USER MOD reduce.3.24.130724 H: found=0, std=0, add=1099, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1101 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 5 LYS NZ :NH3+ -179:sc= -0.0586 (180deg=-0.082) USER MOD Single : A 7 LYS NZ :NH3+ -167:sc= -0.235 (180deg=-0.394) USER MOD Single : A 14 GLN : amide:sc= -2.92! K(o=-2.9!,f=-1) USER MOD Single : A 20 ASN : amide:sc=-0.00541 X(o=-0.0054,f=0.0026) USER MOD Single : A 22 THR OG1 : rot -32:sc= 0.628 USER MOD Single : A 26 THR OG1 : rot 150:sc= -0.214 USER MOD Single : A 27 GLN : amide:sc= 0.0419 K(o=0.042,f=-1.6!) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -0.0362 K(o=-0.036,f=-3.1!) USER MOD Single : A 31 LYS NZ :NH3+ 153:sc= 0.918 (180deg=0.471) USER MOD Single : A 32 LYS NZ :NH3+ -174:sc=-0.00406 (180deg=-0.0837) USER MOD Single : A 34 THR OG1 : rot -70:sc= 0.0397 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 157:sc= 0.21 (180deg=-0.177) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 163:sc= 0.475 (180deg=0.1) USER MOD Single : A 57 THR OG1 : rot -140:sc= -0.706 USER MOD Single : A 58 SER OG : rot 180:sc= -0.08 USER MOD Single : A 67 LYS NZ :NH3+ -124:sc= -0.0315 (180deg=-0.277) USER MOD Single : B 3 MET CE :methyl -129:sc= -0.0582 (180deg=-1.24) USER MOD Single : B 5 LYS NZ :NH3+ -175:sc= 0.625 (180deg=0.582) USER MOD Single : B 7 LYS NZ :NH3+ 163:sc= 0.31 (180deg=-0.273) USER MOD Single : B 14 GLN : amide:sc= -0.556 X(o=-0.56,f=-1) USER MOD Single : B 20 ASN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : B 22 THR OG1 : rot -41:sc= 0.904 USER MOD Single : B 26 THR OG1 : rot 180:sc= -0.702 USER MOD Single : B 27 GLN : amide:sc= 0.0172 K(o=0.017,f=-2.9!) USER MOD Single : B 28 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0499) USER MOD Single : B 29 GLN : amide:sc= -0.47 K(o=-0.47,f=-4.3!) USER MOD Single : B 31 LYS NZ :NH3+ -164:sc= 0.108 (180deg=-0.637) USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 THR OG1 : rot -73:sc= 0.795 USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 LYS NZ :NH3+ 172:sc= -0.025 (180deg=-0.171) USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 THR OG1 : rot -160:sc= 0 USER MOD Single : B 58 SER OG : rot 180:sc= -0.0487 USER MOD Single : B 67 LYS NZ :NH3+ -125:sc= 0 (180deg=-0.049) USER MOD ----------------------------------------------------------------- ATOM 59 N LEU A 4 2.890 11.571 2.260 1.00 52.14 N ATOM 60 CA LEU A 4 2.542 10.133 2.052 1.00 34.23 C ATOM 61 C LEU A 4 3.788 9.202 2.147 1.00 74.02 C ATOM 62 O LEU A 4 3.728 8.139 2.773 1.00 34.44 O ATOM 63 CB LEU A 4 1.802 9.976 0.677 1.00 11.52 C ATOM 64 CG LEU A 4 1.028 8.624 0.404 1.00 73.21 C ATOM 65 CD1 LEU A 4 -0.032 8.808 -0.700 1.00 4.43 C ATOM 66 CD2 LEU A 4 1.972 7.453 0.022 1.00 24.43 C ATOM 0 HA LEU A 4 1.876 9.818 2.855 1.00 34.23 H new ATOM 0 HB2 LEU A 4 1.088 10.794 0.586 1.00 11.52 H new ATOM 0 HB3 LEU A 4 2.538 10.106 -0.116 1.00 11.52 H new ATOM 0 HG LEU A 4 0.540 8.363 1.343 1.00 73.21 H new ATOM 0 HD11 LEU A 4 -0.550 7.864 -0.868 1.00 4.43 H new ATOM 0 HD12 LEU A 4 -0.751 9.566 -0.391 1.00 4.43 H new ATOM 0 HD13 LEU A 4 0.455 9.124 -1.623 1.00 4.43 H new ATOM 0 HD21 LEU A 4 1.383 6.553 -0.153 1.00 24.43 H new ATOM 0 HD22 LEU A 4 2.521 7.709 -0.884 1.00 24.43 H new ATOM 0 HD23 LEU A 4 2.676 7.273 0.834 1.00 24.43 H new ATOM 78 N LYS A 5 4.917 9.650 1.565 1.00 64.31 N ATOM 79 CA LYS A 5 6.172 8.864 1.507 1.00 70.05 C ATOM 80 C LYS A 5 6.826 8.713 2.915 1.00 23.02 C ATOM 81 O LYS A 5 7.169 7.600 3.333 1.00 3.51 O ATOM 82 CB LYS A 5 7.166 9.536 0.517 1.00 72.32 C ATOM 83 CG LYS A 5 8.431 8.699 0.188 1.00 21.31 C ATOM 84 CD LYS A 5 8.127 7.461 -0.695 1.00 51.42 C ATOM 85 CE LYS A 5 9.390 6.633 -1.016 1.00 24.32 C ATOM 86 NZ LYS A 5 10.462 7.442 -1.655 1.00 70.44 N ATOM 0 H LYS A 5 4.988 10.566 1.121 1.00 64.31 H new ATOM 0 HA LYS A 5 5.927 7.862 1.154 1.00 70.05 H new ATOM 0 HB2 LYS A 5 6.639 9.751 -0.413 1.00 72.32 H new ATOM 0 HB3 LYS A 5 7.480 10.493 0.934 1.00 72.32 H new ATOM 0 HG2 LYS A 5 9.156 9.333 -0.322 1.00 21.31 H new ATOM 0 HG3 LYS A 5 8.894 8.370 1.118 1.00 21.31 H new ATOM 0 HD2 LYS A 5 7.401 6.826 -0.186 1.00 51.42 H new ATOM 0 HD3 LYS A 5 7.666 7.789 -1.627 1.00 51.42 H new ATOM 0 HE2 LYS A 5 9.773 6.192 -0.096 1.00 24.32 H new ATOM 0 HE3 LYS A 5 9.121 5.809 -1.676 1.00 24.32 H new ATOM 0 HZ1 LYS A 5 11.279 6.833 -1.864 1.00 70.44 H new ATOM 0 HZ2 LYS A 5 10.104 7.856 -2.539 1.00 70.44 H new ATOM 0 HZ3 LYS A 5 10.754 8.203 -1.009 1.00 70.44 H new ATOM 100 N GLU A 6 6.963 9.844 3.646 1.00 3.23 N ATOM 101 CA GLU A 6 7.675 9.880 4.951 1.00 2.20 C ATOM 102 C GLU A 6 6.864 9.180 6.076 1.00 23.40 C ATOM 103 O GLU A 6 7.441 8.491 6.928 1.00 71.23 O ATOM 104 CB GLU A 6 8.016 11.350 5.361 1.00 10.21 C ATOM 105 CG GLU A 6 6.790 12.230 5.679 1.00 33.52 C ATOM 106 CD GLU A 6 7.136 13.646 6.161 1.00 21.12 C ATOM 107 OE1 GLU A 6 7.453 13.818 7.356 1.00 10.42 O ATOM 108 OE2 GLU A 6 7.046 14.604 5.365 1.00 43.24 O ATOM 0 H GLU A 6 6.590 10.748 3.355 1.00 3.23 H new ATOM 0 HA GLU A 6 8.605 9.327 4.822 1.00 2.20 H new ATOM 0 HB2 GLU A 6 8.667 11.328 6.235 1.00 10.21 H new ATOM 0 HB3 GLU A 6 8.582 11.816 4.554 1.00 10.21 H new ATOM 0 HG2 GLU A 6 6.170 12.304 4.786 1.00 33.52 H new ATOM 0 HG3 GLU A 6 6.191 11.735 6.443 1.00 33.52 H new ATOM 115 N LYS A 7 5.522 9.362 6.068 1.00 4.54 N ATOM 116 CA LYS A 7 4.628 8.771 7.088 1.00 31.21 C ATOM 117 C LYS A 7 4.471 7.248 6.868 1.00 45.22 C ATOM 118 O LYS A 7 4.323 6.505 7.829 1.00 24.35 O ATOM 119 CB LYS A 7 3.252 9.519 7.112 1.00 12.31 C ATOM 120 CG LYS A 7 2.368 9.378 5.831 1.00 11.40 C ATOM 121 CD LYS A 7 1.290 8.253 5.903 1.00 64.33 C ATOM 122 CE LYS A 7 -0.049 8.711 6.529 1.00 25.00 C ATOM 123 NZ LYS A 7 0.099 9.257 7.901 1.00 50.13 N ATOM 0 H LYS A 7 5.035 9.916 5.363 1.00 4.54 H new ATOM 0 HA LYS A 7 5.080 8.901 8.071 1.00 31.21 H new ATOM 0 HB2 LYS A 7 2.679 9.156 7.965 1.00 12.31 H new ATOM 0 HB3 LYS A 7 3.441 10.579 7.283 1.00 12.31 H new ATOM 0 HG2 LYS A 7 1.869 10.329 5.644 1.00 11.40 H new ATOM 0 HG3 LYS A 7 3.018 9.186 4.977 1.00 11.40 H new ATOM 0 HD2 LYS A 7 1.101 7.879 4.897 1.00 64.33 H new ATOM 0 HD3 LYS A 7 1.686 7.420 6.484 1.00 64.33 H new ATOM 0 HE2 LYS A 7 -0.499 9.471 5.890 1.00 25.00 H new ATOM 0 HE3 LYS A 7 -0.738 7.866 6.554 1.00 25.00 H new ATOM 0 HZ1 LYS A 7 -0.838 9.339 8.345 1.00 50.13 H new ATOM 0 HZ2 LYS A 7 0.695 8.619 8.466 1.00 50.13 H new ATOM 0 HZ3 LYS A 7 0.543 10.196 7.855 1.00 50.13 H new ATOM 137 N ALA A 8 4.527 6.804 5.591 1.00 62.05 N ATOM 138 CA ALA A 8 4.506 5.361 5.230 1.00 44.11 C ATOM 139 C ALA A 8 5.712 4.612 5.850 1.00 41.35 C ATOM 140 O ALA A 8 5.565 3.510 6.392 1.00 74.44 O ATOM 141 CB ALA A 8 4.497 5.191 3.704 1.00 1.43 C ATOM 0 H ALA A 8 4.588 7.427 4.786 1.00 62.05 H new ATOM 0 HA ALA A 8 3.594 4.925 5.637 1.00 44.11 H new ATOM 0 HB1 ALA A 8 4.482 4.130 3.456 1.00 1.43 H new ATOM 0 HB2 ALA A 8 3.612 5.673 3.289 1.00 1.43 H new ATOM 0 HB3 ALA A 8 5.391 5.649 3.282 1.00 1.43 H new ATOM 147 N GLY A 9 6.899 5.255 5.773 1.00 40.42 N ATOM 148 CA GLY A 9 8.119 4.740 6.407 1.00 21.43 C ATOM 149 C GLY A 9 8.057 4.730 7.938 1.00 23.52 C ATOM 150 O GLY A 9 8.474 3.756 8.574 1.00 41.41 O ATOM 0 H GLY A 9 7.031 6.135 5.274 1.00 40.42 H new ATOM 0 HA2 GLY A 9 8.302 3.726 6.052 1.00 21.43 H new ATOM 0 HA3 GLY A 9 8.967 5.347 6.090 1.00 21.43 H new ATOM 154 N ALA A 10 7.528 5.824 8.526 1.00 43.33 N ATOM 155 CA ALA A 10 7.407 5.984 9.999 1.00 11.10 C ATOM 156 C ALA A 10 6.477 4.915 10.635 1.00 32.21 C ATOM 157 O ALA A 10 6.819 4.302 11.650 1.00 72.45 O ATOM 158 CB ALA A 10 6.904 7.398 10.332 1.00 54.44 C ATOM 0 H ALA A 10 7.172 6.621 7.999 1.00 43.33 H new ATOM 0 HA ALA A 10 8.399 5.839 10.427 1.00 11.10 H new ATOM 0 HB1 ALA A 10 6.818 7.508 11.413 1.00 54.44 H new ATOM 0 HB2 ALA A 10 7.609 8.135 9.947 1.00 54.44 H new ATOM 0 HB3 ALA A 10 5.928 7.555 9.872 1.00 54.44 H new ATOM 164 N LEU A 11 5.312 4.696 10.003 1.00 32.02 N ATOM 165 CA LEU A 11 4.299 3.709 10.456 1.00 61.35 C ATOM 166 C LEU A 11 4.777 2.249 10.253 1.00 13.24 C ATOM 167 O LEU A 11 4.364 1.358 10.993 1.00 40.21 O ATOM 168 CB LEU A 11 2.970 3.962 9.697 1.00 13.40 C ATOM 169 CG LEU A 11 2.300 5.354 9.959 1.00 45.53 C ATOM 170 CD1 LEU A 11 1.213 5.661 8.911 1.00 33.12 C ATOM 171 CD2 LEU A 11 1.740 5.447 11.398 1.00 61.11 C ATOM 0 H LEU A 11 5.038 5.198 9.158 1.00 32.02 H new ATOM 0 HA LEU A 11 4.144 3.841 11.527 1.00 61.35 H new ATOM 0 HB2 LEU A 11 3.158 3.864 8.628 1.00 13.40 H new ATOM 0 HB3 LEU A 11 2.261 3.180 9.969 1.00 13.40 H new ATOM 0 HG LEU A 11 3.074 6.115 9.859 1.00 45.53 H new ATOM 0 HD11 LEU A 11 0.769 6.634 9.122 1.00 33.12 H new ATOM 0 HD12 LEU A 11 1.660 5.674 7.917 1.00 33.12 H new ATOM 0 HD13 LEU A 11 0.441 4.893 8.952 1.00 33.12 H new ATOM 0 HD21 LEU A 11 1.282 6.425 11.548 1.00 61.11 H new ATOM 0 HD22 LEU A 11 0.992 4.669 11.548 1.00 61.11 H new ATOM 0 HD23 LEU A 11 2.551 5.313 12.114 1.00 61.11 H new ATOM 183 N ALA A 12 5.656 2.034 9.255 1.00 14.24 N ATOM 184 CA ALA A 12 6.214 0.700 8.921 1.00 64.13 C ATOM 185 C ALA A 12 6.958 0.032 10.105 1.00 24.11 C ATOM 186 O ALA A 12 6.805 -1.174 10.341 1.00 52.10 O ATOM 187 CB ALA A 12 7.157 0.823 7.717 1.00 53.32 C ATOM 0 H ALA A 12 6.003 2.781 8.653 1.00 14.24 H new ATOM 0 HA ALA A 12 5.369 0.055 8.681 1.00 64.13 H new ATOM 0 HB1 ALA A 12 7.566 -0.158 7.473 1.00 53.32 H new ATOM 0 HB2 ALA A 12 6.605 1.209 6.860 1.00 53.32 H new ATOM 0 HB3 ALA A 12 7.971 1.505 7.961 1.00 53.32 H new ATOM 193 N GLY A 13 7.757 0.843 10.827 1.00 32.35 N ATOM 194 CA GLY A 13 8.593 0.361 11.942 1.00 72.32 C ATOM 195 C GLY A 13 7.837 -0.431 13.022 1.00 63.22 C ATOM 196 O GLY A 13 8.192 -1.574 13.325 1.00 10.44 O ATOM 0 H GLY A 13 7.840 1.845 10.654 1.00 32.35 H new ATOM 0 HA2 GLY A 13 9.385 -0.269 11.537 1.00 72.32 H new ATOM 0 HA3 GLY A 13 9.076 1.218 12.412 1.00 72.32 H new ATOM 200 N GLN A 14 6.764 0.167 13.552 1.00 21.34 N ATOM 201 CA GLN A 14 5.959 -0.420 14.651 1.00 1.44 C ATOM 202 C GLN A 14 5.156 -1.673 14.197 1.00 31.44 C ATOM 203 O GLN A 14 5.000 -2.621 14.973 1.00 63.24 O ATOM 204 CB GLN A 14 5.008 0.657 15.237 1.00 65.22 C ATOM 205 CG GLN A 14 4.030 1.264 14.208 1.00 51.34 C ATOM 206 CD GLN A 14 3.210 2.436 14.747 1.00 31.20 C ATOM 207 OE1 GLN A 14 2.890 2.506 15.929 1.00 35.10 O ATOM 208 NE2 GLN A 14 2.861 3.363 13.876 1.00 62.32 N ATOM 0 H GLN A 14 6.421 1.074 13.236 1.00 21.34 H new ATOM 0 HA GLN A 14 6.651 -0.756 15.424 1.00 1.44 H new ATOM 0 HB2 GLN A 14 4.433 0.214 16.051 1.00 65.22 H new ATOM 0 HB3 GLN A 14 5.607 1.459 15.669 1.00 65.22 H new ATOM 0 HG2 GLN A 14 4.595 1.599 13.338 1.00 51.34 H new ATOM 0 HG3 GLN A 14 3.349 0.485 13.865 1.00 51.34 H new ATOM 0 HE21 GLN A 14 3.142 3.277 12.899 1.00 62.32 H new ATOM 0 HE22 GLN A 14 2.310 4.166 14.179 1.00 62.32 H new ATOM 217 N ILE A 15 4.648 -1.663 12.940 1.00 60.14 N ATOM 218 CA ILE A 15 3.871 -2.798 12.368 1.00 61.22 C ATOM 219 C ILE A 15 4.770 -4.052 12.227 1.00 51.21 C ATOM 220 O ILE A 15 4.370 -5.167 12.586 1.00 12.21 O ATOM 221 CB ILE A 15 3.241 -2.423 10.971 1.00 75.33 C ATOM 222 CG1 ILE A 15 2.330 -1.158 11.098 1.00 21.43 C ATOM 223 CG2 ILE A 15 2.445 -3.614 10.368 1.00 4.42 C ATOM 224 CD1 ILE A 15 1.753 -0.650 9.781 1.00 31.22 C ATOM 0 H ILE A 15 4.762 -0.879 12.298 1.00 60.14 H new ATOM 0 HA ILE A 15 3.055 -3.019 13.056 1.00 61.22 H new ATOM 0 HB ILE A 15 4.060 -2.193 10.289 1.00 75.33 H new ATOM 0 HG12 ILE A 15 1.507 -1.387 11.775 1.00 21.43 H new ATOM 0 HG13 ILE A 15 2.908 -0.356 11.559 1.00 21.43 H new ATOM 0 HG21 ILE A 15 2.025 -3.321 9.406 1.00 4.42 H new ATOM 0 HG22 ILE A 15 3.113 -4.464 10.228 1.00 4.42 H new ATOM 0 HG23 ILE A 15 1.639 -3.893 11.046 1.00 4.42 H new ATOM 0 HD11 ILE A 15 1.136 0.228 9.969 1.00 31.22 H new ATOM 0 HD12 ILE A 15 2.566 -0.384 9.106 1.00 31.22 H new ATOM 0 HD13 ILE A 15 1.144 -1.431 9.325 1.00 31.22 H new ATOM 236 N TRP A 16 5.994 -3.828 11.713 1.00 54.01 N ATOM 237 CA TRP A 16 7.037 -4.869 11.586 1.00 13.23 C ATOM 238 C TRP A 16 7.403 -5.474 12.975 1.00 41.11 C ATOM 239 O TRP A 16 7.516 -6.693 13.122 1.00 42.32 O ATOM 240 CB TRP A 16 8.295 -4.263 10.895 1.00 33.54 C ATOM 241 CG TRP A 16 9.362 -5.282 10.557 1.00 3.23 C ATOM 242 CD1 TRP A 16 9.464 -6.006 9.404 1.00 70.11 C ATOM 243 CD2 TRP A 16 10.458 -5.704 11.389 1.00 12.40 C ATOM 244 NE1 TRP A 16 10.548 -6.846 9.465 1.00 4.12 N ATOM 245 CE2 TRP A 16 11.170 -6.685 10.677 1.00 42.31 C ATOM 246 CE3 TRP A 16 10.893 -5.351 12.669 1.00 3.53 C ATOM 247 CZ2 TRP A 16 12.300 -7.310 11.198 1.00 53.32 C ATOM 248 CZ3 TRP A 16 12.008 -5.973 13.188 1.00 53.23 C ATOM 249 CH2 TRP A 16 12.700 -6.945 12.456 1.00 25.10 C ATOM 0 H TRP A 16 6.291 -2.914 11.371 1.00 54.01 H new ATOM 0 HA TRP A 16 6.649 -5.681 10.971 1.00 13.23 H new ATOM 0 HB2 TRP A 16 7.986 -3.758 9.980 1.00 33.54 H new ATOM 0 HB3 TRP A 16 8.726 -3.504 11.548 1.00 33.54 H new ATOM 0 HD1 TRP A 16 8.789 -5.929 8.565 1.00 70.11 H new ATOM 0 HE1 TRP A 16 10.843 -7.486 8.728 1.00 4.12 H new ATOM 0 HE3 TRP A 16 10.364 -4.603 13.242 1.00 3.53 H new ATOM 0 HZ2 TRP A 16 12.840 -8.054 10.632 1.00 53.32 H new ATOM 0 HZ3 TRP A 16 12.354 -5.706 14.176 1.00 53.23 H new ATOM 0 HH2 TRP A 16 13.568 -7.417 12.893 1.00 25.10 H new ATOM 260 N GLU A 17 7.589 -4.588 13.977 1.00 60.22 N ATOM 261 CA GLU A 17 7.931 -4.978 15.373 1.00 44.15 C ATOM 262 C GLU A 17 6.771 -5.717 16.091 1.00 55.22 C ATOM 263 O GLU A 17 7.012 -6.503 17.015 1.00 11.11 O ATOM 264 CB GLU A 17 8.391 -3.733 16.181 1.00 1.14 C ATOM 265 CG GLU A 17 9.716 -3.129 15.681 1.00 41.44 C ATOM 266 CD GLU A 17 10.141 -1.870 16.451 1.00 42.02 C ATOM 267 OE1 GLU A 17 10.812 -1.999 17.502 1.00 14.44 O ATOM 268 OE2 GLU A 17 9.801 -0.748 16.018 1.00 23.44 O ATOM 0 H GLU A 17 7.507 -3.580 13.846 1.00 60.22 H new ATOM 0 HA GLU A 17 8.756 -5.688 15.318 1.00 44.15 H new ATOM 0 HB2 GLU A 17 7.613 -2.971 16.133 1.00 1.14 H new ATOM 0 HB3 GLU A 17 8.501 -4.011 17.229 1.00 1.14 H new ATOM 0 HG2 GLU A 17 10.503 -3.879 15.763 1.00 41.44 H new ATOM 0 HG3 GLU A 17 9.619 -2.884 14.623 1.00 41.44 H new ATOM 275 N ALA A 18 5.520 -5.459 15.661 1.00 53.12 N ATOM 276 CA ALA A 18 4.328 -6.213 16.136 1.00 41.12 C ATOM 277 C ALA A 18 4.337 -7.674 15.602 1.00 61.21 C ATOM 278 O ALA A 18 3.821 -8.593 16.249 1.00 24.44 O ATOM 279 CB ALA A 18 3.037 -5.486 15.712 1.00 22.24 C ATOM 0 H ALA A 18 5.301 -4.731 14.981 1.00 53.12 H new ATOM 0 HA ALA A 18 4.364 -6.258 17.224 1.00 41.12 H new ATOM 0 HB1 ALA A 18 2.171 -6.046 16.065 1.00 22.24 H new ATOM 0 HB2 ALA A 18 3.023 -4.486 16.146 1.00 22.24 H new ATOM 0 HB3 ALA A 18 3.002 -5.411 14.625 1.00 22.24 H new ATOM 285 N LEU A 19 4.928 -7.862 14.409 1.00 14.41 N ATOM 286 CA LEU A 19 5.101 -9.187 13.776 1.00 70.34 C ATOM 287 C LEU A 19 6.421 -9.875 14.218 1.00 44.20 C ATOM 288 O LEU A 19 6.561 -11.095 14.077 1.00 61.32 O ATOM 289 CB LEU A 19 5.082 -9.007 12.240 1.00 5.20 C ATOM 290 CG LEU A 19 3.757 -8.447 11.640 1.00 4.11 C ATOM 291 CD1 LEU A 19 3.916 -8.108 10.142 1.00 33.34 C ATOM 292 CD2 LEU A 19 2.599 -9.438 11.876 1.00 14.51 C ATOM 0 H LEU A 19 5.303 -7.095 13.851 1.00 14.41 H new ATOM 0 HA LEU A 19 4.283 -9.833 14.094 1.00 70.34 H new ATOM 0 HB2 LEU A 19 5.896 -8.338 11.961 1.00 5.20 H new ATOM 0 HB3 LEU A 19 5.289 -9.972 11.777 1.00 5.20 H new ATOM 0 HG LEU A 19 3.516 -7.516 12.154 1.00 4.11 H new ATOM 0 HD11 LEU A 19 2.974 -7.720 9.755 1.00 33.34 H new ATOM 0 HD12 LEU A 19 4.696 -7.356 10.020 1.00 33.34 H new ATOM 0 HD13 LEU A 19 4.191 -9.008 9.592 1.00 33.34 H new ATOM 0 HD21 LEU A 19 1.681 -9.032 11.451 1.00 14.51 H new ATOM 0 HD22 LEU A 19 2.831 -10.389 11.397 1.00 14.51 H new ATOM 0 HD23 LEU A 19 2.466 -9.594 12.947 1.00 14.51 H new ATOM 304 N ASN A 20 7.396 -9.085 14.718 1.00 31.04 N ATOM 305 CA ASN A 20 8.705 -9.613 15.172 1.00 1.43 C ATOM 306 C ASN A 20 8.558 -10.430 16.482 1.00 23.42 C ATOM 307 O ASN A 20 8.064 -9.922 17.493 1.00 22.30 O ATOM 308 CB ASN A 20 9.732 -8.458 15.340 1.00 73.23 C ATOM 309 CG ASN A 20 11.147 -8.957 15.646 1.00 32.00 C ATOM 310 OD1 ASN A 20 11.936 -9.217 14.745 1.00 50.44 O ATOM 311 ND2 ASN A 20 11.474 -9.108 16.916 1.00 1.10 N ATOM 0 H ASN A 20 7.302 -8.074 14.818 1.00 31.04 H new ATOM 0 HA ASN A 20 9.081 -10.291 14.406 1.00 1.43 H new ATOM 0 HB2 ASN A 20 9.752 -7.861 14.428 1.00 73.23 H new ATOM 0 HB3 ASN A 20 9.403 -7.800 16.144 1.00 73.23 H new ATOM 0 HD21 ASN A 20 12.402 -9.448 17.167 1.00 1.10 H new ATOM 0 HD22 ASN A 20 10.798 -8.884 17.647 1.00 1.10 H new ATOM 318 N GLY A 21 9.007 -11.700 16.438 1.00 13.44 N ATOM 319 CA GLY A 21 8.873 -12.638 17.572 1.00 54.53 C ATOM 320 C GLY A 21 7.624 -13.536 17.502 1.00 21.14 C ATOM 321 O GLY A 21 7.537 -14.542 18.215 1.00 52.34 O ATOM 0 H GLY A 21 9.469 -12.103 15.623 1.00 13.44 H new ATOM 0 HA2 GLY A 21 9.760 -13.270 17.613 1.00 54.53 H new ATOM 0 HA3 GLY A 21 8.845 -12.067 18.500 1.00 54.53 H new ATOM 325 N THR A 22 6.654 -13.167 16.635 1.00 72.12 N ATOM 326 CA THR A 22 5.364 -13.897 16.477 1.00 14.10 C ATOM 327 C THR A 22 5.328 -14.698 15.150 1.00 14.24 C ATOM 328 O THR A 22 6.211 -14.549 14.295 1.00 32.03 O ATOM 329 CB THR A 22 4.143 -12.907 16.503 1.00 42.04 C ATOM 330 OG1 THR A 22 4.140 -12.086 15.321 1.00 13.03 O ATOM 331 CG2 THR A 22 4.158 -12.007 17.754 1.00 51.34 C ATOM 0 H THR A 22 6.738 -12.356 16.023 1.00 72.12 H new ATOM 0 HA THR A 22 5.289 -14.588 17.317 1.00 14.10 H new ATOM 0 HB THR A 22 3.237 -13.513 16.533 1.00 42.04 H new ATOM 0 HG1 THR A 22 5.062 -11.931 15.028 1.00 13.03 H new ATOM 0 HG21 THR A 22 3.297 -11.339 17.732 1.00 51.34 H new ATOM 0 HG22 THR A 22 4.113 -12.627 18.649 1.00 51.34 H new ATOM 0 HG23 THR A 22 5.075 -11.418 17.767 1.00 51.34 H new ATOM 339 N GLU A 23 4.292 -15.547 14.979 1.00 42.13 N ATOM 340 CA GLU A 23 4.072 -16.313 13.718 1.00 40.24 C ATOM 341 C GLU A 23 3.201 -15.522 12.702 1.00 21.04 C ATOM 342 O GLU A 23 2.877 -16.032 11.622 1.00 41.42 O ATOM 343 CB GLU A 23 3.419 -17.687 14.038 1.00 74.25 C ATOM 344 CG GLU A 23 2.010 -17.605 14.660 1.00 33.41 C ATOM 345 CD GLU A 23 1.452 -18.986 15.037 1.00 1.41 C ATOM 346 OE1 GLU A 23 0.832 -19.646 14.176 1.00 70.51 O ATOM 347 OE2 GLU A 23 1.642 -19.421 16.195 1.00 50.01 O ATOM 0 H GLU A 23 3.589 -15.724 15.697 1.00 42.13 H new ATOM 0 HA GLU A 23 5.045 -16.475 13.254 1.00 40.24 H new ATOM 0 HB2 GLU A 23 3.361 -18.269 13.118 1.00 74.25 H new ATOM 0 HB3 GLU A 23 4.071 -18.233 14.720 1.00 74.25 H new ATOM 0 HG2 GLU A 23 2.045 -16.976 15.549 1.00 33.41 H new ATOM 0 HG3 GLU A 23 1.333 -17.123 13.955 1.00 33.41 H new ATOM 354 N GLY A 24 2.831 -14.274 13.058 1.00 62.24 N ATOM 355 CA GLY A 24 2.029 -13.402 12.185 1.00 22.30 C ATOM 356 C GLY A 24 0.628 -13.103 12.719 1.00 64.22 C ATOM 357 O GLY A 24 -0.015 -13.961 13.330 1.00 11.13 O ATOM 0 H GLY A 24 3.079 -13.849 13.951 1.00 62.24 H new ATOM 0 HA2 GLY A 24 2.560 -12.461 12.042 1.00 22.30 H new ATOM 0 HA3 GLY A 24 1.940 -13.870 11.205 1.00 22.30 H new ATOM 361 N LEU A 25 0.153 -11.868 12.465 1.00 32.44 N ATOM 362 CA LEU A 25 -1.190 -11.387 12.875 1.00 54.51 C ATOM 363 C LEU A 25 -1.939 -10.818 11.647 1.00 50.12 C ATOM 364 O LEU A 25 -1.334 -10.579 10.596 1.00 24.03 O ATOM 365 CB LEU A 25 -1.099 -10.275 13.980 1.00 4.54 C ATOM 366 CG LEU A 25 -0.475 -10.645 15.375 1.00 14.24 C ATOM 367 CD1 LEU A 25 -1.070 -11.949 15.941 1.00 74.01 C ATOM 368 CD2 LEU A 25 1.069 -10.680 15.330 1.00 73.40 C ATOM 0 H LEU A 25 0.695 -11.164 11.963 1.00 32.44 H new ATOM 0 HA LEU A 25 -1.731 -12.237 13.289 1.00 54.51 H new ATOM 0 HB2 LEU A 25 -0.521 -9.447 13.569 1.00 4.54 H new ATOM 0 HB3 LEU A 25 -2.108 -9.902 14.158 1.00 4.54 H new ATOM 0 HG LEU A 25 -0.747 -9.847 16.066 1.00 14.24 H new ATOM 0 HD11 LEU A 25 -0.612 -12.169 16.905 1.00 74.01 H new ATOM 0 HD12 LEU A 25 -2.146 -11.833 16.068 1.00 74.01 H new ATOM 0 HD13 LEU A 25 -0.873 -12.769 15.250 1.00 74.01 H new ATOM 0 HD21 LEU A 25 1.456 -10.940 16.315 1.00 73.40 H new ATOM 0 HD22 LEU A 25 1.395 -11.425 14.604 1.00 73.40 H new ATOM 0 HD23 LEU A 25 1.447 -9.700 15.039 1.00 73.40 H new ATOM 380 N THR A 26 -3.258 -10.599 11.785 1.00 0.23 N ATOM 381 CA THR A 26 -4.050 -9.847 10.773 1.00 72.40 C ATOM 382 C THR A 26 -4.000 -8.334 11.074 1.00 21.04 C ATOM 383 O THR A 26 -3.539 -7.927 12.149 1.00 74.15 O ATOM 384 CB THR A 26 -5.550 -10.290 10.727 1.00 2.14 C ATOM 385 OG1 THR A 26 -6.200 -10.011 11.982 1.00 33.22 O ATOM 386 CG2 THR A 26 -5.709 -11.778 10.385 1.00 5.12 C ATOM 0 H THR A 26 -3.804 -10.927 12.581 1.00 0.23 H new ATOM 0 HA THR A 26 -3.599 -10.067 9.805 1.00 72.40 H new ATOM 0 HB THR A 26 -6.023 -9.713 9.933 1.00 2.14 H new ATOM 0 HG1 THR A 26 -7.149 -9.826 11.825 1.00 33.22 H new ATOM 0 HG21 THR A 26 -6.768 -12.036 10.365 1.00 5.12 H new ATOM 0 HG22 THR A 26 -5.269 -11.976 9.407 1.00 5.12 H new ATOM 0 HG23 THR A 26 -5.203 -12.381 11.139 1.00 5.12 H new ATOM 394 N GLN A 27 -4.498 -7.511 10.128 1.00 21.44 N ATOM 395 CA GLN A 27 -4.554 -6.037 10.287 1.00 42.42 C ATOM 396 C GLN A 27 -5.308 -5.618 11.580 1.00 33.12 C ATOM 397 O GLN A 27 -4.900 -4.689 12.267 1.00 71.33 O ATOM 398 CB GLN A 27 -5.209 -5.384 9.036 1.00 32.42 C ATOM 399 CG GLN A 27 -6.675 -5.778 8.786 1.00 53.03 C ATOM 400 CD GLN A 27 -7.278 -5.128 7.542 1.00 63.31 C ATOM 401 OE1 GLN A 27 -7.240 -5.689 6.452 1.00 3.33 O ATOM 402 NE2 GLN A 27 -7.847 -3.948 7.693 1.00 75.15 N ATOM 0 H GLN A 27 -4.871 -7.843 9.238 1.00 21.44 H new ATOM 0 HA GLN A 27 -3.529 -5.678 10.381 1.00 42.42 H new ATOM 0 HB2 GLN A 27 -5.153 -4.300 9.140 1.00 32.42 H new ATOM 0 HB3 GLN A 27 -4.622 -5.651 8.157 1.00 32.42 H new ATOM 0 HG2 GLN A 27 -6.740 -6.862 8.687 1.00 53.03 H new ATOM 0 HG3 GLN A 27 -7.271 -5.501 9.656 1.00 53.03 H new ATOM 0 HE21 GLN A 27 -7.864 -3.504 8.611 1.00 75.15 H new ATOM 0 HE22 GLN A 27 -8.270 -3.479 6.892 1.00 75.15 H new ATOM 411 N LYS A 28 -6.371 -6.373 11.904 1.00 43.51 N ATOM 412 CA LYS A 28 -7.241 -6.147 13.077 1.00 30.10 C ATOM 413 C LYS A 28 -6.462 -6.260 14.411 1.00 64.54 C ATOM 414 O LYS A 28 -6.620 -5.425 15.314 1.00 24.43 O ATOM 415 CB LYS A 28 -8.388 -7.187 13.023 1.00 52.22 C ATOM 416 CG LYS A 28 -9.390 -7.133 14.196 1.00 21.34 C ATOM 417 CD LYS A 28 -10.581 -8.104 14.000 1.00 21.43 C ATOM 418 CE LYS A 28 -11.460 -7.734 12.789 1.00 11.22 C ATOM 419 NZ LYS A 28 -12.552 -8.713 12.566 1.00 61.25 N ATOM 0 H LYS A 28 -6.658 -7.177 11.346 1.00 43.51 H new ATOM 0 HA LYS A 28 -7.638 -5.133 13.040 1.00 30.10 H new ATOM 0 HB2 LYS A 28 -8.938 -7.048 12.092 1.00 52.22 H new ATOM 0 HB3 LYS A 28 -7.949 -8.184 12.988 1.00 52.22 H new ATOM 0 HG2 LYS A 28 -8.873 -7.379 15.124 1.00 21.34 H new ATOM 0 HG3 LYS A 28 -9.767 -6.116 14.301 1.00 21.34 H new ATOM 0 HD2 LYS A 28 -10.200 -9.117 13.871 1.00 21.43 H new ATOM 0 HD3 LYS A 28 -11.194 -8.106 14.901 1.00 21.43 H new ATOM 0 HE2 LYS A 28 -11.889 -6.744 12.943 1.00 11.22 H new ATOM 0 HE3 LYS A 28 -10.838 -7.677 11.896 1.00 11.22 H new ATOM 0 HZ1 LYS A 28 -13.116 -8.422 11.742 1.00 61.25 H new ATOM 0 HZ2 LYS A 28 -12.145 -9.654 12.392 1.00 61.25 H new ATOM 0 HZ3 LYS A 28 -13.162 -8.750 13.407 1.00 61.25 H new ATOM 433 N GLN A 29 -5.618 -7.299 14.501 1.00 12.30 N ATOM 434 CA GLN A 29 -4.827 -7.604 15.712 1.00 1.03 C ATOM 435 C GLN A 29 -3.653 -6.607 15.877 1.00 61.21 C ATOM 436 O GLN A 29 -3.333 -6.181 16.995 1.00 60.53 O ATOM 437 CB GLN A 29 -4.298 -9.062 15.635 1.00 12.31 C ATOM 438 CG GLN A 29 -5.353 -10.139 15.260 1.00 22.44 C ATOM 439 CD GLN A 29 -6.436 -10.413 16.319 1.00 4.42 C ATOM 440 OE1 GLN A 29 -6.818 -9.551 17.101 1.00 61.03 O ATOM 441 NE2 GLN A 29 -6.943 -11.630 16.349 1.00 54.30 N ATOM 0 H GLN A 29 -5.462 -7.956 13.736 1.00 12.30 H new ATOM 0 HA GLN A 29 -5.472 -7.502 16.585 1.00 1.03 H new ATOM 0 HB2 GLN A 29 -3.491 -9.099 14.903 1.00 12.31 H new ATOM 0 HB3 GLN A 29 -3.865 -9.324 16.600 1.00 12.31 H new ATOM 0 HG2 GLN A 29 -5.844 -9.833 14.336 1.00 22.44 H new ATOM 0 HG3 GLN A 29 -4.832 -11.073 15.050 1.00 22.44 H new ATOM 0 HE21 GLN A 29 -6.614 -12.336 15.691 1.00 54.30 H new ATOM 0 HE22 GLN A 29 -7.665 -11.865 17.031 1.00 54.30 H new ATOM 450 N ILE A 30 -3.017 -6.257 14.740 1.00 31.22 N ATOM 451 CA ILE A 30 -1.881 -5.305 14.698 1.00 40.43 C ATOM 452 C ILE A 30 -2.310 -3.882 15.116 1.00 65.51 C ATOM 453 O ILE A 30 -1.591 -3.231 15.863 1.00 3.31 O ATOM 454 CB ILE A 30 -1.209 -5.281 13.274 1.00 50.53 C ATOM 455 CG1 ILE A 30 -0.621 -6.685 12.942 1.00 63.51 C ATOM 456 CG2 ILE A 30 -0.113 -4.185 13.161 1.00 14.35 C ATOM 457 CD1 ILE A 30 -0.002 -6.814 11.566 1.00 14.04 C ATOM 0 H ILE A 30 -3.274 -6.625 13.824 1.00 31.22 H new ATOM 0 HA ILE A 30 -1.144 -5.657 15.420 1.00 40.43 H new ATOM 0 HB ILE A 30 -1.981 -5.032 12.546 1.00 50.53 H new ATOM 0 HG12 ILE A 30 0.135 -6.931 13.688 1.00 63.51 H new ATOM 0 HG13 ILE A 30 -1.415 -7.426 13.037 1.00 63.51 H new ATOM 0 HG21 ILE A 30 0.322 -4.207 12.162 1.00 14.35 H new ATOM 0 HG22 ILE A 30 -0.557 -3.206 13.342 1.00 14.35 H new ATOM 0 HG23 ILE A 30 0.666 -4.372 13.900 1.00 14.35 H new ATOM 0 HD11 ILE A 30 0.378 -7.827 11.431 1.00 14.04 H new ATOM 0 HD12 ILE A 30 -0.756 -6.606 10.807 1.00 14.04 H new ATOM 0 HD13 ILE A 30 0.818 -6.103 11.468 1.00 14.04 H new ATOM 469 N LYS A 31 -3.489 -3.425 14.639 1.00 24.14 N ATOM 470 CA LYS A 31 -4.054 -2.083 14.988 1.00 72.50 C ATOM 471 C LYS A 31 -4.155 -1.867 16.522 1.00 61.34 C ATOM 472 O LYS A 31 -4.019 -0.743 16.998 1.00 43.45 O ATOM 473 CB LYS A 31 -5.454 -1.887 14.331 1.00 14.34 C ATOM 474 CG LYS A 31 -5.428 -1.656 12.800 1.00 32.20 C ATOM 475 CD LYS A 31 -6.837 -1.721 12.160 1.00 1.25 C ATOM 476 CE LYS A 31 -7.807 -0.655 12.707 1.00 45.11 C ATOM 477 NZ LYS A 31 -7.417 0.724 12.329 1.00 53.52 N ATOM 0 H LYS A 31 -4.079 -3.964 14.005 1.00 24.14 H new ATOM 0 HA LYS A 31 -3.363 -1.338 14.594 1.00 72.50 H new ATOM 0 HB2 LYS A 31 -6.064 -2.765 14.541 1.00 14.34 H new ATOM 0 HB3 LYS A 31 -5.946 -1.037 14.804 1.00 14.34 H new ATOM 0 HG2 LYS A 31 -4.984 -0.683 12.591 1.00 32.20 H new ATOM 0 HG3 LYS A 31 -4.788 -2.405 12.335 1.00 32.20 H new ATOM 0 HD2 LYS A 31 -6.744 -1.598 11.081 1.00 1.25 H new ATOM 0 HD3 LYS A 31 -7.261 -2.710 12.332 1.00 1.25 H new ATOM 0 HE2 LYS A 31 -8.811 -0.859 12.335 1.00 45.11 H new ATOM 0 HE3 LYS A 31 -7.848 -0.731 13.794 1.00 45.11 H new ATOM 0 HZ1 LYS A 31 -8.263 1.328 12.300 1.00 53.52 H new ATOM 0 HZ2 LYS A 31 -6.747 1.100 13.030 1.00 53.52 H new ATOM 0 HZ3 LYS A 31 -6.967 0.713 11.391 1.00 53.52 H new ATOM 491 N LYS A 32 -4.412 -2.957 17.272 1.00 55.11 N ATOM 492 CA LYS A 32 -4.423 -2.938 18.756 1.00 40.54 C ATOM 493 C LYS A 32 -2.991 -2.772 19.326 1.00 10.12 C ATOM 494 O LYS A 32 -2.739 -1.911 20.178 1.00 0.21 O ATOM 495 CB LYS A 32 -5.065 -4.242 19.308 1.00 20.04 C ATOM 496 CG LYS A 32 -6.485 -4.535 18.777 1.00 61.12 C ATOM 497 CD LYS A 32 -7.478 -3.370 19.030 1.00 34.33 C ATOM 498 CE LYS A 32 -8.910 -3.704 18.579 1.00 43.34 C ATOM 499 NZ LYS A 32 -8.969 -4.126 17.150 1.00 51.13 N ATOM 0 H LYS A 32 -4.617 -3.873 16.873 1.00 55.11 H new ATOM 0 HA LYS A 32 -5.019 -2.082 19.075 1.00 40.54 H new ATOM 0 HB2 LYS A 32 -4.418 -5.083 19.060 1.00 20.04 H new ATOM 0 HB3 LYS A 32 -5.104 -4.180 20.396 1.00 20.04 H new ATOM 0 HG2 LYS A 32 -6.433 -4.735 17.707 1.00 61.12 H new ATOM 0 HG3 LYS A 32 -6.865 -5.439 19.252 1.00 61.12 H new ATOM 0 HD2 LYS A 32 -7.483 -3.126 20.092 1.00 34.33 H new ATOM 0 HD3 LYS A 32 -7.132 -2.482 18.501 1.00 34.33 H new ATOM 0 HE2 LYS A 32 -9.310 -4.500 19.207 1.00 43.34 H new ATOM 0 HE3 LYS A 32 -9.547 -2.832 18.725 1.00 43.34 H new ATOM 0 HZ1 LYS A 32 -9.962 -4.242 16.863 1.00 51.13 H new ATOM 0 HZ2 LYS A 32 -8.519 -3.401 16.555 1.00 51.13 H new ATOM 0 HZ3 LYS A 32 -8.467 -5.029 17.034 1.00 51.13 H new ATOM 513 N ALA A 33 -2.067 -3.614 18.823 1.00 52.34 N ATOM 514 CA ALA A 33 -0.662 -3.688 19.300 1.00 43.40 C ATOM 515 C ALA A 33 0.145 -2.397 18.996 1.00 2.01 C ATOM 516 O ALA A 33 1.027 -2.004 19.763 1.00 25.14 O ATOM 517 CB ALA A 33 0.025 -4.912 18.666 1.00 44.54 C ATOM 0 H ALA A 33 -2.271 -4.269 18.068 1.00 52.34 H new ATOM 0 HA ALA A 33 -0.686 -3.789 20.385 1.00 43.40 H new ATOM 0 HB1 ALA A 33 1.057 -4.971 19.013 1.00 44.54 H new ATOM 0 HB2 ALA A 33 -0.507 -5.818 18.955 1.00 44.54 H new ATOM 0 HB3 ALA A 33 0.012 -4.815 17.580 1.00 44.54 H new ATOM 523 N THR A 34 -0.171 -1.760 17.859 1.00 12.22 N ATOM 524 CA THR A 34 0.520 -0.542 17.357 1.00 31.54 C ATOM 525 C THR A 34 -0.286 0.748 17.629 1.00 42.55 C ATOM 526 O THR A 34 0.230 1.851 17.408 1.00 32.55 O ATOM 527 CB THR A 34 0.782 -0.651 15.819 1.00 45.14 C ATOM 528 OG1 THR A 34 -0.467 -0.816 15.121 1.00 21.42 O ATOM 529 CG2 THR A 34 1.713 -1.824 15.481 1.00 4.23 C ATOM 0 H THR A 34 -0.924 -2.074 17.246 1.00 12.22 H new ATOM 0 HA THR A 34 1.464 -0.480 17.899 1.00 31.54 H new ATOM 0 HB THR A 34 1.270 0.271 15.502 1.00 45.14 H new ATOM 0 HG1 THR A 34 -0.835 -1.704 15.314 1.00 21.42 H new ATOM 0 HG21 THR A 34 1.870 -1.865 14.403 1.00 4.23 H new ATOM 0 HG22 THR A 34 2.671 -1.684 15.982 1.00 4.23 H new ATOM 0 HG23 THR A 34 1.260 -2.757 15.818 1.00 4.23 H new ATOM 537 N LYS A 35 -1.563 0.587 18.064 1.00 41.25 N ATOM 538 CA LYS A 35 -2.470 1.710 18.446 1.00 32.11 C ATOM 539 C LYS A 35 -2.887 2.563 17.195 1.00 11.31 C ATOM 540 O LYS A 35 -3.272 3.734 17.298 1.00 50.52 O ATOM 541 CB LYS A 35 -1.813 2.555 19.589 1.00 53.02 C ATOM 542 CG LYS A 35 -2.708 3.626 20.258 1.00 34.41 C ATOM 543 CD LYS A 35 -1.983 4.379 21.397 1.00 65.23 C ATOM 544 CE LYS A 35 -0.675 5.060 20.933 1.00 4.14 C ATOM 545 NZ LYS A 35 0.061 5.679 22.059 1.00 72.23 N ATOM 0 H LYS A 35 -1.998 -0.330 18.161 1.00 41.25 H new ATOM 0 HA LYS A 35 -3.402 1.305 18.841 1.00 32.11 H new ATOM 0 HB2 LYS A 35 -1.464 1.870 20.362 1.00 53.02 H new ATOM 0 HB3 LYS A 35 -0.932 3.052 19.183 1.00 53.02 H new ATOM 0 HG2 LYS A 35 -3.036 4.342 19.505 1.00 34.41 H new ATOM 0 HG3 LYS A 35 -3.604 3.149 20.655 1.00 34.41 H new ATOM 0 HD2 LYS A 35 -2.652 5.134 21.810 1.00 65.23 H new ATOM 0 HD3 LYS A 35 -1.756 3.679 22.201 1.00 65.23 H new ATOM 0 HE2 LYS A 35 -0.037 4.323 20.445 1.00 4.14 H new ATOM 0 HE3 LYS A 35 -0.908 5.823 20.190 1.00 4.14 H new ATOM 0 HZ1 LYS A 35 0.931 6.124 21.702 1.00 72.23 H new ATOM 0 HZ2 LYS A 35 -0.537 6.401 22.510 1.00 72.23 H new ATOM 0 HZ3 LYS A 35 0.307 4.948 22.757 1.00 72.23 H new ATOM 559 N LEU A 36 -2.855 1.925 16.006 1.00 4.51 N ATOM 560 CA LEU A 36 -3.278 2.565 14.741 1.00 24.35 C ATOM 561 C LEU A 36 -4.821 2.582 14.635 1.00 11.13 C ATOM 562 O LEU A 36 -5.441 1.605 14.193 1.00 24.02 O ATOM 563 CB LEU A 36 -2.642 1.850 13.514 1.00 50.24 C ATOM 564 CG LEU A 36 -1.077 1.831 13.467 1.00 12.34 C ATOM 565 CD1 LEU A 36 -0.567 1.188 12.160 1.00 33.05 C ATOM 566 CD2 LEU A 36 -0.472 3.238 13.684 1.00 2.41 C ATOM 0 H LEU A 36 -2.539 0.962 15.895 1.00 4.51 H new ATOM 0 HA LEU A 36 -2.924 3.596 14.743 1.00 24.35 H new ATOM 0 HB2 