USER MOD reduce.3.24.130724 H: found=0, std=0, add=909, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 907 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 Set 1.1: A 88 ASN : amide:sc= -6.42! C(o=-5.2!,f=-7.2!) USER MOD Set 1.2: A 92 SER OG : rot 97:sc= 1.23 USER MOD Set 2.1: A 38 SER OG : rot -135:sc= 1 USER MOD Set 2.2: A 40 TYR OH : rot 180:sc= 0.362 USER MOD Single : A 1 GLY N :NH3+ 133:sc= 0.021 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc=-0.00545 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ -167:sc= 1.11 (180deg=0.953) USER MOD Single : A 11 SER OG : rot 20:sc= 0.32 USER MOD Single : A 16 LYS NZ :NH3+ -177:sc= 0.871 (180deg=0.863) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= -0.61 K(o=-0.61,f=-0.025) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 177:sc= -0.562 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= -0.306 K(o=-0.31,f=-5.7!) USER MOD Single : A 42 ASN : amide:sc= -4.73! K(o=-4.7!,f=-4.1) USER MOD Single : A 44 LYS NZ :NH3+ 163:sc= -0.017 (180deg=-0.15) USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 47:sc= 0.415 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= -0.0165 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 ASN : amide:sc= -0.84 K(o=-0.84,f=-4.4!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot -145:sc= 0.698 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=-0.067) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= -0.0902 K(o=-0.09,f=-0.98) USER MOD Single : A 99 LYS NZ :NH3+ -143:sc= 0 (180deg=-0.862) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= -3.93 K(o=-3.9,f=-9.3!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot -55:sc= 0.355 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 39:sc= 0.59 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.632 -5.092 13.919 1.00 0.00 N ATOM 2 CA GLY A 1 -10.592 -5.194 14.926 1.00 0.00 C ATOM 3 C GLY A 1 -9.258 -4.666 14.439 1.00 0.00 C ATOM 4 O GLY A 1 -8.923 -4.798 13.261 1.00 0.00 O ATOM 0 H1 GLY A 1 -12.149 -5.993 13.862 1.00 0.00 H new ATOM 0 H2 GLY A 1 -12.291 -4.330 14.177 1.00 0.00 H new ATOM 0 H3 GLY A 1 -11.202 -4.880 12.996 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -10.896 -4.640 15.814 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -10.480 -6.237 15.223 1.00 0.00 H new ATOM 8 N SER A 2 -8.494 -4.064 15.345 1.00 0.00 N ATOM 9 CA SER A 2 -7.191 -3.509 15.000 1.00 0.00 C ATOM 10 C SER A 2 -6.206 -3.675 16.153 1.00 0.00 C ATOM 11 O SER A 2 -6.585 -3.600 17.322 1.00 0.00 O ATOM 12 CB SER A 2 -7.324 -2.028 14.637 1.00 0.00 C ATOM 13 OG SER A 2 -7.936 -1.299 15.686 1.00 0.00 O ATOM 0 H SER A 2 -8.755 -3.948 16.324 1.00 0.00 H new ATOM 0 HA SER A 2 -6.808 -4.055 14.138 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.339 -1.612 14.427 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.914 -1.925 13.726 1.00 0.00 H new ATOM 0 HG SER A 2 -8.008 -0.356 15.430 1.00 0.00 H new ATOM 19 N SER A 3 -4.941 -3.901 15.815 1.00 0.00 N ATOM 20 CA SER A 3 -3.901 -4.081 16.821 1.00 0.00 C ATOM 21 C SER A 3 -3.238 -2.750 17.162 1.00 0.00 C ATOM 22 O SER A 3 -3.443 -1.749 16.478 1.00 0.00 O ATOM 23 CB SER A 3 -2.850 -5.076 16.326 1.00 0.00 C ATOM 24 OG SER A 3 -2.034 -5.529 17.392 1.00 0.00 O ATOM 0 H SER A 3 -4.611 -3.964 14.852 1.00 0.00 H new ATOM 0 HA SER A 3 -4.368 -4.476 17.724 1.00 0.00 H new ATOM 0 HB2 SER A 3 -3.343 -5.926 15.855 1.00 0.00 H new ATOM 0 HB3 SER A 3 -2.229 -4.605 15.564 1.00 0.00 H new ATOM 0 HG SER A 3 -1.372 -6.165 17.050 1.00 0.00 H new ATOM 30 N GLY A 4 -2.442 -2.749 18.227 1.00 0.00 N ATOM 31 CA GLY A 4 -1.760 -1.537 18.642 1.00 0.00 C ATOM 32 C GLY A 4 -0.271 -1.585 18.363 1.00 0.00 C ATOM 33 O GLY A 4 0.490 -2.187 19.121 1.00 0.00 O ATOM 0 H GLY A 4 -2.257 -3.566 18.810 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -2.196 -0.683 18.124 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.922 -1.380 19.708 1.00 0.00 H new ATOM 37 N SER A 5 0.147 -0.949 17.273 1.00 0.00 N ATOM 38 CA SER A 5 1.554 -0.927 16.893 1.00 0.00 C ATOM 39 C SER A 5 2.074 0.506 16.818 1.00 0.00 C ATOM 40 O SER A 5 1.295 1.458 16.768 1.00 0.00 O ATOM 41 CB SER A 5 1.753 -1.625 15.547 1.00 0.00 C ATOM 42 OG SER A 5 3.110 -1.981 15.351 1.00 0.00 O ATOM 0 H SER A 5 -0.469 -0.442 16.638 1.00 0.00 H new ATOM 0 HA SER A 5 2.119 -1.461 17.657 1.00 0.00 H new ATOM 0 HB2 SER A 5 1.130 -2.518 15.502 1.00 0.00 H new ATOM 0 HB3 SER A 5 1.427 -0.967 14.741 1.00 0.00 H new ATOM 0 HG SER A 5 3.209 -2.427 14.484 1.00 0.00 H new ATOM 48 N SER A 6 3.395 0.650 16.809 1.00 0.00 N ATOM 49 CA SER A 6 4.020 1.966 16.743 1.00 0.00 C ATOM 50 C SER A 6 4.725 2.166 15.405 1.00 0.00 C ATOM 51 O SER A 6 5.399 1.267 14.905 1.00 0.00 O ATOM 52 CB SER A 6 5.019 2.137 17.889 1.00 0.00 C ATOM 53 OG SER A 6 5.486 3.473 17.963 1.00 0.00 O ATOM 0 H SER A 6 4.053 -0.128 16.847 1.00 0.00 H new ATOM 0 HA SER A 6 3.237 2.718 16.837 1.00 0.00 H new ATOM 0 HB2 SER A 6 4.547 1.861 18.832 1.00 0.00 H new ATOM 0 HB3 SER A 6 5.862 1.461 17.745 1.00 0.00 H new ATOM 0 HG SER A 6 6.122 3.557 18.704 1.00 0.00 H new ATOM 59 N GLY A 7 