.394 12 H GLU 2 HN GLU 2 17.303 -16.313 -1.885 13 HA GLU 2 HA GLU 2 16.434 -18.213 0.161 14 1HB GLU 2 HB2 GLU 2 18.955 -17.407 0.141 15 2HB GLU 2 HB1 GLU 2 18.282 -15.887 0.702 16 1HG GLU 2 HG2 GLU 2 18.055 -18.546 2.109 17 2HG GLU 2 HG1 GLU 2 19.148 -17.239 2.541 18 H MET 3 HN MET 3 14.455 -17.542 0.688 19 HA MET 3 HA MET 3 13.646 -14.914 -0.099 20 1HB MET 3 HB2 MET 3 11.351 -15.535 0.491 21 2HB MET 3 HB1 MET 3 12.098 -16.675 -0.606 22 1HG MET 3 HG2 MET 3 12.490 -18.198 1.284 23 2HG MET 3 HG1 MET 3 11.681 -17.051 2.354 24 1HE MET 3 HE2 MET 3 11.292 -19.538 -0.658 25 2HE MET 3 HE1 MET 3 9.592 -19.344 -1.084 26 3HE MET 3 HE3 MET 3 10.727 -18.033 -1.387 27 H GLY 4 HN GLY 4 14.884 -16.143 2.768 28 1HA GLY 4 HA1 GLY 4 15.050 -15.268 4.853 29 2HA GLY 4 HA2 GLY 4 13.467 -14.528 4.610 30 H GLN 5 HN GLN 5 16.694 -14.192 3.148 31 HA GLN 5 HA GLN 5 17.072 -11.534 4.068 32 1HB GLN 5 HB2 GLN 5 18.414 -12.645 1.587 33 2HB GLN 5 HB1 GLN 5 18.907 -11.311 2.628 34 1HG GLN 5 HG2 GLN 5 18.892 -14.209 3.425 35 2HG GLN 5 HG1 GLN 5 20.310 -13.279 2.950 36 1HE2 GLN 5 1HE2 GLN 5 18.059 -13.956 5.382 37 2HE2 GLN 5 2HE2 GLN 5 18.822 -13.119 6.680 38 H LEU 6 HN LEU 6 15.299 -12.809 1.501 39 HA LEU 6 HA LEU 6 15.118 -10.449 -0.112 40 1HB LEU 6 HB2 LEU 6 14.803 -12.765 -1.006 41 2HB LEU 6 HB1 LEU 6 13.394 -12.931 0.006 42 HG LEU 6 HG LEU 6 12.999 -12.595 -2.477 43 1HD1 LEU 6 HD1 LEU 6 11.217 -12.335 -0.880 44 2HD1 LEU 6 HD1 LEU 6 11.684 -10.663 -0.601 45 3HD1 LEU 6 HD1 LEU 6 11.067 -11.149 -2.180 46 1HD2 LEU 6 HD2 LEU 6 13.803 -9.766 -1.809 47 2HD2 LEU 6 HD2 LEU 6 14.652 -10.873 -2.892 48 3HD2 LEU 6 HD2 LEU 6 13.039 -10.293 -3.310 49 H LYS 7 HN LYS 7 12.925 -12.075 2.196 50 HA LYS 7 HA LYS 7 10.894 -10.132 2.341 51 1HB LYS 7 HB2 LYS 7 11.734 -12.473 3.867 52 2HB LYS 7 HB1 LYS 7 11.236 -11.123 4.882 53 1HG LYS 7 HG2 LYS 7 9.433 -11.908 2.704 54 2HG LYS 7 HG1 LYS 7 9.522 -12.940 4.112 55 1HD LYS 7 HD2 LYS 7 7.793 -11.434 4.719 56 2HD LYS 7 HD1 LYS 7 9.263 -10.719 5.414 57 1HE LYS 7 HE2 LYS 7 9.391 -9.089 3.908 58 2HE LYS 7 HE1 LYS 7 8.409 -9.949 2.730 59 1HZ LYS 7 HZ2 LYS 7 6.458 -9.566 4.309 60 2HZ LYS 7 HZ1 LYS 7 7.470 -8.596 5.242 61 3HZ LYS 7 HZ3 LYS 7 7.090 -8.145 3.677 62 H ASN 8 HN ASN 8 13.941 -10.480 3.890 63 HA ASN 8 HA ASN 8 13.985 -8.544 5.867 64 1HB ASN 8 HB2 ASN 8 15.724 -10.167 5.629 65 2HB ASN 8 HB1 ASN 8 16.056 -9.647 3.992 66 1HD2 ASN 8 HD2 ASN 8 16.725 -9.211 7.268 67 2HD2 ASN 8 HD2 ASN 8 17.920 -7.975 7.098 68 H LYS 9 HN LYS 9 14.661 -8.281 2.387 69 HA LYS 9 HA LYS 9 15.390 -5.499 2.508 70 1HB LYS 9 HB2 LYS 9 14.680 -7.213 0.120 71 2HB LYS 9 HB1 LYS 9 15.407 -5.614 0.051 72 1HG LYS 9 HG2 LYS 9 16.648 -8.093 1.214 73 2HG LYS 9 HG1 LYS 9 17.067 -7.332 -0.324 74 1HD LYS 9 HD2 LYS 9 17.871 -5.365 0.825 75 2HD LYS 9 HD1 LYS 9 17.321 -6.006 2.375 76 1HE LYS 9 HE2 LYS 9 19.415 -7.244 0.615 77 2HE LYS 9 HE1 LYS 9 19.730 -6.294 2.071 78 1HZ LYS 9 HZ1 LYS 9 18.506 -7.966 3.350 79 2HZ LYS 9 HZ3 LYS 9 18.290 -8.895 1.939 80 3HZ LYS 9 HZ2 LYS 9 19.836 -8.607 2.551 81 H ILE 10 HN ILE 10 12.485 -7.360 1.938 82 HA ILE 10 HA ILE 10 11.016 -5.230 0.816 83 HB ILE 10 HB ILE 10 10.207 -7.835 2.113 84 1HG1 ILE 10 2HG1 ILE 10 10.250 -6.888 -0.747 85 2HG1 ILE 10 1HG1 ILE 10 11.436 -7.946 -0.002 86 1HG2 ILE 10 3HG2 ILE 10 8.371 -6.216 2.412 87 2HG2 ILE 10 2HG2 ILE 10 8.398 -5.878 0.681 88 3HG2 ILE 10 1HG2 ILE 10 7.944 -7.480 1.256 89 1HD1 ILE 10 HD1 ILE 10 8.532 -8.540 -0.414 90 2HD1 ILE 10 HD1 ILE 10 9.878 -9.160 -1.377 91 3HD1 ILE 10 HD1 ILE 10 9.718 -9.613 0.321 92 H GLU 11 HN GLU 11 11.344 -6.544 4.049 93 HA GLU 11 HA GLU 11 9.571 -4.813 5.373 94 1HB GLU 11 HB2 GLU 11 12.135 -6.051 6.388 95 2HB GLU 11 HB1 GLU 11 10.900 -5.303 7.393 96 1HG GLU 11 HG2 GLU 11 10.527 -7.739 5.667 97 2HG GLU 11 HG1 GLU 11 10.719 -7.726 7.420 98 H ASN 12 HN ASN 12 13.027 -4.519 4.817 99 HA ASN 12 HA ASN 12 13.400 -2.049 6.060 100 1HB ASN 12 HB2 ASN 12 15.235 -3.556 5.425 101 2HB ASN 12 HB1 ASN 12 14.925 -3.219 3.727 102 1HD2 ASN 12 HD2 ASN 12 15.565 -1.217 2.869 103 2HD2 ASN 12 HD2 ASN 12 16.600 -0.156 3.728 104 H LYS 13 HN LYS 13 12.769 -2.770 2.625 105 HA LYS 13 HA LYS 13 12.988 -0.099 1.739 106 1HB LYS 13 HB2 LYS 13 13.160 -2.246 0.356 107 2HB LYS 13 HB1 LYS 13 11.412 -2.297 0.402 108 1HG LYS 13 HG2 LYS 13 12.227 -1.340 -1.705 109 2HG LYS 13 HG1 LYS 13 11.278 -0.179 -0.780 110 1HD LYS 13 HD2 LYS 13 13.255 0.866 -1.721 111 2HD LYS 13 HD1 LYS 13 13.332 0.873 0.033 112 1HE LYS 13 HE2 LYS 13 15.484 0.329 -0.738 113 2HE LYS 13 HE1 LYS 13 14.803 -1.189 -0.166 114 1HZ LYS 13 HZ2 LYS 13 14.313 -1.714 -2.547 115 2HZ LYS 13 HZ1 LYS 13 15.048 -0.240 -2.953 116 3HZ LYS 13 HZ3 LYS 13 15.958 -1.461 -2.234 117 H LYS 14 HN LYS 14 10.222 -2.100 2.618 118 HA LYS 14 HA LYS 14 8.129 -0.358 2.146 119 1HB LYS 14 HB2 LYS 14 7.783 -2.647 2.539 120 2HB LYS 14 HB1 LYS 14 8.616 -2.610 4.094 121 1HG LYS 14 HG2 LYS 14 6.669 -1.081 4.825 122 2HG LYS 14 HG1 LYS 14 5.866 -1.644 3.358 123 1HD LYS 14 HD2 LYS 14 5.137 -3.111 5.097 124 2HD LYS 14 HD1 LYS 14 6.341 -4.007 4.164 125 1HE LYS 14 HE2 LYS 14 8.052 -3.345 5.858 126 2HE LYS 14 HE1 LYS 14 6.746 -2.594 6.766 127 1HZ LYS 14 HZ1 LYS 14 5.705 -4.912 6.909 128 2HZ LYS 14 HZ3 LYS 14 7.138 -5.510 6.242 129 3HZ LYS 14 HZ2 LYS 14 7.131 -4.705 7.694 130 H LYS 15 HN LYS 15 10.199 -0.830 5.041 131 HA LYS 15 HA LYS 15 8.863 1.103 6.598 132 1HB LYS 15 HB2 LYS 15 11.632 -0.043 6.888 133 2HB LYS 15 HB1 LYS 15 10.869 1.008 8.070 134 1HG LYS 15 HG2 LYS 15 9.108 -0.608 8.441 135 2HG LYS 15 HG1 LYS 15 9.760 -1.647 7.180 136 1HD LYS 15 HD2 LYS 15 10.436 -2.547 9.262 137 2HD LYS 15 HD1 LYS 15 11.844 -1.836 8.502 138 1HE LYS 15 HE2 LYS 15 11.650 0.175 9.869 139 2HE LYS 15 HE1 LYS 15 10.198 -0.468 10.633 140 1HZ LYS 15 HZ1 LYS 15 12.886 -1.719 10.798 141 2HZ LYS 15 HZ3 LYS 15 12.201 -0.730 11.970 142 3HZ LYS 15 HZ2 LYS 15 11.493 -2.203 11.628 143 H GLU 16 HN GLU 16 11.656 1.329 4.462 144 HA GLU 16 HA GLU 16 12.360 3.996 4.934 145 1HB GLU 16 HB2 GLU 16 12.333 2.457 2.335 146 2HB GLU 16 HB1 GLU 16 13.029 4.055 2.501 147 1HG GLU 16 HG2 GLU 16 14.669 3.141 4.088 148 2HG GLU 16 HG1 GLU 16 13.963 1.538 3.867 149 H LEU 17 HN LEU 17 9.854 2.594 2.890 150 HA LEU 17 HA LEU 17 8.954 5.030 1.808 151 1HB LEU 17 HB2 LEU 17 8.383 3.145 0.549 152 2HB LEU 17 HB1 LEU 17 7.863 2.246 1.946 153 HG LEU 17 HG LEU 17 6.033 2.873 0.306 154 1HD1 LEU 17 HD1 LEU 17 5.552 2.080 2.407 155 2HD1 LEU 17 HD1 LEU 17 5.595 3.706 3.075 156 3HD1 LEU 17 HD1 LEU 17 4.371 3.284 1.859 157 1HD2 LEU 17 HD2 LEU 17 6.434 5.628 1.423 158 2HD2 LEU 17 HD2 LEU 17 6.751 5.138 -0.241 159 3HD2 LEU 17 HD2 LEU 17 5.101 5.108 0.388 160 H ILE 18 HN ILE 18 7.903 3.093 4.536 161 HA ILE 18 HA ILE 18 5.689 4.618 5.197 162 HB ILE 18 HB ILE 18 7.486 3.152 7.159 163 1HG1 ILE 18 2HG1 ILE 18 4.925 2.200 5.871 164 2HG1 ILE 18 1HG1 ILE 18 6.505 1.813 5.208 165 1HG2 ILE 18 1HG2 ILE 18 4.631 4.111 7.314 166 2HG2 ILE 18 3HG2 ILE 18 5.397 3.091 8.541 167 3HG2 ILE 18 2HG2 ILE 18 5.986 4.739 8.245 168 1HD1 ILE 18 HD1 ILE 18 5.487 1.060 7.936 169 2HD1 ILE 18 HD1 ILE 18 5.647 -0.006 6.530 170 3HD1 ILE 18 HD1 ILE 18 7.082 0.688 7.283 171 H GLN 19 HN GLN 19 9.054 4.987 6.148 172 HA GLN 19 HA GLN 19 8.732 7.207 7.836 173 1HB GLN 19 HB2 GLN 19 11.076 6.292 6.175 174 2HB GLN 19 HB1 GLN 19 11.160 7.621 7.326 175 1HG GLN 19 HG2 GLN 19 10.670 6.162 9.155 176 2HG GLN 19 HG1 GLN 19 10.314 4.833 8.062 177 1HE2 GLN 19 1HE2 GLN 19 13.036 6.973 7.571 178 2HE2 GLN 19 2HE2 GLN 19 14.237 5.797 7.940 179 H LEU 20 HN LEU 20 9.183 6.984 4.348 180 HA LEU 20 HA LEU 20 9.401 9.774 3.916 181 1HB LEU 20 HB2 LEU 20 8.639 7.569 2.008 182 2HB LEU 20 HB1 LEU 20 8.926 9.230 1.534 183 HG LEU 20 HG LEU 20 10.981 7.383 2.751 184 1HD1 LEU 20 HD1 LEU 20 10.652 8.399 -0.061 185 2HD1 LEU 20 HD1 LEU 20 12.006 7.443 0.542 186 3HD1 LEU 20 HD1 LEU 20 10.386 6.746 0.492 187 1HD2 LEU 20 HD2 LEU 20 11.220 10.198 1.689 188 2HD2 LEU 20 HD2 LEU 20 11.434 9.683 3.366 189 3HD2 LEU 20 HD2 LEU 20 12.569 9.156 2.129 190 H VAL 21 HN VAL 21 6.610 7.534 3.487 191 HA VAL 21 HA VAL 21 4.907 9.691 2.932 192 HB VAL 21 HB VAL 21 4.308 7.469 2.170 193 1HG1 VAL 21 1HG1 VAL 21 4.083 6.642 4.995 194 2HG1 VAL 21 3HG1 VAL 21 3.469 5.758 3.583 195 3HG1 VAL 21 2HG1 VAL 21 5.186 6.082 3.696 196 1HG2 VAL 21 1HG2 VAL 21 2.463 8.983 2.449 197 2HG2 VAL 21 3HG2 VAL 21 1.961 7.330 2.810 198 3HG2 VAL 21 2HG2 VAL 21 2.262 8.462 4.128 199 H ALA 22 HN ALA 22 5.867 8.283 5.957 200 HA ALA 22 HA ALA 22 4.024 9.499 7.642 201 1HB ALA 22 HB3 ALA 22 6.942 8.969 8.187 202 2HB ALA 22 HB2 ALA 22 5.695 9.267 9.412 203 3HB ALA 22 HB1 ALA 22 5.622 7.821 8.416 204 H ARG 23 HN ARG 23 7.200 10.675 6.569 205 HA ARG 23 HA ARG 23 6.937 13.160 7.850 206 1HB ARG 23 HB2 ARG 23 8.953 13.876 6.671 207 2HB ARG 23 HB1 ARG 23 9.145 12.294 7.407 208 1HG ARG 23 HG2 ARG 23 8.686 11.301 5.171 209 2HG ARG 23 HG1 ARG 23 8.730 12.936 4.510 210 1HD ARG 23 HD2 ARG 23 10.884 11.823 4.244 211 2HD ARG 23 HD1 ARG 23 11.017 13.203 5.336 212 HE ARG 23 HE ARG 23 10.589 11.193 7.049 213 1HH1 ARG 23 1HH1 ARG 23 12.883 11.440 4.357 214 2HH1 ARG 23 2HH1 ARG 23 14.050 10.455 5.098 215 1HH2 ARG 23 1HH2 ARG 23 12.183 9.858 8.057 216 2HH2 ARG 23 2HH2 ARG 23 13.644 9.532 7.247 217 H HIS 24 HN HIS 24 5.643 12.087 4.944 218 HA HIS 24 HA HIS 24 5.259 14.435 3.492 219 1HB HIS 24 HB2 HIS 24 4.525 12.337 2.571 220 2HB HIS 24 HB1 HIS 24 3.403 12.047 3.876 221 HD1 HIS 24 HD1 HIS 24 1.094 13.542 3.760 222 HD2 HIS 24 HD2 HIS 24 3.630 13.829 0.483 223 HE1 HIS 24 HE1 HIS 24 -0.221 14.656 1.957 224 H GLY 25 HN GLY 25 3.568 13.260 6.350 225 1HA GLY 25 HA1 GLY 25 1.617 15.393 6.179 226 2HA GLY 25 HA2 GLY 25 2.819 15.593 7.448 227 H LEU 26 HN LEU 26 2.159 12.297 6.881 228 HA LEU 26 HA LEU 26 -0.091 11.831 8.287 229 1HB LEU 26 HB2 LEU 26 2.371 10.364 7.699 230 2HB LEU 26 HB1 LEU 26 1.290 9.676 8.896 231 HG LEU 26 HG LEU 26 -0.488 9.798 7.166 232 1HD1 LEU 26 HD1 LEU 26 0.402 11.431 5.703 233 2HD1 LEU 26 HD1 LEU 26 1.732 10.348 5.243 234 3HD1 LEU 26 HD1 LEU 26 0.057 9.915 4.864 235 1HD2 LEU 26 HD2 LEU 26 1.909 8.068 6.645 236 2HD2 LEU 26 HD2 LEU 26 0.530 7.719 7.691 237 3HD2 LEU 26 HD2 LEU 26 0.316 7.785 5.942 238 H ASP 27 HN ASP 27 -0.570 11.398 10.255 239 HA ASP 27 HA ASP 27 0.932 12.543 12.442 240 1HB ASP 27 HB2 ASP 27 -1.462 10.695 12.677 241 2HB ASP 27 HB1 ASP 27 -0.899 11.888 13.829 242 H HIS 28 HN HIS 28 1.639 11.165 14.276 243 HA HIS 28 HA HIS 28 2.937 8.843 13.371 244 1HB HIS 28 HB2 HIS 28 2.535 9.868 16.176 245 2HB HIS 28 HB1 HIS 28 3.456 8.409 15.818 246 HD1 HIS 28 HD1 HIS 28 4.187 11.707 16.627 247 HD2 HIS 28 HD2 HIS 28 5.373 9.246 13.508 248 HE1 HIS 28 HE1 HIS 28 6.335 12.688 15.743 249 H ASP 29 HN ASP 29 -0.160 9.280 14.789 250 HA ASP 29 HA ASP 29 -0.761 6.559 15.334 251 1HB ASP 29 HB2 ASP 29 -2.194 8.153 16.324 252 2HB ASP 29 HB1 ASP 29 -2.393 9.025 14.814 253 H LYS 30 HN LYS 30 -1.077 8.629 12.521 254 HA LYS 30 HA LYS 30 -2.424 6.862 10.798 255 1HB LYS 30 HB2 LYS 30 -0.431 9.025 10.173 256 2HB LYS 30 HB1 LYS 30 -1.316 8.152 8.946 257 1HG LYS 30 HG2 LYS 30 -2.514 9.898 11.083 258 2HG LYS 30 HG1 LYS 30 -2.237 10.347 9.403 259 1HD LYS 30 HD2 LYS 30 -3.755 8.524 8.721 260 2HD LYS 30 HD1 LYS 30 -4.098 8.210 10.423 261 1HE LYS 30 HE2 LYS 30 -4.635 10.777 8.919 262 2HE LYS 30 HE1 LYS 30 -5.842 9.615 9.456 263 1HZ LYS 30 HZ2 LYS 30 -5.189 10.118 11.760 264 2HZ LYS 30 HZ1 LYS 30 -4.110 11.295 11.211 265 3HZ LYS 30 HZ3 LYS 30 -5.767 11.466 10.953 266 H VAL 31 HN VAL 31 0.967 7.288 11.604 267 HA VAL 31 HA VAL 31 2.035 5.640 9.582 268 HB VAL 31 HB VAL 31 3.236 6.347 12.288 269 1HG1 VAL 31 2HG1 VAL 31 4.368 4.452 11.276 270 2HG1 VAL 31 1HG1 VAL 31 4.582 5.363 9.785 271 3HG1 VAL 31 3HG1 VAL 31 5.399 5.885 11.258 272 1HG2 VAL 31 2HG2 VAL 31 2.657 8.321 11.004 273 2HG2 VAL 31 1HG2 VAL 31 4.410 8.120 11.094 274 3HG2 VAL 31 3HG2 VAL 31 3.544 7.692 9.617 275 H LEU 32 HN LEU 32 0.936 5.042 12.852 276 HA LEU 32 HA LEU 32 1.711 2.306 13.073 277 1HB LEU 32 HB2 LEU 32 -0.520 3.837 14.379 278 2HB LEU 32 HB1 LEU 32 0.016 2.236 14.850 279 HG LEU 32 HG LEU 32 1.702 4.730 14.988 280 1HD1 LEU 32 HD1 LEU 32 0.301 3.172 17.133 281 2HD1 LEU 32 HD1 LEU 32 1.423 4.514 17.395 282 3HD1 LEU 32 HD1 LEU 32 -0.107 4.796 16.559 283 1HD2 LEU 32 HD2 LEU 32 2.202 1.918 15.957 284 2HD2 LEU 32 HD2 LEU 32 3.028 2.738 14.630 285 3HD2 LEU 32 HD2 LEU 32 3.227 3.316 16.281 286 H LEU 33 HN LEU 33 -1.281 3.840 12.094 287 HA LEU 33 HA LEU 33 -2.696 1.444 11.596 288 1HB LEU 33 HB2 LEU 33 -3.103 4.116 10.288 289 2HB LEU 33 HB1 LEU 33 -4.263 2.811 10.435 290 HG LEU 33 HG LEU 33 -3.151 4.430 12.719 291 1HD1 LEU 33 HD1 LEU 33 -4.593 5.750 11.316 292 2HD1 LEU 33 HD1 LEU 33 -5.857 4.518 11.408 293 3HD1 LEU 33 HD1 LEU 33 -5.365 5.405 12.856 294 1HD2 LEU 33 HD2 LEU 33 -5.301 2.320 12.656 295 2HD2 LEU 33 HD2 LEU 33 -3.708 2.165 13.392 296 3HD2 LEU 33 HD2 LEU 33 -4.871 3.308 14.056 297 H PHE 34 HN PHE 34 -0.903 3.630 9.524 298 HA PHE 34 HA PHE 34 -1.419 2.363 7.105 299 1HB PHE 34 HB2 PHE 34 -0.556 4.627 7.196 300 2HB PHE 34 HB1 PHE 34 0.930 4.062 7.948 301 HD1 PHE 34 HD1 PHE 34 -1.093 3.703 4.852 302 HD2 PHE 34 HD2 PHE 34 2.756 3.573 6.643 303 HE1 PHE 34 HE1 PHE 34 -0.077 3.436 2.643 304 HE2 PHE 34 HE2 PHE 34 3.781 3.307 4.405 305 HZ PHE 34 HZ PHE 34 2.395 3.239 2.446 306 H SER 35 HN SER 35 1.370 2.022 9.309 307 HA SER 35 HA SER 35 2.748 0.259 7.634 308 1HB SER 35 HB2 SER 35 4.121 -0.236 9.666 309 2HB SER 35 HB1 SER 35 3.939 1.480 9.313 310 HG SER 35 HG SER 35 2.672 1.743 10.984 311 H ARG 36 HN ARG 36 0.379 -0.357 10.172 312 HA ARG 36 HA ARG 36 0.898 -3.160 10.205 313 1HB ARG 36 HB2 ARG 36 -1.072 -3.367 11.640 314 2HB ARG 36 HB1 ARG 36 -0.043 -2.055 12.182 315 1HG ARG 36 HG2 ARG 36 -1.587 -0.479 10.993 316 2HG ARG 36 HG1 ARG 36 -2.660 -1.849 10.712 317 1HD ARG 36 HD2 ARG 36 -1.750 -0.799 13.383 318 2HD ARG 36 HD1 ARG 36 -3.331 -0.547 12.647 319 HE ARG 36 HE ARG 36 -2.947 -3.287 12.742 320 1HH1 ARG 36 1HH1 ARG 36 -3.325 -0.663 15.121 321 2HH1 ARG 36 2HH1 ARG 36 -3.995 -1.672 16.306 322 1HH2 ARG 36 1HH2 ARG 36 -3.926 -4.646 14.406 323 2HH2 ARG 36 2HH2 ARG 36 -4.343 -3.941 15.900 324 H ASP 37 HN ASP 37 -1.492 -1.124 8.575 325 HA ASP 37 HA ASP 37 -2.999 -3.292 7.503 326 1HB ASP 37 HB2 ASP 37 -3.664 -0.794 7.761 327 2HB ASP 37 HB1 ASP 37 -2.786 -0.548 6.259 328 H LEU 38 HN LEU 38 -0.468 -1.183 6.287 329 HA LEU 38 HA LEU 38 -0.118 -2.060 3.686 330 1HB LEU 38 HB2 LEU 38 0.949 -0.096 4.484 331 2HB LEU 38 HB1 LEU 38 1.772 -0.972 5.747 332 HG LEU 38 HG LEU 38 3.212 -2.039 4.053 333 1HD1 LEU 38 HD1 LEU 38 1.798 -0.224 2.128 334 2HD1 LEU 38 HD1 LEU 38 3.234 -1.198 1.809 335 3HD1 LEU 38 HD1 LEU 38 1.697 -1.991 2.169 336 1HD2 LEU 38 HD2 LEU 38 3.097 0.956 3.944 337 2HD2 LEU 38 HD2 LEU 38 3.928 -0.015 5.156 338 3HD2 LEU 38 HD2 LEU 38 4.481 -0.029 3.480 339 H ASP 39 HN ASP 39 1.469 -3.187 6.622 340 HA ASP 39 HA ASP 39 3.257 -5.023 5.553 341 1HB ASP 39 HB2 ASP 39 3.193 -4.200 7.896 342 2HB ASP 39 HB1 ASP 39 1.794 -5.218 8.170 343 H LYS 40 HN LYS 40 -0.021 -5.514 6.716 344 HA LYS 40 HA LYS 40 -0.111 -8.290 6.193 345 1HB LYS 40 HB2 LYS 40 -2.321 -6.290 6.563 346 2HB LYS 40 HB1 LYS 40 -2.544 -8.033 6.454 347 1HG LYS 40 HG2 LYS 40 -1.230 -8.364 8.462 348 2HG LYS 40 HG1 LYS 40 -0.870 -6.639 8.538 349 1HD LYS 40 HD2 LYS 40 -2.630 -7.224 10.117 350 2HD LYS 40 HD1 LYS 40 -3.252 -6.165 8.857 351 1HE LYS 40 HE2 LYS 40 -4.820 -7.939 9.349 352 2HE LYS 40 HE1 LYS 40 -4.220 -8.108 7.704 353 1HZ LYS 40 HZ3 LYS 40 -2.691 -9.850 8.543 354 2HZ LYS 40 HZ2 LYS 40 -3.331 -9.652 10.075 355 3HZ LYS 40 HZ1 LYS 40 -4.314 -10.225 8.839 356 H LEU 41 HN LEU 41 -0.931 -5.477 4.273 357 HA LEU 41 HA LEU 41 -2.324 -6.836 2.218 358 1HB LEU 41 HB2 LEU 41 -2.566 -4.445 2.473 359 2HB LEU 41 HB1 LEU 41 -0.850 -4.204 2.258 360 HG LEU 41 HG LEU 41 -1.038 -4.890 -0.092 361 1HD1 LEU 41 HD1 LEU 41 -3.994 -5.081 0.462 362 2HD1 LEU 41 HD1 LEU 41 -3.237 -5.129 -1.132 363 3HD1 LEU 41 HD1 LEU 41 -2.905 -6.404 0.034 364 1HD2 LEU 41 HD2 LEU 41 -2.948 -2.703 0.714 365 2HD2 LEU 41 HD2 LEU 41 -1.208 -2.538 0.478 366 3HD2 LEU 41 HD2 LEU 41 -2.254 -2.920 -0.891 367 H ILE 42 HN ILE 42 1.004 -5.989 2.726 368 HA ILE 42 HA ILE 42 1.976 -6.810 0.191 369 HB ILE 42 HB ILE 42 3.433 -6.577 2.836 370 1HG1 ILE 42 2HG1 ILE 42 3.196 -4.698 0.492 371 2HG1 ILE 42 1HG1 ILE 42 2.441 -4.492 2.064 372 1HG2 ILE 42 3HG2 ILE 42 4.532 -6.841 0.035 373 2HG2 ILE 42 2HG2 ILE 42 5.495 -6.489 1.469 374 3HG2 ILE 42 1HG2 ILE 42 4.665 -8.038 1.320 375 1HD1 ILE 42 HD1 ILE 42 5.389 -4.531 1.526 376 2HD1 ILE 42 HD1 ILE 42 4.401 -3.093 1.810 377 3HD1 ILE 42 HD1 ILE 42 4.608 -4.284 3.090 378 H ASN 43 HN ASN 43 2.146 -8.358 3.344 379 HA ASN 43 HA ASN 43 3.247 -10.764 2.500 380 1HB ASN 43 HB2 ASN 43 1.569 -10.098 4.897 381 2HB ASN 43 HB1 ASN 43 2.274 -11.688 4.665 382 1HD2 ASN 43 HD2 ASN 43 2.788 -9.704 6.752 383 2HD2 ASN 43 HD2 ASN 43 4.472 -9.366 6.703 384 H LYS 44 HN LYS 44 -0.064 -9.723 2.540 385 HA LYS 44 HA LYS 44 -1.456 -12.109 2.124 386 1HB LYS 44 HB2 LYS 44 -2.497 -9.937 2.496 387 2HB LYS 44 HB1 LYS 44 -1.941 -9.372 0.932 388 1HG LYS 44 HG2 LYS 44 -3.292 -11.288 -0.079 389 2HG LYS 44 HG1 LYS 44 -4.041 -11.447 1.509 390 1HD LYS 44 HD2 LYS 44 -4.055 -8.959 -0.217 391 2HD LYS 44 HD1 LYS 44 -5.400 -10.074 -0.011 392 1HE LYS 44 HE2 LYS 44 -5.429 -9.543 2.385 393 2HE LYS 44 HE1 LYS 44 -4.137 -8.373 2.136 394 1HZ LYS 44 HZ1 LYS 44 -6.841 -8.230 0.881 395 2HZ LYS 44 HZ3 LYS 44 -6.318 -7.292 2.168 396 3HZ LYS 44 HZ2 LYS 44 -5.620 -7.122 0.652 397 H PHE 45 HN PHE 45 -0.016 -9.863 -0.209 398 HA PHE 45 HA PHE 45 -0.634 -11.495 -2.437 399 1HB PHE 45 HB2 PHE 45 0.696 -8.900 -2.043 400 2HB PHE 45 HB1 PHE 45 1.153 -9.807 -3.481 401 HD1 PHE 45 HD1 PHE 45 -1.758 -8.379 -1.665 402 HD2 PHE 45 HD2 PHE 45 -0.216 -9.974 -5.312 403 HE1 PHE 45 HE1 PHE 45 -3.794 -7.681 -2.831 404 HE2 PHE 45 HE2 PHE 45 -2.263 -9.282 -6.477 405 HZ PHE 45 HZ PHE 45 -4.053 -8.139 -5.242 406 H MET 46 HN MET 46 2.126 -11.033 -0.431 407 HA MET 46 HA MET 46 4.098 -12.372 -1.994 408 1HB MET 46 HB2 MET 46 3.889 -12.254 1.000 409 2HB MET 46 HB1 MET 46 5.316 -12.663 0.055 410 1HG MET 46 HG2 MET 46 5.129 -10.302 -0.920 411 2HG MET 46 HG1 MET 46 3.938 -10.020 0.328 412 1HE MET 46 HE2 MET 46 7.532 -10.891 -0.491 413 2HE MET 46 HE1 MET 46 8.329 -11.046 1.073 414 3HE MET 46 HE3 MET 46 7.144 -12.250 0.565 415 H ASN 47 HN ASN 47 1.442 -13.497 -0.115 416 HA ASN 47 HA ASN 47 0.470 -15.504 0.135 417 1HB ASN 47 HB2 ASN 47 1.271 -16.064 -2.166 418 2HB ASN 47 HB1 ASN 47 2.764 -16.684 -1.489 419 1HD2 ASN 47 HD2 ASN 47 -0.571 -17.175 -0.312 420 2HD2 ASN 47 HD2 ASN 47 -0.560 -18.871 -0.527 421 H VAL 48 HN VAL 48 2.912 -14.379 1.586 422 HA VAL 48 HA VAL 48 3.256 -16.709 3.285 423 HB VAL 48 HB VAL 48 5.347 -15.693 4.167 424 1HG1 VAL 48 2HG1 VAL 48 5.354 -16.231 1.211 425 2HG1 VAL 48 1HG1 VAL 48 6.783 -16.249 2.252 426 3HG1 VAL 48 3HG1 VAL 48 5.488 -17.419 2.509 427 1HG2 VAL 48 2HG2 VAL 48 4.964 -13.357 3.560 428 2HG2 VAL 48 1HG2 VAL 48 6.508 -13.925 2.910 429 3HG2 VAL 48 3HG2 VAL 48 5.102 -13.777 1.853 430 H LYS 49 HN LYS 49 2.254 -16.612 5.040 431 HA LYS 49 HA LYS 49 1.473 -13.979 6.021 432 1HB LYS 49 HB2 LYS 49 0.009 -16.623 6.152 433 2HB LYS 49 HB1 LYS 49 -0.534 -15.155 6.968 434 1HG LYS 49 HG2 LYS 49 -0.835 -13.995 4.931 435 2HG LYS 49 HG1 LYS 49 0.028 -15.225 4.022 436 1HD LYS 49 HD2 LYS 49 -1.829 -16.791 4.446 437 2HD LYS 49 HD1 LYS 49 -2.687 -15.507 5.312 438 1HE LYS 49 HE2 LYS 49 -2.787 -14.147 3.339 439 2HE LYS 49 HE1 LYS 49 -1.735 -15.256 2.467 440 1HZ LYS 49 HZ2 LYS 49 -3.466 -16.917 2.587 441 2HZ LYS 49 HZ1 LYS 49 -4.496 -15.854 3.398 442 3HZ LYS 49 HZ3 LYS 49 -4.009 -15.537 1.807 443 H ASP 50 HN ASP 50 3.822 -15.505 6.438 444 HA ASP 50 HA ASP 50 4.018 -15.256 9.324 445 1HB ASP 50 HB2 ASP 50 5.215 -17.517 7.655 446 2HB ASP 50 HB1 ASP 50 5.663 -17.166 9.313 447 H LYS 51 HN LYS 51 6.297 -14.642 9.797 448 HA LYS 51 HA LYS 51 7.346 -13.214 7.475 449 1HB LYS 51 HB2 LYS 51 8.663 -11.875 8.999 450 2HB LYS 51 HB1 LYS 51 6.977 -11.900 9.501 451 1HG LYS 51 HG2 LYS 51 7.520 -13.563 11.220 452 2HG LYS 51 HG1 LYS 51 9.211 -13.511 10.718 453 1HD LYS 51 HD2 LYS 51 7.620 -11.190 11.808 454 2HD LYS 51 HD1 LYS 51 8.805 -12.146 12.699 455 1HE LYS 51 HE2 LYS 51 10.557 -11.412 11.122 456 2HE LYS 51 HE1 LYS 51 9.363 -10.434 10.269 457 1HZ LYS 51 HZ3 LYS 51 9.015 -9.188 12.345 458 2HZ LYS 51 HZ2 LYS 51 10.239 -10.102 13.069 459 3HZ LYS 51 HZ1 LYS 51 10.618 -9.084 11.791 460 H VAL 52 HN VAL 52 7.737 -16.075 8.453 461 HA VAL 52 HA VAL 52 10.569 -16.167 7.814 462 HB VAL 52 HB VAL 52 10.783 -18.160 9.320 463 1HG1 VAL 52 2HG1 VAL 52 11.641 -15.978 10.025 464 2HG1 VAL 52 1HG1 VAL 52 10.066 -15.559 10.688 465 3HG1 VAL 52 3HG1 VAL 52 11.005 -16.864 11.413 466 1HG2 VAL 52 3HG2 VAL 52 8.439 -18.735 9.568 467 2HG2 VAL 52 2HG2 VAL 52 9.158 -18.441 11.149 468 3HG2 VAL 52 1HG2 VAL 52 8.131 -17.215 10.404 469 H HIS 53 HN HIS 53 11.211 -18.314 6.981 470 HA HIS 53 HA HIS 53 9.396 -19.082 4.937 471 1HB HIS 53 HB2 HIS 53 11.865 -19.031 4.593 472 2HB HIS 53 HB1 HIS 53 12.034 -20.367 5.720 473 HD1 HIS 53 HD1 HIS 53 12.888 -22.177 4.133 474 HD2 HIS 53 HD2 HIS 53 9.509 -20.236 2.704 475 HE1 HIS 53 HE1 HIS 53 12.127 -23.472 2.110 476 H LYS 54 HN LYS 54 9.936 -20.136 8.049 477 HA LYS 54 HA LYS 54 8.863 -21.563 9.421 478 1HB LYS 54 HB2 LYS 54 7.049 -22.046 7.060 479 2HB LYS 54 HB1 LYS 54 6.779 -22.732 8.653 480 1HG LYS 54 HG2 LYS 54 7.050 -19.799 8.173 481 2HG LYS 54 HG1 LYS 54 5.489 -20.626 8.072 482 1HD LYS 54 HD2 LYS 54 7.295 -20.654 10.504 483 2HD LYS 54 HD1 LYS 54 5.963 -19.522 10.275 484 1HE LYS 54 HE2 LYS 54 5.716 -22.534 10.381 485 2HE LYS 54 HE1 LYS 54 5.307 -21.417 11.673 486 1HZ LYS 54 HZ3 LYS 54 3.646 -20.404 10.212 487 2HZ LYS 54 HZ2 LYS 54 3.982 -21.551 9.012 488 3HZ LYS 54 HZ1 LYS 54 3.341 -22.049 10.483 489 H LEU 55 HN LEU 55 10.750 -22.645 9.454 490 HA LEU 55 HA LEU 55 10.835 -25.147 7.955 491 1HB LEU 55 HB2 LEU 55 12.845 -23.975 9.881 492 2HB LEU 55 HB1 LEU 55 13.059 -25.466 8.990 493 HG LEU 55 HG LEU 55 12.884 -22.694 7.807 494 1HD1 LEU 55 HD1 LEU 55 14.971 -23.138 8.949 495 2HD1 LEU 55 HD1 LEU 55 15.166 -24.631 8.031 496 3HD1 LEU 55 HD1 LEU 55 15.213 -23.075 7.200 497 1HD2 LEU 55 HD2 LEU 55 13.288 -25.365 6.450 498 2HD2 LEU 55 HD2 LEU 55 11.879 -24.313 6.284 499 3HD2 LEU 55 HD2 LEU 55 13.449 -23.792 5.676 500 H GLU 56 HN GLU 56 9.804 -26.773 8.736 501 HA GLU 56 HA GLU 56 8.757 -26.956 11.357 502 1HB GLU 56 HB2 GLU 56 7.704 -28.052 9.478 503 2HB GLU 56 HB1 GLU 56 9.139 -29.015 9.188 504 1HG GLU 56 HG2 GLU 56 8.786 -30.086 11.403 505 2HG GLU 56 HG1 GLU 56 7.255 -29.214 11.517 506 H HIS 57 HN HIS 57 11.429 -28.586 9.726 507 HA HIS 57 HA HIS 57 12.665 -29.102 12.307 508 1HB HIS 57 HB2 HIS 57 12.320 -31.120 10.077 509 2HB HIS 57 HB1 HIS 57 13.501 -31.310 11.365 510 HD1 HIS 57 HD1 HIS 57 10.101 -32.231 10.530 511 HD2 HIS 57 HD2 HIS 57 12.171 -31.279 14.008 512 HE1 HIS 57 HE1 HIS 57 8.746 -33.159 12.425 513 H HIS 58 HN HIS 58 14.430 -27.958 12.273 514 HA HIS 58 HA HIS 58 15.882 -27.883 9.775 515 1HB HIS 58 HB2 HIS 58 17.000 -25.765 10.662 516 2HB HIS 58 HB1 HIS 58 15.317 -25.614 10.201 517 HD1 HIS 58 HD1 HIS 58 17.597 -25.459 13.204 518 HD2 HIS 58 HD2 HIS 58 13.566 -25.022 12.266 519 HE1 HIS 58 HE1 HIS 58 16.513 -24.421 15.214 520 H HIS 59 HN HIS 59 17.347 -29.187 9.717 521 HA HIS 59 HA HIS 59 19.155 -29.569 11.999 522 1HB HIS 59 HB2 HIS 59 19.412 -31.955 11.308 523 2HB HIS 59 HB1 HIS 59 17.751 -31.593 11.739 524 HD1 HIS 59 HD1 HIS 59 19.054 -33.882 9.693 525 HD2 HIS 59 HD2 HIS 59 16.727 -30.559 8.771 526 HE1 HIS 59 HE1 HIS 59 17.971 -34.365 7.483 527 H HIS 60 HN HIS 60 19.117 -27.757 9.924 528 HA HIS 60 HA HIS 60 21.660 -28.146 8.600 529 1HB HIS 60 HB2 HIS 60 19.985 -28.904 6.943 530 2HB HIS 60 HB1 HIS 60 19.006 -27.485 7.248 531 HD1 HIS 60 HD1 HIS 60 22.047 -28.631 5.322 532 HD2 HIS 60 HD2 HIS 60 19.820 -25.173 5.942 533 HE1 HIS 60 HE1 HIS 60 22.760 -27.015 3.549 534 H HIS 61 HN HIS 61 22.655 -26.088 8.466 535 HA HIS 61 HA HIS 61 23.063 -23.901 8.782 536 1HB HIS 61 HB2 HIS 61 21.012 -23.321 7.549 537 2HB HIS 61 HB1 HIS 61 20.041 -23.608 8.982 538 HD1 HIS 61 HD1 HIS 61 19.490 -21.552 10.317 539 HD2 HIS 61 HD2 HIS 61 22.809 -21.029 7.860 540 HE1 HIS 61 HE1 HIS 61 20.123 -19.115 10.496 541 H HIS 62 HN HIS 62 20.471 -24.826 10.964 542 HA HIS 62 HA HIS 62 22.253 -24.494 13.210 543 1HB HIS 62 HB2 HIS 62 21.070 -22.299 13.004 544 2HB HIS 62 HB1 HIS 62 19.529 -23.146 13.043 545 HD1 HIS 62 HD1 HIS 62 18.506 -23.461 15.342 546 HD2 HIS 62 HD2 HIS 62 22.566 -22.587 15.501 547 HE1 HIS 62 HE1 HIS 62 19.063 -23.129 17.779 548 H1 MET 101 HT2 MET 101 13.423 21.133 -1.502 549 H2 MET 101 HT1 MET 101 13.258 22.027 -0.123 550 H3 MET 101 HT3 MET 101 14.361 20.729 -0.143 551 HA MET 101 HA MET 101 12.584 19.194 -0.450 552 1HB MET 101 HB2 MET 101 13.022 19.727 1.895 553 2HB MET 101 HB1 MET 101 11.962 21.125 1.794 554 1HG MET 101 HG2 MET 101 10.908 19.223 2.944 555 2HG MET 101 HG1 MET 101 10.035 19.719 1.498 556 1HE MET 101 HE3 MET 101 12.398 17.000 3.092 557 2HE MET 101 HE2 MET 101 12.667 15.912 1.734 558 3HE MET 101 HE1 MET 101 13.351 17.536 1.709 559 H GLU 102 HN GLU 102 11.260 19.107 -1.991 560 HA GLU 102 HA GLU 102 9.210 21.166 -2.277 561 1HB GLU 102 HB2 GLU 102 10.212 19.151 -4.314 562 2HB GLU 102 HB1 GLU 102 9.028 20.407 -4.597 563 1HG GLU 102 HG2 GLU 102 11.052 21.045 -5.614 564 2HG GLU 102 HG1 GLU 102 10.822 22.107 -4.225 565 H MET 103 HN MET 103 7.125 20.441 -2.045 566 HA MET 103 HA MET 103 6.819 17.917 -0.811 567 1HB MET 103 HB2 MET 103 4.400 18.342 -0.741 568 2HB MET 103 HB1 MET 103 5.330 19.714 -0.173 569 1HG MET 103 HG2 MET 103 4.953 20.855 -2.299 570 2HG MET 103 HG1 MET 103 4.032 19.467 -2.883 571 1HE MET 103 HE3 MET 103 4.200 22.378 -0.262 572 2HE MET 103 HE2 MET 103 2.696 22.164 0.633 573 3HE MET 103 HE1 MET 103 3.993 20.981 0.793 574 H GLY 104 HN GLY 104 6.418 18.953 -4.102 575 1HA GLY 104 HA1 GLY 104 5.942 17.764 -6.007 576 2HA GLY 104 HA2 GLY 104 5.074 16.620 -4.990 577 H GLN 105 HN GLN 105 8.462 17.532 -4.668 578 HA GLN 105 HA GLN 105 9.355 15.104 -5.874 579 1HB GLN 105 HB2 GLN 105 10.931 17.155 -4.319 580 2HB GLN 105 HB1 GLN 105 11.639 15.731 -5.057 581 1HG GLN 105 HG2 GLN 105 10.370 18.085 -6.427 582 2HG GLN 105 HG1 GLN 105 12.033 17.515 -6.544 583 1HE2 GLN 105 1HE2 GLN 105 8.822 17.124 -7.610 584 2HE2 GLN 105 2HE2 GLN 105 9.087 15.968 -8.860 585 H LEU 106 HN LEU 106 8.768 16.181 -2.637 586 HA LEU 106 HA LEU 106 9.808 13.973 -1.255 587 1HB LEU 106 HB2 LEU 106 9.109 16.022 -0.118 588 2HB LEU 106 HB1 LEU 106 7.476 15.829 -0.693 589 HG LEU 106 HG LEU 106 7.884 15.416 1.773 590 1HD1 LEU 106 HD1 LEU 106 6.574 13.217 0.195 591 2HD1 LEU 106 HD1 LEU 106 6.356 13.501 1.917 592 3HD1 LEU 106 HD1 LEU 106 5.824 14.707 0.742 593 1HD2 LEU 106 HD2 LEU 106 9.137 12.882 0.724 594 2HD2 LEU 106 HD2 LEU 106 9.957 14.157 1.626 595 3HD2 LEU 106 HD2 LEU 106 8.709 13.180 2.408 596 H LYS 107 HN LYS 107 6.666 14.614 -2.649 597 HA LYS 107 HA LYS 107 5.385 12.184 -2.080 598 1HB LYS 107 HB2 LYS 107 4.690 14.578 -3.092 599 2HB LYS 107 HB1 LYS 107 4.783 13.669 -4.584 600 1HG LYS 107 HG2 LYS 107 3.105 12.886 -2.223 601 2HG LYS 107 HG1 LYS 107 2.518 13.875 -3.539 602 1HD LYS 107 HD2 LYS 107 3.507 11.018 -3.728 603 2HD LYS 107 HD1 LYS 107 1.826 11.550 -3.789 604 1HE LYS 107 HE2 LYS 107 2.462 12.892 -5.838 605 2HE LYS 107 HE1 LYS 107 4.006 12.041 -5.812 606 1HZ LYS 107 HZ1 LYS 107 2.655 9.924 -5.898 607 2HZ LYS 107 HZ3 LYS 107 1.310 10.908 -6.181 608 3HZ LYS 107 HZ2 LYS 107 2.564 10.896 -7.285 609 H ASN 108 HN ASN 108 7.457 13.272 -4.665 610 HA ASN 108 HA ASN 108 7.246 11.076 -6.428 611 1HB ASN 108 HB2 ASN 108 8.176 13.299 -7.062 612 2HB ASN 108 HB1 ASN 108 9.548 12.996 -6.013 613 1HD2 ASN 108 HD2 ASN 108 10.908 13.341 -7.831 614 2HD2 ASN 108 HD2 ASN 108 11.100 12.108 -9.019 615 H LYS 109 HN LYS 109 9.419 11.764 -3.711 616 HA LYS 109 HA LYS 109 11.044 9.453 -3.965 617 1HB LYS 109 HB2 LYS 109 10.384 11.084 -1.501 618 2HB LYS 109 HB1 LYS 109 11.629 9.850 -1.570 619 1HG LYS 109 HG2 LYS 109 11.590 12.403 -3.172 620 2HG LYS 109 HG1 LYS 109 12.552 12.108 -1.724 621 1HD LYS 109 HD2 LYS 109 13.687 10.251 -2.908 622 2HD LYS 109 HD1 LYS 109 12.768 10.645 -4.358 623 1HE LYS 109 HE2 LYS 109 14.987 11.613 -4.477 624 2HE LYS 109 HE1 LYS 109 13.768 12.878 -4.386 625 1HZ LYS 109 HZ3 LYS 109 15.349 11.910 -2.059 626 2HZ LYS 109 HZ2 LYS 109 15.737 13.269 -2.948 627 3HZ LYS 109 HZ1 LYS 109 14.292 13.219 -2.074 628 H ILE 110 HN ILE 110 8.067 10.108 -2.263 629 HA ILE 110 HA ILE 110 7.741 7.673 -0.895 630 HB ILE 110 HB ILE 110 5.724 9.636 -2.004 631 1HG1 ILE 110 2HG1 ILE 110 6.795 9.156 0.776 632 2HG1 ILE 110 1HG1 ILE 110 7.275 10.464 -0.294 633 1HG2 ILE 110 2HG2 ILE 110 5.219 7.327 -0.116 634 2HG2 ILE 110 1HG2 ILE 110 4.052 8.582 -0.540 635 3HG2 ILE 110 3HG2 ILE 110 4.634 7.463 -1.775 636 1HD1 ILE 110 HD1 ILE 110 4.997 11.342 -0.188 637 2HD1 ILE 110 HD1 ILE 110 4.564 10.023 0.901 638 3HD1 ILE 110 HD1 ILE 110 5.766 11.223 1.393 639 H GLU 111 HN GLU 111 6.621 8.678 -4.108 640 HA GLU 111 HA GLU 111 5.514 6.231 -4.974 641 1HB GLU 111 HB2 GLU 111 7.005 8.276 -6.621 642 2HB GLU 111 HB1 GLU 111 5.953 7.011 -7.227 643 1HG GLU 111 HG2 GLU 111 5.088 9.299 -5.496 644 2HG GLU 111 HG1 GLU 111 4.908 9.213 -7.245 645 H ASN 112 HN ASN 112 8.687 7.578 -5.342 646 HA ASN 112 HA ASN 112 9.986 5.706 -6.831 647 1HB ASN 112 HB2 ASN 112 10.850 7.927 -6.149 648 2HB ASN 112 HB1 ASN 112 11.120 7.294 -4.533 649 1HD2 ASN 112 HD2 ASN 112 12.235 7.481 -7.728 650 2HD2 ASN 112 HD2 ASN 112 13.740 6.677 -7.502 651 H LYS 113 HN LYS 113 9.836 5.877 -3.309 652 HA LYS 113 HA LYS 113 11.389 3.543 -2.848 653 1HB LYS 113 HB2 LYS 113 11.032 5.564 -1.329 654 2HB LYS 113 HB1 LYS 113 9.480 4.854 -0.936 655 1HG LYS 113 HG2 LYS 113 11.106 4.341 0.767 656 2HG LYS 113 HG1 LYS 113 10.586 2.875 -0.064 657 1HD LYS 113 HD2 LYS 113 13.011 2.910 0.340 658 2HD LYS 113 HD1 LYS 113 12.633 2.856 -1.376 659 1HE LYS 113 HE2 LYS 113 13.087 5.202 -1.578 660 2HE LYS 113 HE1 LYS 113 13.378 5.350 0.166 661 1HZ LYS 113 HZ3 LYS 113 15.241 3.806 -0.111 662 2HZ LYS 113 HZ2 LYS 113 14.942 3.781 -1.803 663 3HZ LYS 113 HZ1 LYS 113 15.448 5.198 -1.060 664 H LYS 114 HN LYS 114 7.936 4.228 -2.909 665 HA LYS 114 HA LYS 114 6.844 1.806 -2.087 666 1HB LYS 114 HB2 LYS 114 5.531 3.825 -2.504 667 2HB LYS 114 HB1 LYS 114 5.951 3.763 -4.205 668 1HG LYS 114 HG2 LYS 114 4.673 1.655 -4.399 669 2HG LYS 114 HG1 LYS 114 4.210 1.817 -2.703 670 1HD LYS 114 HD2 LYS 114 2.396 2.670 -4.077 671 2HD LYS 114 HD1 LYS 114 3.186 4.016 -3.251 672 1HE LYS 114 HE2 LYS 114 4.468 4.491 -5.304 673 2HE LYS 114 HE1 LYS 114 3.601 3.157 -6.074 674 1HZ LYS 114 HZ2 LYS 114 2.185 5.469 -4.889 675 2HZ LYS 114 HZ1 LYS 114 2.731 5.501 -6.467 676 3HZ LYS 114 HZ3 LYS 114 1.572 4.375 -5.997 677 H LYS 115 HN LYS 115 7.729 2.925 -5.271 678 HA LYS 115 HA LYS 115 7.151 0.611 -6.752 679 1HB LYS 115 HB2 LYS 115 9.092 2.846 -7.320 680 2HB LYS 115 HB1 LYS 115 8.645 1.604 -8.487 681 1HG LYS 115 HG2 LYS 115 6.391 2.360 -8.550 682 2HG LYS 115 HG1 LYS 115 6.644 3.417 -7.164 683 1HD LYS 115 HD2 LYS 115 6.597 4.757 -9.160 684 2HD LYS 115 HD1 LYS 115 8.234 4.752 -8.523 685 1HE LYS 115 HE2 LYS 115 8.315 4.527 -10.918 686 2HE LYS 115 HE1 LYS 115 8.839 3.013 -10.186 687 1HZ LYS 115 HZ2 LYS 115 6.116 3.527 -11.282 688 2HZ LYS 115 HZ1 LYS 115 7.312 2.670 -12.068 689 3HZ LYS 115 HZ3 LYS 115 6.632 2.077 -10.653 690 H GLU 116 HN GLU 116 10.140 1.636 -5.169 691 HA GLU 116 HA GLU 116 11.803 -0.444 -6.015 692 1HB GLU 116 HB2 GLU 116 11.761 1.111 -3.426 693 2HB GLU 116 HB1 GLU 116 12.959 -0.123 -3.751 694 1HG GLU 116 HG2 GLU 116 13.579 1.236 -5.778 695 2HG GLU 116 HG1 GLU 116 12.536 2.501 -5.112 696 H LEU 117 HN LEU 117 9.509 -0.261 -3.396 697 HA LEU 117 HA LEU 117 10.069 -2.739 -2.160 698 1HB LEU 117 HB2 LEU 117 8.903 -1.082 -0.962 699 2HB LEU 117 HB1 LEU 117 7.654 -0.967 -2.197 700 HG LEU 117 HG LEU 117 7.358 -3.523 -1.570 701 1HD1 LEU 117 HD1 LEU 117 8.677 -2.557 0.798 702 2HD1 LEU 117 HD1 LEU 117 7.537 -3.943 0.695 703 3HD1 LEU 117 HD1 LEU 117 8.993 -3.923 -0.285 704 1HD2 LEU 117 HD2 LEU 117 5.703 -1.909 -1.546 705 2HD2 LEU 117 HD2 LEU 117 5.629 -2.972 -0.132 706 3HD2 LEU 117 HD2 LEU 117 6.222 -1.286 0.045 707 H ILE 118 HN ILE 118 7.693 -1.677 -4.527 708 HA ILE 118 HA ILE 118 6.202 -3.996 -4.702 709 HB ILE 118 HB ILE 118 6.762 -2.043 -6.964 710 1HG1 ILE 118 2HG1 ILE 118 4.438 -2.102 -5.030 711 2HG1 ILE 118 1HG1 ILE 118 5.833 -1.044 -4.850 712 1HG2 ILE 118 2HG2 ILE 118 5.812 -4.149 -7.752 713 2HG2 ILE 118 1HG2 ILE 118 4.513 -4.018 -6.573 714 3HG2 ILE 118 3HG2 ILE 118 4.626 -2.844 -7.889 715 1HD1 ILE 118 HD1 ILE 118 5.288 0.016 -6.976 716 2HD1 ILE 118 HD1 ILE 118 3.886 -1.036 -7.146 717 3HD1 ILE 118 HD1 ILE 118 3.961 0.135 -5.826 718 H GLN 119 HN GLN 119 9.055 -3.006 -6.508 719 HA GLN 119 HA GLN 119 9.268 -5.217 -8.214 720 1HB GLN 119 HB2 GLN 119 11.411 -3.448 -7.067 721 2HB GLN 119 HB1 GLN 119 11.648 -4.561 -8.404 722 1HG GLN 119 HG2 GLN 119 10.031 -3.324 -9.734 723 2HG GLN 119 HG1 GLN 119 9.759 -2.221 -8.383 724 1HE2 GLN 119 1HE2 GLN 119 11.913 -3.194 -10.875 725 2HE2 GLN 119 2HE2 GLN 119 13.007 -1.883 -10.737 726 H LEU 120 HN LEU 120 10.106 -4.810 -4.871 727 HA LEU 120 HA LEU 120 11.728 -7.186 -4.770 728 1HB LEU 120 HB2 LEU 120 10.618 -5.470 -2.551 729 2HB LEU 120 HB1 LEU 120 11.720 -6.811 -2.321 730 HG LEU 120 HG LEU 120 12.352 -4.268 -3.820 731 1HD1 LEU 120 HD1 LEU 120 12.128 -3.914 -1.424 732 2HD1 LEU 120 HD1 LEU 120 13.260 -5.233 -1.113 733 3HD1 LEU 120 HD1 LEU 120 13.806 -3.774 -1.940 734 1HD2 LEU 120 HD2 LEU 120 14.096 -6.608 -3.069 735 2HD2 LEU 120 HD2 LEU 120 13.587 -6.175 -4.703 736 3HD2 LEU 120 HD2 LEU 120 14.659 -5.104 -3.799 737 H VAL 121 HN VAL 121 8.359 -6.362 -3.573 738 HA VAL 121 HA VAL 121 7.914 -8.958 -2.732 739 HB VAL 121 HB VAL 121 5.706 -8.300 -2.417 740 1HG1 VAL 121 1HG1 VAL 121 7.275 -5.800 -2.299 741 2HG1 VAL 121 3HG1 VAL 121 5.689 -6.042 -1.577 742 3HG1 VAL 121 2HG1 VAL 121 7.065 -7.009 -1.018 743 1HG2 VAL 121 3HG2 VAL 121 6.015 -6.227 -4.547 744 2HG2 VAL 121 2HG2 VAL 121 5.109 -7.754 -4.649 745 3HG2 VAL 121 1HG2 VAL 121 4.576 -6.478 -3.540 746 H ALA 122 HN ALA 122 7.811 -7.481 -5.872 747 HA ALA 122 HA ALA 122 6.313 -9.409 -7.232 748 1HB ALA 122 HB3 ALA 122 8.418 -7.553 -8.324 749 2HB ALA 122 HB2 ALA 122 7.152 -8.379 -9.259 750 3HB ALA 122 HB1 ALA 122 6.718 -7.158 -8.076 751 H ARG 123 HN ARG 123 9.814 -9.012 -6.759 752 HA ARG 123 HA ARG 123 10.411 -11.339 -8.311 753 1HB ARG 123 HB2 ARG 123 12.731 -10.998 -7.674 754 2HB ARG 123 HB1 ARG 123 12.005 -9.493 -8.198 755 1HG ARG 123 HG2 ARG 123 11.666 -8.968 -5.757 756 2HG ARG 123 HG1 ARG 123 12.701 -10.360 -5.427 757 1HD ARG 123 HD2 ARG 123 14.012 -8.286 -5.454 758 2HD ARG 123 HD1 ARG 123 14.486 -9.365 -6.767 759 HE ARG 123 HE ARG 123 12.455 -7.462 -7.470 760 1HH1 ARG 123 1HH1 ARG 123 15.962 -7.931 -7.245 761 2HH1 ARG 123 2HH1 ARG 123 16.328 -6.826 -8.485 762 1HH2 ARG 123 1HH2 ARG 123 12.975 -5.939 -9.181 763 2HH2 ARG 123 2HH2 ARG 123 14.597 -5.673 -9.612 764 H HIS 124 HN HIS 124 9.129 -11.036 -5.356 765 HA HIS 124 HA HIS 124 10.255 -13.303 -4.070 766 1HB HIS 124 HB2 HIS 124 9.046 -11.702 -2.754 767 2HB HIS 124 HB1 HIS 124 7.576 -11.884 -3.675 768 HD1 HIS 124 HD1 HIS 124 6.261 -14.279 -3.202 769 HD2 HIS 124 HD2 HIS 124 9.440 -13.382 -0.705 770 HE1 HIS 124 HE1 HIS 124 6.140 -15.893 -1.310 771 H GLY 125 HN GLY 125 7.851 -12.881 -6.584 772 1HA GLY 125 HA1 GLY 125 6.967 -15.655 -6.273 773 2HA GLY 125 HA2 GLY 125 7.851 -15.264 -7.740 774 H LEU 126 HN LEU 126 5.916 -12.647 -6.699 775 HA LEU 126 HA LEU 126 3.470 -13.247 -7.635 776 1HB LEU 126 HB2 LEU 126 5.071 -10.812 -7.258 777 2HB LEU 126 HB1 LEU 126 3.560 -10.669 -8.136 778 HG LEU 126 HG LEU 126 2.400 -11.629 -6.261 779 1HD1 LEU 126 HD1 LEU 126 3.991 -12.944 -5.304 780 2HD1 LEU 126 HD1 LEU 126 4.955 -11.546 -4.746 781 3HD1 LEU 126 HD1 LEU 126 3.300 -11.825 -4.130 782 1HD2 LEU 126 HD2 LEU 126 4.013 -9.171 -5.697 783 2HD2 LEU 126 HD2 LEU 126 2.442 -9.265 -6.491 784 3HD2 LEU 126 HD2 LEU 126 2.588 -9.655 -4.774 785 H ASP 127 HN ASP 127 2.464 -13.178 -9.443 786 HA ASP 127 HA ASP 127 3.749 -13.261 -12.010 787 1HB ASP 127 HB2 ASP 127 0.803 -12.794 -11.475 788 2HB ASP 127 HB1 ASP 127 1.534 -13.465 -12.920 789 H HIS 128 HN HIS 128 2.643 -11.682 -13.725 790 HA HIS 128 HA HIS 128 3.402 -9.083 -12.879 791 1HB HIS 128 HB2 HIS 128 2.077 -9.938 -15.460 792 2HB HIS 128 HB1 HIS 128 2.675 -8.314 -15.148 793 HD1 HIS 128 HD1 HIS 128 3.899 -9.872 -17.506 794 HD2 HIS 128 HD2 HIS 128 5.441 -9.938 -13.646 795 HE1 HIS 128 HE1 HIS 128 6.300 -10.557 -17.721 796 H ASP 129 HN ASP 129 0.249 -10.607 -13.393 797 HA ASP 129 HA ASP 129 -1.231 -8.242 -12.920 798 1HB ASP 129 HB2 ASP 129 -2.022 -11.142 -12.714 799 2HB ASP 129 HB1 ASP 129 -3.126 -9.841 -12.314 800 H LYS 130 HN LYS 130 0.143 -10.629 -10.857 801 HA LYS 130 HA LYS 130 -1.079 -9.961 -8.420 802 1HB LYS 130 HB2 LYS 130 1.721 -10.841 -9.031 803 2HB LYS 130 HB1 LYS 130 1.085 -10.667 -7.402 804 1HG LYS 130 HG2 LYS 130 -0.197 -12.465 -9.411 805 2HG LYS 130 HG1 LYS 130 1.187 -12.980 -8.444 806 1HD LYS 130 HD2 LYS 130 -0.015 -12.549 -6.448 807 2HD LYS 130 HD1 LYS 130 -1.427 -11.997 -7.315 808 1HE LYS 130 HE2 LYS 130 -0.212 -14.756 -7.156 809 2HE LYS 130 HE1 LYS 130 -1.864 -14.281 -6.778 810 1HZ LYS 130 HZ1 LYS 130 -2.176 -13.872 -9.224 811 2HZ LYS 130 HZ3 LYS 130 -0.630 -14.538 -9.473 812 3HZ LYS 130 HZ2 LYS 130 -1.854 -15.470 -8.814 813 H VAL 131 HN VAL 131 1.772 -8.714 -10.081 814 HA VAL 131 HA VAL 131 2.555 -6.803 -8.170 815 HB VAL 131 HB VAL 131 3.051 -6.798 -11.178 816 1HG1 VAL 131 2HG1 VAL 131 3.489 -4.621 -10.207 817 2HG1 VAL 131 1HG1 VAL 131 4.529 -5.367 -8.989 818 3HG1 VAL 131 3HG1 VAL 131 4.985 -5.412 -10.692 819 1HG2 VAL 131 1HG2 VAL 131 4.706 -7.924 -8.938 820 2HG2 VAL 131 3HG2 VAL 131 3.815 -8.841 -10.151 821 3HG2 VAL 131 2HG2 VAL 131 5.183 -7.841 -10.638 822 H LEU 132 HN LEU 132 0.541 -6.632 -11.035 823 HA LEU 132 HA LEU 132 -0.091 -3.895 -11.003 824 1HB LEU 132 HB2 LEU 132 -1.754 -6.211 -11.942 825 2HB LEU 132 HB1 LEU 132 -2.040 -4.528 -12.336 826 HG LEU 132 HG LEU 132 0.394 -6.115 -13.122 827 1HD1 LEU 132 HD1 LEU 132 -1.971 -5.194 -14.710 828 2HD1 LEU 132 HD1 LEU 132 -0.507 -5.904 -15.389 829 3HD1 LEU 132 HD1 LEU 132 -1.542 -6.863 -14.328 830 1HD2 LEU 132 HD2 LEU 132 -0.451 -3.294 -13.737 831 2HD2 LEU 132 HD2 LEU 132 0.963 -3.802 -12.817 832 3HD2 LEU 132 HD2 LEU 132 0.867 -4.137 -14.545 833 H LEU 133 HN LEU 133 -1.934 -6.624 -9.683 834 HA LEU 133 HA LEU 133 -3.992 -5.056 -8.580 835 1HB LEU 133 HB2 LEU 133 -3.038 -7.786 -7.765 836 2HB LEU 133 HB1 LEU 133 -4.535 -7.029 -7.251 837 HG LEU 133 HG LEU 133 -3.851 -7.774 -10.097 838 1HD1 LEU 133 HD1 LEU 133 -5.615 -9.142 -8.079 839 2HD1 LEU 133 HD1 LEU 133 -5.537 -9.534 -9.796 840 3HD1 LEU 133 HD1 LEU 133 -4.114 -9.760 -8.782 841 1HD2 LEU 133 HD2 LEU 133 -6.430 -6.802 -8.861 842 2HD2 LEU 133 HD2 LEU 133 -5.399 -5.885 -9.962 843 3HD2 LEU 133 HD2 LEU 133 -6.230 -7.335 -10.530 844 H PHE 134 HN PHE 134 -0.981 -6.288 -7.219 845 HA PHE 134 HA PHE 134 -1.485 -5.361 -4.618 846 1HB PHE 134 HB2 PHE 134 0.213 -7.022 -4.865 847 2HB PHE 134 HB1 PHE 134 1.095 -6.048 -6.033 848 HD1 PHE 134 HD1 PHE 134 -0.030 -5.985 -2.471 849 HD2 PHE 134 HD2 PHE 134 2.881 -4.774 -5.329 850 HE1 PHE 134 HE1 PHE 134 1.332 -5.002 -0.681 851 HE2 PHE 134 HE2 PHE 134 4.238 -3.800 -3.545 852 HZ PHE 134 HZ PHE 134 3.482 -3.901 -1.234 853 H SER 135 HN SER 135 0.408 -3.924 -7.279 854 HA SER 135 HA SER 135 1.252 -1.716 -5.831 855 1HB SER 135 HB2 SER 135 1.727 -0.678 -8.070 856 2HB SER 135 HB1 SER 135 2.381 -2.302 -7.857 857 HG SER 135 HG SER 135 0.921 -3.115 -9.162 858 H ARG 136 HN ARG 136 -1.676 -2.129 -7.748 859 HA ARG 136 HA ARG 136 -2.409 0.600 -7.418 860 1HB ARG 136 HB2 ARG 136 -4.545 0.041 -8.416 861 2HB ARG 136 HB1 ARG 136 -3.236 -0.691 -9.327 862 1HG ARG 136 HG2 ARG 136 -3.741 -2.829 -8.113 863 2HG ARG 136 HG1 ARG 136 -5.186 -2.033 -7.478 864 1HD ARG 136 HD2 ARG 136 -4.502 -2.490 -10.378 865 2HD ARG 136 HD1 ARG 136 -5.735 -3.325 -9.438 866 HE ARG 136 HE ARG 136 -6.541 -0.801 -9.201 867 1HH1 ARG 136 1HH1 ARG 136 -5.628 -2.685 -12.083 868 2HH1 ARG 136 2HH1 ARG 136 -6.559 -1.751 -13.149 869 1HH2 ARG 136 1HH2 ARG 136 -7.802 0.487 -10.707 870 2HH2 ARG 136 2HH2 ARG 136 -7.822 0.071 -12.354 871 H ASP 137 HN ASP 137 -3.162 -2.327 -5.617 872 HA ASP 137 HA ASP 137 -5.171 -1.201 -3.891 873 1HB ASP 137 HB2 ASP 137 -4.387 -3.692 -4.390 874 2HB ASP 137 HB1 ASP 137 -3.287 -3.394 -3.056 875 H LEU 138 HN LEU 138 -1.717 -1.693 -3.740 876 HA LEU 138 HA LEU 138 -1.082 -0.605 -1.251 877 1HB LEU 138 HB2 LEU 138 0.515 -1.906 -2.457 878 2HB LEU 138 HB1 LEU 138 0.407 -0.864 -3.850 879 HG LEU 138 HG LEU 138 1.631 0.892 -2.658 880 1HD1 LEU 138 HD1 LEU 138 1.784 -1.096 -0.420 881 2HD1 LEU 138 HD1 LEU 138 2.659 0.440 -0.537 882 3HD1 LEU 138 HD1 LEU 138 0.900 0.441 -0.418 883 1HD2 LEU 138 HD2 LEU 138 2.959 -1.810 -2.579 884 2HD2 LEU 138 HD2 LEU 138 2.885 -0.712 -3.953 885 3HD2 LEU 138 HD2 LEU 138 3.792 -0.261 -2.514 886 H ASP 139 HN ASP 139 -1.128 0.876 -4.456 887 HA ASP 139 HA ASP 139 -0.343 3.474 -3.819 888 1HB ASP 139 HB2 ASP 139 -0.571 2.496 -6.106 889 2HB ASP 139 HB1 ASP 139 -2.313 2.615 -5.940 890 H LYS 140 HN LYS 140 -3.571 2.025 -4.034 891 HA LYS 140 HA LYS 140 -5.219 4.113 -3.515 892 1HB LYS 140 HB2 LYS 140 -5.583 1.710 -4.233 893 2HB LYS 140 HB1 LYS 140 -5.483 1.296 -2.537 894 1HG LYS 140 HG2 LYS 140 -7.312 2.816 -2.080 895 2HG LYS 140 HG1 LYS 140 -7.407 3.094 -3.844 896 1HD LYS 140 HD2 LYS 140 -7.876 0.727 -4.206 897 2HD LYS 140 HD1 LYS 140 -7.771 0.421 -2.472 898 1HE LYS 140 HE2 LYS 140 -10.095 0.547 -3.087 899 2HE LYS 140 HE1 LYS 140 -9.676 1.965 -2.136 900 1HZ LYS 140 HZ1 LYS 140 -9.500 3.229 -4.238 901 2HZ LYS 140 HZ3 LYS 140 -9.981 1.857 -5.088 902 3HZ LYS 140 HZ2 LYS 140 -11.026 2.576 -4.000 903 H LEU 141 HN LEU 141 -3.652 1.830 -1.292 904 HA LEU 141 HA LEU 141 -4.775 2.801 1.109 905 1HB LEU 141 HB2 LEU 141 -3.778 0.576 0.920 906 2HB LEU 141 HB1 LEU 141 -2.215 1.288 0.616 907 HG LEU 141 HG LEU 141 -2.201 2.209 2.904 908 1HD1 LEU 141 HD1 LEU 141 -4.782 0.692 3.206 909 2HD1 LEU 141 HD1 LEU 141 -3.845 1.384 4.531 910 3HD1 LEU 141 HD1 LEU 141 -4.550 2.446 3.314 911 1HD2 LEU 141 HD2 LEU 141 -1.150 0.064 2.431 912 2HD2 LEU 141 HD2 LEU 141 -1.847 0.080 4.051 913 3HD2 LEU 141 HD2 LEU 141 -2.675 -0.764 2.744 914 H ILE 142 HN ILE 142 -1.805 3.498 -0.591 915 HA ILE 142 HA ILE 142 -0.785 5.138 1.475 916 HB ILE 142 HB ILE 142 0.065 5.048 -1.442 917 1HG1 ILE 142 2HG1 ILE 142 1.160 3.770 1.057 918 2HG1 ILE 142 1HG1 ILE 142 0.338 2.936 -0.252 919 1HG2 ILE 142 2HG2 ILE 142 1.429 6.278 0.967 920 2HG2 ILE 142 1HG2 ILE 142 2.132 6.141 -0.643 921 3HG2 ILE 142 3HG2 ILE 142 0.722 7.171 -0.382 922 1HD1 ILE 142 HD1 ILE 142 2.963 4.379 -0.499 923 2HD1 ILE 142 HD1 ILE 142 2.773 2.637 -0.285 924 3HD1 ILE 142 HD1 ILE 142 2.147 3.428 -1.738 925 H ASN 143 HN ASN 143 -2.326 5.962 -1.606 926 HA ASN 143 HA ASN 143 -2.318 8.756 -1.375 927 1HB ASN 143 HB2 ASN 143 -4.466 7.019 -2.626 928 2HB ASN 143 HB1 ASN 143 -4.324 8.754 -2.849 929 1HD2 ASN 143 HD2 ASN 143 -4.260 6.606 -4.767 930 2HD2 ASN 143 HD2 ASN 143 -2.758 6.650 -5.585 931 H LYS 144 HN LYS 144 -4.455 6.376 -0.035 932 HA LYS 144 HA LYS 144 -6.518 7.949 0.938 933 1HB LYS 144 HB2 LYS 144 -6.531 5.523 0.805 934 2HB LYS 144 HB1 LYS 144 -5.301 5.433 2.050 935 1HG LYS 144 HG2 LYS 144 -6.914 6.481 3.633 936 2HG LYS 144 HG1 LYS 144 -8.130 6.383 2.349 937 1HD LYS 144 HD2 LYS 144 -6.637 4.032 3.478 938 2HD LYS 144 HD1 LYS 144 -8.269 4.517 3.928 939 1HE LYS 144 HE2 LYS 144 -7.384 3.680 1.159 940 2HE LYS 144 HE1 LYS 144 -8.289 2.713 2.319 941 1HZ LYS 144 HZ1 LYS 144 -9.255 5.256 1.130 942 2HZ LYS 144 HZ3 LYS 144 -9.729 3.714 0.664 943 3HZ LYS 144 HZ2 LYS 144 -10.102 4.270 2.204 944 H PHE 145 HN PHE 145 -3.463 6.987 2.418 945 HA PHE 145 HA PHE 145 -4.028 8.367 4.839 946 1HB PHE 145 HB2 PHE 145 -1.756 6.735 3.850 947 2HB PHE 145 HB1 PHE 145 -1.502 7.816 5.218 948 HD1 PHE 145 HD1 PHE 145 -2.335 7.357 7.289 949 HD2 PHE 145 HD2 PHE 145 -3.473 4.917 4.026 950 HE1 PHE 145 HE1 PHE 145 -3.339 5.732 8.870 951 HE2 PHE 145 HE2 PHE 145 -4.474 3.277 5.572 952 HZ PHE 145 HZ PHE 145 -4.404 3.684 8.000 953 H MET 146 HN MET 146 -2.232 9.037 1.962 954 HA MET 146 HA MET 146 -0.647 11.227 2.901 955 1HB MET 146 HB2 MET 146 -1.684 10.905 0.083 956 2HB MET 146 HB1 MET 146 -0.255 11.776 0.613 957 1HG MET 146 HG2 MET 146 0.654 9.542 1.384 958 2HG MET 146 HG1 MET 146 -0.705 8.824 0.554 959 1HE MET 146 HE2 MET 146 2.646 10.507 0.342 960 2HE MET 146 HE1 MET 146 2.836 10.975 -1.347 961 3HE MET 146 HE3 MET 146 1.678 11.824 -0.317 962 H ASN 147 HN ASN 147 -3.939 10.931 1.866 963 HA ASN 147 HA ASN 147 -5.692 12.234 1.859 964 1HB ASN 147 HB2 ASN 147 -3.909 13.773 3.628 965 2HB ASN 147 HB1 ASN 147 -5.443 14.518 3.129 966 1HD2 ASN 147 HD2 ASN 147 -4.581 13.756 5.806 967 2HD2 ASN 147 HD2 ASN 147 -5.706 12.595 6.378 968 H VAL 148 HN VAL 148 -3.439 12.536 -0.108 969 HA VAL 148 HA VAL 148 -4.564 14.829 -1.477 970 HB VAL 148 HB VAL 148 -2.362 15.359 -2.410 971 1HG1 VAL 148 3HG1 VAL 148 -3.122 16.675 -0.519 972 2HG1 VAL 148 2HG1 VAL 148 -2.404 15.514 0.600 973 3HG1 VAL 148 1HG1 VAL 148 -1.369 16.477 -0.456 974 1HG2 VAL 148 3HG2 VAL 148 -1.238 13.217 -2.122 975 2HG2 VAL 148 2HG2 VAL 148 -0.287 14.507 -1.380 976 3HG2 VAL 148 1HG2 VAL 148 -1.255 13.429 -0.372 977 H LYS 149 HN LYS 149 -5.133 14.473 -3.394 978 HA LYS 149 HA LYS 149 -4.278 11.973 -4.627 979 1HB LYS 149 HB2 LYS 149 -6.729 13.667 -5.209 980 2HB LYS 149 HB1 LYS 149 -6.298 12.165 -6.013 981 1HG LYS 149 HG2 LYS 149 -6.608 10.943 -3.915 982 2HG LYS 149 HG1 LYS 149 -7.018 12.450 -3.097 983 1HD LYS 149 HD2 LYS 149 -8.929 12.717 -4.692 984 2HD LYS 149 HD1 LYS 149 -8.543 11.135 -5.353 985 1HE LYS 149 HE2 LYS 149 -9.281 11.669 -2.471 986 2HE LYS 149 HE1 LYS 149 -10.389 11.075 -3.700 987 1HZ LYS 149 HZ2 LYS 149 -7.943 9.679 -2.763 988 2HZ LYS 149 HZ1 LYS 149 -9.516 9.311 -2.309 989 3HZ LYS 149 HZ3 LYS 149 -9.041 9.093 -3.919 990 H ASP 150 HN ASP 150 -2.485 12.605 -5.660 991 HA ASP 150 HA ASP 150 -2.424 15.184 -6.862 992 1HB ASP 150 HB2 ASP 150 -0.124 14.857 -7.495 993 2HB ASP 150 HB1 ASP 150 -0.320 14.208 -5.883 994 H LYS 151 HN LYS 151 -3.841 15.394 -8.235 995 HA LYS 151 HA LYS 151 -3.937 13.741 -10.646 996 1HB LYS 151 HB2 LYS 151 -6.052 15.011 -11.077 997 2HB LYS 151 HB1 LYS 151 -6.091 14.135 -9.558 998 1HG LYS 151 HG2 LYS 151 -5.579 16.215 -8.361 999 2HG LYS 151 HG1 LYS 151 -5.604 17.088 -9.895 1000 1HD LYS 151 HD2 LYS 151 -7.947 16.493 -10.204 1001 2HD LYS 151 HD1 LYS 151 -7.920 15.550 -8.714 1002 1HE LYS 151 HE2 LYS 151 -7.384 17.605 -7.454 1003 2HE LYS 151 HE1 LYS 151 -7.483 18.523 -8.955 1004 1HZ LYS 151 HZ1 LYS 151 -9.816 17.874 -9.129 1005 2HZ LYS 151 HZ3 LYS 151 -9.692 17.028 -7.670 1006 3HZ LYS 151 HZ2 LYS 151 -9.505 18.702 -7.700 1007 H VAL 152 HN VAL 152 -1.751 15.367 -10.055 1008 HA VAL 152 HA VAL 152 -1.961 17.924 -11.237 1009 HB VAL 152 HB VAL 152 0.549 18.038 -10.896 1010 1HG1 VAL 152 1HG1 VAL 152 -1.173 17.331 -8.522 1011 2HG1 VAL 152 3HG1 VAL 152 0.364 18.192 -8.452 1012 3HG1 VAL 152 2HG1 VAL 152 -1.020 18.926 -9.260 1013 1HG2 VAL 152 2HG2 VAL 152 0.076 15.371 -9.544 1014 2HG2 VAL 152 1HG2 VAL 152 1.038 15.636 -10.993 1015 3HG2 VAL 152 3HG2 VAL 152 1.563 16.316 -9.451 1016 H HIS 153 HN HIS 153 -2.847 16.737 -13.176 1017 HA HIS 153 HA HIS 153 -0.815 16.131 -15.139 1018 1HB HIS 153 HB2 HIS 153 -3.827 16.494 -15.386 1019 2HB HIS 153 HB1 HIS 153 -2.778 16.097 -16.741 1020 HD1 HIS 153 HD1 HIS 153 -2.268 13.626 -17.089 1021 HD2 HIS 153 HD2 HIS 153 -3.978 14.423 -13.386 1022 HE1 HIS 153 HE1 HIS 153 -2.739 11.404 -16.057 1023 H LYS 154 HN LYS 154 -0.347 17.544 -16.875 1024 HA LYS 154 HA LYS 154 0.470 19.540 -17.556 1025 1HB LYS 154 HB2 LYS 154 -1.971 20.161 -17.919 1026 2HB LYS 154 HB1 LYS 154 -1.992 20.807 -16.283 1027 1HG LYS 154 HG2 LYS 154 0.032 22.241 -17.131 1028 2HG LYS 154 HG1 LYS 154 -0.620 21.866 -18.723 1029 1HD LYS 154 HD2 LYS 154 -1.566 23.943 -18.097 1030 2HD LYS 154 HD1 LYS 154 -2.837 22.743 -17.859 1031 1HE LYS 154 HE2 LYS 154 -2.341 22.674 -15.455 1032 2HE LYS 154 HE1 LYS 154 -1.039 23.834 -15.691 1033 1HZ LYS 154 HZ3 LYS 154 -2.735 25.438 -16.465 1034 2HZ LYS 154 HZ2 LYS 154 -3.934 24.325 -16.118 1035 3HZ LYS 154 HZ1 LYS 154 -3.007 24.949 -14.879 1036 H LEU 155 HN LEU 155 2.181 19.301 -16.114 1037 HA LEU 155 HA LEU 155 1.999 20.254 -13.447 1038 1HB LEU 155 HB2 LEU 155 4.393 20.059 -13.262 1039 2HB LEU 155 HB1 LEU 155 3.802 18.675 -14.140 1040 HG LEU 155 HG LEU 155 5.129 21.054 -15.466 1041 1HD1 LEU 155 HD1 LEU 155 6.319 18.413 -14.631 1042 2HD1 LEU 155 HD1 LEU 155 7.125 19.648 -15.601 1043 3HD1 LEU 155 HD1 LEU 155 6.687 19.988 -13.928 1044 1HD2 LEU 155 HD2 LEU 155 4.572 18.250 -16.445 1045 2HD2 LEU 155 HD2 LEU 155 3.734 19.715 -16.956 1046 3HD2 LEU 155 HD2 LEU 155 5.442 19.504 -17.332 1047 H GLU 156 HN GLU 156 2.571 22.210 -12.560 1048 HA GLU 156 HA GLU 156 2.186 24.457 -14.343 1049 1HB GLU 156 HB2 GLU 156 2.602 24.418 -11.343 1050 2HB GLU 156 HB1 GLU 156 1.971 25.753 -12.297 1051 1HG GLU 156 HG2 GLU 156 0.024 24.376 -12.896 1052 2HG GLU 156 HG1 GLU 156 0.653 23.083 -11.880 1053 H HIS 157 HN HIS 157 4.633 22.933 -14.464 1054 HA HIS 157 HA HIS 157 6.872 22.989 -14.444 1055 1HB HIS 157 HB2 HIS 157 6.378 25.929 -14.844 1056 2HB HIS 157 HB1 HIS 157 7.950 25.159 -15.032 1057 HD1 HIS 157 HD1 HIS 157 5.329 26.276 -17.160 1058 HD2 HIS 157 HD2 HIS 157 7.533 22.764 -16.925 1059 HE1 HIS 157 HE1 HIS 157 5.105 25.161 -19.401 1060 H HIS 158 HN HIS 158 7.122 22.245 -12.457 1061 HA HIS 158 HA HIS 158 7.185 24.161 -10.346 1062 1HB HIS 158 HB2 HIS 158 7.358 21.150 -10.245 1063 2HB HIS 158 HB1 HIS 158 7.386 22.170 -8.811 1064 HD1 HIS 158 HD1 HIS 158 5.100 23.160 -8.040 1065 HD2 HIS 158 HD2 HIS 158 4.906 20.992 -11.573 1066 HE1 HIS 158 HE1 HIS 158 2.651 22.885 -8.556 1067 H HIS 159 HN HIS 159 9.392 22.650 -12.378 1068 HA HIS 159 HA HIS 159 11.518 22.965 -10.441 1069 1HB HIS 159 HB2 HIS 159 11.637 21.747 -13.219 1070 2HB HIS 159 HB1 HIS 159 13.003 21.881 -12.122 1071 HD1 HIS 159 HD1 HIS 159 13.102 20.176 -10.138 1072 HD2 HIS 159 HD2 HIS 159 9.748 19.786 -12.564 1073 HE1 HIS 159 HE1 HIS 159 12.031 17.991 -9.506 1074 H HIS 160 HN HIS 160 10.938 25.159 -10.496 1075 HA HIS 160 HA HIS 160 12.718 26.635 -12.306 1076 1HB HIS 160 HB2 HIS 160 10.382 27.010 -13.133 1077 2HB HIS 160 HB1 HIS 160 9.919 27.509 -11.521 1078 HD1 HIS 160 HD1 HIS 160 9.374 29.925 -11.792 1079 HD2 HIS 160 HD2 HIS 160 12.954 28.892 -13.626 1080 HE1 HIS 160 HE1 HIS 160 10.392 32.083 -12.596 1081 H HIS 161 HN HIS 161 10.593 26.844 -9.508 1082 HA HIS 161 HA HIS 161 10.848 27.369 -7.360 1083 1HB HIS 161 HB2 HIS 161 13.852 27.141 -7.730 1084 2HB HIS 161 HB1 HIS 161 12.963 27.043 -6.222 1085 HD1 HIS 161 HD1 HIS 161 11.929 24.727 -5.637 1086 HD2 HIS 161 HD2 HIS 161 13.832 24.883 -9.324 1087 HE1 HIS 161 HE1 HIS 161 12.218 22.331 -6.399 1088 H HIS 162 HN HIS 162 13.902 28.851 -8.283 1089 HA HIS 162 HA HIS 162 12.969 31.479 -8.439 1090 1HB HIS 162 HB2 HIS 162 14.037 32.414 -6.388 1091 2HB HIS 162 HB1 HIS 162 12.707 31.342 -5.991 1092 HD1 HIS 162 HD1 HIS 162 16.112 32.079 -5.035 1093 HD2 HIS 162 HD2 HIS 162 13.754 28.670 -5.218 1094 HE1 HIS 162 HE1 HIS 162 17.186 30.396 -3.492 No H/Q in entry = 1094 Start of MODEL 27 1 H1 MET 1 HT3 MET 1 15.474 -16.608 -4.768 2 H2 MET 1 HT2 MET 1 14.749 -15.085 -4.578 3 H3 MET 1 HT1 MET 1 15.961 -15.302 -5.739 4 HA MET 1 HA MET 1 17.537 -15.796 -4.032 5 1HB MET 1 HB2 MET 1 17.176 -13.410 -4.751 6 2HB MET 1 HB1 MET 1 16.033 -13.223 -3.430 7 1HG MET 1 HG2 MET 1 17.822 -13.654 -1.823 8 2HG MET 1 HG1 MET 1 18.964 -13.855 -3.148 9 1HE MET 1 HE3 MET 1 20.591 -12.135 -2.078 10 2HE MET 1 HE2 MET 1 20.142 -10.506 -1.585 11 3HE MET 1 HE1 MET 1 19.494 -11.903 -0.717 12 H GLU 2 HN GLU 2 17.992 -16.001 -1.784 13 HA GLU 2 HA GLU 2 16.378 -17.631 -0.347 14 1HB GLU 2 HB2 GLU 2 18.288 -15.626 0.854 15 2HB GLU 2 HB1 GLU 2 17.742 -17.121 1.600 16 1HG GLU 2 HG2 GLU 2 19.469 -16.846 -0.851 17 2HG GLU 2 HG1 GLU 2 19.953 -17.440 0.735 18 H MET 3 HN MET 3 14.475 -17.424 0.575 19 HA MET 3 HA MET 3 12.990 -15.083 0.579 20 1HB MET 3 HB2 MET 3 11.293 -16.225 1.903 21 2HB MET 3 HB1 MET 3 11.879 -17.233 0.597 22 1HG MET 3 HG2 MET 3 13.187 -18.568 2.122 23 2HG MET 3 HG1 MET 3 12.825 -17.479 3.455 24 1HE MET 3 HE3 MET 3 10.452 -17.302 4.628 25 2HE MET 3 HE2 MET 3 9.689 -16.928 3.080 26 3HE MET 3 HE1 MET 3 9.026 -18.198 4.103 27 H GLY 4 HN GLY 4 14.947 -16.407 3.165 28 1HA GLY 4 HA1 GLY 4 15.584 -15.540 5.175 29 2HA GLY 4 HA2 GLY 4 13.977 -14.824 5.277 30 H GLN 5 HN GLN 5 16.350 -14.187 2.802 31 HA GLN 5 HA GLN 5 16.980 -11.596 3.931 32 1HB GLN 5 HB2 GLN 5 18.041 -13.077 1.536 33 2HB GLN 5 HB1 GLN 5 18.463 -11.401 1.871 34 1HG GLN 5 HG2 GLN 5 18.974 -13.748 3.680 35 2HG GLN 5 HG1 GLN 5 20.175 -12.903 2.699 36 1HE2 GLN 5 1HE2 GLN 5 20.019 -13.238 5.599 37 2HE2 GLN 5 2HE2 GLN 5 20.026 -11.626 6.229 38 H LEU 6 HN LEU 6 15.316 -12.978 1.207 39 HA LEU 6 HA LEU 6 14.874 -10.645 -0.239 40 1HB LEU 6 HB2 LEU 6 14.603 -12.993 -1.069 41 2HB LEU 6 HB1 LEU 6 13.150 -13.125 -0.113 42 HG LEU 6 HG LEU 6 12.822 -12.807 -2.606 43 1HD1 LEU 6 HD1 LEU 6 11.553 -10.790 -0.806 44 2HD1 LEU 6 HD1 LEU 6 10.972 -11.265 -2.404 45 3HD1 LEU 6 HD1 LEU 6 11.020 -12.444 -1.086 46 1HD2 LEU 6 HD2 LEU 6 13.734 -10.003 -1.981 47 2HD2 LEU 6 HD2 LEU 6 14.580 -11.171 -2.999 48 3HD2 LEU 6 HD2 LEU 6 13.007 -10.537 -3.488 49 H LYS 7 HN LYS 7 12.716 -12.237 2.140 50 HA LYS 7 HA LYS 7 10.744 -10.196 2.040 51 1HB LYS 7 HB2 LYS 7 11.076 -12.686 3.354 52 2HB LYS 7 HB1 LYS 7 10.752 -11.502 4.608 53 1HG LYS 7 HG2 LYS 7 9.019 -11.840 2.159 54 2HG LYS 7 HG1 LYS 7 8.744 -12.708 3.661 55 1HD LYS 7 HD2 LYS 7 8.819 -9.686 3.482 56 2HD LYS 7 HD1 LYS 7 7.336 -10.624 3.319 57 1HE LYS 7 HE2 LYS 7 7.798 -11.603 5.574 58 2HE LYS 7 HE1 LYS 7 9.163 -10.498 5.723 59 1HZ LYS 7 HZ2 LYS 7 6.320 -9.645 5.388 60 2HZ LYS 7 HZ1 LYS 7 7.134 -9.688 6.833 61 3HZ LYS 7 HZ3 LYS 7 7.616 -8.616 5.637 62 H ASN 8 HN ASN 8 13.697 -10.589 3.769 63 HA ASN 8 HA ASN 8 13.331 -8.620 5.776 64 1HB ASN 8 HB2 ASN 8 15.068 -10.336 5.962 65 2HB ASN 8 HB1 ASN 8 15.864 -9.704 4.528 66 1HD2 ASN 8 HD2 ASN 8 17.217 -7.952 4.721 67 2HD2 ASN 8 HD2 ASN 8 17.644 -7.252 6.221 68 H LYS 9 HN LYS 9 14.705 -8.525 2.510 69 HA LYS 9 HA LYS 9 15.426 -5.770 2.606 70 1HB LYS 9 HB2 LYS 9 14.769 -7.417 0.147 71 2HB LYS 9 HB1 LYS 9 15.642 -5.898 0.170 72 1HG LYS 9 HG2 LYS 9 16.579 -8.519 1.324 73 2HG LYS 9 HG1 LYS 9 17.153 -7.770 -0.159 74 1HD LYS 9 HD2 LYS 9 17.448 -6.601 2.616 75 2HD LYS 9 HD1 LYS 9 18.696 -7.491 1.758 76 1HE LYS 9 HE2 LYS 9 18.653 -5.757 -0.022 77 2HE LYS 9 HE1 LYS 9 17.466 -4.860 0.922 78 1HZ LYS 9 HZ1 LYS 9 19.104 -4.683 2.718 79 2HZ LYS 9 HZ3 LYS 9 20.236 -5.509 1.792 80 3HZ LYS 9 HZ2 LYS 9 19.694 -3.998 1.310 81 H ILE 10 HN ILE 10 12.579 -7.543 1.586 82 HA ILE 10 HA ILE 10 11.026 -5.441 0.606 83 HB ILE 10 HB ILE 10 10.191 -7.968 2.071 84 1HG1 ILE 10 2HG1 ILE 10 10.178 -7.234 -0.859 85 2HG1 ILE 10 1HG1 ILE 10 11.305 -8.331 -0.070 86 1HG2 ILE 10 1HG2 ILE 10 8.410 -6.306 2.323 87 2HG2 ILE 10 3HG2 ILE 10 8.391 -6.066 0.571 88 3HG2 ILE 10 2HG2 ILE 10 7.917 -7.621 1.251 89 1HD1 ILE 10 HD1 ILE 10 9.440 -9.855 0.417 90 2HD1 ILE 10 HD1 ILE 10 8.343 -8.750 -0.410 91 3HD1 ILE 10 HD1 ILE 10 9.633 -9.553 -1.308 92 H GLU 11 HN GLU 11 11.197 -6.734 3.924 93 HA GLU 11 HA GLU 11 9.522 -4.948 5.218 94 1HB GLU 11 HB2 GLU 11 12.068 -6.215 6.215 95 2HB GLU 11 HB1 GLU 11 10.963 -5.313 7.239 96 1HG GLU 11 HG2 GLU 11 10.356 -7.841 5.733 97 2HG GLU 11 HG1 GLU 11 10.585 -7.675 7.477 98 H ASN 12 HN ASN 12 12.977 -4.647 4.729 99 HA ASN 12 HA ASN 12 13.294 -2.196 6.020 100 1HB ASN 12 HB2 ASN 12 15.163 -3.686 5.528 101 2HB ASN 12 HB1 ASN 12 14.948 -3.416 3.805 102 1HD2 ASN 12 HD2 ASN 12 17.043 -2.668 3.610 103 2HD2 ASN 12 HD2 ASN 12 17.532 -1.118 4.166 104 H LYS 13 HN LYS 13 12.760 -2.880 2.566 105 HA LYS 13 HA LYS 13 13.013 -0.151 1.814 106 1HB LYS 13 HB2 LYS 13 13.317 -2.181 0.294 107 2HB LYS 13 HB1 LYS 13 11.570 -2.271 0.227 108 1HG LYS 13 HG2 LYS 13 12.397 -1.075 -1.750 109 2HG LYS 13 HG1 LYS 13 11.485 0.006 -0.700 110 1HD LYS 13 HD2 LYS 13 13.484 1.061 -1.547 111 2HD LYS 13 HD1 LYS 13 13.585 0.887 0.200 112 1HE LYS 13 HE2 LYS 13 15.708 0.356 -0.753 113 2HE LYS 13 HE1 LYS 13 15.004 -1.140 -0.167 114 1HZ LYS 13 HZ3 LYS 13 14.368 -1.684 -2.469 115 2HZ LYS 13 HZ2 LYS 13 15.066 -0.230 -3.014 116 3HZ LYS 13 HZ1 LYS 13 16.018 -1.416 -2.312 117 H LYS 14 HN LYS 14 10.279 -2.228 2.524 118 HA LYS 14 HA LYS 14 8.155 -0.515 1.970 119 1HB LYS 14 HB2 LYS 14 7.764 -2.779 2.390 120 2HB LYS 14 HB1 LYS 14 8.582 -2.747 3.958 121 1HG LYS 14 HG2 LYS 14 6.667 -1.215 4.689 122 2HG LYS 14 HG1 LYS 14 5.873 -1.685 3.188 123 1HD LYS 14 HD2 LYS 14 5.043 -3.162 4.869 124 2HD LYS 14 HD1 LYS 14 6.199 -4.081 3.901 125 1HE LYS 14 HE2 LYS 14 7.928 -3.663 5.627 126 2HE LYS 14 HE1 LYS 14 6.712 -2.817 6.573 127 1HZ LYS 14 HZ3 LYS 14 5.431 -5.013 6.635 128 2HZ LYS 14 HZ2 LYS 14 6.788 -5.716 5.906 129 3HZ LYS 14 HZ1 LYS 14 6.933 -5.045 7.379 130 H LYS 15 HN LYS 15 10.077 -0.959 4.873 131 HA LYS 15 HA LYS 15 8.784 0.932 6.508 132 1HB LYS 15 HB2 LYS 15 11.576 -0.190 6.632 133 2HB LYS 15 HB1 LYS 15 10.910 0.880 7.856 134 1HG LYS 15 HG2 LYS 15 9.221 -0.717 8.430 135 2HG LYS 15 HG1 LYS 15 9.660 -1.740 7.065 136 1HD LYS 15 HD2 LYS 15 10.546 -2.700 9.067 137 2HD LYS 15 HD1 LYS 15 11.876 -2.100 8.097 138 1HE LYS 15 HE2 LYS 15 12.219 -1.550 10.465 139 2HE LYS 15 HE1 LYS 15 12.044 -0.094 9.495 140 1HZ LYS 15 HZ3 LYS 15 9.879 -1.316 11.137 141 2HZ LYS 15 HZ2 LYS 15 10.802 0.031 11.562 142 3HZ LYS 15 HZ1 LYS 15 9.775 0.115 10.248 143 H GLU 16 HN GLU 16 11.604 1.230 4.405 144 HA GLU 16 HA GLU 16 12.265 3.890 4.890 145 1HB GLU 16 HB2 GLU 16 12.343 2.324 2.310 146 2HB GLU 16 HB1 GLU 16 13.065 3.912 2.507 147 1HG GLU 16 HG2 GLU 16 13.812 1.441 4.041 148 2HG GLU 16 HG1 GLU 16 14.699 2.102 2.669 149 H LEU 17 HN LEU 17 9.831 2.505 2.789 150 HA LEU 17 HA LEU 17 8.956 4.902 1.573 151 1HB LEU 17 HB2 LEU 17 8.380 2.845 0.574 152 2HB LEU 17 HB1 LEU 17 7.621 2.266 2.048 153 HG LEU 17 HG LEU 17 6.079 4.343 1.720 154 1HD1 LEU 17 HD1 LEU 17 7.082 4.105 -1.007 155 2HD1 LEU 17 HD1 LEU 17 5.579 4.905 -0.478 156 3HD1 LEU 17 HD1 LEU 17 7.132 5.466 0.123 157 1HD2 LEU 17 HD2 LEU 17 5.473 2.072 1.747 158 2HD2 LEU 17 HD2 LEU 17 4.531 3.103 0.669 159 3HD2 LEU 17 HD2 LEU 17 5.750 1.941 -0.007 160 H ILE 18 HN ILE 18 7.830 3.054 4.363 161 HA ILE 18 HA ILE 18 5.596 4.606 4.990 162 HB ILE 18 HB ILE 18 7.374 3.120 6.954 163 1HG1 ILE 18 2HG1 ILE 18 4.790 2.186 5.699 164 2HG1 ILE 18 1HG1 ILE 18 6.356 1.783 5.015 165 1HG2 ILE 18 1HG2 ILE 18 4.550 4.180 7.173 166 2HG2 ILE 18 3HG2 ILE 18 5.271 3.082 8.351 167 3HG2 ILE 18 2HG2 ILE 18 5.940 4.699 8.107 168 1HD1 ILE 18 HD1 ILE 18 6.943 0.652 7.096 169 2HD1 ILE 18 HD1 ILE 18 5.349 1.030 7.747 170 3HD1 ILE 18 HD1 ILE 18 5.504 -0.027 6.341 171 H GLN 19 HN GLN 19 8.942 4.898 6.002 172 HA GLN 19 HA GLN 19 8.733 7.095 7.727 173 1HB GLN 19 HB2 GLN 19 10.955 6.393 5.819 174 2HB GLN 19 HB1 GLN 19 11.091 7.498 7.177 175 1HG GLN 19 HG2 GLN 19 10.788 5.737 8.735 176 2HG GLN 19 HG1 GLN 19 10.367 4.600 7.451 177 1HE2 GLN 19 1HE2 GLN 19 12.011 3.199 7.912 178 2HE2 GLN 19 2HE2 GLN 19 13.667 3.558 7.582 179 H LEU 20 HN LEU 20 9.118 6.884 4.238 180 HA LEU 20 HA LEU 20 9.355 9.646 3.819 181 1HB LEU 20 HB2 LEU 20 8.531 7.489 1.882 182 2HB LEU 20 HB1 LEU 20 8.894 9.147 1.446 183 HG LEU 20 HG LEU 20 10.860 7.183 2.621 184 1HD1 LEU 20 HD1 LEU 20 10.591 8.288 -0.166 185 2HD1 LEU 20 HD1 LEU 20 11.899 7.258 0.419 186 3HD1 LEU 20 HD1 LEU 20 10.253 6.633 0.339 187 1HD2 LEU 20 HD2 LEU 20 11.253 10.011 1.626 188 2HD2 LEU 20 HD2 LEU 20 11.388 9.463 3.300 189 3HD2 LEU 20 HD2 LEU 20 12.540 8.899 2.096 190 H VAL 21 HN VAL 21 6.369 7.477 3.412 191 HA VAL 21 HA VAL 21 4.788 9.687 2.862 192 HB VAL 21 HB VAL 21 2.991 8.307 2.973 193 1HG1 VAL 21 3HG1 VAL 21 5.194 6.440 2.440 194 2HG1 VAL 21 2HG1 VAL 21 3.485 6.144 2.087 195 3HG1 VAL 21 1HG1 VAL 21 4.334 7.489 1.300 196 1HG2 VAL 21 1HG2 VAL 21 4.316 6.554 5.002 197 2HG2 VAL 21 3HG2 VAL 21 3.020 7.743 5.238 198 3HG2 VAL 21 2HG2 VAL 21 2.712 6.295 4.267 199 H ALA 22 HN ALA 22 5.901 8.353 5.885 200 HA ALA 22 HA ALA 22 4.091 9.622 7.604 201 1HB ALA 22 HB2 ALA 22 6.921 8.761 8.159 202 2HB ALA 22 HB1 ALA 22 5.681 9.095 9.382 203 3HB ALA 22 HB3 ALA 22 5.492 7.743 8.263 204 H ARG 23 HN ARG 23 7.350 10.543 6.556 205 HA ARG 23 HA ARG 23 7.372 12.969 7.996 206 1HB ARG 23 HB2 ARG 23 9.398 13.541 6.807 207 2HB ARG 23 HB1 ARG 23 9.461 11.865 7.324 208 1HG ARG 23 HG2 ARG 23 8.847 11.193 5.030 209 2HG ARG 23 HG1 ARG 23 8.911 12.888 4.553 210 1HD ARG 23 HD2 ARG 23 11.205 11.270 5.663 211 2HD ARG 23 HD1 ARG 23 10.992 11.746 3.981 212 HE ARG 23 HE ARG 23 11.325 13.686 6.165 213 1HH1 ARG 23 1HH1 ARG 23 12.242 12.518 2.955 214 2HH1 ARG 23 2HH1 ARG 23 13.293 13.793 2.599 215 1HH2 ARG 23 1HH2 ARG 23 12.811 15.460 5.705 216 2HH2 ARG 23 2HH2 ARG 23 13.640 15.535 4.224 217 H HIS 24 HN HIS 24 5.949 12.117 5.030 218 HA HIS 24 HA HIS 24 5.669 14.542 3.712 219 1HB HIS 24 HB2 HIS 24 4.794 12.506 2.725 220 2HB HIS 24 HB1 HIS 24 3.686 12.254 4.061 221 HD1 HIS 24 HD1 HIS 24 1.423 13.671 3.997 222 HD2 HIS 24 HD2 HIS 24 3.959 14.267 0.759 223 HE1 HIS 24 HE1 HIS 24 0.080 14.892 2.274 224 H GLY 25 HN GLY 25 3.972 13.214 6.481 225 1HA GLY 25 HA1 GLY 25 2.359 15.635 6.749 226 2HA GLY 25 HA2 GLY 25 3.464 15.221 8.052 227 H LEU 26 HN LEU 26 3.137 12.432 8.138 228 HA LEU 26 HA LEU 26 0.276 12.106 8.579 229 1HB LEU 26 HB2 LEU 26 2.562 10.203 8.693 230 2HB LEU 26 HB1 LEU 26 1.010 9.758 9.305 231 HG LEU 26 HG LEU 26 1.824 10.381 6.567 232 1HD1 LEU 26 HD1 LEU 26 2.263 8.137 7.217 233 2HD1 LEU 26 HD1 LEU 26 0.594 7.919 7.756 234 3HD1 LEU 26 HD1 LEU 26 0.944 8.157 6.042 235 1HD2 LEU 26 HD2 LEU 26 -1.000 10.112 7.534 236 2HD2 LEU 26 HD2 LEU 26 -0.251 11.496 6.744 237 3HD2 LEU 26 HD2 LEU 26 -0.523 10.013 5.840 238 H ASP 27 HN ASP 27 -0.619 11.694 10.428 239 HA ASP 27 HA ASP 27 0.528 12.581 12.884 240 1HB ASP 27 HB2 ASP 27 -1.727 10.558 12.565 241 2HB ASP 27 HB1 ASP 27 -1.315 11.419 14.015 242 H HIS 28 HN HIS 28 1.088 11.100 14.675 243 HA HIS 28 HA HIS 28 2.713 8.979 13.763 244 1HB HIS 28 HB2 HIS 28 1.795 9.640 16.574 245 2HB HIS 28 HB1 HIS 28 2.950 8.360 16.209 246 HD1 HIS 28 HD1 HIS 28 5.345 9.114 15.429 247 HD2 HIS 28 HD2 HIS 28 2.785 12.241 16.392 248 HE1 HIS 28 HE1 HIS 28 6.771 11.167 15.530 249 H ASP 29 HN ASP 29 -0.524 9.110 14.974 250 HA ASP 29 HA ASP 29 -1.055 6.344 15.046 251 1HB ASP 29 HB2 ASP 29 -2.792 8.760 14.813 252 2HB ASP 29 HB1 ASP 29 -3.488 7.176 14.509 253 H LYS 30 HN LYS 30 -1.079 8.665 12.445 254 HA LYS 30 HA LYS 30 -2.389 7.072 10.504 255 1HB LYS 30 HB2 LYS 30 -0.452 9.331 10.295 256 2HB LYS 30 HB1 LYS 30 -1.038 8.599 8.836 257 1HG LYS 30 HG2 LYS 30 -2.633 10.056 10.955 258 2HG LYS 30 HG1 LYS 30 -2.208 10.643 9.352 259 1HD LYS 30 HD2 LYS 30 -3.574 8.778 8.414 260 2HD LYS 30 HD1 LYS 30 -4.085 8.403 10.062 261 1HE LYS 30 HE2 LYS 30 -4.503 11.016 8.611 262 2HE LYS 30 HE1 LYS 30 -5.732 9.791 8.921 263 1HZ LYS 30 HZ1 LYS 30 -5.389 10.220 11.334 264 2HZ LYS 30 HZ3 LYS 30 -4.342 11.502 10.947 265 3HZ LYS 30 HZ2 LYS 30 -5.960 11.531 10.478 266 H VAL 31 HN VAL 31 1.022 7.554 11.303 267 HA VAL 31 HA VAL 31 2.177 5.882 9.387 268 HB VAL 31 HB VAL 31 3.186 6.267 12.228 269 1HG1 VAL 31 3HG1 VAL 31 4.360 4.525 11.061 270 2HG1 VAL 31 2HG1 VAL 31 4.684 5.617 9.716 271 3HG1 VAL 31 1HG1 VAL 31 5.400 5.931 11.296 272 1HG2 VAL 31 3HG2 VAL 31 3.655 8.007 9.815 273 2HG2 VAL 31 2HG2 VAL 31 2.723 8.439 11.246 274 3HG2 VAL 31 1HG2 VAL 31 4.462 8.176 11.374 275 H LEU 32 HN LEU 32 1.003 5.152 12.627 276 HA LEU 32 HA LEU 32 1.586 2.373 12.757 277 1HB LEU 32 HB2 LEU 32 -0.744 3.832 13.962 278 2HB LEU 32 HB1 LEU 32 -0.089 2.291 14.470 279 HG LEU 32 HG LEU 32 1.248 4.976 14.713 280 1HD1 LEU 32 HD1 LEU 32 -0.558 4.649 16.263 281 2HD1 LEU 32 HD1 LEU 32 0.141 3.108 16.773 282 3HD1 LEU 32 HD1 LEU 32 0.999 4.621 17.095 283 1HD2 LEU 32 HD2 LEU 32 2.237 2.241 15.535 284 2HD2 LEU 32 HD2 LEU 32 2.912 3.286 14.277 285 3HD2 LEU 32 HD2 LEU 32 2.996 3.779 15.964 286 H LEU 33 HN LEU 33 -1.405 4.013 11.842 287 HA LEU 33 HA LEU 33 -2.795 1.664 11.195 288 1HB LEU 33 HB2 LEU 33 -3.194 4.488 10.258 289 2HB LEU 33 HB1 LEU 33 -4.343 3.194 9.990 290 HG LEU 33 HG LEU 33 -3.493 4.217 12.696 291 1HD1 LEU 33 HD1 LEU 33 -6.007 4.706 11.122 292 2HD1 LEU 33 HD1 LEU 33 -5.719 5.194 12.797 293 3HD1 LEU 33 HD1 LEU 33 -4.750 5.886 11.497 294 1HD2 LEU 33 HD2 LEU 33 -5.656 2.271 11.891 295 2HD2 LEU 33 HD2 LEU 33 -4.177 1.883 12.767 296 3HD2 LEU 33 HD2 LEU 33 -5.401 2.905 13.517 297 H PHE 34 HN PHE 34 -0.862 3.839 9.215 298 HA PHE 34 HA PHE 34 -1.441 2.627 6.761 299 1HB PHE 34 HB2 PHE 34 -0.470 4.842 6.831 300 2HB PHE 34 HB1 PHE 34 0.969 4.227 7.635 301 HD1 PHE 34 HD1 PHE 34 -0.988 3.838 4.493 302 HD2 PHE 34 HD2 PHE 34 2.814 3.695 6.374 303 HE1 PHE 34 HE1 PHE 34 0.076 3.476 2.315 304 HE2 PHE 34 HE2 PHE 34 3.888 3.332 4.192 305 HZ PHE 34 HZ PHE 34 2.533 3.216 2.174 306 H SER 35 HN SER 35 1.262 2.111 9.017 307 HA SER 35 HA SER 35 2.518 0.219 7.371 308 1HB SER 35 HB2 SER 35 3.851 -0.342 9.445 309 2HB SER 35 HB1 SER 35 3.829 1.360 8.998 310 HG SER 35 HG SER 35 2.531 1.831 10.616 311 H ARG 36 HN ARG 36 0.075 -0.166 9.878 312 HA ARG 36 HA ARG 36 0.204 -2.995 10.047 313 1HB ARG 36 HB2 ARG 36 -2.123 -1.142 10.550 314 2HB ARG 36 HB1 ARG 36 -2.082 -2.840 11.005 315 1HG ARG 36 HG2 ARG 36 -0.197 -2.362 12.491 316 2HG ARG 36 HG1 ARG 36 -0.297 -0.667 11.992 317 1HD ARG 36 HD2 ARG 36 -1.388 -0.946 14.097 318 2HD ARG 36 HD1 ARG 36 -2.572 -0.536 12.869 319 HE ARG 36 HE ARG 36 -2.399 -3.351 13.091 320 1HH1 ARG 36 1HH1 ARG 36 -3.755 -0.584 14.876 321 2HH1 ARG 36 2HH1 ARG 36 -4.992 -1.483 15.599 322 1HH2 ARG 36 1HH2 ARG 36 -4.113 -4.571 14.091 323 2HH2 ARG 36 2HH2 ARG 36 -5.214 -3.817 15.149 324 H ASP 37 HN ASP 37 -1.722 -0.792 8.094 325 HA ASP 37 HA ASP 37 -3.284 -2.853 6.886 326 1HB ASP 37 HB2 ASP 37 -3.903 -0.413 7.183 327 2HB ASP 37 HB1 ASP 37 -2.857 -0.069 5.816 328 H LEU 38 HN LEU 38 -0.482 -0.967 5.936 329 HA LEU 38 HA LEU 38 -0.127 -1.910 3.336 330 1HB LEU 38 HB2 LEU 38 1.053 0.016 4.086 331 2HB LEU 38 HB1 LEU 38 1.771 -0.855 5.416 332 HG LEU 38 HG LEU 38 3.256 -2.035 3.879 333 1HD1 LEU 38 HD1 LEU 38 1.918 -0.431 1.724 334 2HD1 LEU 38 HD1 LEU 38 3.342 -1.461 1.538 335 3HD1 LEU 38 HD1 LEU 38 1.782 -2.180 1.947 336 1HD2 LEU 38 HD2 LEU 38 3.184 0.937 3.431 337 2HD2 LEU 38 HD2 LEU 38 3.989 0.092 4.753 338 3HD2 LEU 38 HD2 LEU 38 4.555 -0.111 3.093 339 H ASP 39 HN ASP 39 1.080 -3.144 6.412 340 HA ASP 39 HA ASP 39 2.689 -5.150 5.265 341 1HB ASP 39 HB2 ASP 39 2.950 -4.283 7.585 342 2HB ASP 39 HB1 ASP 39 1.482 -5.143 8.029 343 H LYS 40 HN LYS 40 -0.706 -5.107 6.226 344 HA LYS 40 HA LYS 40 -1.026 -7.934 6.038 345 1HB LYS 40 HB2 LYS 40 -3.269 -7.662 6.415 346 2HB LYS 40 HB1 LYS 40 -2.611 -6.224 7.198 347 1HG LYS 40 HG2 LYS 40 -3.272 -4.902 5.202 348 2HG LYS 40 HG1 LYS 40 -3.968 -6.360 4.497 349 1HD LYS 40 HD2 LYS 40 -5.385 -6.489 6.628 350 2HD LYS 40 HD1 LYS 40 -4.877 -4.827 6.920 351 1HE LYS 40 HE2 LYS 40 -6.353 -5.842 4.485 352 2HE LYS 40 HE1 LYS 40 -7.048 -4.906 5.801 353 1HZ LYS 40 HZ3 LYS 40 -4.918 -3.917 3.973 354 2HZ LYS 40 HZ2 LYS 40 -6.550 -3.599 3.825 355 3HZ LYS 40 HZ1 LYS 40 -5.724 -3.010 5.145 356 H LEU 41 HN LEU 41 -1.264 -5.300 3.794 357 HA LEU 41 HA LEU 41 -2.461 -6.659 1.629 358 1HB LEU 41 HB2 LEU 41 -2.304 -4.222 1.771 359 2HB LEU 41 HB1 LEU 41 -0.561 -4.320 1.698 360 HG LEU 41 HG LEU 41 -0.692 -5.162 -0.603 361 1HD1 LEU 41 HD1 LEU 41 -3.657 -4.729 -0.311 362 2HD1 LEU 41 HD1 LEU 41 -2.805 -5.103 -1.814 363 3HD1 LEU 41 HD1 LEU 41 -2.832 -6.278 -0.504 364 1HD2 LEU 41 HD2 LEU 41 -0.463 -2.780 -0.188 365 2HD2 LEU 41 HD2 LEU 41 -1.428 -3.075 -1.634 366 3HD2 LEU 41 HD2 LEU 41 -2.219 -2.612 -0.126 367 H ILE 42 HN ILE 42 0.735 -6.253 2.798 368 HA ILE 42 HA ILE 42 1.942 -7.472 0.520 369 HB ILE 42 HB ILE 42 3.143 -6.771 3.214 370 1HG1 ILE 42 2HG1 ILE 42 3.345 -5.534 0.474 371 2HG1 ILE 42 1HG1 ILE 42 2.430 -4.890 1.829 372 1HG2 ILE 42 2HG2 ILE 42 4.528 -7.771 0.712 373 2HG2 ILE 42 1HG2 ILE 42 5.341 -7.177 2.163 374 3HG2 ILE 42 3HG2 ILE 42 4.375 -8.650 2.234 375 1HD1 ILE 42 HD1 ILE 42 4.488 -4.571 3.051 376 2HD1 ILE 42 HD1 ILE 42 5.410 -5.193 1.676 377 3HD1 ILE 42 HD1 ILE 42 4.491 -3.691 1.526 378 H ASN 43 HN ASN 43 1.175 -8.535 3.787 379 HA ASN 43 HA ASN 43 2.173 -11.148 3.603 380 1HB ASN 43 HB2 ASN 43 -0.261 -10.184 5.135 381 2HB ASN 43 HB1 ASN 43 0.464 -11.779 5.320 382 1HD2 ASN 43 HD2 ASN 43 0.126 -9.684 7.287 383 2HD2 ASN 43 HD2 ASN 43 1.709 -9.259 7.834 384 H LYS 44 HN LYS 44 -0.829 -9.790 2.526 385 HA LYS 44 HA LYS 44 -2.194 -12.109 1.743 386 1HB LYS 44 HB2 LYS 44 -3.246 -9.925 1.973 387 2HB LYS 44 HB1 LYS 44 -2.296 -9.302 0.637 388 1HG LYS 44 HG2 LYS 44 -3.431 -10.920 -0.863 389 2HG LYS 44 HG1 LYS 44 -4.444 -11.412 0.495 390 1HD LYS 44 HD2 LYS 44 -4.283 -8.630 -0.686 391 2HD LYS 44 HD1 LYS 44 -5.592 -9.782 -0.933 392 1HE LYS 44 HE2 LYS 44 -6.010 -9.756 1.504 393 2HE LYS 44 HE1 LYS 44 -4.770 -8.523 1.685 394 1HZ LYS 44 HZ1 LYS 44 -7.262 -8.202 0.089 395 2HZ LYS 44 HZ3 LYS 44 -6.969 -7.528 1.598 396 3HZ LYS 44 HZ2 LYS 44 -6.065 -7.038 0.286 397 H PHE 45 HN PHE 45 -0.092 -9.927 -0.092 398 HA PHE 45 HA PHE 45 -0.319 -11.553 -2.413 399 1HB PHE 45 HB2 PHE 45 1.122 -8.997 -1.838 400 2HB PHE 45 HB1 PHE 45 1.456 -9.907 -3.309 401 HD1 PHE 45 HD1 PHE 45 0.113 -9.655 -5.166 402 HD2 PHE 45 HD2 PHE 45 -1.402 -8.397 -1.384 403 HE1 PHE 45 HE1 PHE 45 -1.856 -8.697 -6.267 404 HE2 PHE 45 HE2 PHE 45 -3.358 -7.434 -2.494 405 HZ PHE 45 HZ PHE 45 -3.594 -7.582 -4.933 406 H MET 46 HN MET 46 1.988 -11.238 0.142 407 HA MET 46 HA MET 46 4.112 -12.804 -1.011 408 1HB MET 46 HB2 MET 46 3.277 -12.650 1.915 409 2HB MET 46 HB1 MET 46 4.769 -13.311 1.299 410 1HG MET 46 HG2 MET 46 4.092 -10.427 0.939 411 2HG MET 46 HG1 MET 46 4.777 -11.012 2.441 412 1HE MET 46 HE2 MET 46 5.230 -10.145 -1.235 413 2HE MET 46 HE1 MET 46 6.938 -10.545 -1.559 414 3HE MET 46 HE3 MET 46 5.739 -11.817 -1.461 415 H ASN 47 HN ASN 47 1.083 -13.371 0.474 416 HA ASN 47 HA ASN 47 -0.256 -15.080 0.884 417 1HB ASN 47 HB2 ASN 47 0.227 -15.602 -1.577 418 2HB ASN 47 HB1 ASN 47 1.421 -16.763 -1.010 419 1HD2 ASN 47 HD2 ASN 47 0.297 -18.522 -1.898 420 2HD2 ASN 47 HD2 ASN 47 -1.155 -19.125 -1.197 421 H VAL 48 HN VAL 48 1.883 -14.566 2.508 422 HA VAL 48 HA VAL 48 3.050 -17.071 3.241 423 HB VAL 48 HB VAL 48 4.052 -15.875 5.213 424 1HG1 VAL 48 3HG1 VAL 48 4.570 -14.857 2.450 425 2HG1 VAL 48 2HG1 VAL 48 5.655 -14.554 3.815 426 3HG1 VAL 48 1HG1 VAL 48 5.344 -16.207 3.257 427 1HG2 VAL 48 2HG2 VAL 48 2.852 -13.450 3.878 428 2HG2 VAL 48 1HG2 VAL 48 2.430 -14.127 5.452 429 3HG2 VAL 48 3HG2 VAL 48 4.027 -13.405 5.209 430 H LYS 49 HN LYS 49 1.884 -18.424 3.941 431 HA LYS 49 HA LYS 49 -0.022 -17.853 6.066 432 1HB LYS 49 HB2 LYS 49 0.273 -20.281 4.277 433 2HB LYS 49 HB1 LYS 49 -0.960 -20.080 5.515 434 1HG LYS 49 HG2 LYS 49 -1.878 -18.168 4.304 435 2HG LYS 49 HG1 LYS 49 -0.634 -18.350 3.074 436 1HD LYS 49 HD2 LYS 49 -1.498 -20.538 2.477 437 2HD LYS 49 HD1 LYS 49 -2.681 -20.447 3.782 438 1HE LYS 49 HE2 LYS 49 -3.749 -18.541 2.708 439 2HE LYS 49 HE1 LYS 49 -2.542 -18.570 1.422 440 1HZ LYS 49 HZ2 LYS 49 -4.434 -20.777 2.016 441 2HZ LYS 49 HZ1 LYS 49 -4.650 -19.647 0.801 442 3HZ LYS 49 HZ3 LYS 49 -3.353 -20.717 0.731 443 H ASP 50 HN ASP 50 1.154 -17.876 7.821 444 HA ASP 50 HA ASP 50 3.543 -19.368 8.033 445 1HB ASP 50 HB2 ASP 50 3.808 -18.507 10.252 446 2HB ASP 50 HB1 ASP 50 3.188 -17.224 9.227 447 H LYS 51 HN LYS 51 4.027 -20.710 9.907 448 HA LYS 51 HA LYS 51 1.856 -22.581 10.547 449 1HB LYS 51 HB2 LYS 51 3.652 -24.340 10.625 450 2HB LYS 51 HB1 LYS 51 3.345 -23.676 9.028 451 1HG LYS 51 HG2 LYS 51 5.302 -22.246 9.244 452 2HG LYS 51 HG1 LYS 51 5.650 -22.945 10.828 453 1HD LYS 51 HD2 LYS 51 5.926 -25.134 9.789 454 2HD LYS 51 HD1 LYS 51 5.493 -24.461 8.223 455 1HE LYS 51 HE2 LYS 51 7.448 -22.999 8.298 456 2HE LYS 51 HE1 LYS 51 7.890 -23.663 9.869 457 1HZ LYS 51 HZ1 LYS 51 7.698 -25.266 7.367 458 2HZ LYS 51 HZ3 LYS 51 9.127 -24.661 8.018 459 3HZ LYS 51 HZ2 LYS 51 8.231 -25.805 8.865 460 H VAL 52 HN VAL 52 2.895 -20.157 11.945 461 HA VAL 52 HA VAL 52 3.998 -21.425 14.329 462 HB VAL 52 HB VAL 52 4.702 -19.240 15.108 463 1HG1 VAL 52 3HG1 VAL 52 5.558 -19.723 12.266 464 2HG1 VAL 52 2HG1 VAL 52 6.403 -18.685 13.414 465 3HG1 VAL 52 1HG1 VAL 52 6.272 -20.417 13.719 466 1HG2 VAL 52 2HG2 VAL 52 3.494 -18.119 12.577 467 2HG2 VAL 52 1HG2 VAL 52 2.952 -17.809 14.224 468 3HG2 VAL 52 3HG2 VAL 52 4.521 -17.209 13.681 469 H HIS 53 HN HIS 53 1.288 -19.775 13.023 470 HA HIS 53 HA HIS 53 -0.054 -19.643 15.565 471 1HB HIS 53 HB2 HIS 53 -0.967 -19.140 12.724 472 2HB HIS 53 HB1 HIS 53 -2.076 -19.115 14.087 473 HD1 HIS 53 HD1 HIS 53 0.394 -17.016 12.292 474 HD2 HIS 53 HD2 HIS 53 -1.578 -17.035 15.951 475 HE1 HIS 53 HE1 HIS 53 0.602 -14.683 13.211 476 H LYS 54 HN LYS 54 -2.110 -20.812 15.841 477 HA LYS 54 HA LYS 54 -1.604 -23.562 15.128 478 1HB LYS 54 HB2 LYS 54 -1.962 -22.976 17.468 479 2HB LYS 54 HB1 LYS 54 -3.574 -22.408 17.082 480 1HG LYS 54 HG2 LYS 54 -4.301 -24.616 16.514 481 2HG LYS 54 HG1 LYS 54 -2.661 -25.246 16.649 482 1HD LYS 54 HD2 LYS 54 -4.224 -24.025 18.921 483 2HD LYS 54 HD1 LYS 54 -4.077 -25.759 18.625 484 1HE LYS 54 HE2 LYS 54 -1.648 -25.609 18.903 485 2HE LYS 54 HE1 LYS 54 -1.767 -23.873 19.152 486 1HZ LYS 54 HZ3 LYS 54 -3.063 -24.292 21.133 487 2HZ LYS 54 HZ2 LYS 54 -2.926 -25.957 20.905 488 3HZ LYS 54 HZ1 LYS 54 -1.557 -25.031 21.208 489 H LEU 55 HN LEU 55 -2.410 -24.301 13.436 490 HA LEU 55 HA LEU 55 -4.927 -23.306 12.370 491 1HB LEU 55 HB2 LEU 55 -2.916 -25.266 11.245 492 2HB LEU 55 HB1 LEU 55 -4.319 -24.663 10.394 493 HG LEU 55 HG LEU 55 -1.928 -23.028 11.254 494 1HD1 LEU 55 HD1 LEU 55 -2.837 -23.915 8.522 495 2HD1 LEU 55 HD1 LEU 55 -1.481 -22.837 8.860 496 3HD1 LEU 55 HD1 LEU 55 -1.428 -24.514 9.400 497 1HD2 LEU 55 HD2 LEU 55 -4.371 -22.218 9.677 498 2HD2 LEU 55 HD2 LEU 55 -3.978 -21.696 11.316 499 3HD2 LEU 55 HD2 LEU 55 -2.954 -21.211 9.966 500 H GLU 56 HN GLU 56 -6.057 -25.402 11.238 501 HA GLU 56 HA GLU 56 -7.050 -26.904 13.441 502 1HB GLU 56 HB2 GLU 56 -8.440 -28.038 11.793 503 2HB GLU 56 HB1 GLU 56 -8.479 -26.299 11.545 504 1HG GLU 56 HG2 GLU 56 -6.949 -26.497 9.687 505 2HG GLU 56 HG1 GLU 56 -6.777 -28.221 9.992 506 H HIS 57 HN HIS 57 -7.138 -29.312 13.378 507 HA HIS 57 HA HIS 57 -4.448 -30.277 12.939 508 1HB HIS 57 HB2 HIS 57 -6.809 -31.678 14.188 509 2HB HIS 57 HB1 HIS 57 -5.197 -32.366 14.041 510 HD1 HIS 57 HD1 HIS 57 -7.238 -30.505 16.386 511 HD2 HIS 57 HD2 HIS 57 -3.189 -30.695 15.463 512 HE1 HIS 57 HE1 HIS 57 -6.038 -29.484 18.336 513 H HIS 58 HN HIS 58 -4.810 -29.922 10.692 514 HA HIS 58 HA HIS 58 -6.162 -32.132 9.366 515 1HB HIS 58 HB2 HIS 58 -6.510 -29.876 8.429 516 2HB HIS 58 HB1 HIS 58 -4.779 -29.679 8.216 517 HD1 HIS 58 HD1 HIS 58 -7.783 -30.814 6.466 518 HD2 HIS 58 HD2 HIS 58 -3.702 -31.452 6.158 519 HE1 HIS 58 HE1 HIS 58 -7.390 -31.682 4.150 520 H HIS 59 HN HIS 59 -3.054 -30.678 9.909 521 HA HIS 59 HA HIS 59 -0.972 -31.265 9.729 522 1HB HIS 59 HB2 HIS 59 -2.020 -34.106 9.755 523 2HB HIS 59 HB1 HIS 59 -0.324 -33.666 9.958 524 HD1 HIS 59 HD1 HIS 59 0.060 -31.980 12.099 525 HD2 HIS 59 HD2 HIS 59 -3.416 -34.244 12.043 526 HE1 HIS 59 HE1 HIS 59 -0.863 -31.932 14.468 527 H HIS 60 HN HIS 60 -1.064 -30.195 7.796 528 HA HIS 60 HA HIS 60 -0.780 -31.882 5.402 529 1HB HIS 60 HB2 HIS 60 -2.501 -30.119 5.177 530 2HB HIS 60 HB1 HIS 60 -1.328 -28.897 5.627 531 HD1 HIS 60 HD1 HIS 60 -2.182 -31.219 2.738 532 HD2 HIS 60 HD2 HIS 60 0.216 -27.930 3.570 533 HE1 HIS 60 HE1 HIS 60 -1.267 -30.453 0.536 534 H HIS 61 HN HIS 61 0.639 -29.154 7.134 535 HA HIS 61 HA HIS 61 3.097 -29.402 5.579 536 1HB HIS 61 HB2 HIS 61 1.991 -27.164 6.148 537 2HB HIS 61 HB1 HIS 61 2.452 -27.466 7.815 538 HD1 HIS 61 HD1 HIS 61 3.630 -25.931 4.789 539 HD2 HIS 61 HD2 HIS 61 5.378 -27.678 8.114 540 HE1 HIS 61 HE1 HIS 61 6.018 -25.118 4.825 541 H HIS 62 HN HIS 62 1.811 -29.637 8.797 542 HA HIS 62 HA HIS 62 3.933 -31.415 9.604 543 1HB HIS 62 HB2 HIS 62 4.568 -29.151 10.454 544 2HB HIS 62 HB1 HIS 62 2.999 -29.034 11.246 545 HD1 HIS 62 HD1 HIS 62 2.772 -30.149 13.552 546 HD2 HIS 62 HD2 HIS 62 6.312 -31.087 11.587 547 HE1 HIS 62 HE1 HIS 62 4.174 -31.399 15.206 548 H1 MET 101 HT3 MET 101 14.047 19.086 -0.368 549 H2 MET 101 HT2 MET 101 14.506 20.454 -1.239 550 H3 MET 101 HT1 MET 101 15.227 20.130 0.233 551 HA MET 101 HA MET 101 13.138 20.426 1.381 552 1HB MET 101 HB2 MET 101 14.629 22.396 1.008 553 2HB MET 101 HB1 MET 101 13.744 22.743 -0.470 554 1HG MET 101 HG2 MET 101 12.996 24.204 1.292 555 2HG MET 101 HG1 MET 101 11.702 23.088 0.854 556 1HE MET 101 HE1 MET 101 11.629 24.815 3.509 557 2HE MET 101 HE3 MET 101 10.368 23.660 3.075 558 3HE MET 101 HE2 MET 101 11.090 23.617 4.685 559 H GLU 102 HN GLU 102 12.912 20.724 -2.141 560 HA GLU 102 HA GLU 102 10.199 21.306 -2.382 561 1HB GLU 102 HB2 GLU 102 12.247 21.264 -4.064 562 2HB GLU 102 HB1 GLU 102 11.786 19.594 -4.289 563 1HG GLU 102 HG2 GLU 102 10.028 21.979 -4.813 564 2HG GLU 102 HG1 GLU 102 10.926 21.079 -6.030 565 H MET 103 HN MET 103 8.559 19.992 -1.617 566 HA MET 103 HA MET 103 9.231 17.271 -1.026 567 1HB MET 103 HB2 MET 103 6.745 18.810 -0.274 568 2HB MET 103 HB1 MET 103 6.951 17.099 0.060 569 1HG MET 103 HG2 MET 103 9.011 17.641 1.336 570 2HG MET 103 HG1 MET 103 8.663 19.348 1.106 571 1HE MET 103 HE2 MET 103 6.523 20.572 2.175 572 2HE MET 103 HE1 MET 103 5.452 19.384 1.433 573 3HE MET 103 HE3 MET 103 5.313 19.742 3.154 574 H GLY 104 HN GLY 104 8.115 18.650 -3.739 575 1HA GLY 104 HA1 GLY 104 7.330 17.674 -5.663 576 2HA GLY 104 HA2 GLY 104 6.416 16.551 -4.641 577 H GLN 105 HN GLN 105 9.825 17.186 -4.501 578 HA GLN 105 HA GLN 105 10.707 14.830 -5.797 579 1HB GLN 105 HB2 GLN 105 12.038 16.688 -3.840 580 2HB GLN 105 HB1 GLN 105 12.855 15.281 -4.508 581 1HG GLN 105 HG2 GLN 105 11.634 17.438 -6.196 582 2HG GLN 105 HG1 GLN 105 13.310 17.454 -5.653 583 1HE2 GLN 105 1HE2 GLN 105 14.049 17.363 -7.747 584 2HE2 GLN 105 2HE2 GLN 105 13.969 15.932 -8.722 585 H LEU 106 HN LEU 106 9.944 15.650 -2.509 586 HA LEU 106 HA LEU 106 10.640 13.235 -1.281 587 1HB LEU 106 HB2 LEU 106 10.130 15.272 -0.007 588 2HB LEU 106 HB1 LEU 106 8.507 15.282 -0.636 589 HG LEU 106 HG LEU 106 8.824 14.673 1.815 590 1HD1 LEU 106 HD1 LEU 106 7.290 12.769 0.082 591 2HD1 LEU 106 HD1 LEU 106 7.074 12.989 1.821 592 3HD1 LEU 106 HD1 LEU 106 6.722 14.314 0.714 593 1HD2 LEU 106 HD2 LEU 106 10.710 13.160 1.587 594 2HD2 LEU 106 HD2 LEU 106 9.321 12.356 2.324 595 3HD2 LEU 106 HD2 LEU 106 9.718 12.050 0.633 596 H LYS 107 HN LYS 107 7.617 14.284 -2.795 597 HA LYS 107 HA LYS 107 6.186 11.877 -2.470 598 1HB LYS 107 HB2 LYS 107 5.745 14.403 -3.652 599 2HB LYS 107 HB1 LYS 107 5.460 13.219 -4.917 600 1HG LYS 107 HG2 LYS 107 4.158 13.118 -2.207 601 2HG LYS 107 HG1 LYS 107 3.447 13.912 -3.602 602 1HD LYS 107 HD2 LYS 107 4.226 10.988 -3.611 603 2HD LYS 107 HD1 LYS 107 2.623 11.547 -3.125 604 1HE LYS 107 HE2 LYS 107 2.464 12.655 -5.380 605 2HE LYS 107 HE1 LYS 107 3.960 11.829 -5.814 606 1HZ LYS 107 HZ3 LYS 107 2.826 9.679 -5.395 607 2HZ LYS 107 HZ2 LYS 107 1.431 10.520 -4.984 608 3HZ LYS 107 HZ1 LYS 107 1.999 10.600 -6.553 609 H ASN 108 HN ASN 108 8.312 13.042 -4.980 610 HA ASN 108 HA ASN 108 8.097 10.942 -6.838 611 1HB ASN 108 HB2 ASN 108 9.178 13.050 -7.428 612 2HB ASN 108 HB1 ASN 108 10.396 12.801 -6.192 613 1HD2 ASN 108 HD2 ASN 108 11.992 13.096 -7.756 614 2HD2 ASN 108 HD2 ASN 108 12.394 11.867 -8.890 615 H LYS 109 HN LYS 109 10.234 11.381 -4.059 616 HA LYS 109 HA LYS 109 11.590 8.922 -4.340 617 1HB LYS 109 HB2 LYS 109 11.195 10.668 -1.910 618 2HB LYS 109 HB1 LYS 109 12.228 9.244 -1.943 619 1HG LYS 109 HG2 LYS 109 13.616 10.271 -3.661 620 2HG LYS 109 HG1 LYS 109 12.563 11.682 -3.682 621 1HD LYS 109 HD2 LYS 109 14.564 12.133 -2.371 622 2HD LYS 109 HD1 LYS 109 13.135 12.134 -1.344 623 1HE LYS 109 HE2 LYS 109 13.658 9.929 -0.522 624 2HE LYS 109 HE1 LYS 109 15.003 9.772 -1.650 625 1HZ LYS 109 HZ2 LYS 109 16.069 11.638 -0.506 626 2HZ LYS 109 HZ1 LYS 109 14.811 11.702 0.608 627 3HZ LYS 109 HZ3 LYS 109 15.809 10.344 0.522 628 H ILE 110 HN ILE 110 8.682 9.867 -2.600 629 HA ILE 110 HA ILE 110 8.173 7.434 -1.318 630 HB ILE 110 HB ILE 110 6.245 9.527 -2.369 631 1HG1 ILE 110 2HG1 ILE 110 7.169 8.849 0.420 632 2HG1 ILE 110 1HG1 ILE 110 7.733 10.216 -0.538 633 1HG2 ILE 110 1HG2 ILE 110 5.046 7.402 -2.291 634 2HG2 ILE 110 3HG2 ILE 110 5.575 7.149 -0.627 635 3HG2 ILE 110 2HG2 ILE 110 4.480 8.478 -1.013 636 1HD1 ILE 110 HD1 ILE 110 4.939 9.764 0.468 637 2HD1 ILE 110 HD1 ILE 110 6.121 10.884 1.143 638 3HD1 ILE 110 HD1 ILE 110 5.478 11.148 -0.480 639 H GLU 111 HN GLU 111 7.069 8.600 -4.470 640 HA GLU 111 HA GLU 111 5.776 6.306 -5.364 641 1HB GLU 111 HB2 GLU 111 7.414 8.284 -6.950 642 2HB GLU 111 HB1 GLU 111 6.363 7.074 -7.664 643 1HG GLU 111 HG2 GLU 111 5.509 9.320 -5.861 644 2HG GLU 111 HG1 GLU 111 5.300 9.284 -7.602 645 H ASN 112 HN ASN 112 9.131 7.241 -5.809 646 HA ASN 112 HA ASN 112 9.976 4.968 -7.176 647 1HB ASN 112 HB2 ASN 112 11.360 6.901 -7.225 648 2HB ASN 112 HB1 ASN 112 11.496 6.931 -5.470 649 1HD2 ASN 112 HD2 ASN 112 12.996 5.684 -4.492 650 2HD2 ASN 112 HD2 ASN 112 14.126 4.665 -5.313 651 H LYS 113 HN LYS 113 9.962 5.600 -3.675 652 HA LYS 113 HA LYS 113 11.408 3.226 -3.088 653 1HB LYS 113 HB2 LYS 113 11.111 5.357 -1.619 654 2HB LYS 113 HB1 LYS 113 9.630 4.576 -1.080 655 1HG LYS 113 HG2 LYS 113 11.090 3.845 0.526 656 2HG LYS 113 HG1 LYS 113 11.215 2.537 -0.644 657 1HD LYS 113 HD2 LYS 113 13.212 4.775 -0.135 658 2HD LYS 113 HD1 LYS 113 13.400 3.022 0.006 659 1HE LYS 113 HE2 LYS 113 13.281 2.775 -2.420 660 2HE LYS 113 HE1 LYS 113 13.008 4.499 -2.582 661 1HZ LYS 113 HZ1 LYS 113 15.496 3.326 -1.449 662 2HZ LYS 113 HZ3 LYS 113 15.260 3.754 -3.054 663 3HZ LYS 113 HZ2 LYS 113 15.223 4.944 -1.872 664 H LYS 114 HN LYS 114 8.030 4.092 -3.068 665 HA LYS 114 HA LYS 114 6.879 1.736 -2.156 666 1HB LYS 114 HB2 LYS 114 5.608 3.683 -2.374 667 2HB LYS 114 HB1 LYS 114 6.030 3.909 -4.072 668 1HG LYS 114 HG2 LYS 114 4.658 1.820 -4.535 669 2HG LYS 114 HG1 LYS 114 4.138 1.897 -2.850 670 1HD LYS 114 HD2 LYS 114 2.430 2.986 -4.171 671 2HD LYS 114 HD1 LYS 114 3.329 4.222 -3.285 672 1HE LYS 114 HE2 LYS 114 4.659 4.672 -5.319 673 2HE LYS 114 HE1 LYS 114 3.669 3.467 -6.138 674 1HZ LYS 114 HZ2 LYS 114 2.512 5.915 -4.883 675 2HZ LYS 114 HZ1 LYS 114 2.972 5.854 -6.475 676 3HZ LYS 114 HZ3 LYS 114 1.735 4.858 -5.928 677 H LYS 115 HN LYS 115 7.798 2.749 -5.386 678 HA LYS 115 HA LYS 115 7.014 0.373 -6.710 679 1HB LYS 115 HB2 LYS 115 8.930 2.529 -7.575 680 2HB LYS 115 HB1 LYS 115 8.360 1.224 -8.608 681 1HG LYS 115 HG2 LYS 115 6.069 2.017 -8.403 682 2HG LYS 115 HG1 LYS 115 6.592 3.264 -7.276 683 1HD LYS 115 HD2 LYS 115 6.279 4.255 -9.418 684 2HD LYS 115 HD1 LYS 115 7.998 4.227 -9.056 685 1HE LYS 115 HE2 LYS 115 7.645 3.591 -11.373 686 2HE LYS 115 HE1 LYS 115 8.270 2.223 -10.460 687 1HZ LYS 115 HZ2 LYS 115 5.413 2.632 -11.206 688 2HZ LYS 115 HZ1 LYS 115 6.478 1.581 -11.956 689 3HZ LYS 115 HZ3 LYS 115 6.026 1.325 -10.364 690 H GLU 116 HN GLU 116 10.167 1.437 -5.467 691 HA GLU 116 HA GLU 116 11.625 -0.810 -6.270 692 1HB GLU 116 HB2 GLU 116 11.964 0.938 -3.838 693 2HB GLU 116 HB1 GLU 116 13.038 -0.402 -4.172 694 1HG GLU 116 HG2 GLU 116 13.559 0.697 -6.369 695 2HG GLU 116 HG1 GLU 116 12.651 2.101 -5.796 696 H LEU 117 HN LEU 117 9.495 -0.343 -3.547 697 HA LEU 117 HA LEU 117 10.040 -2.827 -2.303 698 1HB LEU 117 HB2 LEU 117 8.960 -1.192 -1.018 699 2HB LEU 117 HB1 LEU 117 7.675 -0.981 -2.207 700 HG LEU 117 HG LEU 117 7.263 -3.514 -1.691 701 1HD1 LEU 117 HD1 LEU 117 8.748 -2.785 0.692 702 2HD1 LEU 117 HD1 LEU 117 7.578 -4.125 0.543 703 3HD1 LEU 117 HD1 LEU 117 9.007 -4.069 -0.493 704 1HD2 LEU 117 HD2 LEU 117 5.715 -1.827 -1.423 705 2HD2 LEU 117 HD2 LEU 117 5.686 -2.984 -0.080 706 3HD2 LEU 117 HD2 LEU 117 6.385 -1.349 0.162 707 H ILE 118 HN ILE 118 7.529 -1.698 -4.513 708 HA ILE 118 HA ILE 118 6.051 -4.013 -4.774 709 HB ILE 118 HB ILE 118 6.618 -1.923 -6.902 710 1HG1 ILE 118 2HG1 ILE 118 4.203 -2.246 -5.119 711 2HG1 ILE 118 1HG1 ILE 118 5.550 -1.174 -4.758 712 1HG2 ILE 118 1HG2 ILE 118 4.438 -4.029 -6.848 713 2HG2 ILE 118 3HG2 ILE 118 4.557 -2.711 -8.015 714 3HG2 ILE 118 2HG2 ILE 118 5.796 -3.962 -7.968 715 1HD1 ILE 118 HD1 ILE 118 3.761 -0.994 -7.165 716 2HD1 ILE 118 HD1 ILE 118 3.673 0.028 -5.724 717 3HD1 ILE 118 HD1 ILE 118 5.091 0.089 -6.766 718 H GLN 119 HN GLN 119 8.884 -2.998 -6.606 719 HA GLN 119 HA GLN 119 9.067 -5.229 -8.279 720 1HB GLN 119 HB2 GLN 119 11.211 -3.349 -7.271 721 2HB GLN 119 HB1 GLN 119 11.468 -4.536 -8.540 722 1HG GLN 119 HG2 GLN 119 9.807 -3.467 -9.942 723 2HG GLN 119 HG1 GLN 119 9.420 -2.333 -8.656 724 1HE2 GLN 119 1HE2 GLN 119 11.726 -3.241 -11.060 725 2HE2 GLN 119 2HE2 GLN 119 12.616 -1.769 -11.084 726 H LEU 120 HN LEU 120 10.141 -4.767 -4.982 727 HA LEU 120 HA LEU 120 11.643 -7.193 -4.854 728 1HB LEU 120 HB2 LEU 120 10.506 -5.517 -2.615 729 2HB LEU 120 HB1 LEU 120 11.623 -6.849 -2.405 730 HG LEU 120 HG LEU 120 12.203 -4.242 -3.803 731 1HD1 LEU 120 HD1 LEU 120 12.028 -4.033 -1.393 732 2HD1 LEU 120 HD1 LEU 120 13.189 -5.344 -1.186 733 3HD1 LEU 120 HD1 LEU 120 13.692 -3.828 -1.935 734 1HD2 LEU 120 HD2 LEU 120 14.004 -6.604 -3.263 735 2HD2 LEU 120 HD2 LEU 120 13.445 -6.060 -4.847 736 3HD2 LEU 120 HD2 LEU 120 14.519 -5.040 -3.900 737 H VAL 121 HN VAL 121 8.377 -6.215 -3.687 738 HA VAL 121 HA VAL 121 7.525 -8.671 -2.747 739 HB VAL 121 HB VAL 121 5.873 -6.524 -4.150 740 1HG1 VAL 121 1HG1 VAL 121 4.662 -8.672 -3.674 741 2HG1 VAL 121 3HG1 VAL 121 5.040 -8.384 -1.961 742 3HG1 VAL 121 2HG1 VAL 121 4.042 -7.239 -2.837 743 1HG2 VAL 121 3HG2 VAL 121 7.243 -5.561 -2.425 744 2HG2 VAL 121 2HG2 VAL 121 5.542 -5.555 -1.953 745 3HG2 VAL 121 1HG2 VAL 121 6.651 -6.746 -1.257 746 H ALA 122 HN ALA 122 7.565 -7.356 -6.003 747 HA ALA 122 HA ALA 122 6.106 -9.327 -7.317 748 1HB ALA 122 HB3 ALA 122 8.219 -7.495 -8.421 749 2HB ALA 122 HB2 ALA 122 7.002 -8.371 -9.369 750 3HB ALA 122 HB1 ALA 122 6.509 -7.120 -8.234 751 H ARG 123 HN ARG 123 9.633 -8.886 -6.970 752 HA ARG 123 HA ARG 123 10.321 -11.208 -8.467 753 1HB ARG 123 HB2 ARG 123 12.601 -10.840 -7.746 754 2HB ARG 123 HB1 ARG 123 11.865 -9.300 -8.163 755 1HG ARG 123 HG2 ARG 123 11.469 -8.887 -5.780 756 2HG ARG 123 HG1 ARG 123 12.291 -10.396 -5.409 757 1HD ARG 123 HD2 ARG 123 13.521 -8.021 -6.810 758 2HD ARG 123 HD1 ARG 123 13.786 -8.477 -5.130 759 HE ARG 123 HE ARG 123 14.439 -10.399 -7.223 760 1HH1 ARG 123 1HH1 ARG 123 15.620 -8.165 -4.715 761 2HH1 ARG 123 2HH1 ARG 123 17.226 -8.702 -4.809 762 1HH2 ARG 123 1HH2 ARG 123 16.609 -11.167 -7.285 763 2HH2 ARG 123 2HH2 ARG 123 17.816 -10.484 -6.300 764 H HIS 124 HN HIS 124 9.035 -10.949 -5.437 765 HA HIS 124 HA HIS 124 10.243 -13.136 -4.129 766 1HB HIS 124 HB2 HIS 124 8.986 -11.626 -2.800 767 2HB HIS 124 HB1 HIS 124 7.567 -11.745 -3.783 768 HD1 HIS 124 HD1 HIS 124 5.872 -13.646 -3.134 769 HD2 HIS 124 HD2 HIS 124 9.494 -13.909 -1.101 770 HE1 HIS 124 HE1 HIS 124 5.566 -15.410 -1.387 771 H GLY 125 HN GLY 125 7.674 -12.877 -6.492 772 1HA GLY 125 HA1 GLY 125 6.904 -15.658 -6.102 773 2HA GLY 125 HA2 GLY 125 7.735 -15.301 -7.611 774 H LEU 126 HN LEU 126 5.896 -12.632 -6.601 775 HA LEU 126 HA LEU 126 3.384 -13.177 -7.459 776 1HB LEU 126 HB2 LEU 126 5.139 -10.883 -7.160 777 2HB LEU 126 HB1 LEU 126 3.660 -10.619 -8.068 778 HG LEU 126 HG LEU 126 2.444 -11.500 -6.108 779 1HD1 LEU 126 HD1 LEU 126 4.094 -12.772 -5.089 780 2HD1 LEU 126 HD1 LEU 126 5.028 -11.322 -4.650 781 3HD1 LEU 126 HD1 LEU 126 3.392 -11.592 -3.986 782 1HD2 LEU 126 HD2 LEU 126 4.109 -9.041 -5.712 783 2HD2 LEU 126 HD2 LEU 126 2.552 -9.145 -6.522 784 3HD2 LEU 126 HD2 LEU 126 2.656 -9.419 -4.781 785 H ASP 127 HN ASP 127 2.399 -13.063 -9.301 786 HA ASP 127 HA ASP 127 3.987 -13.079 -11.751 787 1HB ASP 127 HB2 ASP 127 1.003 -13.519 -11.388 788 2HB ASP 127 HB1 ASP 127 1.871 -13.699 -12.906 789 H HIS 128 HN HIS 128 2.721 -11.818 -13.670 790 HA HIS 128 HA HIS 128 3.143 -9.118 -13.085 791 1HB HIS 128 HB2 HIS 128 3.200 -10.129 -15.396 792 2HB HIS 128 HB1 HIS 128 1.440 -10.162 -15.371 793 HD1 HIS 128 HD1 HIS 128 0.392 -8.129 -16.509 794 HD2 HIS 128 HD2 HIS 128 4.169 -7.345 -14.934 795 HE1 HIS 128 HE1 HIS 128 0.933 -5.767 -17.131 796 H ASP 129 HN ASP 129 0.164 -10.969 -13.188 797 HA ASP 129 HA ASP 129 -1.789 -9.067 -12.797 798 1HB ASP 129 HB2 ASP 129 -2.368 -11.362 -13.201 799 2HB ASP 129 HB1 ASP 129 -1.477 -11.891 -11.785 800 H LYS 130 HN LYS 130 0.170 -10.741 -10.492 801 HA LYS 130 HA LYS 130 -1.021 -9.679 -8.197 802 1HB LYS 130 HB2 LYS 130 1.605 -11.012 -8.711 803 2HB LYS 130 HB1 LYS 130 1.099 -10.499 -7.108 804 1HG LYS 130 HG2 LYS 130 -0.533 -12.346 -8.828 805 2HG LYS 130 HG1 LYS 130 0.703 -12.915 -7.696 806 1HD LYS 130 HD2 LYS 130 -0.436 -12.199 -5.863 807 2HD LYS 130 HD1 LYS 130 -1.421 -11.041 -6.719 808 1HE LYS 130 HE2 LYS 130 -1.626 -14.069 -6.726 809 2HE LYS 130 HE1 LYS 130 -2.788 -12.933 -6.044 810 1HZ LYS 130 HZ3 LYS 130 -3.091 -12.129 -8.494 811 2HZ LYS 130 HZ2 LYS 130 -2.245 -13.496 -8.901 812 3HZ LYS 130 HZ1 LYS 130 -3.678 -13.656 -8.111 813 H VAL 131 HN VAL 131 1.696 -8.685 -10.165 814 HA VAL 131 HA VAL 131 2.658 -6.679 -8.390 815 HB VAL 131 HB VAL 131 2.984 -6.706 -11.405 816 1HG1 VAL 131 2HG1 VAL 131 3.732 -4.672 -10.356 817 2HG1 VAL 131 1HG1 VAL 131 4.743 -5.598 -9.250 818 3HG1 VAL 131 3HG1 VAL 131 5.102 -5.596 -10.976 819 1HG2 VAL 131 3HG2 VAL 131 4.585 -8.217 -9.353 820 2HG2 VAL 131 2HG2 VAL 131 3.530 -8.888 -10.592 821 3HG2 VAL 131 1HG2 VAL 131 5.013 -8.051 -11.066 822 H LEU 132 HN LEU 132 0.411 -6.759 -11.079 823 HA LEU 132 HA LEU 132 -0.159 -4.008 -11.251 824 1HB LEU 132 HB2 LEU 132 -1.933 -6.353 -11.900 825 2HB LEU 132 HB1 LEU 132 -2.237 -4.694 -12.368 826 HG LEU 132 HG LEU 132 0.023 -6.438 -13.324 827 1HD1 LEU 132 HD1 LEU 132 -2.408 -5.349 -14.705 828 2HD1 LEU 132 HD1 LEU 132 -1.099 -6.257 -15.476 829 3HD1 LEU 132 HD1 LEU 132 -2.115 -7.032 -14.255 830 1HD2 LEU 132 HD2 LEU 132 -0.668 -3.590 -14.046 831 2HD2 LEU 132 HD2 LEU 132 0.757 -4.126 -13.149 832 3HD2 LEU 132 HD2 LEU 132 0.555 -4.586 -14.835 833 H LEU 133 HN LEU 133 -1.970 -6.584 -9.677 834 HA LEU 133 HA LEU 133 -3.906 -4.853 -8.602 835 1HB LEU 133 HB2 LEU 133 -3.100 -7.558 -7.569 836 2HB LEU 133 HB1 LEU 133 -4.615 -6.734 -7.254 837 HG LEU 133 HG LEU 133 -3.679 -7.816 -9.905 838 1HD1 LEU 133 HD1 LEU 133 -4.374 -9.522 -8.387 839 2HD1 LEU 133 HD1 LEU 133 -5.902 -8.662 -8.091 840 3HD1 