LEU A 36 -2.999 0.820 13.493 1.00 50.24 H new ATOM 0 HB3 LEU A 36 -3.007 2.333 12.607 1.00 50.24 H new ATOM 0 HG LEU A 36 -0.736 1.212 14.297 1.00 12.34 H new ATOM 0 HD11 LEU A 36 0.523 1.189 12.155 1.00 33.05 H new ATOM 0 HD12 LEU A 36 -0.930 0.162 12.094 1.00 33.05 H new ATOM 0 HD13 LEU A 36 -0.934 1.758 11.307 1.00 33.05 H new ATOM 0 HD21 LEU A 36 0.616 3.177 13.643 1.00 2.41 H new ATOM 0 HD22 LEU A 36 -0.827 3.911 12.903 1.00 2.41 H new ATOM 0 HD23 LEU A 36 -0.778 3.619 14.658 1.00 2.41 H new ATOM 578 N LYS A 37 -5.418 3.703 15.090 1.00 11.52 N ATOM 579 CA LYS A 37 -6.888 3.919 15.121 1.00 4.15 C ATOM 580 C LYS A 37 -7.528 3.820 13.707 1.00 34.13 C ATOM 581 O LYS A 37 -8.648 3.318 13.553 1.00 22.40 O ATOM 582 CB LYS A 37 -7.237 5.294 15.800 1.00 62.12 C ATOM 583 CG LYS A 37 -6.938 6.592 14.982 1.00 61.30 C ATOM 584 CD LYS A 37 -5.440 6.792 14.646 1.00 12.21 C ATOM 585 CE LYS A 37 -5.170 8.033 13.778 1.00 44.21 C ATOM 586 NZ LYS A 37 -3.781 8.040 13.252 1.00 32.24 N ATOM 0 H LYS A 37 -4.890 4.497 15.452 1.00 11.52 H new ATOM 0 HA LYS A 37 -7.317 3.117 15.722 1.00 4.15 H new ATOM 0 HB2 LYS A 37 -8.298 5.288 16.048 1.00 62.12 H new ATOM 0 HB3 LYS A 37 -6.690 5.354 16.741 1.00 62.12 H new ATOM 0 HG2 LYS A 37 -7.508 6.563 14.053 1.00 61.30 H new ATOM 0 HG3 LYS A 37 -7.292 7.455 15.546 1.00 61.30 H new ATOM 0 HD2 LYS A 37 -4.875 6.877 15.574 1.00 12.21 H new ATOM 0 HD3 LYS A 37 -5.070 5.907 14.128 1.00 12.21 H new ATOM 0 HE2 LYS A 37 -5.875 8.057 12.947 1.00 44.21 H new ATOM 0 HE3 LYS A 37 -5.341 8.934 14.367 1.00 44.21 H new ATOM 0 HZ1 LYS A 37 -3.736 8.631 12.397 1.00 32.24 H new ATOM 0 HZ2 LYS A 37 -3.139 8.425 13.973 1.00 32.24 H new ATOM 0 HZ3 LYS A 37 -3.494 7.069 13.016 1.00 32.24 H new ATOM 600 N ALA A 38 -6.785 4.280 12.681 1.00 44.41 N ATOM 601 CA ALA A 38 -7.225 4.259 11.272 1.00 4.15 C ATOM 602 C ALA A 38 -6.505 3.134 10.500 1.00 21.45 C ATOM 603 O ALA A 38 -5.327 2.852 10.733 1.00 13.33 O ATOM 604 CB ALA A 38 -6.961 5.629 10.623 1.00 53.42 C ATOM 0 H ALA A 38 -5.855 4.680 12.808 1.00 44.41 H new ATOM 0 HA ALA A 38 -8.296 4.059 11.235 1.00 4.15 H new ATOM 0 HB1 ALA A 38 -7.288 5.608 9.583 1.00 53.42 H new ATOM 0 HB2 ALA A 38 -7.513 6.399 11.161 1.00 53.42 H new ATOM 0 HB3 ALA A 38 -5.895 5.852 10.664 1.00 53.42 H new ATOM 610 N ASP A 39 -7.240 2.462 9.607 1.00 21.41 N ATOM 611 CA ASP A 39 -6.676 1.463 8.678 1.00 12.35 C ATOM 612 C ASP A 39 -5.790 2.154 7.618 1.00 24.33 C ATOM 613 O ASP A 39 -4.906 1.530 7.043 1.00 33.11 O ATOM 614 CB ASP A 39 -7.815 0.664 8.016 1.00 24.12 C ATOM 615 CG ASP A 39 -8.640 -0.120 9.044 1.00 73.32 C ATOM 616 OD1 ASP A 39 -9.386 0.521 9.825 1.00 13.33 O ATOM 617 OD2 ASP A 39 -8.523 -1.365 9.105 1.00 71.43 O ATOM 0 H ASP A 39 -8.246 2.592 9.504 1.00 21.41 H new ATOM 0 HA ASP A 39 -6.048 0.769 9.236 1.00 12.35 H new ATOM 0 HB2 ASP A 39 -8.468 1.346 7.472 1.00 24.12 H new ATOM 0 HB3 ASP A 39 -7.396 -0.027 7.285 1.00 24.12 H new ATOM 622 N LYS A 40 -6.079 3.451 7.369 1.00 21.11 N ATOM 623 CA LYS A 40 -5.233 4.365 6.557 1.00 12.22 C ATOM 624 C LYS A 40 -3.757 4.401 7.042 1.00 22.03 C ATOM 625 O LYS A 40 -2.835 4.525 6.228 1.00 12.44 O ATOM 626 CB LYS A 40 -5.836 5.793 6.613 1.00 71.40 C ATOM 627 CG LYS A 40 -7.208 5.939 5.919 1.00 41.43 C ATOM 628 CD LYS A 40 -7.107 5.918 4.373 1.00 61.23 C ATOM 629 CE LYS A 40 -8.451 6.216 3.688 1.00 21.44 C ATOM 630 NZ LYS A 40 -8.317 6.264 2.215 1.00 3.13 N ATOM 0 H LYS A 40 -6.919 3.903 7.731 1.00 21.11 H new ATOM 0 HA LYS A 40 -5.224 3.989 5.534 1.00 12.22 H new ATOM 0 HB2 LYS A 40 -5.938 6.089 7.657 1.00 71.40 H new ATOM 0 HB3 LYS A 40 -5.134 6.488 6.152 1.00 71.40 H new ATOM 0 HG2 LYS A 40 -7.863 5.131 6.246 1.00 41.43 H new ATOM 0 HG3 LYS A 40 -7.672 6.873 6.235 1.00 41.43 H new ATOM 0 HD2 LYS A 40 -6.369 6.652 4.051 1.00 61.23 H new ATOM 0 HD3 LYS A 40 -6.747 4.941 4.049 1.00 61.23 H new ATOM 0 HE2 LYS A 40 -9.177 5.450 3.962 1.00 21.44 H new ATOM 0 HE3 LYS A 40 -8.840 7.168 4.049 1.00 21.44 H new ATOM 0 HZ1 LYS A 40 -9.244 6.467 1.789 1.00 3.13 H new ATOM 0 HZ2 LYS A 40 -7.643 7.011 1.952 1.00 3.13 H new ATOM 0 HZ3 LYS A 40 -7.970 5.347 1.868 1.00 3.13 H new ATOM 644 N ASP A 41 -3.553 4.306 8.376 1.00 34.40 N ATOM 645 CA ASP A 41 -2.204 4.212 8.975 1.00 50.02 C ATOM 646 C ASP A 41 -1.543 2.860 8.599 1.00 20.52 C ATOM 647 O ASP A 41 -0.348 2.795 8.273 1.00 54.12 O ATOM 648 CB ASP A 41 -2.271 4.318 10.526 1.00 43.31 C ATOM 649 CG ASP A 41 -3.095 5.496 11.064 1.00 2.14 C ATOM 650 OD1 ASP A 41 -2.937 6.633 10.568 1.00 72.13 O ATOM 651 OD2 ASP A 41 -3.902 5.295 11.998 1.00 44.32 O ATOM 0 H ASP A 41 -4.310 4.292 9.060 1.00 34.40 H new ATOM 0 HA ASP A 41 -1.612 5.040 8.584 1.00 50.02 H new ATOM 0 HB2 ASP A 41 -2.690 3.392 10.920 1.00 43.31 H new ATOM 0 HB3 ASP A 41 -1.255 4.399 10.913 1.00 43.31 H new ATOM 656 N PHE A 42 -2.360 1.789 8.638 1.00 13.44 N ATOM 657 CA PHE A 42 -1.886 0.413 8.437 1.00 12.14 C ATOM 658 C PHE A 42 -1.486 0.141 6.965 1.00 51.23 C ATOM 659 O PHE A 42 -0.443 -0.441 6.733 1.00 70.34 O ATOM 660 CB PHE A 42 -2.946 -0.626 8.907 1.00 75.24 C ATOM 661 CG PHE A 42 -2.471 -2.074 8.753 1.00 11.42 C ATOM 662 CD1 PHE A 42 -1.608 -2.642 9.690 1.00 31.42 C ATOM 663 CD2 PHE A 42 -2.843 -2.849 7.649 1.00 24.35 C ATOM 664 CE1 PHE A 42 -1.141 -3.929 9.533 1.00 73.23 C ATOM 665 CE2 PHE A 42 -2.377 -4.139 7.499 1.00 42.45 C ATOM 666 CZ PHE A 42 -1.522 -4.679 8.440 1.00 64.20 C ATOM 0 H PHE A 42 -3.363 1.857 8.809 1.00 13.44 H new ATOM 0 HA PHE A 42 -0.992 0.301 9.050 1.00 12.14 H new ATOM 0 HB2 PHE A 42 -3.192 -0.439 9.952 1.00 75.24 H new ATOM 0 HB3 PHE A 42 -3.863 -0.487 8.334 1.00 75.24 H new ATOM 0 HD1 PHE A 42 -1.302 -2.065 10.550 1.00 31.42 H new ATOM 0 HD2 PHE A 42 -3.504 -2.432 6.904 1.00 24.35 H new ATOM 0 HE1 PHE A 42 -0.474 -4.352 10.269 1.00 73.23 H new ATOM 0 HE2 PHE A 42 -2.681 -4.727 6.645 1.00 42.45 H new ATOM 0 HZ PHE A 42 -1.153 -5.687 8.320 1.00 64.20 H new ATOM 676 N PHE A 43 -2.326 0.549 5.992 1.00 54.01 N ATOM 677 CA PHE A 43 -2.126 0.203 4.551 1.00 35.23 C ATOM 678 C PHE A 43 -0.801 0.771 3.986 1.00 32.10 C ATOM 679 O PHE A 43 -0.071 0.075 3.276 1.00 32.12 O ATOM 680 CB PHE A 43 -3.318 0.700 3.682 1.00 33.21 C ATOM 681 CG PHE A 43 -4.677 0.108 4.060 1.00 1.11 C ATOM 682 CD1 PHE A 43 -4.812 -1.253 4.355 1.00 30.13 C ATOM 683 CD2 PHE A 43 -5.820 0.912 4.121 1.00 22.41 C ATOM 684 CE1 PHE A 43 -6.039 -1.788 4.701 1.00 70.33 C ATOM 685 CE2 PHE A 43 -7.044 0.376 4.467 1.00 20.22 C ATOM 686 CZ PHE A 43 -7.156 -0.974 4.757 1.00 33.10 C ATOM 0 H PHE A 43 -3.153 1.119 6.168 1.00 54.01 H new ATOM 0 HA PHE A 43 -2.074 -0.885 4.503 1.00 35.23 H new ATOM 0 HB2 PHE A 43 -3.377 1.786 3.757 1.00 33.21 H new ATOM 0 HB3 PHE A 43 -3.112 0.464 2.638 1.00 33.21 H new ATOM 0 HD1 PHE A 43 -3.945 -1.895 4.312 1.00 30.13 H new ATOM 0 HD2 PHE A 43 -5.744 1.965 3.895 1.00 22.41 H new ATOM 0 HE1 PHE A 43 -6.125 -2.840 4.927 1.00 70.33 H new ATOM 0 HE2 PHE A 43 -7.917 1.011 4.512 1.00 20.22 H new ATOM 0 HZ PHE A 43 -8.115 -1.391 5.027 1.00 33.10 H new ATOM 696 N LEU A 44 -0.512 2.036 4.327 1.00 63.52 N ATOM 697 CA LEU A 44 0.694 2.752 3.854 1.00 21.40 C ATOM 698 C LEU A 44 1.968 2.231 4.570 1.00 34.30 C ATOM 699 O LEU A 44 3.032 2.113 3.945 1.00 74.40 O ATOM 700 CB LEU A 44 0.514 4.295 4.030 1.00 41.55 C ATOM 701 CG LEU A 44 -0.440 5.005 2.992 1.00 21.24 C ATOM 702 CD1 LEU A 44 -1.891 4.463 3.030 1.00 54.44 C ATOM 703 CD2 LEU A 44 -0.433 6.538 3.178 1.00 54.24 C ATOM 0 H LEU A 44 -1.105 2.596 4.939 1.00 63.52 H new ATOM 0 HA LEU A 44 0.823 2.553 2.790 1.00 21.40 H new ATOM 0 HB2 LEU A 44 0.131 4.484 5.033 1.00 41.55 H new ATOM 0 HB3 LEU A 44 1.496 4.764 3.970 1.00 41.55 H new ATOM 0 HG LEU A 44 -0.038 4.768 2.007 1.00 21.24 H new ATOM 0 HD11 LEU A 44 -2.496 4.992 2.294 1.00 54.44 H new ATOM 0 HD12 LEU A 44 -1.888 3.398 2.800 1.00 54.44 H new ATOM 0 HD13 LEU A 44 -2.311 4.618 4.024 1.00 54.44 H new ATOM 0 HD21 LEU A 44 -1.100 6.996 2.448 1.00 54.24 H new ATOM 0 HD22 LEU A 44 -0.773 6.784 4.184 1.00 54.24 H new ATOM 0 HD23 LEU A 44 0.579 6.917 3.034 1.00 54.24 H new ATOM 715 N GLY A 45 1.838 1.895 5.875 1.00 64.21 N ATOM 716 CA GLY A 45 2.926 1.244 6.629 1.00 50.11 C ATOM 717 C GLY A 45 3.254 -0.165 6.100 1.00 34.03 C ATOM 718 O GLY A 45 4.411 -0.493 5.859 1.00 30.02 O ATOM 0 H GLY A 45 0.994 2.064 6.422 1.00 64.21 H new ATOM 0 HA2 GLY A 45 3.821 1.865 6.577 1.00 50.11 H new ATOM 0 HA3 GLY A 45 2.645 1.177 7.680 1.00 50.11 H new ATOM 722 N LEU A 46 2.197 -0.962 5.869 1.00 65.24 N ATOM 723 CA LEU A 46 2.278 -2.342 5.315 1.00 14.54 C ATOM 724 C LEU A 46 2.851 -2.338 3.878 1.00 51.03 C ATOM 725 O LEU A 46 3.557 -3.265 3.470 1.00 74.14 O ATOM 726 CB LEU A 46 0.866 -2.987 5.296 1.00 3.25 C ATOM 727 CG LEU A 46 0.774 -4.430 4.693 1.00 15.04 C ATOM 728 CD1 LEU A 46 1.491 -5.455 5.591 1.00 14.35 C ATOM 729 CD2 LEU A 46 -0.690 -4.835 4.412 1.00 34.32 C ATOM 0 H LEU A 46 1.240 -0.668 6.063 1.00 65.24 H new ATOM 0 HA LEU A 46 2.945 -2.920 5.955 1.00 14.54 H new ATOM 0 HB2 LEU A 46 0.490 -3.018 6.318 1.00 3.25 H new ATOM 0 HB3 LEU A 46 0.199 -2.336 4.731 1.00 3.25 H new ATOM 0 HG LEU A 46 1.291 -4.422 3.733 1.00 15.04 H new ATOM 0 HD11 LEU A 46 1.410 -6.447 5.147 1.00 14.35 H new ATOM 0 HD12 LEU A 46 2.543 -5.184 5.685 1.00 14.35 H new ATOM 0 HD13 LEU A 46 1.028 -5.461 6.578 1.00 14.35 H new ATOM 0 HD21 LEU A 46 -0.715 -5.842 3.994 1.00 34.32 H new ATOM 0 HD22 LEU A 46 -1.258 -4.814 5.342 1.00 34.32 H new ATOM 0 HD23 LEU A 46 -1.131 -4.136 3.701 1.00 34.32 H new ATOM 741 N GLY A 47 2.527 -1.273 3.135 1.00 4.03 N ATOM 742 CA GLY A 47 3.035 -1.070 1.771 1.00 43.33 C ATOM 743 C GLY A 47 4.556 -0.913 1.735 1.00 52.43 C ATOM 744 O GLY A 47 5.208 -1.316 0.770 1.00 21.30 O ATOM 0 H GLY A 47 1.908 -0.530 3.460 1.00 4.03 H new ATOM 0 HA2 GLY A 47 2.745 -1.916 1.148 1.00 43.33 H new ATOM 0 HA3 GLY A 47 2.570 -0.183 1.341 1.00 43.33 H new ATOM 748 N TRP A 48 5.108 -0.336 2.820 1.00 42.15 N ATOM 749 CA TRP A 48 6.563 -0.196 3.013 1.00 24.01 C ATOM 750 C TRP A 48 7.203 -1.557 3.421 1.00 21.51 C ATOM 751 O TRP A 48 8.348 -1.862 3.057 1.00 30.22 O ATOM 752 CB TRP A 48 6.852 0.899 4.074 1.00 5.14 C ATOM 753 CG TRP A 48 8.252 1.464 4.004 1.00 62.23 C ATOM 754 CD1 TRP A 48 9.398 0.947 4.550 1.00 43.55 C ATOM 755 CD2 TRP A 48 8.638 2.668 3.333 1.00 24.01 C ATOM 756 NE1 TRP A 48 10.466 1.747 4.239 1.00 71.21 N ATOM 757 CE2 TRP A 48 10.024 2.814 3.500 1.00 71.30 C ATOM 758 CE3 TRP A 48 7.936 3.636 2.606 1.00 23.40 C ATOM 759 CZ2 TRP A 48 10.725 3.886 2.961 1.00 73.02 C ATOM 760 CZ3 TRP A 48 8.630 4.702 2.076 1.00 55.31 C ATOM 761 CH2 TRP A 48 10.016 4.821 2.254 1.00 21.15 C ATOM 0 H TRP A 48 4.556 0.046 3.588 1.00 42.15 H new ATOM 0 HA TRP A 48 7.015 0.108 2.069 1.00 24.01 H new ATOM 0 HB2 TRP A 48 6.136 1.711 3.948 1.00 5.14 H new ATOM 0 HB3 TRP A 48 6.688 0.481 5.067 1.00 5.14 H new ATOM 0 HD1 TRP A 48 9.451 0.043 5.138 1.00 43.55 H new ATOM 0 HE1 TRP A 48 11.434 1.576 4.513 1.00 71.21 H new ATOM 0 HE3 TRP A 48 6.869 3.549 2.463 1.00 23.40 H new ATOM 0 HZ2 TRP A 48 11.793 3.979 3.095 1.00 73.02 H new ATOM 0 HZ3 TRP A 48 8.099 5.457 1.515 1.00 55.31 H new ATOM 0 HH2 TRP A 48 10.534 5.666 1.825 1.00 21.15 H new ATOM 772 N LEU A 49 6.449 -2.364 4.187 1.00 54.10 N ATOM 773 CA LEU A 49 6.840 -3.755 4.541 1.00 40.32 C ATOM 774 C LEU A 49 6.966 -4.657 3.284 1.00 1.21 C ATOM 775 O LEU A 49 7.858 -5.508 3.198 1.00 32.51 O ATOM 776 CB LEU A 49 5.822 -4.363 5.553 1.00 4.54 C ATOM 777 CG LEU A 49 6.039 -4.059 7.070 1.00 24.34 C ATOM 778 CD1 LEU A 49 6.198 -2.569 7.337 1.00 14.31 C ATOM 779 CD2 LEU A 49 4.879 -4.634 7.906 1.00 75.10 C ATOM 0 H LEU A 49 5.552 -2.079 4.581 1.00 54.10 H new ATOM 0 HA LEU A 49 7.823 -3.713 5.010 1.00 40.32 H new ATOM 0 HB2 LEU A 49 4.827 -4.013 5.279 1.00 4.54 H new ATOM 0 HB3 LEU A 49 5.826 -5.445 5.424 1.00 4.54 H new ATOM 0 HG LEU A 49 6.968 -4.544 7.369 1.00 24.34 H new ATOM 0 HD11 LEU A 49 6.346 -2.404 8.404 1.00 14.31 H new ATOM 0 HD12 LEU A 49 7.060 -2.191 6.788 1.00 14.31 H new ATOM 0 HD13 LEU A 49 5.301 -2.043 7.010 1.00 14.31 H new ATOM 0 HD21 LEU A 49 5.046 -4.413 8.960 1.00 75.10 H new ATOM 0 HD22 LEU A 49 3.940 -4.182 7.585 1.00 75.10 H new ATOM 0 HD23 LEU A 49 4.829 -5.714 7.765 1.00 75.10 H new ATOM 791 N LEU A 50 6.053 -4.469 2.321 1.00 20.25 N ATOM 792 CA LEU A 50 6.095 -5.173 1.020 1.00 72.11 C ATOM 793 C LEU A 50 7.183 -4.568 0.096 1.00 0.14 C ATOM 794 O LEU A 50 7.820 -5.296 -0.675 1.00 52.20 O ATOM 795 CB LEU A 50 4.692 -5.127 0.344 1.00 65.32 C ATOM 796 CG LEU A 50 3.561 -5.922 1.083 1.00 0.11 C ATOM 797 CD1 LEU A 50 2.183 -5.713 0.413 1.00 42.22 C ATOM 798 CD2 LEU A 50 3.922 -7.424 1.178 1.00 43.30 C ATOM 0 H LEU A 50 5.265 -3.828 2.416 1.00 20.25 H new ATOM 0 HA LEU A 50 6.359 -6.216 1.196 1.00 72.11 H new ATOM 0 HB2 LEU A 50 4.383 -4.085 0.258 1.00 65.32 H new ATOM 0 HB3 LEU A 50 4.783 -5.517 -0.670 1.00 65.32 H new ATOM 0 HG LEU A 50 3.485 -5.528 2.096 1.00 0.11 H new ATOM 0 HD11 LEU A 50 1.426 -6.280 0.954 1.00 42.22 H new ATOM 0 HD12 LEU A 50 1.926 -4.654 0.432 1.00 42.22 H new ATOM 0 HD13 LEU A 50 2.225 -6.057 -0.620 1.00 42.22 H new ATOM 0 HD21 LEU A 50 3.124 -7.958 1.694 1.00 43.30 H new ATOM 0 HD22 LEU A 50 4.043 -7.833 0.175 1.00 43.30 H new ATOM 0 HD23 LEU A 50 4.854 -7.540 1.732 1.00 43.30 H new ATOM 810 N ARG A 51 7.391 -3.233 0.197 1.00 1.21 N ATOM 811 CA ARG A 51 8.364 -2.488 -0.649 1.00 33.34 C ATOM 812 C ARG A 51 9.832 -2.948 -0.405 1.00 70.33 C ATOM 813 O ARG A 51 10.642 -2.960 -1.336 1.00 10.22 O ATOM 814 CB ARG A 51 8.179 -0.923 -0.468 1.00 23.23 C ATOM 815 CG ARG A 51 9.152 -0.182 0.505 1.00 62.02 C ATOM 816 CD ARG A 51 10.289 0.584 -0.199 1.00 64.53 C ATOM 817 NE ARG A 51 11.268 1.138 0.752 1.00 0.32 N ATOM 818 CZ ARG A 51 12.296 1.894 0.425 1.00 12.11 C ATOM 819 NH1 ARG A 51 12.459 2.321 -0.790 1.00 41.12 N ATOM 820 NH2 ARG A 51 13.156 2.229 1.331 1.00 43.00 N ATOM 0 H ARG A 51 6.893 -2.642 0.863 1.00 1.21 H new ATOM 0 HA ARG A 51 8.150 -2.725 -1.691 1.00 33.34 H new ATOM 0 HB2 ARG A 51 8.270 -0.459 -1.450 1.00 23.23 H new ATOM 0 HB3 ARG A 51 7.160 -0.744 -0.124 1.00 23.23 H new ATOM 0 HG2 ARG A 51 8.578 0.519 1.111 1.00 62.02 H new ATOM 0 HG3 ARG A 51 9.589 -0.910 1.188 1.00 62.02 H new ATOM 0 HD2 ARG A 51 10.799 -0.085 -0.892 1.00 64.53 H new ATOM 0 HD3 ARG A 51 9.864 1.394 -0.792 1.00 64.53 H new ATOM 0 HE ARG A 51 11.140 0.919 1.740 1.00 0.32 H new ATOM 0 HH11 ARG A 51 11.784 2.072 -1.513 1.00 41.12 H new ATOM 0 HH12 ARG A 51 13.262 2.905 -1.022 1.00 41.12 H new ATOM 0 HH21 ARG A 51 13.036 1.908 2.292 1.00 43.00 H new ATOM 0 HH22 ARG A 51 13.954 2.814 1.085 1.00 43.00 H new ATOM 834 N GLU A 52 10.164 -3.318 0.852 1.00 24.51 N ATOM 835 CA GLU A 52 11.524 -3.811 1.220 1.00 71.32 C ATOM 836 C GLU A 52 11.575 -5.353 1.397 1.00 23.32 C ATOM 837 O GLU A 52 12.599 -5.878 1.849 1.00 52.24 O ATOM 838 CB GLU A 52 12.003 -3.104 2.522 1.00 25.55 C ATOM 839 CG GLU A 52 11.964 -1.567 2.470 1.00 44.12 C ATOM 840 CD GLU A 52 12.563 -0.853 3.693 1.00 43.24 C ATOM 841 OE1 GLU A 52 12.522 -1.406 4.809 1.00 64.13 O ATOM 842 OE2 GLU A 52 13.066 0.284 3.538 1.00 11.23 O ATOM 0 H GLU A 52 9.512 -3.287 1.635 1.00 24.51 H new ATOM 0 HA GLU A 52 12.193 -3.566 0.395 1.00 71.32 H new ATOM 0 HB2 GLU A 52 11.383 -3.442 3.352 1.00 25.55 H new ATOM 0 HB3 GLU A 52 13.023 -3.421 2.737 1.00 25.55 H new ATOM 0 HG2 GLU