4.562 3.354 14.829 1.00 0.00 N ATOM 60 CA GLY A 7 5.188 3.652 13.554 1.00 0.00 C ATOM 61 C GLY A 7 4.240 3.470 12.386 1.00 0.00 C ATOM 62 O GLY A 7 3.583 2.435 12.265 1.00 0.00 O ATOM 0 H GLY A 7 4.008 4.115 15.223 1.00 0.00 H new ATOM 0 HA2 GLY A 7 5.554 4.678 13.564 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.055 3.005 13.418 1.00 0.00 H new ATOM 66 N LYS A 8 4.165 4.478 11.524 1.00 0.00 N ATOM 67 CA LYS A 8 3.289 4.426 10.359 1.00 0.00 C ATOM 68 C LYS A 8 4.090 4.157 9.089 1.00 0.00 C ATOM 69 O LYS A 8 3.578 4.301 7.978 1.00 0.00 O ATOM 70 CB LYS A 8 2.515 5.738 10.218 1.00 0.00 C ATOM 71 CG LYS A 8 1.152 5.573 9.569 1.00 0.00 C ATOM 72 CD LYS A 8 0.105 5.125 10.575 1.00 0.00 C ATOM 73 CE LYS A 8 -1.294 5.168 9.980 1.00 0.00 C ATOM 74 NZ LYS A 8 -1.872 6.540 10.019 1.00 0.00 N ATOM 0 H LYS A 8 4.701 5.342 11.610 1.00 0.00 H new ATOM 0 HA LYS A 8 2.582 3.609 10.503 1.00 0.00 H new ATOM 0 HB2 LYS A 8 2.387 6.182 11.205 1.00 0.00 H new ATOM 0 HB3 LYS A 8 3.107 6.438 9.628 1.00 0.00 H new ATOM 0 HG2 LYS A 8 0.845 6.518 9.120 1.00 0.00 H new ATOM 0 HG3 LYS A 8 1.218 4.843 8.762 1.00 0.00 H new ATOM 0 HD2 LYS A 8 0.329 4.112 10.908 1.00 0.00 H new ATOM 0 HD3 LYS A 8 0.147 5.766 11.455 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -1.261 4.817 8.949 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -1.943 4.485 10.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -2.826 6.527 9.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -1.928 6.865 11.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -1.267 7.187 9.475 1.00 0.00 H new ATOM 88 N VAL A 9 5.348 3.764 9.259 1.00 0.00 N ATOM 89 CA VAL A 9 6.218 3.472 8.126 1.00 0.00 C ATOM 90 C VAL A 9 6.887 2.111 8.283 1.00 0.00 C ATOM 91 O VAL A 9 6.931 1.551 9.379 1.00 0.00 O ATOM 92 CB VAL A 9 7.306 4.551 7.961 1.00 0.00 C ATOM 93 CG1 VAL A 9 6.675 5.926 7.805 1.00 0.00 C ATOM 94 CG2 VAL A 9 8.264 4.526 9.143 1.00 0.00 C ATOM 0 H VAL A 9 5.788 3.640 10.171 1.00 0.00 H new ATOM 0 HA VAL A 9 5.588 3.463 7.237 1.00 0.00 H new ATOM 0 HB VAL A 9 7.875 4.334 7.057 1.00 0.00 H new ATOM 0 HG11 VAL A 9 7.459 6.675 7.690 1.00 0.00 H new ATOM 0 HG12 VAL A 9 6.033 5.934 6.924 1.00 0.00 H new ATOM 0 HG13 VAL A 9 6.081 6.156 8.689 1.00 0.00 H new ATOM 0 HG21 VAL A 9 9.026 5.294 9.010 1.00 0.00 H new ATOM 0 HG22 VAL A 9 7.712 4.718 10.063 1.00 0.00 H new ATOM 0 HG23 VAL A 9 8.742 3.548 9.204 1.00 0.00 H new ATOM 104 N LYS A 10 7.408 1.584 7.181 1.00 0.00 N ATOM 105 CA LYS A 10 8.077 0.288 7.194 1.00 0.00 C ATOM 106 C LYS A 10 8.953 0.115 