LEU 133 HD1 LEU 133 -5.542 -9.321 -9.693 841 1HD2 LEU 133 HD2 LEU 133 -6.246 -6.378 -9.225 842 2HD2 LEU 133 HD2 LEU 133 -4.949 -5.782 -10.268 843 3HD2 LEU 133 HD2 LEU 133 -5.888 -7.192 -10.751 844 H PHE 134 HN PHE 134 -0.866 -6.049 -7.295 845 HA PHE 134 HA PHE 134 -1.236 -5.060 -4.698 846 1HB PHE 134 HB2 PHE 134 0.475 -6.738 -5.217 847 2HB PHE 134 HB1 PHE 134 1.331 -5.574 -6.215 848 HD1 PHE 134 HD1 PHE 134 0.208 -6.195 -2.732 849 HD2 PHE 134 HD2 PHE 134 2.979 -4.238 -5.291 850 HE1 PHE 134 HE1 PHE 134 1.520 -5.500 -0.775 851 HE2 PHE 134 HE2 PHE 134 4.296 -3.537 -3.338 852 HZ PHE 134 HZ PHE 134 3.570 -4.159 -1.084 853 H SER 135 HN SER 135 0.428 -3.646 -7.538 854 HA SER 135 HA SER 135 1.291 -1.350 -6.204 855 1HB SER 135 HB2 SER 135 1.608 -0.381 -8.515 856 2HB SER 135 HB1 SER 135 2.343 -1.961 -8.276 857 HG SER 135 HG SER 135 0.862 -2.892 -9.488 858 H ARG 136 HN ARG 136 -1.671 -1.995 -7.908 859 HA ARG 136 HA ARG 136 -2.793 0.606 -7.912 860 1HB ARG 136 HB2 ARG 136 -4.091 -2.077 -7.791 861 2HB ARG 136 HB1 ARG 136 -4.959 -0.591 -8.155 862 1HG ARG 136 HG2 ARG 136 -3.719 -0.333 -10.198 863 2HG ARG 136 HG1 ARG 136 -2.680 -1.693 -9.735 864 1HD ARG 136 HD2 ARG 136 -4.516 -3.215 -9.868 865 2HD ARG 136 HD1 ARG 136 -5.657 -1.943 -10.251 866 HE ARG 136 HE ARG 136 -3.445 -2.062 -12.040 867 1HH1 ARG 136 1HH1 ARG 136 -6.566 -3.507 -11.300 868 2HH1 ARG 136 2HH1 ARG 136 -6.883 -4.062 -12.873 869 1HH2 ARG 136 1HH2 ARG 136 -3.867 -2.788 -14.269 870 2HH2 ARG 136 2HH2 ARG 136 -5.308 -3.627 -14.612 871 H ASP 137 HN ASP 137 -3.240 -2.135 -5.690 872 HA ASP 137 HA ASP 137 -5.110 -0.767 -4.040 873 1HB ASP 137 HB2 ASP 137 -4.690 -3.320 -4.379 874 2HB ASP 137 HB1 ASP 137 -3.495 -3.120 -3.104 875 H LEU 138 HN LEU 138 -1.674 -1.352 -3.930 876 HA LEU 138 HA LEU 138 -1.111 -0.218 -1.419 877 1HB LEU 138 HB2 LEU 138 0.502 -1.624 -2.455 878 2HB LEU 138 HB1 LEU 138 0.510 -0.667 -3.913 879 HG LEU 138 HG LEU 138 1.753 1.102 -2.788 880 1HD1 LEU 138 HD1 LEU 138 1.618 -0.674 -0.370 881 2HD1 LEU 138 HD1 LEU 138 2.589 0.799 -0.554 882 3HD1 LEU 138 HD1 LEU 138 0.830 0.903 -0.572 883 1HD2 LEU 138 HD2 LEU 138 2.920 -1.628 -2.319 884 2HD2 LEU 138 HD2 LEU 138 2.997 -0.700 -3.815 885 3HD2 LEU 138 HD2 LEU 138 3.824 -0.120 -2.368 886 H ASP 139 HN ASP 139 -1.205 1.137 -4.677 887 HA ASP 139 HA ASP 139 -0.249 3.702 -4.067 888 1HB ASP 139 HB2 ASP 139 -0.480 2.769 -6.356 889 2HB ASP 139 HB1 ASP 139 -2.217 2.939 -6.252 890 H LYS 140 HN LYS 140 -3.542 2.471 -4.310 891 HA LYS 140 HA LYS 140 -4.938 4.785 -3.608 892 1HB LYS 140 HB2 LYS 140 -5.628 1.901 -3.089 893 2HB LYS 140 HB1 LYS 140 -6.714 3.247 -2.776 894 1HG LYS 140 HG2 LYS 140 -6.709 3.803 -5.162 895 2HG LYS 140 HG1 LYS 140 -5.589 2.474 -5.469 896 1HD LYS 140 HD2 LYS 140 -7.894 1.819 -6.015 897 2HD LYS 140 HD1 LYS 140 -7.266 0.868 -4.669 898 1HE LYS 140 HE2 LYS 140 -8.463 2.335 -3.093 899 2HE LYS 140 HE1 LYS 140 -9.108 3.259 -4.449 900 1HZ LYS 140 HZ1 LYS 140 -9.587 0.375 -3.970 901 2HZ LYS 140 HZ3 LYS 140 -10.650 1.584 -3.519 902 3HZ LYS 140 HZ2 LYS 140 -10.325 1.294 -5.153 903 H LEU 141 HN LEU 141 -3.570 2.262 -1.563 904 HA LEU 141 HA LEU 141 -4.599 3.124 0.908 905 1HB LEU 141 HB2 LEU 141 -3.646 0.924 0.673 906 2HB LEU 141 HB1 LEU 141 -2.093 1.595 0.231 907 HG LEU 141 HG LEU 141 -1.825 2.478 2.507 908 1HD1 LEU 141 HD1 LEU 141 -4.421 1.075 3.086 909 2HD1 LEU 141 HD1 LEU 141 -3.338 1.785 4.280 910 3HD1 LEU 141 HD1 LEU 141 -4.142 2.820 3.102 911 1HD2 LEU 141 HD2 LEU 141 -2.471 -0.460 2.386 912 2HD2 LEU 141 HD2 LEU 141 -0.932 0.286 1.959 913 3HD2 LEU 141 HD2 LEU 141 -1.503 0.331 3.626 914 H ILE 142 HN ILE 142 -1.607 3.837 -0.749 915 HA ILE 142 HA ILE 142 -0.570 5.462 1.301 916 HB ILE 142 HB ILE 142 0.174 5.276 -1.632 917 1HG1 ILE 142 2HG1 ILE 142 1.422 4.232 0.886 918 2HG1 ILE 142 1HG1 ILE 142 0.495 3.275 -0.264 919 1HG2 ILE 142 1HG2 ILE 142 1.623 6.707 0.609 920 2HG2 ILE 142 3HG2 ILE 142 2.252 6.450 -1.018 921 3HG2 ILE 142 2HG2 ILE 142 0.844 7.478 -0.775 922 1HD1 ILE 142 HD1 ILE 142 3.096 4.668 -0.820 923 2HD1 ILE 142 HD1 ILE 142 2.878 2.941 -0.489 924 3HD1 ILE 142 HD1 ILE 142 2.156 3.665 -1.925 925 H ASN 143 HN ASN 143 -2.155 6.270 -1.737 926 HA ASN 143 HA ASN 143 -2.211 9.048 -1.511 927 1HB ASN 143 HB2 ASN 143 -4.323 7.252 -2.721 928 2HB ASN 143 HB1 ASN 143 -4.254 8.992 -2.950 929 1HD2 ASN 143 HD2 ASN 143 -4.124 6.865 -4.883 930 2HD2 ASN 143 HD2 ASN 143 -2.625 6.989 -5.703 931 H LYS 144 HN LYS 144 -4.362 6.676 -0.131 932 HA LYS 144 HA LYS 144 -6.327 8.304 0.992 933 1HB LYS 144 HB2 LYS 144 -6.436 5.862 0.910 934 2HB LYS 144 HB1 LYS 144 -5.113 5.748 2.055 935 1HG LYS 144 HG2 LYS 144 -6.588 6.914 3.735 936 2HG LYS 144 HG1 LYS 144 -7.896 6.758 2.556 937 1HD LYS 144 HD2 LYS 144 -6.339 4.454 3.695 938 2HD LYS 144 HD1 LYS 144 -7.939 4.970 4.227 939 1HE LYS 144 HE2 LYS 144 -7.208 4.000 1.455 940 2HE LYS 144 HE1 LYS 144 -8.060 3.082 2.689 941 1HZ LYS 144 HZ1 LYS 144 -9.875 4.680 2.586 942 2HZ LYS 144 HZ3 LYS 144 -9.070 5.552 1.371 943 3HZ LYS 144 HZ2 LYS 144 -9.577 3.975 1.092 944 H PHE 145 HN PHE 145 -3.280 7.148 2.421 945 HA PHE 145 HA PHE 145 -3.678 8.703 4.760 946 1HB PHE 145 HB2 PHE 145 -1.420 6.973 3.824 947 2HB PHE 145 HB1 PHE 145 -1.231 8.005 5.242 948 HD1 PHE 145 HD1 PHE 145 -2.312 7.532 7.275 949 HD2 PHE 145 HD2 PHE 145 -3.106 5.153 3.850 950 HE1 PHE 145 HE1 PHE 145 -3.473 5.899 8.691 951 HE2 PHE 145 HE2 PHE 145 -4.271 3.508 5.264 952 HZ PHE 145 HZ PHE 145 -4.457 3.879 7.683 953 H MET 146 HN MET 146 -1.942 9.199 1.799 954 HA MET 146 HA MET 146 -0.413 11.442 2.670 955 1HB MET 146 HB2 MET 146 -1.369 10.913 -0.143 956 2HB MET 146 HB1 MET 146 -0.037 11.958 0.327 957 1HG MET 146 HG2 MET 146 0.935 9.731 1.327 958 2HG MET 146 HG1 MET 146 -0.237 9.007 0.254 959 1HE MET 146 HE2 MET 146 2.915 11.036 0.625 960 2HE MET 146 HE1 MET 146 3.289 11.597 -1.009 961 3HE MET 146 HE3 MET 146 1.895 12.249 -0.140 962 H ASN 147 HN ASN 147 -3.633 10.947 2.137 963 HA ASN 147 HA ASN 147 -5.530 12.096 2.224 964 1HB ASN 147 HB2 ASN 147 -4.368 13.446 4.009 965 2HB ASN 147 HB1 ASN 147 -3.901 14.598 2.761 966 1HD2 ASN 147 HD2 ASN 147 -5.029 16.232 3.778 967 2HD2 ASN 147 HD2 ASN 147 -6.746 16.356 3.755 968 H VAL 148 HN VAL 148 -4.620 11.485 -0.121 969 HA VAL 148 HA VAL 148 -5.175 13.780 -1.880 970 HB VAL 148 HB VAL 148 -4.317 11.000 -2.603 971 1HG1 VAL 148 1HG1 VAL 148 -4.393 13.546 -4.234 972 2HG1 VAL 148 3HG1 VAL 148 -3.755 12.004 -4.807 973 3HG1 VAL 148 2HG1 VAL 148 -5.464 12.157 -4.408 974 1HG2 VAL 148 2HG2 VAL 148 -2.555 12.086 -1.316 975 2HG2 VAL 148 1HG2 VAL 148 -2.056 11.897 -3.007 976 3HG2 VAL 148 3HG2 VAL 148 -2.610 13.464 -2.414 977 H LYS 149 HN LYS 149 -7.137 14.032 -2.129 978 HA LYS 149 HA LYS 149 -8.927 11.762 -2.081 979 1HB LYS 149 HB2 LYS 149 -9.528 14.714 -2.251 980 2HB LYS 149 HB1 LYS 149 -10.691 13.424 -1.991 981 1HG LYS 149 HG2 LYS 149 -9.772 12.951 0.193 982 2HG LYS 149 HG1 LYS 149 -8.450 14.074 -0.084 983 1HD LYS 149 HD2 LYS 149 -10.212 15.040 1.373 984 2HD LYS 149 HD1 LYS 149 -10.001 15.957 -0.113 985 1HE LYS 149 HE2 LYS 149 -11.950 14.794 -1.077 986 2HE LYS 149 HE1 LYS 149 -12.167 13.921 0.438 987 1HZ LYS 149 HZ1 LYS 149 -12.302 16.875 0.138 988 2HZ LYS 149 HZ3 LYS 149 -13.631 15.865 0.190 989 3HZ LYS 149 HZ2 LYS 149 -12.639 16.020 1.541 990 H ASP 150 HN ASP 150 -8.778 10.805 -4.091 991 HA ASP 150 HA ASP 150 -9.275 12.610 -6.335 992 1HB ASP 150 HB2 ASP 150 -7.029 11.827 -6.603 993 2HB ASP 150 HB1 ASP 150 -7.537 10.153 -6.412 994 H LYS 151 HN LYS 151 -11.095 12.482 -7.041 995 HA LYS 151 HA LYS 151 -12.003 10.018 -8.226 996 1HB LYS 151 HB2 LYS 151 -14.311 10.388 -7.495 997 2HB LYS 151 HB1 LYS 151 -13.235 10.293 -6.101 998 1HG LYS 151 HG2 LYS 151 -13.338 12.633 -5.749 999 2HG LYS 151 HG1 LYS 151 -14.203 12.879 -7.270 1000 1HD LYS 151 HD2 LYS 151 -16.052 11.491 -6.394 1001 2HD LYS 151 HD1 LYS 151 -15.200 11.387 -4.853 1002 1HE LYS 151 HE2 LYS 151 -15.381 13.754 -4.533 1003 2HE LYS 151 HE1 LYS 151 -16.034 13.968 -6.161 1004 1HZ LYS 151 HZ3 LYS 151 -17.341 12.453 -3.981 1005 2HZ LYS 151 HZ2 LYS 151 -17.783 13.996 -4.489 1006 3HZ LYS 151 HZ1 LYS 151 -17.940 12.680 -5.525 1007 H VAL 152 HN VAL 152 -10.593 12.526 -8.818 1008 HA VAL 152 HA VAL 152 -12.540 13.978 -10.430 1009 HB VAL 152 HB VAL 152 -10.868 15.808 -10.559 1010 1HG1 VAL 152 1HG1 VAL 152 -11.586 14.943 -7.768 1011 2HG1 VAL 152 3HG1 VAL 152 -11.070 16.564 -8.228 1012 3HG1 VAL 152 2HG1 VAL 152 -12.576 15.908 -8.864 1013 1HG2 VAL 152 1HG2 VAL 152 -9.283 14.136 -8.601 1014 2HG2 VAL 152 3HG2 VAL 152 -8.810 14.515 -10.257 1015 3HG2 VAL 152 2HG2 VAL 152 -8.919 15.799 -9.052 1016 H HIS 153 HN HIS 153 -9.782 11.937 -10.603 1017 HA HIS 153 HA HIS 153 -9.478 12.474 -13.449 1018 1HB HIS 153 HB2 HIS 153 -8.103 10.410 -11.723 1019 2HB HIS 153 HB1 HIS 153 -7.729 10.729 -13.408 1020 HD1 HIS 153 HD1 HIS 153 -6.822 11.643 -10.046 1021 HD2 HIS 153 HD2 HIS 153 -6.609 13.415 -13.785 1022 HE1 HIS 153 HE1 HIS 153 -5.063 13.458 -9.852 1023 H LYS 154 HN LYS 154 -11.218 10.474 -11.420 1024 HA LYS 154 HA LYS 154 -12.426 9.070 -13.621 1025 1HB LYS 154 HB2 LYS 154 -10.512 7.624 -13.274 1026 2HB LYS 154 HB1 LYS 154 -10.849 7.532 -11.554 1027 1HG LYS 154 HG2 LYS 154 -12.888 6.304 -11.962 1028 2HG LYS 154 HG1 LYS 154 -12.688 6.479 -13.699 1029 1HD LYS 154 HD2 LYS 154 -10.755 5.024 -11.891 1030 2HD LYS 154 HD1 LYS 154 -12.041 4.243 -12.805 1031 1HE LYS 154 HE2 LYS 154 -9.728 5.810 -13.978 1032 2HE LYS 154 HE1 LYS 154 -9.881 4.061 -13.943 1033 1HZ LYS 154 HZ1 LYS 154 -11.928 4.315 -15.306 1034 2HZ LYS 154 HZ3 LYS 154 -11.594 5.959 -15.479 1035 3HZ LYS 154 HZ2 LYS 154 -10.537 4.799 -16.077 1036 H LEU 155 HN LEU 155 -14.502 9.000 -13.251 1037 HA LEU 155 HA LEU 155 -16.498 8.973 -12.404 1038 1HB LEU 155 HB2 LEU 155 -15.061 7.192 -10.588 1039 2HB LEU 155 HB1 LEU 155 -16.821 7.393 -10.453 1040 HG LEU 155 HG LEU 155 -15.265 6.300 -12.820 1041 1HD1 LEU 155 HD1 LEU 155 -17.089 4.982 -10.840 1042 2HD1 LEU 155 HD1 LEU 155 -16.370 4.197 -12.253 1043 3HD1 LEU 155 HD1 LEU 155 -15.340 4.776 -10.936 1044 1HD2 LEU 155 HD2 LEU 155 -18.242 6.580 -12.404 1045 2HD2 LEU 155 HD2 LEU 155 -17.269 7.494 -13.562 1046 3HD2 LEU 155 HD2 LEU 155 -17.466 5.757 -13.755 1047 H GLU 156 HN GLU 156 -17.176 10.803 -11.869 1048 HA GLU 156 HA GLU 156 -16.388 12.405 -9.680 1049 1HB GLU 156 HB2 GLU 156 -19.056 12.516 -11.116 1050 2HB GLU 156 HB1 GLU 156 -18.411 13.759 -10.068 1051 1HG GLU 156 HG2 GLU 156 -18.098 14.537 -12.256 1052 2HG GLU 156 HG1 GLU 156 -16.513 13.977 -11.736 1053 H HIS 157 HN HIS 157 -19.291 10.400 -10.124 1054 HA HIS 157 HA HIS 157 -19.617 10.613 -7.274 1055 1HB HIS 157 HB2 HIS 157 -21.841 9.516 -7.542 1056 2HB HIS 157 HB1 HIS 157 -21.729 11.118 -8.263 1057 HD1 HIS 157 HD1 HIS 157 -22.888 7.729 -8.925 1058 HD2 HIS 157 HD2 HIS 157 -21.469 10.900 -11.211 1059 HE1 HIS 157 HE1 HIS 157 -23.702 7.322 -11.259 1060 H HIS 158 HN HIS 158 -17.862 9.444 -6.879 1061 HA HIS 158 HA HIS 158 -18.564 6.703 -6.521 1062 1HB HIS 158 HB2 HIS 158 -17.318 6.651 -8.640 1063 2HB HIS 158 HB1 HIS 158 -15.957 7.469 -7.882 1064 HD1 HIS 158 HD1 HIS 158 -17.461 4.107 -8.415 1065 HD2 HIS 158 HD2 HIS 158 -14.485 5.805 -6.067 1066 HE1 HIS 158 HE1 HIS 158 -16.105 2.197 -7.527 1067 H HIS 159 HN HIS 159 -18.616 6.931 -4.438 1068 HA HIS 159 HA HIS 159 -16.124 7.154 -3.010 1069 1HB HIS 159 HB2 HIS 159 -16.884 9.542 -3.083 1070 2HB HIS 159 HB1 HIS 159 -18.411 9.062 -2.360 1071 HD1 HIS 159 HD1 HIS 159 -14.831 9.762 -1.488 1072 HD2 HIS 159 HD2 HIS 159 -18.320 8.491 0.372 1073 HE1 HIS 159 HE1 HIS 159 -14.411 9.946 0.986 1074 H HIS 160 HN HIS 160 -19.629 7.048 -2.835 1075 HA HIS 160 HA HIS 160 -19.831 4.463 -1.875 1076 1HB HIS 160 HB2 HIS 160 -18.963 5.473 0.274 1077 2HB HIS 160 HB1 HIS 160 -20.313 6.600 0.253 1078 HD1 HIS 160 HD1 HIS 160 -19.457 3.025 1.057 1079 HD2 HIS 160 HD2 HIS 160 -22.803 5.490 0.932 1080 HE1 HIS 160 HE1 HIS 160 -21.271 1.803 2.283 1081 H HIS 161 HN HIS 161 -21.992 3.875 -2.166 1082 HA HIS 161 HA HIS 161 -23.861 6.076 -2.536 1083 1HB HIS 161 HB2 HIS 161 -24.842 5.032 -4.517 1084 2HB HIS 161 HB1 HIS 161 -23.149 5.388 -4.807 1085 HD1 HIS 161 HD1 HIS 161 -25.503 2.403 -4.234 1086 HD2 HIS 161 HD2 HIS 161 -21.599 3.222 -5.472 1087 HE1 HIS 161 HE1 HIS 161 -24.633 0.294 -5.230 1088 H HIS 162 HN HIS 162 -26.067 5.343 -2.497 1089 HA HIS 162 HA HIS 162 -26.385 3.029 -0.786 1090 1HB HIS 162 HB2 HIS 162 -28.756 4.023 -0.447 1091 2HB HIS 162 HB1 HIS 162 -27.418 4.875 0.302 1092 HD1 HIS 162 HD1 HIS 162 -29.116 5.134 -3.076 1093 HD2 HIS 162 HD2 HIS 162 -27.785 7.513 0.028 1094 HE1 HIS 162 HE1 HIS 162 -29.652 7.535 -3.752 No H/Q in entry = 1094 Start of MODEL 28 1 H1 MET 1 HT2 MET 1 18.797 -16.841 -4.365 2 H2 MET 1 HT1 MET 1 20.399 -16.249 -4.224 3 H3 MET 1 HT3 MET 1 19.912 -17.622 -3.389 4 HA MET 1 HA MET 1 20.052 -15.928 -1.891 5 1HB MET 1 HB2 MET 1 18.694 -13.877 -2.081 6 2HB MET 1 HB1 MET 1 19.868 -14.024 -3.377 7 1HG MET 1 HG2 MET 1 18.026 -14.853 -4.848 8 2HG MET 1 HG1 MET 1 16.897 -14.503 -3.540 9 1HE MET 1 HE3 MET 1 19.439 -13.057 -6.113 10 2HE MET 1 HE2 MET 1 19.399 -11.327 -5.776 11 3HE MET 1 HE1 MET 1 20.121 -12.435 -4.611 12 H GLU 2 HN GLU 2 18.729 -15.948 -0.133 13 HA GLU 2 HA GLU 2 16.528 -17.833 -0.433 14 1HB GLU 2 HB2 GLU 2 16.722 -18.093 2.023 15 2HB GLU 2 HB1 GLU 2 18.181 -18.523 1.141 16 1HG GLU 2 HG2 GLU 2 19.055 -16.252 1.743 17 2HG GLU 2 HG1 GLU 2 17.651 -16.092 2.806 18 H MET 3 HN MET 3 14.580 -17.572 0.747 19 HA MET 3 HA MET 3 13.475 -15.048 0.135 20 1HB MET 3 HB2 MET 3 12.273 -17.405 1.578 21 2HB MET 3 HB1 MET 3 11.369 -15.956 1.169 22 1HG MET 3 HG2 MET 3 11.834 -16.363 -1.216 23 2HG MET 3 HG1 MET 3 12.686 -17.843 -0.778 24 1HE MET 3 HE3 MET 3 11.512 -19.959 0.306 25 2HE MET 3 HE2 MET 3 10.816 -18.977 1.594 26 3HE MET 3 HE1 MET 3 9.785 -20.055 0.663 27 H GLY 4 HN GLY 4 14.793 -16.409 2.981 28 1HA GLY 4 HA1 GLY 4 15.227 -15.502 5.050 29 2HA GLY 4 HA2 GLY 4 13.612 -14.813 4.957 30 H GLN 5 HN GLN 5 16.514 -14.207 3.005 31 HA GLN 5 HA GLN 5 16.870 -11.621 4.221 32 1HB GLN 5 HB2 GLN 5 18.268 -12.770 1.797 33 2HB GLN 5 HB1 GLN 5 18.727 -11.316 2.678 34 1HG GLN 5 HG2 GLN 5 19.100 -12.724 4.695 35 2HG GLN 5 HG1 GLN 5 18.778 -14.135 3.686 36 1HE2 GLN 5 1HE2 GLN 5 21.184 -13.343 5.144 37 2HE2 GLN 5 2HE2 GLN 5 22.447 -13.302 3.986 38 H LEU 6 HN LEU 6 15.403 -12.930 1.402 39 HA LEU 6 HA LEU 6 15.070 -10.551 -0.068 40 1HB LEU 6 HB2 LEU 6 14.833 -12.841 -0.998 41 2HB LEU 6 HB1 LEU 6 13.418 -13.080 -0.006 42 HG LEU 6 HG LEU 6 13.073 -12.686 -2.490 43 1HD1 LEU 6 HD1 LEU 6 11.590 -10.937 -0.555 44 2HD1 LEU 6 HD1 LEU 6 11.048 -11.363 -2.181 45 3HD1 LEU 6 HD1 LEU 6 11.225 -12.615 -0.952 46 1HD2 LEU 6 HD2 LEU 6 13.680 -9.845 -1.684 47 2HD2 LEU 6 HD2 LEU 6 14.622 -10.842 -2.793 48 3HD2 LEU 6 HD2 LEU 6 12.988 -10.339 -3.224 49 H LYS 7 HN LYS 7 13.034 -12.209 2.304 50 HA LYS 7 HA LYS 7 10.939 -10.391 2.415 51 1HB LYS 7 HB2 LYS 7 11.934 -12.597 4.073 52 2HB LYS 7 HB1 LYS 7 11.133 -11.326 4.996 53 1HG LYS 7 HG2 LYS 7 9.841 -12.448 2.575 54 2HG LYS 7 HG1 LYS 7 9.720 -13.259 4.139 55 1HD LYS 7 HD2 LYS 7 9.155 -10.328 3.934 56 2HD LYS 7 HD1 LYS 7 7.916 -11.484 3.440 57 1HE LYS 7 HE2 LYS 7 7.626 -10.744 5.779 58 2HE LYS 7 HE1 LYS 7 7.937 -12.477 5.658 59 1HZ LYS 7 HZ3 LYS 7 9.932 -10.404 6.555 60 2HZ LYS 7 HZ2 LYS 7 9.094 -11.483 7.507 61 3HZ LYS 7 HZ1 LYS 7 10.204 -12.064 6.422 62 H ASN 8 HN ASN 8 14.026 -10.413 4.059 63 HA ASN 8 HA ASN 8 13.564 -8.235 5.783 64 1HB ASN 8 HB2 ASN 8 15.472 -9.838 5.999 65 2HB ASN 8 HB1 ASN 8 16.183 -9.158 4.551 66 1HD2 ASN 8 HD2 ASN 8 17.271 -9.404 7.224 67 2HD2 ASN 8 HD2 ASN 8 17.679 -7.802 7.732 68 H LYS 9 HN LYS 9 14.843 -8.412 2.478 69 HA LYS 9 HA LYS 9 15.448 -5.701 2.041 70 1HB LYS 9 HB2 LYS 9 14.296 -7.672 0.059 71 2HB LYS 9 HB1 LYS 9 15.023 -6.130 -0.345 72 1HG LYS 9 HG2 LYS 9 16.431 -8.473 0.916 73 2HG LYS 9 HG1 LYS 9 16.518 -8.003 -0.781 74 1HD LYS 9 HD2 LYS 9 17.469 -5.822 -0.069 75 2HD LYS 9 HD1 LYS 9 17.476 -6.410 1.597 76 1HE LYS 9 HE2 LYS 9 19.665 -6.697 0.632 77 2HE LYS 9 HE1 LYS 9 18.919 -8.272 0.906 78 1HZ LYS 9 HZ2 LYS 9 18.316 -8.324 -1.457 79 2HZ LYS 9 HZ1 LYS 9 19.060 -6.849 -1.692 80 3HZ LYS 9 HZ3 LYS 9 19.980 -8.189 -1.265 81 H ILE 10 HN ILE 10 12.501 -7.507 1.430 82 HA ILE 10 HA ILE 10 10.894 -5.443 0.486 83 HB ILE 10 HB ILE 10 10.172 -7.998 1.940 84 1HG1 ILE 10 2HG1 ILE 10 10.062 -7.199 -0.956 85 2HG1 ILE 10 1HG1 ILE 10 11.301 -8.226 -0.235 86 1HG2 ILE 10 2HG2 ILE 10 8.357 -6.356 2.211 87 2HG2 ILE 10 1HG2 ILE 10 8.306 -6.144 0.463 88 3HG2 ILE 10 3HG2 ILE 10 7.876 -7.703 1.171 89 1HD1 ILE 10 HD1 ILE 10 8.371 -8.834 -0.492 90 2HD1 ILE 10 HD1 ILE 10 9.678 -9.518 -1.462 91 3HD1 ILE 10 HD1 ILE 10 9.574 -9.882 0.258 92 H GLU 11 HN GLU 11 11.243 -6.697 3.769 93 HA GLU 11 HA GLU 11 9.494 -4.938 5.035 94 1HB GLU 11 HB2 GLU 11 11.961 -6.309 6.069 95 2HB GLU 11 HB1 GLU 11 10.835 -5.427 7.092 96 1HG GLU 11 HG2 GLU 11 9.065 -6.966 6.471 97 2HG GLU 11 HG1 GLU 11 10.175 -7.827 5.407 98 H ASN 12 HN ASN 12 12.993 -4.708 4.618 99 HA ASN 12 HA ASN 12 13.378 -2.269 5.912 100 1HB ASN 12 HB2 ASN 12 15.222 -3.750 5.371 101 2HB ASN 12 HB1 ASN 12 14.938 -3.524 3.652 102 1HD2 ASN 12 HD2 ASN 12 15.731 -1.715 2.656 103 2HD2 ASN 12 HD2 ASN 12 16.754 -0.577 3.421 104 H LYS 13 HN LYS 13 12.722 -2.923 2.495 105 HA LYS 13 HA LYS 13 12.939 -0.236 1.639 106 1HB LYS 13 HB2 LYS 13 13.014 -2.442 0.280 107 2HB LYS 13 HB1 LYS 13 11.269 -2.378 0.330 108 1HG LYS 13 HG2 LYS 13 12.140 -1.512 -1.777 109 2HG LYS 13 HG1 LYS 13 11.270 -0.270 -0.873 110 1HD LYS 13 HD2 LYS 13 13.311 0.637 -1.835 111 2HD LYS 13 HD1 LYS 13 13.411 0.652 -0.081 112 1HE LYS 13 HE2 LYS 13 15.503 -0.014 -0.842 113 2HE LYS 13 HE1 LYS 13 14.741 -1.503 -0.305 114 1HZ LYS 13 HZ3 LYS 13 14.233 -1.983 -2.689 115 2HZ LYS 13 HZ2 LYS 13 15.058 -0.544 -3.101 116 3HZ LYS 13 HZ1 LYS 13 15.874 -1.797 -2.367 117 H LYS 14 HN LYS 14 10.191 -2.254 2.589 118 HA LYS 14 HA LYS 14 8.042 -0.546 2.348 119 1HB LYS 14 HB2 LYS 14 7.920 -2.916 2.925 120 2HB LYS 14 HB1 LYS 14 8.727 -2.603 4.444 121 1HG LYS 14 HG2 LYS 14 6.753 -1.249 5.132 122 2HG LYS 14 HG1 LYS 14 5.945 -1.752 3.645 123 1HD LYS 14 HD2 LYS 14 5.201 -3.258 5.339 124 2HD LYS 14 HD1 LYS 14 6.381 -4.139 4.366 125 1HE LYS 14 HE2 LYS 14 8.113 -3.467 6.116 126 2HE LYS 14 HE1 LYS 14 6.726 -2.891 7.044 127 1HZ LYS 14 HZ3 LYS 14 5.847 -5.229 7.010 128 2HZ LYS 14 HZ2 LYS 14 7.210 -5.684 6.174 129 3HZ LYS 14 HZ1 LYS 14 7.364 -5.111 7.741 130 H LYS 15 HN LYS 15 10.330 -1.001 5.030 131 HA LYS 15 HA LYS 15 9.146 0.913 6.729 132 1HB LYS 15 HB2 LYS 15 11.932 -0.266 6.816 133 2HB LYS 15 HB1 LYS 15 11.188 0.671 8.106 134 1HG LYS 15 HG2 LYS 15 9.486 -1.004 8.424 135 2HG LYS 15 HG1 LYS 15 10.060 -1.908 7.026 136 1HD LYS 15 HD2 LYS 15 10.887 -3.051 8.921 137 2HD LYS 15 HD1 LYS 15 12.257 -2.158 8.268 138 1HE LYS 15 HE2 LYS 15 12.223 -1.961 10.667 139 2HE LYS 15 HE1 LYS 15 11.862 -0.393 9.950 140 1HZ LYS 15 HZ2 LYS 15 9.801 -2.279 10.992 141 2HZ LYS 15 HZ1 LYS 15 10.381 -0.933 11.817 142 3HZ LYS 15 HZ3 LYS 15 9.517 -0.749 10.395 143 H GLU 16 HN GLU 16 11.790 1.134 4.381 144 HA GLU 16 HA GLU 16 12.537 3.820 4.917 145 1HB GLU 16 HB2 GLU 16 12.513 2.311 2.306 146 2HB GLU 16 HB1 GLU 16 13.183 3.920 2.464 147 1HG GLU 16 HG2 GLU 16 14.740 2.867 4.191 148 2HG GLU 16 HG1 GLU 16 14.181 1.318 3.547 149 H LEU 17 HN LEU 17 9.953 2.409 3.111 150 HA LEU 17 HA LEU 17 9.045 4.841 2.003 151 1HB LEU 17 HB2 LEU 17 8.562 2.870 0.792 152 2HB LEU 17 HB1 LEU 17 7.902 2.069 2.193 153 HG LEU 17 HG LEU 17 6.252 2.718 0.418 154 1HD1 LEU 17 HD1 LEU 17 5.577 2.073 2.485 155 2HD1 LEU 17 HD1 LEU 17 5.694 3.726 3.093 156 3HD1 LEU 17 HD1 LEU 17 4.538 3.338 1.799 157 1HD2 LEU 17 HD2 LEU 17 6.836 5.482 1.394 158 2HD2 LEU 17 HD2 LEU 17 7.140 4.864 -0.232 159 3HD2 LEU 17 HD2 LEU 17 5.481 5.019 0.363 160 H ILE 18 HN ILE 18 8.055 2.886 4.771 161 HA ILE 18 HA ILE 18 5.848 4.379 5.434 162 HB ILE 18 HB ILE 18 7.718 2.971 7.390 163 1HG1 ILE 18 2HG1 ILE 18 5.112 1.991 6.220 164 2HG1 ILE 18 1HG1 ILE 18 6.679 1.614 5.523 165 1HG2 ILE 18 3HG2 ILE 18 6.245 4.572 8.579 166 2HG2 ILE 18 2HG2 ILE 18 4.837 3.875 7.810 167 3HG2 ILE 18 1HG2 ILE 18 5.779 2.915 8.942 168 1HD1 ILE 18 HD1 ILE 18 5.747 0.857 8.283 169 2HD1 ILE 18 HD1 ILE 18 5.866 -0.209 6.872 170 3HD1 ILE 18 HD1 ILE 18 7.321 0.488 7.573 171 H GLN 19 HN GLN 19 9.208 4.751 6.272 172 HA GLN 19 HA GLN 19 9.019 7.007 7.939 173 1HB GLN 19 HB2 GLN 19 11.281 5.884 6.297 174 2HB GLN 19 HB1 GLN 19 11.478 7.275 7.361 175 1HG GLN 19 HG2 GLN 19 10.979 5.976 9.285 176 2HG GLN 19 HG1 GLN 19 10.447 4.614 8.304 177 1HE2 GLN 19 1HE2 GLN 19 12.473 4.811 10.385 178 2HE2 GLN 19 2HE2 GLN 19 13.952 4.262 9.677 179 H LEU 20 HN LEU 20 9.179 6.680 4.460 180 HA LEU 20 HA LEU 20 9.517 9.454 3.944 181 1HB LEU 20 HB2 LEU 20 8.563 7.191 2.204 182 2HB LEU 20 HB1 LEU 20 8.597 8.850 1.647 183 HG LEU 20 HG LEU 20 11.030 7.309 2.554 184 1HD1 LEU 20 HD1 LEU 20 10.080 6.379 0.509 185 2HD1 LEU 20 HD1 LEU 20 10.064 7.987 -0.213 186 3HD1 LEU 20 HD1 LEU 20 11.597 7.218 0.194 187 1HD2 LEU 20 HD2 LEU 20 10.695 9.994 1.220 188 2HD2 LEU 20 HD2 LEU 20 11.277 9.700 2.861 189 3HD2 LEU 20 HD2 LEU 20 12.235 9.174 1.482 190 H VAL 21 HN VAL 21 6.628 7.319 3.811 191 HA VAL 21 HA VAL 21 4.785 9.395 3.370 192 HB VAL 21 HB VAL 21 4.204 6.918 5.020 193 1HG1 VAL 21 1HG1 VAL 21 2.431 8.587 4.983 194 2HG1 VAL 21 3HG1 VAL 21 2.425 8.556 3.222 195 3HG1 VAL 21 2HG1 VAL 21 1.946 7.119 4.128 196 1HG2 VAL 21 2HG2 VAL 21 4.252 7.204 2.025 197 2HG2 VAL 21 1HG2 VAL 21 5.330 6.227 3.029 198 3HG2 VAL 21 3HG2 VAL 21 3.621 5.807 2.914 199 H ALA 22 HN ALA 22 6.232 8.231 6.339 200 HA ALA 22 HA ALA 22 4.607 9.648 8.138 201 1HB ALA 22 HB3 ALA 22 7.428 8.682 8.500 202 2HB ALA 22 HB2 ALA 22 6.305 9.133 9.803 203 3HB ALA 22 HB1 ALA 22 5.966 7.741 8.774 204 H ARG 23 HN ARG 23 7.839 10.432 6.807 205 HA ARG 23 HA ARG 23 8.146 12.870 8.196 206 1HB ARG 23 HB2 ARG 23 9.996 13.367 6.736 207 2HB ARG 23 HB1 ARG 23 10.043 11.658 7.138 208 1HG ARG 23 HG2 ARG 23 9.075 11.130 4.966 209 2HG ARG 23 HG1 ARG 23 9.027 12.838 4.553 210 1HD ARG 23 HD2 ARG 23 10.977 11.875 3.544 211 2HD ARG 23 HD1 ARG 23 11.495 12.914 4.866 212 HE ARG 23 HE ARG 23 11.221 10.025 5.266 213 1HH1 ARG 23 1HH1 ARG 23 13.284 12.910 5.272 214 2HH1 ARG 23 2HH1 ARG 23 14.645 12.109 5.894 215 1HH2 ARG 23 1HH2 ARG 23 13.124 8.921 6.062 216 2HH2 ARG 23 2HH2 ARG 23 14.555 9.787 6.348 217 H HIS 24 HN HIS 24 6.318 12.091 5.462 218 HA HIS 24 HA HIS 24 5.971 14.484 4.151 219 1HB HIS 24 HB2 HIS 24 4.953 12.553 3.213 220 2HB HIS 24 HB1 HIS 24 4.159 12.156 4.713 221 HD1 HIS 24 HD1 HIS 24 1.725 12.505 4.603 222 HD2 HIS 24 HD2 HIS 24 3.774 15.226 2.224 223 HE1 HIS 24 HE1 HIS 24 -0.020 13.972 3.559 224 H GLY 25 HN GLY 25 4.541 13.329 7.126 225 1HA GLY 25 HA1 GLY 25 3.074 15.855 7.414 226 2HA GLY 25 HA2 GLY 25 4.169 15.328 8.689 227 H LEU 26 HN LEU 26 3.588 12.539 8.522 228 HA LEU 26 HA LEU 26 0.757 12.391 8.979 229 1HB LEU 26 HB2 LEU 26 2.921 10.348 9.007 230 2HB LEU 26 HB1 LEU 26 1.374 9.986 9.707 231 HG LEU 26 HG LEU 26 2.068 10.523 6.868 232 1HD1 LEU 26 HD1 LEU 26 0.830 8.180 8.238 233 2HD1 LEU 26 HD1 LEU 26 0.987 8.353 6.493 234 3HD1 LEU 26 HD1 LEU 26 2.433 8.289 7.505 235 1HD2 LEU 26 HD2 LEU 26 -0.699 10.475 8.055 236 2HD2 LEU 26 HD2 LEU 26 0.054 11.781 7.160 237 3HD2 LEU 26 HD2 LEU 26 -0.366 10.284 6.333 238 H ASP 27 HN ASP 27 -0.202 11.864 10.774 239 HA ASP 27 HA ASP 27 0.915 12.756 13.238 240 1HB ASP 27 HB2 ASP 27 -1.580 11.053 12.877 241 2HB ASP 27 HB1 ASP 27 -1.210 12.154 14.180 242 H HIS 28 HN HIS 28 1.048 11.168 15.114 243 HA HIS 28 HA HIS 28 2.761 9.029 14.441 244 1HB HIS 28 HB2 HIS 28 2.823 10.138 16.655 245 2HB HIS 28 HB1 HIS 28 1.230 9.496 17.022 246 HD1 HIS 28 HD1 HIS 28 1.436 7.586 18.639 247 HD2 HIS 28 HD2 HIS 28 4.601 7.736 15.952 248 HE1 HIS 28 HE1 HIS 28 2.937 5.642 19.212 249 H ASP 29 HN ASP 29 -0.616 9.198 15.197 250 HA ASP 29 HA ASP 29 -1.188 6.444 15.206 251 1HB ASP 29 HB2 ASP 29 -2.974 8.825 14.717 252 2HB ASP 29 HB1 ASP 29 -3.573 7.176 14.821 253 H LYS 30 HN LYS 30 -0.673 8.624 12.700 254 HA LYS 30 HA LYS 30 -2.175 7.193 10.683 255 1HB LYS 30 HB2 LYS 30 -0.193 9.416 10.556 256 2HB LYS 30 HB1 LYS 30 -0.912 8.826 9.093 257 1HG LYS 30 HG2 LYS 30 -2.339 10.014 11.467 258 2HG LYS 30 HG1 LYS 30 -1.976 10.863 9.961 259 1HD LYS 30 HD2 LYS 30 -3.477 9.340 8.789 260 2HD LYS 30 HD1 LYS 30 -3.776 8.462 10.290 261 1HE LYS 30 HE2 LYS 30 -5.582 10.048 9.805 262 2HE LYS 30 HE1 LYS 30 -4.741 10.442 11.301 263 1HZ LYS 30 HZ2 LYS 30 -4.231 11.770 8.686 264 2HZ LYS 30 HZ1 LYS 30 -5.202 12.391 9.914 265 3HZ LYS 30 HZ3 LYS 30 -3.553 12.194 10.192 266 H VAL 31 HN VAL 31 1.215 7.697 11.524 267 HA VAL 31 HA VAL 31 2.392 6.074 9.609 268 HB VAL 31 HB VAL 31 3.336 6.428 12.467 269 1HG1 VAL 31 2HG1 VAL 31 4.551 4.723 11.264 270 2HG1 VAL 31 1HG1 VAL 31 4.879 5.854 9.954 271 3HG1 VAL 31 3HG1 VAL 31 5.576 6.128 11.551 272 1HG2 VAL 31 2HG2 VAL 31 3.819 8.224 10.091 273 2HG2 VAL 31 1HG2 VAL 31 2.868 8.618 11.519 274 3HG2 VAL 31 3HG2 VAL 31 4.608 8.375 11.660 275 H LEU 32 HN LEU 32 1.133 5.320 12.836 276 HA LEU 32 HA LEU 32 1.940 2.650 12.702 277 1HB LEU 32 HB2 LEU 32 0.805 2.296 14.790 278 2HB LEU 32 HB1 LEU 32 1.675 3.831 14.762 279 HG LEU 32 HG LEU 32 -0.672 4.785 14.245 280 1HD1 LEU 32 HD1 LEU 32 -1.823 2.630 14.098 281 2HD1 LEU 32 HD1 LEU 32 -1.335 2.253 15.752 282 3HD1 LEU 32 HD1 LEU 32 -2.430 3.600 15.439 283 1HD2 LEU 32 HD2 LEU 32 0.379 3.834 16.855 284 2HD2 LEU 32 HD2 LEU 32 0.750 5.339 16.015 285 3HD2 LEU 32 HD2 LEU 32 -0.876 5.085 16.690 286 H LEU 33 HN LEU 33 -1.143 4.195 11.954 287 HA LEU 33 HA LEU 33 -2.536 1.751 11.512 288 1HB LEU 33 HB2 LEU 33 -3.096 4.511 10.431 289 2HB LEU 33 HB1 LEU 33 -4.154 3.123 10.266 290 HG LEU 33 HG LEU 33 -3.371 4.423 12.875 291 1HD1 LEU 33 HD1 LEU 33 -5.943 4.573 11.319 292 2HD1 LEU 33 HD1 LEU 33 -5.690 5.190 12.954 293 3HD1 LEU 33 HD1 LEU 33 -4.791 5.884 11.605 294 1HD2 LEU 33 HD2 LEU 33 -5.322 2.208 12.266 295 2HD2 LEU 33 HD2 LEU 33 -3.807 2.071 13.164 296 3HD2 LEU 33 HD2 LEU 33 -5.144 3.010 13.834 297 H PHE 34 HN PHE 34 -0.715 3.918 9.470 298 HA PHE 34 HA PHE 34 -1.306 2.680 7.033 299 1HB PHE 34 HB2 PHE 34 -0.379 4.911 7.084 300 2HB PHE 34 HB1 PHE 34 1.072 4.336 7.894 301 HD1 PHE 34 HD1 PHE 34 2.935 3.825 6.654 302 HD2 PHE 34 HD2 PHE 34 -0.869 3.888 4.752 303 HE1 PHE 34 HE1 PHE 34 4.013 3.449 4.471 304 HE2 PHE 34 HE2 PHE 34 0.217 3.516 2.578 305 HZ PHE 34 HZ PHE 34 2.667 3.288 2.464 306 H SER 35 HN SER 35 1.479 2.278 9.225 307 HA SER 35 HA SER 35 2.852 0.458 7.631 308 1HB SER 35 HB2 SER 35 4.058 -0.125 9.766 309 2HB SER 35 HB1 SER 35 4.014 1.592 9.362 310 HG SER 35 HG SER 35 2.809 1.984 11.011 311 H ARG 36 HN ARG 36 0.370 -0.117 10.050 312 HA ARG 36 HA ARG 36 0.802 -2.932 9.987 313 1HB ARG 36 HB2 ARG 36 -1.127 -3.163 11.429 314 2HB ARG 36 HB1 ARG 36 -0.054 -1.905 12.009 315 1HG ARG 36 HG2 ARG 36 -1.679 -0.299 10.809 316 2HG ARG 36 HG1 ARG 36 -2.784 -1.679 10.834 317 1HD ARG 36 HD2 ARG 36 -1.462 -0.375 13.208 318 2HD ARG 36 HD1 ARG 36 -3.167 -0.316 12.783 319 HE ARG 36 HE ARG 36 -3.290 -2.683 13.274 320 1HH1 ARG 36 1HH1 ARG 36 -0.295 -1.136 14.397 321 2HH1 ARG 36 2HH1 ARG 36 -0.132 -2.091 15.786 322 1HH2 ARG 36 1HH2 ARG 36 -3.068 -4.019 15.215 323 2HH2 ARG 36 2HH2 ARG 36 -1.751 -3.789 16.268 324 H ASP 37 HN ASP 37 -1.426 -0.795 8.294 325 HA ASP 37 HA ASP 37 -2.943 -2.969 7.186 326 1HB ASP 37 HB2 ASP 37 -3.653 -0.484 7.426 327 2HB ASP 37 HB1 ASP 37 -2.723 -0.222 5.956 328 H LEU 38 HN LEU 38 -0.353 -0.877 6.098 329 HA LEU 38 HA LEU 38 0.074 -1.747 3.502 330 1HB LEU 38 HB2 LEU 38 1.204 0.167 4.259 331 2HB LEU 38 HB1 LEU 38 1.883 -0.665 5.632 332 HG LEU 38 HG LEU 38 3.421 -1.875 4.126 333 1HD1 LEU 38 HD1 LEU 38 2.071 -1.890 2.113 334 2HD1 LEU 38 HD1 LEU 38 2.278 -0.137 1.951 335 3HD1 LEU 38 HD1 LEU 38 3.679 -1.218 1.848 336 1HD2 LEU 38 HD2 LEU 38 3.447 1.112 3.836 337 2HD2 LEU 38 HD2 LEU 38 4.125 0.177 5.169 338 3HD2 LEU 38 HD2 LEU 38 4.819 0.041 3.553 339 H ASP 39 HN ASP 39 1.486 -2.976 6.494 340 HA ASP 39 HA ASP 39 3.144 -4.913 5.323 341 1HB ASP 39 HB2 ASP 39 3.402 -4.107 7.633 342 2HB ASP 39 HB1 ASP 39 1.904 -4.911 8.078 343 H LYS 40 HN LYS 40 -0.203 -5.037 6.368 344 HA LYS 40 HA LYS 40 -0.409 -7.844 5.966 345 1HB LYS 40 HB2 LYS 40 -2.541 -5.754 6.353 346 2HB LYS 40 HB1 LYS 40 -2.856 -7.486 6.225 347 1HG LYS 40 HG2 LYS 40 -1.430 -7.873 8.189 348 2HG LYS 40 HG1 LYS 40 -1.157 -6.140 8.311 349 1HD LYS 40 HD2 LYS 40 -3.534 -5.783 8.716 350 2HD LYS 40 HD1 LYS 40 -3.829 -7.519 8.556 351 1HE LYS 40 HE2 LYS 40 -3.698 -6.910 10.910 352 2HE LYS 40 HE1 LYS 40 -2.340 -7.938 10.465 353 1HZ LYS 40 HZ2 LYS 40 -0.980 -5.889 10.254 354 2HZ LYS 40 HZ1 LYS 40 -2.295 -4.995 10.820 355 3HZ LYS 40 HZ3 LYS 40 -1.538 -6.123 11.810 356 H LEU 41 HN LEU 41 -1.174 -5.026 4.005 357 HA LEU 41 HA LEU 41 -2.399 -6.329 1.854 358 1HB LEU 41 HB2 LEU 41 -2.373 -3.910 1.948 359 2HB LEU 41 HB1 LEU 41 -0.626 -3.879 1.919 360 HG LEU 41 HG LEU 41 -0.687 -4.739 -0.422 361 1HD1 LEU 41 HD1 LEU 41 -2.888 -5.838 -0.315 362 2HD1 LEU 41 HD1 LEU 41 -3.647 -4.259 -0.272 363 3HD1 LEU 41 HD1 LEU 41 -2.726 -4.746 -1.691 364 1HD2 LEU 41 HD2 LEU 41 -2.182 -2.172 0.091 365 2HD2 LEU 41 HD2 LEU 41 -0.434 -2.371 -0.043 366 3HD2 LEU 41 HD2 LEU 41 -1.464 -2.645 -1.449 367 H ILE 42 HN ILE 42 0.967 -5.797 2.608 368 HA ILE 42 HA ILE 42 2.032 -6.910 0.241 369 HB ILE 42 HB ILE 42 3.297 -6.596 2.985 370 1HG1 ILE 42 2HG1 ILE 42 3.525 -4.959 0.465 371 2HG1 ILE 42 1HG1 ILE 42 2.621 -4.499 1.901 372 1HG2 ILE 42 1HG2 ILE 42 4.609 -7.237 0.338 373 2HG2 ILE 42 3HG2 ILE 42 5.459 -6.869 1.837 374 3HG2 ILE 42 2HG2 ILE 42 4.476 -8.327 1.719 375 1HD1 ILE 42 HD1 ILE 42 5.599 -4.890 1.742 376 2HD1 ILE 42 HD1 ILE 42 4.750 -3.339 1.747 377 3HD1 ILE 42 HD1 ILE 42 4.682 -4.386 3.163 378 H ASN 43 HN ASN 43 1.792 -8.299 3.488 379 HA ASN 43 HA ASN 43 2.640 -10.883 2.996 380 1HB ASN 43 HB2 ASN 43 0.452 -10.043 4.902 381 2HB ASN 43 HB1 ASN 43 1.211 -11.626 4.885 382 1HD2 ASN 43 HD2 ASN 43 1.060 -9.703 6.971 383 2HD2 ASN 43 HD2 ASN 43 2.682 -9.300 7.421 384 H LYS 44 HN LYS 44 -0.564 -9.539 2.570 385 HA LYS 44 HA LYS 44 -2.025 -11.823 1.985 386 1HB LYS 44 HB2 LYS 44 -3.026 -9.670 2.411 387 2HB LYS 44 HB1 LYS 44 -2.243 -9.010 0.985 388 1HG LYS 44 HG2 LYS 44 -3.626 -10.428 -0.440 389 2HG LYS 44 HG1 LYS 44 -4.384 -11.118 0.991 390 1HD LYS 44 HD2 LYS 44 -5.824 -9.409 0.082 391 2HD LYS 44 HD1 LYS 44 -5.121 -8.871 1.631 392 1HE LYS 44 HE2 LYS 44 -3.540 -7.596 0.500 393 2HE LYS 44 HE1 LYS 44 -4.140 -8.159 -1.066 394 1HZ LYS 44 HZ1 LYS 44 -5.735 -6.607 0.917 395 2HZ LYS 44 HZ3 LYS 44 -5.076 -5.935 -0.462 396 3HZ LYS 44 HZ2 LYS 44 -6.277 -7.092 -0.588 397 H PHE 45 HN PHE 45 -0.407 -9.608 -0.209 398 HA PHE 45 HA PHE 45 -0.935 -11.207 -2.515 399 1HB PHE 45 HB2 PHE 45 0.651 -8.750 -2.018 400 2HB PHE 45 HB1 PHE 45 0.977 -9.674 -3.482 401 HD1 PHE 45 HD1 PHE 45 -0.485 -9.670 -5.281 402 HD2 PHE 45 HD2 PHE 45 -1.681 -7.844 -1.620 403 HE1 PHE 45 HE1 PHE 45 -2.411 -8.683 -6.408 404 HE2 PHE 45 HE2 PHE 45 -3.603 -6.839 -2.762 405 HZ PHE 45 HZ PHE 45 -3.971 -7.259 -5.158 406 H MET 46 HN MET 46 1.791 -10.960 -0.375 407 HA MET 46 HA MET 46 3.660 -12.480 -1.936 408 1HB MET 46 HB2 MET 46 3.474 -12.422 1.070 409 2HB MET 46 HB1 MET 46 4.883 -12.843 0.105 410 1HG MET 46 HG2 MET 46 4.771 -10.396 -0.724 411 2HG MET 46 HG1 MET 46 3.625 -10.177 0.576 412 1HE MET 46 HE3 MET 46 7.178 -10.917 -0.430 413 2HE MET 46 HE2 MET 46 8.032 -11.269 1.075 414 3HE MET 46 HE1 MET 46 6.856 -12.421 0.425 415 H ASN 47 HN ASN 47 1.254 -13.269 0.446 416 HA ASN 47 HA ASN 47 0.292 -15.065 1.206 417 1HB ASN 47 HB2 ASN 47 -0.171 -15.742 -1.151 418 2HB ASN 47 HB1 ASN 47 1.383 -16.561 -1.214 419 1HD2 ASN 47 HD2 ASN 47 1.572 -18.553 -0.207 420 2HD2 ASN 47 HD2 ASN 47 0.219 -19.463 0.344 421 H VAL 48 HN VAL 48 1.974 -14.465 2.653 422 HA VAL 48 HA VAL 48 3.712 -16.746 3.162 423 HB VAL 48 HB VAL 48 4.956 -15.262 4.773 424 1HG1 VAL 48 2HG1 VAL 48 4.845 -14.242 1.938 425 2HG1 VAL 48 1HG1 VAL 48 6.152 -13.936 3.086 426 3HG1 VAL 48 3HG1 VAL 48 5.829 -15.578 2.532 427 1HG2 VAL 48 2HG2 VAL 48 3.188 -13.627 5.232 428 2HG2 VAL 48 1HG2 VAL 48 4.651 -12.824 4.662 429 3HG2 VAL 48 3HG2 VAL 48 3.283 -13.047 3.573 430 H LYS 49 HN LYS 49 3.425 -17.876 4.997 431 HA LYS 49 HA LYS 49 1.028 -17.066 6.433 432 1HB LYS 49 HB2 LYS 49 1.797 -19.904 5.760 433 2HB LYS 49 HB1 LYS 49 0.300 -19.361 6.502 434 1HG LYS 49 HG2 LYS 49 -0.197 -18.047 4.454 435 2HG LYS 49 HG1 LYS 49 1.235 -18.736 3.713 436 1HD LYS 49 HD2 LYS 49 -0.446 -20.080 2.883 437 2HD LYS 49 HD1 LYS 49 0.124 -21.002 4.270 438 1HE LYS 49 HE2 LYS 49 -2.261 -19.157 4.306 439 2HE LYS 49 HE1 LYS 49 -2.353 -20.889 4.036 440 1HZ LYS 49 HZ2 LYS 49 -1.440 -21.219 6.266 441 2HZ LYS 49 HZ1 LYS 49 -1.405 -19.555 6.538 442 3HZ LYS 49 HZ3 LYS 49 -2.867 -20.352 6.300 443 H ASP 50 HN ASP 50 4.106 -17.196 6.842 444 HA ASP 50 HA ASP 50 3.847 -18.064 9.612 445 1HB ASP 50 HB2 ASP 50 6.225 -18.476 9.795 446 2HB ASP 50 HB1 ASP 50 5.699 -19.266 8.328 447 H LYS 51 HN LYS 51 3.255 -16.474 10.725 448 HA LYS 51 HA LYS 51 4.621 -13.898 10.375 449 1HB LYS 51 HB2 LYS 51 2.580 -12.907 11.496 450 2HB LYS 51 HB1 LYS 51 2.299 -13.590 9.903 451 1HG LYS 51 HG2 LYS 51 1.381 -15.614 10.939 452 2HG LYS 51 HG1 LYS 51 1.645 -14.905 12.531 453 1HD LYS 51 HD2 LYS 51 0.095 -13.140 12.072 454 2HD LYS 51 HD1 LYS 51 -0.051 -13.645 10.389 455 1HE LYS 51 HE2 LYS 51 -1.064 -15.749 11.105 456 2HE LYS 51 HE1 LYS 51 -0.889 -15.271 12.789 457 1HZ LYS 51 HZ3 LYS 51 -2.535 -13.871 10.763 458 2HZ LYS 51 HZ2 LYS 51 -3.127 -14.884 11.969 459 3HZ LYS 51 HZ1 LYS 51 -2.381 -13.421 12.380 460 H VAL 52 HN VAL 52 4.951 -16.439 11.995 461 HA VAL 52 HA VAL 52 5.866 -15.190 14.421 462 HB VAL 52 HB VAL 52 4.998 -17.115 15.745 463 1HG1 VAL 52 3HG1 VAL 52 2.864 -15.361 14.521 464 2HG1 VAL 52 2HG1 VAL 52 2.691 -16.274 16.022 465 3HG1 VAL 52 1HG1 VAL 52 3.870 -14.967 15.915 466 1HG2 VAL 52 2HG2 VAL 52 4.534 -18.673 13.943 467 2HG2 VAL 52 1HG2 VAL 52 3.082 -18.413 14.913 468 3HG2 VAL 52 3HG2 VAL 52 3.249 -17.627 13.343 469 H HIS 53 HN HIS 53 7.297 -16.760 15.555 470 HA HIS 53 HA HIS 53 8.633 -18.380 13.559 471 1HB HIS 53 HB2 HIS 53 9.646 -17.256 16.174 472 2HB HIS 53 HB1 HIS 53 10.542 -18.458 15.252 473 HD1 HIS 53 HD1 HIS 53 12.147 -17.502 13.558 474 HD2 HIS 53 HD2 HIS 53 9.137 -14.819 14.573 475 HE1 HIS 53 HE1 HIS 53 12.650 -15.379 12.310 476 H LYS 54 HN LYS 54 6.590 -19.576 13.979 477 HA LYS 54 HA LYS 54 7.347 -21.951 15.458 478 1HB LYS 54 HB2 LYS 54 4.613 -20.643 15.665 479 2HB LYS 54 HB1 LYS 54 4.950 -22.286 16.174 480 1HG LYS 54 HG2 LYS 54 6.528 -21.409 17.855 481 2HG LYS 54 HG1 LYS 54 6.119 -19.772 17.357 482 1HD LYS 54 HD2 LYS 54 4.147 -21.793 18.450 483 2HD LYS 54 HD1 LYS 54 4.904 -20.517 19.395 484 1HE LYS 54 HE2 LYS 54 3.840 -18.830 17.936 485 2HE LYS 54 HE1 LYS 54 3.077 -20.122 17.015 486 1HZ LYS 54 HZ2 LYS 54 2.614 -19.571 19.901 487 2HZ LYS 54 HZ1 LYS 54 1.563 -19.170 18.662 488 3HZ LYS 54 HZ3 LYS 54 1.876 -20.788 19.005 489 H LEU 55 HN LEU 55 7.870 -22.729 13.416 490 HA LEU 55 HA LEU 55 5.931 -22.763 11.309 491 1HB LEU 55 HB2 LEU 55 8.474 -24.356 11.653 492 2HB LEU 55 HB1 LEU 55 7.487 -24.365 10.210 493 HG LEU 55 HG LEU 55 8.975 -21.982 11.309 494 1HD1 LEU 55 HD1 LEU 55 10.457 -23.675 10.388 495 2HD1 LEU 55 HD1 LEU 55 9.513 -23.707 8.900 496 3HD1 LEU 55 HD1 LEU 55 10.403 -22.251 9.350 497 1HD2 LEU 55 HD2 LEU 55 7.370 -22.299 8.767 498 2HD2 LEU 55 HD2 LEU 55 6.947 -21.287 10.150 499 3HD2 LEU 55 HD2 LEU 55 8.365 -20.904 9.183 500 H GLU 56 HN GLU 56 5.026 -24.711 10.406 501 HA GLU 56 HA GLU 56 3.747 -26.488 10.490 502 1HB GLU 56 HB2 GLU 56 5.632 -27.292 12.667 503 2HB GLU 56 HB1 GLU 56 4.210 -28.267 12.325 504 1HG GLU 56 HG2 GLU 56 6.300 -27.528 10.293 505 2HG GLU 56 HG1 GLU 56 6.249 -29.052 11.184 506 H HIS 57 HN HIS 57 1.828 -25.881 10.761 507 HA HIS 57 HA HIS 57 0.904 -24.956 13.343 508 1HB HIS 57 HB2 HIS 57 -0.482 -25.070 10.647 509 2HB HIS 57 HB1 HIS 57 -1.218 -24.430 12.115 510 HD1 HIS 57 HD1 HIS 57 -0.566 -22.037 12.802 511 HD2 HIS 57 HD2 HIS 57 1.643 -23.513 9.610 512 HE1 HIS 57 HE1 HIS 57 0.767 -20.095 11.913 513 H HIS 58 HN HIS 58 -1.756 -25.812 13.325 514 HA HIS 58 HA HIS 58 -1.199 -28.541 14.081 515 1HB HIS 58 HB2 HIS 58 -2.196 -26.987 15.730 516 2HB HIS 58 HB1 HIS 58 -3.617 -26.853 14.711 517 HD1 HIS 58 HD1 HIS 58 -1.690 -29.660 16.463 518 HD2 HIS 58 HD2 HIS 58 -5.545 -28.554 15.391 519 HE1 HIS 58 HE1 HIS 58 -3.200 -31.413 17.427 520 H HIS 59 HN HIS 59 -1.301 -29.779 12.424 521 HA HIS 59 HA HIS 59 -2.021 -31.129 10.887 522 1HB HIS 59 HB2 HIS 59 -4.746 -30.400 11.920 523 2HB HIS 59 HB1 HIS 59 -4.528 -31.554 10.613 524 HD1 HIS 59 HD1 HIS 59 -3.344 -33.850 11.259 525 HD2 HIS 59 HD2 HIS 59 -4.151 -31.322 14.450 526 HE1 HIS 59 HE1 HIS 59 -3.082 -35.239 13.324 527 H HIS 60 HN HIS 60 -1.694 -30.958 8.902 528 HA HIS 60 HA HIS 60 -3.215 -28.977 7.371 529 1HB HIS 60 HB2 HIS 60 -1.253 -28.604 5.904 530 2HB HIS 60 HB1 HIS 60 -0.910 -28.135 7.560 531 HD1 HIS 60 HD1 HIS 60 0.992 -29.443 8.776 532 HD2 HIS 60 HD2 HIS 60 0.186 -30.798 4.933 533 HE1 HIS 60 HE1 HIS 60 2.902 -30.912 8.156 534 H HIS 61 HN HIS 61 -2.860 -29.640 4.863 535 HA HIS 61 HA HIS 61 -3.937 -32.295 4.772 536 1HB HIS 61 HB2 HIS 61 -4.918 -30.459 3.391 537 2HB HIS 61 HB1 HIS 61 -3.408 -30.359 2.500 538 HD1 HIS 61 HD1 HIS 61 -6.450 -32.565 2.895 539 HD2 HIS 61 HD2 HIS 61 -3.019 -32.295 0.569 540 HE1 HIS 61 HE1 HIS 61 -6.739 -34.218 1.028 541 H HIS 62 HN HIS 62 -2.701 -33.975 4.684 542 HA HIS 62 HA HIS 62 -0.568 -34.097 2.808 543 1HB HIS 62 HB2 HIS 62 1.088 -35.048 4.414 544 2HB HIS 62 HB1 HIS 62 0.700 -33.385 4.792 545 HD1 HIS 62 HD1 HIS 62 1.198 -36.560 6.389 546 HD2 HIS 62 HD2 HIS 62 -1.297 -33.307 7.044 547 HE1 HIS 62 HE1 HIS 62 0.473 -36.717 8.790 548 H1 MET 101 HT1 MET 101 9.417 22.755 2.653 549 H2 MET 101 HT3 MET 101 10.486 22.129 3.802 550 H3 MET 101 HT2 MET 101 11.027 22.477 2.240 551 HA MET 101 HA MET 101 10.750 20.146 2.458 552 1HB MET 101 HB2 MET 101 9.080 20.146 4.248 553 2HB MET 101 HB1 MET 101 7.900 20.871 3.165 554 1HG MET 101 HG2 MET 101 8.062 18.831 1.739 555 2HG MET 101 HG1 MET 101 9.078 18.109 2.981 556 1HE MET 101 HE3 MET 101 6.455 16.818 1.829 557 2HE MET 101 HE2 MET 101 7.362 16.037 3.131 558 3HE MET 101 HE1 MET 101 5.618 16.265 3.282 559 H GLU 102 HN GLU 102 10.578 19.243 0.475 560 HA GLU 102 HA GLU 102 8.951 20.635 -1.523 561 1HB GLU 102 HB2 GLU 102 11.210 18.649 -1.888 562 2HB GLU 102 HB1 GLU 102 10.278 19.351 -3.190 563 1HG GLU 102 HG2 GLU 102 12.307 20.461 -3.141 564 2HG GLU 102 HG1 GLU 102 11.130 21.577 -2.481 565 H MET 103 HN MET 103 7.045 19.738 -1.393 566 HA MET 103 HA MET 103 6.858 16.984 -0.599 567 1HB MET 103 HB2 MET 103 4.384 17.206 -0.558 568 2HB MET 103 HB1 MET 103 5.222 18.352 0.463 569 1HG MET 103 HG2 MET 103 4.828 20.103 -1.189 570 2HG MET 103 HG1 MET 103 4.001 18.935 -2.225 571 1HE MET 103 HE3 MET 103 1.906 20.646 -2.258 572 2HE MET 103 HE2 MET 103 1.092 21.218 -0.800 573 3HE MET 103 HE1 MET 103 2.741 21.736 -1.154 574 H GLY 104 HN GLY 104 6.729 18.618 -3.580 575 1HA GLY 104 HA1 GLY 104 6.485 17.809 -5.718 576 2HA GLY 104 HA2 GLY 104 5.427 16.565 -5.053 577 H GLN 105 HN GLN 105 8.822 17.379 -4.495 578 HA GLN 105 HA GLN 105 9.894 15.098 -5.789 579 1HB GLN 105 HB2 GLN 105 11.155 16.694 -3.550 580 2HB GLN 105 HB1 GLN 105 11.991 15.576 -4.611 581 1HG GLN 105 HG2 GLN 105 11.428 17.045 -6.523 582 2HG GLN 105 HG1 GLN 105 10.719 18.189 -5.387 583 1HE2 GLN 105 1HE2 GLN 105 12.878 17.493 -3.393 584 2HE2 GLN 105 2HE2 GLN 105 14.241 18.373 -3.936 585 H LEU 106 HN LEU 106 8.930 15.734 -2.469 586 HA LEU 106 HA LEU 106 9.838 13.384 -1.271 587 1HB LEU 106 HB2 LEU 106 9.026 15.368 -0.038 588 2HB LEU 106 HB1 LEU 106 7.419 15.077 -0.641 589 HG LEU 106 HG LEU 106 7.871 14.523 1.793 590 1HD1 LEU 106 HD1 LEU 106 6.706 12.377 0.050 591 2HD1 LEU 106 HD1 LEU 106 6.489 12.510 1.794 592 3HD1 LEU 106 HD1 LEU 106 5.860 13.768 0.727 593 1HD2 LEU 106 HD2 LEU 106 10.018 13.420 1.533 594 2HD2 LEU 106 HD2 LEU 106 8.846 12.329 2.274 595 3HD2 LEU 106 HD2 LEU 106 9.265 12.146 0.571 596 H LYS 107 HN LYS 107 6.759 14.102 -2.856 597 HA LYS 107 HA LYS 107 5.616 11.580 -2.533 598 1HB LYS 107 HB2 LYS 107 4.985 13.969 -3.975 599 2HB LYS 107 HB1 LYS 107 4.736 12.587 -5.034 600 1HG LYS 107 HG2 LYS 107 3.598 12.767 -2.261 601 2HG LYS 107 HG1 LYS 107 2.739 13.343 -3.674 602 1HD LYS 107 HD2 LYS 107 3.769 10.506 -3.494 603 2HD LYS 107 HD1 LYS 107 2.168 10.951 -2.869 604 1HE LYS 107 HE2 LYS 107 1.622 11.786 -5.153 605 2HE LYS 107 HE1 LYS 107 3.189 11.211 -5.707 606 1HZ LYS 107 HZ3 LYS 107 1.028 9.481 -4.577 607 2HZ LYS 107 HZ2 LYS 107 1.369 9.688 -6.195 608 3HZ LYS 107 HZ1 LYS 107 2.513 8.933 -5.199 609 H ASN 108 HN ASN 108 7.808 12.800 -5.002 610 HA ASN 108 HA ASN 108 7.642 10.466 -6.630 611 1HB ASN 108 HB2 ASN 108 8.480 12.675 -7.478 612 2HB ASN 108 HB1 ASN 108 9.946 12.432 -6.538 613 1HD2 ASN 108 HD2 ASN 108 11.296 12.360 -8.309 614 2HD2 ASN 108 HD2 ASN 108 11.309 11.063 -9.446 615 H LYS 109 HN LYS 109 9.724 11.426 -3.956 616 HA LYS 109 HA LYS 109 11.551 9.279 -3.961 617 1HB LYS 109 HB2 LYS 109 10.284 10.613 -1.556 618 2HB LYS 109 HB1 LYS 109 11.678 9.550 -1.513 619 1HG LYS 109 HG2 LYS 109 12.965 11.182 -2.771 620 2HG LYS 109 HG1 LYS 109 11.552 12.245 -2.855 621 1HD LYS 109 HD2 LYS 109 11.539 12.387 -0.405 622 2HD LYS 109 HD1 LYS 109 12.933 11.312 -0.339 623 1HE LYS 109 HE2 LYS 109 12.860 14.034 -1.634 624 2HE LYS 109 HE1 LYS 109 13.579 13.655 -0.071 625 1HZ LYS 109 HZ3 LYS 109 15.133 12.139 -1.250 626 2HZ LYS 109 HZ2 LYS 109 14.471 12.649 -2.724 627 3HZ LYS 109 HZ1 LYS 109 15.260 13.743 -1.756 628 H ILE 110 HN ILE 110 8.415 9.683 -2.477 629 HA ILE 110 HA ILE 110 8.123 7.149 -1.369 630 HB ILE 110 HB ILE 110 6.142 9.238 -2.240 631 1HG1 ILE 110 2HG1 ILE 110 7.058 8.241 0.444 632 2HG1 ILE 110 1HG1 ILE 110 7.566 9.740 -0.333 633 1HG2 ILE 110 3HG2 ILE 110 5.483 6.649 -0.839 634 2HG2 ILE 110 2HG2 ILE 110 4.376 8.001 -1.065 635 3HG2 ILE 110 1HG2 ILE 110 4.982 7.110 -2.466 636 1HD1 ILE 110 HD1 ILE 110 5.276 10.544 -0.190 637 2HD1 ILE 110 HD1 ILE 110 4.810 9.048 0.621 638 3HD1 ILE 110 HD1 ILE 110 5.955 10.158 1.390 639 H GLU 111 HN GLU 111 7.056 8.416 -4.484 640 HA GLU 111 HA GLU 111 5.883 6.115 -5.500 641 1HB GLU 111 HB2 GLU 111 7.457 8.215 -6.990 642 2HB GLU 111 HB1 GLU 111 6.404 7.024 -7.739 643 1HG GLU 111 HG2 GLU 111 5.542 9.118 -5.771 644 2HG GLU 111 HG1 GLU 111 5.313 9.233 -7.504 645 H ASN 112 HN ASN 112 9.250 7.173 -5.808 646 HA ASN 112 HA ASN 112 10.221 4.948 -7.172 647 1HB ASN 112 HB2 ASN 112 11.657 6.838 -7.048 648 2HB ASN 112 HB1 ASN 112 11.576 6.879 -5.292 649 1HD2 ASN 112 HD2 ASN 112 12.943 5.621 -4.121 650 2HD2 ASN 112 HD2 ASN 112 14.183 4.625 -4.757 651 H LYS 113 HN LYS 113 10.034 5.527 -3.692 652 HA LYS 113 HA LYS 113 11.330 3.140 -2.963 653 1HB LYS 113 HB2 LYS 113 10.972 5.248 -1.560 654 2HB LYS 113 HB1 LYS 113 9.350 4.657 -1.273 655 1HG LYS 113 HG2 LYS 113 10.847 4.101 0.607 656 2HG LYS 113 HG1 LYS 113 10.228 2.664 -0.213 657 1HD LYS 113 HD2 LYS 113 12.581 2.465 0.330 658 2HD LYS 113 HD1 LYS 113 12.298 2.392 -1.399 659 1HE LYS 113 HE2 LYS 113 12.982 4.712 -1.597 660 2HE LYS 113 HE1 LYS 113 13.310 4.784 0.147 661 1HZ LYS 113 HZ2 LYS 113 14.929 2.937 -0.244 662 2HZ LYS 113 HZ1 LYS 113 14.625 3.112 -1.912 663 3HZ LYS 113 HZ3 LYS 113 15.349 4.367 -1.043 664 H LYS 114 HN LYS 114 7.921 3.999 -3.172 665 HA LYS 114 HA LYS 114 6.625 1.690 -2.476 666 1HB LYS 114 HB2 LYS 114 5.596 3.887 -2.990 667 2HB LYS 114 HB1 LYS 114 5.997 3.675 -4.680 668 1HG LYS 114 HG2 LYS 114 4.434 1.777 -4.782 669 2HG LYS 114 HG1 LYS 114 4.048 2.024 -3.078 670 1HD LYS 114 HD2 LYS 114 2.301 3.093 -4.343 671 2HD LYS 114 HD1 LYS 114 3.322 4.376 -3.693 672 1HE LYS 114 HE2 LYS 114 4.516 4.429 -5.891 673 2HE LYS 114 HE1 LYS 114 3.327 3.240 -6.442 674 1HZ LYS 114 HZ3 LYS 114 1.538 5.012 -6.152 675 2HZ LYS 114 HZ2 LYS 114 2.735 6.051 -5.560 676 3HZ LYS 114 HZ1 LYS 114 2.793 5.585 -7.098 677 H LYS 115 HN LYS 115 7.794 2.757 -5.664 678 HA LYS 115 HA LYS 115 7.084 0.439 -7.041 679 1HB LYS 115 HB2 LYS 115 9.052 2.615 -7.751 680 2HB LYS 115 HB1 LYS 115 8.645 1.306 -8.851 681 1HG LYS 115 HG2 LYS 115 6.322 1.999 -8.880 682 2HG LYS 115 HG1 LYS 115 6.647 3.226 -7.665 683 1HD LYS 115 HD2 LYS 115 6.523 4.414 -9.685 684 2HD LYS 115 HD1 LYS 115 8.243 4.261 -9.375 685 1HE LYS 115 HE2 LYS 115 6.703 2.436 -11.238 686 2HE LYS 115 HE1 LYS 115 7.520 3.898 -11.761 687 1HZ LYS 115 HZ1 LYS 115 9.618 2.903 -10.989 688 2HZ LYS 115 HZ3 LYS 115 8.804 1.466 -10.616 689 3HZ LYS 115 HZ2 LYS 115 8.865 2.005 -12.187 690 H GLU 116 HN GLU 116 10.137 1.360 -5.479 691 HA GLU 116 HA GLU 116 11.729 -0.822 -6.258 692 1HB GLU 116 HB2 GLU 116 11.705 0.694 -3.634 693 2HB GLU 116 HB1 GLU 116 12.874 -0.552 -4.018 694 1HG GLU 116 HG2 GLU 116 13.558 0.851 -5.956 695 2HG GLU 116 HG1 GLU 116 12.502 2.119 -5.315 696 H LEU 117 HN LEU 117 9.483 -0.448 -3.609 697 HA LEU 117 HA LEU 117 9.929 -2.975 -2.474 698 1HB LEU 117 HB2 LEU 117 9.075 -1.322 -1.052 699 2HB LEU 117 HB1 LEU 117 7.829 -0.863 -2.181 700 HG LEU 117 HG LEU 117 7.033 -1.998 -0.080 701 1HD1 LEU 117 HD1 LEU 117 5.650 -1.718 -1.886 702 2HD1 LEU 117 HD1 LEU 117 6.206 -3.230 -2.593 703 3HD1 LEU 117 HD1 LEU 117 5.329 -3.246 -1.047 704 1HD2 LEU 117 HD2 LEU 117 8.233 -4.428 -1.341 705 2HD2 LEU 117 HD2 LEU 117 8.767 -3.661 0.156 706 3HD2 LEU 117 HD2 LEU 117 7.162 -4.399 0.063 707 H ILE 118 