A 52 12.498 -1.236 1.579 1.00 44.12 H new ATOM 0 HG3 GLU A 52 10.927 -1.250 2.356 1.00 44.12 H new ATOM 849 N ASP A 53 10.460 -6.058 1.063 1.00 50.13 N ATOM 850 CA ASP A 53 10.355 -7.549 1.146 1.00 64.23 C ATOM 851 C ASP A 53 10.503 -8.077 2.603 1.00 63.43 C ATOM 852 O ASP A 53 10.893 -9.232 2.824 1.00 53.14 O ATOM 853 CB ASP A 53 11.385 -8.233 0.206 1.00 11.31 C ATOM 854 CG ASP A 53 11.196 -7.844 -1.262 1.00 54.32 C ATOM 855 OD1 ASP A 53 10.282 -8.389 -1.925 1.00 10.14 O ATOM 856 OD2 ASP A 53 11.936 -6.980 -1.761 1.00 1.32 O ATOM 0 H ASP A 53 9.606 -5.612 0.728 1.00 50.13 H new ATOM 0 HA ASP A 53 9.351 -7.811 0.812 1.00 64.23 H new ATOM 0 HB2 ASP A 53 12.393 -7.964 0.522 1.00 11.31 H new ATOM 0 HB3 ASP A 53 11.298 -9.315 0.305 1.00 11.31 H new ATOM 861 N LYS A 54 10.113 -7.238 3.573 1.00 41.41 N ATOM 862 CA LYS A 54 10.248 -7.522 5.023 1.00 71.32 C ATOM 863 C LYS A 54 9.246 -8.614 5.471 1.00 4.34 C ATOM 864 O LYS A 54 9.492 -9.346 6.437 1.00 35.43 O ATOM 865 CB LYS A 54 9.975 -6.217 5.830 1.00 60.14 C ATOM 866 CG LYS A 54 10.658 -4.956 5.263 1.00 42.21 C ATOM 867 CD LYS A 54 10.256 -3.646 5.993 1.00 24.24 C ATOM 868 CE LYS A 54 10.975 -3.456 7.330 1.00 14.13 C ATOM 869 NZ LYS A 54 12.441 -3.312 7.153 1.00 1.44 N ATOM 0 H LYS A 54 9.689 -6.331 3.379 1.00 41.41 H new ATOM 0 HA LYS A 54 11.260 -7.880 5.211 1.00 71.32 H new ATOM 0 HB2 LYS A 54 8.899 -6.046 5.866 1.00 60.14 H new ATOM 0 HB3 LYS A 54 10.309 -6.364 6.857 1.00 60.14 H new ATOM 0 HG2 LYS A 54 11.739 -5.080 5.326 1.00 42.21 H new ATOM 0 HG3 LYS A 54 10.409 -4.863 4.206 1.00 42.21 H new ATOM 0 HD2 LYS A 54 10.474 -2.796 5.347 1.00 24.24 H new ATOM 0 HD3 LYS A 54 9.179 -3.649 6.164 1.00 24.24 H new ATOM 0 HE2 LYS A 54 10.581 -2.572 7.832 1.00 14.13 H new ATOM 0 HE3 LYS A 54 10.769 -4.308 7.977 1.00 14.13 H new ATOM 0 HZ1 LYS A 54 12.857 -2.905 8.015 1.00 1.44 H new ATOM 0 HZ2 LYS A 54 12.862 -4.246 6.973 1.00 1.44 H new ATOM 0 HZ3 LYS A 54 12.633 -2.684 6.347 1.00 1.44 H new ATOM 883 N VAL A 55 8.107 -8.698 4.747 1.00 73.41 N ATOM 884 CA VAL A 55 6.952 -9.544 5.127 1.00 70.21 C ATOM 885 C VAL A 55 6.357 -10.286 3.906 1.00 42.01 C ATOM 886 O VAL A 55 6.765 -10.072 2.751 1.00 5.22 O ATOM 887 CB VAL A 55 5.795 -8.701 5.785 1.00 41.42 C ATOM 888 CG1 VAL A 55 6.259 -7.966 7.059 1.00 31.42 C ATOM 889 CG2 VAL A 55 5.159 -7.725 4.759 1.00 12.41 C ATOM 0 H VAL A 55 7.962 -8.180 3.880 1.00 73.41 H new ATOM 0 HA VAL A 55 7.341 -10.263 5.848 1.00 70.21 H new ATOM 0 HB VAL A 55 5.023 -9.405 6.097 1.00 41.42 H new ATOM 0 HG11 VAL A 55 5.426 -7.399 7.476 1.00 31.42 H new ATOM 0 HG12 VAL A 55 6.606 -8.694 7.793 1.00 31.42 H new ATOM 0 HG13 VAL A 55 7.073 -7.285 6.810 1.00 31.42 H new ATOM 0 HG21 VAL A 55 4.364 -7.157 5.242 1.00 12.41 H new ATOM 0 HG22 VAL A 55 5.921 -7.039 4.388 1.00 12.41 H new ATOM 0 HG23 VAL A 55 4.745 -8.292 3.925 1.00 12.41 H new ATOM 899 N VAL A 56 5.372 -11.146 4.194 1.00 51.44 N ATOM 900 CA VAL A 56 4.535 -11.818 3.196 1.00 20.12 C ATOM 901 C VAL A 56 3.049 -11.709 3.613 1.00 60.53 C ATOM 902 O VAL A 56 2.703 -11.877 4.788 1.00 74.12 O ATOM 903 CB VAL A 56 4.975 -13.320 2.972 1.00 44.12 C ATOM 904 CG1 VAL A 56 4.952 -14.138 4.287 1.00 31.30 C ATOM 905 CG2 VAL A 56 4.129 -14.003 1.860 1.00 73.50 C ATOM 0 H VAL A 56 5.130 -11.399 5.152 1.00 51.44 H new ATOM 0 HA VAL A 56 4.667 -11.318 2.236 1.00 20.12 H new ATOM 0 HB VAL A 56 6.010 -13.299 2.631 1.00 44.12 H new ATOM 0 HG11 VAL A 56 5.262 -15.163 4.083 1.00 31.30 H new ATOM 0 HG12 VAL A 56 5.636 -13.689 5.007 1.00 31.30 H new ATOM 0 HG13 VAL A 56 3.942 -14.139 4.697 1.00 31.30 H new ATOM 0 HG21 VAL A 56 4.459 -15.034 1.733 1.00 73.50 H new ATOM 0 HG22 VAL A 56 3.077 -13.991 2.144 1.00 73.50 H new ATOM 0 HG23 VAL A 56 4.257 -13.463 0.922 1.00 73.50 H new ATOM 915 N THR A 57 2.186 -11.399 2.639 1.00 3.04 N ATOM 916 CA THR A 57 0.753 -11.145 2.870 1.00 74.12 C ATOM 917 C THR A 57 -0.120 -12.257 2.243 1.00 43.02 C ATOM 918 O THR A 57 0.259 -12.896 1.251 1.00 63.43 O ATOM 919 CB THR A 57 0.340 -9.740 2.308 1.00 3.33 C ATOM 920 OG1 THR A 57 0.880 -9.570 0.984 1.00 11.42 O ATOM 921 CG2 THR A 57 0.820 -8.584 3.214 1.00 41.14 C ATOM 0 H THR A 57 2.461 -11.316 1.660 1.00 3.04 H new ATOM 0 HA THR A 57 0.584 -11.150 3.947 1.00 74.12 H new ATOM 0 HB THR A 57 -0.749 -9.706 2.279 1.00 3.33 H new ATOM 0 HG1 THR A 57 1.201 -8.650 0.877 1.00 11.42 H new ATOM 0 HG21 THR A 57 0.510 -7.632 2.783 1.00 41.14 H new ATOM 0 HG22 THR A 57 0.382 -8.693 4.206 1.00 41.14 H new ATOM 0 HG23 THR A 57 1.907 -8.610 3.292 1.00 41.14 H new ATOM 929 N SER A 58 -1.297 -12.469 2.851 1.00 35.33 N ATOM 930 CA SER A 58 -2.254 -13.528 2.474 1.00 21.13 C ATOM 931 C SER A 58 -3.697 -13.071 2.791 1.00 64.41 C ATOM 932 O SER A 58 -3.900 -12.045 3.449 1.00 31.20 O ATOM 933 CB SER A 58 -1.919 -14.840 3.236 1.00 13.43 C ATOM 934 OG SER A 58 -2.797 -15.902 2.881 1.00 15.25 O ATOM 0 H SER A 58 -1.619 -11.900 3.634 1.00 35.33 H new ATOM 0 HA SER A 58 -2.176 -13.718 1.403 1.00 21.13 H new ATOM 0 HB2 SER A 58 -0.891 -15.132 3.020 1.00 13.43 H new ATOM 0 HB3 SER A 58 -1.981 -14.662 4.310 1.00 13.43 H new ATOM 0 HG SER A 58 -2.552 -16.709 3.380 1.00 15.25 H new ATOM 940 N GLU A 59 -4.694 -13.836 2.321 1.00 63.23 N ATOM 941 CA GLU A 59 -6.125 -13.515 2.528 1.00 10.33 C ATOM 942 C GLU A 59 -6.771 -14.539 3.492 1.00 51.54 C ATOM 943 O GLU A 59 -6.976 -15.702 3.134 1.00 43.52 O ATOM 944 CB GLU A 59 -6.855 -13.498 1.160 1.00 55.41 C ATOM 945 CG GLU A 59 -8.342 -13.102 1.230 1.00 62.25 C ATOM 946 CD GLU A 59 -9.047 -13.208 -0.133 1.00 24.12 C ATOM 947 OE1 GLU A 59 -9.399 -14.343 -0.540 1.00 14.23 O ATOM 948 OE2 GLU A 59 -9.236 -12.176 -0.812 1.00 71.13 O ATOM 0 H GLU A 59 -4.538 -14.692 1.788 1.00 63.23 H new ATOM 0 HA GLU A 59 -6.214 -12.528 2.982 1.00 10.33 H new ATOM 0 HB2 GLU A 59 -6.339 -12.804 0.497 1.00 55.41 H new ATOM 0 HB3 GLU A 59 -6.777 -14.487 0.709 1.00 55.41 H new ATOM 0 HG2 GLU A 59 -8.851 -13.743 1.949 1.00 62.25 H new ATOM 0 HG3 GLU A 59 -8.425 -12.080 1.599 1.00 62.25 H new ATOM 955 N VAL A 60 -7.059 -14.095 4.725 1.00 62.13 N ATOM 956 CA VAL A 60 -7.784 -14.897 5.741 1.00 33.41 C ATOM 957 C VAL A 60 -9.182 -14.285 5.974 1.00 54.11 C ATOM 958 O VAL A 60 -9.272 -13.134 6.411 1.00 2.41 O ATOM 959 CB VAL A 60 -6.966 -14.953 7.096 1.00 23.43 C ATOM 960 CG1 VAL A 60 -7.788 -15.567 8.262 1.00 43.41 C ATOM 961 CG2 VAL A 60 -5.645 -15.735 6.892 1.00 50.31 C ATOM 0 H VAL A 60 -6.797 -13.166 5.054 1.00 62.13 H new ATOM 0 HA VAL A 60 -7.897 -15.918 5.377 1.00 33.41 H new ATOM 0 HB VAL A 60 -6.737 -13.925 7.377 1.00 23.43 H new ATOM 0 HG11 VAL A 60 -7.181 -15.582 9.167 1.00 43.41 H new ATOM 0 HG12 VAL A 60 -8.681 -14.966 8.434 1.00 43.41 H new ATOM 0 HG13 VAL A 60 -8.080 -16.585 8.005 1.00 43.41 H new ATOM 0 HG21 VAL A 60 -5.092 -15.766 7.831 1.00 50.31 H new ATOM 0 HG22 VAL A 60 -5.870 -16.752 6.569 1.00 50.31 H new ATOM 0 HG23 VAL A 60 -5.042 -15.238 6.132 1.00 50.31 H new ATOM 971 N GLU A 61 -10.249 -15.066 5.656 1.00 41.33 N ATOM 972 CA GLU A 61 -11.688 -14.674 5.813 1.00 42.45 C ATOM 973 C GLU A 61 -12.020 -13.249 5.266 1.00 53.30 C ATOM 974 O GLU A 61 -12.760 -12.475 5.892 1.00 23.14 O ATOM 975 CB GLU A 61 -12.213 -14.894 7.284 1.00 63.33 C ATOM 976 CG GLU A 61 -11.384 -14.243 8.419 1.00 70.42 C ATOM 977 CD GLU A 61 -12.084 -14.260 9.787 1.00 13.34 C ATOM 978 OE1 GLU A 61 -12.055 -15.311 10.463 1.00 55.04 O ATOM 979 OE2 GLU A 61 -12.672 -13.234 10.189 1.00 4.14 O ATOM 0 H GLU A 61 -10.137 -16.006 5.275 1.00 41.33 H new ATOM 0 HA GLU A 61 -12.243 -15.359 5.173 1.00 42.45 H new ATOM 0 HB2 GLU A 61 -13.232 -14.511 7.343 1.00 63.33 H new ATOM 0 HB3 GLU A 61 -12.264 -15.967 7.471 1.00 63.33 H new ATOM 0 HG2 GLU A 61 -10.430 -14.763 8.503 1.00 70.42 H new ATOM 0 HG3 GLU A 61 -11.162 -13.211 8.148 1.00 70.42 H new ATOM 986 N GLY A 62 -11.478 -12.929 4.072 1.00 22.51 N ATOM 987 CA GLY A 62 -11.712 -11.630 3.417 1.00 10.43 C ATOM 988 C GLY A 62 -10.962 -10.448 4.053 1.00 2.51 C ATOM 989 O GLY A 62 -11.291 -9.287 3.789 1.00 64.21 O ATOM 0 H GLY A 62 -10.873 -13.557 3.542 1.00 22.51 H new ATOM 0 HA2 GLY A 62 -11.419 -11.708 2.370 1.00 10.43 H new ATOM 0 HA3 GLY A 62 -12.781 -11.417 3.434 1.00 10.43 H new ATOM 993 N GLU A 63 -9.952 -10.741 4.888 1.00 13.13 N ATOM 994 CA GLU A 63 -9.140 -9.715 5.590 1.00 54.54 C ATOM 995 C GLU A 63 -7.629 -9.947 5.330 1.00 64.42 C ATOM 996 O GLU A 63 -7.201 -11.082 5.078 1.00 74.41 O ATOM 997 CB GLU A 63 -9.472 -9.754 7.118 1.00 35.14 C ATOM 998 CG GLU A 63 -8.662 -8.764 7.982 1.00 62.42 C ATOM 999 CD GLU A 63 -9.145 -8.669 9.440 1.00 34.35 C ATOM 1000 OE1 GLU A 63 -8.735 -9.500 10.276 1.00 34.32 O ATOM 1001 OE2 GLU A 63 -9.940 -7.758 9.752 1.00 60.31 O ATOM 0 H GLU A 63 -9.669 -11.698 5.101 1.00 13.13 H new ATOM 0 HA GLU A 63 -9.386 -8.725 5.205 1.00 54.54 H new ATOM 0 HB2 GLU A 63 -10.534 -9.545 7.250 1.00 35.14 H new ATOM 0 HB3 GLU A 63 -9.297 -10.764 7.488 1.00 35.14 H new ATOM 0 HG2 GLU A 63 -7.614 -9.064 7.976 1.00 62.42 H new ATOM 0 HG3 GLU A 63 -8.713 -7.775 7.528 1.00 62.42 H new ATOM 1008 N ILE A 64 -6.829 -8.860 5.396 1.00 54.40 N ATOM 1009 CA ILE A 64 -5.373 -8.915 5.156 1.00 24.34 C ATOM 1010 C ILE A 64 -4.634 -9.557 6.362 1.00 22.31 C ATOM 1011 O ILE A 64 -4.611 -8.994 7.463 1.00 0.44 O ATOM 1012 CB ILE A 64 -4.778 -7.479 4.877 1.00 13.24 C ATOM 1013 CG1 ILE A 64 -5.517 -6.787 3.683 1.00 72.33 C ATOM 1014 CG2 ILE A 64 -3.244 -7.539 4.629 1.00 20.24 C ATOM 1015 CD1 ILE A 64 -5.065 -5.355 3.396 1.00 45.31 C ATOM 0 H ILE A 64 -7.174 -7.926 5.616 1.00 54.40 H new ATOM 0 HA ILE A 64 -5.218 -9.533 4.272 1.00 24.34 H new ATOM 0 HB ILE A 64 -4.943 -6.874 5.769 1.00 13.24 H new ATOM 0 HG12 ILE A 64 -5.369 -7.387 2.785 1.00 72.33 H new ATOM 0 HG13 ILE A 64 -6.587 -6.781 3.890 1.00 72.33 H new ATOM 0 HG21 ILE A 64 -2.866 -6.534 4.440 1.00 20.24 H new ATOM 0 HG22 ILE A 64 -2.749 -7.953 5.507 1.00 20.24 H new ATOM 0 HG23 ILE A 64 -3.040 -8.172 3.765 1.00 20.24 H new ATOM 0 HD11 ILE A 64 -5.631 -4.957 2.554 1.00 45.31 H new ATOM 0 HD12 ILE A 64 -5.239 -4.735 4.276 1.00 45.31 H new ATOM 0 HD13 ILE A 64 -4.002 -5.351 3.154 1.00 45.31 H new ATOM 1027 N PHE A 65 -4.054 -10.744 6.131 1.00 63.03 N ATOM 1028 CA PHE A 65 -3.123 -11.407 7.069 1.00 0.30 C ATOM 1029 C PHE A 65 -1.676 -11.129 6.623 1.00 54.31 C ATOM 1030 O PHE A 65 -1.382 -11.144 5.427 1.00 0.33 O ATOM 1031 CB PHE A 65 -3.386 -12.933 7.101 1.00 61.04 C ATOM 1032 CG PHE A 65 -2.451 -13.719 8.028 1.00 44.22 C ATOM 1033 CD1 PHE A 65 -2.668 -13.744 9.406 1.00 2.12 C ATOM 1034 CD2 PHE A 65 -1.339 -14.404 7.527 1.00 54.20 C ATOM 1035 CE1 PHE A 65 -1.818 -14.430 10.246 1.00 32.34 C ATOM 1036 CE2 PHE A 65 -0.486 -15.087 8.372 1.00 72.42 C ATOM 1037 CZ PHE A 65 -0.724 -15.097 9.731 1.00 12.45 C ATOM 0 H PHE A 65 -4.217 -11.280 5.279 1.00 63.03 H new ATOM 0 HA PHE A 65 -3.279 -11.011 8.073 1.00 0.30 H new ATOM 0 HB2 PHE A 65 -4.416 -13.105 7.413 1.00 61.04 H new ATOM 0 HB3 PHE A 65 -3.290 -13.327 6.089 1.00 61.04 H new ATOM 0 HD1 PHE A 65 -3.515 -13.218 9.821 1.00 2.12 H new ATOM 0 HD2 PHE A 65 -1.145 -14.399 6.465 1.00 54.20 H new ATOM 0 HE1 PHE A 65 -2.008 -14.446 11.309 1.00 32.34 H new ATOM 0 HE2 PHE A 65 0.367 -15.613 7.969 1.00 72.42 H new ATOM 0 HZ PHE A 65 -0.054 -15.627 10.392 1.00 12.45 H new ATOM 1047 N VAL A 66 -0.779 -10.871 7.577 1.00 23.43 N ATOM 1048 CA VAL A 66 0.644 -10.608 7.281 1.00 42.42 C ATOM 1049 C VAL A 66 1.584 -11.266 8.330 1.00 50.32 C ATOM 1050 O VAL A 66 1.230 -11.392 9.504 1.00 34.11 O ATOM 1051 CB VAL A 66 0.890 -9.059 7.158 1.00 55.11 C ATOM 1052 CG1 VAL A 66 0.425 -8.303 8.419 1.00 3.32 C ATOM 1053 CG2 VAL A 66 2.360 -8.749 6.820 1.00 1.43 C ATOM 0 H VAL A 66 -1.009 -10.837 8.570 1.00 23.43 H new ATOM 0 HA VAL A 66 0.887 -11.069 6.323 1.00 42.42 H new ATOM 0 HB VAL A 66 0.281 -8.700 6.329 1.00 55.11 H new ATOM 0 HG11 VAL A 66 0.612 -7.237 8.294 1.00 3.32 H new ATOM 0 HG12 VAL A 66 -0.642 -8.469 8.570 1.00 3.32 H new ATOM 0 HG13 VAL A 66 0.975 -8.669 9.286 1.00 3.32 H new ATOM 0 HG21 VAL A 66 2.496 -7.670 6.742 1.00 1.43 H new ATOM 0 HG22 VAL A 66 3.005 -9.140 7.607 1.00 1.43 H new ATOM 0 HG23 VAL A 66 2.622 -9.217 5.871 1.00 1.43 H new ATOM 1063 N LYS A 67 2.782 -11.699 7.880 1.00 42.02 N ATOM 1064 CA LYS A 67 3.838 -12.252 8.768 1.00 64.42 C ATOM 1065 C LYS A 67 5.228 -12.015 8.150 1.00 0.14 C ATOM 1066 O LYS A 67 5.339 -11.915 6.936 1.00 72.40 O ATOM 1067 CB LYS A 67 3.603 -13.767 9.023 1.00 22.32 C ATOM 1068 CG LYS A 67 3.563 -14.654 7.763 1.00 33.31 C ATOM 1069 CD LYS A 67 3.254 -16.129 8.097 1.00 53.51 C ATOM 1070 CE LYS A 67 3.187 -17.017 6.847 1.00 40.31 C ATOM 1071 NZ LYS A 67 4.494 -17.105 6.137 1.00 13.34 N ATOM 0 H LYS A 67 3.047 -11.677 6.895 1.00 42.02 H new ATOM 0 HA LYS A 67 3.791 -11.736 9.727 1.00 64.42 H new ATOM 0 HB2 LYS A 67 4.392 -14.134 9.679 1.00 22.32 H new ATOM 0 HB3 LYS A 67 2.662 -13.886 9.559 1.00 22.32 H new ATOM 0 HG2 LYS A 67 2.807 -14.273 7.076 1.00 33.31 H new ATOM 0 HG3 LYS A 67 4.521 -14.593 7.248 1.00 33.31 H new ATOM 0 HD2 LYS A 67 4.020 -16.513 8.770 1.00 53.51 H new ATOM 0 HD3 LYS A 67 2.305 -16.186 8.629 1.00 53.51 H new ATOM 0 HE2 LYS A 67 2.865 -18.018 7.134 1.00 40.31 H new ATOM 0 HE3 LYS A 67 2.433 -16.623 6.166 1.00 40.31 H new ATOM 0 HZ1 LYS A 67 4.372 -16.808 5.148 1.00 13.34 H new ATOM 0 HZ2 LYS A 67 5.185 -16.482 6.603 1.00 13.34 H new ATOM 0 HZ3 LYS A 67 4.839 -18.086 6.164 1.00 13.34 H new ATOM 1085 N LEU A 68 6.283 -11.945 8.982 1.00 41.24 N ATOM 1086 CA LEU A 68 7.666 -11.688 8.494 1.00 53.10 C ATOM 1087 C LEU A 68 8.184 -12.830 7.581 1.00 60.04 C ATOM 1088 O LEU A 68 7.801 -13.999 7.748 1.00 34.32 O ATOM 1089 CB LEU A 68 8.659 -11.503 9.677 1.00 34.15 C ATOM 1090 CG LEU A 68 8.328 -10.380 10.711 1.00 2.04 C ATOM 1091 CD1 LEU A 68 9.492 -10.175 11.697 1.00 41.43 C ATOM 1092 CD2 LEU A 68 7.951 -9.062 10.018 1.00 42.23 C ATOM 0 H LEU A 68 6.213 -12.061 9.993 1.00 41.24 H new ATOM 0 HA LEU A 68 7.615 -10.768 7.912 1.00 53.10 H new ATOM 0 HB2 LEU A 68 8.726 -12.449 10.214 1.00 34.15 H new ATOM 0 HB3 LEU A 68 9.647 -11.301 9.262 1.00 34.15 H new ATOM 0 HG LEU A 68 7.458 -10.708 11.280 1.00 2.04 H new ATOM 0 HD11 LEU A 68 9.234 -9.388 12.405 1.00 41.43 H new ATOM 0 HD12 LEU A 68 9.678 -11.103 12.238 1.00 41.43 H new ATOM 0 HD13 LEU A 68 10.389 -9.889 11.147 1.00 41.43 H new ATOM 0 HD21 LEU A 68 7.728 -8.306 10.771 1.00 42.23 H new ATOM 0 HD22 LEU A 68 8.783 -8.725 9.400 1.00 42.23 H new ATOM 0 HD23 LEU A 68 7.074 -9.219 9.390 1.00 42.23 H new ATOM 1104 N VAL A 69 9.053 -12.475 6.614 1.00 44.52 N ATOM 1105 CA VAL A 69 9.792 -13.469 5.808 1.00 40.22 C ATOM 1106 C VAL A 69 10.946 -14.052 6.655 1.00 4.24 C ATOM 1107 O VAL A 69 12.043 -13.475 6.723 1.00 3.55 O ATOM 1108 CB VAL A 69 10.357 -12.865 4.457 1.00 74.02 C ATOM 1109 CG1 VAL A 69 11.165 -13.922 3.647 1.00 41.30 C ATOM 1110 CG2 VAL A 69 9.224 -12.267 3.595 1.00 70.42 C ATOM 0 H VAL A 69 9.261 -11.506 6.371 1.00 44.52 H new ATOM 0 HA VAL A 69 9.091 -14.255 5.528 1.00 40.22 H new ATOM 0 HB VAL A 69 11.041 -12.060 4.727 1.00 74.02 H new ATOM 0 HG11 VAL A 69 11.536 -13.470 2.727 1.00 41.30 H new ATOM 0 HG12 VAL A 69 12.007 -14.272 4.244 1.00 41.30 H new ATOM 0 HG13 VAL A 69 10.518 -14.765 3.402 1.00 41.30 H new ATOM 0 HG21 VAL A 69 9.643 -11.860 2.675 1.00 70.42 H new ATOM 0 HG22 VAL A 69 8.502 -13.046 3.352 1.00 70.42 H new