5.957 1.00 0.00 C ATOM 107 O LYS A 10 8.653 0.656 4.892 1.00 0.00 O ATOM 108 CB LYS A 10 7.046 -0.841 7.264 1.00 0.00 C ATOM 109 CG LYS A 10 7.591 -2.126 7.861 1.00 0.00 C ATOM 110 CD LYS A 10 6.869 -3.346 7.314 1.00 0.00 C ATOM 111 CE LYS A 10 7.692 -4.611 7.500 1.00 0.00 C ATOM 112 NZ LYS A 10 8.973 -4.557 6.741 1.00 0.00 N ATOM 0 H LYS A 10 7.380 2.034 6.266 1.00 0.00 H new ATOM 0 HA LYS A 10 8.714 0.245 8.077 1.00 0.00 H new ATOM 0 HB2 LYS A 10 6.194 -0.508 7.857 1.00 0.00 H new ATOM 0 HB3 LYS A 10 6.675 -1.046 6.260 1.00 0.00 H new ATOM 0 HG2 LYS A 10 8.656 -2.205 7.645 1.00 0.00 H new ATOM 0 HG3 LYS A 10 7.487 -2.097 8.946 1.00 0.00 H new ATOM 0 HD2 LYS A 10 5.909 -3.458 7.818 1.00 0.00 H new ATOM 0 HD3 LYS A 10 6.658 -3.201 6.255 1.00 0.00 H new ATOM 0 HE2 LYS A 10 7.904 -4.754 8.560 1.00 0.00 H new ATOM 0 HE3 LYS A 10 7.112 -5.473 7.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 9.399 -5.505 6.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 8.788 -4.229 5.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 9.627 -3.899 7.210 1.00 0.00 H new ATOM 126 N SER A 11 10.035 -0.642 6.105 1.00 0.00 N ATOM 127 CA SER A 11 10.956 -0.884 5.001 1.00 0.00 C ATOM 128 C SER A 11 11.708 -2.196 5.198 1.00 0.00 C ATOM 129 O SER A 11 12.300 -2.433 6.250 1.00 0.00 O ATOM 130 CB SER A 11 11.949 0.273 4.874 1.00 0.00 C ATOM 131 OG SER A 11 12.864 0.280 5.957 1.00 0.00 O ATOM 0 H SER A 11 10.296 -1.099 6.979 1.00 0.00 H new ATOM 0 HA SER A 11 10.373 -0.955 4.083 1.00 0.00 H new ATOM 0 HB2 SER A 11 12.494 0.187 3.934 1.00 0.00 H new ATOM 0 HB3 SER A 11 11.408 1.219 4.844 1.00 0.00 H new ATOM 0 HG SER A 11 12.884 -0.606 6.374 1.00 0.00 H new ATOM 137 N GLY A 12 11.679 -3.047 4.176 1.00 0.00 N ATOM 138 CA GLY A 12 12.361 -4.326 4.256 1.00 0.00 C ATOM 139 C GLY A 12 12.510 -4.989 2.901 1.00 0.00 C ATOM 140 O GLY A 12 11.908 -4.553 1.920 1.00 0.00 O ATOM 0 H GLY A 12 11.196 -2.873 3.295 1.00 0.00 H new ATOM 0 HA2 GLY A 12 13.347 -4.181 4.697 1.00 0.00 H new ATOM 0 HA3 GLY A 12 11.808 -4.988 4.922 1.00 0.00 H new ATOM 144 N TRP A 13 13.314 -6.044 2.847 1.00 0.00 N ATOM 145 CA TRP A 13 13.541 -6.768 1.601 1.00 0.00 C ATOM 146 C TRP A 13 12.349 -7.656 1.262 1.00 0.00 C ATOM 147 O TRP A 13 12.130 -8.687 1.898 1.00 0.00 O ATOM 148 CB TRP A 13 14.811 -7.615 1.704 1.00 0.00 C ATOM 149 CG TRP A 13 16.066 -6.799 1.761 1.00 0.00 C ATOM 150 CD1 TRP A 13 16.750 -6.424 2.882 1.00 0.00 C ATOM 151 CD2 TRP A 13 16.787 -6.255 0.649 1.00 0.00 C ATOM 152 NE1 TRP A 13 17.852 -5.680 2.535 1.00 0.00 N ATOM 153 