HN ILE 118 7.549 -1.775 -4.754 708 HA ILE 118 HA ILE 118 5.997 -4.039 -4.833 709 HB ILE 118 HB ILE 118 6.556 -2.119 -7.118 710 1HG1 ILE 118 2HG1 ILE 118 4.157 -2.255 -5.295 711 2HG1 ILE 118 1HG1 ILE 118 5.558 -1.251 -4.941 712 1HG2 ILE 118 2HG2 ILE 118 4.378 -4.189 -6.786 713 2HG2 ILE 118 1HG2 ILE 118 4.423 -2.964 -8.073 714 3HG2 ILE 118 3HG2 ILE 118 5.667 -4.212 -7.970 715 1HD1 ILE 118 HD1 ILE 118 3.812 -1.030 -7.380 716 2HD1 ILE 118 HD1 ILE 118 3.756 0.020 -5.958 717 3HD1 ILE 118 HD1 ILE 118 5.191 -0.008 -6.983 718 H GLN 119 HN GLN 119 8.877 -3.171 -6.659 719 HA GLN 119 HA GLN 119 9.071 -5.419 -8.330 720 1HB GLN 119 HB2 GLN 119 11.276 -3.738 -7.153 721 2HB GLN 119 HB1 GLN 119 11.443 -4.862 -8.491 722 1HG GLN 119 HG2 GLN 119 9.999 -3.534 -9.863 723 2HG GLN 119 HG1 GLN 119 9.647 -2.462 -8.511 724 1HE2 GLN 119 1HE2 GLN 119 12.832 -3.757 -9.179 725 2HE2 GLN 119 2HE2 GLN 119 13.525 -2.245 -9.633 726 H LEU 120 HN LEU 120 9.973 -4.880 -5.014 727 HA LEU 120 HA LEU 120 11.517 -7.244 -4.765 728 1HB LEU 120 HB2 LEU 120 10.310 -5.496 -2.630 729 2HB LEU 120 HB1 LEU 120 11.397 -6.842 -2.340 730 HG LEU 120 HG LEU 120 12.119 -4.345 -3.868 731 1HD1 LEU 120 HD1 LEU 120 11.761 -3.949 -1.492 732 2HD1 LEU 120 HD1 LEU 120 12.879 -5.253 -1.103 733 3HD1 LEU 120 HD1 LEU 120 13.461 -3.807 -1.928 734 1HD2 LEU 120 HD2 LEU 120 13.771 -6.716 -2.988 735 2HD2 LEU 120 HD2 LEU 120 13.378 -6.256 -4.647 736 3HD2 LEU 120 HD2 LEU 120 14.415 -5.222 -3.671 737 H VAL 121 HN VAL 121 8.113 -6.454 -3.565 738 HA VAL 121 HA VAL 121 7.660 -9.075 -2.806 739 HB VAL 121 HB VAL 121 5.436 -8.542 -2.646 740 1HG1 VAL 121 2HG1 VAL 121 6.676 -7.220 -1.143 741 2HG1 VAL 121 1HG1 VAL 121 6.840 -5.951 -2.367 742 3HG1 VAL 121 3HG1 VAL 121 5.253 -6.321 -1.692 743 1HG2 VAL 121 1HG2 VAL 121 4.959 -7.993 -4.878 744 2HG2 VAL 121 3HG2 VAL 121 4.247 -6.769 -3.820 745 3HG2 VAL 121 2HG2 VAL 121 5.739 -6.409 -4.727 746 H ALA 122 HN ALA 122 7.701 -7.630 -5.945 747 HA ALA 122 HA ALA 122 6.228 -9.601 -7.328 748 1HB ALA 122 HB2 ALA 122 8.304 -7.698 -8.376 749 2HB ALA 122 HB1 ALA 122 7.098 -8.563 -9.351 750 3HB ALA 122 HB3 ALA 122 6.593 -7.350 -8.168 751 H ARG 123 HN ARG 123 9.705 -9.134 -6.776 752 HA ARG 123 HA ARG 123 10.467 -11.408 -8.327 753 1HB ARG 123 HB2 ARG 123 12.733 -11.057 -7.437 754 2HB ARG 123 HB1 ARG 123 12.037 -9.556 -8.022 755 1HG ARG 123 HG2 ARG 123 11.434 -9.010 -5.681 756 2HG ARG 123 HG1 ARG 123 12.318 -10.443 -5.176 757 1HD ARG 123 HD2 ARG 123 13.513 -8.146 -6.723 758 2HD ARG 123 HD1 ARG 123 13.633 -8.353 -4.980 759 HE ARG 123 HE ARG 123 14.592 -10.676 -6.039 760 1HH1 ARG 123 1HH1 ARG 123 15.450 -7.228 -6.345 761 2HH1 ARG 123 2HH1 ARG 123 17.103 -7.507 -6.576 762 1HH2 ARG 123 1HH2 ARG 123 16.846 -11.044 -6.355 763 2HH2 ARG 123 2HH2 ARG 123 17.944 -9.753 -6.586 764 H HIS 124 HN HIS 124 9.079 -11.149 -5.338 765 HA HIS 124 HA HIS 124 10.052 -13.472 -4.043 766 1HB HIS 124 HB2 HIS 124 8.763 -11.869 -2.780 767 2HB HIS 124 HB1 HIS 124 7.402 -11.960 -3.869 768 HD1 HIS 124 HD1 HIS 124 5.777 -14.060 -3.502 769 HD2 HIS 124 HD2 HIS 124 8.936 -13.807 -0.830 770 HE1 HIS 124 HE1 HIS 124 5.272 -15.690 -1.672 771 H GLY 125 HN GLY 125 7.841 -12.863 -6.639 772 1HA GLY 125 HA1 GLY 125 7.326 -15.757 -6.821 773 2HA GLY 125 HA2 GLY 125 7.728 -14.776 -8.219 774 H LEU 126 HN LEU 126 6.098 -12.537 -7.730 775 HA LEU 126 HA LEU 126 3.394 -13.570 -7.539 776 1HB LEU 126 HB2 LEU 126 4.560 -10.861 -7.990 777 2HB LEU 126 HB1 LEU 126 2.869 -11.140 -8.245 778 HG LEU 126 HG LEU 126 4.434 -11.316 -5.755 779 1HD1 LEU 126 HD1 LEU 126 2.153 -9.533 -6.540 780 2HD1 LEU 126 HD1 LEU 126 2.867 -9.603 -4.931 781 3HD1 LEU 126 HD1 LEU 126 3.839 -9.085 -6.308 782 1HD2 LEU 126 HD2 LEU 126 1.594 -12.208 -6.161 783 2HD2 LEU 126 HD2 LEU 126 2.966 -13.161 -5.593 784 3HD2 LEU 126 HD2 LEU 126 2.313 -11.889 -4.580 785 H ASP 127 HN ASP 127 1.919 -13.450 -9.146 786 HA ASP 127 HA ASP 127 2.701 -13.843 -11.881 787 1HB ASP 127 HB2 ASP 127 0.024 -12.757 -10.899 788 2HB ASP 127 HB1 ASP 127 0.348 -13.415 -12.483 789 H HIS 128 HN HIS 128 2.389 -12.201 -13.594 790 HA HIS 128 HA HIS 128 3.314 -9.643 -12.875 791 1HB HIS 128 HB2 HIS 128 3.546 -10.627 -15.161 792 2HB HIS 128 HB1 HIS 128 1.814 -10.443 -15.386 793 HD1 HIS 128 HD1 HIS 128 1.388 -8.519 -16.895 794 HD2 HIS 128 HD2 HIS 128 4.606 -7.836 -14.373 795 HE1 HIS 128 HE1 HIS 128 2.201 -6.189 -17.422 796 H ASP 129 HN ASP 129 0.146 -10.976 -13.356 797 HA ASP 129 HA ASP 129 -1.465 -8.718 -13.186 798 1HB ASP 129 HB2 ASP 129 -2.315 -10.846 -13.914 799 2HB ASP 129 HB1 ASP 129 -1.897 -11.575 -12.372 800 H LYS 130 HN LYS 130 -0.108 -10.808 -10.700 801 HA LYS 130 HA LYS 130 -1.436 -9.719 -8.472 802 1HB LYS 130 HB2 LYS 130 1.161 -11.128 -8.814 803 2HB LYS 130 HB1 LYS 130 0.685 -10.672 -7.206 804 1HG LYS 130 HG2 LYS 130 -0.760 -12.531 -9.103 805 2HG LYS 130 HG1 LYS 130 0.217 -12.998 -7.714 806 1HD LYS 130 HD2 LYS 130 -1.385 -11.894 -6.242 807 2HD LYS 130 HD1 LYS 130 -2.373 -11.437 -7.622 808 1HE LYS 130 HE2 LYS 130 -1.698 -14.234 -6.721 809 2HE LYS 130 HE1 LYS 130 -3.263 -13.439 -6.582 810 1HZ LYS 130 HZ1 LYS 130 -3.345 -13.373 -9.053 811 2HZ LYS 130 HZ3 LYS 130 -1.894 -14.258 -9.107 812 3HZ LYS 130 HZ2 LYS 130 -3.274 -14.926 -8.430 813 H VAL 131 HN VAL 131 1.660 -9.003 -10.001 814 HA VAL 131 HA VAL 131 2.530 -6.958 -8.298 815 HB VAL 131 HB VAL 131 3.027 -7.095 -11.290 816 1HG1 VAL 131 2HG1 VAL 131 4.665 -5.914 -9.067 817 2HG1 VAL 131 1HG1 VAL 131 5.158 -6.016 -10.757 818 3HG1 VAL 131 3HG1 VAL 131 3.766 -5.030 -10.301 819 1HG2 VAL 131 1HG2 VAL 131 4.519 -8.505 -9.084 820 2HG2 VAL 131 3HG2 VAL 131 3.502 -9.255 -10.315 821 3HG2 VAL 131 2HG2 VAL 131 5.000 -8.452 -10.785 822 H LEU 132 HN LEU 132 0.553 -6.864 -11.222 823 HA LEU 132 HA LEU 132 0.164 -4.066 -11.395 824 1HB LEU 132 HB2 LEU 132 -1.709 -6.249 -12.258 825 2HB LEU 132 HB1 LEU 132 -1.736 -4.588 -12.810 826 HG LEU 132 HG LEU 132 0.391 -6.642 -13.374 827 1HD1 LEU 132 HD1 LEU 132 -1.619 -5.308 -15.141 828 2HD1 LEU 132 HD1 LEU 132 -0.330 -6.395 -15.682 829 3HD1 LEU 132 HD1 LEU 132 -1.609 -6.997 -14.625 830 1HD2 LEU 132 HD2 LEU 132 0.247 -3.745 -14.202 831 2HD2 LEU 132 HD2 LEU 132 1.432 -4.489 -13.124 832 3HD2 LEU 132 HD2 LEU 132 1.397 -4.934 -14.829 833 H LEU 133 HN LEU 133 -1.776 -6.556 -9.813 834 HA LEU 133 HA LEU 133 -3.782 -4.740 -8.931 835 1HB LEU 133 HB2 LEU 133 -3.038 -7.452 -7.884 836 2HB LEU 133 HB1 LEU 133 -4.475 -6.533 -7.445 837 HG LEU 133 HG LEU 133 -3.864 -7.511 -10.239 838 1HD1 LEU 133 HD1 LEU 133 -5.644 -8.727 -8.135 839 2HD1 LEU 133 HD1 LEU 133 -5.547 -9.227 -9.827 840 3HD1 LEU 133 HD1 LEU 133 -4.144 -9.402 -8.779 841 1HD2 LEU 133 HD2 LEU 133 -6.382 -6.403 -8.991 842 2HD2 LEU 133 HD2 LEU 133 -5.353 -5.583 -10.169 843 3HD2 LEU 133 HD2 LEU 133 -6.236 -7.034 -10.635 844 H PHE 134 HN PHE 134 -0.858 -5.996 -7.480 845 HA PHE 134 HA PHE 134 -1.327 -4.928 -4.917 846 1HB PHE 134 HB2 PHE 134 0.269 -6.729 -5.231 847 2HB PHE 134 HB1 PHE 134 1.256 -5.717 -6.278 848 HD1 PHE 134 HD1 PHE 134 2.899 -4.322 -5.387 849 HD2 PHE 134 HD2 PHE 134 0.022 -6.090 -2.806 850 HE1 PHE 134 HE1 PHE 134 4.169 -3.534 -3.426 851 HE2 PHE 134 HE2 PHE 134 1.295 -5.300 -0.854 852 HZ PHE 134 HZ PHE 134 3.371 -4.011 -1.192 853 H SER 135 HN SER 135 0.568 -3.753 -7.675 854 HA SER 135 HA SER 135 1.585 -1.487 -6.442 855 1HB SER 135 HB2 SER 135 1.880 -0.624 -8.818 856 2HB SER 135 HB1 SER 135 2.592 -2.198 -8.457 857 HG SER 135 HG SER 135 0.972 -3.195 -9.508 858 H ARG 136 HN ARG 136 -1.368 -1.792 -8.379 859 HA ARG 136 HA ARG 136 -2.010 0.948 -8.170 860 1HB ARG 136 HB2 ARG 136 -4.215 0.334 -9.051 861 2HB ARG 136 HB1 ARG 136 -2.922 -0.427 -9.963 862 1HG ARG 136 HG2 ARG 136 -3.316 -2.491 -8.607 863 2HG ARG 136 HG1 ARG 136 -4.744 -1.696 -7.947 864 1HD ARG 136 HD2 ARG 136 -4.205 -2.298 -10.845 865 2HD ARG 136 HD1 ARG 136 -5.301 -3.178 -9.791 866 HE ARG 136 HE ARG 136 -5.700 -0.439 -10.802 867 1HH1 ARG 136 1HH1 ARG 136 -7.051 -3.273 -9.099 868 2HH1 ARG 136 2HH1 ARG 136 -8.661 -2.811 -9.394 869 1HH2 ARG 136 1HH2 ARG 136 -7.905 0.124 -11.179 870 2HH2 ARG 136 2HH2 ARG 136 -9.168 -0.848 -10.568 871 H ASP 137 HN ASP 137 -2.783 -1.818 -6.124 872 HA ASP 137 HA ASP 137 -4.769 -0.486 -4.552 873 1HB ASP 137 HB2 ASP 137 -4.172 -3.036 -4.770 874 2HB ASP 137 HB1 ASP 137 -3.000 -2.678 -3.522 875 H LEU 138 HN LEU 138 -1.342 -1.179 -4.163 876 HA LEU 138 HA LEU 138 -0.866 -0.003 -1.685 877 1HB LEU 138 HB2 LEU 138 0.726 -1.481 -2.680 878 2HB LEU 138 HB1 LEU 138 0.889 -0.461 -4.086 879 HG LEU 138 HG LEU 138 2.081 1.210 -2.783 880 1HD1 LEU 138 HD1 LEU 138 1.754 -0.683 -0.469 881 2HD1 LEU 138 HD1 LEU 138 2.750 0.780 -0.521 882 3HD1 LEU 138 HD1 LEU 138 0.998 0.914 -0.664 883 1HD2 LEU 138 HD2 LEU 138 3.342 -0.574 -3.826 884 2HD2 LEU 138 HD2 LEU 138 4.088 -0.075 -2.307 885 3HD2 LEU 138 HD2 LEU 138 3.154 -1.568 -2.383 886 H ASP 139 HN ASP 139 -0.792 1.353 -4.919 887 HA ASP 139 HA ASP 139 0.166 3.902 -4.385 888 1HB ASP 139 HB2 ASP 139 -0.147 3.077 -6.658 889 2HB ASP 139 HB1 ASP 139 -1.888 3.016 -6.425 890 H LYS 140 HN LYS 140 -3.149 2.705 -4.327 891 HA LYS 140 HA LYS 140 -4.278 5.180 -3.558 892 1HB LYS 140 HB2 LYS 140 -5.343 2.398 -3.733 893 2HB LYS 140 HB1 LYS 140 -6.261 3.639 -2.891 894 1HG LYS 140 HG2 LYS 140 -6.930 3.337 -5.226 895 2HG LYS 140 HG1 LYS 140 -6.370 4.984 -4.901 896 1HD LYS 140 HD2 LYS 140 -4.120 4.164 -5.777 897 2HD LYS 140 HD1 LYS 140 -4.989 2.747 -6.336 898 1HE LYS 140 HE2 LYS 140 -6.416 4.101 -7.717 899 2HE LYS 140 HE1 LYS 140 -5.671 5.568 -7.087 900 1HZ LYS 140 HZ1 LYS 140 -3.561 4.860 -8.014 901 2HZ LYS 140 HZ3 LYS 140 -4.293 3.478 -8.682 902 3HZ LYS 140 HZ2 LYS 140 -4.768 4.995 -9.199 903 H LEU 141 HN LEU 141 -3.068 2.490 -1.707 904 HA LEU 141 HA LEU 141 -4.217 3.355 0.741 905 1HB LEU 141 HB2 LEU 141 -3.445 1.060 0.504 906 2HB LEU 141 HB1 LEU 141 -1.805 1.610 0.234 907 HG LEU 141 HG LEU 141 -1.674 2.416 2.544 908 1HD1 LEU 141 HD1 LEU 141 -4.487 1.357 2.820 909 2HD1 LEU 141 HD1 LEU 141 -3.438 1.833 4.161 910 3HD1 LEU 141 HD1 LEU 141 -3.938 3.031 2.978 911 1HD2 LEU 141 HD2 LEU 141 -2.615 -0.440 2.321 912 2HD2 LEU 141 HD2 LEU 141 -0.968 0.141 2.064 913 3HD2 LEU 141 HD2 LEU 141 -1.701 0.237 3.667 914 H ILE 142 HN ILE 142 -1.140 3.913 -0.829 915 HA ILE 142 HA ILE 142 -0.099 5.474 1.306 916 HB ILE 142 HB ILE 142 0.787 5.322 -1.590 917 1HG1 ILE 142 2HG1 ILE 142 1.867 4.144 0.954 918 2HG1 ILE 142 1HG1 ILE 142 1.041 3.251 -0.313 919 1HG2 ILE 142 3HG2 ILE 142 2.153 6.659 0.755 920 2HG2 ILE 142 2HG2 ILE 142 2.856 6.433 -0.845 921 3HG2 ILE 142 1HG2 ILE 142 1.452 7.481 -0.639 922 1HD1 ILE 142 HD1 ILE 142 3.676 4.670 -0.603 923 2HD1 ILE 142 HD1 ILE 142 3.470 2.941 -0.342 924 3HD1 ILE 142 HD1 ILE 142 2.878 3.674 -1.831 925 H ASN 143 HN ASN 143 -1.541 6.346 -1.816 926 HA ASN 143 HA ASN 143 -1.351 9.108 -1.455 927 1HB ASN 143 HB2 ASN 143 -3.238 7.475 -3.144 928 2HB ASN 143 HB1 ASN 143 -3.243 9.231 -3.174 929 1HD2 ASN 143 HD2 ASN 143 -2.580 7.296 -5.300 930 2HD2 ASN 143 HD2 ASN 143 -0.989 7.599 -5.807 931 H LYS 144 HN LYS 144 -3.576 6.850 -0.185 932 HA LYS 144 HA LYS 144 -5.675 8.527 0.664 933 1HB LYS 144 HB2 LYS 144 -5.673 6.050 0.619 934 2HB LYS 144 HB1 LYS 144 -4.566 6.042 1.976 935 1HG LYS 144 HG2 LYS 144 -6.320 7.204 3.331 936 2HG LYS 144 HG1 LYS 144 -7.403 7.025 1.948 937 1HD LYS 144 HD2 LYS 144 -6.117 4.784 3.476 938 2HD LYS 144 HD1 LYS 144 -7.811 5.262 3.547 939 1HE LYS 144 HE2 LYS 144 -6.339 4.104 1.169 940 2HE LYS 144 HE1 LYS 144 -7.593 3.344 2.142 941 1HZ LYS 144 HZ3 LYS 144 -9.169 5.020 1.325 942 2HZ LYS 144 HZ2 LYS 144 -7.975 5.691 0.357 943 3HZ LYS 144 HZ1 LYS 144 -8.492 4.112 0.083 944 H PHE 145 HN PHE 145 -2.825 7.276 2.404 945 HA PHE 145 HA PHE 145 -3.288 8.907 4.648 946 1HB PHE 145 HB2 PHE 145 -1.048 7.097 3.855 947 2HB PHE 145 HB1 PHE 145 -0.853 8.168 5.238 948 HD1 PHE 145 HD1 PHE 145 -2.814 5.348 3.880 949 HD2 PHE 145 HD2 PHE 145 -1.969 7.756 7.284 950 HE1 PHE 145 HE1 PHE 145 -4.020 3.751 5.314 951 HE2 PHE 145 HE2 PHE 145 -3.173 6.155 8.720 952 HZ PHE 145 HZ PHE 145 -4.192 4.161 7.734 953 H MET 146 HN MET 146 -1.490 9.275 1.752 954 HA MET 146 HA MET 146 0.085 11.519 2.505 955 1HB MET 146 HB2 MET 146 -0.833 10.542 -0.184 956 2HB MET 146 HB1 MET 146 0.233 11.920 0.011 957 1HG MET 146 HG2 MET 146 0.808 9.128 0.966 958 2HG MET 146 HG1 MET 146 1.435 9.847 -0.518 959 1HE MET 146 HE1 MET 146 3.137 11.729 -0.622 960 2HE MET 146 HE3 MET 146 2.079 12.809 0.293 961 3HE MET 146 HE2 MET 146 3.771 12.622 0.762 962 H ASN 147 HN ASN 147 -3.189 11.133 1.913 963 HA ASN 147 HA ASN 147 -4.951 12.530 2.129 964 1HB ASN 147 HB2 ASN 147 -3.514 13.438 4.000 965 2HB ASN 147 HB1 ASN 147 -2.902 14.642 2.882 966 1HD2 ASN 147 HD2 ASN 147 -4.126 16.412 2.480 967 2HD2 ASN 147 HD2 ASN 147 -5.579 16.796 3.312 968 H VAL 148 HN VAL 148 -3.318 12.274 -0.310 969 HA VAL 148 HA VAL 148 -3.835 14.783 -1.668 970 HB VAL 148 HB VAL 148 -2.707 13.765 -3.625 971 1HG1 VAL 148 1HG1 VAL 148 -1.080 13.855 -1.071 972 2HG1 VAL 148 3HG1 VAL 148 -0.396 13.918 -2.695 973 3HG1 VAL 148 2HG1 VAL 148 -1.447 15.216 -2.126 974 1HG2 VAL 148 3HG2 VAL 148 -2.021 11.543 -1.705 975 2HG2 VAL 148 2HG2 VAL 148 -3.008 11.419 -3.163 976 3HG2 VAL 148 1HG2 VAL 148 -1.284 11.763 -3.294 977 H LYS 149 HN LYS 149 -5.482 15.164 -2.563 978 HA LYS 149 HA LYS 149 -7.278 12.957 -2.906 979 1HB LYS 149 HB2 LYS 149 -7.822 15.888 -2.658 980 2HB LYS 149 HB1 LYS 149 -9.061 14.678 -2.948 981 1HG LYS 149 HG2 LYS 149 -7.190 14.600 -0.610 982 2HG LYS 149 HG1 LYS 149 -8.775 15.395 -0.541 983 1HD LYS 149 HD2 LYS 149 -8.342 12.469 -1.219 984 2HD LYS 149 HD1 LYS 149 -8.613 13.051 0.412 985 1HE LYS 149 HE2 LYS 149 -10.697 12.229 -0.408 986 2HE LYS 149 HE1 LYS 149 -10.807 13.977 -0.342 987 1HZ LYS 149 HZ3 LYS 149 -10.380 12.358 -2.818 988 2HZ LYS 149 HZ2 LYS 149 -11.815 13.030 -2.307 989 3HZ LYS 149 HZ1 LYS 149 -10.584 14.044 -2.778 990 H ASP 150 HN ASP 150 -7.148 12.134 -4.689 991 HA ASP 150 HA ASP 150 -6.812 13.021 -7.262 992 1HB ASP 150 HB2 ASP 150 -7.161 10.710 -6.985 993 2HB ASP 150 HB1 ASP 150 -8.651 10.942 -6.091 994 H LYS 151 HN LYS 151 -7.550 14.829 -8.003 995 HA LYS 151 HA LYS 151 -10.201 15.886 -7.287 996 1HB LYS 151 HB2 LYS 151 -9.227 18.044 -7.992 997 2HB LYS 151 HB1 LYS 151 -8.235 17.267 -6.759 998 1HG LYS 151 HG2 LYS 151 -6.748 16.408 -8.544 999 2HG LYS 151 HG1 LYS 151 -7.717 17.277 -9.724 1000 1HD LYS 151 HD2 LYS 151 -7.105 19.389 -8.665 1001 2HD LYS 151 HD1 LYS 151 -6.136 18.511 -7.473 1002 1HE LYS 151 HE2 LYS 151 -4.788 17.564 -9.310 1003 2HE LYS 151 HE1 LYS 151 -5.718 18.522 -10.459 1004 1HZ LYS 151 HZ3 LYS 151 -4.868 20.538 -9.327 1005 2HZ LYS 151 HZ2 LYS 151 -3.950 19.539 -8.318 1006 3HZ LYS 151 HZ1 LYS 151 -3.643 19.556 -9.951 1007 H VAL 152 HN VAL 152 -9.375 13.927 -9.461 1008 HA VAL 152 HA VAL 152 -10.547 15.368 -11.727 1009 HB VAL 152 HB VAL 152 -9.052 14.061 -13.222 1010 1HG1 VAL 152 2HG1 VAL 152 -7.603 15.813 -11.237 1011 2HG1 VAL 152 1HG1 VAL 152 -7.011 15.382 -12.840 1012 3HG1 VAL 152 3HG1 VAL 152 -8.464 16.365 -12.675 1013 1HG2 VAL 152 2HG2 VAL 152 -7.624 13.321 -10.665 1014 2HG2 VAL 152 1HG2 VAL 152 -8.490 12.223 -11.737 1015 3HG2 VAL 152 3HG2 VAL 152 -7.017 13.020 -12.294 1016 H HIS 153 HN HIS 153 -11.298 13.804 -13.397 1017 HA HIS 153 HA HIS 153 -12.055 11.210 -12.280 1018 1HB HIS 153 HB2 HIS 153 -14.050 12.621 -12.875 1019 2HB HIS 153 HB1 HIS 153 -13.417 12.792 -14.509 1020 HD1 HIS 153 HD1 HIS 153 -14.073 10.951 -16.177 1021 HD2 HIS 153 HD2 HIS 153 -14.861 9.929 -12.220 1022 HE1 HIS 153 HE1 HIS 153 -15.391 8.825 -16.257 1023 H LYS 154 HN LYS 154 -10.196 10.215 -12.876 1024 HA LYS 154 HA LYS 154 -9.512 10.327 -15.723 1025 1HB LYS 154 HB2 LYS 154 -8.086 11.734 -14.053 1026 2HB LYS 154 HB1 LYS 154 -7.452 10.183 -13.543 1027 1HG LYS 154 HG2 LYS 154 -5.938 11.110 -15.110 1028 2HG LYS 154 HG1 LYS 154 -6.780 9.783 -15.921 1029 1HD LYS 154 HD2 LYS 154 -8.297 11.406 -16.983 1030 2HD LYS 154 HD1 LYS 154 -7.454 12.716 -16.163 1031 1HE LYS 154 HE2 LYS 154 -5.401 12.147 -17.346 1032 2HE LYS 154 HE1 LYS 154 -6.223 10.800 -18.126 1033 1HZ LYS 154 HZ1 LYS 154 -7.710 12.395 -19.197 1034 2HZ LYS 154 HZ3 LYS 154 -6.877 13.682 -18.487 1035 3HZ LYS 154 HZ2 LYS 154 -6.116 12.674 -19.589 1036 H LEU 155 HN LEU 155 -8.844 8.374 -16.525 1037 HA LEU 155 HA LEU 155 -9.290 6.101 -14.797 1038 1HB LEU 155 HB2 LEU 155 -8.883 6.331 -17.782 1039 2HB LEU 155 HB1 LEU 155 -8.903 4.791 -16.968 1040 HG LEU 155 HG LEU 155 -11.249 5.323 -16.202 1041 1HD1 LEU 155 HD1 LEU 155 -11.220 7.736 -16.465 1042 2HD1 LEU 155 HD1 LEU 155 -11.064 7.552 -18.214 1043 3HD1 LEU 155 HD1 LEU 155 -12.525 7.003 -17.392 1044 1HD2 LEU 155 HD2 LEU 155 -10.815 3.809 -18.045 1045 2HD2 LEU 155 HD2 LEU 155 -12.267 4.762 -18.352 1046 3HD2 LEU 155 HD2 LEU 155 -10.759 5.167 -19.168 1047 H GLU 156 HN GLU 156 -7.682 4.195 -15.286 1048 HA GLU 156 HA GLU 156 -5.225 5.103 -14.220 1049 1HB GLU 156 HB2 GLU 156 -6.163 2.355 -14.994 1050 2HB GLU 156 HB1 GLU 156 -4.612 2.680 -14.218 1051 1HG GLU 156 HG2 GLU 156 -5.727 3.665 -12.324 1052 2HG GLU 156 HG1 GLU 156 -7.293 3.434 -13.093 1053 H HIS 157 HN HIS 157 -6.131 5.256 -17.252 1054 HA HIS 157 HA HIS 157 -3.864 4.642 -18.802 1055 1HB HIS 157 HB2 HIS 157 -6.009 5.551 -19.749 1056 2HB HIS 157 HB1 HIS 157 -5.656 7.072 -18.923 1057 HD1 HIS 157 HD1 HIS 157 -4.980 8.782 -20.638 1058 HD2 HIS 157 HD2 HIS 157 -3.493 4.997 -21.505 1059 HE1 HIS 157 HE1 HIS 157 -3.583 9.042 -22.697 1060 H HIS 158 HN HIS 158 -4.731 7.281 -16.711 1061 HA HIS 158 HA HIS 158 -1.985 8.207 -16.708 1062 1HB HIS 158 HB2 HIS 158 -3.656 9.921 -17.415 1063 2HB HIS 158 HB1 HIS 158 -4.527 9.667 -15.912 1064 HD1 HIS 158 HD1 HIS 158 -1.529 11.372 -17.334 1065 HD2 HIS 158 HD2 HIS 158 -3.389 10.878 -13.654 1066 HE1 HIS 158 HE1 HIS 158 -0.517 13.099 -15.800 1067 H HIS 159 HN HIS 159 -1.208 6.840 -15.157 1068 HA HIS 159 HA HIS 159 -2.739 6.702 -12.702 1069 1HB HIS 159 HB2 HIS 159 -1.612 4.509 -12.234 1070 2HB HIS 159 HB1 HIS 159 -2.683 4.498 -13.626 1071 HD1 HIS 159 HD1 HIS 159 -1.649 3.791 -15.848 1072 HD2 HIS 159 HD2 HIS 159 1.148 4.404 -12.842 1073 HE1 HIS 159 HE1 HIS 159 0.547 2.926 -16.742 1074 H HIS 160 HN HIS 160 -1.448 6.223 -10.729 1075 HA HIS 160 HA HIS 160 -0.068 6.968 -9.141 1076 1HB HIS 160 HB2 HIS 160 1.918 7.442 -11.404 1077 2HB HIS 160 HB1 HIS 160 2.305 7.654 -9.707 1078 HD1 HIS 160 HD1 HIS 160 3.045 5.353 -12.188 1079 HD2 HIS 160 HD2 HIS 160 1.462 4.950 -8.372 1080 HE1 HIS 160 HE1 HIS 160 3.568 3.001 -11.457 1081 H HIS 161 HN HIS 161 -1.302 8.588 -8.499 1082 HA HIS 161 HA HIS 161 -0.870 11.185 -9.805 1083 1HB HIS 161 HB2 HIS 161 -3.171 11.800 -9.268 1084 2HB HIS 161 HB1 HIS 161 -3.162 10.309 -10.194 1085 HD1 HIS 161 HD1 HIS 161 -4.020 11.687 -6.759 1086 HD2 HIS 161 HD2 HIS 161 -4.102 8.048 -8.821 1087 HE1 HIS 161 HE1 HIS 161 -5.365 10.123 -5.363 1088 H HIS 162 HN HIS 162 -1.987 12.881 -8.136 1089 HA HIS 162 HA HIS 162 -1.225 12.378 -5.434 1090 1HB HIS 162 HB2 HIS 162 -0.024 14.596 -5.300 1091 2HB HIS 162 HB1 HIS 162 0.823 13.411 -6.273 1092 HD1 HIS 162 HD1 HIS 162 0.711 13.850 -8.966 1093 HD2 HIS 162 HD2 HIS 162 -0.581 16.960 -6.532 1094 HE1 HIS 162 HE1 HIS 162 0.766 15.919 -10.389 No H/Q in entry = 1094 Start of MODEL 29 1 H1 MET 1 HT2 MET 1 14.294 -16.116 -4.359 2 H2 MET 1 HT1 MET 1 14.354 -17.545 -5.247 3 H3 MET 1 HT3 MET 1 13.752 -17.575 -3.688 4 HA MET 1 HA MET 1 15.886 -18.503 -3.633 5 1HB MET 1 HB2 MET 1 16.775 -17.343 -5.664 6 2HB MET 1 HB1 MET 1 16.842 -15.851 -4.742 7 1HG MET 1 HG2 MET 1 18.484 -16.815 -3.236 8 2HG MET 1 HG1 MET 1 18.380 -18.353 -4.084 9 1HE MET 1 HE1 MET 1 19.526 -14.599 -4.272 10 2HE MET 1 HE3 MET 1 20.157 -14.496 -5.914 11 3HE MET 1 HE2 MET 1 18.427 -14.698 -5.653 12 H GLU 2 HN GLU 2 15.641 -18.604 -1.516 13 HA GLU 2 HA GLU 2 15.551 -18.126 0.605 14 1HB GLU 2 HB2 GLU 2 17.744 -16.189 -0.124 15 2HB GLU 2 HB1 GLU 2 17.321 -16.617 1.528 16 1HG GLU 2 HG2 GLU 2 17.825 -18.955 1.057 17 2HG GLU 2 HG1 GLU 2 18.236 -18.530 -0.600 18 H MET 3 HN MET 3 13.537 -17.512 0.722 19 HA MET 3 HA MET 3 12.686 -14.886 0.168 20 1HB MET 3 HB2 MET 3 11.224 -17.045 1.677 21 2HB MET 3 HB1 MET 3 10.511 -15.543 1.109 22 1HG MET 3 HG2 MET 3 11.626 -17.773 -0.567 23 2HG MET 3 HG1 MET 3 9.941 -17.287 -0.411 24 1HE MET 3 HE3 MET 3 9.726 -17.290 -2.964 25 2HE MET 3 HE2 MET 3 10.739 -16.381 -4.086 26 3HE MET 3 HE1 MET 3 11.416 -17.735 -3.174 27 H GLY 4 HN GLY 4 14.179 -16.215 2.883 28 1HA GLY 4 HA1 GLY 4 14.664 -15.343 4.952 29 2HA GLY 4 HA2 GLY 4 13.107 -14.516 4.883 30 H GLN 5 HN GLN 5 16.045 -14.329 2.904 31 HA GLN 5 HA GLN 5 16.774 -11.752 3.868 32 1HB GLN 5 HB2 GLN 5 17.658 -13.254 1.398 33 2HB GLN 5 HB1 GLN 5 18.329 -11.705 1.892 34 1HG GLN 5 HG2 GLN 5 19.079 -12.718 3.995 35 2HG GLN 5 HG1 GLN 5 18.441 -14.272 3.459 36 1HE2 GLN 5 1HE2 GLN 5 19.548 -15.423 1.896 37 2HE2 GLN 5 2HE2 GLN 5 21.136 -15.021 1.392 38 H LEU 6 HN LEU 6 15.012 -12.916 1.105 39 HA LEU 6 HA LEU 6 14.653 -10.513 -0.249 40 1HB LEU 6 HB2 LEU 6 14.212 -12.743 -1.202 41 2HB LEU 6 HB1 LEU 6 12.906 -12.965 -0.069 42 HG LEU 6 HG LEU 6 12.310 -12.502 -2.502 43 1HD1 LEU 6 HD1 LEU 6 11.102 -10.806 -0.342 44 2HD1 LEU 6 HD1 LEU 6 10.380 -11.106 -1.919 45 3HD1 LEU 6 HD1 LEU 6 10.629 -12.442 -0.790 46 1HD2 LEU 6 HD2 LEU 6 13.087 -9.711 -1.678 47 2HD2 LEU 6 HD2 LEU 6 13.846 -10.684 -2.939 48 3HD2 LEU 6 HD2 LEU 6 12.182 -10.123 -3.129 49 H LYS 7 HN LYS 7 12.653 -12.057 2.250 50 HA LYS 7 HA LYS 7 10.640 -10.129 2.445 51 1HB LYS 7 HB2 LYS 7 11.494 -12.421 3.885 52 2HB LYS 7 HB1 LYS 7 11.171 -11.103 5.013 53 1HG LYS 7 HG2 LYS 7 9.229 -11.990 2.861 54 2HG LYS 7 HG1 LYS 7 9.216 -12.691 4.469 55 1HD LYS 7 HD2 LYS 7 8.852 -9.733 3.889 56 2HD LYS 7 HD1 LYS 7 7.523 -10.872 4.115 57 1HE LYS 7 HE2 LYS 7 8.379 -11.381 6.374 58 2HE LYS 7 HE1 LYS 7 9.659 -10.195 6.139 59 1HZ LYS 7 HZ3 LYS 7 6.743 -9.562 6.152 60 2HZ LYS 7 HZ2 LYS 7 7.818 -9.313 7.428 61 3HZ LYS 7 HZ1 LYS 7 7.986 -8.439 6.032 62 H ASN 8 HN ASN 8 13.757 -10.370 4.023 63 HA ASN 8 HA ASN 8 13.300 -8.155 5.695 64 1HB ASN 8 HB2 ASN 8 15.828 -9.598 4.969 65 2HB ASN 8 HB1 ASN 8 15.836 -8.079 5.865 66 1HD2 ASN 8 HD2 ASN 8 14.898 -11.446 5.979 67 2HD2 ASN 8 HD2 ASN 8 14.659 -11.487 7.682 68 H LYS 9 HN LYS 9 14.654 -8.385 2.474 69 HA LYS 9 HA LYS 9 15.448 -5.672 2.293 70 1HB LYS 9 HB2 LYS 9 14.510 -7.555 0.116 71 2HB LYS 9 HB1 LYS 9 15.215 -5.970 -0.166 72 1HG LYS 9 HG2 LYS 9 17.284 -6.709 0.897 73 2HG LYS 9 HG1 LYS 9 16.574 -8.309 1.143 74 1HD LYS 9 HD2 LYS 9 16.351 -8.580 -1.268 75 2HD LYS 9 HD1 LYS 9 17.000 -6.958 -1.519 76 1HE LYS 9 HE2 LYS 9 18.458 -9.257 -0.225 77 2HE LYS 9 HE1 LYS 9 18.711 -8.682 -1.874 78 1HZ LYS 9 HZ1 LYS 9 19.398 -6.528 -0.904 79 2HZ LYS 9 HZ3 LYS 9 19.272 -7.207 0.645 80 3HZ LYS 9 HZ2 LYS 9 20.379 -7.803 -0.473 81 H ILE 10 HN ILE 10 12.496 -7.345 1.396 82 HA ILE 10 HA ILE 10 10.861 -5.232 0.694 83 HB ILE 10 HB ILE 10 10.242 -7.821 2.111 84 1HG1 ILE 10 2HG1 ILE 10 9.701 -6.854 -0.678 85 2HG1 ILE 10 1HG1 ILE 10 11.001 -7.956 -0.208 86 1HG2 ILE 10 3HG2 ILE 10 8.200 -5.819 1.152 87 2HG2 ILE 10 2HG2 ILE 10 7.845 -7.464 1.675 88 3HG2 ILE 10 1HG2 ILE 10 8.499 -6.295 2.823 89 1HD1 ILE 10 HD1 ILE 10 9.288 -9.584 0.473 90 2HD1 ILE 10 HD1 ILE 10 8.036 -8.465 -0.069 91 3HD1 ILE 10 HD1 ILE 10 9.180 -9.148 -1.231 92 H GLU 11 HN GLU 11 11.408 -6.541 3.949 93 HA GLU 11 HA GLU 11 9.807 -4.790 5.377 94 1HB GLU 11 HB2 GLU 11 12.415 -6.075 6.135 95 2HB GLU 11 HB1 GLU 11 11.466 -5.119 7.259 96 1HG GLU 11 HG2 GLU 11 10.546 -7.600 5.850 97 2HG GLU 11 HG1 GLU 11 11.078 -7.507 7.528 98 H ASN 12 HN ASN 12 13.235 -4.438 4.587 99 HA ASN 12 HA ASN 12 13.562 -1.941 5.804 100 1HB ASN 12 HB2 ASN 12 15.561 -3.115 5.269 101 2HB ASN 12 HB1 ASN 12 15.111 -3.253 3.570 102 1HD2 ASN 12 HD2 ASN 12 15.625 -1.643 2.197 103 2HD2 ASN 12 HD2 ASN 12 16.361 -0.152 2.621 104 H LYS 13 HN LYS 13 12.751 -2.734 2.474 105 HA LYS 13 HA LYS 13 12.863 -0.052 1.611 106 1HB LYS 13 HB2 LYS 13 12.991 -2.302 0.269 107 2HB LYS 13 HB1 LYS 13 11.246 -2.147 0.216 108 1HG LYS 13 HG2 LYS 13 12.306 -1.256 -1.803 109 2HG LYS 13 HG1 LYS 13 11.427 -0.013 -0.913 110 1HD LYS 13 HD2 LYS 13 13.573 0.823 -1.692 111 2HD LYS 13 HD1 LYS 13 13.547 0.810 0.061 112 1HE LYS 13 HE2 LYS 13 15.653 0.031 -0.557 113 2HE LYS 13 HE1 LYS 13 14.777 -1.430 -0.135 114 1HZ LYS 13 HZ3 LYS 13 14.388 -1.783 -2.563 115 2HZ LYS 13 HZ2 LYS 13 15.292 -0.371 -2.848 116 3HZ LYS 13 HZ1 LYS 13 16.033 -1.699 -2.165 117 H LYS 14 HN LYS 14 10.235 -2.138 2.666 118 HA LYS 14 HA LYS 14 8.022 -0.511 2.324 119 1HB LYS 14 HB2 LYS 14 8.038 -2.901 2.982 120 2HB LYS 14 HB1 LYS 14 8.706 -2.441 4.534 121 1HG LYS 14 HG2 LYS 14 6.607 -1.165 4.968 122 2HG LYS 14 HG1 LYS 14 5.953 -1.836 3.472 123 1HD LYS 14 HD2 LYS 14 5.176 -3.239 5.270 124 2HD LYS 14 HD1 LYS 14 6.431 -4.133 4.408 125 1HE LYS 14 HE2 LYS 14 8.070 -3.410 6.122 126 2HE LYS 14 HE1 LYS 14 6.750 -2.593 6.958 127 1HZ LYS 14 HZ1 LYS 14 5.696 -4.906 7.174 128 2HZ LYS 14 HZ3 LYS 14 7.157 -5.523 6.586 129 3HZ LYS 14 HZ2 LYS 14 7.110 -4.663 8.004 130 H LYS 15 HN LYS 15 10.266 -0.874 5.061 131 HA LYS 15 HA LYS 15 9.039 1.037 6.734 132 1HB LYS 15 HB2 LYS 15 11.869 -0.010 6.781 133 2HB LYS 15 HB1 LYS 15 11.106 0.912 8.073 134 1HG LYS 15 HG2 LYS 15 9.509 -0.844 8.464 135 2HG LYS 15 HG1 LYS 15 10.081 -1.732 7.056 136 1HD LYS 15 HD2 LYS 15 11.045 -2.811 8.899 137 2HD LYS 15 HD1 LYS 15 12.341 -1.825 8.221 138 1HE LYS 15 HE2 LYS 15 12.390 -1.591 10.595 139 2HE LYS 15 HE1 LYS 15 11.791 -0.079 9.913 140 1HZ LYS 15 HZ3 LYS 15 9.513 -0.844 10.406 141 2HZ LYS 15 HZ2 LYS 15 10.138 -2.233 11.106 142 3HZ LYS 15 HZ1 LYS 15 10.463 -0.724 11.795 143 H GLU 16 HN GLU 16 11.793 1.313 4.490 144 HA GLU 16 HA GLU 16 12.414 4.001 4.975 145 1HB GLU 16 HB2 GLU 16 12.531 2.416 2.404 146 2HB GLU 16 HB1 GLU 16 13.093 4.072 2.504 147 1HG GLU 16 HG2 GLU 16 14.737 3.271 4.238 148 2HG GLU 16 HG1 GLU 16 14.212 1.627 3.858 149 H LEU 17 HN LEU 17 9.950 2.540 2.979 150 HA LEU 17 HA LEU 17 8.984 4.931 1.832 151 1HB LEU 17 HB2 LEU 17 8.611 2.918 0.648 152 2HB LEU 17 HB1 LEU 17 7.919 2.130 2.042 153 HG LEU 17 HG LEU 17 6.302 2.669 0.193 154 1HD1 LEU 17 HD1 LEU 17 5.554 2.063 2.253 155 2HD1 LEU 17 HD1 LEU 17 5.632 3.730 2.823 156 3HD1 LEU 17 HD1 LEU 17 4.506 3.289 1.520 157 1HD2 LEU 17 HD2 LEU 17 6.725 5.495 1.103 158 2HD2 LEU 17 HD2 LEU 17 7.163 4.839 -0.474 159 3HD2 LEU 17 HD2 LEU 17 5.464 4.938 -0.005 160 H ILE 18 HN ILE 18 7.911 2.969 4.564 161 HA ILE 18 HA ILE 18 5.603 4.325 5.150 162 HB ILE 18 HB ILE 18 7.520 2.982 7.086 163 1HG1 ILE 18 2HG1 ILE 18 4.862 2.000 6.064 164 2HG1 ILE 18 1HG1 ILE 18 6.367 1.652 5.230 165 1HG2 ILE 18 1HG2 ILE 18 6.123 4.573 8.356 166 2HG2 ILE 18 3HG2 ILE 18 4.665 3.883 7.660 167 3HG2 ILE 18 2HG2 ILE 18 5.670 2.924 8.733 168 1HD1 ILE 18 HD1 ILE 18 5.739 0.878 8.069 169 2HD1 ILE 18 HD1 ILE 18 5.630 -0.185 6.656 170 3HD1 ILE 18 HD1 ILE 18 7.185 0.469 7.152 171 H GLN 19 HN GLN 19 8.872 4.964 6.143 172 HA GLN 19 HA GLN 19 8.462 7.168 7.843 173 1HB GLN 19 HB2 GLN 19 10.822 6.578 6.061 174 2HB GLN 19 HB1 GLN 19 10.819 7.692 7.420 175 1HG GLN 19 HG2 GLN 19 10.452 5.854 8.955 176 2HG GLN 19 HG1 GLN 19 10.339 4.726 7.609 177 1HE2 GLN 19 1HE2 GLN 19 12.145 4.666 9.819 178 2HE2 GLN 19 2HE2 GLN 19 13.745 4.755 9.173 179 H LEU 20 HN LEU 20 8.838 6.912 4.351 180 HA LEU 20 HA LEU 20 9.003 9.704 3.877 181 1HB LEU 20 HB2 LEU 20 8.353 7.443 1.990 182 2HB LEU 20 HB1 LEU 20 8.607 9.110 1.500 183 HG LEU 20 HG LEU 20 10.679 7.326 2.780 184 1HD1 LEU 20 HD1 LEU 20 10.397 8.298 -0.053 185 2HD1 LEU 20 HD1 LEU 20 11.757 7.383 0.598 186 3HD1 LEU 20 HD1 LEU 20 10.159 6.645 0.514 187 1HD2 LEU 20 HD2 LEU 20 10.901 10.129 1.674 188 2HD2 LEU 20 HD2 LEU 20 11.023 9.669 3.373 189 3HD2 LEU 20 HD2 LEU 20 12.244 9.131 2.224 190 H VAL 21 HN VAL 21 6.311 7.343 3.494 191 HA VAL 21 HA VAL 21 4.384 9.285 2.868 192 HB VAL 21 HB VAL 21 3.859 6.797 4.515 193 1HG1 VAL 21 1HG1 VAL 21 2.086 8.346 2.628 194 2HG1 VAL 21 3HG1 VAL 21 1.643 6.848 3.451 195 3HG1 VAL 21 2HG1 VAL 21 1.964 8.315 4.385 196 1HG2 VAL 21 1HG2 VAL 21 4.065 7.072 1.525 197 2HG2 VAL 21 3HG2 VAL 21 5.138 6.169 2.601 198 3HG2 VAL 21 2HG2 VAL 21 3.466 5.648 2.386 199 H ALA 22 HN ALA 22 5.528 8.119 5.988 200 HA ALA 22 HA ALA 22 3.735 9.359 7.677 201 1HB ALA 22 HB1 ALA 22 6.648 8.809 8.182 202 2HB ALA 22 HB3 ALA 22 5.414 9.073 9.422 203 3HB ALA 22 HB2 ALA 22 5.328 7.656 8.372 204 H ARG 23 HN ARG 23 6.891 10.521 6.584 205 HA ARG 23 HA ARG 23 6.800 12.970 7.976 206 1HB ARG 23 HB2 ARG 23 8.735 13.641 6.666 207 2HB ARG 23 HB1 ARG 23 8.908 11.995 7.243 208 1HG ARG 23 HG2 ARG 23 8.254 11.170 5.042 209 2HG ARG 23 HG1 ARG 23 8.126 12.829 4.464 210 1HD ARG 23 HD2 ARG 23 10.604 11.506 5.543 211 2HD ARG 23 HD1 ARG 23 10.273 11.865 3.845 212 HE ARG 23 HE ARG 23 10.109 14.239 4.641 213 1HH1 ARG 23 1HH1 ARG 23 12.286 11.856 6.144 214 2HH1 ARG 23 2HH1 ARG 23 13.390 13.034 6.667 215 1HH2 ARG 23 1HH2 ARG 23 11.670 15.839 5.408 216 2HH2 ARG 23 2HH2 ARG 23 13.056 15.305 6.236 217 H HIS 24 HN HIS 24 5.305 12.013 5.087 218 HA HIS 24 HA HIS 24 4.980 14.420 3.724 219 1HB HIS 24 HB2 HIS 24 4.366 12.368 2.666 220 2HB HIS 24 HB1 HIS 24 3.200 11.950 3.892 221 HD1 HIS 24 HD1 HIS 24 0.800 13.118 3.647 222 HD2 HIS 24 HD2 HIS 24 3.578 14.225 0.768 223 HE1 HIS 24 HE1 HIS 24 -0.467 14.422 1.921 224 H GLY 25 HN GLY 25 3.415 13.254 6.636 225 1HA GLY 25 HA1 GLY 25 1.392 15.357 6.472 226 2HA GLY 25 HA2 GLY 25 2.626 15.566 7.709 227 H LEU 26 HN LEU 26 2.142 12.290 7.443 228 HA LEU 26 HA LEU 26 -0.207 11.898 8.853 229 1HB LEU 26 HB2 LEU 26 2.274 10.333 8.408 230 2HB LEU 26 HB1 LEU 26 1.014 9.716 9.448 231 HG LEU 26 HG LEU 26 -0.548 9.842 7.537 232 1HD1 LEU 26 HD1 LEU 26 0.469 11.504 6.179 233 2HD1 LEU 26 HD1 LEU 26 1.864 10.457 5.888 234 3HD1 LEU 26 HD1 LEU 26 0.267 10.002 5.278 235 1HD2 LEU 26 HD2 LEU 26 1.901 8.148 7.181 236 2HD2 LEU 26 HD2 LEU 26 0.463 7.757 8.127 237 3HD2 LEU 26 HD2 LEU 26 0.374 7.865 6.362 238 H ASP 27 HN ASP 27 -0.355 11.008 10.980 239 HA ASP 27 HA ASP 27 1.486 12.289 12.881 240 1HB ASP 27 HB2 ASP 27 -1.301 11.218 13.413 241 2HB ASP 27 HB1 ASP 27 -0.296 12.120 14.536 242 H HIS 28 HN HIS 28 1.465 10.874 14.996 243 HA HIS 28 HA HIS 28 2.875 8.561 14.418 244 1HB HIS 28 HB2 HIS 28 2.697 7.952 16.798 245 2HB HIS 28 HB1 HIS 28 3.152 9.646 16.564 246 HD1 HIS 28 HD1 HIS 28 1.014 7.524 18.552 247 HD2 HIS 28 HD2 HIS 28 0.737 11.371 16.995 248 HE1 HIS 28 HE1 HIS 28 -0.748 8.686 19.889 249 H ASP 29 HN ASP 29 -0.456 8.787 15.447 250 HA ASP 29 HA ASP 29 -1.111 6.068 15.489 251 1HB ASP 29 HB2 ASP 29 -3.448 6.736 15.316 252 2HB ASP 29 HB1 ASP 29 -2.606 7.833 16.397 253 H LYS 30 HN LYS 30 -1.053 8.349 12.899 254 HA LYS 30 HA LYS 30 -2.290 6.710 10.952 255 1HB LYS 30 HB2 LYS 30 -0.528 9.108 10.684 256 2HB LYS 30 HB1 LYS 30 -1.273 8.337 9.299 257 1HG LYS 30 HG2 LYS 30 -2.659 9.691 11.623 258 2HG LYS 30 HG1 LYS 30 -2.530 10.283 9.965 259 1HD LYS 30 HD2 LYS 30 -3.833 8.367 9.181 260 2HD LYS 30 HD1 LYS 30 -3.978 7.782 10.836 261 1HE LYS 30 HE2 LYS 30 -5.097 10.355 9.726 262 2HE LYS 30 HE1 LYS 30 -6.005 8.928 10.217 263 1HZ LYS 30 HZ1 LYS 30 -5.010 9.334 12.519 264 2HZ LYS 30 HZ3 LYS 30 -4.566 10.855 11.939 265 3HZ LYS 30 HZ2 LYS 30 -6.169 10.425 11.983 266 H VAL 31 HN VAL 31 1.079 7.262 11.823 267 HA VAL 31 HA VAL 31 2.205 5.803 9.701 268 HB VAL 31 HB VAL 31 3.345 6.187 12.493 269 1HG1 VAL 31 3HG1 VAL 31 4.537 4.509 11.219 270 2HG1 VAL 31 2HG1 VAL 31 4.724 5.642 9.883 271 3HG1 VAL 31 1HG1 VAL 31 5.517 5.964 11.423 272 1HG2 VAL 31 2HG2 VAL 31 2.689 8.321 11.518 273 2HG2 VAL 31 1HG2 VAL 31 4.450 8.180 11.595 274 3HG2 VAL 31 3HG2 VAL 31 3.601 7.946 10.064 275 H LEU 32 HN LEU 32 1.176 4.939 12.942 276 HA LEU 32 HA LEU 32 1.876 2.191 12.956 277 1HB LEU 32 HB2 LEU 32 -0.433 3.557 14.313 278 2HB LEU 32 HB1 LEU 32 0.217 1.982 14.713 279 HG LEU 32 HG LEU 32 1.652 4.615 15.022 280 1HD1 LEU 32 HD1 LEU 32 0.489 2.736 17.040 281 2HD1 LEU 32 HD1 LEU 32 1.440 4.180 17.400 282 3HD1 LEU 32 HD1 LEU 32 -0.135 4.328 16.608 283 1HD2 LEU 32 HD2 LEU 32 2.511 1.815 15.756 284 2HD2 LEU 32 HD2 LEU 32 3.218 2.831 14.501 285 3HD2 LEU 32 HD2 LEU 32 3.365 3.293 16.195 286 H LEU 33 HN LEU 33 -1.176 3.765 12.134 287 HA LEU 33 HA LEU 33 -2.563 1.446 11.393 288 1HB LEU 33 HB2 LEU 33 -2.896 4.278 10.423 289 2HB LEU 33 HB1 LEU 33 -4.037 2.986 10.121 290 HG LEU 33 HG LEU 33 -3.319 4.031 12.855 291 1HD1 LEU 33 HD1 LEU 33 -5.753 4.549 11.149 292 2HD1 LEU 33 HD1 LEU 33 -5.539 5.053 12.827 293 3HD1 LEU 33 HD1 LEU 33 -4.497 5.718 11.578 294 1HD2 LEU 33 HD2 LEU 33 -5.426 2.083 11.922 295 2HD2 LEU 33 HD2 LEU 33 -4.017 1.724 12.921 296 3HD2 LEU 33 HD2 LEU 33 -5.303 2.742 13.555 297 H PHE 34 HN PHE 34 -0.691 3.716 9.420 298 HA PHE 34 HA PHE 34 -1.175 2.481 6.966 299 1HB PHE 34 HB2 PHE 34 -0.285 4.753 7.130 300 2HB PHE 34 HB1 PHE 34 1.200 4.138 7.845 301 HD1 PHE 34 HD1 PHE 34 3.020 3.706 6.460 302 HD2 PHE 34 HD2 PHE 34 -0.884 3.826 4.784 303 HE1 PHE 34 HE1 PHE 34 3.972 3.464 4.182 304 HE2 PHE 34 HE2 PHE 34 0.073 3.599 2.536 305 HZ PHE 34 HZ PHE 34 2.503 3.412 2.256 306 H SER 35 HN SER 35 1.578 2.112 9.197 307 HA SER 35 HA SER 35 2.944 0.300 7.564 308 1HB SER 35 HB2 SER 35 4.283 -0.212 9.639 309 2HB SER 35 HB1 SER 35 4.170 1.495 9.211 310 HG SER 35 HG SER 35 2.740 1.825 10.812 311 H ARG 36 HN ARG 36 0.589 -0.299 10.121 312 HA ARG 36 HA ARG 36 1.029 -3.110 10.049 313 1HB ARG 36 HB2 ARG 36 -0.963 -3.323 11.454 314 2HB ARG 36 HB1 ARG 36 0.125 -2.087 12.064 315 1HG ARG 36 HG2 ARG 36 -1.333 -0.385 10.996 316 2HG ARG 36 HG1 ARG 36 -2.450 -1.678 10.571 317 1HD ARG 36 HD2 ARG 36 -1.569 -0.930 13.338 318 2HD ARG 36 HD1 ARG 36 -3.117 -0.525 12.609 319 HE ARG 36 HE ARG 36 -2.544 -3.348 12.627 320 1HH1 ARG 36 1HH1 ARG 36 -3.968 -0.706 14.515 321 2HH1 ARG 36 2HH1 ARG 36 -5.078 -1.712 15.317 322 1HH2 ARG 36 1HH2 ARG 36 -4.032 -4.712 13.751 323 2HH2 ARG 36 2HH2 ARG 36 -5.119 -4.030 14.882 324 H ASP 37 HN ASP 37 -1.257 -0.970 8.402 325 HA ASP 37 HA ASP 37 -2.819 -3.085 7.292 326 1HB ASP 37 HB2 ASP 37 -3.521 -0.629 7.475 327 2HB ASP 37 HB1 ASP 37 -2.465 -0.330 6.106 328 H LEU 38 HN LEU 38 -0.112 -1.174 6.255 329 HA LEU 38 HA LEU 38 0.198 -2.137 3.656 330 1HB LEU 38 HB2 LEU 38 1.247 -0.121 4.392 331 2HB LEU 38 HB1 LEU 38 2.137 -0.969 5.627 332 HG LEU 38 HG LEU 38 3.643 -1.906 4.016 333 1HD1 LEU 38 HD1 LEU 38 1.878 -0.675 1.902 334 2HD1 LEU 38 HD1 LEU 38 3.416 -1.510 1.655 335 3HD1 LEU 38 HD1 LEU 38 2.023 -2.412 2.256 336 1HD2 LEU 38 HD2 LEU 38 2.975 0.923 3.379 337 2HD2 LEU 38 HD2 LEU 38 4.036 0.377 4.677 338 3HD2 LEU 38 HD2 LEU 38 4.507 0.128 2.985 339 H ASP 39 HN ASP 39 1.564 -3.236 6.727 340 HA ASP 39 HA ASP 39 3.215 -5.213 5.624 341 1HB ASP 39 HB2 ASP 39 3.313 -4.423 8.006 342 2HB ASP 39 HB1 ASP 39 1.852 -5.354 8.319 343 H LYS 40 HN LYS 40 -0.136 -5.323 6.750 344 HA LYS 40 HA LYS 40 -0.557 -8.055 6.194 345 1HB LYS 40 HB2 LYS 40 -2.517 -5.777 6.311 346 2HB LYS 40 HB1 LYS 40 -2.977 -7.459 6.114 347 1HG LYS 40 HG2 LYS 40 -1.925 -7.957 8.291 348 2HG LYS 40 HG1 LYS 40 -1.555 -6.240 8.474 349 1HD LYS 40 HD2 LYS 40 -3.935 -5.707 8.356 350 2HD LYS 40 HD1 LYS 40 -4.314 -7.418 8.152 351 1HE LYS 40 HE2 LYS 40 -3.005 -6.154 10.553 352 2HE LYS 40 HE1 LYS 40 -4.681 -6.690 10.450 353 1HZ LYS 40 HZ2 LYS 40 -3.845 -8.978 10.103 354 2HZ LYS 40 HZ1 LYS 40 -2.270 -8.423 10.291 355 3HZ LYS 40 HZ3 LYS 40 -3.361 -8.341 11.568 356 H LEU 41 HN LEU 41 -0.926 -5.176 4.199 357 HA LEU 41 HA LEU 41 -2.149 -6.433 2.013 358 1HB LEU 41 HB2 LEU 41 -2.150 -4.011 2.249 359 2HB LEU 41 HB1 LEU 41 -0.408 -3.965 2.141 360 HG LEU 41 HG LEU 41 -0.469 -4.524 -0.214 361 1HD1 LEU 41 HD1 LEU 41 -3.470 -4.707 0.118 362 2HD1 LEU 41 HD1 LEU 41 -2.585 -4.821 -1.402 363 3HD1 LEU 41 HD1 LEU 41 -2.384 -6.069 -0.173 364 1HD2 LEU 41 HD2 LEU 41 -2.492 -2.417 0.497 365 2HD2 LEU 41 HD2 LEU 41 -0.741 -2.198 0.336 366 3HD2 LEU 41 HD2 LEU 41 -1.726 -2.623 -1.071 367 H ILE 42 HN ILE 42 1.202 -5.917 2.841 368 HA ILE 42 HA ILE 42 2.187 -7.150 0.478 369 HB ILE 42 HB ILE 42 3.567 -6.575 3.121 370 1HG1 ILE 42 2HG1 ILE 42 3.684 -5.259 0.406 371 2HG1 ILE 42 1HG1 ILE 42 2.907 -4.608 1.840 372 1HG2 ILE 42 1HG2 ILE 42 4.673 -8.483 2.062 373 2HG2 ILE 42 3HG2 ILE 42 4.813 -7.576 0.555 374 3HG2 ILE 42 2HG2 ILE 42 5.692 -7.043 1.986 375 1HD1 ILE 42 HD1 ILE 42 5.855 -5.084 1.489 376 2HD1 ILE 42 HD1 ILE 42 5.034 -3.524 1.400 377 3HD1 ILE 42 HD1 ILE 42 5.069 -4.412 2.923 378 H ASN 43 HN ASN 43 1.642 -8.334 3.771 379 HA ASN 43 HA ASN 43 2.555 -10.967 3.401 380 1HB ASN 43 HB2 ASN 43 0.273 -10.095 5.203 381 2HB ASN 43 HB1 ASN 43 1.089 -11.652 5.238 382 1HD2 ASN 43 HD2 ASN 43 0.802 -9.675 7.305 383 2HD2 ASN 43 HD2 ASN 43 2.384 -9.159 7.766 384 H LYS 44 HN LYS 44 -0.373 -9.450 2.485 385 HA LYS 44 HA LYS 44 -1.960 -11.708 1.942 386 1HB LYS 44 HB2 LYS 44 -2.827 -9.452 2.226 387 2HB LYS 44 HB1 LYS 44 -2.000 -8.932 0.770 388 1HG LYS 44 HG2 LYS 44 -3.426 -10.461 -0.547 389 2HG LYS 44 HG1 LYS 44 -4.263 -10.901 0.946 390 1HD LYS 44 HD2 LYS 44 -4.140 -8.142 -0.240 391 2HD LYS 44 HD1 LYS 44 -5.514 -9.241 -0.299 392 1HE LYS 44 HE2 LYS 44 -4.291 -8.037 2.190 393 2HE LYS 44 HE1 LYS 44 -5.814 -7.606 1.427 394 1HZ LYS 44 HZ2 LYS 44 -5.238 -10.277 2.651 395 2HZ LYS 44 HZ1 LYS 44 -6.133 -9.015 3.337 396 3HZ LYS 44 HZ3 LYS 44 -6.697 -9.775 1.947 397 H PHE 45 HN PHE 45 0.036 -9.670 -0.168 398 HA PHE 45 HA PHE 45 -0.458 -11.344 -2.426 399 1HB PHE 45 HB2 PHE 45 1.225 -8.917 -1.979 400 2HB PHE 45 HB1 PHE 45 1.404 -9.848 -3.458 401 HD1 PHE 45 HD1 PHE 45 -1.025 -7.890 -1.427 402 HD2 PHE 45 HD2 PHE 45 -0.159 -9.691 -5.190 403 HE1 PHE 45 HE1 PHE 45 -2.938 -6.726 -2.429 404 HE2 PHE 45 HE2 PHE 45 -2.071 -8.531 -6.188 405 HZ PHE 45 HZ PHE 45 -3.462 -7.040 -4.807 406 H MET 46 HN MET 46 2.058 -11.021 -0.110 407 HA MET 46 HA MET 46 3.976 -12.715 -1.409 408 1HB MET 46 HB2 MET 46 3.576 -11.870 1.451 409 2HB MET 46 HB1 MET 46 4.926 -12.865 0.940 410 1HG MET 46 HG2 MET 46 4.364 -10.139 -0.197 411 2HG MET 46 HG1 MET 46 5.346 -10.393 1.242 412 1HE MET 46 HE2 MET 46 7.656 -11.509 1.286 413 2HE MET 46 HE1 MET 46 6.969 -13.001 0.646 414 3HE MET 46 HE3 MET 46 8.413 -12.305 -0.093 415 H ASN 47 HN ASN 47 1.233 -13.123 0.609 416 HA ASN 47 HA ASN 47 0.259 -14.744 1.720 417 1HB ASN 47 HB2 ASN 47 0.002 -15.875 -0.489 418 2HB ASN 47 HB1 ASN 47 1.573 -16.635 -0.273 419 1HD2 ASN 47 HD2 ASN 47 0.671 -18.710 -0.398 420 2HD2 ASN 47 HD2 ASN 47 -0.256 -19.386 0.886 421 H VAL 48 HN VAL 48 1.720 -13.934 3.221 422 HA VAL 48 HA VAL 48 3.895 -15.689 4.097 423 HB VAL 48 HB VAL 48 2.749 -13.212 5.425 424 1HG1 VAL 48 2HG1 VAL 48 3.864 -14.703 7.012 425 2HG1 VAL 48 1HG1 VAL 48 5.303 -14.734 5.989 426 3HG1 VAL 48 3HG1 VAL 48 4.809 -13.235 6.780 427 1HG2 VAL 48 3HG2 VAL 48 3.784 -12.680 3.282 428 2HG2 VAL 48 2HG2 VAL 48 4.727 -12.026 4.620 429 3HG2 VAL 48 1HG2 VAL 48 5.266 -13.486 3.784 430 H LYS 49 HN LYS 49 3.567 -17.296 5.198 431 HA LYS 49 HA LYS 49 1.072 -17.387 6.654 432 1HB LYS 49 HB2 LYS 49 2.712 -19.641 5.542 433 2HB LYS 49 HB1 LYS 49 1.280 -19.817 6.546 434 1HG LYS 49 HG2 LYS 49 -0.036 -18.663 4.807 435 2HG LYS 49 HG1 LYS 49 1.400 -18.589 3.799 436 1HD LYS 49 HD2 LYS 49 0.006 -20.481 3.152 437 2HD LYS 49 HD1 LYS 49 1.537 -21.043 3.815 438 1HE LYS 49 HE2 LYS 49 -0.332 -22.392 4.659 439 2HE LYS 49 HE1 LYS 49 0.443 -21.527 5.971 440 1HZ LYS 49 HZ3 LYS 49 -2.046 -20.667 4.596 441 2HZ LYS 49 HZ2 LYS 49 -2.018 -21.443 6.086 442 3HZ LYS 49 HZ1 LYS 49 -1.367 -19.901 5.928 443 H ASP 50 HN ASP 50 1.517 -16.843 8.602 444 HA ASP 50 HA ASP 50 3.815 -17.614 10.061 445 1HB ASP 50 HB2 ASP 50 2.078 -16.026 11.007 446 2HB ASP 50 HB1 ASP 50 0.998 -17.404 11.202 447 H LYS 51 HN LYS 51 4.421 -19.577 10.581 448 HA LYS 51 HA LYS 51 3.088 -21.553 9.170 449 1HB LYS 51 HB2 LYS 51 5.003 -23.065 9.879 450 2HB LYS 51 HB1 LYS 51 5.306 -21.684 8.851 451 1HG LYS 51 HG2 LYS 51 6.051 -20.443 10.890 452 2HG LYS 51 HG1 LYS 51 5.922 -21.964 11.778 453 1HD LYS 51 HD2 LYS 51 7.521 -23.021 10.350 454 2HD LYS 51 HD1 LYS 51 7.523 -21.635 9.261 455 1HE LYS 51 HE2 LYS 51 8.473 -20.257 11.061 456 2HE LYS 51 HE1 LYS 51 8.510 -21.685 12.097 457 1HZ LYS 51 HZ3 LYS 51 9.971 -21.415 9.523 458 2HZ LYS 51 HZ2 LYS 51 10.654 -21.230 11.032 459 3HZ LYS 51 HZ1 LYS 51 10.041 -22.734 10.574 460 H VAL 52 HN VAL 52 1.854 -20.821 11.817 461 HA VAL 52 HA VAL 52 1.193 -23.612 12.401 462 HB VAL 52 HB VAL 52 0.077 -22.845 14.448 463 1HG1 VAL 52 2HG1 VAL 52 2.930 -21.943 14.180 464 2HG1 VAL 52 1HG1 VAL 52 2.098 -22.234 15.712 465 3HG1 VAL 52 3HG1 VAL 52 2.374 -23.563 14.588 466 1HG2 VAL 52 3HG2 VAL 52 1.149 -20.129 13.703 467 2HG2 VAL 52 2HG2 VAL 52 -0.545 -20.604 13.759 468 3HG2 VAL 52 1HG2 VAL 52 0.400 -20.539 15.247 469 H HIS 53 HN HIS 53 0.167 -20.942 10.703 470 HA HIS 53 HA HIS 53 -2.645 -21.492 10.966 471 1HB HIS 53 HB2 HIS 53 -1.188 -19.536 9.161 472 2HB HIS 53 HB1 HIS 53 -2.935 -19.678 9.264 473 HD1 HIS 53 HD1 HIS 53 -0.961 -17.154 10.066 474 HD2 HIS 53 HD2 HIS 53 -3.110 -19.672 12.584 475 HE1 HIS 53 HE1 HIS 53 -1.325 -15.871 12.185 476 H LYS 54 HN LYS 54 -3.656 -22.856 9.768 477 HA LYS 54 HA LYS 54 -2.257 -24.553 7.929 478 1HB LYS 54 HB2 LYS 54 -5.182 -24.502 8.662 479 2HB LYS 54 HB1 LYS 54 -4.336 -25.814 7.863 480 1HG LYS 54 HG2 LYS 54 -3.797 -24.838 10.655 481 2HG LYS 54 HG1 LYS 54 -4.744 -26.265 10.233 482 1HD LYS 54 HD2 LYS 54 -2.767 -27.249 9.189 483 2HD LYS 54 HD1 LYS 54 -1.824 -25.823 9.624 484 1HE LYS 54 HE2 LYS 54 -3.213 -27.657 11.574 485 2HE LYS 54 HE1 LYS 54 -1.494 -27.694 11.189 486 1HZ LYS 54 HZ1 LYS 54 -1.349 -25.389 12.029 487 2HZ LYS 54 HZ3 LYS 54 -2.963 -25.460 12.516 488 3HZ LYS 54 HZ2 LYS 54 -1.817 -26.474 13.197 489 H LEU 55 HN LEU 55 -3.986 -25.290 6.039 490 HA LEU 55 HA LEU 55 -4.145 -23.064 4.254 491 1HB LEU 55 HB2 LEU 55 -3.133 -24.998 3.460 492 2HB LEU 55 HB1 LEU 55 -4.407 -26.027 4.116 493 HG LEU 55 HG LEU 55 -5.924 -24.994 2.518 494 1HD1 LEU 55 HD1 LEU 55 -4.655 -22.983 1.964 495 2HD1 LEU 55 HD1 LEU 55 -3.374 -23.965 1.265 496 3HD1 LEU 55 HD1 LEU 55 -4.956 -23.912 0.491 497 1HD2 LEU 55 HD2 LEU 55 -3.614 -26.555 1.394 498 2HD2 LEU 55 HD2 LEU 55 -5.086 -27.201 2.120 499 3HD2 LEU 55 HD2 LEU 55 -5.166 -26.346 0.579 500 H GLU 56 HN GLU 56 -5.869 -21.986 4.566 501 HA GLU 56 HA GLU 56 -8.493 -23.133 4.231 502 1HB GLU 56 HB2 GLU 56 -7.951 -23.519 6.694 503 2HB GLU 56 HB1 GLU 56 -8.049 -21.778 6.889 504 1HG GLU 56 HG2 GLU 56 -10.129 -22.763 7.532 505 2HG GLU 56 HG1 GLU 56 -10.359 -21.844 6.043 506 H HIS 57 HN HIS 57 -6.692 -20.328 5.340 507 HA HIS 57 HA HIS 57 -8.485 -18.287 4.997 508 1HB HIS 57 HB2 HIS 57 -6.567 -16.764 4.738 509 2HB HIS 57 HB1 HIS 57 -6.320 -17.924 6.036 510 HD1 HIS 57 HD1 HIS 57 -4.899 -16.786 2.788 511 HD2 HIS 57 HD2 HIS 57 -4.362 -19.906 5.482 512 HE1 HIS 57 HE1 HIS 57 -2.744 -17.910 2.141 513 H HIS 58 HN HIS 58 -6.728 -19.895 2.371 514 HA HIS 58 HA HIS 58 -7.430 -17.751 0.553 515 1HB HIS 58 HB2 HIS 58 -5.172 -18.881 0.455 516 2HB HIS 58 HB1 HIS 58 -5.972 -20.334 -0.117 517 HD1 HIS 58 HD1 HIS 58 -6.148 -20.505 -2.677 518 HD2 HIS 58 HD2 HIS 58 -5.573 -16.598 -1.347 519 HE1 HIS 58 HE1 HIS 58 -5.829 -19.099 -4.736 520 H HIS 59 HN HIS 59 -8.854 -20.528 1.720 521 HA HIS 59 HA HIS 59 -10.513 -21.020 -0.602 522 1HB HIS 59 HB2 HIS 59 -10.925 -21.879 2.287 523 2HB HIS 59 HB1 HIS 59 -11.896 -22.409 0.925 524 HD1 HIS 59 HD1 HIS 59 -9.825 -23.973 3.027 525 HD2 HIS 59 HD2 HIS 59 -9.584 -23.404 -1.078 526 HE1 HIS 59 HE1 HIS 59 -8.256 -25.769 2.152 527 H HIS 60 HN HIS 60 -10.293 -19.008 2.104 528 HA HIS 60 HA HIS 60 -11.402 -17.248 2.909 529 1HB HIS 60 HB2 HIS 60 -13.140 -17.474 0.414 530 2HB HIS 60 HB1 HIS 60 -13.142 -16.113 1.531 531 HD1 HIS 60 HD1 HIS 60 -11.536 -17.278 -1.575 532 HD2 HIS 60 HD2 HIS 60 -10.559 -14.750 1.591 533 HE1 HIS 60 HE1 HIS 60 -9.663 -15.843 -2.385 534 H HIS 61 HN HIS 61 -13.985 -19.006 1.387 535 HA HIS 61 HA HIS 61 -14.838 -20.209 3.861 536 1HB HIS 61 HB2 HIS 61 -16.658 -18.394 2.216 537 2HB HIS 61 HB1 HIS 61 -17.292 -19.644 3.277 538 HD1 HIS 61 HD1 HIS 61 -16.981 -16.155 3.355 539 HD2 HIS 61 HD2 HIS 61 -15.883 -19.174 5.994 540 HE1 HIS 61 HE1 HIS 61 -16.774 -15.071 5.609 541 H HIS 62 HN HIS 62 -15.901 -19.590 0.553 542 HA HIS 62 HA HIS 62 -15.045 -21.960 -0.541 543 1HB HIS 62 HB2 HIS 62 -16.901 -22.992 0.779 544 2HB HIS 62 HB1 HIS 62 -18.037 -21.894 0.004 545 HD1 HIS 62 HD1 HIS 62 -19.037 -22.713 -2.204 546 HD2 HIS 62 HD2 HIS 62 -15.632 -24.805 -1.075 547 HE1 HIS 62 HE1 HIS 62 -18.788 -24.577 -3.859 548 H1 MET 101 HT3 MET 101 10.566 24.039 -1.381 549 H2 MET 101 HT2 MET 101 11.216 24.162 0.166 550 H3 MET 101 HT1 MET 101 11.098 22.660 -0.589 551 HA MET 101 HA MET 101 9.360 22.756 0.988 552 1HB MET 101 HB2 MET 101 8.675 25.355 -0.385 553 2HB MET 101 HB1 MET 101 7.553 24.513 0.668 554 1HG MET 101 HG2 MET 101 10.259 25.559 1.476 555 2HG MET 101 HG1 MET 101 8.720 26.344 1.792 556 1HE MET 101 HE3 MET 101 6.868 25.427 3.428 557 2HE MET 101 HE2 MET 101 6.799 23.894 2.555 558 3HE MET 101 HE1 MET 101 6.993 23.901 4.302 559 H GLU 102 HN GLU 102 9.971 22.214 -2.075 560 HA GLU 102 HA GLU 102 7.276 21.900 -3.019 561 1HB GLU 102 HB2 GLU 102 9.881 21.186 -4.403 562 2HB GLU 102 HB1 GLU 102 8.292 21.275 -5.139 563 1HG GLU 102 HG2 GLU 102 9.355 23.249 -5.832 564 2HG GLU 102 HG1 GLU 102 8.331 23.761 -4.500 565 H MET 103 HN MET 103 6.193 20.160 -2.643 566 HA MET 103 HA MET 103 7.481 17.940 -1.320 567 1HB MET 103 HB2 MET 103 4.554 18.443 -1.890 568 2HB MET 103 HB1 MET 103 5.197 17.173 -0.860 569 1HG MET 103 HG2 MET 103 6.111 18.845 0.664 570 2HG MET 103 HG1 MET 103 5.519 20.131 -0.381 571 1HE MET 103 HE1 MET 103 4.584 17.283 2.137 572 2HE MET 103 HE3 MET 103 2.823 17.312 2.090 573 3HE MET 103 HE2 MET 103 3.731 16.751 0.688 574 H GLY 104 HN GLY 104 7.062 18.666 -4.447 575 1HA GLY 104 HA1 GLY 104 6.947 17.439 -6.415 576 2HA GLY 104 HA2 GLY 104 6.011 16.255 -5.510 577 H GLN 105 HN GLN 105 9.252 17.341 -4.756 578 HA GLN 105 HA GLN 105 10.515 15.029 -5.824 579 1HB GLN 105 HB2 GLN 105 11.515 16.991 -3.757 580 2HB GLN 105 HB1 GLN 105 12.501 15.747 -4.517 581 1HG GLN 105 HG2 GLN 105 11.145 18.046 -5.905 582 2HG GLN 105 HG1 GLN 105 12.868 17.873 -5.579 583 1HE2 GLN 105 1HE2 GLN 105 14.061 16.423 -6.778 584 2HE2 GLN 105 2HE2 GLN 105 13.495 15.742 -8.246 585 H LEU 106 HN LEU 106 9.143 15.846 -2.791 586 HA LEU 106 HA LEU 106 10.074 13.633 -1.301 587 1HB LEU 106 HB2 LEU 106 9.190 15.676 -0.247 588 2HB LEU 106 HB1 LEU 106 7.629 15.409 -0.968 589 HG LEU 106 HG LEU 106 7.822 14.973 1.522 590 1HD1 LEU 106 HD1 LEU 106 5.933 14.136 0.286 591 2HD1 LEU 106 HD1 LEU 106 6.838 12.693 -0.154 592 3HD1 LEU 106 HD1 LEU 106 6.433 12.993 1.534 593 1HD2 LEU 106 HD2 LEU 106 9.996 13.872 1.528 594 2HD2 LEU 106 HD2 LEU 106 8.758 12.834 2.238 595 3HD2 LEU 106 HD2 LEU 106 9.328 12.530 0.597 596 H LYS 107 HN LYS 107 7.115 14.261 -3.145 597 HA LYS 107 HA LYS 107 5.963 11.716 -2.766 598 1HB LYS 107 HB2 LYS 107 5.240 14.109 -4.062 599 2HB LYS 107 HB1 LYS 107 5.210 12.864 -5.305 600 1HG LYS 107 HG2 LYS 107 3.801 12.668 -2.671 601 2HG LYS 107 HG1 LYS 107 3.025 13.209 -4.158 602 1HD LYS 107 HD2 LYS 107 4.363 10.511 -3.820 603 2HD LYS 107 HD1 LYS 107 2.646 10.778 -3.544 604 1HE LYS 107 HE2 LYS 107 4.062 11.371 -6.129 605 2HE LYS 107 HE1 LYS 107 3.225 9.859 -5.802 606 1HZ LYS 107 HZ1 LYS 107 1.956 12.558 -5.833 607 2HZ LYS 107 HZ3 LYS 107 1.868 11.403 -7.049 608 3HZ LYS 107 HZ2 LYS 107 1.160 11.093 -5.560 609 H ASN 108 HN ASN 108 8.184 12.988 -5.140 610 HA ASN 108 HA ASN 108 8.191 10.805 -6.893 611 1HB ASN 108 HB2 ASN 108 9.181 12.909 -7.555 612 2HB ASN 108 HB1 ASN 108 10.381 12.795 -6.280 613 1HD2 ASN 108 HD2 ASN 108 12.236 11.681 -6.647 614 2HD2 ASN 108 HD2 ASN 108 12.597 10.862 -8.112 615 H LYS 109 HN LYS 109 10.086 11.444 -3.992 616 HA LYS 109 HA LYS 109 11.545 9.025 -4.216 617 1HB LYS 109 HB2 LYS 109 11.055 10.710 -1.769 618 2HB LYS 109 HB1 LYS 109 12.128 9.320 -1.810 619 1HG LYS 109 HG2 LYS 109 13.292 10.562 -3.737 620 2HG LYS 109 HG1 LYS 109 12.436 11.978 -3.132 621 1HD LYS 109 HD2 LYS 109 14.249 10.198 -1.530 622 2HD LYS 109 HD1 LYS 109 14.702 11.768 -2.200 623 1HE LYS 109 HE2 LYS 109 13.005 12.836 -0.775 624 2HE LYS 109 HE1 LYS 109 12.560 11.256 -0.129 625 1HZ LYS 109 HZ3 LYS 109 15.237 12.500 0.107 626 2HZ LYS 109 HZ2 LYS 109 14.117 12.472 1.340 627 3HZ LYS 109 HZ1 LYS 109 14.791 11.026 0.769 628 H ILE 110 HN ILE 110 8.568 9.874 -2.611 629 HA ILE 110 HA ILE 110 8.053 7.435 -1.332 630 HB ILE 110 HB ILE 110 6.075 9.362 -2.600 631 1HG1 ILE 110 2HG1 ILE 110 6.900 8.925 0.278 632 2HG1 ILE 110 1HG1 ILE 110 7.340 10.303 -0.724 633 1HG2 ILE 110 1HG2 ILE 110 5.032 7.164 -2.478 634 2HG2 ILE 110 3HG2 ILE 110 5.460 7.043 -0.769 635 3HG2 ILE 110 2HG2 ILE 110 4.305 8.263 -1.302 636 1HD1 ILE 110 HD1 ILE 110 4.962 10.949 -0.817 637 2HD1 ILE 110 HD1 ILE 110 4.579 9.580 0.235 638 3HD1 ILE 110 HD1 ILE 110 5.597 10.892 0.828 639 H GLU 111 HN GLU 111 7.102 8.474 -4.591 640 HA GLU 111 HA GLU 111 6.053 6.069 -5.524 641 1HB GLU 111 HB2 GLU 111 7.526 8.258 -6.991 642 2HB GLU 111 HB1 GLU 111 6.747 6.909 -7.802 643 1HG GLU 111 HG2 GLU 111 5.350 8.916 -6.047 644 2HG GLU 111 HG1 GLU 111 5.396 8.965 -7.808 645 H ASN 112 HN ASN 112 9.361 7.283 -5.752 646 HA ASN 112 HA ASN 112 10.542 5.152 -7.075 647 1HB ASN 112 HB2 ASN 112 11.823 7.139 -6.831 648 2HB ASN 112 HB1 ASN 112 11.682 7.099 -5.077 649 1HD2 ASN 112 HD2 ASN 112 13.102 5.876 -3.900 650 2HD2 ASN 112 HD2 ASN 112 14.436 5.024 -4.551 651 H LYS 113 HN LYS 113 10.137 5.607 -3.608 652 HA LYS 113 HA LYS 113 11.623 3.322 -2.871 653 1HB LYS 113 HB2 LYS 113 11.078 5.392 -1.482 654 2HB LYS 113 HB1 LYS 113 9.496 4.682 -1.239 655 1HG LYS 113 HG2 LYS 113 10.956 4.255 0.655 656 2HG LYS 113 HG1 LYS 113 10.495 2.758 -0.160 657 1HD LYS 113 HD2 LYS 113 12.881 2.814 0.470 658 2HD LYS 113 HD1 LYS 113 12.630 2.629 -1.258 659 1HE LYS 113 HE2 LYS 113 13.104 4.948 -1.602 660 2HE LYS 113 HE1 LYS 113 13.301 5.223 0.141 661 1HZ LYS 113 HZ3 LYS 113 15.195 3.663 0.063 662 2HZ LYS 113 HZ2 LYS 113 14.950 3.522 -1.644 663 3HZ LYS 113 HZ1 LYS 113 15.408 4.983 -0.971 664 H LYS 114 HN LYS 114 8.187 4.005 -3.220 665 HA LYS 114 HA LYS 114 7.019 1.614 -2.548 666 1HB LYS 114 HB2 LYS 114 5.888 3.760 -3.113 667 2HB LYS 114 HB1 LYS 114 6.329 3.515 -4.791 668 1HG LYS 114 HG2 LYS 114 4.931 1.475 -4.806 669 2HG LYS 114 HG1 LYS 114 4.456 1.846 -3.148 670 1HD LYS 114 HD2 LYS 114 2.711 2.683 -4.582 671 2HD LYS 114 HD1 LYS 114 3.614 4.071 -3.974 672 1HE LYS 114 HE2 LYS 114 4.907 4.099 -6.089 673 2HE LYS 114 HE1 LYS 114 3.898 2.778 -6.674 674 1HZ LYS 114 HZ2 LYS 114 1.927 4.412 -6.407 675 2HZ LYS 114 HZ1 LYS 114 3.066 5.565 -6.022 676 3HZ LYS 114 HZ3 LYS 114 3.105 4.884 -7.524 677 H LYS 115 HN LYS 115 8.256 2.758 -5.670 678 HA LYS 115 HA LYS 115 7.732 0.411 -7.149 679 1HB LYS 115 HB2 LYS 115 9.673 2.651 -7.681 680 2HB LYS 115 HB1 LYS 115 9.254 1.389 -8.838 681 1HG LYS 115 HG2 LYS 115 6.982 2.126 -8.922 682 2HG LYS 115 HG1 LYS 115 7.250 3.245 -7.591 683 1HD LYS 115 HD2 LYS 115 7.191 4.461 -9.635 684 2HD LYS 115 HD1 LYS 115 8.835 4.500 -9.008 685 1HE LYS 115 HE2 LYS 115 8.879 4.133 -11.407 686 2HE LYS 115 HE1 LYS 115 9.459 2.696 -10.575 687 1HZ LYS 115 HZ2 LYS 115 6.670 3.013 -11.554 688 2HZ LYS 115 HZ1 LYS 115 7.883 2.250 -12.426 689 3HZ LYS 115 HZ3 LYS 115 7.370 1.612 -10.959 690 H GLU 116 HN GLU 116 10.590 1.437 -5.369 691 HA GLU 116 HA GLU 116 12.271 -0.673 -6.149 692 1HB GLU 116 HB2 GLU 116 12.107 0.802 -3.505 693 2HB GLU 116 HB1 GLU 116 13.338 -0.390 -3.865 694 1HG GLU 116 HG2 GLU 116 14.024 1.114 -5.764 695 2HG GLU 116 HG1 GLU 116 12.917 2.312 -5.084 696 H LEU 117 HN LEU 117 9.898 -0.397 -3.602 697 HA LEU 117 HA LEU 117 10.320 -2.953 -2.521 698 1HB LEU 117 HB2 LEU 117 9.421 -1.331 -1.088 699 2HB LEU 117 HB1 LEU 117 8.202 -0.856 -2.237 700 HG LEU 117 HG LEU 117 7.347 -2.044 -0.195 701 1HD1 LEU 117 HD1 LEU 117 6.015 -1.751 -2.038 702 2HD1 LEU 117 HD1 LEU 117 6.632 -3.232 -2.763 703 3HD1 LEU 117 HD1 LEU 117 5.707 -3.307 -1.249 704 1HD2 LEU 117 HD2 LEU 117 8.655 -4.421 -1.456 705 2HD2 LEU 117 HD2 LEU 117 9.068 -3.706 0.109 706 3HD2 LEU 117 HD2 LEU 117 7.487 -4.458 -0.137 707 H ILE 118 HN ILE 118 8.020 -1.714 -4.875 708 HA ILE 118 HA ILE 118 6.402 -3.932 -5.025 709 HB ILE 118 HB ILE 118 7.126 -2.032 -7.287 710 1HG1 ILE 118 2HG1 ILE 118 4.642 -2.081 -5.573 711 2HG1 ILE 118 1HG1 ILE 118 6.063 -1.122 -5.171 712 1HG2 ILE 118 3HG2 ILE 118 6.169 -4.123 -8.199 713 2HG2 ILE 118 2HG2 ILE 118 4.792 -3.971 -7.124 714 3HG2 ILE 118 1HG2 ILE 118 5.049 -2.779 -8.390 715 1HD1 ILE 118 HD1 ILE 118 4.496 -0.882 -7.716 716 2HD1 ILE 118 HD1 ILE 118 4.304 0.167 -6.306 717 3HD1 ILE 118 HD1 ILE 118 5.835 0.130 -7.196 718 H GLN 119 HN GLN 119 9.402 -3.217 -6.665 719 HA GLN 119 HA GLN 119 9.559 -5.486 -8.344 720 1HB GLN 119 HB2 GLN 119 11.748 -3.778 -7.156 721 2HB GLN 119 HB1 GLN 119 11.992 -4.985 -8.410 722 1HG GLN 119 HG2 GLN 119 10.640 -3.764 -9.948 723 2HG GLN 119 HG1 GLN 119 10.145 -2.638 -8.686 724 1HE2 GLN 119 1HE2 GLN 119 11.546 -1.121 -8.001 725 2HE2 GLN 119 2HE2 GLN 119 12.956 -0.646 -8.878 726 H LEU 120 HN LEU 120 10.514 -4.929 -5.032 727 HA LEU 120 HA LEU 120 11.865 -7.377 -4.595 728 1HB LEU 120 HB2 LEU 120 10.726 -5.248 -2.874 729 2HB LEU 120 HB1 LEU 120 10.981 -6.814 -2.151 730 HG LEU 120 HG LEU 120 13.330 -6.666 -2.341 731 1HD1 LEU 120 HD1 LEU 120 12.960 -4.271 -4.110 732 2HD1 LEU 120 HD1 LEU 120 14.484 -4.966 -3.529 733 3HD1 LEU 120 HD1 LEU 120 13.471 -5.889 -4.644 734 1HD2 LEU 120 HD2 LEU 120 12.269 -3.927 -1.745 735 2HD2 LEU 120 HD2 LEU 120 12.446 -5.275 -0.618 736 3HD2 LEU 120 HD2 LEU 120 13.873 -4.529 -1.324 737 H VAL 121 HN VAL 121 8.511 -6.410 -3.725 738 HA VAL 121 HA VAL 121 7.687 -8.979 -2.975 739 HB VAL 121 HB VAL 121 5.908 -6.924 -4.316 740 1HG1 VAL 121 2HG1 VAL 121 4.854 -9.079 -3.930 741 2HG1 VAL 121 1HG1 VAL 121 5.304 -9.008 -2.229 742 3HG1 VAL 121 3HG1 VAL 121 4.153 -7.840 -2.886 743 1HG2 VAL 121 1HG2 VAL 121 6.790 -7.035 -1.438 744 2HG2 VAL 121 3HG2 VAL 121 7.182 -5.797 -2.638 745 3HG2 VAL 121 2HG2 VAL 121 5.519 -5.988 -2.083 746 H ALA 122 HN ALA 122 7.947 -7.511 -6.125 747 HA ALA 122 HA ALA 122 6.519 -9.411 -7.627 748 1HB ALA 122 HB1 ALA 122 8.796 -7.671 -8.525 749 2HB ALA 122 HB3 ALA 122 7.584 -8.430 -9.574 750 3HB ALA 122 HB2 ALA 122 7.112 -7.176 -8.417 751 H ARG 123 HN ARG 123 10.015 -9.116 -6.972 752 HA ARG 123 HA ARG 123 10.727 -11.455 -8.420 753 1HB ARG 123 HB2 ARG 123 12.955 -11.235 -7.348 754 2HB ARG 123 HB1 ARG 123 12.405 -9.750 -8.107 755 1HG ARG 123 HG2 ARG 123 11.751 -8.886 -5.941 756 2HG ARG 123 HG1 ARG 123 12.306 -10.367 -5.168 757 1HD ARG 123 HD2 ARG 123 14.048 -8.510 -6.789 758 2HD ARG 123 HD1 ARG 123 13.930 -8.489 -5.031 759 HE ARG 123 HE ARG 123 14.571 -11.067 -5.708 760 1HH1 ARG 123 1HH1 ARG 123 16.102 -7.897 -6.281 761 2HH1 ARG 123 2HH1 ARG 123 17.671 -8.497 -6.076 762 1HH2 ARG 123 1HH2 ARG 123 16.752 -11.854 -5.498 763 2HH2 ARG 123 2HH2 ARG 123 18.073 -10.791 -5.666 764 H HIS 124 HN HIS 124 9.268 -11.113 -5.460 765 HA HIS 124 HA HIS 124 10.144 -13.420 -4.128 766 1HB HIS 124 HB2 HIS 124 8.758 -11.895 -2.903 767 2HB HIS 124 HB1 HIS 124 7.555 -11.861 -4.152 768 HD1 HIS 124 HD1 HIS 124 5.521 -13.200 -3.649 769 HD2 HIS 124 HD2 HIS 124 8.868 -14.688 -1.691 770 HE1 HIS 124 HE1 HIS 124 4.732 -15.171 -2.333 771 H GLY 125 HN GLY 125 7.713 -12.867 -6.576 772 1HA GLY 125 HA1 GLY 125 7.223 -15.753 -6.739 773 2HA GLY 125 HA2 GLY 125 7.749 -14.896 -8.182 774 H LEU 126 HN LEU 126 6.271 -12.500 -7.756 775 HA LEU 126 HA LEU 126 3.528 -13.386 -7.638 776 1HB LEU 126 HB2 LEU 126 4.761 -10.692 -8.018 777 2HB LEU 126 HB1 LEU 126 3.068 -10.946 -8.313 778 HG LEU 126 HG LEU 126 4.573 -11.179 -5.798 779 1HD1 LEU 126 HD1 LEU 126 2.335 -9.363 -6.634 780 2HD1 LEU 126 HD1 LEU 126 2.990 -9.438 -5.001 781 3HD1 LEU 126 HD1 LEU 126 4.017 -8.930 -6.342 782 1HD2 LEU 126 HD2 LEU 126 1.723 -12.046 -6.272 783 2HD2 LEU 126 HD2 LEU 126 3.073 -13.001 -5.670 784 3HD2 LEU 126 HD2 LEU 126 2.400 -11.726 -4.672 785 H ASP 127 HN ASP 127 2.137 -13.333 -9.235 786 HA ASP 127 HA ASP 127 2.980 -13.798 -11.893 787 1HB ASP 127 HB2 ASP 127 0.262 -12.903 -10.852 788 2HB ASP 127 HB1 ASP 127 0.575 -13.527 -12.461 789 H HIS 128 HN HIS 128 2.508 -12.316 -13.686 790 HA HIS 128 HA HIS 128 3.500 -9.742 -13.148 791 1HB HIS 128 HB2 HIS 128 2.163 -10.845 -15.621 792 2HB HIS 128 HB1 HIS 128 2.718 -9.179 -15.520 793 HD1 HIS 128 HD1 HIS 128 5.132 -8.795 -16.177 794 HD2 HIS 128 HD2 HIS 128 4.354 -12.761 -15.216 795 HE1 HIS 128 HE1 HIS 128 7.222 -10.072 -16.726 796 H ASP 129 HN ASP 129 0.265 -10.940 -13.383 797 HA ASP 129 HA ASP 129 -0.991 -8.383 -13.223 798 1HB ASP 129 HB2 ASP 129 -2.056 -11.159 -12.740 799 2HB ASP 129 HB1 ASP 129 -3.046 -9.717 -12.548 800 H LYS 130 HN LYS 130 0.123 -10.701 -10.890 801 HA LYS 130 HA LYS 130 -1.153 -9.585 -8.631 802 1HB LYS 130 HB2 LYS 130 1.302 -11.308 -8.916 803 2HB LYS 130 HB1 LYS 130 0.883 -10.661 -7.371 804 1HG LYS 130 HG2 LYS 130 -1.020 -12.326 -9.020 805 2HG LYS 130 HG1 LYS 130 0.085 -13.002 -7.822 806 1HD LYS 130 HD2 LYS 130 -0.976 -11.567 -6.092 807 2HD LYS 130 HD1 LYS 130 -2.116 -10.988 -7.305 808 1HE LYS 130 HE2 LYS 130 -3.032 -13.193 -7.579 809 2HE LYS 130 HE1 LYS 130 -1.784 -13.886 -6.550 810 1HZ LYS 130 HZ1 LYS 130 -3.907 -11.987 -5.625 811 2HZ LYS 130 HZ3 LYS 130 -3.854 -13.648 -5.352 812 3HZ LYS 130 HZ2 LYS 130 -2.687 -12.666 -4.677 813 H VAL 131 HN VAL 131 1.970 -8.922 -10.140 814 HA VAL 131 HA VAL 131 2.903 -7.037 -8.296 815 HB VAL 131 HB VAL 131 3.379 -7.117 -11.288 816 1HG1 VAL 131 1HG1 VAL 131 5.045 -5.936 -9.076 817 2HG1 VAL 131 3HG1 VAL 131 5.517 -6.035 -10.772 818 3HG1 VAL 131 2HG1 VAL 131 4.135 -5.045 -10.295 819 1HG2 VAL 131 2HG2 VAL 131 4.882 -8.513 -9.080 820 2HG2 VAL 131 1HG2 VAL 131 3.872 -9.281 -10.304 821 3HG2 VAL 131 3HG2 VAL 131 5.365 -8.467 -10.777 822 H LEU 132 HN LEU 132 0.904 -6.747 -11.181 823 HA LEU 132 HA LEU 132 0.637 -3.935 -11.247 824 1HB LEU 132 HB2 LEU 132 -1.257 -6.049 -12.232 825 2HB LEU 132 HB1 LEU 132 -1.290 -4.355 -12.680 826 HG LEU 132 HG LEU 132 0.949 -6.271 -13.302 827 1HD1 LEU 132 HD1 LEU 132 -1.082 -6.769 -14.506 828 2HD1 LEU 132 HD1 LEU 132 -1.169 -5.099 -15.067 829 3HD1 LEU 132 HD1 LEU 132 0.171 -6.136 -15.580 830 1HD2 LEU 132 HD2 LEU 132 0.495 -3.402 -14.126 831 2HD2 LEU 132 HD2 LEU 132 1.758 -4.014 -13.052 832 3HD2 LEU 132 HD2 LEU 132 1.762 -4.464 -14.752 833 H LEU 133 HN LEU 133 -1.459 -6.443 -9.895 834 HA LEU 133 HA LEU 133 -3.365 -4.628 -8.893 835 1HB LEU 133 HB2 LEU 133 -2.751 -7.437 -8.006 836 2HB LEU 133 HB1 LEU 133 -4.170 -6.506 -7.561 837 HG LEU 133 HG LEU 133 -3.465 -7.399 -10.363 838 1HD1 LEU 133 HD1 LEU 133 -4.115 -9.264 -8.978 839 2HD1 LEU 133 HD1 LEU 133 -5.579 -8.412 -8.483 840 3HD1 LEU 133 HD1 LEU 133 -5.366 -8.899 -10.165 841 1HD2 LEU 133 HD2 LEU 133 -5.917 -5.976 -9.319 842 2HD2 LEU 133 HD2 LEU 133 -4.702 -5.306 -10.403 843 3HD2 LEU 133 HD2 LEU 133 -5.732 -6.629 -10.948 844 H PHE 134 HN PHE 134 -0.539 -6.157 -7.431 845 HA PHE 134 HA PHE 134 -0.948 -5.205 -4.836 846 1HB PHE 134 HB2 PHE 134 0.651 -6.962 -5.193 847 2HB PHE 134 HB1 PHE 134 1.597 -5.947 -6.279 848 HD1 PHE 134 HD1 PHE 134 3.369 -4.722 -5.470 849 HD2 PHE 134 HD2 PHE 134 0.420 -6.161 -2.762 850 HE1 PHE 134 HE1 PHE 134 4.691 -3.878 -3.574 851 HE2 PHE 134 HE2 PHE 134 1.749 -5.326 -0.876 852 HZ PHE 134 HZ PHE 134 3.883 -4.145 -1.316 853 H SER 135 HN SER 135 0.977 -3.825 -7.486 854 HA SER 135 HA SER 135 1.984 -1.668 -6.070 855 1HB SER 135 HB2 SER 135 2.301 -0.628 -8.355 856 2HB SER 135 HB1 SER 135 2.984 -2.240 -8.139 857 HG SER 135 HG SER 135 1.444 -3.099 -9.340 858 H ARG 136 HN ARG 136 -0.985 -1.924 -7.921 859 HA ARG 136 HA ARG 136 -1.659 0.817 -7.450 860 1HB ARG 136 HB2 ARG 136 -3.754 0.322 -8.576 861 2HB ARG 136 HB1 ARG 136 -2.369 -0.249 -9.505 862 1HG ARG 136 HG2 ARG 136 -2.820 -2.521 -8.608 863 2HG ARG 136 HG1 ARG 136 -4.284 -1.870 -7.865 864 1HD ARG 136 HD2 ARG 136 -3.625 -1.887 -10.800 865 2HD ARG 136 HD1 ARG 136 -4.784 -2.932 -9.992 866 HE ARG 136 HE ARG 136 -5.871 -0.728 -9.316 867 1HH1 ARG 136 1HH1 ARG 136 -4.292 -1.266 -12.456 868 2HH1 ARG 136 2HH1 ARG 136 -5.268 -0.175 -13.281 869 1HH2 ARG 136 1HH2 ARG 136 -7.219 0.783 -10.482 870 2HH2 ARG 136 2HH2 ARG 136 -6.984 0.997 -12.153 871 H ASP 137 HN ASP 137 -2.181 -2.119 -5.698 872 HA ASP 137 HA ASP 137 -4.425 -0.988 -4.260 873 1HB ASP 137 HB2 ASP 137 -3.835 -3.522 -4.711 874 2HB ASP 137 HB1 ASP 137 -2.934 -3.344 -3.214 875 H LEU 138 HN LEU 138 -1.027 -1.480 -3.827 876 HA LEU 138 HA LEU 138 -0.913 -0.479 -1.171 877 1HB LEU 138 HB2 LEU 138 0.779 -1.984 -2.241 878 2HB LEU 138 HB1 LEU 138 1.246 -0.671 -3.289 879 HG LEU 138 HG LEU 138 1.578 -0.466 -0.280 880 1HD1 LEU 138 HD1 LEU 138 2.749 -2.446 -1.135 881 2HD1 LEU 138 HD1 LEU 138 3.505 -1.411 -2.363 882 3HD1 LEU 138 HD1 LEU 138 3.871 -1.160 -0.656 883 1HD2 LEU 138 HD2 LEU 138 2.929 0.723 -2.605 884 2HD2 LEU 138 HD2 LEU 138 1.775 1.569 -1.547 885 3HD2 LEU 138 HD2 LEU 138 3.342 0.982 -0.904 886 H ASP 139 HN ASP 139 -0.750 0.872 -4.372 887 HA ASP 139 HA ASP 139 0.079 3.483 -3.804 888 1HB ASP 139 HB2 ASP 139 -0.252 2.429 -6.087 889 2HB ASP 139 HB1 ASP 139 -1.981 2.663 -5.841 890 H LYS 140 HN LYS 140 -3.136 2.008 -3.885 891 HA LYS 140 HA LYS 140 -4.829 4.119 -3.235 892 1HB LYS 140 HB2 LYS 140 -4.946 1.317 -2.147 893 2HB LYS 140 HB1 LYS 140 -6.258 2.473 -2.075 894 1HG LYS 140 HG2 LYS 140 -6.373 2.363 -4.556 895 2HG LYS 140 HG1 LYS 140 -5.112 1.121 -4.517 896 1HD LYS 140 HD2 LYS 140 -6.557 -0.229 -3.002 897 2HD LYS 140 HD1 LYS 140 -7.833 0.966 -3.208 898 1HE LYS 140 HE2 LYS 140 -8.315 -0.837 -4.677 899 2HE LYS 140 HE1 LYS 140 -7.728 0.495 -5.670 900 1HZ LYS 140 HZ3 LYS 140 -5.539 -0.604 -5.691 901 2HZ LYS 140 HZ2 LYS 140 -6.231 -1.908 -4.820 902 3HZ LYS 140 HZ1 LYS 140 -6.760 -1.567 -6.365 903 H LEU 141 HN LEU 141 -3.010 1.980 -1.129 904 HA LEU 141 HA LEU 141 -3.977 2.802 1.375 905 1HB LEU 141 HB2 LEU 141 -2.390 0.819 0.527 906 2HB LEU 141 HB1 LEU 141 -1.144 1.932 1.015 907 HG LEU 141 HG LEU 141 -3.008 0.324 2.644 908 1HD1 LEU 141 HD1 LEU 141 -0.901 -0.512 2.314 909 2HD1 LEU 141 HD1 LEU 141 -0.163 0.959 2.955 910 3HD1 LEU 141 HD1 LEU 141 -1.146 -0.067 4.003 911 1HD2 LEU 141 HD2 LEU 141 -1.961 2.966 3.514 912 2HD2 LEU 141 HD2 LEU 141 -3.626 2.442 3.522 913 3HD2 LEU 141 HD2 LEU 141 -2.478 1.715 4.663 914 H ILE 142 HN ILE 142 -1.127 3.726 -0.457 915 HA ILE 142 HA ILE 142 -0.107 5.578 1.409 916 HB ILE 142 HB ILE 142 0.330 5.505 -1.597 917 1HG1 ILE 142 2HG1 ILE 142 1.986 4.448 0.684 918 2HG1 ILE 142 1HG1 ILE 142 1.019 3.462 -0.411 919 1HG2 ILE 142 2HG2 ILE 142 1.883 6.955 0.559 920 2HG2 ILE 142 1HG2 ILE 142 2.353 6.837 -1.138 921 3HG2 ILE 142 3HG2 ILE 142 0.890 7.711 -0.689 922 1HD1 ILE 142 HD1 ILE 142 2.440 4.194 -2.262 923 2HD1 ILE 142 HD1 ILE 142 3.439 5.111 -1.126 924 3HD1 ILE 142 HD1 ILE 142 3.332 3.345 -1.003 925 H ASN 143 HN ASN 143 -1.925 6.163 -1.578 926 HA ASN 143 HA ASN 143 -2.231 8.913 -1.385 927 1HB ASN 143 HB2 ASN 143 -4.305 6.975 -2.444 928 2HB ASN 143 HB1 ASN 143 -4.238 8.696 -2.789 929 1HD2 ASN 143 HD2 ASN 143 -4.213 6.514 -4.607 930 2HD2 ASN 143 HD2 ASN 143 -2.708 6.527 -5.463 931 H LYS 144 HN LYS 144 -4.154 6.356 0.068 932 HA LYS 144 HA LYS 144 -6.266 7.810 1.106 933 1HB LYS 144 HB2 LYS 144 -6.088 5.350 1.026 934 2HB LYS 144 HB1 LYS 144 -4.907 5.405 2.324 935 1HG LYS 144 HG2 LYS 144 -6.670 6.433 3.785 936 2HG LYS 144 HG1 LYS 144 -7.811 6.182 2.460 937 1HD LYS 144 HD2 LYS 144 -6.260 4.014 3.844 938 2HD LYS 144 HD1 LYS 144 -7.961 4.396 4.100 939 1HE LYS 144 HE2 LYS 144 -6.713 3.431 1.513 940 2HE LYS 144 HE1 LYS 144 -7.706 2.501 2.629 941 1HZ LYS 144 HZ2 LYS 144 -8.674 4.873 1.111 942 2HZ LYS 144 HZ1 LYS 144 -8.945 3.275 0.710 943 3HZ LYS 144 HZ3 LYS 144 -9.589 3.874 2.133 944 H PHE 145 HN PHE 145 -3.162 7.002 2.573 945 HA PHE 145 HA PHE 145 -3.796 8.531 4.900 946 1HB PHE 145 HB2 PHE 145 -1.485 6.836 4.104 947 2HB PHE 145 HB1 PHE 145 -1.326 7.955 5.454 948 HD1 PHE 145 HD1 PHE 145 -3.234 5.045 4.196 949 HD2 PHE 145 HD2 PHE 145 -2.287 7.498 7.523 950 HE1 PHE 145 HE1 PHE 145 -4.342 3.432 5.691 951 HE2 PHE 145 HE2 PHE 145 -3.392 5.890 9.033 952 HZ PHE 145 HZ PHE 145 -4.421 3.853 8.109 953 H MET 146 HN MET 146 -2.270 9.208 1.958 954 HA MET 146 HA MET 146 -0.663 11.364 2.855 955 1HB MET 146 HB2 MET 146 -1.913 10.992 0.126 956 2HB MET 146 HB1 MET 146 -0.647 12.142 0.526 957 1HG MET 146 HG2 MET 146 0.789 10.150 1.174 958 2HG MET 146 HG1 MET 146 -0.482 9.150 0.510 959 1HE MET 146 HE1 MET 146 0.920 12.597 -0.715 960 2HE MET 146 HE3 MET 146 2.345 11.674 -0.232 961 3HE MET 146 HE2 MET 146 2.069 12.064 -1.935 962 H ASN 147 HN ASN 147 -3.923 11.212 1.564 963 HA ASN 147 HA ASN 147 -4.906 13.271 3.216 964 1HB ASN 147 HB2 ASN 147 -3.408 14.543 1.693 965 2HB ASN 147 HB1 ASN 147 -4.517 14.194 0.384 966 1HD2 ASN 147 HD2 ASN 147 -4.110 16.030 3.311 967 2HD2 ASN 147 HD2 ASN 147 -5.483 17.057 3.105 968 H VAL 148 HN VAL 148 -5.315 11.041 0.965 969 HA VAL 148 HA VAL 148 -8.119 11.715 0.297 970 HB VAL 148 HB VAL 148 -6.410 9.483 -0.726 971 1HG1 VAL 148 1HG1 VAL 148 -8.785 9.159 -1.197 972 2HG1 VAL 148 3HG1 VAL 148 -8.865 10.746 -1.968 973 3HG1 VAL 148 2HG1 VAL 148 -7.910 9.454 -2.697 974 1HG2 VAL 148 3HG2 VAL 148 -5.326 11.587 -1.153 975 2HG2 VAL 148 2HG2 VAL 148 -5.808 10.830 -2.674 976 3HG2 VAL 148 1HG2 VAL 148 -6.750 12.178 -1.993 977 H LYS 149 HN LYS 149 -8.588 11.397 2.335 978 HA LYS 149 HA LYS 149 -8.442 8.642 3.380 979 1HB LYS 149 HB2 LYS 149 -8.373 9.714 5.571 980 2HB LYS 149 HB1 LYS 149 -6.965 10.061 4.560 981 1HG LYS 149 HG2 LYS 149 -7.963 12.202 3.954 982 2HG LYS 149 HG1 LYS 149 -9.348 11.869 4.990 983 1HD LYS 149 HD2 LYS 149 -7.783 11.773 6.923 984 2HD LYS 149 HD1 LYS 149 -6.480 12.243 5.834 985 1HE LYS 149 HE2 LYS 149 -7.352 14.194 7.018 986 2HE LYS 149 HE1 LYS 149 -7.644 14.314 5.286 987 1HZ LYS 149 HZ1 LYS 149 -9.682 13.433 7.275 988 2HZ LYS 149 HZ3 LYS 149 -9.561 14.978 6.662 989 3HZ LYS 149 HZ2 LYS 149 -9.980 13.705 5.645 990 H ASP 150 HN ASP 150 -10.586 10.810 2.393 991 HA ASP 150 HA ASP 150 -12.573 9.969 4.397 992 1HB ASP 150 HB2 ASP 150 -12.656 12.515 2.767 993 2HB ASP 150 HB1 ASP 150 -13.927 11.978 3.851 994 H LYS 151 HN LYS 151 -12.898 8.051 3.293 995 HA LYS 151 HA LYS 151 -13.774 6.579 1.902 996 1HB LYS 151 HB2 LYS 151 -16.202 6.814 1.643 997 2HB LYS 151 HB1 LYS 151 -15.594 7.084 3.273 998 1HG LYS 151 HG2 LYS 151 -15.770 9.530 2.849 999 2HG LYS 151 HG1 LYS 151 -16.535 9.159 1.306 1000 1HD LYS 151 HD2 LYS 151 -18.161 9.659 2.997 1001 2HD LYS 151 HD1 LYS 151 -18.289 7.963 2.470 1002 1HE LYS 151 HE2 LYS 151 -17.114 7.245 4.480 1003 2HE LYS 151 HE1 LYS 151 -16.889 8.921 4.974 1004 1HZ LYS 151 HZ3 LYS 151 -19.497 7.553 4.657 1005 2HZ LYS 151 HZ2 LYS 151 -18.706 7.826 6.127 1006 3HZ LYS 151 HZ1 LYS 151 -19.252 9.129 5.198 1007 H VAL 152 HN VAL 152 -12.433 8.690 0.434 1008 HA VAL 152 HA VAL 152 -13.810 8.352 -2.098 1009 HB VAL 152 HB VAL 152 -12.330 10.254 -2.937 1010 1HG1 VAL 152 2HG1 VAL 152 -14.201 10.830 -0.646 1011 2HG1 VAL 152 1HG1 VAL 152 -13.693 12.006 -1.863 1012 3HG1 VAL 152 3HG1 VAL 152 -14.675 10.614 -2.331 1013 1HG2 VAL 152 1HG2 VAL 152 -10.637 10.107 -1.150 1014 2HG2 VAL 152 3HG2 VAL 152 -11.314 11.728 -1.286 1015 3HG2 VAL 152 2HG2 VAL 152 -11.836 10.657 0.018 1016 H HIS 153 HN HIS 153 -12.972 7.202 -3.601 1017 HA HIS 153 HA HIS 153 -10.470 5.804 -3.094 1018 1HB HIS 153 HB2 HIS 153 -12.550 4.569 -3.789 1019 2HB HIS 153 HB1 HIS 153 -12.495 5.430 -5.318 1020 HD1 HIS 153 HD1 HIS 153 -11.383 2.356 -3.741 1021 HD2 HIS 153 HD2 HIS 153 -10.075 4.758 -6.869 1022 HE1 HIS 153 HE1 HIS 153 -9.811 0.949 -5.092 1023 H LYS 154 HN LYS 154 -12.001 7.837 -5.326 1024 HA LYS 154 HA LYS 154 -9.675 8.060 -7.038 1025 1HB LYS 154 HB2 LYS 154 -11.081 9.726 -8.302 1026 2HB LYS 154 HB1 LYS 154 -11.676 8.085 -8.274 1027 1HG LYS 154 HG2 LYS 154 -13.409 8.597 -6.775 1028 2HG LYS 154 HG1 LYS 154 -12.689 10.147 -6.335 1029 1HD LYS 154 HD2 LYS 154 -13.680 9.510 -9.112 1030 2HD LYS 154 HD1 LYS 154 -14.702 10.244 -7.872 1031 1HE LYS 154 HE2 LYS 154 -13.157 12.115 -7.689 1032 2HE LYS 154 HE1 LYS 154 -12.091 11.387 -8.879 1033 1HZ LYS 154 HZ3 LYS 154 -14.895 12.149 -9.418 1034 2HZ LYS 154 HZ2 LYS 154 -13.593 13.161 -9.714 1035 3HZ LYS 154 HZ1 LYS 154 -13.740 11.677 -10.554 1036 H LEU 155 HN LEU 155 -8.096 9.416 -6.607 1037 HA LEU 155 HA LEU 155 -8.692 11.671 -4.946 1038 1HB LEU 155 HB2 LEU 155 -6.276 12.220 -5.043 1039 2HB LEU 155 HB1 LEU 155 -6.600 10.607 -4.475 1040 HG LEU 155 HG LEU 155 -5.933 9.822 -6.837 1041 1HD1 LEU 155 HD1 LEU 155 -5.991 12.004 -7.951 1042 2HD1 LEU 155 HD1 LEU 155 -4.698 12.574 -6.902 1043 3HD1 LEU 155 HD1 LEU 155 -4.388 11.264 -8.044 1044 1HD2 LEU 155 HD2 LEU 155 -3.950 11.090 -4.995 1045 2HD2 LEU 155 HD2 LEU 155 -4.634 9.467 -4.859 1046 3HD2 LEU 155 HD2 LEU 155 -3.574 9.870 -6.220 1047 H GLU 156 HN GLU 156 -9.332 13.496 -5.638 1048 HA GLU 156 HA GLU 156 -9.157 13.844 -8.514 1049 1HB GLU 156 HB2 GLU 156 -11.450 13.835 -7.468 1050 2HB GLU 156 HB1 GLU 156 -11.030 15.358 -6.690 1051 1HG GLU 156 HG2 GLU 156 -10.794 16.435 -8.829 1052 2HG GLU 156 HG1 GLU 156 -11.037 14.901 -9.663 1053 H HIS 157 HN HIS 157 -7.056 14.301 -8.222 1054 HA HIS 157 HA HIS 157 -6.518 17.150 -8.088 1055 1HB HIS 157 HB2 HIS 157 -4.835 15.051 -6.651 1056 2HB HIS 157 HB1 HIS 157 -4.355 16.711 -6.938 1057 HD1 HIS 157 HD1 HIS 157 -5.173 18.462 -5.236 1058 HD2 HIS 157 HD2 HIS 157 -6.793 14.679 -4.652 1059 HE1 HIS 157 HE1 HIS 157 -6.279 18.518 -2.982 1060 H HIS 158 HN HIS 158 -6.246 17.127 -10.308 1061 HA HIS 158 HA HIS 158 -4.292 15.171 -11.277 1062 1HB HIS 158 HB2 HIS 158 -6.561 14.944 -12.294 1063 2HB HIS 158 HB1 HIS 158 -6.415 16.581 -12.918 1064 HD1 HIS 158 HD1 HIS 158 -5.721 16.594 -15.335 1065 HD2 HIS 158 HD2 HIS 158 -4.189 13.325 -13.272 1066 HE1 HIS 158 HE1 HIS 158 -4.416 15.253 -17.016 1067 H HIS 159 HN HIS 159 -2.414 15.914 -11.821 1068 HA HIS 159 HA HIS 159 -1.955 18.754 -12.015 1069 1HB HIS 159 HB2 HIS 159 -0.063 16.395 -12.263 1070 2HB HIS 159 HB1 HIS 159 0.438 18.075 -12.304 1071 HD1 HIS 159 HD1 HIS 159 0.858 19.187 -10.023 1072 HD2 HIS 159 HD2 HIS 159 -1.060 15.512 -9.742 1073 HE1 HIS 159 HE1 HIS 159 0.903 18.566 -7.599 1074 H HIS 160 HN HIS 160 -2.547 19.648 -13.917 1075 HA HIS 160 HA HIS 160 -2.130 18.144 -16.343 1076 1HB HIS 160 HB2 HIS 160 -3.426 20.821 -15.838 1077 2HB HIS 160 HB1 HIS 160 -3.064 20.250 -17.453 1078 HD1 HIS 160 HD1 HIS 160 -4.590 18.460 -18.448 1079 HD2 HIS 160 HD2 HIS 160 -5.499 19.394 -14.506 1080 HE1 HIS 160 HE1 HIS 160 -6.834 17.446 -18.005 1081 H HIS 161 HN HIS 161 -0.481 18.270 -17.516 1082 HA HIS 161 HA HIS 161 1.488 20.400 -17.103 1083 1HB HIS 161 HB2 HIS 161 1.751 17.711 -18.489 1084 2HB HIS 161 HB1 HIS 161 3.044 18.885 -18.318 1085 HD1 HIS 161 HD1 HIS 161 4.416 18.757 -16.159 1086 HD2 HIS 161 HD2 HIS 161 0.906 16.533 -15.984 1087 HE1 HIS 161 HE1 HIS 161 4.544 17.401 -14.047 1088 H HIS 162 HN HIS 162 -0.599 18.870 -19.430 1089 HA HIS 162 HA HIS 162 0.198 20.863 -21.416 1090 1HB HIS 162 HB2 HIS 162 -1.056 18.130 -21.819 1091 2HB HIS 162 HB1 HIS 162 -0.787 19.301 -23.105 1092 HD1 HIS 162 HD1 HIS 162 1.618 19.539 -23.986 1093 HD2 HIS 162 HD2 HIS 162 1.226 16.839 -20.863 1094 HE1 HIS 162 HE1 HIS 162 3.820 18.302 -23.846 No H/Q in entry = 1094 Start of MODEL 30 1 H1 MET 1 HT2 MET 1 17.342 -16.435 -3.897 2 H2 MET 1 HT1 MET 1 17.172 -17.262 -5.358 3 H3 MET 1 HT3 MET 1 15.837 -16.946 -4.392 4 HA MET 1 HA MET 1 16.409 -19.219 -4.195 5 1HB MET 1 HB2 MET 1 19.072 -18.185 -3.170 6 2HB MET 1 HB1 MET 1 18.538 -19.844 -3.053 7 1HG MET 1 HG2 MET 1 18.506 -20.004 -5.490 8 2HG MET 1 HG1 MET 1 19.042 -18.331 -5.606 9 1HE MET 1 HE3 MET 1 21.409 -17.485 -4.683 10 2HE MET 1 HE2 MET 1 21.180 -18.259 -3.117 11 3HE MET 1 HE1 MET 1 22.652 -18.554 -4.032 12 H GLU 2 HN GLU 2 18.022 -17.199 -1.717 13 HA GLU 2 HA GLU 2 16.384 -18.455 0.277 14 1HB GLU 2 HB2 GLU 2 18.940 -17.733 0.356 15 2HB GLU 2 HB1 GLU 2 18.267 -16.183 0.829 16 1HG GLU 2 HG2 GLU 2 17.909 -18.808 2.273 17 2HG GLU 2 HG1 GLU 2 18.908 -17.450 2.786 18 H MET 3 HN MET 3 14.457 -17.723 0.620 19 HA MET 3 HA MET 3 13.614 -15.149 -0.357 20 1HB MET 3 HB2 MET 3 12.041 -17.418 0.851 21 2HB MET 3 HB1 MET 3 11.341 -15.948 0.186 22 1HG MET 3 HG2 MET 3 12.184 -16.472 -2.004 23 2HG MET 3 HG1 MET 3 13.059 -17.861 -1.377 24 1HE MET 3 HE1 MET 3 9.538 -16.333 -2.202 25 2HE MET 3 HE3 MET 3 8.456 -17.615 -1.668 26 3HE MET 3 HE2 MET 3 9.373 -16.689 -0.483 27 H GLY 4 HN GLY 4 14.586 -16.421 2.685 28 1HA GLY 4 HA1 GLY 4 14.516 -15.561 4.797 29 2HA GLY 4 HA2 GLY 4 12.984 -14.800 4.377 30 H GLN 5 HN GLN 5 16.276 -14.499 3.185 31 HA GLN 5 HA GLN 5 16.812 -11.896 4.093 32 1HB GLN 5 HB2 GLN 5 17.862 -13.304 1.636 33 2HB GLN 5 HB1 GLN 5 18.521 -11.803 2.263 34 1HG GLN 5 HG2 GLN 5 19.111 -12.960 4.352 35 2HG GLN 5 HG1 GLN 5 18.479 -14.459 3.676 36 1HE2 GLN 5 1HE2 GLN 5 19.523 -13.865 0.990 37 2HE2 GLN 5 2HE2 GLN 5 21.210 -14.143 1.075 38 H LEU 6 HN LEU 6 15.219 -13.036 1.222 39 HA LEU 6 HA LEU 6 14.985 -10.579 -0.149 40 1HB LEU 6 HB2 LEU 6 14.657 -12.853 -1.163 41 2HB LEU 6 HB1 LEU 6 13.204 -13.035 -0.226 42 HG LEU 6 HG LEU 6 12.908 -12.555 -2.693 43 1HD1 LEU 6 HD1 LEU 6 11.079 -12.293 -1.163 44 2HD1 LEU 6 HD1 LEU 6 11.597 -10.653 -0.793 45 3HD1 LEU 6 HD1 LEU 6 11.036 -11.054 -2.418 46 1HD2 LEU 6 HD2 LEU 6 13.796 -9.793 -1.874 47 2HD2 LEU 6 HD2 LEU 6 14.652 -10.892 -2.962 48 3HD2 LEU 6 HD2 LEU 6 13.082 -10.239 -3.425 49 H LYS 7 HN LYS 7 12.821 -12.307 2.041 50 HA LYS 7 HA LYS 7 10.789 -10.391 2.218 51 1HB LYS 7 HB2 LYS 7 11.520 -12.857 3.513 52 2HB LYS 7 HB1 LYS 7 10.906 -11.705 4.688 53 1HG LYS 7 HG2 LYS 7 9.479 -12.405 2.142 54 2HG LYS 7 HG1 LYS 7 9.194 -13.227 3.674 55 1HD LYS 7 HD2 LYS 7 8.944 -10.236 3.339 56 2HD LYS 7 HD1 LYS 7 7.582 -11.345 3.124 57 1HE LYS 7 HE2 LYS 7 7.886 -12.112 5.429 58 2HE LYS 7 HE1 LYS 7 9.222 -10.980 5.628 59 1HZ LYS 7 HZ2 LYS 7 6.451 -10.119 4.947 60 2HZ LYS 7 HZ1 LYS 7 7.070 -10.211 6.493 61 3HZ LYS 7 HZ3 LYS 7 7.751 -9.147 5.410 62 H ASN 8 HN ASN 8 13.767 -10.798 3.987 63 HA ASN 8 HA ASN 8 13.270 -8.900 5.996 64 1HB ASN 8 HB2 ASN 8 15.058 -10.692 6.007 65 2HB ASN 8 HB1 ASN 8 15.970 -9.692 4.883 66 1HD2 ASN 8 HD2 ASN 8 17.655 -9.421 6.273 67 2HD2 ASN 8 HD2 ASN 8 17.564 -8.463 7.709 68 H LYS 9 HN LYS 9 14.712 -8.683 2.787 69 HA LYS 9 HA LYS 9 15.378 -5.902 2.899 70 1HB LYS 9 HB2 LYS 9 14.860 -7.723 0.537 71 2HB LYS 9 HB1 LYS 9 15.396 -6.057 0.385 72 1HG LYS 9 HG2 LYS 9 16.902 -8.255 1.782 73 2HG LYS 9 HG1 LYS 9 17.235 -7.649 0.153 74 1HD LYS 9 HD2 LYS 9 17.715 -5.445 1.053 75 2HD LYS 9 HD1 LYS 9 17.325 -5.996 2.678 76 1HE LYS 9 HE2 LYS 9 19.158 -7.610 2.551 77 2HE LYS 9 HE1 LYS 9 19.564 -7.004 0.945 78 1HZ LYS 9 HZ3 LYS 9 19.949 -4.824 1.929 79 2HZ LYS 9 HZ2 LYS 9 19.593 -5.437 3.450 80 3HZ LYS 9 HZ1 LYS 9 20.958 -5.994 2.613 81 H ILE 10 HN ILE 10 12.529 -7.664 1.993 82 HA ILE 10 HA ILE 10 11.063 -5.509 0.989 83 HB ILE 10 HB ILE 10 10.235 -8.130 2.227 84 1HG1 ILE 10 2HG1 ILE 10 10.125 -7.040 -0.580 85 2HG1 ILE 10 1HG1 ILE 10 11.344 -8.143 0.046 86 1HG2 ILE 10 3HG2 ILE 10 8.423 -6.544 2.719 87 2HG2 ILE 10 2HG2 ILE 10 8.368 -6.085 1.017 88 3HG2 ILE 10 1HG2 ILE 10 7.926 -7.720 1.498 89 1HD1 ILE 10 HD1 ILE 10 8.418 -8.698 -0.241 90 2HD1 ILE 10 HD1 ILE 10 9.712 -9.283 -1.301 91 3HD1 ILE 10 HD1 ILE 10 9.633 -9.814 0.381 92 H GLU 11 HN GLU 11 11.219 -6.850 4.250 93 HA GLU 11 HA GLU 11 9.593 -4.968 5.621 94 1HB GLU 11 HB2 GLU 11 12.141 -6.243 6.628 95 2HB GLU 11 HB1 GLU 11 10.875 -5.522 7.610 96 1HG GLU 11 HG2 GLU 11 10.667 -8.015 5.934 97 2HG GLU 11 HG1 GLU 11 10.708 -7.922 7.691 98 H ASN 12 HN ASN 12 13.023 -4.799 4.892 99 HA ASN 12 HA ASN 12 13.472 -2.309 6.121 100 1HB ASN 12 HB2 ASN 12 15.284 -3.841 5.481 101 2HB ASN 12 HB1 ASN 12 14.956 -3.524 3.782 102 1HD2 ASN 12 HD2 ASN 12 15.680 -1.588 2.884 103 2HD2 ASN 12 HD2 ASN 12 16.718 -0.517 3.726 104 H LYS 13 HN LYS 13 12.665 -3.094 2.758 105 HA LYS 13 HA LYS 13 12.868 -0.413 1.848 106 1HB LYS 13 HB2 LYS 13 13.022 -2.521 0.441 107 2HB LYS 13 HB1 LYS 13 11.274 -2.619 0.555 108 1HG LYS 13 HG2 LYS 13 11.820 -1.599 -1.551 109 2HG LYS 13 HG1 LYS 13 11.127 -0.375 -0.492 110 1HD LYS 13 HD2 LYS 13 13.014 0.537 -1.686 111 2HD LYS 13 HD1 LYS 13 13.391 0.435 0.031 112 1HE LYS 13 HE2 LYS 13 14.697 -1.515 -0.310 113 2HE LYS 13 HE1 LYS 13 14.237 -1.616 -2.018 114 1HZ LYS 13 HZ2 LYS 13 15.393 0.586 -2.306 115 2HZ LYS 13 HZ1 LYS 13 15.873 0.497 -0.710 116 3HZ LYS 13 HZ3 LYS 13 16.428 -0.655 -1.804 117 H LYS 14 HN LYS 14 10.167 -2.428 2.894 118 HA LYS 14 HA LYS 14 7.959 -0.850 2.545 119 1HB LYS 14 HB2 LYS 14 8.045 -3.183 3.385 120 2HB LYS 14 HB1 LYS 14 8.739 -2.608 4.881 121 1HG LYS 14 HG2 LYS 14 6.633 -1.370 5.309 122 2HG LYS 14 HG1 LYS 14 5.946 -2.091 3.858 123 1HD LYS 14 HD2 LYS 14 5.212 -3.455 5.677 124 2HD LYS 14 HD1 LYS 14 6.502 -4.361 4.886 125 1HE LYS 14 HE2 LYS 14 8.093 -3.491 6.590 126 2HE LYS 14 HE1 LYS 14 6.722 -2.672 7.342 127 1HZ LYS 14 HZ3 LYS 14 5.757 -5.102 7.580 128 2HZ LYS 14 HZ2 LYS 14 7.317 -5.582 7.236 129 3HZ LYS 14 HZ1 LYS 14 7.064 -4.660 8.560 130 H LYS 15 HN LYS 15 10.170 -1.033 5.303 131 HA LYS 15 HA LYS 15 9.093 1.081 6.841 132 1HB LYS 15 HB2 LYS 15 11.853 -0.086 6.788 133 2HB LYS 15 HB1 LYS 15 11.247 1.022 8.015 134 1HG LYS 15 HG2 LYS 15 9.656 -0.550 8.772 135 2HG LYS 15 HG1 LYS 15 9.960 -1.608 7.390 136 1HD LYS 15 HD2 LYS 15 11.030 -2.499 9.298 137 2HD LYS 15 HD1 LYS 15 12.226 -1.945 8.151 138 1HE LYS 15 HE2 LYS 15 12.908 -1.246 10.420 139 2HE LYS 15 HE1 LYS 15 12.595 0.148 9.392 140 1HZ LYS 15 HZ3 LYS 15 10.379 0.329 10.483 141 2HZ LYS 15 HZ2 LYS 15 10.787 -0.997 11.433 142 3HZ LYS 15 HZ1 LYS 15 11.648 0.439 11.598 143 H GLU 16 HN GLU 16 11.688 0.975 4.508 144 HA GLU 16 HA GLU 16 12.550 3.595 4.646 145 1HB GLU 16 HB2 GLU 16 12.457 1.573 2.422 146 2HB GLU 16 HB1 GLU 16 12.915 3.237 2.096 147 1HG GLU 16 HG2 GLU 16 14.248 1.610 4.212 148 2HG GLU 16 HG1 GLU 16 14.771 1.603 2.525 149 H LEU 17 HN LEU 17 9.915 2.221 2.760 150 HA LEU 17 HA LEU 17 9.128 4.667 1.620 151 1HB LEU 17 HB2 LEU 17 8.513 2.771 0.415 152 2HB LEU 17 HB1 LEU 17 7.922 1.940 1.827 153 HG LEU 17 HG LEU 17 6.170 2.587 0.145 154 1HD1 LEU 17 HD1 LEU 17 5.613 1.914 2.274 155 2HD1 LEU 17 HD1 LEU 17 5.747 3.563 2.863 156 3HD1 LEU 17 HD1 LEU 17 4.498 3.155 1.669 157 1HD2 LEU 17 HD2 LEU 17 6.713 5.362 1.133 158 2HD2 LEU 17 HD2 LEU 17 7.009 4.773 -0.504 159 3HD2 LEU 17 HD2 LEU 17 5.354 4.871 0.114 160 H ILE 18 HN ILE 18 8.007 2.896 4.454 161 HA ILE 18 HA ILE 18 5.829 4.459 5.056 162 HB ILE 18 HB ILE 18 7.715 3.128 7.049 163 1HG1 ILE 18 2HG1 ILE 18 5.047 2.162 6.033 164 2HG1 ILE 18 1HG1 ILE 18 6.574 1.718 5.281 165 1HG2 ILE 18 3HG2 ILE 18 4.872 4.124 7.490 166 2HG2 ILE 18 2HG2 ILE 18 5.816 3.206 8.653 167 3HG2 ILE 18 1HG2 ILE 18 6.322 4.822 8.195 168 1HD1 ILE 18 HD1 ILE 18 5.820 1.150 8.136 169 2HD1 ILE 18 HD1 ILE 18 5.745 -0.003 6.785 170 3HD1 ILE 18 HD1 ILE 18 7.291 0.655 7.304 171 H GLN 19 HN GLN 19 9.196 4.901 5.784 172 HA GLN 19 HA GLN 19 9.095 7.207 7.351 173 1HB GLN 19 HB2 GLN 19 11.193 6.216 5.442 174 2HB GLN 19 HB1 GLN 19 11.410 7.645 6.437 175 1HG GLN 19 HG2 GLN 19 11.300 6.366 8.440 176 2HG GLN 19 HG1 GLN 19 10.777 4.931 7.557 177 1HE2 GLN 19 1HE2 GLN 19 12.212 3.796 6.435 178 2HE2 GLN 19 2HE2 GLN 19 13.930 3.958 6.509 179 H LEU 20 HN LEU 20 9.116 6.885 3.772 180 HA LEU 20 HA LEU 20 9.219 9.688 3.392 181 1HB LEU 20 HB2 LEU 20 8.368 7.533 1.440 182 2HB LEU 20 HB1 LEU 20 8.332 9.236 1.065 183 HG LEU 20 HG LEU 20 10.223 8.578 0.047 184 1HD1 LEU 20 HD1 LEU 20 10.744 10.471 1.347 185 2HD1 LEU 20 HD1 LEU 20 11.237 9.452 2.705 186 3HD1 LEU 20 HD1 LEU 20 12.155 9.425 1.199 187 1HD2 LEU 20 HD2 LEU 20 10.882 6.783 2.356 188 2HD2 LEU 20 HD2 LEU 20 10.360 6.314 0.737 189 3HD2 LEU 20 HD2 LEU 20 11.936 7.065 0.967 190 H VAL 21 HN VAL 21 6.483 7.360 3.387 191 HA VAL 21 HA VAL 21 4.544 9.355 2.944 192 HB VAL 21 HB VAL 21 4.100 6.865 4.610 193 1HG1 VAL 21 1HG1 VAL 21 2.232 8.474 2.871 194 2HG1 VAL 21 3HG1 VAL 21 1.812 6.988 3.729 195 3HG1 VAL 21 2HG1 VAL 21 2.248 8.439 4.632 196 1HG2 VAL 21 2HG2 VAL 21 4.075 7.174 1.619 197 2HG2 VAL 21 1HG2 VAL 21 5.214 6.226 2.590 198 3HG2 VAL 21 3HG2 VAL 21 3.517 5.745 2.504 199 H ALA 22 HN ALA 22 6.004 8.231 5.941 200 HA ALA 22 HA ALA 22 4.311 9.571 7.727 201 1HB ALA 22 HB1 ALA 22 7.184 8.791 8.149 202 2HB ALA 22 HB3 ALA 22 5.974 9.084 9.420 203 3HB ALA 22 HB2 ALA 22 5.796 7.721 8.311 204 H ARG 23 HN ARG 23 7.456 10.532 6.351 205 HA ARG 23 HA ARG 23 7.585 12.990 7.734 206 1HB ARG 23 HB2 ARG 23 9.385 13.620 6.165 207 2HB ARG 23 HB1 ARG 23 9.617 12.018 6.843 208 1HG ARG 23 HG2 ARG 23 8.764 11.026 4.819 209 2HG ARG 23 HG1 ARG 23 8.501 12.627 4.135 210 1HD ARG 23 HD2 ARG 23 11.190 11.653 5.056 211 2HD ARG 23 HD1 ARG 23 10.606 11.417 3.411 212 HE ARG 23 HE ARG 23 10.442 14.132 4.203 213 1HH1 ARG 23 1HH1 ARG 23 12.768 11.661 3.168 214 2HH1 ARG 23 2HH1 ARG 23 13.807 12.742 2.376 215 1HH2 ARG 23 1HH2 ARG 23 11.883 15.650 3.092 216 2HH2 ARG 23 2HH2 ARG 23 13.271 15.067 2.327 217 H HIS 24 HN HIS 24 5.795 12.046 5.004 218 HA HIS 24 HA HIS 24 5.351 14.471 3.727 219 1HB HIS 24 HB2 HIS 24 4.532 12.459 2.715 220 2HB HIS 24 HB1 HIS 24 3.564 12.039 4.099 221 HD1 HIS 24 HD1 HIS 24 1.127 12.916 4.086 222 HD2 HIS 24 HD2 HIS 24 3.507 14.661 1.158 223 HE1 HIS 24 HE1 HIS 24 -0.413 14.283 2.652 224 H GLY 25 HN GLY 25 4.033 13.222 6.743 225 1HA GLY 25 HA1 GLY 25 2.351 15.629 6.962 226 2HA GLY 25 HA2 GLY 25 3.600 15.353 8.167 227 H LEU 26 HN LEU 26 2.584 12.308 7.533 228 HA LEU 26 HA LEU 26 0.143 12.021 8.679 229 1HB LEU 26 HB2 LEU 26 2.542 10.355 8.322 230 2HB LEU 26 HB1 LEU 26 1.274 9.756 9.366 231 HG LEU 26 HG LEU 26 -0.302 10.024 7.517 232 1HD1 LEU 26 HD1 LEU 26 0.739 11.686 6.210 233 2HD1 LEU 26 HD1 LEU 26 2.071 10.599 5.804 234 3HD1 LEU 26 HD1 LEU 26 0.430 10.235 5.247 235 1HD2 LEU 26 HD2 LEU 26 2.043 8.219 7.031 236 2HD2 LEU 26 HD2 LEU 26 0.625 7.874 8.016 237 3HD2 LEU 26 HD2 LEU 26 0.468 8.029 6.265 238 H ASP 27 HN ASP 27 -0.579 11.459 10.651 239 HA ASP 27 HA ASP 27 0.682 12.551 12.989 240 1HB ASP 27 HB2 ASP 27 -1.637 10.573 12.942 241 2HB ASP 27 HB1 ASP 27 -1.150 11.610 14.250 242 H HIS 28 HN HIS 28 0.782 10.996 14.995 243 HA HIS 28 HA HIS 28 2.801 9.050 14.496 244 1HB HIS 28 HB2 HIS 28 1.048 9.247 16.980 245 2HB HIS 28 HB1 HIS 28 2.585 8.425 16.847 246 HD1 HIS 28 HD1 HIS 28 4.551 9.749 17.707 247 HD2 HIS 28 HD2 HIS 28 1.323 12.157 16.662 248 HE1 HIS 28 HE1 HIS 28 5.144 12.089 18.438 249 H ASP 29 HN ASP 29 -0.630 8.949 15.187 250 HA ASP 29 HA ASP 29 -0.874 6.122 15.261 251 1HB ASP 29 HB2 ASP 29 -3.013 8.179 14.707 252 2HB ASP 29 HB1 ASP 29 -3.294 6.487 15.079 253 H LYS 30 HN LYS 30 -1.030 8.510 12.742 254 HA LYS 30 HA LYS 30 -2.245 6.916 10.759 255 1HB LYS 30 HB2 LYS 30 -0.323 9.202 10.484 256 2HB LYS 30 HB1 LYS 30 -1.090 8.423 9.117 257 1HG LYS 30 HG2 LYS 30 -2.461 9.958 11.316 258 2HG LYS 30 HG1 LYS 30 -2.152 10.507 9.670 259 1HD LYS 30 HD2 LYS 30 -3.568 8.536 8.925 260 2HD LYS 30 HD1 LYS 30 -4.043 8.380 10.618 261 1HE LYS 30 HE2 LYS 30 -4.434 10.782 8.834 262 2HE LYS 30 HE1 LYS 30 -5.687 9.709 9.451 263 1HZ LYS 30 HZ1 LYS 30 -3.995 11.525 11.125 264 2HZ LYS 30 HZ3 LYS 30 -5.591 11.773 10.647 265 3HZ LYS 30 HZ2 LYS 30 -5.241 10.510 11.683 266 H VAL 31 HN VAL 31 1.177 7.414 11.649 267 HA VAL 31 HA VAL 31 2.257 5.887 9.560 268 HB VAL 31 HB VAL 31 3.446 6.369 12.324 269 1HG1 VAL 31 1HG1 VAL 31 4.597 4.609 11.136 270 2HG1 VAL 31 3HG1 VAL 31 4.799 5.665 9.739 271 3HG1 VAL 31 2HG1 VAL 31 5.605 6.054 11.258 272 1HG2 VAL 31 2HG2 VAL 31 3.714 8.007 9.810 273 2HG2 VAL 31 1HG2 VAL 31 2.845 8.474 11.271 274 3HG2 VAL 31 3HG2 VAL 31 4.597 8.275 11.312 275 H LEU 32 HN LEU 32 1.113 5.093 12.763 276 HA LEU 32 HA LEU 32 1.937 2.383 12.805 277 1HB LEU 32 HB2 LEU 32 -0.356 3.698 14.246 278 2HB LEU 32 HB1 LEU 32 0.312 2.121 14.622 279 HG LEU 32 HG LEU 32 1.723 4.771 14.909 280 1HD1 LEU 32 HD1 LEU 32 0.689 2.833 16.944 281 2HD1 LEU 32 HD1 LEU 32 1.624 4.294 17.290 282 3HD1 LEU 32 HD1 LEU 32 0.017 4.424 16.566 283 1HD2 LEU 32 HD2 LEU 32 2.675 1.977 15.544 284 2HD2 LEU 32 HD2 LEU 32 3.311 3.043 14.291 285 3HD2 LEU 32 HD2 LEU 32 3.509 3.464 15.991 286 H LEU 33 HN LEU 33 -1.183 3.896 12.030 287 HA LEU 33 HA LEU 33 -2.584 1.570 11.327 288 1HB LEU 33 HB2 LEU 33 -2.881 4.369 10.270 289 2HB LEU 33 HB1 LEU 33 -4.028 3.080 9.985 290 HG LEU 33 HG LEU 33 -3.371 4.289 12.668 291 1HD1 LEU 33 HD1 LEU 33 -5.759 4.572 10.857 292 2HD1 LEU 33 HD1 LEU 33 -5.650 5.185 12.507 293 3HD1 LEU 33 HD1 LEU 33 -4.585 5.828 11.259 294 1HD2 LEU 33 HD2 LEU 33 -5.432 2.239 11.862 295 2HD2 LEU 33 HD2 LEU 33 -4.001 1.939 12.851 296 3HD2 LEU 33 HD2 LEU 33 -5.287 2.987 13.448 297 H PHE 34 HN PHE 34 -0.698 3.796 9.365 298 HA PHE 34 HA PHE 34 -1.191 2.596 6.902 299 1HB PHE 34 HB2 PHE 34 -0.274 4.856 7.101 300 2HB PHE 34 HB1 PHE 34 1.207 4.208 7.797 301 HD1 PHE 34 HD1 PHE 34 2.972 3.545 6.420 302 HD2 PHE 34 HD2 PHE 34 -0.869 4.221 4.729 303 HE1 PHE 34 HE1 PHE 34 3.926 3.333 4.153 304 HE2 PHE 34 HE2 PHE 34 0.086 4.009 2.472 305 HZ PHE 34 HZ PHE 34 2.489 3.560 2.200 306 H SER 35 HN SER 35 1.537 2.149 9.161 307 HA SER 35 HA SER 35 2.903 0.371 7.498 308 1HB SER 35 HB2 SER 35 4.179 -0.242 9.590 309 2HB SER 35 HB1 SER 35 4.130 1.480 9.204 310 HG SER 35 HG SER 35 2.780 1.846 10.799 311 H ARG 36 HN ARG 36 0.515 -0.269 10.034 312 HA ARG 36 HA ARG 36 0.934 -3.073 9.804 313 1HB ARG 36 HB2 ARG 36 -0.969 -3.368 11.299 314 2HB ARG 36 HB1 ARG 36 0.172 -2.187 11.924 315 1HG ARG 36 HG2 ARG 36 -1.401 -0.429 10.983 316 2HG ARG 36 HG1 ARG 36 -2.561 -1.745 10.780 317 1HD ARG 36 HD2 ARG 36 -1.253 -0.883 13.364 318 2HD ARG 36 HD1 ARG 36 -2.929 -0.619 12.897 319 HE ARG 36 HE ARG 36 -2.745 -3.287 12.784 320 1HH1 ARG 36 1HH1 ARG 36 -1.672 -1.054 15.320 321 2HH1 ARG 36 2HH1 ARG 36 -2.014 -2.100 16.607 322 1HH2 ARG 36 1HH2 ARG 36 -3.192 -4.732 14.530 323 2HH2 ARG 36 2HH2 ARG 36 -2.901 -4.263 16.151 324 H ASP 37 HN ASP 37 -1.259 -0.845 8.260 325 HA ASP 37 HA ASP 37 -2.939 -2.866 7.096 326 1HB ASP 37 HB2 ASP 37 -3.514 -0.422 7.388 327 2HB ASP 37 HB1 ASP 37 -2.417 -0.060 6.069 328 H LEU 38 HN LEU 38 -0.203 -0.936 6.055 329 HA LEU 38 HA LEU 38 0.209 -1.855 3.477 330 1HB LEU 38 HB2 LEU 38 1.374 0.050 4.230 331 2HB LEU 38 HB1 LEU 38 2.025 -0.796 5.609 332 HG LEU 38 HG LEU 38 3.586 -2.000 4.158 333 1HD1 LEU 38 HD1 LEU 38 2.245 -2.119 2.144 334 2HD1 LEU 38 HD1 LEU 38 2.427 -0.368 1.921 335 3HD1 LEU 38 HD1 LEU 38 3.847 -1.429 1.867 336 1HD2 LEU 38 HD2 LEU 38 3.569 0.969 3.721 337 2HD2 LEU 38 HD2 LEU 38 4.246 0.118 5.108 338 3HD2 LEU 38 HD2 LEU 38 4.954 -0.100 3.506 339 H ASP 39 HN ASP 39 1.453 -3.113 6.534 340 HA ASP 39 HA ASP 39 3.068 -5.137 5.465 341 1HB ASP 39 HB2 ASP 39 3.036 -4.312 7.863 342 2HB ASP 39 HB1 ASP 39 1.593 -5.289 8.102 343 H LYS 40 HN LYS 40 -0.327 -5.111 6.385 344 HA LYS 40 HA LYS 40 -0.822 -7.848 5.877 345 1HB LYS 40 HB2 LYS 40 -2.755 -5.532 5.879 346 2HB LYS 40 HB1 LYS 40 -3.198 -7.233 5.856 347 1HG LYS 40 HG2 LYS 40 -2.140 -7.537 8.040 348 2HG LYS 40 HG1 LYS 40 -1.691 -5.831 8.056 349 1HD LYS 40 HD2 LYS 40 -4.091 -5.244 7.941 350 2HD LYS 40 HD1 LYS 40 -4.493 -6.957 8.025 351 1HE LYS 40 HE2 LYS 40 -3.048 -5.331 10.119 352 2HE LYS 40 HE1 LYS 40 -4.692 -5.959 10.224 353 1HZ LYS 40 HZ3 LYS 40 -3.732 -8.230 10.136 354 2HZ LYS 40 HZ2 LYS 40 -2.188 -7.545 10.151 355 3HZ LYS 40 HZ1 LYS 40 -3.198 -7.336 11.465 356 H LEU 41 HN LEU 41 -1.204 -4.945 3.885 357 HA LEU 41 HA LEU 41 -2.368 -6.088 1.610 358 1HB LEU 41 HB2 LEU 41 -1.949 -3.598 2.169 359 2HB LEU 41 HB1 LEU 41 -0.318 -3.847 1.604 360 HG LEU 41 HG LEU 41 -2.801 -4.075 -0.148 361 1HD1 LEU 41 HD1 LEU 41 -2.435 -1.804 0.560 362 2HD1 LEU 41 HD1 LEU 41 -0.761 -1.929 -0.023 363 3HD1 LEU 41 HD1 LEU 41 -2.108 -2.076 -1.159 364 1HD2 LEU 41 HD2 LEU 41 -0.972 -5.433 -0.945 365 2HD2 LEU 41 HD2 LEU 41 -1.324 -4.065 -1.995 366 3HD2 LEU 41 HD2 LEU 41 0.071 -4.005 -0.917 367 H ILE 42 HN ILE 42 0.984 -5.700 2.563 368 HA ILE 42 HA ILE 42 2.131 -6.881 0.261 369 HB ILE 42 HB ILE 42 3.295 -6.657 3.066 370 1HG1 ILE 42 2HG1 ILE 42 3.666 -4.957 0.596 371 2HG1 ILE 42 1HG1 ILE 42 2.776 -4.500 2.039 372 1HG2 ILE 42 1HG2 ILE 42 4.675 -7.290 0.455 373 2HG2 ILE 42 3HG2 ILE 42 5.479 -7.002 1.998 374 3HG2 ILE 42 2HG2 ILE 42 4.433 -8.408 1.794 375 1HD1 ILE 42 HD1 ILE 42 5.732 -5.044 1.890 376 2HD1 ILE 42 HD1 ILE 42 4.969 -3.453 1.960 377 3HD1 ILE 42 HD1 ILE 42 4.837 -4.557 3.331 378 H ASN 43 HN ASN 43 1.583 -8.325 3.470 379 HA ASN 43 HA ASN 43 2.333 -10.946 2.866 380 1HB ASN 43 HB2 ASN 43 0.301 -9.924 4.852 381 2HB ASN 43 HB1 ASN 43 0.606 -11.643 4.611 382 1HD2 ASN 43 HD2 ASN 43 2.017 -8.624 5.702 383 2HD2 ASN 43 HD2 ASN 43 3.284 -9.337 6.610 384 H LYS 44 HN LYS 44 -0.678 -9.355 2.195 385 HA LYS 44 HA LYS 44 -2.315 -11.487 1.435 386 1HB LYS 44 HB2 LYS 44 -3.064 -9.172 1.732 387 2HB LYS 44 HB1 LYS 44 -2.147 -8.692 0.317 388 1HG LYS 44 HG2 LYS 44 -3.620 -10.258 -1.029 389 2HG LYS 44 HG1 LYS 44 -4.595 -10.422 0.434 390 1HD LYS 44 HD2 LYS 44 -4.011 -7.823 -0.953 391 2HD LYS 44 HD1 LYS 44 -5.512 -8.736 -1.085 392 1HE LYS 44 HE2 LYS 44 -4.372 -7.527 1.437 393 2HE LYS 44 HE1 LYS 44 -5.730 -6.919 0.500 394 1HZ LYS 44 HZ1 LYS 44 -6.913 -9.019 1.000 395 2HZ LYS 44 HZ3 LYS 44 -5.623 -9.472 2.000 396 3HZ LYS 44 HZ2 LYS 44 -6.525 -8.122 2.373 397 H PHE 45 HN PHE 45 -0.136 -9.483 -0.491 398 HA PHE 45 HA PHE 45 -0.660 -11.021 -2.838 399 1HB PHE 45 HB2 PHE 45 0.953 -8.602 -2.256 400 2HB PHE 45 HB1 PHE 45 1.282 -9.510 -3.726 401 HD1 PHE 45 HD1 PHE 45 -0.217 -9.480 -5.559 402 HD2 PHE 45 HD2 PHE 45 -1.277 -7.591 -1.889 403 HE1 PHE 45 HE1 PHE 45 -2.138 -8.415 -6.659 404 HE2 PHE 45 HE2 PHE 45 -3.192 -6.512 -2.992 405 HZ PHE 45 HZ PHE 45 -3.626 -6.926 -5.378 406 H MET 46 HN MET 46 1.801 -10.984 -0.437 407 HA MET 46 HA MET 46 3.818 -12.397 -1.892 408 1HB MET 46 HB2 MET 46 3.330 -12.506 1.080 409 2HB MET 46 HB1 MET 46 4.835 -12.870 0.239 410 1HG MET 46 HG2 MET 46 4.698 -10.439 -0.562 411 2HG MET 46 HG1 MET 46 3.490 -10.254 0.700 412 1HE MET 46 HE1 MET 46 7.021 -10.514 -0.307 413 2HE MET 46 HE3 MET 46 7.923 -11.000 1.123 414 3HE MET 46 HE2 MET 46 6.864 -12.159 0.311 415 H ASN 47 HN ASN 47 0.951 -13.290 -0.260 416 HA ASN 47 HA ASN 47 -0.190 -15.142 0.154 417 1HB ASN 47 HB2 ASN 47 0.186 -15.652 -2.299 418 2HB ASN 47 HB1 ASN 47 1.574 -16.621 -1.824 419 1HD2 ASN 47 HD2 ASN 47 -0.835 -17.397 -3.194 420 2HD2 ASN 47 HD2 ASN 47 -1.571 -18.658 -2.275 421 H VAL 48 HN VAL 48 0.782 -14.844 2.165 422 HA VAL 48 HA VAL 48 2.128 -17.206 3.008 423 HB VAL 48 HB VAL 48 3.520 -15.828 4.592 424 1HG1 VAL 48 2HG1 VAL 48 4.569 -16.796 2.607 425 2HG1 VAL 48 1HG1 VAL 48 4.131 -15.370 1.670 426 3HG1 VAL 48 3HG1 VAL 48 5.295 -15.233 2.989 427 1HG2 VAL 48 3HG2 VAL 48 2.729 -13.543 2.796 428 2HG2 VAL 48 2HG2 VAL 48 2.312 -13.734 4.497 429 3HG2 VAL 48 1HG2 VAL 48 3.993 -13.474 4.027 430 H LYS 49 HN LYS 49 1.431 -17.787 4.981 431 HA LYS 49 HA LYS 49 -0.441 -16.072 6.342 432 1HB LYS 49 HB2 LYS 49 -1.986 -18.142 6.500 433 2HB LYS 49 HB1 LYS 49 -1.981 -17.189 5.014 434 1HG LYS 49 HG2 LYS 49 -0.585 -18.776 3.923 435 2HG LYS 49 HG1 LYS 49 -0.399 -19.720 5.399 436 1HD LYS 49 HD2 LYS 49 -2.812 -20.209 5.366 437 2HD LYS 49 HD1 LYS 49 -2.977 -19.259 3.889 438 1HE LYS 49 HE2 LYS 49 -2.874 -21.651 3.398 439 2HE LYS 49 HE1 LYS 49 -1.493 -20.794 2.714 440 1HZ LYS 49 HZ1 LYS 49 -0.140 -21.588 4.579 441 2HZ LYS 49 HZ3 LYS 49 -1.458 -22.406 5.224 442 3HZ LYS 49 HZ2 LYS 49 -0.821 -22.876 3.757 443 H ASP 50 HN ASP 50 1.394 -15.988 7.677 444 HA ASP 50 HA ASP 50 1.856 -18.422 9.234 445 1HB ASP 50 HB2 ASP 50 3.611 -16.059 8.667 446 2HB ASP 50 HB1 ASP 50 3.906 -17.116 10.044 447 H LYS 51 HN LYS 51 2.252 -18.135 11.522 448 HA LYS 51 HA LYS 51 0.380 -16.131 12.507 449 1HB LYS 51 HB2 LYS 51 0.174 -17.488 14.544 450 2HB LYS 51 HB1 LYS 51 -0.175 -18.447 13.112 451 1HG LYS 51 HG2 LYS 51 2.000 -19.487 13.233 452 2HG LYS 51 HG1 LYS 51 2.455 -18.445 14.581 453 1HD LYS 51 HD2 LYS 51 0.588 -19.410 15.889 454 2HD LYS 51 HD1 LYS 51 0.269 -20.518 14.557 455 1HE LYS 51 HE2 LYS 51 2.468 -21.488 14.783 456 2HE LYS 51 HE1 LYS 51 2.885 -20.325 16.035 457 1HZ LYS 51 HZ1 LYS 51 1.150 -21.299 17.439 458 2HZ LYS 51 HZ3 LYS 51 0.790 -22.419 16.232 459 3HZ LYS 51 HZ2 LYS 51 2.290 -22.449 16.980 460 H VAL 52 HN VAL 52 3.419 -16.390 12.030 461 HA VAL 52 HA VAL 52 4.321 -15.319 14.556 462 HB VAL 52 HB VAL 52 6.631 -15.290 13.588 463 1HG1 VAL 52 3HG1 VAL 52 5.174 -17.924 13.470 464 2HG1 VAL 52 2HG1 VAL 52 6.922 -17.730 13.589 465 3HG1 VAL 52 1HG1 VAL 52 5.878 -17.172 14.898 466 1HG2 VAL 52 1HG2 VAL 52 6.036 -15.094 11.197 467 2HG2 VAL 52 3HG2 VAL 52 7.093 -16.473 11.505 468 3HG2 VAL 52 2HG2 VAL 52 5.375 -16.736 11.253 469 H HIS 53 HN HIS 53 3.947 -13.337 14.978 470 HA HIS 53 HA HIS 53 3.819 -11.294 12.947 471 1HB HIS 53 HB2 HIS 53 3.834 -11.091 15.977 472 2HB HIS 53 HB1 HIS 53 3.620 -9.734 14.890 473 HD1 HIS 53 HD1 HIS 53 1.797 -12.471 16.566 474 HD2 HIS 53 HD2 HIS 53 1.109 -9.683 13.568 475 HE1 HIS 53 HE1 HIS 53 -0.713 -12.309 16.324 476 H LYS 54 HN LYS 54 5.710 -10.643 12.079 477 HA LYS 54 HA LYS 54 8.133 -10.823 13.572 478 1HB LYS 54 HB2 LYS 54 8.293 -11.043 11.156 479 2HB LYS 54 HB1 LYS 54 7.537 -9.473 10.925 480 1HG LYS 54 HG2 LYS 54 9.467 -8.369 11.937 481 2HG LYS 54 HG1 LYS 54 10.227 -9.933 12.211 482 1HD LYS 54 HD2 LYS 54 9.454 -8.929 9.474 483 2HD LYS 54 HD1 LYS 54 11.036 -8.638 10.191 484 1HE LYS 54 HE2 LYS 54 9.827 -11.368 9.697 485 2HE LYS 54 HE1 LYS 54 11.013 -10.582 8.658 486 1HZ LYS 54 HZ1 LYS 54 11.460 -11.316 11.507 487 2HZ LYS 54 HZ3 LYS 54 12.042 -12.159 10.178 488 3HZ LYS 54 HZ2 LYS 54 12.593 -10.607 10.487 489 H LEU 55 HN LEU 55 7.952 -9.666 15.391 490 HA LEU 55 HA LEU 55 7.096 -6.944 15.255 491 1HB LEU 55 HB2 LEU 55 8.095 -8.563 17.577 492 2HB LEU 55 HB1 LEU 55 7.550 -6.901 17.683 493 HG LEU 55 HG LEU 55 5.861 -9.285 16.934 494 1HD1 LEU 55 HD1 LEU 55 5.979 -7.506 19.317 495 2HD1 LEU 55 HD1 LEU 55 4.745 -8.756 19.046 496 3HD1 LEU 55 HD1 LEU 55 6.452 -9.202 19.244 497 1HD2 LEU 55 HD2 LEU 55 5.119 -6.367 17.217 498 2HD2 LEU 55 HD2 LEU 55 5.099 -7.311 15.723 499 3HD2 LEU 55 HD2 LEU 55 3.981 -7.700 17.020 500 H GLU 56 HN GLU 56 8.468 -6.356 13.925 501 HA GLU 56 HA GLU 56 11.286 -6.196 14.341 502 1HB GLU 56 HB2 GLU 56 10.359 -6.294 12.103 503 2HB GLU 56 HB1 GLU 56 9.384 -4.875 12.392 504 1HG GLU 56 HG2 GLU 56 12.369 -4.770 12.384 505 2HG GLU 56 HG1 GLU 56 11.423 -4.669 10.896 506 H HIS 57 HN HIS 57 8.537 -4.083 14.754 507 HA HIS 57 HA HIS 57 10.189 -2.383 16.425 508 1HB HIS 57 HB2 HIS 57 8.485 -0.551 15.897 509 2HB HIS 57 HB1 HIS 57 9.636 -0.940 14.625 510 HD1 HIS 57 HD1 HIS 57 8.626 -2.227 12.520 511 HD2 HIS 57 HD2 HIS 57 5.830 -0.867 15.281 512 HE1 HIS 57 HE1 HIS 57 6.367 -2.360 11.374 513 H HIS 58 HN HIS 58 9.825 -2.987 18.363 514 HA HIS 58 HA HIS 58 7.227 -2.745 19.512 515 1HB HIS 58 HB2 HIS 58 6.994 -5.018 18.649 516 2HB HIS 58 HB1 HIS 58 8.540 -5.479 19.344 517 HD1 HIS 58 HD1 HIS 58 8.496 -6.361 21.757 518 HD2 HIS 58 HD2 HIS 58 4.884 -4.682 20.557 519 HE1 HIS 58 HE1 HIS 58 6.839 -6.910 23.555 520 H HIS 59 HN HIS 59 10.356 -4.375 20.036 521 HA HIS 59 HA HIS 59 10.411 -3.341 22.743 522 1HB HIS 59 HB2 HIS 59 10.904 -5.759 22.315 523 2HB HIS 59 HB1 HIS 59 12.318 -5.269 21.391 524 HD1 HIS 59 HD1 HIS 59 11.127 -5.857 24.844 525 HD2 HIS 59 HD2 HIS 59 14.422 -4.180 22.970 526 HE1 HIS 59 HE1 HIS 59 12.899 -5.647 26.615 527 H HIS 60 HN HIS 60 10.893 -1.275 22.521 528 HA HIS 60 HA HIS 60 13.303 -0.522 21.066 529 1HB HIS 60 HB2 HIS 60 11.085 1.182 22.234 530 2HB HIS 60 HB1 HIS 60 12.493 1.814 21.388 531 HD1 HIS 60 HD1 HIS 60 9.070 0.724 20.800 532 HD2 HIS 60 HD2 HIS 60 12.594 0.921 18.630 533 HE1 HIS 60 HE1 HIS 60 8.406 0.513 18.373 534 H HIS 61 HN HIS 61 11.703 0.379 24.114 535 HA HIS 61 HA HIS 61 14.139 -0.055 25.579 536 1HB HIS 61 HB2 HIS 61 14.598 2.180 24.779 537 2HB HIS 61 HB1 HIS 61 12.986 2.723 25.214 538 HD1 HIS 61 HD1 HIS 61 13.004 4.112 27.300 539 HD2 HIS 61 HD2 HIS 61 16.027 1.261 27.292 540 HE1 HIS 61 HE1 HIS 61 14.273 4.438 29.437 541 H HIS 62 HN HIS 62 13.664 -0.667 27.598 542 HA HIS 62 HA HIS 62 10.962 -0.128 28.582 543 1HB HIS 62 HB2 HIS 62 12.817 -2.464 29.184 544 2HB HIS 62 HB1 HIS 62 11.373 -2.121 30.116 545 HD1 HIS 62 HD1 HIS 62 10.973 -4.739 29.199 546 HD2 HIS 62 HD2 HIS 62 10.501 -1.632 26.475 547 HE1 HIS 62 HE1 HIS 62 9.582 -5.658 27.316 548 H1 MET 101 HT3 MET 101 6.553 23.576 0.509 549 H2 MET 101 HT2 MET 101 7.823 24.000 1.576 550 H3 MET 101 HT1 MET 101 8.032 24.082 -0.095 551 HA MET 101 HA MET 101 9.105 22.141 0.668 552 1HB MET 101 HB2 MET 101 6.357 21.329 1.682 553 2HB MET 101 HB1 MET 101 7.764 20.292 1.635 554 1HG MET 101 HG2 MET 101 7.423 21.026 3.882 555 2HG MET 101 HG1 MET 101 8.877 21.796 3.261 556 1HE MET 101 HE3 MET 101 5.077 22.286 4.198 557 2HE MET 101 HE2 MET 101 4.827 23.979 3.773 558 3HE MET 101 HE1 MET 101 5.103 22.788 2.506 559 H GLU 102 HN GLU 102 9.455 21.279 -1.272 560 HA GLU 102 HA GLU 102 7.318 21.159 -3.163 561 1HB GLU 102 HB2 GLU 102 9.562 21.760 -3.925 562 2HB GLU 102 HB1 GLU 102 10.181 20.211 -3.375 563 1HG GLU 102 HG2 GLU 102 9.843 20.373 -5.826 564 2HG GLU 102 HG1 GLU 102 8.981 19.039 -5.061 565 H MET 103 HN MET 103 5.828 19.768 -2.718 566 HA MET 103 HA MET 103 6.408 17.264 -1.510 567 1HB MET 103 HB2 MET 103 4.065 16.762 -1.542 568 2HB MET 103 HB1 MET 103 4.263 18.444 -1.081 569 1HG MET 103 HG2 MET 103 3.621 19.138 -3.337 570 2HG MET 103 HG1 MET 103 3.468 17.453 -3.809 571 1HE MET 103 HE1 MET 103 1.618 15.800 -2.858 572 2HE MET 103 HE3 MET 103 2.085 16.148 -1.189 573 3HE MET 103 HE2 MET 103 0.398 16.267 -1.678 574 H GLY 104 HN GLY 104 6.439 18.299 -4.760 575 1HA GLY 104 HA1 GLY 104 6.671 17.148 -6.717 576 2HA GLY 104 HA2 GLY 104 5.700 15.870 -5.999 577 H GLN 105 HN GLN 105 8.777 17.145 -4.878 578 HA GLN 105 HA GLN 105 10.243 14.857 -5.824 579 1HB GLN 105 HB2 GLN 105 11.083 17.058 -3.937 580 2HB GLN 105 HB1 GLN 105 12.155 15.833 -4.609 581 1HG GLN 105 HG2 GLN 105 11.705 16.636 -6.847 582 2HG GLN 105 HG1 GLN 105 10.583 17.829 -6.205 583 1HE2 GLN 105 1HE2 GLN 105 13.694 17.001 -4.729 584 2HE2 GLN 105 2HE2 GLN 105 14.393 18.542 -5.037 585 H LEU 106 HN LEU 106 8.579 15.763 -3.005 586 HA LEU 106 HA LEU 106 9.652 13.753 -1.305 587 1HB LEU 106 HB2 LEU 106 8.523 15.826 -0.486 588 2HB LEU 106 HB1 LEU 106 7.030 15.276 -1.199 589 HG LEU 106 HG LEU 106 7.233 15.094 1.334 590 1HD1 LEU 106 HD1 LEU 106 6.575 12.607 -0.189 591 2HD1 LEU 106 HD1 LEU 106 6.123 12.954 1.477 592 3HD1 LEU 106 HD1 LEU 106 5.483 13.948 0.165 593 1HD2 LEU 106 HD2 LEU 106 9.032 12.801 0.591 594 2HD2 LEU 106 HD2 LEU 106 9.509 14.263 1.462 595 3HD2 LEU 106 HD2 LEU 106 8.376 13.118 2.192 596 H LYS 107 HN LYS 107 6.738 14.092 -3.288 597 HA LYS 107 HA LYS 107 5.709 11.530 -2.998 598 1HB LYS 107 HB2 LYS 107 5.290 13.809 -4.753 599 2HB LYS 107 HB1 LYS 107 5.027 12.276 -5.571 600 1HG LYS 107 HG2 LYS 107 3.781 12.921 -2.926 601 2HG LYS 107 HG1 LYS 107 3.019 13.355 -4.456 602 1HD LYS 107 HD2 LYS 107 3.938 10.561 -3.902 603 2HD LYS 107 HD1 LYS 107 2.315 11.096 -3.396 604 1HE LYS 107 HE2 LYS 107 1.962 11.757 -5.806 605 2HE LYS 107 HE1 LYS 107 3.500 10.985 -6.169 606 1HZ LYS 107 HZ3 LYS 107 1.133 9.612 -5.013 607 2HZ LYS 107 HZ2 LYS 107 1.567 9.585 -6.615 608 3HZ LYS 107 HZ1 LYS 107 2.584 8.854 -5.470 609 H ASN 108 HN ASN 108 8.051 12.812 -5.277 610 HA ASN 108 HA ASN 108 8.298 10.576 -6.858 611 1HB ASN 108 HB2 ASN 108 9.376 12.718 -7.443 612 2HB ASN 108 HB1 ASN 108 10.499 12.522 -6.106 613 1HD2 ASN 108 HD2 ASN 108 12.298 11.176 -6.365 614 2HD2 ASN 108 HD2 ASN 108 12.685 10.431 -7.863 615 H LYS 109 HN LYS 109 9.882 11.333 -3.798 616 HA LYS 109 HA LYS 109 11.526 9.012 -3.761 617 1HB LYS 109 HB2 LYS 109 10.587 10.753 -1.479 618 2HB LYS 109 HB1 LYS 109 11.813 9.502 -1.347 619 1HG LYS 109 HG2 LYS 109 13.226 10.705 -2.922 620 2HG LYS 109 HG1 LYS 109 11.989 11.953 -3.073 621 1HD LYS 109 HD2 LYS 109 12.197 12.427 -0.670 622 2HD LYS 109 HD1 LYS 109 13.470 11.207 -0.555 623 1HE LYS 109 HE2 LYS 109 14.446 13.421 -0.724 624 2HE LYS 109 HE1 LYS 109 14.820 12.475 -2.155 625 1HZ LYS 109 HZ2 LYS 109 12.658 14.508 -1.983 626 2HZ LYS 109 HZ1 LYS 109 14.158 14.751 -2.698 627 3HZ LYS 109 HZ3 LYS 109 13.081 13.632 -3.364 628 H ILE 110 HN ILE 110 8.333 9.773 -2.472 629 HA ILE 110 HA ILE 110 7.836 7.360 -1.133 630 HB ILE 110 HB ILE 110 5.902 9.235 -2.543 631 1HG1 ILE 110 2HG1 ILE 110 6.535 8.831 0.376 632 2HG1 ILE 110 1HG1 ILE 110 7.080 10.192 -0.607 633 1HG2 ILE 110 3HG2 ILE 110 4.883 7.024 -2.436 634 2HG2 ILE 110 2HG2 ILE 110 5.217 6.939 -0.707 635 3HG2 ILE 110 1HG2 ILE 110 4.082 8.139 -1.325 636 1HD1 ILE 110 HD1 ILE 110 4.248 9.521 0.165 637 2HD1 ILE 110 HD1 ILE 110 5.258 10.802 0.836 638 3HD1 ILE 110 HD1 ILE 110 4.739 10.890 -0.847 639 H GLU 111 HN GLU 111 7.081 8.347 -4.439 640 HA GLU 111 HA GLU 111 6.009 5.956 -5.338 641 1HB GLU 111 HB2 GLU 111 7.534 8.063 -6.862 642 2HB GLU 111 HB1 GLU 111 6.668 6.743 -7.632 643 1HG GLU 111 HG2 GLU 111 5.487 8.949 -5.959 644 2HG GLU 111 HG1 GLU 111 5.388 8.796 -7.711 645 H ASN 112 HN ASN 112 9.316 7.159 -5.584 646 HA ASN 112 HA ASN 112 10.486 5.027 -6.911 647 1HB ASN 112 HB2 ASN 112 11.640 7.112 -6.756 648 2HB ASN 112 HB1 ASN 112 11.614 7.072 -5.005 649 1HD2 ASN 112 HD2 ASN 112 13.835 7.459 -5.040 650 2HD2 ASN 112 HD2 ASN 112 14.971 6.207 -5.374 651 H LYS 113 HN LYS 113 10.276 5.533 -3.380 652 HA LYS 113 HA LYS 113 11.758 3.173 -2.844 653 1HB LYS 113 HB2 LYS 113 11.385 5.270 -1.363 654 2HB LYS 113 HB1 LYS 113 9.875 4.503 -0.919 655 1HG LYS 113 HG2 LYS 113 11.571 4.062 0.735 656 2HG LYS 113 HG1 LYS 113 11.073 2.570 -0.062 657 1HD LYS 113 HD2 LYS 113 13.494 2.600 0.201 658 2HD LYS 113 HD1 LYS 113 13.094 2.682 -1.503 659 1HE LYS 113 HE2 LYS 113 14.854 4.189 -1.137 660 2HE LYS 113 HE1 LYS 113 13.416 5.169 -1.348 661 1HZ LYS 113 HZ1 LYS 113 13.327 5.414 1.131 662 2HZ LYS 113 HZ3 LYS 113 14.775 4.538 1.245 663 3HZ LYS 113 HZ2 LYS 113 14.730 6.003 0.448 664 H LYS 114 HN LYS 114 8.287 3.901 -2.924 665 HA LYS 114 HA LYS 114 7.196 1.464 -2.213 666 1HB LYS 114 HB2 LYS 114 5.918 3.519 -2.579 667 2HB LYS 114 HB1 LYS 114 6.372 3.499 -4.271 668 1HG LYS 114 HG2 LYS 114 5.061 1.402 -4.535 669 2HG LYS 114 HG1 LYS 114 4.533 1.564 -2.860 670 1HD LYS 114 HD2 LYS 114 2.802 2.490 -4.325 671 2HD LYS 114 HD1 LYS 114 3.582 3.791 -3.422 672 1HE LYS 114 HE2 LYS 114 4.999 4.271 -5.372 673 2HE LYS 114 HE1 LYS 114 4.181 3.002 -6.267 674 1HZ LYS 114 HZ2 LYS 114 2.086 4.368 -6.084 675 2HZ LYS 114 HZ1 LYS 114 2.956 5.516 -5.211 676 3HZ LYS 114 HZ3 LYS 114 3.329 5.217 -6.787 677 H LYS 115 HN LYS 115 8.175 2.706 -5.390 678 HA LYS 115 HA LYS 115 7.601 0.446 -6.924 679 1HB LYS 115 HB2 LYS 115 9.470 2.755 -7.310 680 2HB LYS 115 HB1 LYS 115 9.359 1.463 -8.497 681 1HG LYS 115 HG2 LYS 115 7.178 2.015 -9.077 682 2HG LYS 115 HG1 LYS 115 6.895 2.886 -7.568 683 1HD LYS 115 HD2 LYS 115 8.205 4.666 -8.217 684 2HD LYS 115 HD1 LYS 115 8.896 3.827 -9.624 685 1HE LYS 115 HE2 LYS 115 6.006 4.640 -9.237 686 2HE LYS 115 HE1 LYS 115 7.179 5.543 -10.186 687 1HZ LYS 115 HZ1 LYS 115 7.426 3.537 -11.591 688 2HZ LYS 115 HZ3 LYS 115 6.129 2.821 -10.759 689 3HZ LYS 115 HZ2 LYS 115 5.903 4.234 -11.642 690 H GLU 116 HN GLU 116 10.586 1.303 -5.223 691 HA GLU 116 HA GLU 116 12.038 -0.940 -6.115 692 1HB GLU 116 HB2 GLU 116 12.315 0.731 -3.643 693 2HB GLU 116 HB1 GLU 116 13.398 -0.601 -3.979 694 1HG GLU 116 HG2 GLU 116 13.678 0.701 -6.253 695 2HG GLU 116 HG1 GLU 116 13.140 2.051 -5.251 696 H LEU 117 HN LEU 117 9.914 -0.503 -3.384 697 HA LEU 117 HA LEU 117 10.278 -3.069 -2.276 698 1HB LEU 117 HB2 LEU 117 9.357 -1.415 -0.867 699 2HB LEU 117 HB1 LEU 117 8.149 -0.961 -2.037 700 HG LEU 117 HG LEU 117 7.281 -2.135 0.021 701 1HD1 LEU 117 HD1 LEU 117 5.967 -1.856 -1.836 702 2HD1 LEU 117 HD1 LEU 117 6.570 -3.358 -2.526 703 3HD1 LEU 117 HD1 LEU 117 5.646 -3.389 -1.010 704 1HD2 LEU 117 HD2 LEU 117 8.582 -4.531 -1.216 705 2HD2 LEU 117 HD2 LEU 117 9.020 -3.784 0.327 706 3HD2 LEU 117 HD2 LEU 117 7.432 -4.535 0.126 707 H ILE 118 HN ILE 118 7.955 -1.766 -4.542 708 HA ILE 118 HA ILE 118 6.412 -4.012 -4.810 709 HB ILE 118 HB ILE 118 7.034 -1.884 -6.882 710 1HG1 ILE 118 2HG1 ILE 118 4.504 -2.257 -5.292 711 2HG1 ILE 118 1HG1 ILE 118 5.809 -1.279 -4.654 712 1HG2 ILE 118 1HG2 ILE 118 4.877 -4.001 -6.915 713 2HG2 ILE 118 3HG2 ILE 118 5.000 -2.660 -8.061 714 3HG2 ILE 118 2HG2 ILE 118 6.252 -3.907 -8.008 715 1HD1 ILE 118 HD1 ILE 118 4.418 -0.831 -7.274 716 2HD1 ILE 118 HD1 ILE 118 4.049 0.025 -5.775 717 3HD1 ILE 118 HD1 ILE 118 5.634 0.203 -6.547 718 H GLN 119 HN GLN 119 9.336 -3.047 -6.518 719 HA GLN 119 HA GLN 119 9.590 -5.246 -8.247 720 1HB GLN 119 HB2 GLN 119 11.632 -3.401 -7.033 721 2HB GLN 119 HB1 GLN 119 12.066 -4.645 -8.198 722 1HG GLN 119 HG2 GLN 119 10.667 -3.616 -9.870 723 2HG GLN 119 HG1 GLN 119 10.074 -2.445 -8.698 724 1HE2 GLN 119 1HE2 GLN 119 11.362 -0.765 -8.111 725 2HE2 GLN 119 2HE2 GLN 119 12.781 -0.303 -8.985 726 H LEU 120 HN LEU 120 10.160 -5.002 -4.848 727 HA LEU 120 HA LEU 120 11.752 -7.402 -4.736 728 1HB LEU 120 HB2 LEU 120 10.575 -5.721 -2.526 729 2HB LEU 120 HB1 LEU 120 11.582 -7.130 -2.273 730 HG LEU 120 HG LEU 120 12.462 -4.576 -3.621 731 1HD1 LEU 120 HD1 LEU 120 13.104 -5.699 -0.902 732 2HD1 LEU 120 HD1 LEU 120 13.820 -4.258 -1.622 733 3HD1 LEU 120 HD1 LEU 120 12.102 -4.285 -1.237 734 1HD2 LEU 120 HD2 LEU 120 14.014 -7.065 -2.883 735 2HD2 LEU 120 HD2 LEU 120 13.653 -6.502 -4.515 736 3HD2 LEU 120 HD2 LEU 120 14.714 -5.559 -3.476 737 H VAL 121 HN VAL 121 8.388 -6.520 -3.543 738 HA VAL 121 HA VAL 121 7.791 -9.157 -2.969 739 HB VAL 121 HB VAL 121 5.531 -8.520 -2.960 740 1HG1 VAL 121 1HG1 VAL 121 7.214 -6.236 -2.118 741 2HG1 VAL 121 3HG1 VAL 121 5.533 -6.468 -1.637 742 3HG1 VAL 121 2HG1 VAL 121 6.761 -7.654 -1.143 743 1HG2 VAL 121 1HG2 VAL 121 5.351 -7.441 -5.080 744 2HG2 VAL 121 3HG2 VAL 121 4.675 -6.421 -3.807 745 3HG2 VAL 121 2HG2 VAL 121 6.280 -6.061 -4.479 746 H ALA 122 HN ALA 122 7.851 -7.481 -6.022 747 HA ALA 122 HA ALA 122 6.309 -9.236 -7.523 748 1HB ALA 122 HB3 ALA 122 8.595 -7.513 -8.426 749 2HB ALA 122 HB2 ALA 122 7.295 -8.168 -9.457 750 3HB ALA 122 HB1 ALA 122 6.930 -7.001 -8.186 751 H ARG 123 HN ARG 123 9.764 -9.182 -6.813 752 HA ARG 123 HA ARG 123 10.255 -11.493 -8.433 753 1HB ARG 123 HB2 ARG 123 12.555 -11.357 -7.673 754 2HB ARG 123 HB1 ARG 123 12.002 -9.781 -8.192 755 1HG ARG 123 HG2 ARG 123 11.596 -9.250 -5.767 756 2HG ARG 123 HG1 ARG 123 12.421 -10.768 -5.400 757 1HD ARG 123 HD2 ARG 123 13.984 -8.900 -5.274 758 2HD ARG 123 HD1 ARG 123 14.407 -9.973 -6.608 759 HE ARG 123 HE ARG 123 12.688 -7.799 -7.348 760 1HH1 ARG 123 1HH1 ARG 123 16.089 -8.730 -6.900 761 2HH1 ARG 123 2HH1 ARG 123 16.687 -7.617 -8.036 762 1HH2 ARG 123 1HH2 ARG 123 13.541 -6.239 -8.891 763 2HH2 ARG 123 2HH2 ARG 123 15.197 -6.141 -9.186 764 H HIS 124 HN HIS 124 8.962 -11.068 -5.428 765 HA HIS 124 HA HIS 124 9.928 -13.356 -4.069 766 1HB HIS 124 HB2 HIS 124 8.718 -11.575 -2.894 767 2HB HIS 124 HB1 HIS 124 7.259 -11.919 -3.796 768 HD1 HIS 124 HD1 HIS 124 5.912 -14.144 -3.027 769 HD2 HIS 124 HD2 HIS 124 9.215 -13.141 -0.734 770 HE1 HIS 124 HE1 HIS 124 5.737 -15.489 -0.928 771 H GLY 125 HN GLY 125 7.558 -12.894 -6.588 772 1HA GLY 125 HA1 GLY 125 6.441 -15.550 -6.197 773 2HA GLY 125 HA2 GLY 125 7.431 -15.338 -7.634 774 H LEU 126 HN LEU 126 5.678 -12.514 -6.716 775 HA LEU 126 HA LEU 126 3.250 -12.887 -7.770 776 1HB LEU 126 HB2 LEU 126 5.040 -10.594 -7.380 777 2HB LEU 126 HB1 LEU 126 3.580 -10.346 -8.327 778 HG LEU 126 HG LEU 126 2.277 -11.155 -6.466 779 1HD1 LEU 126 HD1 LEU 126 3.771 -12.554 -5.391 780 2HD1 LEU 126 HD1 LEU 126 4.782 -11.190 -4.857 781 3HD1 LEU 126 HD1 LEU 126 3.089 -11.361 -4.301 782 1HD2 LEU 126 HD2 LEU 126 4.065 -8.816 -5.923 783 2HD2 LEU 126 HD2 LEU 126 2.530 -8.809 -6.786 784 3HD2 LEU 126 HD2 LEU 126 2.564 -9.131 -5.057 785 H ASP 127 HN ASP 127 2.324 -12.744 -9.570 786 HA ASP 127 HA ASP 127 3.720 -13.027 -12.084 787 1HB ASP 127 HB2 ASP 127 0.749 -12.524 -11.714 788 2HB ASP 127 HB1 ASP 127 1.540 -13.307 -13.070 789 H HIS 128 HN HIS 128 3.131 -11.496 -13.892 790 HA HIS 128 HA HIS 128 3.747 -8.840 -13.344 791 1HB HIS 128 HB2 HIS 128 3.969 -9.801 -15.570 792 2HB HIS 128 HB1 HIS 128 2.234 -10.021 -15.686 793 HD1 HIS 128 HD1 HIS 128 1.278 -8.379 -17.261 794 HD2 HIS 128 HD2 HIS 128 4.475 -6.783 -15.149 795 HE1 HIS 128 HE1 HIS 128 1.578 -6.036 -18.125 796 H ASP 129 HN ASP 129 0.595 -10.335 -13.760 797 HA ASP 129 HA ASP 129 -0.986 -8.033 -13.553 798 1HB ASP 129 HB2 ASP 129 -1.934 -9.998 -14.485 799 2HB ASP 129 HB1 ASP 129 -1.538 -10.949 -13.066 800 H LYS 130 HN LYS 130 0.181 -10.300 -11.149 801 HA LYS 130 HA LYS 130 -1.102 -9.405 -8.839 802 1HB LYS 130 HB2 LYS 130 1.678 -10.466 -9.233 803 2HB LYS 130 HB1 LYS 130 0.975 -10.147 -7.660 804 1HG LYS 130 HG2 LYS 130 -0.304 -12.027 -9.600 805 2HG LYS 130 HG1 LYS 130 1.009 -12.517 -8.534 806 1HD LYS 130 HD2 LYS 130 -0.234 -11.906 -6.621 807 2HD LYS 130 HD1 LYS 130 -1.575 -11.303 -7.552 808 1HE LYS 130 HE2 LYS 130 -0.574 -14.142 -7.243 809 2HE LYS 130 HE1 LYS 130 -2.162 -13.509 -6.834 810 1HZ LYS 130 HZ1 LYS 130 -2.559 -13.209 -9.261 811 2HZ LYS 130 HZ3 LYS 130 -1.091 -13.992 -9.583 812 3HZ LYS 130 HZ2 LYS 130 -2.356 -14.781 -8.786 813 H VAL 131 HN VAL 131 1.914 -8.393 -10.373 814 HA VAL 131 HA VAL 131 2.775 -6.537 -8.471 815 HB VAL 131 HB VAL 131 3.348 -6.542 -11.458 816 1HG1 VAL 131 1HG1 VAL 131 3.992 -4.450 -10.427 817 2HG1 VAL 131 3HG1 VAL 131 4.914 -5.325 -9.204 818 3HG1 VAL 131 2HG1 VAL 131 5.409 -5.393 -10.896 819 1HG2 VAL 131 3HG2 VAL 131 4.802 -7.915 -9.211 820 2HG2 VAL 131 2HG2 VAL 131 3.864 -8.680 -10.496 821 3HG2 VAL 131 1HG2 VAL 131 5.350 -7.819 -10.888 822 H LEU 132 HN LEU 132 0.839 -6.183 -11.381 823 HA LEU 132 HA LEU 132 0.552 -3.360 -11.317 824 1HB LEU 132 HB2 LEU 132 -1.307 -5.413 -12.475 825 2HB LEU 132 HB1 LEU 132 -1.269 -3.704 -12.867 826 HG LEU 132 HG LEU 132 0.886 -5.719 -13.477 827 1HD1 LEU 132 HD1 LEU 132 -1.038 -4.261 -15.245 828 2HD1 LEU 132 HD1 LEU 132 0.271 -5.321 -15.789 829 3HD1 LEU 132 HD1 LEU 132 -1.065 -5.983 -14.845 830 1HD2 LEU 132 HD2 LEU 132 0.737 -2.775 -14.137 831 2HD2 LEU 132 HD2 LEU 132 1.866 -3.546 -13.019 832 3HD2 LEU 132 HD2 LEU 132 1.949 -3.909 -14.739 833 H LEU 133 HN LEU 133 -1.445 -5.948 -10.023 834 HA LEU 133 HA LEU 133 -3.497 -4.252 -9.051 835 1HB LEU 133 HB2 LEU 133 -2.652 -6.998 -8.160 836 2HB LEU 133 HB1 LEU 133 -4.135 -6.197 -7.676 837 HG LEU 133 HG LEU 133 -3.450 -6.926 -10.517 838 1HD1 LEU 133 HD1 LEU 133 -5.216 -8.317 -8.522 839 2HD1 LEU 133 HD1 LEU 133 -5.069 -8.713 -10.238 840 3HD1 LEU 133 HD1 LEU 133 -3.675 -8.906 -9.181 841 1HD2 LEU 133 HD2 LEU 133 -6.027 -6.001 -9.238 842 2HD2 LEU 133 HD2 LEU 133 -5.018 -5.060 -10.340 843 3HD2 LEU 133 HD2 LEU 133 -5.831 -6.513 -10.913 844 H PHE 134 HN PHE 134 -0.677 -5.740 -7.518 845 HA PHE 134 HA PHE 134 -1.061 -4.821 -4.925 846 1HB PHE 134 HB2 PHE 134 0.551 -6.546 -5.425 847 2HB PHE 134 HB1 PHE 134 1.483 -5.445 -6.429 848 HD1 PHE 134 HD1 PHE 134 0.346 -5.958 -2.903 849 HD2 PHE 134 HD2 PHE 134 3.261 -4.258 -5.504 850 HE1 PHE 134 HE1 PHE 134 1.726 -5.406 -0.997 851 HE2 PHE 134 HE2 PHE 134 4.640 -3.682 -3.532 852 HZ PHE 134 HZ PHE 134 3.868 -4.263 -1.301 853 H SER 135 HN SER 135 0.846 -3.393 -7.548 854 HA SER 135 HA SER 135 1.845 -1.258 -6.082 855 1HB SER 135 HB2 SER 135 2.288 -0.247 -8.360 856 2HB SER 135 HB1 SER 135 2.929 -1.868 -8.083 857 HG SER 135 HG SER 135 1.464 -2.720 -9.352 858 H ARG 136 HN ARG 136 -1.112 -1.468 -7.992 859 HA ARG 136 HA ARG 136 -1.638 1.314 -7.629 860 1HB ARG 136 HB2 ARG 136 -3.752 0.927 -8.747 861 2HB ARG 136 HB1 ARG 136 -2.433 0.178 -9.641 862 1HG ARG 136 HG2 ARG 136 -3.111 -1.982 -8.580 863 2HG ARG 136 HG1 ARG 136 -4.525 -1.145 -7.942 864 1HD ARG 136 HD2 ARG 136 -3.771 -1.548 -10.828 865 2HD ARG 136 HD1 ARG 136 -5.117 -2.270 -9.972 866 HE ARG 136 HE ARG 136 -5.253 0.579 -9.891 867 1HH1 ARG 136 1HH1 ARG 136 -5.941 -2.179 -12.012 868 2HH1 ARG 136 2HH1 ARG 136 -7.207 -1.409 -12.845 869 1HH2 ARG 136 1HH2 ARG 136 -7.011 1.663 -11.090 870 2HH2 ARG 136 2HH2 ARG 136 -7.852 0.786 -12.283 871 H ASP 137 HN ASP 137 -2.611 -1.618 -5.960 872 HA ASP 137 HA ASP 137 -4.696 -0.402 -4.418 873 1HB ASP 137 HB2 ASP 137 -4.253 -2.911 -4.791 874 2HB ASP 137 HB1 ASP 137 -3.028 -2.754 -3.550 875 H LEU 138 HN LEU 138 -1.331 -1.040 -3.988 876 HA LEU 138 HA LEU 138 -0.988 0.016 -1.415 877 1HB LEU 138 HB2 LEU 138 0.577 -1.490 -2.279 878 2HB LEU 138 HB1 LEU 138 0.757 -0.597 -3.755 879 HG LEU 138 HG LEU 138 2.290 0.931 -2.745 880 1HD1 LEU 138 HD1 LEU 138 1.608 -0.343 -0.097 881 2HD1 LEU 138 HD1 LEU 138 2.844 0.878 -0.432 882 3HD1 LEU 138 HD1 LEU 138 1.135 1.297 -0.620 883 1HD2 LEU 138 HD2 LEU 138 2.658 -1.822 -1.714 884 2HD2 LEU 138 HD2 LEU 138 3.127 -1.231 -3.307 885 3HD2 LEU 138 HD2 LEU 138 3.950 -0.619 -1.855 886 H ASP 139 HN ASP 139 -0.881 1.469 -4.613 887 HA ASP 139 HA ASP 139 0.069 4.017 -3.878 888 1HB ASP 139 HB2 ASP 139 -0.278 3.046 -6.232 889 2HB ASP 139 HB1 ASP 139 -1.969 3.475 -6.042 890 H LYS 140 HN LYS 140 -3.191 2.705 -4.221 891 HA LYS 140 HA LYS 140 -4.780 4.855 -3.442 892 1HB LYS 140 HB2 LYS 140 -5.197 1.913 -2.908 893 2HB LYS 140 HB1 LYS 140 -6.420 3.152 -2.686 894 1HG LYS 140 HG2 LYS 140 -6.486 3.590 -5.038 895 2HG LYS 140 HG1 LYS 140 -5.085 2.554 -5.322 896 1HD LYS 140 HD2 LYS 140 -7.118 1.398 -5.965 897 2HD LYS 140 HD1 LYS 140 -6.415 0.620 -4.556 898 1HE LYS 140 HE2 LYS 140 -8.025 1.789 -3.115 899 2HE LYS 140 HE1 LYS 140 -8.738 2.546 -4.542 900 1HZ LYS 140 HZ2 LYS 140 -9.286 0.311 -5.360 901 2HZ LYS 140 HZ1 LYS 140 -8.650 -0.367 -3.966 902 3HZ LYS 140 HZ3 LYS 140 -10.014 0.614 -3.882 903 H LEU 141 HN LEU 141 -3.212 2.406 -1.436 904 HA LEU 141 HA LEU 141 -4.306 3.193 1.034 905 1HB LEU 141 HB2 LEU 141 -3.207 1.041 0.765 906 2HB LEU 141 HB1 LEU 141 -1.682 1.836 0.437 907 HG LEU 141 HG LEU 141 -1.610 2.673 2.733 908 1HD1 LEU 141 HD1 LEU 141 -4.193 1.159 3.098 909 2HD1 LEU 141 HD1 LEU 141 -3.195 1.815 4.400 910 3HD1 LEU 141 HD1 LEU 141 -3.929 2.904 3.233 911 1HD2 LEU 141 HD2 LEU 141 -2.079 -0.297 2.536 912 2HD2 LEU 141 HD2 LEU 141 -0.560 0.544 2.212 913 3HD2 LEU 141 HD2 LEU 141 -1.230 0.530 3.844 914 H ILE 142 HN ILE 142 -1.388 4.157 -0.632 915 HA ILE 142 HA ILE 142 -0.441 5.858 1.423 916 HB ILE 142 HB ILE 142 0.134 5.962 -1.561 917 1HG1 ILE 142 2HG1 ILE 142 1.677 4.676 0.692 918 2HG1 ILE 142 1HG1 ILE 142 0.717 3.810 -0.503 919 1HG2 ILE 142 3HG2 ILE 142 1.619 7.199 0.764 920 2HG2 ILE 142 2HG2 ILE 142 2.173 7.187 -0.911 921 3HG2 ILE 142 1HG2 ILE 142 0.705 8.063 -0.475 922 1HD1 ILE 142 HD1 ILE 142 2.210 4.639 -2.251 923 2HD1 ILE 142 HD1 ILE 142 3.187 5.440 -1.019 924 3HD1 ILE 142 HD1 ILE 142 3.067 3.681 -1.040 925 H ASN 143 HN ASN 143 -2.201 6.477 -1.540 926 HA ASN 143 HA ASN 143 -2.676 9.212 -1.362 927 1HB ASN 143 HB2 ASN 143 -4.570 7.116 -2.450 928 2HB ASN 143 HB1 ASN 143 -4.688 8.850 -2.732 929 1HD2 ASN 143 HD2 ASN 143 -4.306 6.562 -4.565 930 2HD2 ASN 143 HD2 ASN 143 -2.843 6.875 -5.415 931 H LYS 144 HN LYS 144 -4.358 6.604 0.223 932 HA LYS 144 HA LYS 144 -6.537 7.983 1.324 933 1HB LYS 144 HB2 LYS 144 -6.273 5.537 1.366 934 2HB LYS 144 HB1 LYS 144 -4.933 5.696 2.487 935 1HG LYS 144 HG2 LYS 144 -6.572 6.794 4.081 936 2HG LYS 144 HG1 LYS 144 -7.846 6.263 2.980 937 1HD LYS 144 HD2 LYS 144 -5.856 4.486 4.401 938 2HD LYS 144 HD1 LYS 144 -7.555 4.667 4.814 939 1HE LYS 144 HE2 LYS 144 -8.165 3.755 2.620 940 2HE LYS 144 HE1 LYS 144 -6.458 3.557 2.230 941 1HZ LYS 144 HZ3 LYS 144 -6.306 2.038 4.189 942 2HZ LYS 144 HZ2 LYS 144 -7.957 2.181 4.385 943 3HZ LYS 144 HZ1 LYS 144 -7.347 1.479 2.989 944 H PHE 145 HN PHE 145 -3.320 7.310 2.632 945 HA PHE 145 HA PHE 145 -3.799 8.805 4.986 946 1HB PHE 145 HB2 PHE 145 -1.429 7.304 3.963 947 2HB PHE 145 HB1 PHE 145 -1.307 8.342 5.384 948 HD1 PHE 145 HD1 PHE 145 -2.208 7.734 7.420 949 HD2 PHE 145 HD2 PHE 145 -3.002 5.352 4.006 950 HE1 PHE 145 HE1 PHE 145 -3.165 5.984 8.870 951 HE2 PHE 145 HE2 PHE 145 -3.951 3.595 5.437 952 HZ PHE 145 HZ PHE 145 -4.037 3.908 7.870 953 H MET 146 HN MET 146 -2.304 9.472 1.952 954 HA MET 146 HA MET 146 -1.026 11.949 2.757 955 1HB MET 146 HB2 MET 146 -1.946 11.196 -0.015 956 2HB MET 146 HB1 MET 146 -0.737 12.400 0.400 957 1HG MET 146 HG2 MET 146 0.613 10.373 1.306 958 2HG MET 146 HG1 MET 146 -0.591 9.431 0.473 959 1HE MET 146 HE3 MET 146 1.026 12.867 -0.544 960 2HE MET 146 HE2 MET 146 2.345 11.890 0.105 961 3HE MET 146 HE1 MET 146 2.317 12.304 -1.608 962 H ASN 147 HN ASN 147 -4.080 10.855 2.039 963 HA ASN 147 HA ASN 147 -6.110 11.626 1.755 964 1HB ASN 147 HB2 ASN 147 -5.681 12.925 3.851 965 2HB ASN 147 HB1 ASN 147 -5.170 14.290 2.858 966 1HD2 ASN 147 HD2 ASN 147 -6.820 15.632 3.556 967 2HD2 ASN 147 HD2 ASN 147 -8.471 15.394 3.134 968 H VAL 148 HN VAL 148 -5.252 11.325 -0.433 969 HA VAL 148 HA VAL 148 -5.613 13.791 -1.994 970 HB VAL 148 HB VAL 148 -4.678 11.095 -2.921 971 1HG1 VAL 148 3HG1 VAL 148 -5.696 12.421 -4.701 972 2HG1 VAL 148 2HG1 VAL 148 -4.633 13.778 -4.323 973 3HG1 VAL 148 1HG1 VAL 148 -3.959 12.290 -4.976 974 1HG2 VAL 148 1HG2 VAL 148 -3.039 12.031 -1.419 975 2HG2 VAL 148 3HG2 VAL 148 -2.412 12.053 -3.070 976 3HG2 VAL 148 2HG2 VAL 148 -3.029 13.540 -2.338 977 H LYS 149 HN LYS 149 -7.564 14.050 -2.053 978 HA LYS 149 HA LYS 149 -9.275 11.855 -2.943 979 1HB LYS 149 HB2 LYS 149 -10.032 14.401 -1.519 980 2HB LYS 149 HB1 LYS 149 -11.162 13.190 -2.090 981 1HG LYS 149 HG2 LYS 149 -9.052 12.756 0.023 982 2HG LYS 149 HG1 LYS 149 -10.766 13.039 0.339 983 1HD LYS 149 HD2 LYS 149 -11.228 10.959 -1.020 984 2HD LYS 149 HD1 LYS 149 -9.491 10.670 -1.031 985 1HE LYS 149 HE2 LYS 149 -11.244 10.871 1.426 986 2HE LYS 149 HE1 LYS 149 -10.591 9.389 0.742 987 1HZ LYS 149 HZ2 LYS 149 -8.982 11.614 1.913 988 2HZ LYS 149 HZ1 LYS 149 -9.324 10.147 2.642 989 3HZ LYS 149 HZ3 LYS 149 -8.354 10.173 1.267 990 H ASP 150 HN ASP 150 -7.736 14.440 -3.943 991 HA ASP 150 HA ASP 150 -9.662 15.042 -6.069 992 1HB ASP 150 HB2 ASP 150 -9.618 16.971 -4.724 993 2HB ASP 150 HB1 ASP 150 -7.870 16.932 -4.578 994 H LYS 151 HN LYS 151 -8.995 14.042 -7.745 995 HA LYS 151 HA LYS 151 -6.486 14.879 -8.917 996 1HB LYS 151 HB2 LYS 151 -5.900 12.610 -9.585 997 2HB LYS 151 HB1 LYS 151 -6.085 12.719 -7.835 998 1HG LYS 151 HG2 LYS 151 -8.208 11.617 -7.922 999 2HG LYS 151 HG1 LYS 151 -8.185 11.618 -9.689 1000 1HD LYS 151 HD2 LYS 151 -6.149 10.252 -9.640 1001 2HD LYS 151 HD1 LYS 151 -6.229 10.212 -7.884 1002 1HE LYS 151 HE2 LYS 151 -8.376 9.054 -7.998 1003 2HE LYS 151 HE1 LYS 151 -8.333 9.130 -9.760 1004 1HZ LYS 151 HZ1 LYS 151 -6.315 7.800 -9.711 1005 2HZ LYS 151 HZ3 LYS 151 -6.394 7.680 -8.035 1006 3HZ LYS 151 HZ2 LYS 151 -7.591 6.983 -9.008 1007 H VAL 152 HN VAL 152 -9.356 15.423 -9.132 1008 HA VAL 152 HA VAL 152 -10.000 14.263 -11.746 1009 HB VAL 152 HB VAL 152 -12.359 14.934 -11.293 1010 1HG1 VAL 152 2HG1 VAL 152 -11.112 13.147 -9.208 1011 2HG1 VAL 152 1HG1 VAL 152 -12.825 13.193 -9.623 1012 3HG1 VAL 152 3HG1 VAL 152 -11.642 12.661 -10.816 1013 1HG2 VAL 152 2HG2 VAL 152 -11.313 15.614 -8.540 1014 2HG2 VAL 152 1HG2 VAL 152 -11.948 16.761 -9.718 1015 3HG2 VAL 152 3HG2 VAL 152 -13.015 15.553 -8.998 1016 H HIS 153 HN HIS 153 -11.435 15.779 -13.055 1017 HA HIS 153 HA HIS 153 -9.947 17.948 -13.892 1018 1HB HIS 153 HB2 HIS 153 -11.877 18.607 -15.290 1019 2HB HIS 153 HB1 HIS 153 -11.569 16.884 -15.373 1020 HD1 HIS 153 HD1 HIS 153 -14.250 19.314 -14.697 1021 HD2 HIS 153 HD2 HIS 153 -13.496 15.308 -13.876 1022 HE1 HIS 153 HE1 HIS 153 -16.453 18.311 -14.001 1023 H LYS 154 HN LYS 154 -12.624 17.935 -11.777 1024 HA LYS 154 HA LYS 154 -11.925 20.486 -10.615 1025 1HB LYS 154 HB2 LYS 154 -13.107 21.165 -12.668 1026 2HB LYS 154 HB1 LYS 154 -14.471 20.170 -12.200 1027 1HG LYS 154 HG2 LYS 154 -14.748 21.621 -10.184 1028 2HG LYS 154 HG1 LYS 154 -13.471 22.659 -10.818 1029 1HD LYS 154 HD2 LYS 154 -15.619 23.593 -11.408 1030 2HD LYS 154 HD1 LYS 154 -14.828 23.000 -12.867 1031 1HE LYS 154 HE2 LYS 154 -16.188 20.949 -12.771 1032 2HE LYS 154 HE1 LYS 154 -16.975 21.546 -11.309 1033 1HZ LYS 154 HZ1 LYS 154 -17.852 23.391 -12.621 1034 2HZ LYS 154 HZ3 LYS 154 -17.101 22.792 -14.001 1035 3HZ LYS 154 HZ2 LYS 154 -18.321 21.923 -13.257 1036 H LEU 155 HN LEU 155 -12.657 20.456 -8.527 1037 HA LEU 155 HA LEU 155 -14.444 18.357 -7.687 1038 1HB LEU 155 HB2 LEU 155 -13.259 20.683 -6.144 1039 2HB LEU 155 HB1 LEU 155 -14.191 19.384 -5.443 1040 HG LEU 155 HG LEU 155 -11.516 19.031 -6.788 1041 1HD1 LEU 155 HD1 LEU 155 -12.257 19.148 -3.868 1042 2HD1 LEU 155 HD1 LEU 155 -10.668 18.730 -4.509 1043 3HD1 LEU 155 HD1 LEU 155 -11.322 20.347 -4.756 1044 1HD2 LEU 155 HD2 LEU 155 -13.203 17.143 -5.133 1045 2HD2 LEU 155 HD2 LEU 155 -12.924 17.031 -6.871 1046 3HD2 LEU 155 HD2 LEU 155 -11.585 16.810 -5.753 1047 H GLU 156 HN GLU 156 -16.556 18.573 -7.700 1048 HA GLU 156 HA GLU 156 -17.747 20.954 -8.697 1049 1HB GLU 156 HB2 GLU 156 -18.431 18.210 -8.555 1050 2HB GLU 156 HB1 GLU 156 -19.722 19.110 -7.781 1051 1HG GLU 156 HG2 GLU 156 -18.662 19.636 -10.552 1052 2HG GLU 156 HG1 GLU 156 -20.116 18.716 -10.180 1053 H HIS 157 HN HIS 157 -17.261 22.426 -7.060 1054 HA HIS 157 HA HIS 157 -19.114 22.264 -4.792 1055 1HB HIS 157 HB2 HIS 157 -16.435 23.685 -4.897 1056 2HB HIS 157 HB1 HIS 157 -17.593 23.851 -3.584 1057 HD1 HIS 157 HD1 HIS 157 -18.048 21.552 -2.167 1058 HD2 HIS 157 HD2 HIS 157 -14.769 21.559 -4.719 1059 HE1 HIS 157 HE1 HIS 157 -16.612 19.616 -1.462 1060 H HIS 158 HN HIS 158 -19.739 24.479 -3.958 1061 HA HIS 158 HA HIS 158 -20.911 26.359 -4.201 1062 1HB HIS 158 HB2 HIS 158 -18.824 27.222 -5.471 1063 2HB HIS 158 HB1 HIS 158 -19.679 26.813 -6.955 1064 HD1 HIS 158 HD1 HIS 158 -21.697 28.385 -7.620 1065 HD2 HIS 158 HD2 HIS 158 -19.739 29.480 -4.127 1066 HE1 HIS 158 HE1 HIS 158 -22.512 30.695 -7.062 1067 H HIS 159 HN HIS 159 -21.753 23.831 -4.972 1068 HA HIS 159 HA HIS 159 -23.611 24.218 -7.181 1069 1HB HIS 159 HB2 HIS 159 -24.271 21.830 -6.695 1070 2HB HIS 159 HB1 HIS 159 -22.577 22.026 -7.114 1071 HD1 HIS 159 HD1 HIS 159 -20.954 20.828 -5.528 1072 HD2 HIS 159 HD2 HIS 159 -24.671 21.560 -3.789 1073 HE1 HIS 159 HE1 HIS 159 -20.876 19.808 -3.277 1074 H HIS 160 HN HIS 160 -23.445 24.647 -3.901 1075 HA HIS 160 HA HIS 160 -26.284 24.380 -3.343 1076 1HB HIS 160 HB2 HIS 160 -24.607 23.618 -1.685 1077 2HB HIS 160 HB1 HIS 160 -23.939 25.239 -1.620 1078 HD1 HIS 160 HD1 HIS 160 -26.876 23.199 -0.442 1079 HD2 HIS 160 HD2 HIS 160 -25.338 27.031 -0.004 1080 HE1 HIS 160 HE1 HIS 160 -28.106 24.218 1.464 1081 H HIS 161 HN HIS 161 -27.638 26.118 -3.221 1082 HA HIS 161 HA HIS 161 -26.428 28.773 -3.484 1083 1HB HIS 161 HB2 HIS 161 -27.702 28.195 -5.527 1084 2HB HIS 161 HB1 HIS 161 -29.119 27.835 -4.547 1085 HD1 HIS 161 HD1 HIS 161 -27.096 30.748 -5.857 1086 HD2 HIS 161 HD2 HIS 161 -30.616 30.033 -3.766 1087 HE1 HIS 161 HE1 HIS 161 -28.320 32.955 -5.753 1088 H HIS 162 HN HIS 162 -26.611 29.813 -1.673 1089 HA HIS 162 HA HIS 162 -28.615 28.994 0.247 1090 1HB HIS 162 HB2 HIS 162 -26.263 29.134 0.962 1091 2HB HIS 162 HB1 HIS 162 -26.214 30.826 0.494 1092 HD1 HIS 162 HD1 HIS 162 -26.414 32.330 2.457 1093 HD2 HIS 162 HD2 HIS 162 -28.410 28.739 3.046 1094 HE1 HIS 162 HE1 HIS 162 -27.285 32.397 4.818 No H/Q in entry = 1094 Start of MODEL 31 1 H1 MET 1 HT2 MET 1 19.375 -14.704 -3.147 2 H2 MET 1 HT1 MET 1 19.266 -14.807 -4.817 3 H3 MET 1 HT3 MET 1 17.864 -14.710 -3.898 4 HA MET 1 HA MET 1 18.139 -16.898 -4.686 5 1HB MET 1 HB2 MET 1 20.577 -16.841 -5.003 6 2HB MET 1 HB1 MET 1 20.823 -16.784 -3.269 7 1HG MET 1 HG2 MET 1 19.467 -19.118 -4.592 8 2HG MET 1 HG1 MET 1 21.218 -18.988 -4.509 9 1HE MET 1 HE3 MET 1 21.211 -21.394 -3.307 10 2HE MET 1 HE2 MET 1 20.300 -21.745 -1.841 11 3HE MET 1 HE1 MET 1 19.449 -21.434 -3.353 12 H GLU 2 HN GLU 2 18.787 -15.470 -1.519 13 HA GLU 2 HA GLU 2 17.560 -17.763 -0.210 14 1HB GLU 2 HB2 GLU 2 19.808 -16.687 0.451 15 2HB GLU 2 HB1 GLU 2 18.870 -15.331 1.030 16 1HG GLU 2 HG2 GLU 2 18.563 -18.147 2.055 17 2HG GLU 2 HG1 GLU 2 19.640 -16.958 2.764 18 H MET 3 HN MET 3 15.442 -17.631 0.258 19 HA MET 3 HA MET 3 13.931 -15.365 -0.525 20 1HB MET 3 HB2 MET 3 11.924 -16.563 0.241 21 2HB MET 3 HB1 MET 3 12.952 -17.556 -0.777 22 1HG MET 3 HG2 MET 3 13.761 -18.762 1.152 23 2HG MET 3 HG1 MET 3 12.860 -17.705 2.237 24 1HE MET 3 HE3 MET 3 12.608 -20.441 -0.585 25 2HE MET 3 HE2 MET 3 10.868 -20.687 -0.698 26 3HE MET 3 HE1 MET 3 11.577 -19.162 -1.226 27 H GLY 4 HN GLY 4 15.126 -16.301 2.627 28 1HA GLY 4 HA1 GLY 4 14.811 -15.370 4.686 29 2HA GLY 4 HA2 GLY 4 13.265 -14.763 4.116 30 H GLN 5 HN GLN 5 16.525 -14.143 2.924 31 HA GLN 5 HA GLN 5 16.609 -11.524 3.981 32 1HB GLN 5 HB2 GLN 5 18.243 -12.730 1.758 33 2HB GLN 5 HB1 GLN 5 18.530 -11.136 2.440 34 1HG GLN 5 HG2 GLN 5 18.801 -12.210 4.661 35 2HG GLN 5 HG1 GLN 5 18.698 -13.769 3.850 36 1HE2 GLN 5 1HE2 GLN 5 20.388 -14.449 2.571 37 2HE2 GLN 5 2HE2 GLN 5 21.929 -13.675 2.614 38 H LEU 6 HN LEU 6 15.390 -12.820 1.035 39 HA LEU 6 HA LEU 6 14.989 -10.406 -0.355 40 1HB LEU 6 HB2 LEU 6 14.794 -12.587 -1.449 41 2HB LEU 6 HB1 LEU 6 13.477 -13.036 -0.399 42 HG LEU 6 HG LEU 6 12.910 -12.512 -2.826 43 1HD1 LEU 6 HD1 LEU 6 11.434 -11.004 -0.691 44 2HD1 LEU 6 HD1 LEU 6 10.821 -11.365 -2.309 45 3HD1 LEU 6 HD1 LEU 6 11.168 -12.669 -1.174 46 1HD2 LEU 6 HD2 LEU 6 13.359 -9.681 -1.890 47 2HD2 LEU 6 HD2 LEU 6 14.305 -10.531 -3.111 48 3HD2 LEU 6 HD2 LEU 6 12.609 -10.149 -3.415 49 H LYS 7 HN LYS 7 12.945 -12.222 1.879 50 HA LYS 7 HA LYS 7 10.794 -10.395 1.982 51 1HB LYS 7 HB2 LYS 7 11.466 -12.873 3.237 52 2HB LYS 7 HB1 LYS 7 11.306 -11.624 4.467 53 1HG LYS 7 HG2 LYS 7 9.122 -12.056 2.530 54 2HG LYS 7 HG1 LYS 7 9.275 -13.052 3.961 55 1HD LYS 7 HD2 LYS 7 7.814 -11.317 4.693 56 2HD LYS 7 HD1 LYS 7 9.423 -10.750 5.186 57 1HE LYS 7 HE2 LYS 7 9.571 -9.224 3.608 58 2HE LYS 7 HE1 LYS 7 8.442 -10.040 2.542 59 1HZ LYS 7 HZ2 LYS 7 6.674 -9.319 4.294 60 2HZ LYS 7 HZ1 LYS 7 7.844 -8.362 4.980 61 3HZ LYS 7 HZ3 LYS 7 7.335 -8.066 3.422 62 H ASN 8 HN ASN 8 13.763 -10.748 3.833 63 HA ASN 8 HA ASN 8 13.353 -8.802 5.810 64 1HB ASN 8 HB2 ASN 8 15.212 -10.519 5.769 65 2HB ASN 8 HB1 ASN 8 16.004 -9.525 4.555 66 1HD2 ASN 8 HD2 ASN 8 17.784 -9.192 5.859 67 2HD2 ASN 8 HD2 ASN 8 17.746 -8.135 7.213 68 H LYS 9 HN LYS 9 14.761 -8.535 2.570 69 HA LYS 9 HA LYS 9 15.319 -5.769 2.769 70 1HB LYS 9 HB2 LYS 9 14.958 -7.537 0.350 71 2HB LYS 9 HB1 LYS 9 15.440 -5.848 0.258 72 1HG LYS 9 HG2 LYS 9 17.422 -6.337 1.587 73 2HG LYS 9 HG1 LYS 9 16.938 -8.027 1.684 74 1HD LYS 9 HD2 LYS 9 17.134 -8.239 -0.730 75 2HD LYS 9 HD1 LYS 9 17.564 -6.530 -0.856 76 1HE LYS 9 HE2 LYS 9 19.532 -6.930 0.545 77 2HE LYS 9 HE1 LYS 9 19.080 -8.631 0.651 78 1HZ LYS 9 HZ3 LYS 9 19.733 -7.237 -1.882 79 2HZ LYS 9 HZ2 LYS 9 20.825 -8.159 -1.001 80 3HZ LYS 9 HZ1 LYS 9 19.467 -8.879 -1.688 81 H ILE 10 HN ILE 10 12.510 -7.551 1.507 82 HA ILE 10 HA ILE 10 10.950 -5.400 0.759 83 HB ILE 10 HB ILE 10 10.183 -8.029 2.048 84 1HG1 ILE 10 2HG1 ILE 10 9.870 -7.019 -0.722 85 2HG1 ILE 10 1HG1 ILE 10 11.261 -7.999 -0.210 86 1HG2 ILE 10 2HG2 ILE 10 8.387 -6.415 2.502 87 2HG2 ILE 10 1HG2 ILE 10 8.326 -6.003 0.791 88 3HG2 ILE 10 3HG2 ILE 10 7.870 -7.622 1.320 89 1HD1 ILE 10 HD1 ILE 10 8.362 -8.792 -0.304 90 2HD1 ILE 10 HD1 ILE 10 9.639 -9.322 -1.404 91 3HD1 ILE 10 HD1 ILE 10 9.671 -9.807 0.288 92 H GLU 11 HN GLU 11 11.341 -6.841 3.959 93 HA GLU 11 HA GLU 11 9.643 -5.184 5.443 94 1HB GLU 11 HB2 GLU 11 12.275 -6.437 6.239 95 2HB GLU 11 HB1 GLU 11 11.105 -5.758 7.362 96 1HG GLU 11 HG2 GLU 11 10.597 -8.077 5.517 97 2HG GLU 11 HG1 GLU 11 11.006 -8.204 7.226 98 H ASN 12 HN ASN 12 13.079 -4.895 4.812 99 HA ASN 12 HA ASN 12 13.578 -2.476 6.090 100 1HB ASN 12 HB2 ASN 12 15.287 -4.077 5.231 101 2HB ASN 12 HB1 ASN 12 14.918 -3.536 3.602 102 1HD2 ASN 12 HD2 ASN 12 15.600 -1.454 2.954 103 2HD2 ASN 12 HD2 ASN 12 16.781 -0.596 3.852 104 H LYS 13 HN LYS 13 12.656 -3.120 2.747 105 HA LYS 13 HA LYS 13 12.848 -0.461 1.816 106 1HB LYS 13 HB2 LYS 13 12.914 -2.595 0.429 107 2HB LYS 13 HB1 LYS 13 11.184 -2.692 0.641 108 1HG LYS 13 HG2 LYS 13 11.739 -1.707 -1.550 109 2HG LYS 13 HG1 LYS 13 10.890 -0.571 -0.499 110 1HD LYS 13 HD2 LYS 13 12.727 0.481 -1.675 111 2HD LYS 13 HD1 LYS 13 12.966 0.519 0.063 112 1HE LYS 13 HE2 LYS 13 14.478 -1.388 -0.134 113 2HE LYS 13 HE1 LYS 13 14.276 -1.365 -1.897 114 1HZ LYS 13 HZ3 LYS 13 15.145 0.949 -1.826 115 2HZ LYS 13 HZ2 LYS 13 15.432 0.711 -0.149 116 3HZ LYS 13 HZ1 LYS 13 16.262 -0.205 -1.273 117 H LYS 14 HN LYS 14 10.120 -2.441 2.859 118 HA LYS 14 HA LYS 14 7.956 -0.792 2.558 119 1HB LYS 14 HB2 LYS 14 7.922 -3.139 3.222 120 2HB LYS 14 HB1 LYS 14 8.698 -2.755 4.734 121 1HG LYS 14 HG2 LYS 14 6.655 -1.476 5.366 122 2HG LYS 14 HG1 LYS 14 5.895 -2.027 3.876 123 1HD LYS 14 HD2 LYS 14 5.180 -3.569 5.540 124 2HD LYS 14 HD1 LYS 14 6.459 -4.402 4.657 125 1HE LYS 14 HE2 LYS 14 8.061 -3.575 6.450 126 2HE LYS 14 HE1 LYS 14 6.597 -3.032 7.282 127 1HZ LYS 14 HZ1 LYS 14 5.851 -5.419 7.326 128 2HZ LYS 14 HZ3 LYS 14 7.340 -5.860 6.649 129 3HZ LYS 14 HZ2 LYS 14 7.268 -5.133 8.153 130 H LYS 15 HN LYS 15 10.181 -1.150 5.291 131 HA LYS 15 HA LYS 15 9.064 0.864 6.917 132 1HB LYS 15 HB2 LYS 15 11.839 -0.322 6.968 133 2HB LYS 15 HB1 LYS 15 11.135 0.663 8.249 134 1HG LYS 15 HG2 LYS 15 9.445 -1.003 8.672 135 2HG LYS 15 HG1 LYS 15 9.991 -1.957 7.300 136 1HD LYS 15 HD2 LYS 15 10.853 -2.986 9.263 137 2HD LYS 15 HD1 LYS 15 12.201 -2.195 8.452 138 1HE LYS 15 HE2 LYS 15 12.332 -1.798 10.834 139 2HE LYS 15 HE1 LYS 15 11.993 -0.288 9.994 140 1HZ LYS 15 HZ2 LYS 15 9.947 -1.975 11.336 141 2HZ LYS 15 HZ1 LYS 15 10.634 -0.592 11.997 142 3HZ LYS 15 HZ3 LYS 15 9.669 -0.486 10.625 143 H GLU 16 HN GLU 16 11.747 0.928 4.596 144 HA GLU 16 HA GLU 16 12.615 3.564 4.950 145 1HB GLU 16 HB2 GLU 16 12.378 1.932 2.405 146 2HB GLU 16 HB1 GLU 16 13.093 3.531 2.450 147 1HG GLU 16 HG2 GLU 16 14.848 2.654 3.934 148 2HG GLU 16 HG1 GLU 16 14.103 1.055 3.835 149 H LEU 17 HN LEU 17 9.972 2.257 3.052 150 HA LEU 17 HA LEU 17 9.184 4.702 1.902 151 1HB LEU 17 HB2 LEU 17 8.650 2.763 0.696 152 2HB LEU 17 HB1 LEU 17 7.958 1.977 2.089 153 HG LEU 17 HG LEU 17 6.340 2.639 0.279 154 1HD1 LEU 17 HD1 LEU 17 5.675 2.006 2.394 155 2HD1 LEU 17 HD1 LEU 17 5.745 3.670 2.952 156 3HD1 LEU 17 HD1 LEU 17 4.594 3.216 1.673 157 1HD2 LEU 17 HD2 LEU 17 6.887 5.405 1.285 158 2HD2 LEU 17 HD2 LEU 17 7.256 4.796 -0.328 159 3HD2 LEU 17 HD2 LEU 17 5.574 4.941 0.193 160 H ILE 18 HN ILE 18 8.049 2.900 4.708 161 HA ILE 18 HA ILE 18 5.833 4.450 5.199 162 HB ILE 18 HB ILE 18 7.594 3.128 7.307 163 1HG1 ILE 18 2HG1 ILE 18 5.016 2.119 6.115 164 2HG1 ILE 18 1HG1 ILE 18 6.586 1.706 5.440 165 1HG2 ILE 18 3HG2 ILE 18 4.733 4.144 7.492 166 2HG2 ILE 18 2HG2 ILE 18 5.519 3.187 8.742 167 3HG2 ILE 18 1HG2 ILE 18 6.112 4.797 8.354 168 1HD1 ILE 18 HD1 ILE 18 5.635 1.075 8.220 169 2HD1 ILE 18 HD1 ILE 18 5.750 -0.049 6.860 170 3HD1 ILE 18 HD1 ILE 18 7.209 0.664 7.538 171 H GLN 19 HN GLN 19 9.194 4.867 6.111 172 HA GLN 19 HA GLN 19 8.908 7.160 7.675 173 1HB GLN 19 HB2 GLN 19 11.255 6.328 5.977 174 2HB GLN 19 HB1 GLN 19 11.282 7.566 7.226 175 1HG GLN 19 HG2 GLN 19 10.637 5.858 8.879 176 2HG GLN 19 HG1 GLN 19 10.746 4.637 7.616 177 1HE2 GLN 19 1HE2 GLN 19 12.177 4.829 10.044 178 2HE2 GLN 19 2HE2 GLN 19 13.866 4.938 9.693 179 H LEU 20 HN LEU 20 9.335 6.799 4.152 180 HA LEU 20 HA LEU 20 9.465 9.580 3.701 181 1HB LEU 20 HB2 LEU 20 8.623 7.433 1.738 182 2HB LEU 20 HB1 LEU 20 8.608 9.141 1.368 183 HG LEU 20 HG LEU 20 10.508 8.659 0.416 184 1HD1 LEU 20 HD1 LEU 20 11.170 10.248 1.952 185 2HD1 LEU 20 HD1 LEU 20 11.559 9.021 3.162 186 3HD1 LEU 20 HD1 LEU 20 12.495 9.119 1.668 187 1HD2 LEU 20 HD2 LEU 20 10.972 6.363 2.299 188 2HD2 LEU 20 HD2 LEU 20 10.518 6.343 0.579 189 3HD2 LEU 20 HD2 LEU 20 12.110 6.884 1.045 190 H VAL 21 HN VAL 21 6.493 7.405 3.502 191 HA VAL 21 HA VAL 21 4.907 9.632 3.045 192 HB VAL 21 HB VAL 21 3.074 8.293 3.382 193 1HG1 VAL 21 1HG1 VAL 21 5.237 6.521 2.442 194 2HG1 VAL 21 3HG1 VAL 21 3.516 6.201 2.230 195 3HG1 VAL 21 2HG1 VAL 21 4.247 7.631 1.467 196 1HG2 VAL 21 3HG2 VAL 21 4.716 6.396 5.008 197 2HG2 VAL 21 2HG2 VAL 21 3.430 7.497 5.542 198 3HG2 VAL 21 1HG2 VAL 21 3.034 6.132 4.490 199 H ALA 22 HN ALA 22 6.146 8.303 6.040 200 HA ALA 22 HA ALA 22 4.334 9.565 7.768 201 1HB ALA 22 HB3 ALA 22 7.153 8.738 8.357 202 2HB ALA 22 HB2 ALA 22 5.829 8.966 9.531 203 3HB ALA 22 HB1 ALA 22 5.748 7.670 8.327 204 H ARG 23 HN ARG 23 7.394 10.589 6.408 205 HA ARG 23 HA ARG 23 7.441 12.980 7.961 206 1HB ARG 23 HB2 ARG 23 9.348 13.661 6.573 207 2HB ARG 23 HB1 ARG 23 9.542 12.043 7.223 208 1HG ARG 23 HG2 ARG 23 8.799 11.141 5.050 209 2HG ARG 23 HG1 ARG 23 8.779 12.788 4.423 210 1HD ARG 23 HD2 ARG 23 11.187 11.465 5.636 211 2HD ARG 23 HD1 ARG 23 10.844 11.488 3.911 212 HE ARG 23 HE ARG 23 10.805 14.046 4.352 213 1HH1 ARG 23 1HH1 ARG 23 12.935 11.849 6.106 214 2HH1 ARG 23 2HH1 ARG 23 14.350 12.766 5.893 215 1HH2 ARG 23 1HH2 ARG 23 12.766 15.383 4.076 216 2HH2 ARG 23 2HH2 ARG 23 14.245 14.816 4.677 217 H HIS 24 HN HIS 24 5.864 12.049 5.100 218 HA HIS 24 HA HIS 24 5.515 14.478 3.776 219 1HB HIS 24 HB2 HIS 24 4.718 12.462 2.757 220 2HB HIS 24 HB1 HIS 24 3.593 12.119 4.053 221 HD1 HIS 24 HD1 HIS 24 1.307 13.672 4.018 222 HD2 HIS 24 HD2 HIS 24 3.920 14.199 0.830 223 HE1 HIS 24 HE1 HIS 24 0.058 14.968 2.294 224 H GLY 25 HN GLY 25 3.714 13.107 6.467 225 1HA GLY 25 HA1 GLY 25 2.028 15.474 6.564 226 2HA GLY 25 HA2 GLY 25 3.161 15.286 7.898 227 H LEU 26 HN LEU 26 2.384 12.183 7.109 228 HA LEU 26 HA LEU 26 -0.046 11.749 8.180 229 1HB LEU 26 HB2 LEU 26 2.461 10.225 7.979 230 2HB LEU 26 HB1 LEU 26 1.197 9.596 9.015 231 HG LEU 26 HG LEU 26 -0.326 9.715 7.104 232 1HD1 LEU 26 HD1 LEU 26 0.698 11.318 5.736 233 2HD1 LEU 26 HD1 LEU 26 2.099 10.257 5.460 234 3HD1 LEU 26 HD1 LEU 26 0.484 9.787 4.881 235 1HD2 LEU 26 HD2 LEU 26 2.093 8.003 6.941 236 2HD2 LEU 26 HD2 LEU 26 0.545 7.629 7.714 237 3HD2 LEU 26 HD2 LEU 26 0.671 7.736 5.941 238 H ASP 27 HN ASP 27 -0.845 11.480 10.053 239 HA ASP 27 HA ASP 27 0.329 12.709 12.355 240 1HB ASP 27 HB2 ASP 27 -2.124 10.922 12.276 241 2HB ASP 27 HB1 ASP 27 -1.726 12.124 13.483 242 H HIS 28 HN HIS 28 0.238 11.351 14.470 243 HA HIS 28 HA HIS 28 2.241 9.375 14.302 244 1HB HIS 28 HB2 HIS 28 0.279 9.807 16.582 245 2HB HIS 28 HB1 HIS 28 1.824 8.987 16.692 246 HD1 HIS 28 HD1 HIS 28 0.313 12.153 17.424 247 HD2 HIS 28 HD2 HIS 28 4.018 10.908 16.012 248 HE1 HIS 28 HE1 HIS 28 1.889 14.049 17.861 249 H ASP 29 HN ASP 29 -1.235 9.117 14.845 250 HA ASP 29 HA ASP 29 -1.415 6.311 15.049 251 1HB ASP 29 HB2 ASP 29 -3.804 6.580 14.736 252 2HB ASP 29 HB1 ASP 29 -3.214 7.874 15.777 253 H LYS 30 HN LYS 30 -1.435 8.482 12.405 254 HA LYS 30 HA LYS 30 -2.399 6.741 10.405 255 1HB LYS 30 HB2 LYS 30 -0.677 9.186 10.193 256 2HB LYS 30 HB1 LYS 30 -1.308 8.347 8.794 257 1HG LYS 30 HG2 LYS 30 -2.930 9.624 10.984 258 2HG LYS 30 HG1 LYS 30 -2.648 10.306 9.381 259 1HD LYS 30 HD2 LYS 30 -3.831 8.445 8.372 260 2HD LYS 30 HD1 LYS 30 -4.057 7.698 9.958 261 1HE LYS 30 HE2 LYS 30 -5.141 10.350 9.065 262 2HE LYS 30 HE1 LYS 30 -6.069 8.866 9.274 263 1HZ LYS 30 HZ2 LYS 30 -5.323 8.933 11.678 264 2HZ LYS 30 HZ1 LYS 30 -4.724 10.452 11.393 265 3HZ LYS 30 HZ3 LYS 30 -6.375 10.180 11.212 266 H VAL 31 HN VAL 31 0.880 7.514 11.439 267 HA VAL 31 HA VAL 31 2.189 5.986 9.495 268 HB VAL 31 HB VAL 31 3.141 6.516 12.333 269 1HG1 VAL 31 1HG1 VAL 31 4.445 4.817 11.215 270 2HG1 VAL 31 3HG1 VAL 31 4.711 5.908 9.852 271 3HG1 VAL 31 2HG1 VAL 31 5.376 6.300 11.439 272 1HG2 VAL 31 2HG2 VAL 31 2.490 8.593 11.207 273 2HG2 VAL 31 1HG2 VAL 31 4.243 8.503 11.435 274 3HG2 VAL 31 3HG2 VAL 31 3.533 8.181 9.852 275 H LEU 32 HN LEU 32 0.878 5.177 12.660 276 HA LEU 32 HA LEU 32 1.857 2.509 12.796 277 1HB LEU 32 HB2 LEU 32 -0.654 3.613 14.028 278 2HB LEU 32 HB1 LEU 32 0.175 2.148 14.488 279 HG LEU 32 HG LEU 32 1.132 4.964 14.863 280 1HD1 LEU 32 HD1 LEU 32 0.300 2.812 16.776 281 2HD1 LEU 32 HD1 LEU 32 0.994 4.364 17.247 282 3HD1 LEU 32 HD1 LEU 32 -0.569 4.301 16.421 283 1HD2 LEU 32 HD2 LEU 32 2.523 2.362 15.485 284 2HD2 LEU 32 HD2 LEU 32 3.034 3.570 14.309 285 3HD2 LEU 32 HD2 LEU 32 3.065 3.950 16.031 286 H LEU 33 HN LEU 33 -1.314 3.806 11.910 287 HA LEU 33 HA LEU 33 -2.467 1.337 11.243 288 1HB LEU 33 HB2 LEU 33 -3.156 4.076 10.211 289 2HB LEU 33 HB1 LEU 33 -4.174 2.657 10.065 290 HG LEU 33 HG LEU 33 -3.382 3.993 12.648 291 1HD1 LEU 33 HD1 LEU 33 -5.994 3.954 11.161 292 2HD1 LEU 33 HD1 LEU 33 -5.721 4.650 12.760 293 3HD1 LEU 33 HD1 LEU 33 -4.917 5.338 11.352 294 1HD2 LEU 33 HD2 LEU 33 -5.243 1.676 12.109 295 2HD2 LEU 33 HD2 LEU 33 -3.695 1.601 12.959 296 3HD2 LEU 33 HD2 LEU 33 -5.042 2.493 13.658 297 H PHE 34 HN PHE 34 -0.754 3.704 9.274 298 HA PHE 34 HA PHE 34 -1.185 2.436 6.831 299 1HB PHE 34 HB2 PHE 34 -0.378 4.728 6.924 300 2HB PHE 34 HB1 PHE 34 1.106 4.201 7.712 301 HD1 PHE 34 HD1 PHE 34 -0.854 3.841 4.582 302 HD2 PHE 34 HD2 PHE 34 2.958 3.621 6.449 303 HE1 PHE 34 HE1 PHE 34 0.204 3.505 2.390 304 HE2 PHE 34 HE2 PHE 34 4.011 3.289 4.260 305 HZ PHE 34 HZ PHE 34 2.658 3.223 2.253 306 H SER 35 HN SER 35 1.557 2.165 9.124 307 HA SER 35 HA SER 35 2.983 0.344 7.576 308 1HB SER 35 HB2 SER 35 4.239 -0.191 9.651 309 2HB SER 35 HB1 SER 35 4.018 1.538 9.435 310 HG SER 35 HG SER 35 2.008 0.998 10.884 311 H ARG 36 HN ARG 36 0.421 -0.175 9.878 312 HA ARG 36 HA ARG 36 0.591 -2.989 10.089 313 1HB ARG 36 HB2 ARG 36 -1.702 -1.068 10.520 314 2HB ARG 36 HB1 ARG 36 -1.757 -2.774 10.949 315 1HG ARG 36 HG2 ARG 36 -0.051 -2.495 12.579 316 2HG ARG 36 HG1 ARG 36 0.290 -0.876 11.941 317 1HD ARG 36 HD2 ARG 36 -0.968 -0.883 14.115 318 2HD ARG 36 HD1 ARG 36 -1.720 0.008 12.807 319 HE ARG 36 HE ARG 36 -3.066 -2.134 12.501 320 1HH1 ARG 36 1HH1 ARG 36 -1.966 -1.039 15.699 321 2HH1 ARG 36 2HH1 ARG 36 -3.361 -1.617 16.492 322 1HH2 ARG 36 1HH2 ARG 36 -4.941 -2.839 13.589 323 2HH2 ARG 36 2HH2 ARG 36 -5.089 -2.661 15.282 324 H ASP 37 HN ASP 37 -1.450 -0.863 8.134 325 HA ASP 37 HA ASP 37 -2.893 -2.961 6.846 326 1HB ASP 37 HB2 ASP 37 -3.479 -0.486 7.183 327 2HB ASP 37 HB1 ASP 37 -2.500 -0.189 5.762 328 H LEU 38 HN LEU 38 -0.153 -0.954 5.946 329 HA LEU 38 HA LEU 38 0.293 -1.862 3.352 330 1HB LEU 38 HB2 LEU 38 1.436 0.067 4.083 331 2HB LEU 38 HB1 LEU 38 2.081 -0.746 5.486 332 HG LEU 38 HG LEU 38 3.649 -1.978 4.073 333 1HD1 LEU 38 HD1 LEU 38 2.487 -0.401 1.796 334 2HD1 LEU 38 HD1 LEU 38 3.936 -1.425 1.761 335 3HD1 LEU 38 HD1 LEU 38 2.358 -2.153 2.053 336 1HD2 LEU 38 HD2 LEU 38 3.645 0.987 3.605 337 2HD2 LEU 38 HD2 LEU 38 4.329 0.140 4.990 338 3HD2 LEU 38 HD2 LEU 38 5.028 -0.082 3.388 339 H ASP 39 HN ASP 39 1.605 -3.050 6.410 340 HA ASP 39 HA ASP 39 3.218 -5.088 5.331 341 1HB ASP 39 HB2 ASP 39 3.417 -4.243 7.652 342 2HB ASP 39 HB1 ASP 39 1.865 -4.959 8.022 343 H LYS 40 HN LYS 40 -0.154 -5.100 6.511 344 HA LYS 40 HA LYS 40 -0.722 -7.756 6.226 345 1HB LYS 40 HB2 LYS 40 -1.864 -5.963 7.454 346 2HB LYS 40 HB1 LYS 40 -2.452 -5.332 5.932 347 1HG LYS 40 HG2 LYS 40 -3.601 -7.338 5.479 348 2HG LYS 40 HG1 LYS 40 -2.961 -8.039 6.990 349 1HD LYS 40 HD2 LYS 40 -4.134 -6.268 8.267 350 2HD LYS 40 HD1 LYS 40 -4.800 -5.647 6.758 351 1HE LYS 40 HE2 LYS 40 -6.447 -6.998 7.954 352 2HE LYS 40 HE1 LYS 40 -6.006 -7.744 6.422 353 1HZ LYS 40 HZ1 LYS 40 -4.864 -8.533 9.055 354 2HZ LYS 40 HZ3 LYS 40 -6.130 -9.321 8.280 355 3HZ LYS 40 HZ2 LYS 40 -4.611 -9.308 7.578 356 H LEU 41 HN LEU 41 -0.941 -5.026 3.984 357 HA LEU 41 HA LEU 41 -2.241 -6.366 1.870 358 1HB LEU 41 HB2 LEU 41 -2.173 -3.949 1.965 359 2HB LEU 41 HB1 LEU 41 -0.425 -3.953 1.899 360 HG LEU 41 HG LEU 41 -0.512 -4.775 -0.413 361 1HD1 LEU 41 HD1 LEU 41 -2.596 -6.010 -0.321 362 2HD1 LEU 41 HD1 LEU 41 -3.494 -4.502 -0.130 363 3HD1 LEU 41 HD1 LEU 41 -2.619 -4.828 -1.626 364 1HD2 LEU 41 HD2 LEU 41 -0.416 -2.383 0.010 365 2HD2 LEU 41 HD2 LEU 41 -1.365 -2.731 -1.432 366 3HD2 LEU 41 HD2 LEU 41 -2.177 -2.313 0.076 367 H ILE 42 HN ILE 42 1.086 -5.877 2.725 368 HA ILE 42 HA ILE 42 2.192 -7.083 0.403 369 HB ILE 42 HB ILE 42 3.397 -6.617 3.159 370 1HG1 ILE 42 2HG1 ILE 42 3.773 -5.193 0.527 371 2HG1 ILE 42 1HG1 ILE 42 2.836 -4.591 1.888 372 1HG2 ILE 42 1HG2 ILE 42 4.779 -7.536 0.637 373 2HG2 ILE 42 3HG2 ILE 42 5.588 -7.023 2.116 374 3HG2 ILE 42 2HG2 ILE 42 4.577 -8.468 2.127 375 1HD1 ILE 42 HD1 ILE 42 5.805 -5.088 1.860 376 2HD1 ILE 42 HD1 ILE 42 5.014 -3.517 1.729 377 3HD1 ILE 42 HD1 ILE 42 4.872 -4.460 3.215 378 H ASN 43 HN ASN 43 1.753 -8.314 3.662 379 HA ASN 43 HA ASN 43 2.514 -10.961 3.275 380 1HB ASN 43 HB2 ASN 43 0.354 -9.951 5.136 381 2HB ASN 43 HB1 ASN 43 1.072 -11.556 5.197 382 1HD2 ASN 43 HD2 ASN 43 1.015 -9.466 7.197 383 2HD2 ASN 43 HD2 ASN 43 2.634 -9.053 7.576 384 H LYS 44 HN LYS 44 -0.567 -9.443 2.590 385 HA LYS 44 HA LYS 44 -2.150 -11.678 2.037 386 1HB LYS 44 HB2 LYS 44 -2.997 -9.374 2.185 387 2HB LYS 44 HB1 LYS 44 -2.153 -8.959 0.702 388 1HG LYS 44 HG2 LYS 44 -3.574 -10.720 -0.446 389 2HG LYS 44 HG1 LYS 44 -4.526 -10.784 1.035 390 1HD LYS 44 HD2 LYS 44 -4.095 -8.355 -0.722 391 2HD LYS 44 HD1 LYS 44 -5.574 -9.297 -0.587 392 1HE LYS 44 HE2 LYS 44 -5.741 -8.647 1.781 393 2HE LYS 44 HE1 LYS 44 -4.279 -7.682 1.607 394 1HZ LYS 44 HZ3 LYS 44 -5.435 -6.325 -0.054 395 2HZ LYS 44 HZ2 LYS 44 -6.829 -7.204 0.134 396 3HZ LYS 44 HZ1 LYS 44 -6.236 -6.289 1.410 397 H PHE 45 HN PHE 45 -0.115 -9.739 -0.090 398 HA PHE 45 HA PHE 45 -0.622 -11.445 -2.310 399 1HB PHE 45 HB2 PHE 45 1.022 -8.993 -1.915 400 2HB PHE 45 HB1 PHE 45 1.238 -9.954 -3.372 401 HD1 PHE 45 HD1 PHE 45 -0.357 -9.941 -5.089 402 HD2 PHE 45 HD2 PHE 45 -1.223 -7.988 -1.415 403 HE1 PHE 45 HE1 PHE 45 -2.335 -8.912 -6.105 404 HE2 PHE 45 HE2 PHE 45 -3.189 -6.949 -2.430 405 HZ PHE 45 HZ PHE 45 -3.756 -7.416 -4.782 406 H MET 46 HN MET 46 1.904 -11.114 0.026 407 HA MET 46 HA MET 46 3.788 -12.711 -1.397 408 1HB MET 46 HB2 MET 46 3.649 -12.254 1.563 409 2HB MET 46 HB1 MET 46 5.041 -12.876 0.696 410 1HG MET 46 HG2 MET 46 4.735 -10.491 -0.549 411 2HG MET 46 HG1 MET 46 3.961 -10.159 0.967 412 1HE MET 46 HE1 MET 46 7.203 -11.194 -0.751 413 2HE MET 46 HE3 MET 46 8.321 -11.466 0.578 414 3HE MET 46 HE2 MET 46 6.983 -12.589 0.316 415 H ASN 47 HN ASN 47 1.109 -13.271 0.689 416 HA ASN 47 HA ASN 47 -0.067 -15.047 1.357 417 1HB ASN 47 HB2 ASN 47 0.307 -15.890 -0.974 418 2HB ASN 47 HB1 ASN 47 1.767 -16.689 -0.429 419 1HD2 ASN 47 HD2 ASN 47 1.035 -18.658 -1.053 420 2HD2 ASN 47 HD2 ASN 47 -0.244 -19.527 -0.294 421 H VAL 48 HN VAL 48 2.613 -14.190 2.468 422 HA VAL 48 HA VAL 48 3.474 -16.561 3.850 423 HB VAL 48 HB VAL 48 5.198 -15.172 4.960 424 1HG1 VAL 48 3HG1 VAL 48 5.078 -14.859 1.972 425 2HG1 VAL 48 2HG1 VAL 48 6.532 -14.664 2.959 426 3HG1 VAL 48 1HG1 VAL 48 5.721 -16.231 2.872 427 1HG2 VAL 48 2HG2 VAL 48 4.009 -12.904 3.358 428 2HG2 VAL 48 1HG2 VAL 48 4.058 -13.038 5.108 429 3HG2 VAL 48 3HG2 VAL 48 5.561 -12.827 4.204 430 H LYS 49 HN LYS 49 2.617 -17.275 5.484 431 HA LYS 49 HA LYS 49 1.292 -15.504 7.434 432 1HB LYS 49 HB2 LYS 49 0.194 -18.133 6.397 433 2HB LYS 49 HB1 LYS 49 -0.604 -17.039 7.517 434 1HG LYS 49 HG2 LYS 49 -0.814 -15.351 5.762 435 2HG LYS 49 HG1 LYS 49 0.062 -16.387 4.643 436 1HD LYS 49 HD2 LYS 49 -2.632 -16.949 5.876 437 2HD LYS 49 HD1 LYS 49 -2.340 -16.447 4.215 438 1HE LYS 49 HE2 LYS 49 -1.482 -19.046 5.504 439 2HE LYS 49 HE1 LYS 49 -2.757 -18.840 4.323 440 1HZ LYS 49 HZ3 LYS 49 0.139 -18.358 3.809 441 2HZ LYS 49 HZ2 LYS 49 -0.739 -19.708 3.329 442 3HZ LYS 49 HZ1 LYS 49 -1.090 -18.205 2.660 443 H ASP 50 HN ASP 50 3.802 -17.188 7.005 444 HA ASP 50 HA ASP 50 3.697 -18.845 9.423 445 1HB ASP 50 HB2 ASP 50 5.227 -20.399 8.342 446 2HB ASP 50 HB1 ASP 50 3.775 -20.220 7.357 447 H LYS 51 HN LYS 51 5.691 -18.967 10.524 448 HA LYS 51 HA LYS 51 7.552 -16.807 9.912 449 1HB LYS 51 HB2 LYS 51 7.647 -16.352 12.372 450 2HB LYS 51 HB1 LYS 51 6.101 -16.000 11.613 451 1HG LYS 51 HG2 LYS 51 5.188 -18.100 12.492 452 2HG LYS 51 HG1 LYS 51 6.725 -18.419 13.293 453 1HD LYS 51 HD2 LYS 51 6.491 -16.400 14.628 454 2HD LYS 51 HD1 LYS 51 5.009 -15.983 13.771 455 1HE LYS 51 HE2 LYS 51 3.942 -18.012 14.651 456 2HE LYS 51 HE1 LYS 51 5.425 -18.409 15.514 457 1HZ LYS 51 HZ2 LYS 51 3.833 -15.938 15.950 458 2HZ LYS 51 HZ1 LYS 51 3.776 -17.314 16.930 459 3HZ LYS 51 HZ3 LYS 51 5.201 -16.424 16.807 460 H VAL 52 HN VAL 52 7.966 -19.320 9.096 461 HA VAL 52 HA VAL 52 9.451 -20.872 11.037 462 HB VAL 52 HB VAL 52 9.813 -22.506 9.264 463 1HG1 VAL 52 2HG1 VAL 52 6.981 -21.504 9.377 464 2HG1 VAL 52 1HG1 VAL 52 7.475 -23.090 8.779 465 3HG1 VAL 52 3HG1 VAL 52 7.746 -22.660 10.468 466 1HG2 VAL 52 3HG2 VAL 52 10.116 -20.986 7.365 467 2HG2 VAL 52 2HG2 VAL 52 8.886 -22.201 7.012 468 3HG2 VAL 52 1HG2 VAL 52 8.408 -20.555 7.431 469 H HIS 53 HN HIS 53 10.474 -18.195 10.217 470 HA HIS 53 HA HIS 53 12.891 -18.660 8.833 471 1HB HIS 53 HB2 HIS 53 12.045 -16.366 9.021 472 2HB HIS 53 HB1 HIS 53 12.151 -16.440 10.774 473 HD1 HIS 53 HD1 HIS 53 14.537 -16.619 7.802 474 HD2 HIS 53 HD2 HIS 53 14.402 -15.376 11.751 475 HE1 HIS 53 HE1 HIS 53 16.803 -15.605 8.307 476 H LYS 54 HN LYS 54 12.006 -18.534 12.092 477 HA LYS 54 HA LYS 54 14.195 -20.319 12.820 478 1HB LYS 54 HB2 LYS 54 14.779 -18.051 13.688 479 2HB LYS 54 HB1 LYS 54 13.203 -17.945 14.450 480 1HG LYS 54 HG2 LYS 54 14.935 -18.434 16.094 481 2HG LYS 54 HG1 LYS 54 13.792 -19.764 15.970 482 1HD LYS 54 HD2 LYS 54 16.043 -20.644 16.133 483 2HD LYS 54 HD1 LYS 54 15.409 -20.971 14.527 484 1HE LYS 54 HE2 LYS 54 17.721 -20.246 14.392 485 2HE LYS 54 HE1 LYS 54 16.659 -19.058 13.651 486 1HZ LYS 54 HZ2 LYS 54 17.844 -18.852 16.372 487 2HZ LYS 54 HZ1 LYS 54 18.362 -18.032 14.997 488 3HZ LYS 54 HZ3 LYS 54 16.860 -17.686 15.666 489 H LEU 55 HN LEU 55 13.190 -22.144 13.387 490 HA LEU 55 HA LEU 55 10.372 -21.970 13.858 491 1HB LEU 55 HB2 LEU 55 12.113 -24.414 13.611 492 2HB LEU 55 HB1 LEU 55 10.382 -24.442 13.847 493 HG LEU 55 HG LEU 55 10.279 -23.119 11.631 494 1HD1 LEU 55 HD1 LEU 55 12.626 -22.582 11.431 495 2HD1 LEU 55 HD1 LEU 55 13.034 -24.297 11.374 496 3HD1 LEU 55 HD1 LEU 55 12.092 -23.571 10.070 497 1HD2 LEU 55 HD2 LEU 55 11.102 -26.007 11.702 498 2HD2 LEU 55 HD2 LEU 55 9.474 -25.361 11.922 499 3HD2 LEU 55 HD2 LEU 55 10.283 -25.201 10.358 500 H GLU 56 HN GLU 56 10.181 -21.088 15.780 501 HA GLU 56 HA GLU 56 11.226 -22.353 18.160 502 1HB GLU 56 HB2 GLU 56 10.356 -19.872 17.798 503 2HB GLU 56 HB1 GLU 56 8.775 -20.581 18.075 504 1HG GLU 56 HG2 GLU 56 11.094 -20.551 19.996 505 2HG GLU 56 HG1 GLU 56 9.659 -19.551 20.086 506 H HIS 57 HN HIS 57 8.316 -22.088 16.303 507 HA HIS 57 HA HIS 57 7.127 -24.429 17.564 508 1HB HIS 57 HB2 HIS 57 6.093 -22.592 15.403 509 2HB HIS 57 HB1 HIS 57 5.184 -23.906 16.148 510 HD1 HIS 57 HD1 HIS 57 4.308 -23.496 18.610 511 HD2 HIS 57 HD2 HIS 57 6.310 -20.269 16.934 512 HE1 HIS 57 HE1 HIS 57 3.866 -21.552 20.119 513 H HIS 58 HN HIS 58 7.957 -26.219 16.773 514 HA HIS 58 HA HIS 58 9.080 -26.104 14.114 515 1HB HIS 58 HB2 HIS 58 10.523 -26.844 15.974 516 2HB HIS 58 HB1 HIS 58 9.458 -28.216 16.246 517 HD1 HIS 58 HD1 HIS 58 9.835 -30.292 14.743 518 HD2 HIS 58 HD2 HIS 58 12.053 -26.965 13.612 519 HE1 HIS 58 HE1 HIS 58 11.476 -31.093 13.027 520 H HIS 59 HN HIS 59 6.753 -27.939 15.989 521 HA HIS 59 HA HIS 59 6.279 -29.804 13.842 522 1HB HIS 59 HB2 HIS 59 6.072 -30.459 16.267 523 2HB HIS 59 HB1 HIS 59 4.686 -29.391 16.393 524 HD1 HIS 59 HD1 HIS 59 2.515 -30.665 16.236 525 HD2 HIS 59 HD2 HIS 59 5.565 -32.465 14.060 526 HE1 HIS 59 HE1 HIS 59 1.536 -32.751 15.263 527 H HIS 60 HN HIS 60 4.224 -27.485 15.572 528 HA HIS 60 HA HIS 60 3.040 -26.624 13.047 529 1HB HIS 60 HB2 HIS 60 1.423 -27.536 15.461 530 2HB HIS 60 HB1 HIS 60 0.762 -26.614 14.126 531 HD1 HIS 60 HD1 HIS 60 -0.189 -29.486 15.103 532 HD2 HIS 60 HD2 HIS 60 2.180 -28.672 11.799 533 HE1 HIS 60 HE1 HIS 60 -0.517 -31.422 13.519 534 H HIS 61 HN HIS 61 1.913 -24.534 13.378 535 HA HIS 61 HA HIS 61 3.278 -22.910 15.324 536 1HB HIS 61 HB2 HIS 61 1.052 -22.228 13.371 537 2HB HIS 61 HB1 HIS 61 1.845 -21.062 14.417 538 HD1 HIS 61 HD1 HIS 61 1.994 -22.353 11.043 539 HD2 HIS 61 HD2 HIS 61 4.751 -20.905 13.806 540 HE1 HIS 61 HE1 HIS 61 4.030 -21.735 9.729 541 H HIS 62 HN HIS 62 2.323 -21.938 17.122 542 HA HIS 62 HA HIS 62 -0.325 -22.963 17.808 543 1HB HIS 62 HB2 HIS 62 1.539 -24.095 19.085 544 2HB HIS 62 HB1 HIS 62 1.980 -22.523 19.736 545 HD1 HIS 62 HD1 HIS 62 0.988 -22.083 22.013 546 HD2 HIS 62 HD2 HIS 62 -1.264 -24.777 19.794 547 HE1 HIS 62 HE1 HIS 62 -0.845 -22.878 23.536 548 H1 MET 101 HT3 MET 101 7.699 21.946 2.401 549 H2 MET 101 HT2 MET 101 8.365 23.300 1.692 550 H3 MET 101 HT1 MET 101 7.513 23.441 3.135 551 HA MET 101 HA MET 101 5.483 22.747 2.078 552 1HB MET 101 HB2 MET 101 6.837 25.067 0.662 553 2HB MET 101 HB1 MET 101 5.125 24.712 0.561 554 1HG MET 101 HG2 MET 101 4.869 25.095 2.938 555 2HG MET 101 HG1 MET 101 6.597 25.390 3.097 556 1HE MET 101 HE2 MET 101 7.845 27.498 2.085 557 2HE MET 101 HE1 MET 101 7.234 27.141 0.472 558 3HE MET 101 HE3 MET 101 7.056 28.761 1.145 559 H GLU 102 HN GLU 102 8.172 22.978 -0.272 560 HA GLU 102 HA GLU 102 6.607 21.762 -2.326 561 1HB GLU 102 HB2 GLU 102 8.564 23.347 -2.790 562 2HB GLU 102 HB1 GLU 102 9.607 22.095 -2.131 563 1HG GLU 102 HG2 GLU 102 7.938 21.266 -4.380 564 2HG GLU 102 HG1 GLU 102 9.224 22.426 -4.723 565 H MET 103 HN MET 103 5.990 19.766 -2.143 566 HA MET 103 HA MET 103 7.823 17.784 -0.972 567 1HB MET 103 HB2 MET 103 4.800 17.836 -0.938 568 2HB MET 103 HB1 MET 103 5.767 16.473 -0.387 569 1HG MET 103 HG2 MET 103 6.814 17.947 1.283 570 2HG MET 103 HG1 MET 103 5.749 19.250 0.772 571 1HE MET 103 HE3 MET 103 3.100 19.219 1.133 572 2HE MET 103 HE2 MET 103 2.984 17.676 0.287 573 3HE MET 103 HE1 MET 103 2.232 17.873 1.869 574 H GLY 104 HN GLY 104 7.597 18.722 -3.732 575 1HA GLY 104 HA1 GLY 104 7.229 17.979 -5.877 576 2HA GLY 104 HA2 GLY 104 6.169 16.726 -5.232 577 H GLN 105 HN GLN 105 9.478 17.434 -4.360 578 HA GLN 105 HA GLN 105 10.595 15.214 -5.815 579 1HB GLN 105 HB2 GLN 105 11.932 16.440 -3.417 580 2HB GLN 105 HB1 GLN 105 12.666 15.785 -4.864 581 1HG GLN 105 HG2 GLN 105 11.718 17.768 -6.117 582 2HG GLN 105 HG1 GLN 105 11.273 18.441 -4.550 583 1HE2 GLN 105 1HE2 GLN 105 12.577 20.121 -4.598 584 2HE2 GLN 105 2HE2 GLN 105 14.314 20.034 -4.546 585 H LEU 106 HN LEU 106 9.411 15.837 -2.630 586 HA LEU 106 HA LEU 106 10.285 13.546 -1.298 587 1HB LEU 106 HB2 LEU 106 9.469 15.613 -0.206 588 2HB LEU 106 HB1 LEU 106 7.861 15.299 -0.793 589 HG LEU 106 HG LEU 106 8.274 14.886 1.662 590 1HD1 LEU 106 HD1 LEU 106 7.240 12.569 0.076 591 2HD1 LEU 106 HD1 LEU 106 6.969 12.846 1.797 592 3HD1 LEU 106 HD1 LEU 106 6.324 13.978 0.606 593 1HD2 LEU 106 HD2 LEU 106 10.475 13.859 1.501 594 2HD2 LEU 106 HD2 LEU 106 9.338 12.785 2.313 595 3HD2 LEU 106 HD2 LEU 106 9.785 12.485 0.636 596 H LYS 107 HN LYS 107 7.206 14.212 -2.967 597 HA LYS 107 HA LYS 107 6.164 11.624 -2.611 598 1HB LYS 107 HB2 LYS 107 5.388 13.972 -4.087 599 2HB LYS 107 HB1 LYS 107 5.137 12.527 -5.059 600 1HG LYS 107 HG2 LYS 107 4.137 12.825 -2.238 601 2HG LYS 107 HG1 LYS 107 3.179 13.271 -3.643 602 1HD LYS 107 HD2 LYS 107 4.328 10.485 -3.351 603 2HD LYS 107 HD1 LYS 107 2.779 10.918 -2.615 604 1HE LYS 107 HE2 LYS 107 2.058 11.657 -4.871 605 2HE LYS 107 HE1 LYS 107 3.526 10.953 -5.539 606 1HZ LYS 107 HZ2 LYS 107 1.418 9.407 -4.046 607 2HZ LYS 107 HZ1 LYS 107 1.562 9.493 -5.698 608 3HZ LYS 107 HZ3 LYS 107 2.784 8.754 -4.840 609 H ASN 108 HN ASN 108 8.320 12.940 -4.990 610 HA ASN 108 HA ASN 108 8.221 10.757 -6.781 611 1HB ASN 108 HB2 ASN 108 9.129 13.031 -7.322 612 2HB ASN 108 HB1 ASN 108 10.512 12.677 -6.301 613 1HD2 ASN 108 HD2 ASN 108 11.933 12.934 -8.050 614 2HD2 ASN 108 HD2 ASN 108 12.056 11.750 -9.293 615 H LYS 109 HN LYS 109 10.073 11.400 -3.870 616 HA LYS 109 HA LYS 109 11.731 9.067 -3.975 617 1HB LYS 109 HB2 LYS 109 10.852 10.763 -1.639 618 2HB LYS 109 HB1 LYS 109 11.977 9.420 -1.499 619 1HG LYS 109 HG2 LYS 109 13.502 10.591 -3.045 620 2HG LYS 109 HG1 LYS 109 12.378 11.950 -3.078 621 1HD LYS 109 HD2 LYS 109 12.658 12.293 -0.698 622 2HD LYS 109 HD1 LYS 109 13.671 10.856 -0.580 623 1HE LYS 109 HE2 LYS 109 15.324 11.909 -2.047 624 2HE LYS 109 HE1 LYS 109 14.310 13.347 -2.156 625 1HZ LYS 109 HZ2 LYS 109 15.501 12.300 0.371 626 2HZ LYS 109 HZ1 LYS 109 16.106 13.560 -0.532 627 3HZ LYS 109 HZ3 LYS 109 14.606 13.723 0.185 628 H ILE 110 HN ILE 110 8.644 9.773 -2.491 629 HA ILE 110 HA ILE 110 8.182 7.291 -1.281 630 HB ILE 110 HB ILE 110 6.254 9.345 -2.383 631 1HG1 ILE 110 2HG1 ILE 110 7.048 8.608 0.401 632 2HG1 ILE 110 1HG1 ILE 110 7.731 9.970 -0.496 633 1HG2 ILE 110 1HG2 ILE 110 5.109 7.171 -2.353 634 2HG2 ILE 110 3HG2 ILE 110 5.592 6.937 -0.672 635 3HG2 ILE 110 2HG2 ILE 110 4.476 8.236 -1.101 636 1HD1 ILE 110 HD1 ILE 110 4.893 9.598 0.400 637 2HD1 ILE 110 HD1 ILE 110 6.094 10.682 1.104 638 3HD1 ILE 110 HD1 ILE 110 5.500 10.965 -0.530 639 H GLU 111 HN GLU 111 7.205 8.467 -4.456 640 HA GLU 111 HA GLU 111 6.046 6.142 -5.464 641 1HB GLU 111 HB2 GLU 111 7.624 8.282 -6.905 642 2HB GLU 111 HB1 GLU 111 6.647 7.060 -7.702 643 1HG GLU 111 HG2 GLU 111 5.587 9.078 -5.744 644 2HG GLU 111 HG1 GLU 111 5.540 9.296 -7.485 645 H ASN 112 HN ASN 112 9.413 7.202 -5.507 646 HA ASN 112 HA ASN 112 10.395 5.041 -7.024 647 1HB ASN 112 HB2 ASN 112 11.678 7.095 -6.769 648 2HB ASN 112 HB1 ASN 112 11.871 6.795 -5.046 649 1HD2 ASN 112 HD2 ASN 112 13.492 5.401 -4.367 650 2HD2 ASN 112 HD2 ASN 112 14.597 4.661 -5.451 651 H LYS 113 HN LYS 113 10.177 5.508 -3.503 652 HA LYS 113 HA LYS 113 11.523 3.133 -2.837 653 1HB LYS 113 HB2 LYS 113 11.013 5.237 -1.439 654 2HB LYS 113 HB1 LYS 113 9.445 4.506 -1.167 655 1HG LYS 113 HG2 LYS 113 10.971 4.065 0.689 656 2HG LYS 113 HG1 LYS 113 10.481 2.582 -0.133 657 1HD LYS 113 HD2 LYS 113 12.891 2.655 0.432 658 2HD LYS 113 HD1 LYS 113 12.574 2.443 -1.280 659 1HE LYS 113 HE2 LYS 113 12.998 4.779 -1.661 660 2HE LYS 113 HE1 LYS 113 13.335 5.035 0.069 661 1HZ LYS 113 HZ3 LYS 113 14.794 3.259 -1.799 662 2HZ LYS 113 HZ2 LYS 113 15.357 4.750 -1.246 663 3HZ LYS 113 HZ1 LYS 113 15.167 3.456 -0.157 664 H LYS 114 HN LYS 114 8.097 3.957 -3.135 665 HA LYS 114 HA LYS 114 6.808 1.620 -2.505 666 1HB LYS 114 HB2 LYS 114 5.826 3.849 -3.076 667 2HB LYS 114 HB1 LYS 114 6.249 3.569 -4.749 668 1HG LYS 114 HG2 LYS 114 4.693 1.656 -4.786 669 2HG LYS 114 HG1 LYS 114 4.253 2.019 -3.113 670 1HD LYS 114 HD2 LYS 114 2.571 3.024 -4.493 671 2HD LYS 114 HD1 LYS 114 3.597 4.330 -3.896 672 1HE LYS 114 HE2 LYS 114 4.863 4.226 -6.048 673 2HE LYS 114 HE1 LYS 114 3.680 3.027 -6.581 674 1HZ LYS 114 HZ2 LYS 114 1.923 4.786 -6.439 675 2HZ LYS 114 HZ1 LYS 114 3.089 5.877 -5.879 676 3HZ LYS 114 HZ3 LYS 114 3.185 5.247 -7.404 677 H LYS 115 HN LYS 115 8.068 2.727 -5.607 678 HA LYS 115 HA LYS 115 7.478 0.430 -7.112 679 1HB LYS 115 HB2 LYS 115 9.432 2.672 -7.572 680 2HB LYS 115 HB1 LYS 115 9.143 1.397 -8.750 681 1HG LYS 115 HG2 LYS 115 6.893 2.057 -9.061 682 2HG LYS 115 HG1 LYS 115 6.925 3.093 -7.640 683 1HD LYS 115 HD2 LYS 115 7.006 4.459 -9.612 684 2HD LYS 115 HD1 LYS 115 8.541 4.559 -8.766 685 1HE LYS 115 HE2 LYS 115 8.965 4.388 -11.141 686 2HE LYS 115 HE1 LYS 115 9.521 2.933 -10.331 687 1HZ LYS 115 HZ1 LYS 115 7.456 1.827 -11.062 688 2HZ LYS 115 HZ3 LYS 115 7.017 3.215 -11.926 689 3HZ LYS 115 HZ2 LYS 115 8.396 2.344 -12.325 690 H GLU 116 HN GLU 116 10.387 1.289 -5.283 691 HA GLU 116 HA GLU 116 11.966 -0.910 -6.119 692 1HB GLU 116 HB2 GLU 116 11.976 0.609 -3.503 693 2HB GLU 116 HB1 GLU 116 13.164 -0.625 -3.899 694 1HG GLU 116 HG2 GLU 116 13.704 0.883 -5.900 695 2HG GLU 116 HG1 GLU 116 12.752 2.107 -5.061 696 H LEU 117 HN LEU 117 9.652 -0.527 -3.540 697 HA LEU 117 HA LEU 117 10.041 -3.086 -2.437 698 1HB LEU 117 HB2 LEU 117 9.183 -1.468 -0.989 699 2HB LEU 117 HB1 LEU 117 7.974 -0.948 -2.131 700 HG LEU 117 HG LEU 117 7.135 -2.119 -0.065 701 1HD1 LEU 117 HD1 LEU 117 5.787 -1.715 -1.867 702 2HD1 LEU 117 HD1 LEU 117 6.279 -3.225 -2.633 703 3HD1 LEU 117 HD1 LEU 117 5.405 -3.259 -1.083 704 1HD2 LEU 117 HD2 LEU 117 8.269 -4.534 -1.408 705 2HD2 LEU 117 HD2 LEU 117 8.782 -3.860 0.144 706 3HD2 LEU 117 HD2 LEU 117 7.156 -4.533 -0.032 707 H ILE 118 HN ILE 118 7.683 -1.833 -4.730 708 HA ILE 118 HA ILE 118 6.095 -4.085 -4.835 709 HB ILE 118 HB ILE 118 6.704 -2.230 -7.166 710 1HG1 ILE 118 2HG1 ILE 118 4.321 -2.175 -5.327 711 2HG1 ILE 118 1HG1 ILE 118 5.778 -1.241 -4.997 712 1HG2 ILE 118 2HG2 ILE 118 4.406 -4.155 -6.712 713 2HG2 ILE 118 1HG2 ILE 118 4.518 -3.005 -8.054 714 3HG2 ILE 118 3HG2 ILE 118 5.676 -4.329 -7.905 715 1HD1 ILE 118 HD1 ILE 118 4.088 -0.998 -7.476 716 2HD1 ILE 118 HD1 ILE 118 4.018 0.082 -6.080 717 3HD1 ILE 118 HD1 ILE 118 5.490 -0.024 -7.052 718 H GLN 119 HN GLN 119 9.038 -3.277 -6.561 719 HA GLN 119 HA GLN 119 9.154 -5.502 -8.262 720 1HB GLN 119 HB2 GLN 119 11.280 -3.678 -7.176 721 2HB GLN 119 HB1 GLN 119 11.643 -4.976 -8.307 722 1HG GLN 119 HG2 GLN 119 10.215 -3.996 -9.972 723 2HG GLN 119 HG1 GLN 119 9.663 -2.784 -8.820 724 1HE2 GLN 119 1HE2 GLN 119 10.957 -1.095 -8.332 725 2HE2 GLN 119 2HE2 GLN 119 12.335 -0.648 -9.276 726 H LEU 120 HN LEU 120 10.234 -5.021 -4.957 727 HA LEU 120 HA LEU 120 11.589 -7.473 -4.736 728 1HB LEU 120 HB2 LEU 120 10.624 -5.457 -2.781 729 2HB LEU 120 HB1 LEU 120 10.896 -7.102 -2.239 730 HG LEU 120 HG LEU 120 13.225 -7.008 -2.764 731 1HD1 LEU 120 HD1 LEU 120 12.706 -4.266 -3.803 732 2HD1 LEU 120 HD1 LEU 120 14.269 -5.042 -3.543 733 3HD1 LEU 120 HD1 LEU 120 13.162 -5.696 -4.775 734 1HD2 LEU 120 HD2 LEU 120 12.345 -4.509 -1.378 735 2HD2 LEU 120 HD2 LEU 120 12.571 -6.100 -0.646 736 3HD2 LEU 120 HD2 LEU 120 13.953 -5.228 -1.306 737 H VAL 121 HN VAL 121 8.184 -6.628 -3.522 738 HA VAL 121 HA VAL 121 7.675 -9.260 -2.863 739 HB VAL 121 HB VAL 121 5.428 -8.731 -2.776 740 1HG1 VAL 121 1HG1 VAL 121 6.982 -6.318 -2.083 741 2HG1 VAL 121 3HG1 VAL 121 5.322 -6.628 -1.556 742 3HG1 VAL 121 2HG1 VAL 121 6.617 -7.734 -1.060 743 1HG2 VAL 121 3HG2 VAL 121 5.915 -6.352 -4.525 744 2HG2 VAL 121 2HG2 VAL 121 5.027 -7.845 -4.890 745 3HG2 VAL 121 1HG2 VAL 121 4.388 -6.720 -3.681 746 H ALA 122 HN ALA 122 7.623 -7.704 -5.954 747 HA ALA 122 HA ALA 122 6.076 -9.596 -7.325 748 1HB ALA 122 HB1 ALA 122 8.218 -7.796 -8.414 749 2HB ALA 122 HB3 ALA 122 6.881 -8.522 -9.336 750 3HB ALA 122 HB2 ALA 122 6.564 -7.327 -8.067 751 H ARG 123 HN ARG 123 9.579 -9.250 -6.893 752 HA ARG 123 HA ARG 123 10.163 -11.551 -8.474 753 1HB ARG 123 HB2 ARG 123 12.488 -11.255 -7.793 754 2HB ARG 123 HB1 ARG 123 11.785 -9.741 -8.333 755 1HG ARG 123 HG2 ARG 123 11.427 -9.169 -5.920 756 2HG ARG 123 HG1 ARG 123 12.371 -10.612 -5.529 757 1HD ARG 123 HD2 ARG 123 13.777 -8.599 -5.508 758 2HD ARG 123 HD1 ARG 123 14.271 -9.724 -6.777 759 HE ARG 123 HE ARG 123 12.561 -8.097 -8.054 760 1HH1 ARG 123 1HH1 ARG 123 15.418 -7.410 -6.093 761 2HH1 ARG 123 2HH1 ARG 123 15.819 -5.979 -6.922 762 1HH2 ARG 123 1HH2 ARG 123 13.075 -6.185 -9.181 763 2HH2 ARG 123 2HH2 ARG 123 14.422 -5.235 -8.721 764 H HIS 124 HN HIS 124 9.049 -11.197 -5.353 765 HA HIS 124 HA HIS 124 10.054 -13.501 -4.099 766 1HB HIS 124 HB2 HIS 124 8.720 -12.001 -2.780 767 2HB HIS 124 HB1 HIS 124 7.374 -12.083 -3.896 768 HD1 HIS 124 HD1 HIS 124 5.612 -13.987 -3.454 769 HD2 HIS 124 HD2 HIS 124 9.051 -14.305 -1.117 770 HE1 HIS 124 HE1 HIS 124 5.147 -15.737 -1.777 771 H GLY 125 HN GLY 125 7.538 -12.971 -6.443 772 1HA GLY 125 HA1 GLY 125 7.005 -15.845 -6.581 773 2HA GLY 125 HA2 GLY 125 7.541 -14.997 -8.028 774 H LEU 126 HN LEU 126 6.067 -12.541 -7.557 775 HA LEU 126 HA LEU 126 3.324 -13.423 -7.423 776 1HB LEU 126 HB2 LEU 126 4.558 -10.742 -7.866 777 2HB LEU 126 HB1 LEU 126 2.854 -10.995 -8.072 778 HG LEU 126 HG LEU 126 4.476 -11.173 -5.626 779 1HD1 LEU 126 HD1 LEU 126 3.833 -8.949 -6.237 780 2HD1 LEU 126 HD1 LEU 126 2.144 -9.424 -6.337 781 3HD1 LEU 126 HD1 LEU 126 2.967 -9.433 -4.776 782 1HD2 LEU 126 HD2 LEU 126 1.620 -12.065 -5.942 783 2HD2 LEU 126 HD2 LEU 126 3.004 -13.021 -5.410 784 3HD2 LEU 126 HD2 LEU 126 2.380 -11.728 -4.397 785 H ASP 127 HN ASP 127 1.946 -13.378 -8.970 786 HA ASP 127 HA ASP 127 2.850 -13.702 -11.670 787 1HB ASP 127 HB2 ASP 127 0.055 -13.420 -10.528 788 2HB ASP 127 HB1 ASP 127 0.410 -13.787 -12.211 789 H HIS 128 HN HIS 128 2.065 -12.324 -13.424 790 HA HIS 128 HA HIS 128 2.796 -9.675 -13.160 791 1HB HIS 128 HB2 HIS 128 2.618 -10.837 -15.335 792 2HB HIS 128 HB1 HIS 128 0.871 -10.860 -15.181 793 HD1 HIS 128 HD1 HIS 128 -0.335 -8.914 -16.256 794 HD2 HIS 128 HD2 HIS 128 3.688 -8.134 -15.593 795 HE1 HIS 128 HE1 HIS 128 0.123 -6.691 -17.331 796 H ASP 129 HN ASP 129 -0.419 -11.074 -12.981 797 HA ASP 129 HA ASP 129 -1.872 -8.679 -12.683 798 1HB ASP 129 HB2 ASP 129 -2.566 -11.482 -11.808 799 2HB ASP 129 HB1 ASP 129 -3.689 -10.125 -11.783 800 H LYS 130 HN LYS 130 -0.361 -10.809 -10.384 801 HA LYS 130 HA LYS 130 -1.487 -9.730 -8.033 802 1HB LYS 130 HB2 LYS 130 1.073 -11.194 -8.567 803 2HB LYS 130 HB1 LYS 130 0.665 -10.709 -6.953 804 1HG LYS 130 HG2 LYS 130 -1.017 -12.487 -8.711 805 2HG LYS 130 HG1 LYS 130 0.122 -13.061 -7.484 806 1HD LYS 130 HD2 LYS 130 -1.219 -11.822 -5.786 807 2HD LYS 130 HD1 LYS 130 -2.378 -11.416 -7.050 808 1HE LYS 130 HE2 LYS 130 -2.746 -13.826 -7.445 809 2HE LYS 130 HE1 LYS 130 -1.618 -14.184 -6.140 810 1HZ LYS 130 HZ3 LYS 130 -3.109 -13.012 -4.610 811 2HZ LYS 130 HZ2 LYS 130 -4.185 -12.739 -5.880 812 3HZ LYS 130 HZ1 LYS 130 -3.890 -14.304 -5.371 813 H VAL 131 HN VAL 131 1.492 -9.023 -9.785 814 HA VAL 131 HA VAL 131 2.498 -7.044 -8.087 815 HB VAL 131 HB VAL 131 2.797 -7.132 -11.102 816 1HG1 VAL 131 1HG1 VAL 131 3.640 -5.094 -10.119 817 2HG1 VAL 131 3HG1 VAL 131 4.614 -6.023 -8.981 818 3HG1 VAL 131 2HG1 VAL 131 4.974 -6.093 -10.703 819 1HG2 VAL 131 2HG2 VAL 131 4.386 -8.616 -9.018 820 2HG2 VAL 131 1HG2 VAL 131 3.301 -9.314 -10.223 821 3HG2 VAL 131 3HG2 VAL 131 4.790 -8.520 -10.735 822 H LEU 132 HN LEU 132 0.270 -6.889 -10.814 823 HA LEU 132 HA LEU 132 -0.034 -4.069 -10.941 824 1HB LEU 132 HB2 LEU 132 -2.018 -6.190 -11.715 825 2HB LEU 132 HB1 LEU 132 -2.041 -4.513 -12.217 826 HG LEU 132 HG LEU 132 0.002 -6.583 -12.987 827 1HD1 LEU 132 HD1 LEU 132 -2.113 -6.875 -14.071 828 2HD1 LEU 132 HD1 LEU 132 -2.113 -5.177 -14.566 829 3HD1 LEU 132 HD1 LEU 132 -0.901 -6.285 -15.216 830 1HD2 LEU 132 HD2 LEU 132 -0.187 -3.670 -13.748 831 2HD2 LEU 132 HD2 LEU 132 1.072 -4.432 -12.773 832 3HD2 LEU 132 HD2 LEU 132 0.904 -4.855 -14.476 833 H LEU 133 HN LEU 133 -2.124 -6.537 -9.505 834 HA LEU 133 HA LEU 133 -3.973 -4.726 -8.451 835 1HB LEU 133 HB2 LEU 133 -3.303 -7.505 -7.509 836 2HB LEU 133 HB1 LEU 133 -4.750 -6.609 -7.081 837 HG LEU 133 HG LEU 133 -4.012 -7.565 -9.847 838 1HD1 LEU 133 HD1 LEU 133 -6.133 -8.470 -7.933 839 2HD1 LEU 133 HD1 LEU 133 -5.945 -9.019 -9.599 840 3HD1 LEU 133 HD1 LEU 133 -4.682 -9.370 -8.414 841 1HD2 LEU 133 HD2 LEU 133 -6.464 -6.110 -8.877 842 2HD2 LEU 133 HD2 LEU 133 -5.235 -5.468 -9.967 843 3HD2 LEU 133 HD2 LEU 133 -6.254 -6.811 -10.481 844 H PHE 134 HN PHE 134 -1.038 -6.066 -7.087 845 HA PHE 134 HA PHE 134 -1.377 -5.024 -4.500 846 1HB PHE 134 HB2 PHE 134 0.214 -6.797 -4.908 847 2HB PHE 134 HB1 PHE 134 1.124 -5.783 -6.021 848 HD1 PHE 134 HD1 PHE 134 0.138 -6.159 -2.473 849 HD2 PHE 134 HD2 PHE 134 2.818 -4.383 -5.253 850 HE1 PHE 134 HE1 PHE 134 1.545 -5.377 -0.619 851 HE2 PHE 134 HE2 PHE 134 4.228 -3.605 -3.395 852 HZ PHE 134 HZ PHE 134 3.591 -4.094 -1.095 853 H SER 135 HN SER 135 0.424 -3.776 -7.315 854 HA SER 135 HA SER 135 1.400 -1.509 -5.991 855 1HB SER 135 HB2 SER 135 1.853 -0.656 -8.340 856 2HB SER 135 HB1 SER 135 2.544 -2.226 -7.928 857 HG SER 135 HG SER 135 1.125 -3.228 -9.141 858 H ARG 136 HN ARG 136 -1.533 -2.024 -7.778 859 HA ARG 136 HA ARG 136 -2.432 0.663 -7.936 860 1HB ARG 136 HB2 ARG 136 -3.998 -1.882 -7.715 861 2HB ARG 136 HB1 ARG 136 -4.683 -0.331 -8.164 862 1HG ARG 136 HG2 ARG 136 -3.441 -0.296 -10.204 863 2HG ARG 136 HG1 ARG 136 -2.516 -1.716 -9.678 864 1HD ARG 136 HD2 ARG 136 -4.453 -3.084 -9.743 865 2HD ARG 136 HD1 ARG 136 -5.507 -1.738 -10.166 866 HE ARG 136 HE ARG 136 -3.433 -2.027 -12.042 867 1HH1 ARG 136 1HH1 ARG 136 -6.550 -3.455 -11.068 868 2HH1 ARG 136 2HH1 ARG 136 -6.762 -4.311 -12.523 869 1HH2 ARG 136 1HH2 ARG 136 -3.804 -3.247 -14.104 870 2HH2 ARG 136 2HH2 ARG 136 -5.200 -4.205 -14.245 871 H ASP 137 HN ASP 137 -3.177 -1.938 -5.633 872 HA ASP 137 HA ASP 137 -4.891 -0.476 -3.929 873 1HB ASP 137 HB2 ASP 137 -4.554 -2.985 -4.092 874 2HB ASP 137 HB1 ASP 137 -3.097 -2.772 -3.143 875 H LEU 138 HN LEU 138 -1.464 -1.211 -3.804 876 HA LEU 138 HA LEU 138 -0.751 0.067 -1.440 877 1HB LEU 138 HB2 LEU 138 0.724 -1.468 -2.501 878 2HB LEU 138 HB1 LEU 138 0.751 -0.526 -3.969 879 HG LEU 138 HG LEU 138 2.094 1.193 -2.861 880 1HD1 LEU 138 HD1 LEU 138 2.017 -0.626 -0.464 881 2HD1 LEU 138 HD1 LEU 138 3.014 0.820 -0.677 882 3HD1 LEU 138 HD1 LEU 138 1.257 0.974 -0.611 883 1HD2 LEU 138 HD2 LEU 138 3.156 -1.596 -2.527 884 2HD2 LEU 138 HD2 LEU 138 3.217 -0.613 -3.990 885 3HD2 LEU 138 HD2 LEU 138 4.126 -0.129 -2.555 886 H ASP 139 HN ASP 139 -0.833 1.310 -4.759 887 HA ASP 139 HA ASP 139 0.202 3.874 -4.260 888 1HB ASP 139 HB2 ASP 139 -0.093 2.856 -6.505 889 2HB ASP 139 HB1 ASP 139 -1.831 3.052 -6.364 890 H LYS 140 HN LYS 140 -3.084 2.653 -4.315 891 HA LYS 140 HA LYS 140 -4.456 5.043 -3.723 892 1HB LYS 140 HB2 LYS 140 -5.200 2.198 -3.069 893 2HB LYS 140 HB1 LYS 140 -6.287 3.579 -2.989 894 1HG LYS 140 HG2 LYS 140 -6.134 3.856 -5.400 895 2HG LYS 140 HG1 LYS 140 -4.922 2.575 -5.488 896 1HD LYS 140 HD2 LYS 140 -7.012 1.613 -6.156 897 2HD LYS 140 HD1 LYS 140 -6.630 1.002 -4.556 898 1HE LYS 140 HE2 LYS 140 -8.992 1.583 -4.717 899 2HE LYS 140 HE1 LYS 140 -8.174 2.626 -3.559 900 1HZ LYS 140 HZ2 LYS 140 -8.731 3.407 -6.374 901 2HZ LYS 140 HZ1 LYS 140 -9.720 3.801 -5.070 902 3HZ LYS 140 HZ3 LYS 140 -8.151 4.393 -5.136 903 H LEU 141 HN LEU 141 -3.344 2.405 -1.650 904 HA LEU 141 HA LEU 141 -4.289 3.310 0.805 905 1HB LEU 141 HB2 LEU 141 -3.451 1.051 0.442 906 2HB LEU 141 HB1 LEU 141 -1.836 1.671 0.177 907 HG LEU 141 HG LEU 141 -1.773 2.429 2.538 908 1HD1 LEU 141 HD1 LEU 141 -4.387 0.957 2.758 909 2HD1 LEU 141 HD1 LEU 141 -3.439 1.585 4.106 910 3HD1 LEU 141 HD1 LEU 141 -4.146 2.697 2.935 911 1HD2 LEU 141 HD2 LEU 141 -2.356 -0.500 2.126 912 2HD2 LEU 141 HD2 LEU 141 -0.797 0.297 1.900 913 3HD2 LEU 141 HD2 LEU 141 -1.513 0.199 3.508 914 H ILE 142 HN ILE 142 -1.217 3.880 -0.776 915 HA ILE 142 HA ILE 142 -0.084 5.384 1.309 916 HB ILE 142 HB ILE 142 0.575 5.362 -1.652 917 1HG1 ILE 142 2HG1 ILE 142 1.937 4.209 0.768 918 2HG1 ILE 142 1HG1 ILE 142 1.035 3.293 -0.434 919 1HG2 ILE 142 2HG2 ILE 142 2.082 6.743 0.572 920 2HG2 ILE 142 1HG2 ILE 142 2.651 6.545 -1.087 921 3HG2 ILE 142 3HG2 ILE 142 1.228 7.532 -0.752 922 1HD1 ILE 142 HD1 ILE 142 3.579 4.826 -0.933 923 2HD1 ILE 142 HD1 ILE 142 3.455 3.079 -0.723 924 3HD1 ILE 142 HD1 ILE 142 2.693 3.861 -2.110 925 H ASN 143 HN ASN 143 -1.526 6.526 -1.723 926 HA ASN 143 HA ASN 143 -1.393 9.245 -1.140 927 1HB ASN 143 HB2 ASN 143 -3.340 7.760 -2.905 928 2HB ASN 143 HB1 ASN 143 -3.238 9.515 -2.836 929 1HD2 ASN 143 HD2 ASN 143 -2.778 7.655 -5.053 930 2HD2 ASN 143 HD2 ASN 143 -1.189 7.949 -5.620 931 H LYS 144 HN LYS 144 -3.826 6.890 -0.263 932 HA LYS 144 HA LYS 144 -5.877 8.508 0.689 933 1HB LYS 144 HB2 LYS 144 -6.004 6.067 0.463 934 2HB LYS 144 HB1 LYS 144 -4.868 5.879 1.786 935 1HG LYS 144 HG2 LYS 144 -6.548 7.017 3.279 936 2HG LYS 144 HG1 LYS 144 -7.676 6.946 1.923 937 1HD LYS 144 HD2 LYS 144 -6.363 4.551 3.183 938 2HD LYS 144 HD1 LYS 144 -8.002 5.105 3.512 939 1HE LYS 144 HE2 LYS 144 -6.943 4.187 0.835 940 2HE LYS 144 HE1 LYS 144 -7.982 3.277 1.926 941 1HZ LYS 144 HZ2 LYS 144 -9.711 4.929 1.627 942 2HZ LYS 144 HZ1 LYS 144 -8.731 5.822 0.581 943 3HZ LYS 144 HZ3 LYS 144 -9.234 4.272 0.152 944 H PHE 145 HN PHE 145 -3.097 7.158 2.412 945 HA PHE 145 HA PHE 145 -3.662 8.470 4.859 946 1HB PHE 145 HB2 PHE 145 -1.418 6.823 3.825 947 2HB PHE 145 HB1 PHE 145 -1.175 7.802 5.269 948 HD1 PHE 145 HD1 PHE 145 -3.177 5.060 3.832 949 HD2 PHE 145 HD2 PHE 145 -2.094 7.269 7.254 950 HE1 PHE 145 HE1 PHE 145 -4.285 3.366 5.245 951 HE2 PHE 145 HE2 PHE 145 -3.197 5.590 8.710 952 HZ PHE 145 HZ PHE 145 -4.289 3.635 7.693 953 H MET 146 HN MET 146 -1.676 9.206 2.129 954 HA MET 146 HA MET 146 -0.155 11.314 3.254 955 1HB MET 146 HB2 MET 146 -1.094 11.086 0.405 956 2HB MET 146 HB1 MET 146 0.273 12.027 0.996 957 1HG MET 146 HG2 MET 146 1.258 9.809 1.752 958 2HG MET 146 HG1 MET 146 -0.020 9.054 0.818 959 1HE MET 146 HE2 MET 146 3.133 10.994 0.907 960 2HE MET 146 HE1 MET 146 3.422 11.544 -0.747 961 3HE MET 146 HE3 MET 146 2.114 12.250 0.208 962 H ASN 147 HN ASN 147 -3.329 11.036 1.914 963 HA ASN 147 HA ASN 147 -5.198 12.229 2.037 964 1HB ASN 147 HB2 ASN 147 -4.394 12.889 4.370 965 2HB ASN 147 HB1 ASN 147 -3.736 14.354 3.655 966 1HD2 ASN 147 HD2 ASN 147 -5.075 15.666 4.899 967 2HD2 ASN 147 HD2 ASN 147 -6.772 15.801 4.603 968 H VAL 148 HN VAL 148 -3.079 12.539 0.080 969 HA VAL 148 HA VAL 148 -4.001 15.025 -1.095 970 HB VAL 148 HB VAL 148 -1.984 15.012 -2.533 971 1HG1 VAL 148 3HG1 VAL 148 -1.435 15.183 0.437 972 2HG1 VAL 148 2HG1 VAL 148 -0.399 15.873 -0.814 973 3HG1 VAL 148 1HG1 VAL 148 -2.039 16.477 -0.593 974 1HG2 VAL 148 1HG2 VAL 148 -1.320 12.676 -2.358 975 2HG2 VAL 148 3HG2 VAL 148 0.019 13.719 -1.864 976 3HG2 VAL 148 2HG2 VAL 148 -0.952 12.892 -0.646 977 H LYS 149 HN LYS 149 -4.949 14.878 -2.973 978 HA LYS 149 HA LYS 149 -5.549 12.172 -3.645 979 1HB LYS 149 HB2 LYS 149 -6.988 14.712 -4.330 980 2HB LYS 149 HB1 LYS 149 -7.518 13.107 -4.839 981 1HG LYS 149 HG2 LYS 149 -7.771 12.399 -2.555 982 2HG LYS 149 HG1 LYS 149 -7.074 13.895 -1.966 983 1HD LYS 149 HD2 LYS 149 -8.979 15.142 -2.905 984 2HD LYS 149 HD1 LYS 149 -9.658 13.629 -3.508 985 1HE LYS 149 HE2 LYS 149 -9.893 12.798 -1.237 986 2HE LYS 149 HE1 LYS 149 -9.128 14.248 -0.601 987 1HZ LYS 149 HZ1 LYS 149 -11.699 14.203 -2.098 988 2HZ LYS 149 HZ3 LYS 149 -11.553 14.344 -0.424 989 3HZ LYS 149 HZ2 LYS 149 -10.964 15.556 -1.426 990 H ASP 150 HN ASP 150 -3.722 11.713 -4.585 991 HA ASP 150 HA ASP 150 -2.371 11.125 -6.300 992 1HB ASP 150 HB2 ASP 150 -4.596 10.287 -7.144 993 2HB ASP 150 HB1 ASP 150 -4.748 11.771 -8.073 994 H LYS 151 HN LYS 151 -2.047 11.950 -8.838 995 HA LYS 151 HA LYS 151 -0.403 14.282 -8.340 996 1HB LYS 151 HB2 LYS 151 0.728 13.622 -10.410 997 2HB LYS 151 HB1 LYS 151 0.622 12.288 -9.275 998 1HG LYS 151 HG2 LYS 151 -1.413 11.512 -10.570 999 2HG LYS 151 HG1 LYS 151 -0.979 12.713 -11.783 1000 1HD LYS 151 HD2 LYS 151 -0.075 10.655 -12.502 1001 2HD LYS 151 HD1 LYS 151 1.280 11.610 -11.908 1002 1HE LYS 151 HE2 LYS 151 1.516 9.334 -11.115 1003 2HE LYS 151 HE1 LYS 151 1.148 10.366 -9.743 1004 1HZ LYS 151 HZ1 LYS 151 -0.838 8.666 -11.179 1005 2HZ LYS 151 HZ3 LYS 151 -0.078 8.258 -9.757 1006 3HZ LYS 151 HZ2 LYS 151 -1.159 9.527 -9.761 1007 H VAL 152 HN VAL 152 -3.364 14.080 -9.041 1008 HA VAL 152 HA VAL 152 -3.425 15.760 -11.378 1009 HB VAL 152 HB VAL 152 -5.964 15.761 -11.088 1010 1HG1 VAL 152 2HG1 VAL 152 -4.839 14.241 -12.628 1011 2HG1 VAL 152 1HG1 VAL 152 -4.589 13.081 -11.323 1012 3HG1 VAL 152 3HG1 VAL 152 -6.224 13.450 -11.875 1013 1HG2 VAL 152 1HG2 VAL 152 -5.323 13.684 -8.979 1014 2HG2 VAL 152 3HG2 VAL 152 -6.066 15.257 -8.684 1015 3HG2 VAL 152 2HG2 VAL 152 -6.930 14.035 -9.615 1016 H HIS 153 HN HIS 153 -2.343 17.460 -10.746 1017 HA HIS 153 HA HIS 153 -3.775 19.435 -9.160 1018 1HB HIS 153 HB2 HIS 153 -0.886 18.603 -8.737 1019 2HB HIS 153 HB1 HIS 153 -1.511 20.153 -8.205 1020 HD1 HIS 153 HD1 HIS 153 -1.437 16.514 -7.280 1021 HD2 HIS 153 HD2 HIS 153 -3.245 20.032 -6.005 1022 HE1 HIS 153 HE1 HIS 153 -2.339 16.042 -4.992 1023 H LYS 154 HN LYS 154 -2.354 21.540 -9.421 1024 HA LYS 154 HA LYS 154 -2.330 22.256 -12.147 1025 1HB LYS 154 HB2 LYS 154 -1.386 24.361 -11.393 1026 2HB LYS 154 HB1 LYS 154 -2.637 23.859 -10.264 1027 1HG LYS 154 HG2 LYS 154 -0.890 22.999 -8.756 1028 2HG LYS 154 HG1 LYS 154 0.343 23.580 -9.869 1029 1HD LYS 154 HD2 LYS 154 0.152 25.193 -8.125 1030 2HD LYS 154 HD1 LYS 154 -0.607 25.892 -9.552 1031 1HE LYS 154 HE2 LYS 154 -1.966 26.331 -7.589 1032 2HE LYS 154 HE1 LYS 154 -2.816 25.223 -8.659 1033 1HZ LYS 154 HZ2 LYS 154 -1.264 24.398 -6.266 1034 2HZ LYS 154 HZ1 LYS 154 -2.938 24.578 -6.313 1035 3HZ LYS 154 HZ3 LYS 154 -2.189 23.384 -7.234 1036 H LEU 155 HN LEU 155 -0.414 22.995 -13.360 1037 HA LEU 155 HA LEU 155 1.733 21.129 -13.218 1038 1HB LEU 155 HB2 LEU 155 1.372 23.662 -14.848 1039 2HB LEU 155 HB1 LEU 155 2.764 22.619 -14.994 1040 HG LEU 155 HG LEU 155 1.203 20.781 -15.744 1041 1HD1 LEU 155 HD1 LEU 155 -0.893 21.622 -14.848 1042 2HD1 LEU 155 HD1 LEU 155 -0.819 23.004 -15.941 1043 3HD1 LEU 155 HD1 LEU 155 -0.999 21.373 -16.590 1044 1HD2 LEU 155 HD2 LEU 155 1.306 23.289 -17.402 1045 2HD2 LEU 155 HD2 LEU 155 2.533 22.023 -17.333 1046 3HD2 LEU 155 HD2 LEU 155 0.941 21.676 -18.012 1047 H GLU 156 HN GLU 156 3.755 21.424 -12.361 1048 HA GLU 156 HA GLU 156 4.014 23.149 -10.155 1049 1HB GLU 156 HB2 GLU 156 6.211 21.792 -11.720 1050 2HB GLU 156 HB1 GLU 156 6.347 22.430 -10.095 1051 1HG GLU 156 HG2 GLU 156 4.785 20.759 -9.283 1052 2HG GLU 156 HG1 GLU 156 4.568 20.147 -10.923 1053 H HIS 157 HN HIS 157 4.535 25.270 -10.098 1054 HA HIS 157 HA HIS 157 5.267 26.647 -12.490 1055 1HB HIS 157 HB2 HIS 157 5.285 27.616 -9.608 1056 2HB HIS 157 HB1 HIS 157 5.588 28.625 -11.005 1057 HD1 HIS 157 HD1 HIS 157 3.581 29.995 -11.600 1058 HD2 HIS 157 HD2 HIS 157 2.532 26.312 -9.978 1059 HE1 HIS 157 HE1 HIS 157 1.072 29.947 -11.551 1060 H HIS 158 HN HIS 158 7.170 26.329 -13.325 1061 HA HIS 158 HA HIS 158 9.442 25.983 -11.518 1062 1HB HIS 158 HB2 HIS 158 8.920 24.149 -13.144 1063 2HB HIS 158 HB1 HIS 158 9.202 25.283 -14.455 1064 HD1 HIS 158 HD1 HIS 158 11.477 24.987 -15.480 1065 HD2 HIS 158 HD2 HIS 158 11.416 23.974 -11.446 1066 HE1 HIS 158 HE1 HIS 158 13.773 24.147 -14.944 1067 H HIS 159 HN HIS 159 7.964 28.367 -13.184 1068 HA HIS 159 HA HIS 159 10.485 29.619 -14.005 1069 1HB HIS 159 HB2 HIS 159 7.694 30.091 -15.046 1070 2HB HIS 159 HB1 HIS 159 9.043 31.161 -15.393 1071 HD1 HIS 159 HD1 HIS 159 10.866 30.266 -17.033 1072 HD2 HIS 159 HD2 HIS 159 7.658 27.704 -16.423 1073 HE1 HIS 159 HE1 HIS 159 10.990 28.540 -18.874 1074 H HIS 160 HN HIS 160 11.205 30.885 -12.537 1075 HA HIS 160 HA HIS 160 9.412 32.910 -11.387 1076 1HB HIS 160 HB2 HIS 160 10.050 31.089 -9.689 1077 2HB HIS 160 HB1 HIS 160 11.714 31.629 -9.866 1078 HD1 HIS 160 HD1 HIS 160 9.042 32.007 -7.614 1079 HD2 HIS 160 HD2 HIS 160 11.718 34.683 -9.320 1080 HE1 HIS 160 HE1 HIS 160 9.035 34.042 -6.133 1081 H HIS 161 HN HIS 161 12.746 31.870 -11.751 1082 HA HIS 161 HA HIS 161 13.658 33.761 -13.482 1083 1HB HIS 161 HB2 HIS 161 13.308 35.389 -11.545 1084 2HB HIS 161 HB1 HIS 161 14.481 34.452 -10.627 1085 HD1 HIS 161 HD1 HIS 161 16.565 35.867 -10.573 1086 HD2 HIS 161 HD2 HIS 161 14.768 35.820 -14.320 1087 HE1 HIS 161 HE1 HIS 161 18.092 37.149 -12.103 1088 H HIS 162 HN HIS 162 14.545 32.127 -10.465 1089 HA HIS 162 HA HIS 162 16.338 30.465 -12.053 1090 1HB HIS 162 HB2 HIS 162 16.832 31.471 -9.221 1091 2HB HIS 162 HB1 HIS 162 17.795 30.242 -10.025 1092 HD1 HIS 162 HD1 HIS 162 18.017 33.703 -9.242 1093 HD2 HIS 162 HD2 HIS 162 18.784 31.451 -12.658 1094 HE1 HIS 162 HE1 HIS 162 19.561 35.065 -10.629 No H/Q in entry = 1094 Start of MODEL 32 1 H1 MET 1 HT3 MET 1 19.866 -18.331 -3.014 2 H2 MET 1 HT2 MET 1 18.495 -17.777 -3.796 3 H3 MET 1 HT1 MET 1 20.020 -17.174 -4.242 4 HA MET 1 HA MET 1 20.246 -16.197 -2.058 5 1HB MET 1 HB2 MET 1 17.681 -15.502 -3.510 6 2HB MET 1 HB1 MET 1 18.340 -14.539 -2.201 7 1HG MET 1 HG2 MET 1 20.336 -14.104 -3.522 8 2HG MET 1 HG1 MET 1 19.695 -15.093 -4.834 9 1HE MET 1 HE1 MET 1 20.168 -13.031 -6.465 10 2HE MET 1 HE3 MET 1 19.508 -11.417 -6.203 11 3HE MET 1 HE2 MET 1 20.739 -12.054 -5.113 12 H GLU 2 HN GLU 2 18.724 -15.332 -0.255 13 HA GLU 2 HA GLU 2 17.407 -17.698 0.821 14 1HB GLU 2 HB2 GLU 2 19.589 -16.717 1.820 15 2HB GLU 2 HB1 GLU 2 18.594 -15.385 2.366 16 1HG GLU 2 HG2 GLU 2 18.106 -18.251 3.119 17 2HG GLU 2 HG1 GLU 2 19.104 -17.154 4.060 18 H MET 3 HN MET 3 15.282 -17.511 1.111 19 HA MET 3 HA MET 3 13.837 -15.281 0.175 20 1HB MET 3 HB2 MET 3 12.896 -17.714 1.677 21 2HB MET 3 HB1 MET 3 11.811 -16.511 1.000 22 1HG MET 3 HG2 MET 3 12.693 -16.990 -1.238 23 2HG MET 3 HG1 MET 3 13.745 -18.222 -0.549 24 1HE MET 3 HE2 MET 3 12.845 -20.476 0.581 25 2HE MET 3 HE1 MET 3 11.811 -19.544 1.665 26 3HE MET 3 HE3 MET 3 11.136 -20.878 0.730 27 H GLY 4 HN GLY 4 14.830 -16.185 3.394 28 1HA GLY 4 HA1 GLY 4 14.536 -15.153 5.394 29 2HA GLY 4 HA2 GLY 4 13.012 -14.519 4.776 30 H GLN 5 HN GLN 5 16.350 -14.133 3.723 31 HA GLN 5 HA GLN 5 16.641 -11.429 4.440 32 1HB GLN 5 HB2 GLN 5 18.026 -13.045 2.299 33 2HB GLN 5 HB1 GLN 5 18.452 -11.382 2.692 34 1HG GLN 5 HG2 GLN 5 18.447 -13.568 4.730 35 2HG GLN 5 HG1 GLN 5 19.861 -13.176 3.750 36 1HE2 GLN 5 1HE2 GLN 5 21.021 -12.599 5.573 37 2HE2 GLN 5 2HE2 GLN 5 20.747 -11.156 6.465 38 H LEU 6 HN LEU 6 15.264 -12.932 1.636 39 HA LEU 6 HA LEU 6 14.934 -10.614 0.067 40 1HB LEU 6 HB2 LEU 6 14.729 -12.944 -0.803 41 2HB LEU 6 HB1 LEU 6 13.294 -13.162 0.153 42 HG LEU 6 HG LEU 6 12.975 -12.852 -2.352 43 1HD1 LEU 6 HD1 LEU 6 11.481 -11.002 -0.531 44 2HD1 LEU 6 HD1 LEU 6 10.968 -11.507 -2.143 45 3HD1 LEU 6 HD1 LEU 6 11.111 -12.695 -0.848 46 1HD2 LEU 6 HD2 LEU 6 14.559 -11.036 -2.701 47 2HD2 LEU 6 HD2 LEU 6 12.937 -10.555 -3.199 48 3HD2 LEU 6 HD2 LEU 6 13.594 -9.981 -1.667 49 H LYS 7 HN LYS 7 12.736 -12.259 2.332 50 HA LYS 7 HA LYS 7 10.672 -10.346 2.273 51 1HB LYS 7 HB2 LYS 7 11.281 -12.721 3.747 52 2HB LYS 7 HB1 LYS 7 10.782 -11.475 4.879 53 1HG LYS 7 HG2 LYS 7 9.199 -12.247 2.440 54 2HG LYS 7 HG1 LYS 7 8.955 -12.970 4.021 55 1HD LYS 7 HD2 LYS 7 8.750 -9.990 3.519 56 2HD LYS 7 HD1 LYS 7 7.365 -11.074 3.415 57 1HE LYS 7 HE2 LYS 7 7.802 -11.745 5.783 58 2HE LYS 7 HE1 LYS 7 9.080 -10.538 5.846 59 1HZ LYS 7 HZ2 LYS 7 6.217 -9.878 5.284 60 2HZ LYS 7 HZ1 LYS 7 6.947 -9.788 6.785 61 3HZ LYS 7 HZ3 LYS 7 7.478 -8.785 5.565 62 H ASN 8 HN ASN 8 13.602 -10.561 4.103 63 HA ASN 8 HA ASN 8 13.126 -8.499 5.968 64 1HB ASN 8 HB2 ASN 8 14.948 -10.307 5.988 65 2HB ASN 8 HB1 ASN 8 15.819 -9.290 4.857 66 1HD2 ASN 8 HD2 ASN 8 16.641 -10.159 7.418 67 2HD2 ASN 8 HD2 ASN 8 16.915 -8.750 8.384 68 H LYS 9 HN LYS 9 14.646 -8.529 2.736 69 HA LYS 9 HA LYS 9 15.240 -5.751 2.638 70 1HB LYS 9 HB2 LYS 9 14.701 -7.683 0.364 71 2HB LYS 9 HB1 LYS 9 15.271 -6.041 0.144 72 1HG LYS 9 HG2 LYS 9 16.749 -8.278 1.527 73 2HG LYS 9 HG1 LYS 9 17.084 -7.633 -0.079 74 1HD LYS 9 HD2 LYS 9 17.545 -5.414 0.985 75 2HD LYS 9 HD1 LYS 9 17.365 -6.192 2.558 76 1HE LYS 9 HE2 LYS 9 19.417 -6.858 0.448 77 2HE LYS 9 HE1 LYS 9 19.707 -6.021 1.967 78 1HZ LYS 9 HZ2 LYS 9 19.000 -8.045 3.130 79 2HZ LYS 9 HZ1 LYS 9 18.858 -8.852 1.649 80 3HZ LYS 9 HZ3 LYS 9 20.357 -8.287 2.187 81 H ILE 10 HN ILE 10 12.412 -7.622 1.829 82 HA ILE 10 HA ILE 10 10.883 -5.550 0.701 83 HB ILE 10 HB ILE 10 10.069 -8.102 2.115 84 1HG1 ILE 10 2HG1 ILE 10 10.040 -7.277 -0.783 85 2HG1 ILE 10 1HG1 ILE 10 11.244 -8.318 -0.029 86 1HG2 ILE 10 2HG2 ILE 10 8.239 -6.499 2.399 87 2HG2 ILE 10 1HG2 ILE 10 8.240 -6.190 0.663 88 3HG2 ILE 10 3HG2 ILE 10 7.789 -7.782 1.275 89 1HD1 ILE 10 HD1 ILE 10 9.491 -9.967 0.410 90 2HD1 ILE 10 HD1 ILE 10 8.319 -8.911 -0.382 91 3HD1 ILE 10 HD1 ILE 10 9.658 -9.598 -1.306 92 H GLU 11 HN GLU 11 11.084 -6.762 4.019 93 HA GLU 11 HA GLU 11 9.405 -4.902 5.276 94 1HB GLU 11 HB2 GLU 11 11.926 -6.206 6.327 95 2HB GLU 11 HB1 GLU 11 10.763 -5.336 7.313 96 1HG GLU 11 HG2 GLU 11 10.252 -7.865 5.769 97 2HG GLU 11 HG1 GLU 11 10.447 -7.725 7.520 98 H ASN 12 HN ASN 12 12.805 -4.812 4.625 99 HA ASN 12 HA ASN 12 13.579 -2.432 5.722 100 1HB ASN 12 HB2 ASN 12 15.054 -4.151 4.686 101 2HB ASN 12 HB1 ASN 12 14.485 -3.643 3.117 102 1HD2 ASN 12 HD2 ASN 12 16.461 -2.892 5.772 103 2HD2 ASN 12 HD2 ASN 12 17.323 -1.575 5.051 104 H LYS 13 HN LYS 13 12.473 -3.013 2.416 105 HA LYS 13 HA LYS 13 12.711 -0.321 1.561 106 1HB LYS 13 HB2 LYS 13 12.583 -2.651 0.277 107 2HB LYS 13 HB1 LYS 13 10.888 -2.232 0.193 108 1HG LYS 13 HG2 LYS 13 12.120 -1.557 -1.827 109 2HG LYS 13 HG1 LYS 13 11.393 -0.187 -0.991 110 1HD LYS 13 HD2 LYS 13 13.753 0.179 -1.803 111 2HD LYS 13 HD1 LYS 13 13.502 0.505 -0.096 112 1HE LYS 13 HE2 LYS 13 14.406 -1.688 0.446 113 2HE LYS 13 HE1 LYS 13 14.718 -2.011 -1.272 114 1HZ LYS 13 HZ3 LYS 13 15.848 0.162 0.385 115 2HZ LYS 13 HZ2 LYS 13 16.697 -1.225 -0.076 116 3HZ LYS 13 HZ1 LYS 13 16.230 -0.093 -1.241 117 H LYS 14 HN LYS 14 10.016 -2.306 2.619 118 HA LYS 14 HA LYS 14 7.874 -0.600 2.318 119 1HB LYS 14 HB2 LYS 14 7.803 -2.992 2.942 120 2HB LYS 14 HB1 LYS 14 8.485 -2.585 4.503 121 1HG LYS 14 HG2 LYS 14 6.455 -1.302 5.031 122 2HG LYS 14 HG1 LYS 14 5.789 -1.749 3.458 123 1HD LYS 14 HD2 LYS 14 4.864 -3.278 5.073 124 2HD LYS 14 HD1 LYS 14 6.072 -4.156 4.130 125 1HE LYS 14 HE2 LYS 14 7.714 -3.707 5.952 126 2HE LYS 14 HE1 LYS 14 6.370 -3.011 6.862 127 1HZ LYS 14 HZ3 LYS 14 5.282 -5.277 6.849 128 2HZ LYS 14 HZ2 LYS 14 6.577 -5.836 5.923 129 3HZ LYS 14 HZ1 LYS 14 6.850 -5.361 7.433 130 H LYS 15 HN LYS 15 10.087 -1.053 5.056 131 HA LYS 15 HA LYS 15 8.934 0.926 6.691 132 1HB LYS 15 HB2 LYS 15 11.656 -0.368 6.804 133 2HB LYS 15 HB1 LYS 15 11.035 0.721 8.038 134 1HG LYS 15 HG2 LYS 15 9.251 -0.785 8.575 135 2HG LYS 15 HG1 LYS 15 9.650 -1.816 7.204 136 1HD LYS 15 HD2 LYS 15 10.454 -2.842 9.209 137 2HD LYS 15 HD1 LYS 15 11.830 -2.301 8.263 138 1HE LYS 15 HE2 LYS 15 12.040 -0.305 9.668 139 2HE LYS 15 HE1 LYS 15 10.652 -0.839 10.624 140 1HZ LYS 15 HZ2 LYS 15 13.212 -2.308 10.355 141 2HZ LYS 15 HZ1 LYS 15 12.770 -1.366 11.685 142 3HZ LYS 15 HZ3 LYS 15 11.918 -2.773 11.305 143 H GLU 16 HN GLU 16 11.608 1.031 4.379 144 HA GLU 16 HA GLU 16 12.430 3.673 4.865 145 1HB GLU 16 HB2 GLU 16 12.370 2.077 2.301 146 2HB GLU 16 HB1 GLU 16 13.018 3.712 2.388 147 1HG GLU 16 HG2 GLU 16 14.612 2.810 4.116 148 2HG GLU 16 HG1 GLU 16 14.026 1.201 3.679 149 H LEU 