ATOM 0 HG23 VAL A 69 8.726 -11.472 4.149 1.00 70.42 H new ATOM 1302 N MET B 3 0.557 -15.511 -4.842 1.00 21.30 N ATOM 1303 CA MET B 3 0.429 -14.732 -3.590 1.00 74.13 C ATOM 1304 C MET B 3 0.000 -13.265 -3.846 1.00 70.03 C ATOM 1305 O MET B 3 0.043 -12.767 -4.981 1.00 72.03 O ATOM 1306 CB MET B 3 1.773 -14.772 -2.806 1.00 52.02 C ATOM 1307 CG MET B 3 2.237 -16.180 -2.353 1.00 23.52 C ATOM 1308 SD MET B 3 1.169 -16.948 -1.092 1.00 61.22 S ATOM 1309 CE MET B 3 -0.093 -17.810 -2.050 1.00 1.32 C ATOM 0 HA MET B 3 -0.359 -15.194 -2.996 1.00 74.13 H new ATOM 0 HB2 MET B 3 2.552 -14.335 -3.431 1.00 52.02 H new ATOM 0 HB3 MET B 3 1.679 -14.138 -1.924 1.00 52.02 H new ATOM 0 HG2 MET B 3 2.280 -16.834 -3.224 1.00 23.52 H new ATOM 0 HG3 MET B 3 3.251 -16.107 -1.959 1.00 23.52 H new ATOM 0 HE1 MET B 3 -1.081 -17.532 -1.683 1.00 1.32 H new ATOM 0 HE2 MET B 3 -0.005 -17.533 -3.101 1.00 1.32 H new ATOM 0 HE3 MET B 3 0.043 -18.886 -1.946 1.00 1.32 H new ATOM 1319 N LEU B 4 -0.386 -12.591 -2.743 1.00 2.34 N ATOM 1320 CA LEU B 4 -0.855 -11.180 -2.728 1.00 43.02 C ATOM 1321 C LEU B 4 0.210 -10.210 -3.331 1.00 53.13 C ATOM 1322 O LEU B 4 -0.140 -9.240 -4.017 1.00 10.31 O ATOM 1323 CB LEU B 4 -1.235 -10.801 -1.250 1.00 11.33 C ATOM 1324 CG LEU B 4 -2.112 -9.519 -0.985 1.00 20.43 C ATOM 1325 CD1 LEU B 4 -1.324 -8.200 -1.150 1.00 24.22 C ATOM 1326 CD2 LEU B 4 -3.383 -9.533 -1.859 1.00 73.30 C ATOM 0 H LEU B 4 -0.382 -13.017 -1.816 1.00 2.34 H new ATOM 0 HA LEU B 4 -1.736 -11.079 -3.362 1.00 43.02 H new ATOM 0 HB2 LEU B 4 -1.760 -11.653 -0.818 1.00 11.33 H new ATOM 0 HB3 LEU B 4 -0.306 -10.684 -0.692 1.00 11.33 H new ATOM 0 HG LEU B 4 -2.414 -9.557 0.062 1.00 20.43 H new ATOM 0 HD11 LEU B 4 -1.984 -7.355 -0.954 1.00 24.22 H new ATOM 0 HD12 LEU B 4 -0.493 -8.182 -0.445 1.00 24.22 H new ATOM 0 HD13 LEU B 4 -0.939 -8.131 -2.167 1.00 24.22 H new ATOM 0 HD21 LEU B 4 -3.972 -8.638 -1.659 1.00 73.30 H new ATOM 0 HD22 LEU B 4 -3.101 -9.553 -2.912 1.00 73.30 H new ATOM 0 HD23 LEU B 4 -3.976 -10.418 -1.625 1.00 73.30 H new ATOM 1338 N LYS B 5 1.500 -10.500 -3.087 1.00 64.33 N ATOM 1339 CA LYS B 5 2.627 -9.670 -3.588 1.00 64.43 C ATOM 1340 C LYS B 5 2.729 -9.696 -5.141 1.00 73.42 C ATOM 1341 O LYS B 5 2.991 -8.663 -5.771 1.00 4.41 O ATOM 1342 CB LYS B 5 3.964 -10.149 -2.957 1.00 1.43 C ATOM 1343 CG LYS B 5 5.214 -9.383 -3.459 1.00 34.11 C ATOM 1344 CD LYS B 5 6.522 -9.752 -2.723 1.00 42.23 C ATOM 1345 CE LYS B 5 6.578 -9.224 -1.278 1.00 14.43 C ATOM 1346 NZ LYS B 5 7.860 -9.576 -0.618 1.00 73.11 N ATOM 0 H LYS B 5 1.797 -11.309 -2.541 1.00 64.33 H new ATOM 0 HA LYS B 5 2.431 -8.640 -3.291 1.00 64.43 H new ATOM 0 HB2 LYS B 5 3.899 -10.046 -1.874 1.00 1.43 H new ATOM 0 HB3 LYS B 5 4.093 -11.210 -3.169 1.00 1.43 H new ATOM 0 HG2 LYS B 5 5.342 -9.578 -4.524 1.00 34.11 H new ATOM 0 HG3 LYS B 5 5.038 -8.313 -3.350 1.00 34.11 H new ATOM 0 HD2 LYS B 5 6.630 -10.837 -2.710 1.00 42.23 H new ATOM 0 HD3 LYS B 5 7.369 -9.354 -3.281 1.00 42.23 H new ATOM 0 HE2 LYS B 5 6.455 -8.141 -1.281 1.00 14.43 H new ATOM 0 HE3 LYS B 5 5.748 -9.638 -0.706 1.00 14.43 H new ATOM 0 HZ1 LYS B 5 7.830 -9.280 0.378 1.00 73.11 H new ATOM 0 HZ2 LYS B 5 8.006 -10.604 -0.669 1.00 73.11 H new ATOM 0 HZ3 LYS B 5 8.643 -9.091 -1.100 1.00 73.11 H new ATOM 1360 N GLU B 6 2.504 -10.881 -5.734 1.00 65.03 N ATOM 1361 CA GLU B 6 2.680 -11.112 -7.187 1.00 2.24 C ATOM 1362 C GLU B 6 1.615 -10.371 -8.030 1.00 2.31 C ATOM 1363 O GLU B 6 1.926 -9.806 -9.089 1.00 24.04 O ATOM 1364 CB GLU B 6 2.643 -12.635 -7.473 1.00 51.45 C ATOM 1365 CG GLU B 6 3.809 -13.412 -6.831 1.00 43.21 C ATOM 1366 CD GLU B 6 3.699 -14.933 -7.012 1.00 0.14 C ATOM 1367 OE1 GLU B 6 4.038 -15.446 -8.102 1.00 0.31 O ATOM 1368 OE2 GLU B 6 3.275 -15.623 -6.071 1.00 62.32 O ATOM 0 H GLU B 6 2.195 -11.708 -5.224 1.00 65.03 H new ATOM 0 HA GLU B 6 3.649 -10.707 -7.480 1.00 2.24 H new ATOM 0 HB2 GLU B 6 1.701 -13.042 -7.107 1.00 51.45 H new ATOM 0 HB3 GLU B 6 2.661 -12.794 -8.551 1.00 51.45 H new ATOM 0 HG2 GLU B 6 4.748 -13.069 -7.265 1.00 43.21 H new ATOM 0 HG3 GLU B 6 3.847 -13.182 -5.766 1.00 43.21 H new ATOM 1375 N LYS B 7 0.354 -10.385 -7.556 1.00 50.34 N ATOM 1376 CA LYS B 7 -0.746 -9.632 -8.199 1.00 52.23 C ATOM 1377 C LYS B 7 -0.628 -8.103 -7.942 1.00 64.40 C ATOM 1378 O LYS B 7 -1.083 -7.303 -8.758 1.00 50.20 O ATOM 1379 CB LYS B 7 -2.132 -10.223 -7.781 1.00 61.22 C ATOM 1380 CG LYS B 7 -2.436 -10.289 -6.253 1.00 24.41 C ATOM 1381 CD LYS B 7 -3.029 -8.978 -5.670 1.00 11.05 C ATOM 1382 CE LYS B 7 -4.399 -8.610 -6.280 1.00 72.41 C ATOM 1383 NZ LYS B 7 -5.019 -7.456 -5.587 1.00 30.23 N ATOM 0 H LYS B 7 0.069 -10.910 -6.729 1.00 50.34 H new ATOM 0 HA LYS B 7 -0.662 -9.752 -9.279 1.00 52.23 H new ATOM 0 HB2 LYS B 7 -2.912 -9.629 -8.257 1.00 61.22 H new ATOM 0 HB3 LYS B 7 -2.207 -11.232 -8.186 1.00 61.22 H new ATOM 0 HG2 LYS B 7 -3.134 -11.106 -6.067 1.00 24.41 H new ATOM 0 HG3 LYS B 7 -1.516 -10.528 -5.720 1.00 24.41 H new ATOM 0 HD2 LYS B 7 -3.135 -9.083 -4.590 1.00 11.05 H new ATOM 0 HD3 LYS B 7 -2.329 -8.161 -5.844 1.00 11.05 H new ATOM 0 HE2 LYS B 7 -4.275 -8.375 -7.337 1.00 72.41 H new ATOM 0 HE3 LYS B 7 -5.066 -9.470 -6.221 1.00 72.41 H new ATOM 0 HZ1 LYS B 7 -5.774 -7.058 -6.182 1.00 30.23 H new ATOM 0 HZ2 LYS B 7 -5.422 -7.770 -4.681 1.00 30.23 H new ATOM 0 HZ3 LYS B 7 -4.297 -6.728 -5.411 1.00 30.23 H new ATOM 1397 N ALA B 8 0.008 -7.713 -6.813 1.00 32.12 N ATOM 1398 CA ALA B 8 0.306 -6.290 -6.498 1.00 54.22 C ATOM 1399 C ALA B 8 1.299 -5.681 -7.522 1.00 5.01 C ATOM 1400 O ALA B 8 1.162 -4.519 -7.921 1.00 32.42 O ATOM 1401 CB ALA B 8 0.869 -6.175 -5.076 1.00 21.12 C ATOM 0 H ALA B 8 0.328 -8.367 -6.098 1.00 32.12 H new ATOM 0 HA ALA B 8 -0.625 -5.726 -6.562 1.00 54.22 H new ATOM 0 HB1 ALA B 8 1.085 -5.130 -4.853 1.00 21.12 H new ATOM 0 HB2 ALA B 8 0.137 -6.554 -4.363 1.00 21.12 H new ATOM 0 HB3 ALA B 8 1.786 -6.759 -5.000 1.00 21.12 H new ATOM 1407 N GLY B 9 2.290 -6.500 -7.936 1.00 25.43 N ATOM 1408 CA GLY B 9 3.244 -6.122 -8.989 1.00 32.23 C ATOM 1409 C GLY B 9 2.602 -5.943 -10.376 1.00 22.41 C ATOM 1410 O GLY B 9 3.060 -5.122 -11.177 1.00 70.43 O ATOM 0 H GLY B 9 2.446 -7.432 -7.551 1.00 25.43 H new ATOM 0 HA2 GLY B 9 3.735 -5.192 -8.704 1.00 32.23 H new ATOM 0 HA3 GLY B 9 4.020 -6.885 -9.054 1.00 32.23 H new ATOM 1414 N ALA B 10 1.550 -6.733 -10.663 1.00 50.21 N ATOM 1415 CA ALA B 10 0.753 -6.598 -11.907 1.00 2.24 C ATOM 1416 C ALA B 10 -0.075 -5.284 -11.913 1.00 21.02 C ATOM 1417 O ALA B 10 -0.101 -4.555 -12.916 1.00 71.14 O ATOM 1418 CB ALA B 10 -0.162 -7.819 -12.076 1.00 61.03 C ATOM 0 H ALA B 10 1.227 -7.479 -10.047 1.00 50.21 H new ATOM 0 HA ALA B 10 1.442 -6.551 -12.750 1.00 2.24 H new ATOM 0 HB1 ALA B 10 -0.744 -7.713 -12.991 1.00 61.03 H new ATOM 0 HB2 ALA B 10 0.444 -8.723 -12.134 1.00 61.03 H new ATOM 0 HB3 ALA B 10 -0.837 -7.889 -11.223 1.00 61.03 H new ATOM 1424 N LEU B 11 -0.733 -4.993 -10.766 1.00 64.31 N ATOM 1425 CA LEU B 11 -1.517 -3.747 -10.555 1.00 23.13 C ATOM 1426 C LEU B 11 -0.623 -2.490 -10.665 1.00 22.01 C ATOM 1427 O LEU B 11 -1.068 -1.446 -11.134 1.00 42.41 O ATOM 1428 CB LEU B 11 -2.210 -3.785 -9.168 1.00 31.20 C ATOM 1429 CG LEU B 11 -3.230 -4.948 -8.949 1.00 2.55 C ATOM 1430 CD1 LEU B 11 -3.718 -4.992 -7.491 1.00 14.54 C ATOM 1431 CD2 LEU B 11 -4.414 -4.858 -9.938 1.00 3.32 C ATOM 0 H LEU B 11 -0.737 -5.615 -9.958 1.00 64.31 H new ATOM 0 HA LEU B 11 -2.273 -3.690 -11.338 1.00 23.13 H new ATOM 0 HB2 LEU B 11 -1.440 -3.853 -8.400 1.00 31.20 H new ATOM 0 HB3 LEU B 11 -2.729 -2.839 -9.016 1.00 31.20 H new ATOM 0 HG LEU B 11 -2.709 -5.884 -9.152 1.00 2.55 H new ATOM 0 HD11 LEU B 11 -4.427 -5.811 -7.369 1.00 14.54 H new ATOM 0 HD12 LEU B 11 -2.867 -5.146 -6.827 1.00 14.54 H new ATOM 0 HD13 LEU B 11 -4.206 -4.050 -7.242 1.00 14.54 H new ATOM 0 HD21 LEU B 11 -5.103 -5.683 -9.756 1.00 3.32 H new ATOM 0 HD22 LEU B 11 -4.935 -3.911 -9.796 1.00 3.32 H new ATOM 0 HD23 LEU B 11 -4.040 -4.916 -10.960 1.00 3.32 H new ATOM 1443 N ALA B 12 0.642 -2.623 -10.237 1.00 22.35 N ATOM 1444 CA ALA B 12 1.658 -1.554 -10.343 1.00 10.14 C ATOM 1445 C ALA B 12 1.821 -1.045 -11.794 1.00 41.41 C ATOM 1446 O ALA B 12 1.904 0.167 -12.039 1.00 21.32 O ATOM 1447 CB ALA B 12 3.004 -2.058 -9.804 1.00 63.42 C ATOM 0 H ALA B 12 0.994 -3.477 -9.805 1.00 22.35 H new ATOM 0 HA ALA B 12 1.314 -0.712 -9.742 1.00 10.14 H new ATOM 0 HB1 ALA B 12 3.748 -1.266 -9.885 1.00 63.42 H new ATOM 0 HB2 ALA B 12 2.893 -2.346 -8.759 1.00 63.42 H new ATOM 0 HB3 ALA B 12 3.328 -2.921 -10.385 1.00 63.42 H new ATOM 1453 N GLY B 13 1.859 -2.001 -12.742 1.00 31.23 N ATOM 1454 CA GLY B 13 2.008 -1.696 -14.170 1.00 4.03 C ATOM 1455 C GLY B 13 0.893 -0.808 -14.735 1.00 43.01 C ATOM 1456 O GLY B 13 1.169 0.219 -15.363 1.00 41.41 O ATOM 0 H GLY B 13 1.788 -2.998 -12.537 1.00 31.23 H new ATOM 0 HA2 GLY B 13 2.967 -1.203 -14.328 1.00 4.03 H new ATOM 0 HA3 GLY B 13 2.034 -2.631 -14.730 1.00 4.03 H new ATOM 1460 N GLN B 14 -0.369 -1.202 -14.487 1.00 35.31 N ATOM 1461 CA GLN B 14 -1.553 -0.492 -15.029 1.00 2.13 C ATOM 1462 C GLN B 14 -1.759 0.905 -14.373 1.00 51.11 C ATOM 1463 O GLN B 14 -2.220 1.839 -15.034 1.00 73.42 O ATOM 1464 CB GLN B 14 -2.829 -1.369 -14.884 1.00 21.13 C ATOM 1465 CG GLN B 14 -3.241 -1.694 -13.433 1.00 43.40 C ATOM 1466 CD GLN B 14 -4.479 -2.590 -13.299 1.00 43.42 C ATOM 1467 OE1 GLN B 14 -5.252 -2.457 -12.362 1.00 71.34 O ATOM 1468 NE2 GLN B 14 -4.656 -3.539 -14.202 1.00 2.35 N ATOM 0 H GLN B 14 -0.601 -2.012 -13.912 1.00 35.31 H new ATOM 0 HA GLN B 14 -1.367 -0.317 -16.089 1.00 2.13 H new ATOM 0 HB2 GLN B 14 -3.658 -0.860 -15.375 1.00 21.13 H new ATOM 0 HB3 GLN B 14 -2.669 -2.306 -15.418 1.00 21.13 H new ATOM 0 HG2 GLN B 14 -2.403 -2.180 -12.933 1.00 43.40 H new ATOM 0 HG3 GLN B 14 -3.428 -0.759 -12.906 1.00 43.40 H new ATOM 0 HE21 GLN B 14 -4.000 -3.634 -14.977 1.00 2.35 H new ATOM 0 HE22 GLN B 14 -5.449 -4.176 -14.124 1.00 2.35 H new ATOM 1477 N ILE B 15 -1.411 1.026 -13.071 1.00 62.30 N ATOM 1478 CA ILE B 15 -1.500 2.304 -12.312 1.00 14.02 C ATOM 1479 C ILE B 15 -0.472 3.335 -12.837 1.00 60.02 C ATOM 1480 O ILE B 15 -0.803 4.513 -13.030 1.00 12.03 O ATOM 1481 CB ILE B 15 -1.310 2.036 -10.764 1.00 63.15 C ATOM 1482 CG1 ILE B 15 -2.514 1.197 -10.221 1.00 55.23 C ATOM 1483 CG2 ILE B 15 -1.134 3.348 -9.947 1.00 20.41 C ATOM 1484 CD1 ILE B 15 -2.377 0.745 -8.781 1.00 40.25 C ATOM 0 H ILE B 15 -1.061 0.246 -12.515 1.00 62.30 H new ATOM 0 HA ILE B 15 -2.492 2.729 -12.464 1.00 14.02 H new ATOM 0 HB ILE B 15 -0.387 1.470 -10.638 1.00 63.15 H new ATOM 0 HG12 ILE B 15 -3.424 1.790 -10.316 1.00 55.23 H new ATOM 0 HG13 ILE B 15 -2.640 0.318 -10.853 1.00 55.23 H new ATOM 0 HG21 ILE B 15 -1.008 3.105 -8.892 1.00 20.41 H new ATOM 0 HG22 ILE B 15 -0.254 3.884 -10.304 1.00 20.41 H new ATOM 0 HG23 ILE B 15 -2.016 3.976 -10.072 1.00 20.41 H new ATOM 0 HD11 ILE B 15 -3.258 0.171 -8.494 1.00 40.25 H new ATOM 0 HD12 ILE B 15 -1.489 0.121 -8.678 1.00 40.25 H new ATOM 0 HD13 ILE B 15 -2.285 1.617 -8.133 1.00 40.25 H new ATOM 1496 N TRP B 16 0.766 2.867 -13.081 1.00 12.20 N ATOM 1497 CA TRP B 16 1.837 3.684 -13.703 1.00 24.35 C ATOM 1498 C TRP B 16 1.432 4.135 -15.131 1.00 1.14 C ATOM 1499 O TRP B 16 1.650 5.290 -15.519 1.00 50.44 O ATOM 1500 CB TRP B 16 3.164 2.876 -13.758 1.00 13.31 C ATOM 1501 CG TRP B 16 4.377 3.695 -14.161 1.00 73.25 C ATOM 1502 CD1 TRP B 16 5.241 4.337 -13.320 1.00 21.53 C ATOM 1503 CD2 TRP B 16 4.848 3.971 -15.496 1.00 54.13 C ATOM 1504 NE1 TRP B 16 6.208 4.989 -14.041 1.00 72.00 N ATOM 1505 CE2 TRP B 16 5.990 4.784 -15.375 1.00 0.42 C ATOM 1506 CE3 TRP B 16 4.412 3.612 -16.779 1.00 12.54 C ATOM 1507 CZ2 TRP B 16 6.701 5.244 -16.482 1.00 62.42 C ATOM 1508 CZ3 TRP B 16 5.114 4.071 -17.876 1.00 14.34 C ATOM 1509 CH2 TRP B 16 6.248 4.880 -17.722 1.00 21.24 C ATOM 0 H TRP B 16 1.056 1.916 -12.855 1.00 12.20 H new ATOM 0 HA TRP B 16 1.985 4.574 -13.091 1.00 24.35 H new ATOM 0 HB2 TRP B 16 3.348 2.434 -12.779 1.00 13.31 H new ATOM 0 HB3 TRP B 16 3.046 2.053 -14.462 1.00 13.31 H new ATOM 0 HD1 TRP B 16 5.172 4.332 -12.242 1.00 21.53 H new ATOM 0 HE1 TRP B 16 6.970 5.540 -13.645 1.00 72.00 H new ATOM 0 HE3 TRP B 16 3.541 2.986 -16.907 1.00 12.54 H new ATOM 0 HZ2 TRP B 16 7.577 5.865 -16.366 1.00 62.42 H new ATOM 0 HZ3 TRP B 16 4.784 3.802 -18.869 1.00 14.34 H new ATOM 0 HH2 TRP B 16 6.776 5.224 -18.600 1.00 21.24 H new ATOM 1520 N GLU B 17 0.855 3.191 -15.896 1.00 32.25 N ATOM 1521 CA GLU B 17 0.428 3.409 -17.298 1.00 20.33 C ATOM 1522 C GLU B 17 -0.693 4.486 -17.359 1.00 40.42 C ATOM 1523 O GLU B 17 -0.707 5.332 -18.263 1.00 54.14 O ATOM 1524 CB GLU B 17 -0.029 2.035 -17.900 1.00 64.20 C ATOM 1525 CG GLU B 17 -0.095 1.925 -19.449 1.00 43.14 C ATOM 1526 CD GLU B 17 -1.253 2.700 -20.113 1.00 73.35 C ATOM 1527 OE1 GLU B 17 -2.423 2.298 -19.938 1.00 64.11 O ATOM 1528 OE2 GLU B 17 -1.001 3.699 -20.823 1.00 24.44 O ATOM 0 H GLU B 17 0.669 2.246 -15.560 1.00 32.25 H new ATOM 0 HA GLU B 17 1.256 3.788 -17.897 1.00 20.33 H new ATOM 0 HB2 GLU B 17 0.650 1.264 -17.535 1.00 64.20 H new ATOM 0 HB3 GLU B 17 -1.017 1.804 -17.502 1.00 64.20 H new ATOM 0 HG2 GLU B 17 0.847 2.285 -19.863 1.00 43.14 H new ATOM 0 HG3 GLU B 17 -0.181 0.873 -19.719 1.00 43.14 H new ATOM 1535 N ALA B 18 -1.593 4.457 -16.354 1.00 51.33 N ATOM 1536 CA ALA B 18 -2.676 5.459 -16.186 1.00 15.20 C ATOM 1537 C ALA B 18 -2.106 6.890 -15.994 1.00 74.50 C ATOM 1538 O ALA B 18 -2.649 7.868 -16.510 1.00 11.23 O ATOM 1539 CB ALA B 18 -3.562 5.067 -14.988 1.00 12.23 C ATOM 0 H ALA B 18 -1.592 3.737 -15.632 1.00 51.33 H new ATOM 0 HA ALA B 18 -3.277 5.467 -17.095 1.00 15.20 H new ATOM 0 HB1 ALA B 18 -4.356 5.804 -14.866 1.00 12.23 H new ATOM 0 HB2 ALA B 18 -4.002 4.086 -15.166 1.00 12.23 H new ATOM 0 HB3 ALA B 18 -2.956 5.034 -14.083 1.00 12.23 H new ATOM 1545 N LEU B 19 -0.995 6.976 -15.250 1.00 44.44 N ATOM 1546 CA LEU B 19 -0.271 8.240 -14.992 1.00 25.44 C ATOM 1547 C LEU B 19 0.570 8.699 -16.208 1.00 25.11 C ATOM 1548 O LEU B 19 0.864 9.894 -16.343 1.00 65.13 O ATOM 1549 CB LEU B 19 0.644 8.045 -13.762 1.00 22.55 C ATOM 1550 CG LEU B 19 -0.084 7.858 -12.399 1.00 75.02 C ATOM 1551 CD1 LEU B 19 0.889 7.383 -11.299 1.00 41.24 C ATOM 1552 CD2 LEU B 19 -0.799 9.166 -11.995 1.00 33.34 C ATOM 0 H LEU B 19 -0.565 6.166 -14.804 1.00 44.44 H new ATOM 0 HA LEU B 19 -1.008 9.021 -14.805 1.00 25.44 H new ATOM 0 HB2 LEU B 19 1.276 7.174 -13.937 1.00 22.55 H new ATOM 0 HB3 LEU B 19 1.305 8.908 -13.684 1.00 22.55 H new ATOM 0 HG LEU B 19 -0.836 7.078 -12.516 1.00 75.02 H new ATOM 0 HD11 LEU B 19 0.347 7.263 -10.361 1.00 41.24 H new ATOM 0 HD12 LEU B 19 1.328 6.429 -11.589 1.00 41.24 H new ATOM 0 HD13 LEU B 19 1.680 8.122 -11.169 1.00 41.24 H new ATOM 0 HD21 LEU B 19 -1.305 9.024 -11.040 1.00 33.34 H new ATOM 0 HD22 LEU B 19 -0.066 9.967 -11.902 1.00 33.34 H new ATOM 0 HD23 LEU B 19 -1.531 9.431 -12.758 1.00 33.34 H new ATOM 1564 N ASN B 20 0.968 7.753 -17.081 1.00 31.21 N ATOM 1565 CA ASN B 20 1.827 8.056 -18.243 1.00 71.52 C ATOM 1566 C ASN B 20 1.032 8.836 -19.321 1.00 32.22 C ATOM 1567 O ASN B 20 -0.101 8.473 -19.656 1.00 52.15 O ATOM 1568 CB ASN B 20 2.446 6.752 -18.820 1.00 3.23 C ATOM 1569 CG ASN B 20 3.537 7.006 -19.870 1.00 54.10 C ATOM 1570 OD1 ASN B 20 4.222 8.026 -19.847 1.00 21.24 O ATOM 1571 ND2 ASN B 20 3.716 6.076 -20.787 1.00 24.21 N ATOM 0 H ASN B 20 0.707 6.770 -17.003 1.00 31.21 H new ATOM 0 HA ASN B 20 2.648 8.693 -17.914 1.00 71.52 H new ATOM 0 HB2 ASN B 20 2.868 6.167 -18.003 1.00 3.23 H new ATOM 0 HB3 ASN B 20 1.655 6.150 -19.267 1.00 3.23 H new ATOM 0 HD21 ASN B 20 4.436 6.194 -21.499 1.00 24.21 H new ATOM 0 HD22 ASN B 20 3.134 5.238 -20.784 1.00 24.21 H new ATOM 1578 N GLY B 21 1.644 9.918 -19.837 1.00 12.40 N ATOM 1579 CA GLY B 21 0.996 10.817 -20.812 1.00 43.22 C ATOM 1580 C GLY B 21 0.238 11.994 -20.180 1.00 12.03 C ATOM 1581 O GLY B 21 -0.329 12.828 -20.897 1.00 10.04 O ATOM 0 H GLY B 21 2.595 10.193 -19.592 1.00 12.40 H new ATOM 0 HA2 GLY B 21 1.756 11.210 -21.487 1.00 43.22 H new ATOM 0 HA3 GLY B 21 0.301 10.236 -21.418 1.00 43.22 H new ATOM 1585 N THR B 22 0.224 12.062 -18.832 1.00 44.01 N ATOM 1586 CA THR B 22 -0.398 13.180 -18.072 1.00 3.20 C ATOM 1587 C THR B 22 0.648 13.850 -17.151 1.00 55.51 C ATOM 1588 O THR B 22 1.750 13.321 -16.949 1.00 51.51 O ATOM 1589 CB THR B 22 -1.607 12.701 -17.183 1.00 43.33 C ATOM 1590 OG1 THR B 22 -1.141 11.883 -16.093 1.00 55.23 O ATOM 1591 CG2 THR B 22 -2.661 11.920 -17.992 1.00 55.44 C ATOM 0 H THR B 22 0.641 11.347 -18.236 1.00 44.01 H new ATOM 0 HA THR B 22 -0.770 13.889 -18.812 1.00 3.20 H new ATOM 0 HB THR B 22 -2.083 13.601 -16.795 1.00 43.33 H new ATOM 0 HG1 THR B 22 -0.438 11.280 -16.414 1.00 55.23 H new ATOM 0 HG21 THR B 22 -3.472 11.613 -17.332 1.00 55.44 H new ATOM 0 HG22 THR B 22 -3.058 12.557 -18.783 1.00 55.44 H new ATOM 0 HG23 THR B 22 -2.199 11.037 -18.434 1.00 55.44 H new ATOM 1599 N GLU B 23 0.280 15.007 -16.572 1.00 61.03 N ATOM 1600 CA GLU B 23 1.108 15.706 -15.550 1.00 35.05 C ATOM 1601 C GLU B 23 0.893 15.102 -14.130 1.00 73.50 C ATOM 1602 O GLU B 23 1.457 15.592 -13.142 1.00 44.02 O ATOM 1603 CB GLU B 23 0.764 17.222 -15.552 1.00 23.53 C ATOM 1604 CG GLU B 23 -0.674 17.553 -15.104 1.00 20.41 C ATOM 1605 CD GLU B 23 -1.023 19.039 -15.264 1.00 23.11 C ATOM 1606 OE1 GLU B 23 -1.520 19.429 -16.342 1.00 14.52 O ATOM 1607 OE2 GLU B 23 -0.799 19.826 -14.319 1.00 33.32 O ATOM 0 H GLU B 23 -0.592 15.488 -16.792 1.00 61.03 H new ATOM 0 HA GLU B 23 2.159 15.570 -15.807 1.00 35.05 H new ATOM 0 HB2 GLU B 23 1.464 17.741 -14.897 1.00 23.53 H new ATOM 0 HB3 GLU B 23 0.917 17.615 -16.557 1.00 23.53 H new ATOM 0 HG2 GLU B 23 -1.377 16.956 -15.685 1.00 20.41 H new ATOM 0 HG3 GLU B 23 -0.799 17.266 -14.060 1.00 20.41 H new ATOM 1614 N GLY B 24 0.082 14.028 -14.061 1.00 13.15 N ATOM 1615 CA GLY B 24 -0.330 13.402 -12.804 1.00 5.22 C ATOM 1616 C GLY B 24 -1.847 13.285 -12.691 1.00 71.14 C ATOM 1617 O GLY B 24 -2.582 14.089 -13.278 1.00 33.02 O ATOM 0 H GLY B 24 -0.305 13.572 -14.887 1.00 13.15 H new ATOM 0 HA2 GLY B 24 0.116 12.410 -12.730 1.00 5.22 H new ATOM 0 HA3 GLY B 24 0.051 13.986 -11.967 1.00 5.22 H new ATOM 1621 N LEU B 25 -2.318 12.290 -11.919 1.00 24.31 N ATOM 1622 CA LEU B 25 -3.758 12.029 -11.694 1.00 34.33 C ATOM 1623 C LEU B 25 -4.020 11.777 -10.195 1.00 12.41 C ATOM 1624 O LEU B 25 -3.125 11.336 -9.467 1.00 32.32 O ATOM 1625 CB LEU B 25 -4.237 10.792 -12.516 1.00 71.13 C ATOM 1626 CG LEU B 25 -4.219 10.919 -14.075 1.00 43.15 C ATOM 1627 CD1 LEU B 25 -4.728 9.620 -14.738 1.00 21.11 C ATOM 1628 CD2 LEU B 25 -5.035 12.141 -14.557 1.00 53.41 C ATOM 0 H LEU B 25 -1.708 11.637 -11.428 1.00 24.31 H new ATOM 0 HA LEU B 25 -4.315 12.906 -12.024 1.00 34.33 H new ATOM 0 HB2 LEU B 25 -3.615 9.941 -12.239 1.00 71.13 H new ATOM 0 HB3 LEU B 25 -5.256 10.556 -12.208 1.00 71.13 H new ATOM 0 HG LEU B 25 -3.184 11.076 -14.380 1.00 43.15 H new ATOM 0 HD11 LEU B 25 -4.706 9.732 -15.822 1.00 21.11 H new ATOM 0 HD12 LEU B 25 -4.088 8.788 -14.446 1.00 21.11 H new ATOM 0 HD13 LEU B 25 -5.750 9.422 -14.414 1.00 21.11 H new ATOM 0 HD21 LEU B 25 -4.999 12.196 -15.645 1.00 53.41 H new ATOM 0 HD22 LEU B 25 -6.071 12.038 -14.233 1.00 53.41 H new ATOM 0 HD23 LEU B 25 -4.611 13.052 -14.133 1.00 53.41 H new ATOM 1640 N THR B 26 -5.259 12.048 -9.745 1.00 31.12 N ATOM 1641 CA THR B 26 -5.706 11.690 -8.376 1.00 14.10 C ATOM 1642 C THR B 26 -6.036 10.185 -8.298 1.00 40.34 C ATOM 1643 O THR B 26 -6.157 9.519 -9.334 1.00 10.12 O ATOM 1644 CB THR B 26 -6.967 12.499 -7.930 1.00 1.31 C ATOM 1645 OG1 THR B 26 -8.088 12.163 -8.768 1.00 64.43 O ATOM 1646 CG2 THR B 26 -6.720 14.019 -7.973 1.00 23.30 C ATOM 0 H THR B 26 -5.972 12.514 -10.306 1.00 31.12 H new ATOM 0 HA THR B 26 -4.883 11.938 -7.705 1.00 14.10 H new ATOM 0 HB THR B 26 -7.184 12.227 -6.897 1.00 1.31 H new ATOM 0 HG1 THR B 26 -8.875 12.672 -8.482 1.00 64.43 H new ATOM 0 HG21 THR B 26 -7.621 14.543 -7.656 1.00 23.30 H new ATOM 0 HG22 THR B 26 -5.898 14.273 -7.304 1.00 23.30 H new ATOM 0 HG23 THR B 26 -6.466 14.318 -8.990 1.00 23.30 H new ATOM 1654 N GLN B 27 -6.203 9.661 -7.066 1.00 72.31 N ATOM 1655 CA GLN B 27 -6.500 8.231 -6.836 1.00 4.03 C ATOM 1656 C GLN B 27 -7.790 7.776 -7.567 1.00 50.13 C ATOM 1657 O GLN B 27 -7.867 6.646 -8.035 1.00 1.45 O ATOM 1658 CB GLN B 27 -6.596 7.926 -5.315 1.00 71.43 C ATOM 1659 CG GLN B 27 -7.769 8.596 -4.569 1.00 50.13 C ATOM 1660 CD GLN B 27 -7.850 8.181 -3.102 1.00 44.42 C ATOM 1661 OE1 GLN B 27 -7.292 8.834 -2.228 1.00 43.20 O ATOM 1662 NE2 GLN B 27 -8.522 7.074 -2.827 1.00 21.51 N ATOM 0 H GLN B 27 -6.137 10.211 -6.210 1.00 72.31 H new ATOM 0 HA GLN B 27 -5.672 7.660 -7.256 1.00 4.03 H new ATOM 0 HB2 GLN B 27 -6.676 6.847 -5.184 1.00 71.43 H new ATOM 0 HB3 GLN B 27 -5.664 8.236 -4.842 1.00 71.43 H new ATOM 0 HG2 GLN B 27 -7.662 9.679 -4.630 1.00 50.13 H new ATOM 0 HG3 GLN B 27 -8.704 8.340 -5.067 1.00 50.13 H new ATOM 0 HE21 GLN B 27 -8.976 6.553 -3.577 1.00 21.51 H new ATOM 0 HE22 GLN B 27 -8.586 6.742 -1.865 1.00 21.51 H new ATOM 1671 N LYS B 28 -8.786 8.688 -7.646 1.00 62.00 N ATOM 1672 CA LYS B 28 -10.057 8.467 -8.379 1.00 14.41 C ATOM 1673 C LYS B 28 -9.826 8.389 -9.913 1.00 41.40 C ATOM 1674 O LYS B 28 -10.424 7.545 -10.587 1.00 44.11 O ATOM 1675 CB LYS B 28 -11.075 9.593 -7.995 1.00 62.42 C ATOM 1676 CG LYS B 28 -12.566 9.352 -8.392 1.00 51.24 C ATOM 1677 CD LYS B 28 -12.882 9.620 -9.889 1.00 5.12 C ATOM 1678 CE LYS B 28 -14.349 9.342 -10.247 1.00 12.31 C ATOM 1679 NZ LYS B 28 -15.281 10.233 -9.509 1.00 61.10 N ATOM 0 H LYS B 28 -8.731 9.604 -7.201 1.00 62.00 H new ATOM 0 HA LYS B 28 -10.475 7.504 -8.087 1.00 14.41 H new ATOM 0 HB2 LYS B 28 -11.029 9.740 -6.916 1.00 62.42 H new ATOM 0 HB3 LYS B 28 -10.745 10.523 -8.458 1.00 62.42 H new ATOM 0 HG2 LYS B 28 -12.830 8.321 -8.156 1.00 51.24 H new ATOM 0 HG3 LYS B 28 -13.201 9.992 -7.779 1.00 51.24 H new ATOM 0 HD2 LYS B 28 -12.646 10.657 -10.125 1.00 5.12 H new ATOM 0 HD3 LYS B 28 -12.237 8.997 -10.509 1.00 5.12 H new ATOM 0 HE2 LYS B 28 -14.492 9.476 -11.319 1.00 12.31 H new ATOM 0 HE3 LYS B 28 -14.586 8.302 -10.021 1.00 12.31 H new ATOM 0 HZ1 LYS B 28 -16.248 10.095 -9.865 1.00 61.10 H new ATOM 0 HZ2 LYS B 28 -15.250 10.005 -8.495 1.00 61.10 H new ATOM 0 HZ3 LYS B 28 -14.998 11.224 -9.650 1.00 61.10 H new ATOM 1693 N GLN B 29 -8.979 9.277 -10.462 1.00 71.20 N ATOM 1694 CA GLN B 29 -8.707 9.320 -11.925 1.00 23.34 C ATOM 1695 C GLN B 29 -7.940 8.067 -12.400 1.00 45.24 C ATOM 1696 O GLN B 29 -8.179 7.558 -13.501 1.00 41.12 O ATOM 1697 CB GLN B 29 -7.930 10.606 -12.300 1.00 40.50 C ATOM 1698 CG GLN B 29 -8.649 11.935 -11.960 1.00 14.12 C ATOM 1699 CD GLN B 29 -9.939 12.217 -12.758 1.00 11.44 C ATOM 1700 OE1 GLN B 29 -10.667 11.322 -13.174 1.00 0.01 O ATOM 1701 NE2 GLN B 29 -10.242 13.477 -12.959 1.00 53.00 N ATOM 0 H GLN B 29 -8.468 9.976 -9.923 1.00 71.20 H new ATOM 0 HA GLN B 29 -9.670 9.332 -12.436 1.00 23.34 H new ATOM 0 HB2 GLN B 29 -6.967 10.591 -11.789 1.00 40.50 H new ATOM 0 HB3 GLN B 29 -7.723 10.587 -13.370 1.00 40.50 H new ATOM 0 HG2 GLN B 29 -8.893 11.934 -10.898 1.00 14.12 H new ATOM 0 HG3 GLN B 29 -7.953 12.757 -12.126 1.00 14.12 H new ATOM 0 HE21 GLN B 29 -9.628 14.212 -12.608 1.00 53.00 H new ATOM 0 HE22 GLN B 29 -11.092 13.722 -13.467 1.00 53.00 H new ATOM 1710 N ILE B 30 -7.017 7.587 -11.552 1.00 73.23 N ATOM 1711 CA ILE B 30 -6.291 6.319 -11.779 1.00 14.34 C ATOM 1712 C ILE B 30 -7.249 5.109 -11.632 1.00 21.32 C ATOM 1713 O ILE B 30 -7.210 4.187 -12.436 1.00 10.31 O ATOM 1714 CB ILE B 30 -5.092 6.177 -10.774 1.00 75.24 C ATOM 1715 CG1 ILE B 30 -4.151 7.426 -10.849 1.00 4.25 C ATOM 1716 CG2 ILE B 30 -4.297 4.872 -11.035 1.00 35.14 C ATOM 1717 CD1 ILE B 30 -3.098 7.504 -9.750 1.00 63.31 C ATOM 0 H ILE B 30 -6.750 8.063 -10.690 1.00 73.23 H new ATOM 0 HA ILE B 30 -5.896 6.334 -12.795 1.00 14.34 H new ATOM 0 HB ILE B 30 -5.505 6.122 -9.767 1.00 75.24 H new ATOM 0 HG12 ILE B 30 -3.647 7.425 -11.815 1.00 4.25 H new ATOM 0 HG13 ILE B 30 -4.763 8.327 -10.810 1.00 4.25 H new ATOM 0 HG21 ILE B 30 -3.473 4.800 -10.325 1.00 35.14 H new ATOM 0 HG22 ILE B 30 -4.957 4.013 -10.913 1.00 35.14 H new ATOM 0 HG23 ILE B 30 -3.901 4.884 -12.050 1.00 35.14 H new ATOM 0 HD11 ILE B 30 -2.496 8.402 -9.886 1.00 63.31 H new ATOM 0 HD12 ILE B 30 -3.589 7.541 -8.778 1.00 63.31 H new ATOM 0 HD13 ILE B 30 -2.455 6.625 -9.799 1.00 63.31 H new ATOM 1729 N LYS B 31 -8.112 5.168 -10.593 1.00 22.03 N ATOM 1730 CA LYS B 31 -9.172 4.154 -10.295 1.00 41.41 C ATOM 1731 C LYS B 31 -10.059 3.889 -11.542 1.00 62.25 C ATOM 1732 O LYS B 31 -10.343 2.741 -11.900 1.00 11.12 O ATOM 1733 CB LYS B 31 -10.055 4.701 -9.137 1.00 61.55 C ATOM 1734 CG LYS B 31 -11.073 3.721 -8.517 1.00 55.53 C ATOM 1735 CD LYS B 31 -10.422 2.737 -7.519 1.00 4.12 C ATOM 1736 CE LYS B 31 -11.468 1.894 -6.775 1.00 22.53 C ATOM 1737 NZ LYS B 31 -12.494 2.724 -6.094 1.00 54.13 N ATOM 0 H LYS B 31 -8.098 5.934 -9.919 1.00 22.03 H new ATOM 0 HA LYS B 31 -8.700 3.213 -10.013 1.00 41.41 H new ATOM 0 HB2 LYS B 31 -9.395 5.053 -8.344 1.00 61.55 H new ATOM 0 HB3 LYS B 31 -10.601 5.569 -9.507 1.00 61.55 H new ATOM 0 HG2 LYS B 31 -11.852 4.287 -8.007 1.00 55.53 H new ATOM 0 HG3 LYS B 31 -11.559 3.157 -9.313 1.00 55.53 H new ATOM 0 HD2 LYS B 31 -9.739 2.077 -8.054 1.00 4.12 H new ATOM 0 HD3 LYS B 31 -9.826 3.295 -6.797 1.00 4.12 H new ATOM 0 HE2 LYS B 31 -11.959 1.225 -7.482 1.00 22.53 H new ATOM 0 HE3 LYS B 31 -10.966 1.267 -6.038 1.00 22.53 H new ATOM 0 HZ1 LYS B 31 -13.004 2.143 -5.398 1.00 54.13 H new ATOM 0 HZ2 LYS B 31 -12.031 3.519 -5.609 1.00 54.13 H new ATOM 0 HZ3 LYS B 31 -13.166 3.091 -6.797 1.00 54.13 H new ATOM 1751 N LYS B 32 -10.460 5.000 -12.181 1.00 22.13 N ATOM 1752 CA LYS B 32 -11.286 5.011 -13.401 1.00 41.10 C ATOM 1753 C LYS B 32 -10.506 4.441 -14.618 1.00 2.14 C ATOM 1754 O LYS B 32 -11.022 3.599 -15.363 1.00 23.13 O ATOM 1755 CB LYS B 32 -11.751 6.472 -13.677 1.00 34.13 C ATOM 1756 CG LYS B 32 -12.696 6.649 -14.889 1.00 15.34 C ATOM 1757 CD LYS B 32 -14.031 5.873 -14.741 1.00 14.44 C ATOM 1758 CE LYS B 32 -14.971 6.067 -15.943 1.00 4.02 C ATOM 1759 NZ LYS B 32 -16.238 5.303 -15.783 1.00 31.40 N ATOM 0 H LYS B 32 -10.214 5.936 -11.858 1.00 22.13 H new ATOM 0 HA LYS B 32 -12.155 4.370 -13.251 1.00 41.10 H new ATOM 0 HB2 LYS B 32 -12.254 6.849 -12.787 1.00 34.13 H new ATOM 0 HB3 LYS B 32 -10.869 7.093 -13.832 1.00 34.13 H new ATOM 0 HG2 LYS B 32 -12.912 7.709 -15.021 1.00 15.34 H new ATOM 0 HG3 LYS B 32 -12.186 6.313 -15.792 1.00 15.34 H new ATOM 0 HD2 LYS B 32 -13.817 4.811 -14.621 1.00 14.44 H new ATOM 0 HD3 LYS B 32 -14.537 6.201 -13.833 1.00 14.44 H new ATOM 0 HE2 LYS B 32 -15.198 7.127 -16.060 1.00 4.02 H new ATOM 0 HE3 LYS B 32 -14.466 5.747 -16.855 1.00 4.02 H new ATOM 0 HZ1 LYS B 32 -16.845 5.459 -16.613 1.00 31.40 H new ATOM 0 HZ2 LYS B 32 -16.023 4.289 -15.697 1.00 31.40 H new ATOM 0 HZ3 LYS B 32 -16.732 5.626 -14.927 1.00 31.40 H new ATOM 1773 N ALA B 33 -9.252 4.905 -14.790 1.00 4.32 N ATOM 1774 CA ALA B 33 -8.388 4.522 -15.936 1.00 23.03 C ATOM 1775 C ALA B 33 -7.942 3.035 -15.886 1.00 33.04 C ATOM 1776 O ALA B 33 -7.705 2.412 -16.924 1.00 74.02 O ATOM 1777 CB ALA B 33 -7.166 5.455 -15.986 1.00 73.33 C ATOM 0 H ALA B 33 -8.806 5.555 -14.142 1.00 4.32 H new ATOM 0 HA ALA B 33 -8.978 4.632 -16.846 1.00 23.03 H new ATOM 0 HB1 ALA B 33 -6.530 5.177 -16.826 1.00 73.33 H new ATOM 0 HB2 ALA B 33 -7.500 6.485 -16.109 1.00 73.33 H new ATOM 0 HB3 ALA B 33 -6.601 5.365 -15.058 1.00 73.33 H new ATOM 1783 N THR B 34 -7.830 2.485 -14.665 1.00 5.41 N ATOM 1784 CA THR B 34 -7.455 1.062 -14.428 1.00 52.54 C ATOM 1785 C THR B 34 -8.701 0.160 -14.276 1.00 64.22 C ATOM 1786 O THR B 34 -8.586 -1.070 -14.345 1.00 31.34 O ATOM 1787 CB THR B 34 -6.565 0.917 -13.149 1.00 10.42 C ATOM 1788 OG1 THR B 34 -7.285 1.394 -11.991 1.00 2.13 O ATOM 1789 CG2 THR B 34 -5.239 1.687 -13.280 1.00 2.23 C ATOM 0 H THR B 34 -7.996 3.008 -13.805 1.00 5.41 H new ATOM 0 HA THR B 34 -6.890 0.740 -15.303 1.00 52.54 H new ATOM 0 HB THR B 34 -6.330 -0.141 -13.033 1.00 10.42 H new ATOM 0 HG1 THR B 34 -7.334 2.372 -12.017 1.00 2.13 H new ATOM 0 HG21 THR B 34 -4.653 1.559 -12.370 1.00 2.23 H new ATOM 0 HG22 THR B 34 -4.677 1.302 -14.131 1.00 2.23 H new ATOM 0 HG23 THR B 34 -5.447 2.746 -13.432 1.00 2.23 H new ATOM 1797 N LYS B 35 -9.874 0.801 -14.041 1.00 34.33 N ATOM 1798 CA LYS B 35 -11.193 0.128 -13.896 1.00 44.33 C ATOM 1799 C LYS B 35 -11.240 -0.788 -12.624 1.00 32.20 C ATOM 1800 O LYS B 35 -11.999 -1.767 -12.549 1.00 73.23 O ATOM 1801 CB LYS B 35 -11.549 -0.631 -15.216 1.00 40.34 C ATOM 1802 CG LYS B 35 -13.020 -1.091 -15.347 1.00 32.42 C ATOM 1803 CD LYS B 35 -13.309 -1.824 -16.677 1.00 1.25 C ATOM 1804 CE LYS B 35 -12.453 -3.094 -16.871 1.00 71.42 C ATOM 1805 NZ LYS B 35 -12.801 -3.811 -18.123 1.00 3.03 N ATOM 0 H LYS B 35 -9.932 1.815 -13.945 1.00 34.33 H new ATOM 0 HA LYS B 35 -11.963 0.883 -13.736 1.00 44.33 H new ATOM 0 HB2 LYS B 35 -11.313 0.016 -16.061 1.00 40.34 H new ATOM 0 HB3 LYS B 35 -10.905 -1.507 -15.295 1.00 40.34 H new ATOM 0 HG2 LYS B 35 -13.264 -1.751 -14.515 1.00 32.42 H new ATOM 0 HG3 LYS B 35 -13.675 -0.223 -15.268 1.00 32.42 H new ATOM 0 HD2 LYS B 35 -14.364 -2.096 -16.712 1.00 1.25 H new ATOM 0 HD3 LYS B 35 -13.128 -1.141 -17.507 1.00 1.25 H new ATOM 0 HE2 LYS B 35 -11.398 -2.821 -16.890 1.00 71.42 H new ATOM 0 HE3 LYS B 35 -12.594 -3.760 -16.020 1.00 71.42 H new ATOM 0 HZ1 LYS B 35 -12.204 -4.657 -18.216 1.00 3.03 H new ATOM 0 HZ2 LYS B 35 -13.801 -4.094 -18.094 1.00 3.03 H new ATOM 0 HZ3 LYS B 35 -12.642 -3.184 -18.938 1.00 3.03 H new ATOM 1819 N LEU B 36 -10.436 -0.416 -11.608 1.00 40.42 N ATOM 1820 CA LEU B 36 -10.395 -1.127 -10.309 1.00 75.40 C ATOM 1821 C LEU B 36 -11.689 -0.859 -9.496 1.00 1.33 C ATOM 1822 O LEU B 36 -12.188 0.269 -9.461 1.00 53.13 O ATOM 1823 CB LEU B 36 -9.126 -0.722 -9.500 1.00 72.52 C ATOM 1824 CG LEU B 36 -7.762 -1.237 -10.072 1.00 61.30 C ATOM 1825 CD1 LEU B 36 -6.563 -0.692 -9.261 1.00 24.45 C ATOM 1826 CD2 LEU B 36 -7.736 -2.784 -10.147 1.00 73.31 C ATOM 0 H LEU B 36 -9.800 0.380 -11.661 1.00 40.42 H new ATOM 0 HA LEU B 36 -10.339 -2.198 -10.504 1.00 75.40 H new ATOM 0 HB2 LEU B 36 -9.087 0.366 -9.442 1.00 72.52 H new ATOM 0 HB3 LEU B 36 -9.234 -1.092 -8.481 1.00 72.52 H new ATOM 0 HG LEU B 36 -7.667 -0.854 -11.088 1.00 61.30 H new ATOM 0 HD11 LEU B 36 -5.634 -1.070 -9.687 1.00 24.45 H new ATOM 0 HD12 LEU B 36 -6.563 0.397 -9.299 1.00 24.45 H new ATOM 0 HD13 LEU B 36 -6.646 -1.018 -8.224 1.00 24.45 H new ATOM 0 HD21 LEU B 36 -6.777 -3.113 -10.548 1.00 73.31 H new ATOM 0 HD22 LEU B 36 -7.874 -3.199 -9.149 1.00 73.31 H new ATOM 0 HD23 LEU B 36 -8.539 -3.130 -10.798 1.00 73.31 H new ATOM 1838 N