CE2 TRP A 13 17.897 -5.563 1.171 1.00 0.00 C ATOM 154 CE3 TRP A 13 16.603 -6.287 -0.736 1.00 0.00 C ATOM 155 CZ2 TRP A 13 18.817 -4.909 0.355 1.00 0.00 C ATOM 156 CZ3 TRP A 13 17.516 -5.638 -1.544 1.00 0.00 C ATOM 157 CH2 TRP A 13 18.612 -4.957 -0.997 1.00 0.00 C ATOM 0 H TRP A 13 13.820 -6.417 3.650 1.00 0.00 H new ATOM 0 HA TRP A 13 13.664 -6.037 0.802 1.00 0.00 H new ATOM 0 HB2 TRP A 13 14.751 -8.239 2.595 1.00 0.00 H new ATOM 0 HB3 TRP A 13 14.862 -8.287 0.847 1.00 0.00 H new ATOM 0 HD1 TRP A 13 16.466 -6.675 3.893 1.00 0.00 H new ATOM 0 HE1 TRP A 13 18.527 -5.280 3.187 1.00 0.00 H new ATOM 0 HE3 TRP A 13 15.762 -6.810 -1.167 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 19.662 -4.383 0.774 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 17.383 -5.656 -2.616 1.00 0.00 H new ATOM 0 HH2 TRP A 13 19.309 -4.460 -1.656 1.00 0.00 H new ATOM 168 N LEU A 14 11.582 -7.250 0.256 1.00 0.00 N ATOM 169 CA LEU A 14 10.411 -8.009 -0.168 1.00 0.00 C ATOM 170 C LEU A 14 10.659 -8.687 -1.512 1.00 0.00 C ATOM 171 O LEU A 14 11.554 -8.295 -2.260 1.00 0.00 O ATOM 172 CB LEU A 14 9.191 -7.092 -0.264 1.00 0.00 C ATOM 173 CG LEU A 14 8.634 -6.574 1.063 1.00 0.00 C ATOM 174 CD1 LEU A 14 7.723 -5.380 0.830 1.00 0.00 C ATOM 175 CD2 LEU A 14 7.890 -7.680 1.797 1.00 0.00 C ATOM 0 H LEU A 14 11.750 -6.399 -0.281 1.00 0.00 H new ATOM 0 HA LEU A 14 10.220 -8.781 0.578 1.00 0.00 H new ATOM 0 HB2 LEU A 14 9.454 -6.235 -0.884 1.00 0.00 H new ATOM 0 HB3 LEU A 14 8.397 -7.630 -0.783 1.00 0.00 H new ATOM 0 HG LEU A 14 9.469 -6.251 1.684 1.00 0.00 H new ATOM 0 HD11 LEU A 14 7.336 -5.025 1.785 1.00 0.00 H new ATOM 0 HD12 LEU A 14 8.286 -4.581 0.348 1.00 0.00 H new ATOM 0 HD13 LEU A 14 6.892 -5.676 0.190 1.00 0.00 H new ATOM 0 HD21 LEU A 14 7.501 -7.294 2.739 1.00 0.00 H new ATOM 0 HD22 LEU A 14 7.064 -8.034 1.181 1.00 0.00 H new ATOM 0 HD23 LEU A 14 8.572 -8.506 1.998 1.00 0.00 H new ATOM 187 N ASP A 15 9.859 -9.704 -1.813 1.00 0.00 N ATOM 188 CA ASP A 15 9.989 -10.434 -3.068 1.00 0.00 C ATOM 189 C ASP A 15 8.718 -10.312 -3.902 1.00 0.00 C ATOM 190 O ASP A 15 7.628 -10.659 -3.447 1.00 0.00 O ATOM 191 CB ASP A 15 10.296 -11.908 -2.796 1.00 0.00 C ATOM 192 CG ASP A 15 11.686 -12.114 -2.226 1.00 0.00 C ATOM 193 OD1 ASP A 15 12.038 -11.414 -1.253 1.00 0.00 O ATOM 194 OD2 ASP A 15 12.420 -12.976 -2.751 1.00 0.00 O ATOM 0 H ASP A 15 9.113 -10.042 -1.204 1.00 0.00 H new ATOM 0 HA ASP A 15 10.814 -9.997 -3.630 1.00 0.00 H new ATOM 0 HB2 ASP A 15 9.558 -12.307 -2.100 1.00 0.00 H new ATOM 0 HB3 ASP A 15 10.199 -12.473 -3.723 1.00 0.00 H new ATOM 199 N LYS A 16 8.864 -9.815 -5.126 1.00 0.00 N ATOM 200 CA LYS A 16 7.729 -9.647 -6.025 1.00 0.00 C ATOM 201 C LYS A 16 7.727 -10.722 -7.107 1.00 0.00 C ATOM 202 O LYS A 16 8.759 -11.330 -7.394 1.00 0.00 O ATOM 203 CB LYS A 16 7.764 -8.259 -6.670 1.00 0.00 C ATOM 204 CG LYS A 16 6.507 -7.919 -7.451 1.00 0.00 C ATOM 205 CD LYS A 16 6.349 -6.419 -7.628 1.00 0.00 C ATOM 206 CE LYS A 16 4.994 -6.067 -8.223 1.00 0.00 C ATOM 207 NZ LYS A 16 4.645 -4.636 -8.002 1.00 0.00 N ATOM 0 H LYS A 16 9.759 -9.521 -5.518 1.00 0.00 H new ATOM 0 HA LYS A 16 6.816 -9.746 -5.438 1.00 0.00 H new ATOM 0 HB2 LYS A 16 7.912 -7.510 -5.892 1.00 0.00 H new ATOM 0 HB3 LYS A 16 8.624 -8.199 -7.338 1.00 0.00 H new ATOM 0 HG2 LYS A 16 6.544 -8.400 -8.429 1.00 0.00 H new ATOM 0 HG3 LYS A 16 5.636 -8.319 -6.932 1.00 0.00 H new ATOM 0 HD2 LYS A 16 6.464 -5.924 -6.664 1.00 0.00 H new ATOM 0 HD3 LYS A 16 7.141 -6.043 -8.276 1.00 0.00 H new ATOM 0 HE2 LYS A 16 5.001 -6.278 -9.292 1.00 0.00 H new ATOM 0 HE3 LYS A 16 4.227 -6.701 -7.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 3.693 -4.449 -8.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 4.663 -4.428 -6.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 5.335 -4.031 -8.491 1.00 0.00 H new ATOM 221 N LEU A 17 6.563 -10.951 -7.705 1.00 0.00 N ATOM 222 CA LEU A 17 6.428 -11.952 -8.757 1.00 0.00 C ATOM 223 C LEU A 17 6.433 -11.298 -10.135 1.00 0.00 C ATOM 224 O LEU A 17 5.385 -11.127 -10.756 1.00 0.00 O ATOM 225 CB LEU A 17 5.138 -12.752 -8.565 1.00 0.00 C ATOM 226 CG LEU A 17 4.923 -13.920 -9.527 1.00 0.00 C ATOM 227 CD1 LEU A 17 5.819 -15.091 -9.155 1.00 0.00 C ATOM 228 CD2 LEU A 17 3.461 -14.345 -9.532 1.00 0.00 C ATOM 0 H LEU A 17 5.700 -10.457 -7.479 1.00 0.00 H new ATOM 0 HA LEU A 17 7.281 -12.628 -8.692 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.123 -13.139 -7.546 1.00 0.00 H new ATOM 0 HB3 LEU A 17 4.293 -12.069 -8.660 1.00 0.00 H new ATOM 0 HG LEU A 17 5.189 -13.591 -10.532 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.652 -15.913 -9.851 1.00 0.00 H new ATOM 0 HD12 LEU A 17 6.863 -14.781 -9.204 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.586 -15.420 -8.142 1.00 0.00 H new ATOM 0 HD21 LEU A 17 3.326 -15.178 -10.222 1.00 0.00 H new ATOM 0 HD22 LEU A 17 3.169 -14.655 -8.529 1.00 0.00 H new ATOM 0 HD23 LEU A 17 2.840 -13.507 -9.848 1.00 0.00 H new ATOM 240 N SER A 18 7.622 -10.936 -10.608 1.00 0.00 N ATOM 241 CA SER A 18 7.764 -10.300 -11.912 1.00 0.00 C ATOM 242 C SER A 18 7.242 -11.209 -13.020 1.00 