17 HN LEU 17 9.858 2.395 2.877 150 HA LEU 17 HA LEU 17 9.072 4.896 1.834 151 1HB LEU 17 HB2 LEU 17 8.568 3.045 0.507 152 2HB LEU 17 HB1 LEU 17 7.906 2.142 1.840 153 HG LEU 17 HG LEU 17 6.254 2.859 0.090 154 1HD1 LEU 17 HD1 LEU 17 5.561 2.087 2.146 155 2HD1 LEU 17 HD1 LEU 17 5.669 3.706 2.826 156 3HD1 LEU 17 HD1 LEU 17 4.492 3.365 1.538 157 1HD2 LEU 17 HD2 LEU 17 6.721 5.587 1.238 158 2HD2 LEU 17 HD2 LEU 17 7.093 5.069 -0.409 159 3HD2 LEU 17 HD2 LEU 17 5.415 5.132 0.139 160 H ILE 18 HN ILE 18 7.916 2.943 4.521 161 HA ILE 18 HA ILE 18 5.687 4.448 5.081 162 HB ILE 18 HB ILE 18 7.439 2.989 7.094 163 1HG1 ILE 18 2HG1 ILE 18 4.842 2.106 5.843 164 2HG1 ILE 18 1HG1 ILE 18 6.413 1.688 5.170 165 1HG2 ILE 18 1HG2 ILE 18 4.617 4.036 7.342 166 2HG2 ILE 18 3HG2 ILE 18 5.398 2.976 8.522 167 3HG2 ILE 18 2HG2 ILE 18 6.023 4.606 8.228 168 1HD1 ILE 18 HD1 ILE 18 5.467 0.965 7.932 169 2HD1 ILE 18 HD1 ILE 18 5.467 -0.104 6.521 170 3HD1 ILE 18 HD1 ILE 18 6.990 0.499 7.165 171 H GLN 19 HN GLN 19 9.000 4.798 6.193 172 HA GLN 19 HA GLN 19 8.679 7.034 7.854 173 1HB GLN 19 HB2 GLN 19 11.054 6.074 6.276 174 2HB GLN 19 HB1 GLN 19 11.121 7.372 7.459 175 1HG GLN 19 HG2 GLN 19 10.491 5.854 9.223 176 2HG GLN 19 HG1 GLN 19 10.236 4.558 8.055 177 1HE2 GLN 19 1HE2 GLN 19 11.968 3.605 7.123 178 2HE2 GLN 19 2HE2 GLN 19 13.581 3.721 7.756 179 H LEU 20 HN LEU 20 9.043 6.729 4.397 180 HA LEU 20 HA LEU 20 9.483 9.486 3.900 181 1HB LEU 20 HB2 LEU 20 8.481 7.327 2.049 182 2HB LEU 20 HB1 LEU 20 8.907 8.953 1.552 183 HG LEU 20 HG LEU 20 10.810 6.914 2.700 184 1HD1 LEU 20 HD1 LEU 20 10.083 6.351 0.451 185 2HD1 LEU 20 HD1 LEU 20 10.495 7.975 -0.097 186 3HD1 LEU 20 HD1 LEU 20 11.763 6.883 0.457 187 1HD2 LEU 20 HD2 LEU 20 11.301 9.694 1.631 188 2HD2 LEU 20 HD2 LEU 20 11.485 9.161 3.304 189 3HD2 LEU 20 HD2 LEU 20 12.550 8.527 2.057 190 H VAL 21 HN VAL 21 6.390 7.482 3.494 191 HA VAL 21 HA VAL 21 4.898 9.764 3.065 192 HB VAL 21 HB VAL 21 2.989 8.493 3.508 193 1HG1 VAL 21 2HG1 VAL 21 5.068 6.783 2.307 194 2HG1 VAL 21 1HG1 VAL 21 3.321 6.463 2.220 195 3HG1 VAL 21 3HG1 VAL 21 3.979 7.939 1.494 196 1HG2 VAL 21 1HG2 VAL 21 3.501 7.528 5.607 197 2HG2 VAL 21 3HG2 VAL 21 2.945 6.285 4.486 198 3HG2 VAL 21 2HG2 VAL 21 4.679 6.428 4.861 199 H ALA 22 HN ALA 22 6.024 8.362 6.044 200 HA ALA 22 HA ALA 22 4.342 9.635 7.836 201 1HB ALA 22 HB2 ALA 22 7.188 8.787 8.230 202 2HB ALA 22 HB1 ALA 22 5.987 9.044 9.516 203 3HB ALA 22 HB3 ALA 22 5.771 7.749 8.328 204 H ARG 23 HN ARG 23 7.490 10.602 6.575 205 HA ARG 23 HA ARG 23 7.609 12.991 8.085 206 1HB ARG 23 HB2 ARG 23 9.575 13.581 6.752 207 2HB ARG 23 HB1 ARG 23 9.660 11.924 7.316 208 1HG ARG 23 HG2 ARG 23 8.818 11.253 5.043 209 2HG ARG 23 HG1 ARG 23 9.085 12.934 4.572 210 1HD ARG 23 HD2 ARG 23 11.017 11.573 3.968 211 2HD ARG 23 HD1 ARG 23 11.443 12.734 5.229 212 HE ARG 23 HE ARG 23 10.671 10.402 6.495 213 1HH1 ARG 23 1HH1 ARG 23 13.303 11.374 4.316 214 2HH1 ARG 23 2HH1 ARG 23 14.427 10.266 4.956 215 1HH2 ARG 23 1HH2 ARG 23 12.287 8.901 7.409 216 2HH2 ARG 23 2HH2 ARG 23 13.837 8.853 6.740 217 H HIS 24 HN HIS 24 5.966 12.208 5.234 218 HA HIS 24 HA HIS 24 5.687 14.683 3.968 219 1HB HIS 24 HB2 HIS 24 4.887 12.705 2.869 220 2HB HIS 24 HB1 HIS 24 3.785 12.314 4.170 221 HD1 HIS 24 HD1 HIS 24 1.444 13.609 4.140 222 HD2 HIS 24 HD2 HIS 24 4.014 14.587 1.024 223 HE1 HIS 24 HE1 HIS 24 0.071 14.850 2.482 224 H GLY 25 HN GLY 25 4.167 13.431 6.881 225 1HA GLY 25 HA1 GLY 25 2.235 15.610 6.910 226 2HA GLY 25 HA2 GLY 25 3.509 15.707 8.111 227 H LEU 26 HN LEU 26 2.544 12.493 7.329 228 HA LEU 26 HA LEU 26 0.352 12.071 8.834 229 1HB LEU 26 HB2 LEU 26 2.680 10.442 8.096 230 2HB LEU 26 HB1 LEU 26 1.521 9.778 9.225 231 HG LEU 26 HG LEU 26 -0.220 10.184 7.497 232 1HD1 LEU 26 HD1 LEU 26 0.883 11.818 6.183 233 2HD1 LEU 26 HD1 LEU 26 2.095 10.633 5.665 234 3HD1 LEU 26 HD1 LEU 26 0.389 10.419 5.220 235 1HD2 LEU 26 HD2 LEU 26 2.039 8.321 6.929 236 2HD2 LEU 26 HD2 LEU 26 0.606 8.013 7.915 237 3HD2 LEU 26 HD2 LEU 26 0.462 8.215 6.157 238 H ASP 27 HN ASP 27 -0.098 11.615 10.783 239 HA ASP 27 HA ASP 27 1.658 12.425 12.954 240 1HB ASP 27 HB2 ASP 27 -0.996 10.998 13.245 241 2HB ASP 27 HB1 ASP 27 -0.198 12.041 14.399 242 H HIS 28 HN HIS 28 1.756 10.744 14.872 243 HA HIS 28 HA HIS 28 3.114 8.481 13.855 244 1HB HIS 28 HB2 HIS 28 3.586 9.564 16.075 245 2HB HIS 28 HB1 HIS 28 2.105 8.839 16.679 246 HD1 HIS 28 HD1 HIS 28 2.539 6.685 17.954 247 HD2 HIS 28 HD2 HIS 28 5.330 7.346 14.938 248 HE1 HIS 28 HE1 HIS 28 4.158 4.795 18.079 249 H ASP 29 HN ASP 29 -0.134 8.969 15.086 250 HA ASP 29 HA ASP 29 -0.908 6.266 15.235 251 1HB ASP 29 HB2 ASP 29 -3.207 7.038 15.258 252 2HB ASP 29 HB1 ASP 29 -2.234 8.133 16.235 253 H LYS 30 HN LYS 30 -0.868 8.564 12.668 254 HA LYS 30 HA LYS 30 -2.255 7.084 10.690 255 1HB LYS 30 HB2 LYS 30 -0.064 9.102 10.320 256 2HB LYS 30 HB1 LYS 30 -1.156 8.552 9.062 257 1HG LYS 30 HG2 LYS 30 -1.868 10.118 11.527 258 2HG LYS 30 HG1 LYS 30 -1.771 10.720 9.871 259 1HD LYS 30 HD2 LYS 30 -3.586 9.291 9.218 260 2HD LYS 30 HD1 LYS 30 -3.672 8.598 10.839 261 1HE LYS 30 HE2 LYS 30 -4.206 11.453 10.054 262 2HE LYS 30 HE1 LYS 30 -5.383 10.273 10.631 263 1HZ LYS 30 HZ1 LYS 30 -4.040 10.204 12.761 264 2HZ LYS 30 HZ3 LYS 30 -3.200 11.568 12.184 265 3HZ LYS 30 HZ2 LYS 30 -4.849 11.652 12.454 266 H VAL 31 HN VAL 31 1.113 7.319 11.619 267 HA VAL 31 HA VAL 31 2.159 5.752 9.525 268 HB VAL 31 HB VAL 31 3.334 6.309 12.281 269 1HG1 VAL 31 1HG1 VAL 31 4.406 4.400 11.220 270 2HG1 VAL 31 3HG1 VAL 31 4.682 5.368 9.771 271 3HG1 VAL 31 2HG1 VAL 31 5.478 5.800 11.286 272 1HG2 VAL 31 2HG2 VAL 31 2.834 8.334 11.022 273 2HG2 VAL 31 1HG2 VAL 31 4.578 8.075 11.164 274 3HG2 VAL 31 3HG2 VAL 31 3.746 7.707 9.654 275 H LEU 32 HN LEU 32 1.047 5.024 12.766 276 HA LEU 32 HA LEU 32 1.614 2.212 12.806 277 1HB LEU 32 HB2 LEU 32 -0.603 3.716 14.171 278 2HB LEU 32 HB1 LEU 32 -0.037 2.108 14.565 279 HG LEU 32 HG LEU 32 1.511 4.669 14.908 280 1HD1 LEU 32 HD1 LEU 32 0.302 2.776 16.889 281 2HD1 LEU 32 HD1 LEU 32 1.320 4.174 17.274 282 3HD1 LEU 32 HD1 LEU 32 -0.257 4.407 16.510 283 1HD2 LEU 32 HD2 LEU 32 2.288 1.824 15.556 284 2HD2 LEU 32 HD2 LEU 32 3.007 2.858 14.317 285 3HD2 LEU 32 HD2 LEU 32 3.188 3.272 16.023 286 H LEU 33 HN LEU 33 -1.271 3.981 11.853 287 HA LEU 33 HA LEU 33 -2.753 1.685 11.150 288 1HB LEU 33 HB2 LEU 33 -2.978 4.476 10.053 289 2HB LEU 33 HB1 LEU 33 -4.170 3.196 9.904 290 HG LEU 33 HG LEU 33 -3.312 4.419 12.529 291 1HD1 LEU 33 HD1 LEU 33 -5.748 5.009 10.854 292 2HD1 LEU 33 HD1 LEU 33 -5.438 5.599 12.492 293 3HD1 LEU 33 HD1 LEU 33 -4.390 6.096 11.168 294 1HD2 LEU 33 HD2 LEU 33 -5.632 2.620 11.814 295 2HD2 LEU 33 HD2 LEU 33 -4.201 2.155 12.741 296 3HD2 LEU 33 HD2 LEU 33 -5.332 3.336 13.398 297 H PHE 34 HN PHE 34 -0.718 3.828 9.238 298 HA PHE 34 HA PHE 34 -1.264 2.582 6.791 299 1HB PHE 34 HB2 PHE 34 -0.382 4.831 6.888 300 2HB PHE 34 HB1 PHE 34 1.109 4.255 7.633 301 HD1 PHE 34 HD1 PHE 34 2.910 3.676 6.302 302 HD2 PHE 34 HD2 PHE 34 -0.947 3.966 4.547 303 HE1 PHE 34 HE1 PHE 34 3.899 3.378 4.069 304 HE2 PHE 34 HE2 PHE 34 0.043 3.667 2.320 305 HZ PHE 34 HZ PHE 34 2.488 3.372 2.102 306 H SER 35 HN SER 35 1.440 2.142 9.079 307 HA SER 35 HA SER 35 2.847 0.326 7.497 308 1HB SER 35 HB2 SER 35 3.972 -0.330 9.662 309 2HB SER 35 HB1 SER 35 3.978 1.396 9.300 310 HG SER 35 HG SER 35 2.603 1.779 10.830 311 H ARG 36 HN ARG 36 0.325 -0.258 9.894 312 HA ARG 36 HA ARG 36 0.625 -3.081 9.833 313 1HB ARG 36 HB2 ARG 36 -1.574 -3.139 11.008 314 2HB ARG 36 HB1 ARG 36 -0.367 -2.122 11.782 315 1HG ARG 36 HG2 ARG 36 -1.437 -0.166 10.672 316 2HG ARG 36 HG1 ARG 36 -2.712 -1.252 10.128 317 1HD ARG 36 HD2 ARG 36 -1.920 -0.885 12.991 318 2HD ARG 36 HD1 ARG 36 -3.167 0.055 12.212 319 HE ARG 36 HE ARG 36 -4.096 -2.271 11.597 320 1HH1 ARG 36 1HH1 ARG 36 -2.522 -1.677 14.700 321 2HH1 ARG 36 2HH1 ARG 36 -3.768 -2.379 15.628 322 1HH2 ARG 36 1HH2 ARG 36 -5.817 -3.237 12.871 323 2HH2 ARG 36 2HH2 ARG 36 -5.678 -3.278 14.573 324 H ASP 37 HN ASP 37 -1.516 -0.852 8.084 325 HA ASP 37 HA ASP 37 -2.943 -3.022 6.888 326 1HB ASP 37 HB2 ASP 37 -3.865 -0.658 7.163 327 2HB ASP 37 HB1 ASP 37 -2.827 -0.206 5.825 328 H LEU 38 HN LEU 38 -0.293 -0.960 5.955 329 HA LEU 38 HA LEU 38 0.082 -1.875 3.343 330 1HB LEU 38 HB2 LEU 38 1.191 0.098 4.085 331 2HB LEU 38 HB1 LEU 38 1.980 -0.753 5.390 332 HG LEU 38 HG LEU 38 3.442 -1.896 3.806 333 1HD1 LEU 38 HD1 LEU 38 2.000 -0.325 1.689 334 2HD1 LEU 38 HD1 LEU 38 3.457 -1.312 1.475 335 3HD1 LEU 38 HD1 LEU 38 1.939 -2.079 1.933 336 1HD2 LEU 38 HD2 LEU 38 3.300 1.071 3.367 337 2HD2 LEU 38 HD2 LEU 38 4.139 0.245 4.678 338 3HD2 LEU 38 HD2 LEU 38 4.686 0.046 3.013 339 H ASP 39 HN ASP 39 1.443 -3.049 6.411 340 HA ASP 39 HA ASP 39 3.057 -5.080 5.369 341 1HB ASP 39 HB2 ASP 39 3.124 -4.383 7.748 342 2HB ASP 39 HB1 ASP 39 1.535 -5.103 7.990 343 H LYS 40 HN LYS 40 -0.300 -5.196 6.454 344 HA LYS 40 HA LYS 40 -0.689 -7.892 5.754 345 1HB LYS 40 HB2 LYS 40 -2.655 -5.684 6.245 346 2HB LYS 40 HB1 LYS 40 -3.122 -7.350 5.917 347 1HG LYS 40 HG2 LYS 40 -1.858 -8.071 7.888 348 2HG LYS 40 HG1 LYS 40 -1.428 -6.390 8.204 349 1HD LYS 40 HD2 LYS 40 -3.751 -5.819 8.524 350 2HD LYS 40 HD1 LYS 40 -4.243 -7.461 8.111 351 1HE LYS 40 HE2 LYS 40 -4.246 -7.191 10.525 352 2HE LYS 40 HE1 LYS 40 -2.972 -8.305 10.035 353 1HZ LYS 40 HZ2 LYS 40 -1.378 -6.503 10.261 354 2HZ LYS 40 HZ1 LYS 40 -2.583 -5.453 10.793 355 3HZ LYS 40 HZ3 LYS 40 -2.156 -6.806 11.699 356 H LEU 41 HN LEU 41 -1.083 -4.941 3.898 357 HA LEU 41 HA LEU 41 -2.490 -6.109 1.734 358 1HB LEU 41 HB2 LEU 41 -2.390 -3.691 1.975 359 2HB LEU 41 HB1 LEU 41 -0.647 -3.714 1.831 360 HG LEU 41 HG LEU 41 -0.860 -4.429 -0.525 361 1HD1 LEU 41 HD1 LEU 41 -3.820 -4.084 -0.104 362 2HD1 LEU 41 HD1 LEU 41 -3.016 -4.296 -1.659 363 3HD1 LEU 41 HD1 LEU 41 -2.965 -5.590 -0.463 364 1HD2 LEU 41 HD2 LEU 41 -0.635 -2.066 0.003 365 2HD2 LEU 41 HD2 LEU 41 -1.673 -2.302 -1.406 366 3HD2 LEU 41 HD2 LEU 41 -2.386 -1.924 0.162 367 H ILE 42 HN ILE 42 0.885 -5.703 2.481 368 HA ILE 42 HA ILE 42 1.842 -6.825 0.073 369 HB ILE 42 HB ILE 42 3.189 -6.487 2.774 370 1HG1 ILE 42 2HG1 ILE 42 3.423 -4.996 0.169 371 2HG1 ILE 42 1HG1 ILE 42 2.593 -4.423 1.608 372 1HG2 ILE 42 3HG2 ILE 42 4.418 -7.335 0.148 373 2HG2 ILE 42 2HG2 ILE 42 5.315 -6.919 1.608 374 3HG2 ILE 42 1HG2 ILE 42 4.256 -8.332 1.592 375 1HD1 ILE 42 HD1 ILE 42 5.542 -4.961 1.365 376 2HD1 ILE 42 HD1 ILE 42 4.769 -3.374 1.319 377 3HD1 ILE 42 HD1 ILE 42 4.695 -4.341 2.790 378 H ASN 43 HN ASN 43 1.494 -8.201 3.323 379 HA ASN 43 HA ASN 43 2.173 -10.855 2.836 380 1HB ASN 43 HB2 ASN 43 -0.067 -9.899 4.642 381 2HB ASN 43 HB1 ASN 43 0.654 -11.495 4.683 382 1HD2 ASN 43 HD2 ASN 43 0.427 -9.506 6.747 383 2HD2 ASN 43 HD2 ASN 43 2.002 -9.074 7.266 384 H LYS 44 HN LYS 44 -0.862 -9.216 2.278 385 HA LYS 44 HA LYS 44 -2.523 -11.335 1.581 386 1HB LYS 44 HB2 LYS 44 -3.296 -9.028 1.971 387 2HB LYS 44 HB1 LYS 44 -2.508 -8.516 0.491 388 1HG LYS 44 HG2 LYS 44 -4.045 -10.151 -0.725 389 2HG LYS 44 HG1 LYS 44 -4.906 -10.280 0.811 390 1HD LYS 44 HD2 LYS 44 -4.456 -7.696 -0.656 391 2HD LYS 44 HD1 LYS 44 -5.929 -8.662 -0.732 392 1HE LYS 44 HE2 LYS 44 -4.765 -7.406 1.764 393 2HE LYS 44 HE1 LYS 44 -6.121 -6.798 0.822 394 1HZ LYS 44 HZ1 LYS 44 -7.347 -8.822 1.353 395 2HZ LYS 44 HZ3 LYS 44 -6.054 -9.380 2.273 396 3HZ LYS 44 HZ2 LYS 44 -6.898 -7.999 2.739 397 H PHE 45 HN PHE 45 -0.274 -9.481 -0.371 398 HA PHE 45 HA PHE 45 -1.034 -10.985 -2.673 399 1HB PHE 45 HB2 PHE 45 0.759 -8.637 -2.284 400 2HB PHE 45 HB1 PHE 45 0.870 -9.585 -3.769 401 HD1 PHE 45 HD1 PHE 45 -1.295 -7.409 -1.754 402 HD2 PHE 45 HD2 PHE 45 -0.888 -9.635 -5.343 403 HE1 PHE 45 HE1 PHE 45 -3.303 -6.308 -2.661 404 HE2 PHE 45 HE2 PHE 45 -2.879 -8.560 -6.250 405 HZ PHE 45 HZ PHE 45 -4.100 -6.881 -4.913 406 H MET 46 HN MET 46 1.583 -10.896 -0.435 407 HA MET 46 HA MET 46 3.470 -12.489 -1.906 408 1HB MET 46 HB2 MET 46 3.201 -12.414 1.099 409 2HB MET 46 HB1 MET 46 4.618 -12.849 0.165 410 1HG MET 46 HG2 MET 46 4.589 -10.446 -0.697 411 2HG MET 46 HG1 MET 46 3.395 -10.160 0.551 412 1HE MET 46 HE3 MET 46 6.973 -10.925 -0.330 413 2HE MET 46 HE2 MET 46 7.772 -11.261 1.204 414 3HE MET 46 HE1 MET 46 6.617 -12.420 0.528 415 H ASN 47 HN ASN 47 0.715 -13.122 0.080 416 HA ASN 47 HA ASN 47 -0.633 -14.820 0.413 417 1HB ASN 47 HB2 ASN 47 -0.076 -15.675 -1.862 418 2HB ASN 47 HB1 ASN 47 1.240 -16.606 -1.162 419 1HD2 ASN 47 HD2 ASN 47 -2.074 -16.196 0.099 420 2HD2 ASN 47 HD2 ASN 47 -2.462 -17.875 0.010 421 H VAL 48 HN VAL 48 2.379 -14.659 1.271 422 HA VAL 48 HA VAL 48 2.074 -16.637 3.367 423 HB VAL 48 HB VAL 48 4.413 -16.069 4.079 424 1HG1 VAL 48 3HG1 VAL 48 3.928 -18.034 2.713 425 2HG1 VAL 48 2HG1 VAL 48 4.051 -17.066 1.245 426 3HG1 VAL 48 1HG1 VAL 48 5.483 -17.342 2.239 427 1HG2 VAL 48 2HG2 VAL 48 4.597 -13.879 3.068 428 2HG2 VAL 48 1HG2 VAL 48 5.890 -14.930 2.462 429 3HG2 VAL 48 3HG2 VAL 48 4.472 -14.589 1.457 430 H LYS 49 HN LYS 49 0.986 -16.053 4.866 431 HA LYS 49 HA LYS 49 1.054 -13.282 5.820 432 1HB LYS 49 HB2 LYS 49 -1.174 -15.337 5.825 433 2HB LYS 49 HB1 LYS 49 -1.294 -13.748 6.569 434 1HG LYS 49 HG2 LYS 49 -1.269 -12.634 4.516 435 2HG LYS 49 HG1 LYS 49 -0.587 -14.018 3.669 436 1HD LYS 49 HD2 LYS 49 -2.944 -13.678 3.097 437 2HD LYS 49 HD1 LYS 49 -2.692 -15.218 3.906 438 1HE LYS 49 HE2 LYS 49 -3.453 -14.179 6.014 439 2HE LYS 49 HE1 LYS 49 -3.791 -12.692 5.128 440 1HZ LYS 49 HZ3 LYS 49 -5.024 -15.329 4.579 441 2HZ LYS 49 HZ2 LYS 49 -5.764 -14.075 5.427 442 3HZ LYS 49 HZ1 LYS 49 -5.393 -13.887 3.782 443 H ASP 50 HN ASP 50 2.810 -15.343 6.484 444 HA ASP 50 HA ASP 50 3.943 -16.316 8.119 445 1HB ASP 50 HB2 ASP 50 3.438 -14.255 9.379 446 2HB ASP 50 HB1 ASP 50 2.028 -15.051 10.077 447 H LYS 51 HN LYS 51 3.968 -18.344 8.618 448 HA LYS 51 HA LYS 51 1.404 -19.604 9.279 449 1HB LYS 51 HB2 LYS 51 2.027 -21.555 7.968 450 2HB LYS 51 HB1 LYS 51 2.075 -20.124 6.954 451 1HG LYS 51 HG2 LYS 51 4.536 -20.063 7.212 452 2HG LYS 51 HG1 LYS 51 4.453 -21.555 8.146 453 1HD LYS 51 HD2 LYS 51 3.332 -22.621 6.163 454 2HD LYS 51 HD1 LYS 51 3.665 -21.147 5.256 455 1HE LYS 51 HE2 LYS 51 5.401 -22.702 4.722 456 2HE LYS 51 HE1 LYS 51 6.103 -21.490 5.792 457 1HZ LYS 51 HZ1 LYS 51 5.840 -23.074 7.645 458 2HZ LYS 51 HZ3 LYS 51 5.208 -24.213 6.580 459 3HZ LYS 51 HZ2 LYS 51 6.800 -23.697 6.431 460 H VAL 52 HN VAL 52 3.827 -18.607 10.805 461 HA VAL 52 HA VAL 52 4.590 -21.172 11.945 462 HB VAL 52 HB VAL 52 6.633 -20.166 12.797 463 1HG1 VAL 52 2HG1 VAL 52 6.231 -19.747 9.855 464 2HG1 VAL 52 1HG1 VAL 52 7.799 -19.856 10.656 465 3HG1 VAL 52 3HG1 VAL 52 6.704 -21.237 10.662 466 1HG2 VAL 52 2HG2 VAL 52 5.888 -17.845 13.059 467 2HG2 VAL 52 1HG2 VAL 52 7.374 -17.936 12.108 468 3HG2 VAL 52 3HG2 VAL 52 5.823 -17.672 11.308 469 H HIS 53 HN HIS 53 3.486 -17.972 12.725 470 HA HIS 53 HA HIS 53 2.577 -19.094 15.232 471 1HB HIS 53 HB2 HIS 53 4.113 -16.499 15.064 472 2HB HIS 53 HB1 HIS 53 3.009 -16.839 16.384 473 HD1 HIS 53 HD1 HIS 53 3.753 -18.702 18.094 474 HD2 HIS 53 HD2 HIS 53 6.549 -17.793 15.159 475 HE1 HIS 53 HE1 HIS 53 5.917 -19.736 18.852 476 H LYS 54 HN LYS 54 0.739 -19.300 14.023 477 HA LYS 54 HA LYS 54 -0.771 -16.836 13.619 478 1HB LYS 54 HB2 LYS 54 -0.928 -18.531 11.838 479 2HB LYS 54 HB1 LYS 54 -1.481 -19.720 13.015 480 1HG LYS 54 HG2 LYS 54 -3.424 -18.216 13.498 481 2HG LYS 54 HG1 LYS 54 -2.915 -17.220 12.140 482 1HD LYS 54 HD2 LYS 54 -3.225 -19.093 10.626 483 2HD LYS 54 HD1 LYS 54 -3.638 -20.140 11.991 484 1HE LYS 54 HE2 LYS 54 -5.538 -18.676 12.510 485 2HE LYS 54 HE1 LYS 54 -5.157 -17.702 11.095 486 1HZ LYS 54 HZ3 LYS 54 -5.570 -19.645 9.696 487 2HZ LYS 54 HZ2 LYS 54 -5.936 -20.570 11.070 488 3HZ LYS 54 HZ1 LYS 54 -6.928 -19.296 10.627 489 H LEU 55 HN LEU 55 -1.601 -16.123 15.519 490 HA LEU 55 HA LEU 55 -2.456 -17.976 17.501 491 1HB LEU 55 HB2 LEU 55 -2.899 -15.011 17.116 492 2HB LEU 55 HB1 LEU 55 -3.622 -15.895 18.443 493 HG LEU 55 HG LEU 55 -1.738 -14.709 19.227 494 1HD1 LEU 55 HD1 LEU 55 -2.075 -16.854 20.234 495 2HD1 LEU 55 HD1 LEU 55 -1.043 -17.621 19.026 496 3HD1 LEU 55 HD1 LEU 55 -0.357 -16.472 20.175 497 1HD2 LEU 55 HD2 LEU 55 -0.090 -16.072 17.103 498 2HD2 LEU 55 HD2 LEU 55 -0.458 -14.350 17.221 499 3HD2 LEU 55 HD2 LEU 55 0.573 -15.115 18.428 500 H GLU 56 HN GLU 56 -4.413 -18.881 17.678 501 HA GLU 56 HA GLU 56 -5.891 -19.199 15.371 502 1HB GLU 56 HB2 GLU 56 -7.592 -20.369 16.737 503 2HB GLU 56 HB1 GLU 56 -5.956 -20.913 17.049 504 1HG GLU 56 HG2 GLU 56 -5.913 -19.618 19.109 505 2HG GLU 56 HG1 GLU 56 -7.544 -19.033 18.781 506 H HIS 57 HN HIS 57 -6.555 -17.053 18.050 507 HA HIS 57 HA HIS 57 -8.740 -16.008 16.460 508 1HB HIS 57 HB2 HIS 57 -8.004 -15.527 19.343 509 2HB HIS 57 HB1 HIS 57 -9.187 -14.536 18.498 510 HD1 HIS 57 HD1 HIS 57 -9.085 -17.393 20.634 511 HD2 HIS 57 HD2 HIS 57 -11.265 -16.332 17.265 512 HE1 HIS 57 HE1 HIS 57 -11.158 -18.814 20.670 513 H HIS 58 HN HIS 58 -6.118 -14.560 18.371 514 HA HIS 58 HA HIS 58 -4.953 -12.668 18.168 515 1HB HIS 58 HB2 HIS 58 -4.121 -13.909 16.036 516 2HB HIS 58 HB1 HIS 58 -5.262 -12.927 15.151 517 HD1 HIS 58 HD1 HIS 58 -1.868 -12.799 16.695 518 HD2 HIS 58 HD2 HIS 58 -4.574 -10.159 14.973 519 HE1 HIS 58 HE1 HIS 58 -0.570 -10.714 16.166 520 H HIS 59 HN HIS 59 -6.915 -11.854 19.107 521 HA HIS 59 HA HIS 59 -8.451 -10.113 17.325 522 1HB HIS 59 HB2 HIS 59 -9.755 -11.793 18.615 523 2HB HIS 59 HB1 HIS 59 -9.125 -11.111 20.107 524 HD1 HIS 59 HD1 HIS 59 -10.624 -9.382 21.177 525 HD2 HIS 59 HD2 HIS 59 -11.303 -9.774 17.094 526 HE1 HIS 59 HE1 HIS 59 -12.602 -7.939 20.660 527 H HIS 60 HN HIS 60 -7.674 -8.115 17.326 528 HA HIS 60 HA HIS 60 -6.997 -6.997 19.901 529 1HB HIS 60 HB2 HIS 60 -4.929 -5.964 19.093 530 2HB HIS 60 HB1 HIS 60 -4.846 -7.703 18.903 531 HD1 HIS 60 HD1 HIS 60 -3.876 -4.776 17.267 532 HD2 HIS 60 HD2 HIS 60 -5.652 -8.300 15.976 533 HE1 HIS 60 HE1 HIS 60 -3.386 -4.949 14.794 534 H HIS 61 HN HIS 61 -7.992 -5.202 20.250 535 HA HIS 61 HA HIS 61 -9.116 -3.669 18.024 536 1HB HIS 61 HB2 HIS 61 -10.506 -4.264 20.037 537 2HB HIS 61 HB1 HIS 61 -9.420 -3.312 21.028 538 HD1 HIS 61 HD1 HIS 61 -10.313 -1.034 21.540 539 HD2 HIS 61 HD2 HIS 61 -11.788 -2.539 17.956 540 HE1 HIS 61 HE1 HIS 61 -12.000 0.640 20.725 541 H HIS 62 HN HIS 62 -6.479 -3.908 20.019 542 HA HIS 62 HA HIS 62 -5.442 -1.312 19.232 543 1HB HIS 62 HB2 HIS 62 -6.211 -1.246 21.641 544 2HB HIS 62 HB1 HIS 62 -5.161 -2.612 21.973 545 HD1 HIS 62 HD1 HIS 62 -3.151 -1.817 23.223 546 HD2 HIS 62 HD2 HIS 62 -4.444 0.949 20.402 547 HE1 HIS 62 HE1 HIS 62 -1.603 0.153 23.422 548 H1 MET 101 HT3 MET 101 6.220 25.183 -0.525 549 H2 MET 101 HT2 MET 101 6.768 26.102 -1.800 550 H3 MET 101 HT1 MET 101 5.138 26.188 -1.329 551 HA MET 101 HA MET 101 4.843 23.875 -1.897 552 1HB MET 101 HB2 MET 101 5.930 25.591 -4.145 553 2HB MET 101 HB1 MET 101 5.095 24.067 -4.400 554 1HG MET 101 HG2 MET 101 3.099 24.970 -3.349 555 2HG MET 101 HG1 MET 101 3.926 26.495 -3.059 556 1HE MET 101 HE2 MET 101 4.672 28.153 -4.944 557 2HE MET 101 HE1 MET 101 5.567 26.891 -5.790 558 3HE MET 101 HE3 MET 101 4.411 27.893 -6.668 559 H GLU 102 HN GLU 102 5.881 22.189 -1.379 560 HA GLU 102 HA GLU 102 8.476 21.573 -2.582 561 1HB GLU 102 HB2 GLU 102 7.798 21.406 0.359 562 2HB GLU 102 HB1 GLU 102 9.241 20.759 -0.399 563 1HG GLU 102 HG2 GLU 102 10.054 22.941 -0.889 564 2HG GLU 102 HG1 GLU 102 8.531 23.677 -0.383 565 H MET 103 HN MET 103 8.837 19.249 -1.162 566 HA MET 103 HA MET 103 8.247 17.154 -0.749 567 1HB MET 103 HB2 MET 103 5.409 18.177 -0.750 568 2HB MET 103 HB1 MET 103 5.842 16.522 -0.362 569 1HG MET 103 HG2 MET 103 7.153 17.295 1.539 570 2HG MET 103 HG1 MET 103 6.766 18.968 1.134 571 1HE MET 103 HE2 MET 103 5.971 19.328 3.611 572 2HE MET 103 HE1 MET 103 4.704 18.383 4.398 573 3HE MET 103 HE3 MET 103 6.258 17.640 4.035 574 H GLY 104 HN GLY 104 7.782 18.553 -3.584 575 1HA GLY 104 HA1 GLY 104 7.559 17.720 -5.708 576 2HA GLY 104 HA2 GLY 104 6.464 16.504 -5.037 577 H GLN 105 HN GLN 105 9.768 17.255 -4.192 578 HA GLN 105 HA GLN 105 10.855 14.947 -5.459 579 1HB GLN 105 HB2 GLN 105 12.930 15.489 -4.321 580 2HB GLN 105 HB1 GLN 105 12.248 16.852 -5.189 581 1HG GLN 105 HG2 GLN 105 11.511 17.883 -3.169 582 2HG GLN 105 HG1 GLN 105 11.903 16.445 -2.229 583 1HE2 GLN 105 1HE2 GLN 105 12.792 19.203 -2.029 584 2HE2 GLN 105 2HE2 GLN 105 14.523 19.145 -2.061 585 H LEU 106 HN LEU 106 9.375 15.579 -2.498 586 HA LEU 106 HA LEU 106 10.465 13.376 -1.022 587 1HB LEU 106 HB2 LEU 106 9.552 15.443 0.056 588 2HB LEU 106 HB1 LEU 106 7.975 15.064 -0.577 589 HG LEU 106 HG LEU 106 8.341 14.677 1.895 590 1HD1 LEU 106 HD1 LEU 106 7.410 12.336 0.280 591 2HD1 LEU 106 HD1 LEU 106 7.086 12.609 1.992 592 3HD1 LEU 106 HD1 LEU 106 6.444 13.724 0.784 593 1HD2 LEU 106 HD2 LEU 106 9.928 12.321 0.900 594 2HD2 LEU 106 HD2 LEU 106 10.556 13.703 1.804 595 3HD2 LEU 106 HD2 LEU 106 9.410 12.598 2.563 596 H LYS 107 HN LYS 107 7.431 14.085 -2.709 597 HA LYS 107 HA LYS 107 6.308 11.540 -2.624 598 1HB LYS 107 HB2 LYS 107 5.883 14.026 -4.083 599 2HB LYS 107 HB1 LYS 107 5.456 12.604 -5.024 600 1HG LYS 107 HG2 LYS 107 4.506 13.012 -2.215 601 2HG LYS 107 HG1 LYS 107 3.626 13.633 -3.613 602 1HD LYS 107 HD2 LYS 107 4.519 10.827 -3.636 603 2HD LYS 107 HD1 LYS 107 3.069 11.213 -2.653 604 1HE LYS 107 HE2 LYS 107 2.162 12.259 -4.779 605 2HE LYS 107 HE1 LYS 107 3.562 11.581 -5.610 606 1HZ LYS 107 HZ3 LYS 107 1.525 9.992 -4.142 607 2HZ LYS 107 HZ2 LYS 107 1.630 10.169 -5.819 608 3HZ LYS 107 HZ1 LYS 107 2.857 9.390 -4.989 609 H ASN 108 HN ASN 108 8.578 12.994 -4.772 610 HA ASN 108 HA ASN 108 8.782 11.160 -6.774 611 1HB ASN 108 HB2 ASN 108 9.968 13.230 -6.913 612 2HB ASN 108 HB1 ASN 108 10.838 12.890 -5.429 613 1HD2 ASN 108 HD2 ASN 108 10.710 12.439 -8.805 614 2HD2 ASN 108 HD2 ASN 108 12.253 11.668 -8.957 615 H LYS 109 HN LYS 109 10.561 11.237 -3.701 616 HA LYS 109 HA LYS 109 11.954 8.807 -4.142 617 1HB LYS 109 HB2 LYS 109 11.432 10.279 -1.549 618 2HB LYS 109 HB1 LYS 109 12.576 8.961 -1.753 619 1HG LYS 109 HG2 LYS 109 12.721 11.637 -3.134 620 2HG LYS 109 HG1 LYS 109 13.682 11.141 -1.743 621 1HD LYS 109 HD2 LYS 109 14.741 9.397 -3.051 622 2HD LYS 109 HD1 LYS 109 13.712 9.765 -4.433 623 1HE LYS 109 HE2 LYS 109 15.715 11.645 -3.193 624 2HE LYS 109 HE1 LYS 109 15.966 10.718 -4.668 625 1HZ LYS 109 HZ2 LYS 109 14.025 11.898 -5.619 626 2HZ LYS 109 HZ1 LYS 109 13.968 12.871 -4.229 627 3HZ LYS 109 HZ3 LYS 109 15.300 12.915 -5.258 628 H ILE 110 HN ILE 110 8.950 9.643 -2.566 629 HA ILE 110 HA ILE 110 8.365 7.175 -1.404 630 HB ILE 110 HB ILE 110 6.573 9.357 -2.471 631 1HG1 ILE 110 2HG1 ILE 110 7.266 8.454 0.319 632 2HG1 ILE 110 1HG1 ILE 110 7.918 9.872 -0.501 633 1HG2 ILE 110 3HG2 ILE 110 5.289 7.285 -2.649 634 2HG2 ILE 110 2HG2 ILE 110 5.668 6.893 -0.976 635 3HG2 ILE 110 1HG2 ILE 110 4.663 8.295 -1.345 636 1HD1 ILE 110 HD1 ILE 110 5.052 9.422 0.285 637 2HD1 ILE 110 HD1 ILE 110 6.216 10.460 1.109 638 3HD1 ILE 110 HD1 ILE 110 5.693 10.851 -0.528 639 H GLU 111 HN GLU 111 7.469 8.415 -4.601 640 HA GLU 111 HA GLU 111 6.157 6.135 -5.543 641 1HB GLU 111 HB2 GLU 111 7.743 8.175 -7.100 642 2HB GLU 111 HB1 GLU 111 6.634 7.005 -7.798 643 1HG GLU 111 HG2 GLU 111 5.938 9.245 -5.924 644 2HG GLU 111 HG1 GLU 111 5.553 9.154 -7.640 645 H ASN 112 HN ASN 112 9.547 7.049 -5.818 646 HA ASN 112 HA ASN 112 10.239 4.762 -7.315 647 1HB ASN 112 HB2 ASN 112 11.701 6.679 -7.423 648 2HB ASN 112 HB1 ASN 112 11.991 6.606 -5.688 649 1HD2 ASN 112 HD2 ASN 112 13.564 5.281 -4.930 650 2HD2 ASN 112 HD2 ASN 112 14.544 4.268 -5.919 651 H LYS 113 HN LYS 113 10.360 5.394 -3.844 652 HA LYS 113 HA LYS 113 11.710 3.024 -3.108 653 1HB LYS 113 HB2 LYS 113 11.290 5.122 -1.711 654 2HB LYS 113 HB1 LYS 113 9.676 4.506 -1.451 655 1HG LYS 113 HG2 LYS 113 11.088 3.991 0.457 656 2HG LYS 113 HG1 LYS 113 10.601 2.514 -0.371 657 1HD LYS 113 HD2 LYS 113 12.988 2.540 0.315 658 2HD LYS 113 HD1 LYS 113 12.765 2.323 -1.418 659 1HE LYS 113 HE2 LYS 113 13.325 4.581 -1.837 660 2HE LYS 113 HE1 LYS 113 13.362 4.978 -0.108 661 1HZ LYS 113 HZ1 LYS 113 15.188 3.112 -1.530 662 2HZ LYS 113 HZ3 LYS 113 15.578 4.679 -1.050 663 3HZ LYS 113 HZ2 LYS 113 15.267 3.525 0.120 664 H LYS 114 HN LYS 114 8.306 3.877 -3.293 665 HA LYS 114 HA LYS 114 6.977 1.594 -2.576 666 1HB LYS 114 HB2 LYS 114 6.006 3.784 -3.137 667 2HB LYS 114 HB1 LYS 114 6.431 3.541 -4.815 668 1HG LYS 114 HG2 LYS 114 4.912 1.523 -4.754 669 2HG LYS 114 HG1 LYS 114 4.345 2.102 -3.192 670 1HD LYS 114 HD2 LYS 114 2.817 2.970 -4.794 671 2HD LYS 114 HD1 LYS 114 3.868 4.324 -4.364 672 1HE LYS 114 HE2 LYS 114 5.250 3.845 -6.367 673 2HE LYS 114 HE1 LYS 114 4.135 2.525 -6.721 674 1HZ LYS 114 HZ2 LYS 114 2.350 4.294 -6.881 675 2HZ LYS 114 HZ1 LYS 114 3.551 5.457 -6.837 676 3HZ LYS 114 HZ3 LYS 114 3.499 4.326 -8.076 677 H LYS 115 HN LYS 115 8.128 2.604 -5.781 678 HA LYS 115 HA LYS 115 7.423 0.280 -7.177 679 1HB LYS 115 HB2 LYS 115 9.502 2.375 -7.798 680 2HB LYS 115 HB1 LYS 115 9.029 1.100 -8.918 681 1HG LYS 115 HG2 LYS 115 6.818 1.944 -9.084 682 2HG LYS 115 HG1 LYS 115 7.066 3.045 -7.737 683 1HD LYS 115 HD2 LYS 115 7.135 4.393 -9.667 684 2HD LYS 115 HD1 LYS 115 8.799 4.202 -9.170 685 1HE LYS 115 HE2 LYS 115 7.521 2.524 -11.336 686 2HE LYS 115 HE1 LYS 115 8.378 4.020 -11.660 687 1HZ LYS 115 HZ1 LYS 115 10.384 2.959 -10.661 688 2HZ LYS 115 HZ3 LYS 115 9.532 1.495 -10.567 689 3HZ LYS 115 HZ2 LYS 115 9.817 2.228 -12.045 690 H GLU 116 HN GLU 116 10.525 1.191 -5.690 691 HA GLU 116 HA GLU 116 11.991 -1.073 -6.401 692 1HB GLU 116 HB2 GLU 116 12.158 0.538 -3.830 693 2HB GLU 116 HB1 GLU 116 13.313 -0.698 -4.299 694 1HG GLU 116 HG2 GLU 116 13.758 0.690 -6.346 695 2HG GLU 116 HG1 GLU 116 12.772 1.946 -5.598 696 H LEU 117 HN LEU 117 9.740 -0.579 -3.794 697 HA LEU 117 HA LEU 117 10.142 -3.083 -2.553 698 1HB LEU 117 HB2 LEU 117 9.298 -1.350 -1.200 699 2HB LEU 117 HB1 LEU 117 8.053 -0.941 -2.345 700 HG LEU 117 HG LEU 117 7.235 -1.995 -0.209 701 1HD1 LEU 117 HD1 LEU 117 5.862 -1.803 -2.015 702 2HD1 LEU 117 HD1 LEU 117 6.431 -3.330 -2.679 703 3HD1 LEU 117 HD1 LEU 117 5.563 -3.311 -1.130 704 1HD2 LEU 117 HD2 LEU 117 8.470 -4.474 -1.351 705 2HD2 LEU 117 HD2 LEU 117 8.995 -3.637 0.114 706 3HD2 LEU 117 HD2 LEU 117 7.395 -4.388 0.047 707 H ILE 118 HN ILE 118 7.777 -1.897 -4.886 708 HA ILE 118 HA ILE 118 6.160 -4.131 -4.884 709 HB ILE 118 HB ILE 118 6.743 -2.321 -7.259 710 1HG1 ILE 118 2HG1 ILE 118 4.391 -2.262 -5.368 711 2HG1 ILE 118 1HG1 ILE 118 5.843 -1.304 -5.104 712 1HG2 ILE 118 2HG2 ILE 118 4.475 -4.284 -6.786 713 2HG2 ILE 118 1HG2 ILE 118 4.551 -3.132 -8.131 714 3HG2 ILE 118 3HG2 ILE 118 5.731 -4.433 -7.991 715 1HD1 ILE 118 HD1 ILE 118 5.455 -0.165 -7.225 716 2HD1 ILE 118 HD1 ILE 118 3.984 -1.113 -7.464 717 3HD1 ILE 118 HD1 ILE 118 4.108 0.021 -6.109 718 H GLN 119 HN GLN 119 9.039 -3.380 -6.746 719 HA GLN 119 HA GLN 119 9.190 -5.650 -8.359 720 1HB GLN 119 HB2 GLN 119 11.478 -4.122 -7.133 721 2HB GLN 119 HB1 GLN 119 11.569 -5.193 -8.521 722 1HG GLN 119 HG2 GLN 119 10.165 -3.680 -9.798 723 2HG GLN 119 HG1 GLN 119 10.007 -2.623 -8.397 724 1HE2 GLN 119 1HE2 GLN 119 12.928 -4.282 -9.377 725 2HE2 GLN 119 2HE2 GLN 119 13.812 -2.849 -9.767 726 H LEU 120 HN LEU 120 10.183 -5.071 -5.054 727 HA LEU 120 HA LEU 120 11.593 -7.498 -4.728 728 1HB LEU 120 HB2 LEU 120 10.433 -5.653 -2.648 729 2HB LEU 120 HB1 LEU 120 11.455 -7.032 -2.298 730 HG LEU 120 HG LEU 120 12.279 -4.584 -3.855 731 1HD1 LEU 120 HD1 LEU 120 12.005 -4.145 -1.487 732 2HD1 LEU 120 HD1 LEU 120 13.036 -5.521 -1.099 733 3HD1 LEU 120 HD1 LEU 120 13.708 -4.123 -1.942 734 1HD2 LEU 120 HD2 LEU 120 13.858 -7.025 -3.036 735 2HD2 LEU 120 HD2 LEU 120 13.452 -6.536 -4.680 736 3HD2 LEU 120 HD2 LEU 120 14.547 -5.549 -3.712 737 H VAL 121 HN VAL 121 8.213 -6.560 -3.566 738 HA VAL 121 HA VAL 121 7.682 -9.137 -2.726 739 HB VAL 121 HB VAL 121 5.487 -8.523 -2.532 740 1HG1 VAL 121 3HG1 VAL 121 7.017 -6.005 -2.294 741 2HG1 VAL 121 2HG1 VAL 121 5.410 -6.279 -1.611 742 3HG1 VAL 121 1HG1 VAL 121 6.789 -7.253 -1.063 743 1HG2 VAL 121 1HG2 VAL 121 4.966 -7.959 -4.758 744 2HG2 VAL 121 3HG2 VAL 121 4.336 -6.708 -3.685 745 3HG2 VAL 121 2HG2 VAL 121 5.815 -6.408 -4.635 746 H ALA 122 HN ALA 122 7.642 -7.743 -5.916 747 HA ALA 122 HA ALA 122 6.091 -9.753 -7.125 748 1HB ALA 122 HB2 ALA 122 6.785 -8.782 -9.225 749 2HB ALA 122 HB3 ALA 122 8.089 -7.900 -8.389 750 3HB ALA 122 HB1 ALA 122 6.402 -7.521 -8.053 751 H ARG 123 HN ARG 123 9.567 -9.344 -6.617 752 HA ARG 123 HA ARG 123 10.107 -11.766 -8.052 753 1HB ARG 123 HB2 ARG 123 12.459 -11.426 -7.451 754 2HB ARG 123 HB1 ARG 123 11.765 -10.029 -8.239 755 1HG ARG 123 HG2 ARG 123 11.449 -9.065 -5.948 756 2HG ARG 123 HG1 ARG 123 12.449 -10.398 -5.359 757 1HD ARG 123 HD2 ARG 123 13.817 -8.390 -5.752 758 2HD ARG 123 HD1 ARG 123 14.262 -9.701 -6.847 759 HE ARG 123 HE ARG 123 12.343 -8.188 -8.151 760 1HH1 ARG 123 1HH1 ARG 123 15.644 -7.627 -6.982 761 2HH1 ARG 123 2HH1 ARG 123 16.036 -6.516 -8.216 762 1HH2 ARG 123 1HH2 ARG 123 12.916 -6.676 -9.866 763 2HH2 ARG 123 2HH2 ARG 123 14.478 -6.005 -9.896 764 H HIS 124 HN HIS 124 8.876 -11.226 -5.117 765 HA HIS 124 HA HIS 124 9.912 -13.492 -3.735 766 1HB HIS 124 HB2 HIS 124 8.591 -11.926 -2.464 767 2HB HIS 124 HB1 HIS 124 7.221 -12.033 -3.546 768 HD1 HIS 124 HD1 HIS 124 5.770 -14.400 -3.285 769 HD2 HIS 124 HD2 HIS 124 8.710 -13.709 -0.438 770 HE1 HIS 124 HE1 HIS 124 5.329 -16.006 -1.431 771 H GLY 125 HN GLY 125 7.537 -12.886 -6.193 772 1HA GLY 125 HA1 GLY 125 7.004 -15.752 -6.410 773 2HA GLY 125 HA2 GLY 125 7.576 -14.841 -7.800 774 H LEU 126 HN LEU 126 6.098 -12.504 -7.621 775 HA LEU 126 HA LEU 126 3.349 -13.382 -7.418 776 1HB LEU 126 HB2 LEU 126 4.502 -10.672 -7.988 777 2HB LEU 126 HB1 LEU 126 2.796 -10.998 -8.034 778 HG LEU 126 HG LEU 126 4.628 -11.066 -5.767 779 1HD1 LEU 126 HD1 LEU 126 2.175 -9.406 -6.312 780 2HD1 LEU 126 HD1 LEU 126 3.088 -9.369 -4.806 781 3HD1 LEU 126 HD1 LEU 126 3.849 -8.865 -6.312 782 1HD2 LEU 126 HD2 LEU 126 1.810 -12.067 -5.828 783 2HD2 LEU 126 HD2 LEU 126 3.263 -12.958 -5.403 784 3HD2 LEU 126 HD2 LEU 126 2.671 -11.685 -4.337 785 H ASP 127 HN ASP 127 2.016 -13.473 -8.952 786 HA ASP 127 HA ASP 127 3.010 -13.765 -11.639 787 1HB ASP 127 HB2 ASP 127 0.201 -13.893 -10.519 788 2HB ASP 127 HB1 ASP 127 0.552 -14.091 -12.231 789 H HIS 128 HN HIS 128 1.928 -12.555 -13.412 790 HA HIS 128 HA HIS 128 2.543 -9.876 -13.176 791 1HB HIS 128 HB2 HIS 128 1.285 -9.497 -15.290 792 2HB HIS 128 HB1 HIS 128 2.447 -10.830 -15.356 793 HD1 HIS 128 HD1 HIS 128 1.364 -13.264 -15.616 794 HD2 HIS 128 HD2 HIS 128 -1.308 -10.082 -15.831 795 HE1 HIS 128 HE1 HIS 128 -0.740 -14.186 -16.613 796 H ASP 129 HN ASP 129 -0.564 -11.326 -12.934 797 HA ASP 129 HA ASP 129 -2.236 -9.129 -12.574 798 1HB ASP 129 HB2 ASP 129 -2.473 -11.723 -11.054 799 2HB ASP 129 HB1 ASP 129 -3.752 -10.562 -11.349 800 H LYS 130 HN LYS 130 -0.416 -10.953 -10.215 801 HA LYS 130 HA LYS 130 -1.413 -9.666 -7.957 802 1HB LYS 130 HB2 LYS 130 1.035 -11.289 -8.458 803 2HB LYS 130 HB1 LYS 130 0.743 -10.688 -6.853 804 1HG LYS 130 HG2 LYS 130 -1.072 -12.486 -8.474 805 2HG LYS 130 HG1 LYS 130 0.017 -13.029 -7.187 806 1HD LYS 130 HD2 LYS 130 -1.282 -11.664 -5.589 807 2HD LYS 130 HD1 LYS 130 -2.359 -11.172 -6.895 808 1HE LYS 130 HE2 LYS 130 -3.392 -12.946 -5.633 809 2HE LYS 130 HE1 LYS 130 -2.964 -13.549 -7.227 810 1HZ LYS 130 HZ1 LYS 130 -1.388 -14.029 -4.742 811 2HZ LYS 130 HZ3 LYS 130 -2.425 -15.120 -5.452 812 3HZ LYS 130 HZ2 LYS 130 -1.036 -14.664 -6.257 813 H VAL 131 HN VAL 131 1.474 -9.081 -9.895 814 HA VAL 131 HA VAL 131 2.563 -7.010 -8.313 815 HB VAL 131 HB VAL 131 2.836 -7.165 -11.322 816 1HG1 VAL 131 3HG1 VAL 131 3.810 -5.220 -10.332 817 2HG1 VAL 131 2HG1 VAL 131 4.738 -6.221 -9.216 818 3HG1 VAL 131 1HG1 VAL 131 5.062 -6.296 -10.948 819 1HG2 VAL 131 1HG2 VAL 131 4.310 -8.834 -9.293 820 2HG2 VAL 131 3HG2 VAL 131 3.146 -9.398 -10.490 821 3HG2 VAL 131 2HG2 VAL 131 4.693 -8.732 -11.020 822 H LEU 132 HN LEU 132 0.379 -7.021 -11.078 823 HA LEU 132 HA LEU 132 -0.101 -4.202 -11.380 824 1HB LEU 132 HB2 LEU 132 -1.938 -6.509 -11.929 825 2HB LEU 132 HB1 LEU 132 -2.081 -4.876 -12.552 826 HG LEU 132 HG LEU 132 0.145 -6.796 -13.204 827 1HD1 LEU 132 HD1 LEU 132 -1.958 -7.492 -14.114 828 2HD1 LEU 132 HD1 LEU 132 -2.198 -5.889 -14.821 829 3HD1 LEU 132 HD1 LEU 132 -0.876 -6.920 -15.388 830 1HD2 LEU 132 HD2 LEU 132 -0.495 -4.058 -14.302 831 2HD2 LEU 132 HD2 LEU 132 0.895 -4.495 -13.302 832 3HD2 LEU 132 HD2 LEU 132 0.734 -5.156 -14.930 833 H LEU 133 HN LEU 133 -2.078 -6.579 -9.724 834 HA LEU 133 HA LEU 133 -3.865 -4.635 -8.787 835 1HB LEU 133 HB2 LEU 133 -3.277 -7.364 -7.709 836 2HB LEU 133 HB1 LEU 133 -4.682 -6.387 -7.293 837 HG LEU 133 HG LEU 133 -4.031 -7.498 -10.027 838 1HD1 LEU 133 HD1 LEU 133 -6.097 -8.349 -8.020 839 2HD1 LEU 133 HD1 LEU 133 -5.955 -8.955 -9.670 840 3HD1 LEU 133 HD1 LEU 133 -4.658 -9.256 -8.513 841 1HD2 LEU 133 HD2 LEU 133 -6.450 -5.973 -9.051 842 2HD2 LEU 133 HD2 LEU 133 -5.245 -5.416 -10.217 843 3HD2 LEU 133 HD2 LEU 133 -6.302 -6.756 -10.626 844 H PHE 134 HN PHE 134 -0.925 -5.906 -7.373 845 HA PHE 134 HA PHE 134 -1.352 -4.599 -4.890 846 1HB PHE 134 HB2 PHE 134 0.119 -6.513 -4.994 847 2HB PHE 134 HB1 PHE 134 1.166 -5.705 -6.154 848 HD1 PHE 134 HD1 PHE 134 2.989 -4.490 -5.408 849 HD2 PHE 134 HD2 PHE 134 -0.113 -5.466 -2.670 850 HE1 PHE 134 HE1 PHE 134 4.353 -3.614 -3.542 851 HE2 PHE 134 HE2 PHE 134 1.253 -4.595 -0.819 852 HZ PHE 134 HZ PHE 134 3.491 -3.664 -1.287 853 H SER 135 HN SER 135 0.591 -3.755 -7.776 854 HA SER 135 HA SER 135 1.694 -1.459 -6.651 855 1HB SER 135 HB2 SER 135 2.153 -0.756 -9.049 856 2HB SER 135 HB1 SER 135 2.746 -2.350 -8.588 857 HG SER 135 HG SER 135 1.128 -3.291 -9.690 858 H ARG 136 HN ARG 136 -1.294 -1.808 -8.459 859 HA ARG 136 HA ARG 136 -1.913 0.967 -8.470 860 1HB ARG 136 HB2 ARG 136 -4.325 0.136 -8.834 861 2HB ARG 136 HB1 ARG 136 -3.115 -0.255 -10.051 862 1HG ARG 136 HG2 ARG 136 -2.911 -2.474 -9.245 863 2HG ARG 136 HG1 ARG 136 -3.899 -2.113 -7.840 864 1HD ARG 136 HD2 ARG 136 -4.983 -1.777 -10.575 865 2HD ARG 136 HD1 ARG 136 -4.852 -3.373 -9.879 866 HE ARG 136 HE ARG 136 -6.019 -1.937 -7.878 867 1HH1 ARG 136 1HH1 ARG 136 -6.997 -2.544 -11.238 868 2HH1 ARG 136 2HH1 ARG 136 -8.658 -2.413 -10.888 869 1HH2 ARG 136 1HH2 ARG 136 -8.246 -1.726 -7.460 870 2HH2 ARG 136 2HH2 ARG 136 -9.400 -1.926 -8.696 871 H ASP 137 HN ASP 137 -2.909 -1.655 -6.266 872 HA ASP 137 HA ASP 137 -4.496 0.181 -4.801 873 1HB ASP 137 HB2 ASP 137 -3.984 -2.709 -4.665 874 2HB ASP 137 HB1 ASP 137 -4.607 -1.951 -3.208 875 H LEU 138 HN LEU 138 -1.299 -1.023 -4.437 876 HA LEU 138 HA LEU 138 -0.807 -0.079 -1.832 877 1HB LEU 138 HB2 LEU 138 0.810 -1.493 -2.846 878 2HB LEU 138 HB1 LEU 138 0.921 -0.479 -4.264 879 HG LEU 138 HG LEU 138 2.138 1.213 -2.978 880 1HD1 LEU 138 HD1 LEU 138 1.942 -0.716 -0.687 881 2HD1 LEU 138 HD1 LEU 138 2.910 0.762 -0.755 882 3HD1 LEU 138 HD1 LEU 138 1.147 0.867 -0.814 883 1HD2 LEU 138 HD2 LEU 138 3.261 -1.554 -2.680 884 2HD2 LEU 138 HD2 LEU 138 3.378 -0.526 -4.105 885 3HD2 LEU 138 HD2 LEU 138 4.181 -0.050 -2.611 886 H ASP 139 HN ASP 139 -0.623 1.399 -5.003 887 HA ASP 139 HA ASP 139 0.370 3.919 -4.274 888 1HB ASP 139 HB2 ASP 139 0.193 2.976 -6.596 889 2HB ASP 139 HB1 ASP 139 -1.536 3.267 -6.525 890 H LYS 140 HN LYS 140 -2.913 2.687 -4.610 891 HA LYS 140 HA LYS 140 -4.290 5.045 -3.970 892 1HB LYS 140 HB2 LYS 140 -5.147 2.186 -3.532 893 2HB LYS 140 HB1 LYS 140 -6.198 3.591 -3.461 894 1HG LYS 140 HG2 LYS 140 -5.793 4.033 -5.824 895 2HG LYS 140 HG1 LYS 140 -4.687 2.659 -5.905 896 1HD LYS 140 HD2 LYS 140 -6.594 1.194 -5.209 897 2HD LYS 140 HD1 LYS 140 -7.646 2.603 -5.347 898 1HE LYS 140 HE2 LYS 140 -6.008 1.388 -7.577 899 2HE LYS 140 HE1 LYS 140 -7.740 1.185 -7.352 900 1HZ LYS 140 HZ1 LYS 140 -7.991 3.602 -7.685 901 2HZ LYS 140 HZ3 LYS 140 -6.329 3.731 -7.976 902 3HZ LYS 140 HZ2 LYS 140 -7.288 2.831 -9.005 903 H LEU 141 HN LEU 141 -3.185 2.365 -1.897 904 HA LEU 141 HA LEU 141 -4.291 3.305 0.508 905 1HB LEU 141 HB2 LEU 141 -3.484 1.020 0.316 906 2HB LEU 141 HB1 LEU 141 -1.849 1.584 0.042 907 HG LEU 141 HG LEU 141 -1.771 2.469 2.344 908 1HD1 LEU 141 HD1 LEU 141 -4.490 1.229 2.641 909 2HD1 LEU 141 HD1 LEU 141 -3.480 1.831 3.958 910 3HD1 LEU 141 HD1 LEU 141 -4.080 2.945 2.731 911 1HD2 LEU 141 HD2 LEU 141 -2.517 -0.445 2.142 912 2HD2 LEU 141 HD2 LEU 141 -0.907 0.248 1.939 913 3HD2 LEU 141 HD2 LEU 141 -1.705 0.305 3.514 914 H ILE 142 HN ILE 142 -1.223 3.913 -1.035 915 HA ILE 142 HA ILE 142 -0.101 5.437 1.076 916 HB ILE 142 HB ILE 142 0.521 5.494 -1.897 917 1HG1 ILE 142 2HG1 ILE 142 1.925 4.205 0.438 918 2HG1 ILE 142 1HG1 ILE 142 1.003 3.363 -0.802 919 1HG2 ILE 142 2HG2 ILE 142 2.058 6.764 0.368 920 2HG2 ILE 142 1HG2 ILE 142 2.610 6.650 -1.302 921 3HG2 ILE 142 3HG2 ILE 142 1.185 7.616 -0.908 922 1HD1 ILE 142 HD1 ILE 142 3.561 4.896 -1.210 923 2HD1 ILE 142 HD1 ILE 142 3.392 3.142 -1.165 924 3HD1 ILE 142 HD1 ILE 142 2.649 4.061 -2.472 925 H ASN 143 HN ASN 143 -1.699 6.476 -1.895 926 HA ASN 143 HA ASN 143 -1.696 9.214 -1.323 927 1HB ASN 143 HB2 ASN 143 -3.489 7.571 -3.069 928 2HB ASN 143 HB1 ASN 143 -3.738 9.300 -2.900 929 1HD2 ASN 143 HD2 ASN 143 -1.620 6.849 -4.196 930 2HD2 ASN 143 HD2 ASN 143 -0.659 7.897 -5.149 931 H LYS 144 HN LYS 144 -3.923 6.748 -0.338 932 HA LYS 144 HA LYS 144 -6.051 8.179 0.733 933 1HB LYS 144 HB2 LYS 144 -5.893 5.730 0.595 934 2HB LYS 144 HB1 LYS 144 -4.666 5.733 1.837 935 1HG LYS 144 HG2 LYS 144 -6.402 6.789 3.391 936 2HG LYS 144 HG1 LYS 144 -7.582 6.381 2.142 937 1HD LYS 144 HD2 LYS 144 -5.763 4.377 3.441 938 2HD LYS 144 HD1 LYS 144 -7.410 4.692 3.963 939 1HE LYS 144 HE2 LYS 144 -6.596 3.751 1.211 940 2HE LYS 144 HE1 LYS 144 -7.215 2.731 2.503 941 1HZ LYS 144 HZ3 LYS 144 -8.731 4.950 1.219 942 2HZ LYS 144 HZ2 LYS 144 -8.932 3.311 0.921 943 3HZ LYS 144 HZ1 LYS 144 -9.293 3.931 2.440 944 H PHE 145 HN PHE 145 -2.945 7.331 2.179 945 HA PHE 145 HA PHE 145 -3.537 8.741 4.608 946 1HB PHE 145 HB2 PHE 145 -1.351 6.960 3.699 947 2HB PHE 145 HB1 PHE 145 -1.056 8.032 5.062 948 HD1 PHE 145 HD1 PHE 145 -2.977 5.163 3.846 949 HD2 PHE 145 HD2 PHE 145 -2.198 7.741 7.137 950 HE1 PHE 145 HE1 PHE 145 -4.142 3.592 5.339 951 HE2 PHE 145 HE2 PHE 145 -3.360 6.173 8.644 952 HZ PHE 145 HZ PHE 145 -4.332 4.095 7.740 953 H MET 146 HN MET 146 -1.880 9.366 1.687 954 HA MET 146 HA MET 146 -0.286 11.528 2.715 955 1HB MET 146 HB2 MET 146 -1.100 11.051 -0.146 956 2HB MET 146 HB1 MET 146 0.199 12.090 0.407 957 1HG MET 146 HG2 MET 146 1.108 9.870 1.460 958 2HG MET 146 HG1 MET 146 0.036 9.130 0.285 959 1HE MET 146 HE3 MET 146 3.135 11.087 0.988 960 2HE MET 146 HE2 MET 146 3.653 11.755 -0.563 961 3HE MET 146 HE1 MET 146 2.188 12.364 0.231 962 H ASN 147 HN ASN 147 -3.451 11.124 2.312 963 HA ASN 147 HA ASN 147 -5.325 12.399 2.489 964 1HB ASN 147 HB2 ASN 147 -3.860 13.911 3.948 965 2HB ASN 147 HB1 ASN 147 -3.529 14.870 2.519 966 1HD2 ASN 147 HD2 ASN 147 -5.110 16.313 1.799 967 2HD2 ASN 147 HD2 ASN 147 -6.544 16.632 2.704 968 H VAL 148 HN VAL 148 -3.890 11.730 -0.033 969 HA VAL 148 HA VAL 148 -4.944 13.816 -1.808 970 HB VAL 148 HB VAL 148 -3.288 11.438 -2.575 971 1HG1 VAL 148 3HG1 VAL 148 -3.914 13.990 -4.066 972 2HG1 VAL 148 2HG1 VAL 148 -2.833 12.727 -4.649 973 3HG1 VAL 148 1HG1 VAL 148 -4.549 12.383 -4.421 974 1HG2 VAL 148 2HG2 VAL 148 -1.987 12.826 -1.060 975 2HG2 VAL 148 1HG2 VAL 148 -1.340 12.958 -2.702 976 3HG2 VAL 148 3HG2 VAL 148 -2.351 14.244 -2.036 977 H LYS 149 HN LYS 149 -6.876 13.531 -1.890 978 HA LYS 149 HA LYS 149 -7.943 11.031 -2.956 979 1HB LYS 149 HB2 LYS 149 -9.127 12.763 -0.786 980 2HB LYS 149 HB1 LYS 149 -9.985 11.460 -1.588 981 1HG LYS 149 HG2 LYS 149 -8.349 9.850 -0.723 982 2HG LYS 149 HG1 LYS 149 -7.488 11.165 0.077 983 1HD LYS 149 HD2 LYS 149 -10.347 10.359 0.630 984 2HD LYS 149 HD1 LYS 149 -8.958 9.897 1.607 985 1HE LYS 149 HE2 LYS 149 -8.524 12.294 2.062 986 2HE LYS 149 HE1 LYS 149 -9.954 12.711 1.116 987 1HZ LYS 149 HZ3 LYS 149 -11.297 11.437 2.696 988 2HZ LYS 149 HZ2 LYS 149 -9.941 11.099 3.613 989 3HZ LYS 149 HZ1 LYS 149 -10.476 12.675 3.472 990 H ASP 150 HN ASP 150 -7.068 13.452 -4.160 991 HA ASP 150 HA ASP 150 -9.374 15.109 -4.726 992 1HB ASP 150 HB2 ASP 150 -6.472 15.333 -5.552 993 2HB ASP 150 HB1 ASP 150 -7.714 16.436 -6.132 994 H LYS 151 HN LYS 151 -9.535 12.568 -5.527 995 HA LYS 151 HA LYS 151 -9.294 12.377 -8.440 996 1HB LYS 151 HB2 LYS 151 -10.251 10.119 -8.124 997 2HB LYS 151 HB1 LYS 151 -8.830 10.378 -7.125 998 1HG LYS 151 HG2 LYS 151 -10.309 10.826 -5.194 999 2HG LYS 151 HG1 LYS 151 -11.704 10.479 -6.212 1000 1HD LYS 151 HD2 LYS 151 -9.471 8.541 -5.602 1001 2HD LYS 151 HD1 LYS 151 -11.029 8.598 -4.780 1002 1HE LYS 151 HE2 LYS 151 -10.619 8.057 -7.731 1003 2HE LYS 151 HE1 LYS 151 -10.931 6.834 -6.506 1004 1HZ LYS 151 HZ1 LYS 151 -13.091 7.891 -6.075 1005 2HZ LYS 151 HZ3 LYS 151 -12.811 9.008 -7.306 1006 3HZ LYS 151 HZ2 LYS 151 -12.959 7.388 -7.666 1007 H VAL 152 HN VAL 152 -10.989 14.350 -7.149 1008 HA VAL 152 HA VAL 152 -13.730 13.503 -7.538 1009 HB VAL 152 HB VAL 152 -14.347 15.702 -6.658 1010 1HG1 VAL 152 2HG1 VAL 152 -13.838 13.921 -5.055 1011 2HG1 VAL 152 1HG1 VAL 152 -12.153 14.428 -5.030 1012 3HG1 VAL 152 3HG1 VAL 152 -13.406 15.503 -4.404 1013 1HG2 VAL 152 3HG2 VAL 152 -11.377 16.283 -6.604 1014 2HG2 VAL 152 2HG2 VAL 152 -12.566 17.057 -7.650 1015 3HG2 VAL 152 1HG2 VAL 152 -12.632 17.310 -5.906 1016 H HIS 153 HN HIS 153 -15.155 15.141 -8.692 1017 HA HIS 153 HA HIS 153 -13.895 15.979 -11.205 1018 1HB HIS 153 HB2 HIS 153 -16.803 15.321 -10.591 1019 2HB HIS 153 HB1 HIS 153 -16.207 15.885 -12.140 1020 HD1 HIS 153 HD1 HIS 153 -17.220 12.851 -10.572 1021 HD2 HIS 153 HD2 HIS 153 -14.107 13.921 -13.117 1022 HE1 HIS 153 HE1 HIS 153 -16.458 10.733 -11.656 1023 H LYS 154 HN LYS 154 -15.327 17.891 -12.108 1024 HA LYS 154 HA LYS 154 -15.320 19.949 -10.110 1025 1HB LYS 154 HB2 LYS 154 -16.267 20.014 -12.981 1026 2HB LYS 154 HB1 LYS 154 -16.116 21.418 -11.935 1027 1HG LYS 154 HG2 LYS 154 -13.875 19.614 -12.740 1028 2HG LYS 154 HG1 LYS 154 -14.234 21.177 -13.510 1029 1HD LYS 154 HD2 LYS 154 -13.881 22.227 -11.256 1030 2HD LYS 154 HD1 LYS 154 -13.384 20.646 -10.653 1031 1HE LYS 154 HE2 LYS 154 -12.044 22.196 -12.870 1032 2HE LYS 154 HE1 LYS 154 -11.448 22.039 -11.223 1033 1HZ LYS 154 HZ3 LYS 154 -11.239 19.620 -11.617 1034 2HZ LYS 154 HZ2 LYS 154 -11.723 19.844 -13.222 1035 3HZ LYS 154 HZ1 LYS 154 -10.306 20.531 -12.674 1036 H LEU 155 HN LEU 155 -16.762 19.782 -8.695 1037 HA LEU 155 HA LEU 155 -19.463 19.032 -9.446 1038 1HB LEU 155 HB2 LEU 155 -19.816 18.681 -6.931 1039 2HB LEU 155 HB1 LEU 155 -18.821 17.542 -7.804 1040 HG LEU 155 HG LEU 155 -16.798 18.677 -6.866 1041 1HD1 LEU 155 HD1 LEU 155 -17.742 20.851 -6.356 1042 2HD1 LEU 155 HD1 LEU 155 -18.783 20.119 -5.135 1043 3HD1 LEU 155 HD1 LEU 155 -17.032 20.118 -4.918 1044 1HD2 LEU 155 HD2 LEU 155 -17.658 16.637 -5.888 1045 2HD2 LEU 155 HD2 LEU 155 -17.007 17.699 -4.642 1046 3HD2 LEU 155 HD2 LEU 155 -18.752 17.566 -4.862 1047 H GLU 156 HN GLU 156 -21.258 20.031 -8.099 1048 HA GLU 156 HA GLU 156 -21.114 22.844 -8.719 1049 1HB GLU 156 HB2 GLU 156 -23.398 21.164 -7.698 1050 2HB GLU 156 HB1 GLU 156 -23.533 22.852 -8.173 1051 1HG GLU 156 HG2 GLU 156 -22.733 20.573 -9.975 1052 2HG GLU 156 HG1 GLU 156 -24.312 21.354 -9.928 1053 H HIS 157 HN HIS 157 -19.953 21.441 -6.222 1054 HA HIS 157 HA HIS 157 -19.339 21.980 -4.140 1055 1HB HIS 157 HB2 HIS 157 -20.332 24.739 -4.886 1056 2HB HIS 157 HB1 HIS 157 -19.374 24.398 -3.447 1057 HD1 HIS 157 HD1 HIS 157 -18.940 25.733 -6.688 1058 HD2 HIS 157 HD2 HIS 157 -16.853 22.953 -4.414 1059 HE1 HIS 157 HE1 HIS 157 -16.635 25.591 -7.707 1060 H HIS 158 HN HIS 158 -22.022 24.259 -3.854 1061 HA HIS 158 HA HIS 158 -23.083 22.442 -1.860 1062 1HB HIS 158 HB2 HIS 158 -23.519 25.374 -2.340 1063 2HB HIS 158 HB1 HIS 158 -24.751 24.452 -1.490 1064 HD1 HIS 158 HD1 HIS 158 -21.433 26.051 -0.972 1065 HD2 HIS 158 HD2 HIS 158 -23.900 23.316 0.951 1066 HE1 HIS 158 HE1 HIS 158 -20.565 25.857 1.375 1067 H HIS 159 HN HIS 159 -23.954 20.912 -2.911 1068 HA HIS 159 HA HIS 159 -25.502 21.205 -5.254 1069 1HB HIS 159 HB2 HIS 159 -25.289 18.848 -3.363 1070 2HB HIS 159 HB1 HIS 159 -26.051 18.802 -4.948 1071 HD1 HIS 159 HD1 HIS 159 -22.762 18.428 -3.307 1072 HD2 HIS 159 HD2 HIS 159 -24.216 19.258 -7.113 1073 HE1 HIS 159 HE1 HIS 159 -20.847 18.084 -4.870 1074 H HIS 160 HN HIS 160 -26.343 20.463 -1.923 1075 HA HIS 160 HA HIS 160 -28.714 21.982 -2.190 1076 1HB HIS 160 HB2 HIS 160 -30.353 20.210 -1.533 1077 2HB HIS 160 HB1 HIS 160 -29.661 19.930 -3.116 1078 HD1 HIS 160 HD1 HIS 160 -28.206 17.762 -3.379 1079 HD2 HIS 160 HD2 HIS 160 -29.817 18.295 0.408 1080 HE1 HIS 160 HE1 HIS 160 -27.891 15.573 -2.161 1081 H HIS 161 HN HIS 161 -27.101 19.567 -0.186 1082 HA HIS 161 HA HIS 161 -26.623 19.403 1.977 1083 1HB HIS 161 HB2 HIS 161 -25.537 21.655 1.631 1084 2HB HIS 161 HB1 HIS 161 -27.042 22.416 2.112 1085 HD1 HIS 161 HD1 HIS 161 -24.314 20.202 3.588 1086 HD2 HIS 161 HD2 HIS 161 -27.305 22.830 4.761 1087 HE1 HIS 161 HE1 HIS 161 -24.016 20.528 6.061 1088 H HIS 162 HN HIS 162 -29.146 21.878 1.874 1089 HA HIS 162 HA HIS 162 -31.156 20.127 2.778 1090 1HB HIS 162 HB2 HIS 162 -30.040 20.710 4.975 1091 2HB HIS 162 HB1 HIS 162 -30.369 22.406 4.626 1092 HD1 HIS 162 HD1 HIS 162 -32.841 23.225 4.941 1093 HD2 HIS 162 HD2 HIS 162 -32.248 19.187 5.725 1094 HE1 HIS 162 HE1 HIS 162 -34.944 22.409 6.043 No H/Q in entry = 1094
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