LYS B 37 -12.235 -1.921 -8.878 1.00 15.15 N ATOM 1839 CA LYS B 37 -13.455 -1.845 -8.044 1.00 60.23 C ATOM 1840 C LYS B 37 -13.115 -1.375 -6.607 1.00 3.05 C ATOM 1841 O LYS B 37 -13.731 -0.440 -6.079 1.00 32.00 O ATOM 1842 CB LYS B 37 -14.149 -3.232 -8.009 1.00 44.04 C ATOM 1843 CG LYS B 37 -14.531 -3.786 -9.403 1.00 24.15 C ATOM 1844 CD LYS B 37 -15.279 -5.139 -9.331 1.00 11.23 C ATOM 1845 CE LYS B 37 -14.442 -6.264 -8.698 1.00 60.12 C ATOM 1846 NZ LYS B 37 -15.201 -7.535 -8.603 1.00 60.14 N ATOM 0 H LYS B 37 -11.844 -2.861 -8.941 1.00 15.15 H new ATOM 0 HA LYS B 37 -14.134 -1.114 -8.484 1.00 60.23 H new ATOM 0 HB2 LYS B 37 -13.487 -3.944 -7.516 1.00 44.04 H new ATOM 0 HB3 LYS B 37 -15.050 -3.160 -7.400 1.00 44.04 H new ATOM 0 HG2 LYS B 37 -15.157 -3.058 -9.918 1.00 24.15 H new ATOM 0 HG3 LYS B 37 -13.627 -3.908 -10.000 1.00 24.15 H new ATOM 0 HD2 LYS B 37 -16.195 -5.009 -8.755 1.00 11.23 H new ATOM 0 HD3 LYS B 37 -15.574 -5.437 -10.337 1.00 11.23 H new ATOM 0 HE2 LYS B 37 -13.541 -6.423 -9.291 1.00 60.12 H new ATOM 0 HE3 LYS B 37 -14.119 -5.959 -7.703 1.00 60.12 H new ATOM 0 HZ1 LYS B 37 -14.601 -8.266 -8.171 1.00 60.14 H new ATOM 0 HZ2 LYS B 37 -16.047 -7.391 -8.016 1.00 60.14 H new ATOM 0 HZ3 LYS B 37 -15.488 -7.840 -9.555 1.00 60.14 H new ATOM 1860 N ALA B 38 -12.114 -2.033 -5.992 1.00 12.31 N ATOM 1861 CA ALA B 38 -11.645 -1.714 -4.623 1.00 22.45 C ATOM 1862 C ALA B 38 -10.392 -0.807 -4.667 1.00 25.01 C ATOM 1863 O ALA B 38 -9.464 -1.048 -5.450 1.00 72.15 O ATOM 1864 CB ALA B 38 -11.349 -3.009 -3.843 1.00 43.21 C ATOM 0 H ALA B 38 -11.605 -2.802 -6.428 1.00 12.31 H new ATOM 0 HA ALA B 38 -12.437 -1.171 -4.108 1.00 22.45 H new ATOM 0 HB1 ALA B 38 -11.005 -2.759 -2.839 1.00 43.21 H new ATOM 0 HB2 ALA B 38 -12.256 -3.609 -3.777 1.00 43.21 H new ATOM 0 HB3 ALA B 38 -10.575 -3.577 -4.360 1.00 43.21 H new ATOM 1870 N ASP B 39 -10.391 0.244 -3.821 1.00 40.22 N ATOM 1871 CA ASP B 39 -9.255 1.199 -3.673 1.00 53.25 C ATOM 1872 C ASP B 39 -8.004 0.509 -3.103 1.00 74.41 C ATOM 1873 O ASP B 39 -6.892 1.000 -3.264 1.00 22.22 O ATOM 1874 CB ASP B 39 -9.660 2.389 -2.767 1.00 54.14 C ATOM 1875 CG ASP B 39 -10.906 3.117 -3.280 1.00 60.14 C ATOM 1876 OD1 ASP B 39 -12.031 2.645 -2.994 1.00 34.11 O ATOM 1877 OD2 ASP B 39 -10.774 4.123 -4.014 1.00 60.43 O ATOM 0 H ASP B 39 -11.181 0.462 -3.214 1.00 40.22 H new ATOM 0 HA ASP B 39 -9.011 1.572 -4.668 1.00 53.25 H new ATOM 0 HB2 ASP B 39 -9.845 2.026 -1.756 1.00 54.14 H new ATOM 0 HB3 ASP B 39 -8.831 3.094 -2.705 1.00 54.14 H new ATOM 1882 N LYS B 40 -8.227 -0.606 -2.390 1.00 54.23 N ATOM 1883 CA LYS B 40 -7.157 -1.426 -1.774 1.00 42.52 C ATOM 1884 C LYS B 40 -6.194 -2.006 -2.840 1.00 50.41 C ATOM 1885 O LYS B 40 -4.993 -2.097 -2.607 1.00 34.54 O ATOM 1886 CB LYS B 40 -7.791 -2.557 -0.925 1.00 24.40 C ATOM 1887 CG LYS B 40 -8.914 -2.074 0.018 1.00 74.13 C ATOM 1888 CD LYS B 40 -8.442 -1.018 1.045 1.00 35.21 C ATOM 1889 CE LYS B 40 -9.605 -0.498 1.911 1.00 3.14 C ATOM 1890 NZ LYS B 40 -10.326 -1.603 2.601 1.00 73.14 N ATOM 0 H LYS B 40 -9.163 -0.973 -2.220 1.00 54.23 H new ATOM 0 HA LYS B 40 -6.562 -0.783 -1.125 1.00 42.52 H new ATOM 0 HB2 LYS B 40 -8.193 -3.318 -1.593 1.00 24.40 H new ATOM 0 HB3 LYS B 40 -7.011 -3.034 -0.331 1.00 24.40 H new ATOM 0 HG2 LYS B 40 -9.723 -1.653 -0.579 1.00 74.13 H new ATOM 0 HG3 LYS B 40 -9.324 -2.931 0.552 1.00 74.13 H new ATOM 0 HD2 LYS B 40 -7.677 -1.454 1.688 1.00 35.21 H new ATOM 0 HD3 LYS B 40 -7.979 -0.183 0.520 1.00 35.21 H new ATOM 0 HE2 LYS B 40 -9.220 0.202 2.653 1.00 3.14 H new ATOM 0 HE3 LYS B 40 -10.304 0.055 1.284 1.00 3.14 H new ATOM 0 HZ1 LYS B 40 -11.010 -1.204 3.275 1.00 73.14 H new ATOM 0 HZ2 LYS B 40 -10.830 -2.181 1.898 1.00 73.14 H new ATOM 0 HZ3 LYS B 40 -9.643 -2.197 3.112 1.00 73.14 H new ATOM 1904 N ASP B 41 -6.739 -2.357 -4.022 1.00 3.30 N ATOM 1905 CA ASP B 41 -5.932 -2.794 -5.189 1.00 71.31 C ATOM 1906 C ASP B 41 -5.029 -1.646 -5.699 1.00 12.52 C ATOM 1907 O ASP B 41 -3.879 -1.874 -6.098 1.00 45.12 O ATOM 1908 CB ASP B 41 -6.858 -3.296 -6.322 1.00 61.11 C ATOM 1909 CG ASP B 41 -7.600 -4.581 -5.940 1.00 14.25 C ATOM 1910 OD1 ASP B 41 -8.676 -4.497 -5.317 1.00 14.54 O ATOM 1911 OD2 ASP B 41 -7.100 -5.681 -6.250 1.00 11.30 O ATOM 0 H ASP B 41 -7.744 -2.347 -4.199 1.00 3.30 H new ATOM 0 HA ASP B 41 -5.288 -3.614 -4.871 1.00 71.31 H new ATOM 0 HB2 ASP B 41 -7.583 -2.520 -6.567 1.00 61.11 H new ATOM 0 HB3 ASP B 41 -6.266 -3.474 -7.220 1.00 61.11 H new ATOM 1916 N PHE B 42 -5.570 -0.411 -5.659 1.00 13.24 N ATOM 1917 CA PHE B 42 -4.809 0.807 -5.980 1.00 53.01 C ATOM 1918 C PHE B 42 -3.664 1.048 -4.958 1.00 13.21 C ATOM 1919 O PHE B 42 -2.556 1.371 -5.355 1.00 51.22 O ATOM 1920 CB PHE B 42 -5.747 2.049 -6.064 1.00 41.21 C ATOM 1921 CG PHE B 42 -4.992 3.376 -6.165 1.00 44.40 C ATOM 1922 CD1 PHE B 42 -4.331 3.729 -7.340 1.00 54.53 C ATOM 1923 CD2 PHE B 42 -4.895 4.242 -5.070 1.00 44.32 C ATOM 1924 CE1 PHE B 42 -3.613 4.901 -7.420 1.00 3.35 C ATOM 1925 CE2 PHE B 42 -4.166 5.412 -5.155 1.00 11.11 C ATOM 1926 CZ PHE B 42 -3.528 5.741 -6.332 1.00 44.42 C ATOM 0 H PHE B 42 -6.542 -0.234 -5.404 1.00 13.24 H new ATOM 0 HA PHE B 42 -4.354 0.659 -6.959 1.00 53.01 H new ATOM 0 HB2 PHE B 42 -6.400 1.944 -6.931 1.00 41.21 H new ATOM 0 HB3 PHE B 42 -6.388 2.071 -5.183 1.00 41.21 H new ATOM 0 HD1 PHE B 42 -4.383 3.075 -8.198 1.00 54.53 H new ATOM 0 HD2 PHE B 42 -5.397 3.992 -4.147 1.00 44.32 H new ATOM 0 HE1 PHE B 42 -3.114 5.163 -8.341 1.00 3.35 H new ATOM 0 HE2 PHE B 42 -4.096 6.068 -4.300 1.00 11.11 H new ATOM 0 HZ PHE B 42 -2.961 6.658 -6.401 1.00 44.42 H new ATOM 1936 N PHE B 43 -3.957 0.905 -3.649 1.00 12.23 N ATOM 1937 CA PHE B 43 -2.958 1.146 -2.568 1.00 52.12 C ATOM 1938 C PHE B 43 -1.787 0.123 -2.624 1.00 64.12 C ATOM 1939 O PHE B 43 -0.631 0.474 -2.371 1.00 5.52 O ATOM 1940 CB PHE B 43 -3.642 1.102 -1.171 1.00 25.45 C ATOM 1941 CG PHE B 43 -4.760 2.136 -0.961 1.00 5.23 C ATOM 1942 CD1 PHE B 43 -4.597 3.467 -1.356 1.00 73.23 C ATOM 1943 CD2 PHE B 43 -5.967 1.779 -0.353 1.00 62.24 C ATOM 1944 CE1 PHE B 43 -5.602 4.399 -1.154 1.00 23.03 C ATOM 1945 CE2 PHE B 43 -6.970 2.709 -0.155 1.00 52.33 C ATOM 1946 CZ PHE B 43 -6.788 4.019 -0.555 1.00 23.34 C ATOM 0 H PHE B 43 -4.876 0.624 -3.307 1.00 12.23 H new ATOM 0 HA PHE B 43 -2.540 2.140 -2.729 1.00 52.12 H new ATOM 0 HB2 PHE B 43 -4.056 0.105 -1.017 1.00 25.45 H new ATOM 0 HB3 PHE B 43 -2.881 1.252 -0.406 1.00 25.45 H new ATOM 0 HD1 PHE B 43 -3.674 3.773 -1.826 1.00 73.23 H new ATOM 0 HD2 PHE B 43 -6.118 0.759 -0.032 1.00 62.24 H new ATOM 0 HE1 PHE B 43 -5.458 5.423 -1.465 1.00 23.03 H new ATOM 0 HE2 PHE B 43 -7.897 2.412 0.313 1.00 52.33 H new ATOM 0 HZ PHE B 43 -7.572 4.745 -0.400 1.00 23.34 H new ATOM 1956 N LEU B 44 -2.123 -1.133 -2.970 1.00 44.04 N ATOM 1957 CA LEU B 44 -1.150 -2.246 -3.138 1.00 43.22 C ATOM 1958 C LEU B 44 -0.226 -2.007 -4.362 1.00 65.40 C ATOM 1959 O LEU B 44 1.000 -2.168 -4.269 1.00 75.24 O ATOM 1960 CB LEU B 44 -1.927 -3.600 -3.269 1.00 21.24 C ATOM 1961 CG LEU B 44 -2.324 -4.337 -1.928 1.00 2.53 C ATOM 1962 CD1 LEU B 44 -2.746 -3.367 -0.800 1.00 2.31 C ATOM 1963 CD2 LEU B 44 -3.432 -5.387 -2.191 1.00 51.12 C ATOM 0 H LEU B 44 -3.088 -1.415 -3.145 1.00 44.04 H new ATOM 0 HA LEU B 44 -0.508 -2.290 -2.259 1.00 43.22 H new ATOM 0 HB2 LEU B 44 -2.840 -3.412 -3.835 1.00 21.24 H new ATOM 0 HB3 LEU B 44 -1.319 -4.283 -3.863 1.00 21.24 H new ATOM 0 HG LEU B 44 -1.425 -4.844 -1.576 1.00 2.53 H new ATOM 0 HD11 LEU B 44 -3.006 -3.937 0.092 1.00 2.31 H new ATOM 0 HD12 LEU B 44 -1.920 -2.693 -0.572 1.00 2.31 H new ATOM 0 HD13 LEU B 44 -3.610 -2.786 -1.124 1.00 2.31 H new ATOM 0 HD21 LEU B 44 -3.692 -5.884 -1.256 1.00 51.12 H new ATOM 0 HD22 LEU B 44 -4.314 -4.891 -2.596 1.00 51.12 H new ATOM 0 HD23 LEU B 44 -3.071 -6.126 -2.906 1.00 51.12 H new ATOM 1975 N GLY B 45 -0.836 -1.608 -5.498 1.00 2.15 N ATOM 1976 CA GLY B 45 -0.087 -1.307 -6.731 1.00 2.00 C ATOM 1977 C GLY B 45 0.789 -0.049 -6.613 1.00 55.55 C ATOM 1978 O GLY B 45 1.952 -0.061 -7.003 1.00 33.11 O ATOM 0 H GLY B 45 -1.845 -1.488 -5.584 1.00 2.15 H new ATOM 0 HA2 GLY B 45 0.544 -2.159 -6.983 1.00 2.00 H new ATOM 0 HA3 GLY B 45 -0.790 -1.177 -7.554 1.00 2.00 H new ATOM 1982 N LEU B 46 0.220 1.024 -6.030 1.00 21.14 N ATOM 1983 CA LEU B 46 0.931 2.311 -5.781 1.00 41.22 C ATOM 1984 C LEU B 46 2.093 2.124 -4.772 1.00 74.35 C ATOM 1985 O LEU B 46 3.119 2.804 -4.858 1.00 74.13 O ATOM 1986 CB LEU B 46 -0.062 3.382 -5.245 1.00 75.32 C ATOM 1987 CG LEU B 46 0.547 4.793 -4.931 1.00 70.55 C ATOM 1988 CD1 LEU B 46 1.104 5.460 -6.205 1.00 60.23 C ATOM 1989 CD2 LEU B 46 -0.470 5.705 -4.204 1.00 73.11 C ATOM 0 H LEU B 46 -0.750 1.031 -5.714 1.00 21.14 H new ATOM 0 HA LEU B 46 1.349 2.649 -6.729 1.00 41.22 H new ATOM 0 HB2 LEU B 46 -0.859 3.508 -5.978 1.00 75.32 H new ATOM 0 HB3 LEU B 46 -0.523 2.997 -4.335 1.00 75.32 H new ATOM 0 HG LEU B 46 1.385 4.643 -4.250 1.00 70.55 H new ATOM 0 HD11 LEU B 46 1.519 6.436 -5.953 1.00 60.23 H new ATOM 0 HD12 LEU B 46 1.886 4.833 -6.632 1.00 60.23 H new ATOM 0 HD13 LEU B 46 0.301 5.584 -6.932 1.00 60.23 H new ATOM 0 HD21 LEU B 46 -0.012 6.673 -4.003 1.00 73.11 H new ATOM 0 HD22 LEU B 46 -1.349 5.843 -4.833 1.00 73.11 H new ATOM 0 HD23 LEU B 46 -0.766 5.242 -3.263 1.00 73.11 H new ATOM 2001 N GLY B 47 1.906 1.183 -3.836 1.00 73.34 N ATOM 2002 CA GLY B 47 2.947 0.807 -2.863 1.00 15.23 C ATOM 2003 C GLY B 47 4.201 0.235 -3.538 1.00 11.02 C ATOM 2004 O GLY B 47 5.323 0.405 -3.047 1.00 64.53 O ATOM 0 H GLY B 47 1.035 0.663 -3.730 1.00 73.34 H new ATOM 0 HA2 GLY B 47 3.222 1.682 -2.274 1.00 15.23 H new ATOM 0 HA3 GLY B 47 2.543 0.070 -2.170 1.00 15.23 H new ATOM 2008 N TRP B 48 3.986 -0.437 -4.686 1.00 31.40 N ATOM 2009 CA TRP B 48 5.067 -0.970 -5.533 1.00 50.33 C ATOM 2010 C TRP B 48 5.760 0.167 -6.337 1.00 23.23 C ATOM 2011 O TRP B 48 6.941 0.085 -6.649 1.00 52.32 O ATOM 2012 CB TRP B 48 4.512 -2.060 -6.490 1.00 54.43 C ATOM 2013 CG TRP B 48 5.560 -3.044 -6.943 1.00 2.12 C ATOM 2014 CD1 TRP B 48 6.484 -2.897 -7.942 1.00 0.51 C ATOM 2015 CD2 TRP B 48 5.799 -4.321 -6.363 1.00 12.42 C ATOM 2016 NE1 TRP B 48 7.291 -4.002 -7.998 1.00 3.55 N ATOM 2017 CE2 TRP B 48 6.885 -4.895 -7.043 1.00 40.21 C ATOM 2018 CE3 TRP B 48 5.192 -5.029 -5.329 1.00 53.22 C ATOM 2019 CZ2 TRP B 48 7.386 -6.148 -6.711 1.00 43.31 C ATOM 2020 CZ3 TRP B 48 5.679 -6.268 -5.001 1.00 52.15 C ATOM 2021 CH2 TRP B 48 6.768 -6.823 -5.687 1.00 42.41 C ATOM 0 H TRP B 48 3.053 -0.625 -5.052 1.00 31.40 H new ATOM 0 HA TRP B 48 5.817 -1.424 -4.885 1.00 50.33 H new ATOM 0 HB2 TRP B 48 3.709 -2.600 -5.988 1.00 54.43 H new ATOM 0 HB3 TRP B 48 4.074 -1.578 -7.364 1.00 54.43 H new ATOM 0 HD1 TRP B 48 6.565 -2.037 -8.590 1.00 0.51 H new ATOM 0 HE1 TRP B 48 8.068 -4.138 -8.645 1.00 3.55 H new ATOM 0 HE3 TRP B 48 4.352 -4.610 -4.795 1.00 53.22 H new ATOM 0 HZ2 TRP B 48 8.228 -6.574 -7.237 1.00 43.31 H new ATOM 0 HZ3 TRP B 48 5.216 -6.826 -4.201 1.00 52.15 H new ATOM 0 HH2 TRP B 48 7.128 -7.801 -5.405 1.00 42.41 H new ATOM 2032 N LEU B 49 5.003 1.216 -6.683 1.00 55.20 N ATOM 2033 CA LEU B 49 5.556 2.444 -7.328 1.00 3.21 C ATOM 2034 C LEU B 49 6.453 3.250 -6.340 1.00 14.24 C ATOM 2035 O LEU B 49 7.432 3.887 -6.753 1.00 1.44 O ATOM 2036 CB LEU B 49 4.391 3.327 -7.873 1.00 63.20 C ATOM 2037 CG LEU B 49 3.756 2.922 -9.251 1.00 35.22 C ATOM 2038 CD1 LEU B 49 3.435 1.438 -9.324 1.00 41.51 C ATOM 2039 CD2 LEU B 49 2.485 3.753 -9.534 1.00 0.34 C ATOM 0 H LEU B 49 3.995 1.251 -6.531 1.00 55.20 H new ATOM 0 HA LEU B 49 6.187 2.140 -8.163 1.00 3.21 H new ATOM 0 HB2 LEU B 49 3.597 3.334 -7.126 1.00 63.20 H new ATOM 0 HB3 LEU B 49 4.757 4.350 -7.959 1.00 63.20 H new ATOM 0 HG LEU B 49 4.502 3.136 -10.017 1.00 35.22 H new ATOM 0 HD11 LEU B 49 2.998 1.208 -10.296 1.00 41.51 H new ATOM 0 HD12 LEU B 49 4.350 0.861 -9.192 1.00 41.51 H new ATOM 0 HD13 LEU B 49 2.726 1.180 -8.537 1.00 41.51 H new ATOM 0 HD21 LEU B 49 2.062 3.456 -10.494 1.00 0.34 H new ATOM 0 HD22 LEU B 49 1.753 3.579 -8.745 1.00 0.34 H new ATOM 0 HD23 LEU B 49 2.742 4.812 -9.563 1.00 0.34 H new ATOM 2051 N LEU B 50 6.088 3.215 -5.039 1.00 73.30 N ATOM 2052 CA LEU B 50 6.914 3.773 -3.930 1.00 71.02 C ATOM 2053 C LEU B 50 8.160 2.895 -3.677 1.00 32.12 C ATOM 2054 O LEU B 50 9.234 3.397 -3.333 1.00 12.20 O ATOM 2055 CB LEU B 50 6.063 3.867 -2.634 1.00 2.51 C ATOM 2056 CG LEU B 50 4.824 4.815 -2.704 1.00 52.11 C ATOM 2057 CD1 LEU B 50 3.968 4.712 -1.425 1.00 50.15 C ATOM 2058 CD2 LEU B 50 5.259 6.272 -2.981 1.00 72.23 C ATOM 0 H LEU B 50 5.212 2.800 -4.722 1.00 73.30 H new ATOM 0 HA LEU B 50 7.248 4.770 -4.218 1.00 71.02 H new ATOM 0 HB2 LEU B 50 5.717 2.866 -2.375 1.00 2.51 H new ATOM 0 HB3 LEU B 50 6.708 4.202 -1.821 1.00 2.51 H new ATOM 0 HG LEU B 50 4.200 4.492 -3.538 1.00 52.11 H new ATOM 0 HD11 LEU B 50 3.113 5.384 -1.504 1.00 50.15 H new ATOM 0 HD12 LEU B 50 3.615 3.688 -1.305 1.00 50.15 H new ATOM 0 HD13 LEU B 50 4.570 4.992 -0.561 1.00 50.15 H new ATOM 0 HD21 LEU B 50 4.378 6.913 -3.025 1.00 72.23 H new ATOM 0 HD22 LEU B 50 5.916 6.614 -2.182 1.00 72.23 H new ATOM 0 HD23 LEU B 50 5.790 6.319 -3.932 1.00 72.23 H new ATOM 2070 N ARG B 51 7.973 1.573 -3.839 1.00 43.20 N ATOM 2071 CA ARG B 51 9.059 0.569 -3.807 1.00 2.31 C ATOM 2072 C ARG B 51 10.149 0.879 -4.847 1.00 23.44 C ATOM 2073 O ARG B 51 11.341 0.896 -4.524 1.00 33.50 O ATOM 2074 CB ARG B 51 8.447 -0.841 -4.048 1.00 10.33 C ATOM 2075 CG ARG B 51 9.449 -1.975 -4.323 1.00 52.14 C ATOM 2076 CD ARG B 51 8.787 -3.351 -4.411 1.00 54.30 C ATOM 2077 NE ARG B 51 9.767 -4.387 -4.772 1.00 74.40 N ATOM 2078 CZ ARG B 51 10.069 -5.435 -4.047 1.00 32.11 C ATOM 2079 NH1 ARG B 51 9.448 -5.697 -2.938 1.00 72.32 N ATOM 2080 NH2 ARG B 51 11.005 -6.235 -4.446 1.00 20.32 N ATOM 0 H ARG B 51 7.052 1.164 -3.998 1.00 43.20 H new ATOM 0 HA ARG B 51 9.539 0.599 -2.829 1.00 2.31 H new ATOM 0 HB2 ARG B 51 7.854 -1.112 -3.174 1.00 10.33 H new ATOM 0 HB3 ARG B 51 7.760 -0.777 -4.892 1.00 10.33 H new ATOM 0 HG2 ARG B 51 9.973 -1.770 -5.256 1.00 52.14 H new ATOM 0 HG3 ARG B 51 10.199 -1.989 -3.532 1.00 52.14 H new ATOM 0 HD2 ARG B 51 8.327 -3.599 -3.454 1.00 54.30 H new ATOM 0 HD3 ARG B 51 7.988 -3.327 -5.152 1.00 54.30 H new ATOM 0 HE ARG B 51 10.253 -4.280 -5.663 1.00 74.40 H new ATOM 0 HH11 ARG B 51 8.704 -5.080 -2.612 1.00 72.32 H new ATOM 0 HH12 ARG B 51 9.703 -6.520 -2.393 1.00 72.32 H new ATOM 0 HH21 ARG B 51 11.500 -6.046 -5.318 1.00 20.32 H new ATOM 0 HH22 ARG B 51 11.248 -7.054 -3.889 1.00 20.32 H new ATOM 2094 N GLU B 52 9.722 1.154 -6.088 1.00 1.14 N ATOM 2095 CA GLU B 52 10.640 1.464 -7.197 1.00 74.20 C ATOM 2096 C GLU B 52 11.156 2.923 -7.123 1.00 40.44 C ATOM 2097 O GLU B 52 12.148 3.250 -7.783 1.00 60.01 O ATOM 2098 CB GLU B 52 9.928 1.221 -8.559 1.00 54.22 C ATOM 2099 CG GLU B 52 9.295 -0.180 -8.734 1.00 71.10 C ATOM 2100 CD GLU B 52 10.289 -1.347 -8.591 1.00 3.55 C ATOM 2101 OE1 GLU B 52 11.099 -1.562 -9.514 1.00 72.33 O ATOM 2102 OE2 GLU B 52 10.255 -2.066 -7.567 1.00 13.11 O ATOM 0 H GLU B 52 8.737 1.168 -6.352 1.00 1.14 H new ATOM 0 HA GLU B 52 11.501 0.802 -7.111 1.00 74.20 H new ATOM 0 HB2 GLU B 52 9.147 1.972 -8.681 1.00 54.22 H new ATOM 0 HB3 GLU B 52 10.650 1.378 -9.361 1.00 54.22 H new ATOM 0 HG2 GLU B 52 8.501 -0.302 -7.997 1.00 71.10 H new ATOM 0 HG3 GLU B 52 8.828 -0.234 -9.717 1.00 71.10 H new ATOM 2109 N ASP B 53 10.448 