0.00 C ATOM 243 O SER A 18 6.337 -10.853 -13.776 1.00 0.00 O ATOM 244 CB SER A 18 9.229 -9.947 -12.174 1.00 0.00 C ATOM 245 OG SER A 18 9.534 -10.027 -13.556 1.00 0.00 O ATOM 0 H SER A 18 8.500 -11.073 -10.107 1.00 0.00 H new ATOM 0 HA SER A 18 7.172 -9.385 -11.908 1.00 0.00 H new ATOM 0 HB2 SER A 18 9.434 -8.940 -11.811 1.00 0.00 H new ATOM 0 HB3 SER A 18 9.875 -10.625 -11.616 1.00 0.00 H new ATOM 0 HG SER A 18 10.476 -9.795 -13.697 1.00 0.00 H new ATOM 251 N PRO A 19 7.825 -12.413 -13.121 1.00 0.00 N ATOM 252 CA PRO A 19 7.436 -13.399 -14.133 1.00 0.00 C ATOM 253 C PRO A 19 6.052 -13.983 -13.871 1.00 0.00 C ATOM 254 O PRO A 19 5.680 -14.228 -12.724 1.00 0.00 O ATOM 255 CB PRO A 19 8.508 -14.484 -14.003 1.00 0.00 C ATOM 256 CG PRO A 19 8.999 -14.364 -12.601 1.00 0.00 C ATOM 257 CD PRO A 19 8.910 -12.903 -12.255 1.00 0.00 C ATOM 0 HA PRO A 19 7.375 -12.959 -15.128 1.00 0.00 H new ATOM 0 HB2 PRO A 19 8.095 -15.474 -14.194 1.00 0.00 H new ATOM 0 HB3 PRO A 19 9.315 -14.331 -14.720 1.00 0.00 H new ATOM 0 HG2 PRO A 19 8.392 -14.963 -11.922 1.00 0.00 H new ATOM 0 HG3 PRO A 19 10.024 -14.724 -12.514 1.00 0.00 H new ATOM 0 HD2 PRO A 19 8.681 -12.753 -11.200 1.00 0.00 H new ATOM 0 HD3 PRO A 19 9.848 -12.385 -12.454 1.00 0.00 H new ATOM 265 N GLN A 20 5.295 -14.204 -14.941 1.00 0.00 N ATOM 266 CA GLN A 20 3.952 -14.760 -14.824 1.00 0.00 C ATOM 267 C GLN A 20 3.997 -16.282 -14.756 1.00 0.00 C ATOM 268 O GLN A 20 4.794 -16.921 -15.441 1.00 0.00 O ATOM 269 CB GLN A 20 3.089 -14.315 -16.007 1.00 0.00 C ATOM 270 CG GLN A 20 2.784 -12.826 -16.012 1.00 0.00 C ATOM 271 CD GLN A 20 1.696 -12.450 -15.026 1.00 0.00 C ATOM 272 OE1 GLN A 20 1.975 -11.942 -13.940 1.00 0.00 O ATOM 273 NE2 GLN A 20 0.446 -12.698 -15.400 1.00 0.00 N ATOM 0 H GLN A 20 5.588 -14.007 -15.898 1.00 0.00 H new ATOM 0 HA GLN A 20 3.510 -14.387 -13.900 1.00 0.00 H new ATOM 0 HB2 GLN A 20 3.597 -14.576 -16.935 1.00 0.00 H new ATOM 0 HB3 GLN A 20 2.151 -14.869 -15.990 1.00 0.00 H new ATOM 0 HG2 GLN A 20 3.692 -12.272 -15.774 1.00 0.00 H new ATOM 0 HG3 GLN A 20 2.481 -12.525 -17.015 1.00 0.00 H new ATOM 0 HE21 GLN A 20 0.260 -13.120 -16.310 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -0.328 -12.466 -14.778 1.00 0.00 H new ATOM 282 N GLY A 21 3.135 -16.858 -13.923 1.00 0.00 N ATOM 283 CA GLY A 21 3.094 -18.302 -13.780 1.00 0.00 C ATOM 284 C GLY A 21 4.477 -18.922 -13.751 1.00 0.00 C ATOM 285 O GLY A 21 4.818 -19.738 -14.608 1.00 0.00 O ATOM 0 H GLY A 21 2.465 -16.351 -13.345 1.00 0.00 H new ATOM 0 HA2 GLY A 21 2.565 -18.558 -12.862 