3.787 -6.336 1.00 71.35 N ATOM 2110 CA ASP B 53 10.686 5.260 -6.281 1.00 12.10 C ATOM 2111 C ASP B 53 10.474 5.900 -7.680 1.00 22.53 C ATOM 2112 O ASP B 53 11.025 6.956 -8.003 1.00 31.24 O ATOM 2113 CB ASP B 53 12.095 5.596 -5.667 1.00 50.35 C ATOM 2114 CG ASP B 53 12.007 6.134 -4.228 1.00 24.45 C ATOM 2115 OD1 ASP B 53 11.892 5.330 -3.276 1.00 54.53 O ATOM 2116 OD2 ASP B 53 12.011 7.378 -4.044 1.00 32.43 O ATOM 0 H ASP B 53 9.695 3.479 -5.721 1.00 71.35 H new ATOM 0 HA ASP B 53 9.950 5.703 -5.609 1.00 12.10 H new ATOM 0 HB2 ASP B 53 12.714 4.699 -5.677 1.00 50.35 H new ATOM 0 HB3 ASP B 53 12.593 6.334 -6.296 1.00 50.35 H new ATOM 2121 N LYS B 54 9.603 5.253 -8.465 1.00 72.13 N ATOM 2122 CA LYS B 54 9.343 5.591 -9.876 1.00 32.11 C ATOM 2123 C LYS B 54 8.221 6.658 -10.007 1.00 44.30 C ATOM 2124 O LYS B 54 7.951 7.164 -11.106 1.00 55.03 O ATOM 2125 CB LYS B 54 9.001 4.268 -10.621 1.00 75.15 C ATOM 2126 CG LYS B 54 8.928 4.353 -12.162 1.00 63.50 C ATOM 2127 CD LYS B 54 8.855 2.960 -12.845 1.00 73.25 C ATOM 2128 CE LYS B 54 7.742 2.047 -12.276 1.00 0.34 C ATOM 2129 NZ LYS B 54 7.570 0.808 -13.074 1.00 60.41 N ATOM 0 H LYS B 54 9.047 4.464 -8.134 1.00 72.13 H new ATOM 0 HA LYS B 54 10.225 6.043 -10.330 1.00 32.11 H new ATOM 0 HB2 LYS B 54 9.749 3.521 -10.354 1.00 75.15 H new ATOM 0 HB3 LYS B 54 8.042 3.905 -10.252 1.00 75.15 H new ATOM 0 HG2 LYS B 54 8.053 4.937 -12.447 1.00 63.50 H new ATOM 0 HG3 LYS B 54 9.803 4.888 -12.533 1.00 63.50 H new ATOM 0 HD2 LYS B 54 8.690 3.097 -13.914 1.00 73.25 H new ATOM 0 HD3 LYS B 54 9.817 2.459 -12.733 1.00 73.25 H new ATOM 0 HE2 LYS B 54 7.982 1.783 -11.246 1.00 0.34 H new ATOM 0 HE3 LYS B 54 6.801 2.596 -12.253 1.00 0.34 H new ATOM 0 HZ1 LYS B 54 6.815 0.228 -12.656 1.00 60.41 H new ATOM 0 HZ2 LYS B 54 7.315 1.057 -14.051 1.00 60.41 H new ATOM 0 HZ3 LYS B 54 8.460 0.269 -13.075 1.00 60.41 H new ATOM 2143 N VAL B 55 7.579 7.016 -8.863 1.00 62.21 N ATOM 2144 CA VAL B 55 6.548 8.091 -8.811 1.00 71.42 C ATOM 2145 C VAL B 55 6.772 9.063 -7.625 1.00 61.21 C ATOM 2146 O VAL B 55 7.505 8.767 -6.678 1.00 72.30 O ATOM 2147 CB VAL B 55 5.079 7.530 -8.714 1.00 11.15 C ATOM 2148 CG1 VAL B 55 4.738 6.619 -9.910 1.00 71.14 C ATOM 2149 CG2 VAL B 55 4.834 6.814 -7.356 1.00 73.40 C ATOM 0 H VAL B 55 7.757 6.575 -7.961 1.00 62.21 H new ATOM 0 HA VAL B 55 6.662 8.627 -9.753 1.00 71.42 H new ATOM 0 HB VAL B 55 4.401 8.382 -8.758 1.00 11.15 H new ATOM 0 HG11 VAL B 55 3.717 6.251 -9.808 1.00 71.14 H new ATOM 0 HG12 VAL B 55 4.829 7.186 -10.837 1.00 71.14 H new ATOM 0 HG13 VAL B 55 5.427 5.775 -9.932 1.00 71.14 H new ATOM 0 HG21 VAL B 55 3.811 6.439 -7.322 1.00 73.40 H new ATOM 0 HG22 VAL B 55 5.530 5.981 -7.253 1.00 73.40 H new ATOM 0 HG23 VAL B 55 4.989 7.519 -6.540 1.00 73.40 H new ATOM 2159 N VAL B 56 6.123 10.231 -7.726 1.00 1.41 N ATOM 2160 CA VAL B 56 5.999 11.241 -6.656 1.00 63.53 C ATOM 2161 C VAL B 56 4.557 11.235 -6.093 1.00 64.42 C ATOM 2162 O VAL B 56 3.601 11.358 -6.859 1.00 1.11 O ATOM 2163 CB VAL B 56 6.318 12.688 -7.209 1.00 75.50 C ATOM 2164 CG1 VAL B 56 6.330 13.751 -6.074 1.00 35.22 C ATOM 2165 CG2 VAL B 56 7.642 12.702 -8.007 1.00 52.54 C ATOM 0 H VAL B 56 5.651 10.513 -8.585 1.00 1.41 H new ATOM 0 HA VAL B 56 6.712 10.990 -5.871 1.00 63.53 H new ATOM 0 HB VAL B 56 5.514 12.958 -7.893 1.00 75.50 H new ATOM 0 HG11 VAL B 56 6.553 14.731 -6.496 1.00 35.22 H new ATOM 0 HG12 VAL B 56 5.354 13.778 -5.590 1.00 35.22 H new ATOM 0 HG13 VAL B 56 7.092 13.490 -5.339 1.00 35.22 H new ATOM 0 HG21 VAL B 56 7.835 13.710 -8.375 1.00 52.54 H new ATOM 0 HG22 VAL B 56 8.461 12.389 -7.359 1.00 52.54 H new ATOM 0 HG23 VAL B 56 7.565 12.017 -8.851 1.00 52.54 H new ATOM 2175 N THR B 57 4.403 11.099 -4.764 1.00 11.54 N ATOM 2176 CA THR B 57 3.077 11.162 -4.100 1.00 31.54 C ATOM 2177 C THR B 57 2.872 12.514 -3.375 1.00 25.24 C ATOM 2178 O THR B 57 3.767 13.018 -2.683 1.00 42.54 O ATOM 2179 CB THR B 57 2.872 9.977 -3.099 1.00 2.55 C ATOM 2180 OG1 THR B 57 4.015 9.847 -2.228 1.00 0.34 O ATOM 2181 CG2 THR B 57 2.616 8.646 -3.836 1.00 43.20 C ATOM 0 H THR B 57 5.180 10.944 -4.122 1.00 11.54 H new ATOM 0 HA THR B 57 2.327 11.074 -4.886 1.00 31.54 H new ATOM 0 HB THR B 57 1.990 10.205 -2.500 1.00 2.55 H new ATOM 0 HG1 THR B 57 4.029 8.948 -1.839 1.00 0.34 H new ATOM 0 HG21 THR B 57 2.479 7.847 -3.107 1.00 43.20 H new ATOM 0 HG22 THR B 57 1.719 8.736 -4.449 1.00 43.20 H new ATOM 0 HG23 THR B 57 3.469 8.413 -4.473 1.00 43.20 H new ATOM 2189 N SER B 58 1.662 13.067 -3.545 1.00 23.33 N ATOM 2190 CA SER B 58 1.251 14.392 -3.030 1.00 70.44 C ATOM 2191 C SER B 58 -0.256 14.353 -2.674 1.00 55.42 C ATOM 2192 O SER B 58 -0.945 13.375 -2.982 1.00 45.14 O ATOM 2193 CB SER B 58 1.530 15.479 -4.102 1.00 4.22 C ATOM 2194 OG SER B 58 1.156 16.774 -3.657 1.00 74.13 O ATOM 0 H SER B 58 0.917 12.595 -4.058 1.00 23.33 H new ATOM 0 HA SER B 58 1.822 14.636 -2.134 1.00 70.44 H new ATOM 0 HB2 SER B 58 2.590 15.475 -4.355 1.00 4.22 H new ATOM 0 HB3 SER B 58 0.984 15.237 -5.014 1.00 4.22 H new ATOM 0 HG SER B 58 1.349 17.430 -4.359 1.00 74.13 H new ATOM 2200 N GLU B 59 -0.769 15.405 -2.011 1.00 40.32 N ATOM 2201 CA GLU B 59 -2.197 15.475 -1.602 1.00 22.30 C ATOM 2202 C GLU B 59 -2.919 16.696 -2.233 1.00 75.13 C ATOM 2203 O GLU B 59 -2.502 17.843 -2.044 1.00 11.31 O ATOM 2204 CB GLU B 59 -2.296 15.534 -0.052 1.00 55.32 C ATOM 2205 CG GLU B 59 -3.737 15.507 0.493 1.00 1.42 C ATOM 2206 CD GLU B 59 -3.808 15.661 2.022 1.00 41.53 C ATOM 2207 OE1 GLU B 59 -3.629 16.796 2.516 1.00 4.21 O ATOM 2208 OE2 GLU B 59 -4.024 14.656 2.733 1.00 44.40 O ATOM 0 H GLU B 59 -0.221 16.223 -1.744 1.00 40.32 H new ATOM 0 HA GLU B 59 -2.696 14.577 -1.967 1.00 22.30 H new ATOM 0 HB2 GLU B 59 -1.745 14.692 0.368 1.00 55.32 H new ATOM 0 HB3 GLU B 59 -1.805 16.442 0.297 1.00 55.32 H new ATOM 0 HG2 GLU B 59 -4.310 16.308 0.026 1.00 1.42 H new ATOM 0 HG3 GLU B 59 -4.210 14.568 0.206 1.00 1.42 H new ATOM 2215 N VAL B 60 -4.003 16.430 -2.988 1.00 60.23 N ATOM 2216 CA VAL B 60 -4.951 17.467 -3.460 1.00 32.32 C ATOM 2217 C VAL B 60 -6.288 17.337 -2.692 1.00 60.20 C ATOM 2218 O VAL B 60 -7.047 16.384 -2.901 1.00 55.22 O ATOM 2219 CB VAL B 60 -5.177 17.365 -5.028 1.00 32.33 C ATOM 2220 CG1 VAL B 60 -6.449 18.126 -5.511 1.00 1.31 C ATOM 2221 CG2 VAL B 60 -3.923 17.884 -5.779 1.00 51.53 C ATOM 0 H VAL B 60 -4.249 15.488 -3.290 1.00 60.23 H new ATOM 0 HA VAL B 60 -4.526 18.450 -3.259 1.00 32.32 H new ATOM 0 HB VAL B 60 -5.337 16.312 -5.258 1.00 32.33 H new ATOM 0 HG11 VAL B 60 -6.549 18.019 -6.591 1.00 1.31 H new ATOM 0 HG12 VAL B 60 -7.330 17.710 -5.022 1.00 1.31 H new ATOM 0 HG13 VAL B 60 -6.359 19.182 -5.258 1.00 1.31 H new ATOM 0 HG21 VAL B 60 -4.086 17.810 -6.854 1.00 51.53 H new ATOM 0 HG22 VAL B 60 -3.742 18.925 -5.510 1.00 51.53 H new ATOM 0 HG23 VAL B 60 -3.058 17.282 -5.502 1.00 51.53 H new ATOM 2231 N GLU B 61 -6.529 18.310 -1.784 1.00 42.32 N ATOM 2232 CA GLU B 61 -7.801 18.480 -1.031 1.00 33.21 C ATOM 2233 C GLU B 61 -8.231 17.206 -0.245 1.00 71.21 C ATOM 2234 O GLU B 61 -9.423 16.895 -0.145 1.00 64.41 O ATOM 2235 CB GLU B 61 -8.921 18.973 -1.991 1.00 61.30 C ATOM 2236 CG GLU B 61 -8.556 20.226 -2.817 1.00 62.44 C ATOM 2237 CD GLU B 61 -9.757 20.794 -3.587 1.00 62.04 C ATOM 2238 OE1 GLU B 61 -10.006 20.367 -4.736 1.00 12.22 O ATOM 2239 OE2 GLU B 61 -10.465 21.666 -3.040 1.00 65.31 O ATOM 0 H GLU B 61 -5.832 19.016 -1.546 1.00 42.32 H new ATOM 0 HA GLU B 61 -7.627 19.239 -0.268 1.00 33.21 H new ATOM 0 HB2 GLU B 61 -9.176 18.164 -2.676 1.00 61.30 H new ATOM 0 HB3 GLU B 61 -9.815 19.188 -1.405 1.00 61.30 H new ATOM 0 HG2 GLU B 61 -8.160 20.993 -2.152 1.00 62.44 H new ATOM 0 HG3 GLU B 61 -7.763 19.974 -3.521 1.00 62.44 H new ATOM 2246 N GLY B 62 -7.246 16.509 0.352 1.00 44.31 N ATOM 2247 CA GLY B 62 -7.487 15.238 1.069 1.00 23.10 C ATOM 2248 C GLY B 62 -7.295 13.976 0.208 1.00 52.15 C ATOM 2249 O GLY B 62 -7.015 12.896 0.736 1.00 30.43 O ATOM 0 H GLY B 62 -6.270 16.805 0.353 1.00 44.31 H new ATOM 0 HA2 GLY B 62 -6.815 15.185 1.925 1.00 23.10 H new ATOM 0 HA3 GLY B 62 -8.504 15.244 1.462 1.00 23.10 H new ATOM 2253 N GLU B 63 -7.477 14.100 -1.117 1.00 41.20 N ATOM 2254 CA GLU B 63 -7.277 12.980 -2.078 1.00 74.35 C ATOM 2255 C GLU B 63 -5.788 12.790 -2.444 1.00 51.31 C ATOM 2256 O GLU B 63 -5.012 13.750 -2.475 1.00 5.33 O ATOM 2257 CB GLU B 63 -8.134 13.192 -3.364 1.00 70.32 C ATOM 2258 CG GLU B 63 -9.642 12.894 -3.193 1.00 51.34 C ATOM 2259 CD GLU B 63 -10.338 13.754 -2.120 1.00 21.44 C ATOM 2260 OE1 GLU B 63 -10.619 14.942 -2.392 1.00 35.42 O ATOM 2261 OE2 GLU B 63 -10.593 13.252 -0.999 1.00 21.12 O ATOM 0 H GLU B 63 -7.766 14.972 -1.560 1.00 41.20 H new ATOM 0 HA GLU B 63 -7.611 12.068 -1.582 1.00 74.35 H new ATOM 0 HB2 GLU B 63 -8.017 14.224 -3.696 1.00 70.32 H new ATOM 0 HB3 GLU B 63 -7.739 12.555 -4.156 1.00 70.32 H new ATOM 0 HG2 GLU B 63 -10.142 13.050 -4.149 1.00 51.34 H new ATOM 0 HG3 GLU B 63 -9.766 11.842 -2.936 1.00 51.34 H new ATOM 2268 N ILE B 64 -5.411 11.535 -2.732 1.00 24.14 N ATOM 2269 CA ILE B 64 -4.028 11.166 -3.108 1.00 12.25 C ATOM 2270 C ILE B 64 -3.749 11.540 -4.588 1.00 13.23 C ATOM 2271 O ILE B 64 -4.254 10.889 -5.500 1.00 52.14 O ATOM 2272 CB ILE B 64 -3.784 9.624 -2.881 1.00 41.30 C ATOM 2273 CG1 ILE B 64 -3.974 9.247 -1.375 1.00 55.44 C ATOM 2274 CG2 ILE B 64 -2.396 9.173 -3.404 1.00 5.40 C ATOM 2275 CD1 ILE B 64 -3.815 7.760 -1.059 1.00 23.30 C ATOM 0 H ILE B 64 -6.053 10.743 -2.712 1.00 24.14 H new ATOM 0 HA ILE B 64 -3.341 11.724 -2.472 1.00 12.25 H new ATOM 0 HB ILE B 64 -4.532 9.086 -3.463 1.00 41.30 H new ATOM 0 HG12 ILE B 64 -3.253 9.809 -0.781 1.00 55.44 H new ATOM 0 HG13 ILE B 64 -4.967 9.567 -1.058 1.00 55.44 H new ATOM 0 HG21 ILE B 64 -2.270 8.105 -3.227 1.00 5.40 H new ATOM 0 HG22 ILE B 64 -2.327 9.375 -4.473 1.00 5.40 H new ATOM 0 HG23 ILE B 64 -1.614 9.722 -2.880 1.00 5.40 H new ATOM 0 HD11 ILE B 64 -3.964 7.597 0.008 1.00 23.30 H new ATOM 0 HD12 ILE B 64 -4.554 7.188 -1.620 1.00 23.30 H new ATOM 0 HD13 ILE B 64 -2.814 7.434 -1.339 1.00 23.30 H new ATOM 2287 N PHE B 65 -2.969 12.613 -4.810 1.00 52.20 N ATOM 2288 CA PHE B 65 -2.501 13.012 -6.156 1.00 72.43 C ATOM 2289 C PHE B 65 -1.092 12.432 -6.419 1.00 61.25 C ATOM 2290 O PHE B 65 -0.134 12.776 -5.730 1.00 13.45 O ATOM 2291 CB PHE B 65 -2.475 14.558 -6.284 1.00 74.41 C ATOM 2292 CG PHE B 65 -2.095 15.059 -7.682 1.00 45.04 C ATOM 2293 CD1 PHE B 65 -3.044 15.093 -8.702 1.00 1.20 C ATOM 2294 CD2 PHE B 65 -0.792 15.472 -7.979 1.00 14.31 C ATOM 2295 CE1 PHE B 65 -2.708 15.530 -9.966 1.00 51.03 C ATOM 2296 CE2 PHE B 65 -0.457 15.905 -9.247 1.00 33.44 C ATOM 2297 CZ PHE B 65 -1.415 15.932 -10.241 1.00 44.53 C ATOM 0 H PHE B 65 -2.644 13.229 -4.065 1.00 52.20 H new ATOM 0 HA PHE B 65 -3.193 12.614 -6.899 1.00 72.43 H new ATOM 0 HB2 PHE B 65 -3.457 14.951 -6.022 1.00 74.41 H new ATOM 0 HB3 PHE B 65 -1.767 14.961 -5.559 1.00 74.41 H new ATOM 0 HD1 PHE B 65 -4.056 14.773 -8.500 1.00 1.20 H new ATOM 0 HD2 PHE B 65 -0.038 15.452 -7.206 1.00 14.31 H new ATOM 0 HE1 PHE B 65 -3.458 15.558 -10.743 1.00 51.03 H new ATOM 0 HE2 PHE B 65 0.553 16.222 -9.461 1.00 33.44 H new ATOM 0 HZ PHE B 65 -1.154 16.267 -11.234 1.00 44.53 H new ATOM 2307 N VAL B 66 -0.968 11.563 -7.423 1.00 52.11 N ATOM 2308 CA VAL B 66 0.325 10.952 -7.809 1.00 61.13 C ATOM 2309 C VAL B 66 0.747 11.447 -9.213 1.00 42.55 C ATOM 2310 O VAL B 66 -0.106 11.702 -10.059 1.00 44.25 O ATOM 2311 CB VAL B 66 0.227 9.379 -7.801 1.00 62.30 C ATOM 2312 CG1 VAL B 66 1.618 8.721 -7.997 1.00 74.42 C ATOM 2313 CG2 VAL B 66 -0.445 8.869 -6.505 1.00 70.33 C ATOM 0 H VAL B 66 -1.754 11.257 -7.997 1.00 52.11 H new ATOM 0 HA VAL B 66 1.077 11.254 -7.080 1.00 61.13 H new ATOM 0 HB VAL B 66 -0.399 9.088 -8.645 1.00 62.30 H new ATOM 0 HG11 VAL B 66 1.512 7.636 -7.986 1.00 74.42 H new ATOM 0 HG12 VAL B 66 2.038 9.035 -8.953 1.00 74.42 H new ATOM 0 HG13 VAL B 66 2.283 9.029 -7.190 1.00 74.42 H new ATOM 0 HG21 VAL B 66 -0.499 7.781 -6.527 1.00 70.33 H new ATOM 0 HG22 VAL B 66 0.141 9.186 -5.642 1.00 70.33 H new ATOM 0 HG23 VAL B 66 -1.451 9.281 -6.431 1.00 70.33 H new ATOM 2323 N LYS B 67 2.068 11.585 -9.447 1.00 13.42 N ATOM 2324 CA LYS B 67 2.627 11.943 -10.778 1.00 50.31 C ATOM 2325 C LYS B 67 3.971 11.221 -10.982 1.00 2.22 C ATOM 2326 O LYS B 67 4.641 10.917 -10.014 1.00 52.32 O ATOM 2327 CB LYS B 67 2.785 13.486 -10.907 1.00 1.34 C ATOM 2328 CG LYS B 67 3.798 14.140 -9.941 1.00 65.00 C ATOM 2329 CD LYS B 67 3.755 15.686 -10.006 1.00 33.22 C ATOM 2330 CE LYS B 67 4.861 16.341 -9.161 1.00 42.43 C ATOM 2331 NZ LYS B 67 6.222 16.094 -9.714 1.00 30.45 N ATOM 0 H LYS B 67 2.778 11.453 -8.727 1.00 13.42 H new ATOM 0 HA LYS B 67 1.939 11.619 -11.559 1.00 50.31 H new ATOM 0 HB2 LYS B 67 3.084 13.718 -11.929 1.00 1.34 H new ATOM 0 HB3 LYS B 67 1.810 13.947 -10.748 1.00 1.34 H new ATOM 0 HG2 LYS B 67 3.587 13.815 -8.922 1.00 65.00 H new ATOM 0 HG3 LYS B 67 4.803 13.796 -10.184 1.00 65.00 H new ATOM 0 HD2 LYS B 67 3.857 16.006 -11.043 1.00 33.22 H new ATOM 0 HD3 LYS B 67 2.782 16.034 -9.659 1.00 33.22 H new ATOM 0 HE2 LYS B 67 4.684 17.415 -9.106 1.00 42.43 H new ATOM 0 HE3 LYS B 67 4.811 15.957 -8.142 1.00 42.43 H new ATOM 0 HZ1 LYS B 67 6.822 15.666 -8.981 1.00 30.45 H new ATOM 0 HZ2 LYS B 67 6.155 15.448 -10.527 1.00 30.45 H new ATOM 0 HZ3 LYS B 67 6.641 16.995 -10.022 1.00 30.45 H new ATOM 2345 N LEU B 68 4.355 10.935 -12.235 1.00 65.14 N ATOM 2346 CA LEU B 68 5.596 10.172 -12.531 1.00 75.35 C ATOM 2347 C LEU B 68 6.877 11.001 -12.275 1.00 43.01 C ATOM 2348 O LEU B 68 6.891 12.218 -12.488 1.00 75.13 O ATOM 2349 CB LEU B 68 5.600 9.679 -14.003 1.00 44.30 C ATOM 2350 CG LEU B 68 4.393 8.793 -14.439 1.00 14.44 C ATOM 2351 CD1 LEU B 68 4.563 8.294 -15.887 1.00 60.23 C ATOM 2352 CD2 LEU B 68 4.178 7.623 -13.463 1.00 65.32 C ATOM 0 H LEU B 68 3.831 11.216 -13.064 1.00 65.14 H new ATOM 0 HA LEU B 68 5.601 9.320 -11.851 1.00 75.35 H new ATOM 0 HB2 LEU B 68 5.637 10.551 -14.656 1.00 44.30 H new ATOM 0 HB3 LEU B 68 6.517 9.115 -14.172 1.00 44.30 H new ATOM 0 HG LEU B 68 3.497 9.414 -14.408 1.00 14.44 H new ATOM 0 HD11 LEU B 68 3.706 7.679 -16.163 1.00 60.23 H new ATOM 0 HD12 LEU B 68 4.629 9.148 -16.561 1.00 60.23 H new ATOM 0 HD13 LEU B 68 5.475 7.701 -15.963 1.00 60.23 H new ATOM 0 HD21 LEU B 68 3.330 7.024 -13.794 1.00 65.32 H new ATOM 0 HD22 LEU B 68 5.073 7.001 -13.437 1.00 65.32 H new ATOM 0 HD23 LEU B 68 3.979 8.014 -12.465 1.00 65.32 H new ATOM 2364 N VAL B 69 7.948 10.320 -11.818 1.00 3.01 N ATOM 2365 CA VAL B 69 9.315 10.885 -11.812 1.00 62.43 C ATOM 2366 C VAL B 69 9.807 11.036 -13.277 1.00 22.44 C ATOM 2367 O VAL B 69 9.610 10.118 -14.091 1.00 73.00 O ATOM 2368 CB VAL B 69 10.307 9.981 -10.975 1.00 51.24 C ATOM 2369 CG1 VAL B 69 11.781 10.451 -11.100 1.00 22.45 C ATOM 2370 CG2 VAL B 69 9.884 9.936 -9.485 1.00 14.20 C ATOM 0 H VAL B 69 7.892 9.372 -11.446 1.00 3.01 H new ATOM 0 HA VAL B 69 9.292 11.864 -11.334 1.00 62.43 H new ATOM 0 HB VAL B 69 10.248 8.976 -11.393 1.00 51.24 H new ATOM 0 HG11 VAL B 69 12.422 9.799 -10.508 1.00 22.45 H new ATOM 0 HG12 VAL B 69 12.088 10.411 -12.145 1.00 22.45 H new ATOM 0 HG13 VAL B 69 11.869 11.474 -10.735 1.00 22.45 H new ATOM 0 HG21 VAL B 69 10.580 9.309 -8.928 1.00 14.20 H new ATOM 0 HG22 VAL B 69 9.895 10.945 -9.073 1.00 14.20 H new ATOM 0 HG23 VAL B 69 8.879 9.522 -9.405 1.00 14.20 H new