1.00 0.00 H new ATOM 0 HA3 GLY A 21 2.525 -18.730 -14.605 1.00 0.00 H new ATOM 289 N LYS A 22 5.277 -18.534 -12.764 1.00 0.00 N ATOM 290 CA LYS A 22 6.631 -19.056 -12.626 1.00 0.00 C ATOM 291 C LYS A 22 7.114 -18.941 -11.183 1.00 0.00 C ATOM 292 O LYS A 22 6.912 -17.917 -10.531 1.00 0.00 O ATOM 293 CB LYS A 22 7.586 -18.305 -13.556 1.00 0.00 C ATOM 294 CG LYS A 22 7.598 -18.840 -14.977 1.00 0.00 C ATOM 295 CD LYS A 22 8.691 -18.190 -15.809 1.00 0.00 C ATOM 296 CE LYS A 22 10.070 -18.682 -15.399 1.00 0.00 C ATOM 297 NZ LYS A 22 11.140 -18.126 -16.272 1.00 0.00 N ATOM 0 H LYS A 22 5.011 -17.859 -12.047 1.00 0.00 H new ATOM 0 HA LYS A 22 6.618 -20.110 -12.903 1.00 0.00 H new ATOM 0 HB2 LYS A 22 7.307 -17.252 -13.576 1.00 0.00 H new ATOM 0 HB3 LYS A 22 8.595 -18.360 -13.148 1.00 0.00 H new ATOM 0 HG2 LYS A 22 7.747 -19.920 -14.959 1.00 0.00 H new ATOM 0 HG3 LYS A 22 6.629 -18.660 -15.443 1.00 0.00 H new ATOM 0 HD2 LYS A 22 8.525 -18.408 -16.864 1.00 0.00 H new ATOM 0 HD3 LYS A 22 8.641 -17.107 -15.695 1.00 0.00 H new ATOM 0 HE2 LYS A 22 10.263 -18.400 -14.364 1.00 0.00 H new ATOM 0 HE3 LYS A 22 10.095 -19.771 -15.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 12.065 -18.485 -15.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 10.970 -18.416 -17.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 11.133 -17.088 -16.211 1.00 0.00 H new ATOM 311 N ARG A 23 7.753 -19.998 -10.692 1.00 0.00 N ATOM 312 CA ARG A 23 8.265 -20.015 -9.327 1.00 0.00 C ATOM 313 C ARG A 23 9.554 -19.206 -9.220 1.00 0.00 C ATOM 314 O ARG A 23 10.648 -19.768 -9.159 1.00 0.00 O ATOM 315 CB ARG A 23 8.513 -21.453 -8.871 1.00 0.00 C ATOM 316 CG ARG A 23 8.668 -21.597 -7.366 1.00 0.00 C ATOM 317 CD ARG A 23 7.319 -21.587 -6.664 1.00 0.00 C ATOM 318 NE ARG A 23 7.455 -21.416 -5.220 1.00 0.00 N ATOM 319 CZ ARG A 23 6.423 -21.262 -4.398 1.00 0.00 C ATOM 320 NH1 ARG A 23 5.186 -21.258 -4.875 1.00 0.00 N ATOM 321 NH2 ARG A 23 6.627 -21.112 -3.095 1.00 0.00 N ATOM 0 H ARG A 23 7.928 -20.853 -11.219 1.00 0.00 H new ATOM 0 HA ARG A 23 7.516 -19.560 -8.679 1.00 0.00 H new ATOM 0 HB2 ARG A 23 7.685 -22.079 -9.204 1.00 0.00 H new ATOM 0 HB3 ARG A 23 9.413 -21.829 -9.358 1.00 0.00 H new ATOM 0 HG2 ARG A 23 9.190 -22.527 -7.140 1.00 0.00 H new ATOM 0 HG3 ARG A 23 9.285 -20.784 -6.983 1.00 0.00 H new ATOM 0 HD2 ARG A 23 6.706 -20.782 -7.068 1.00 0.00 H new ATOM 0 HD3 ARG A 23 6.796 -22.521 -6.871 1.00 0.00 H new ATOM 0 HE ARG A 23 8.394 -21.415 -4.821 1.00 0.00 H new ATOM 0 HH11 ARG A 23 5.025 -21.373 -5.876 1.00 0.00 H new ATOM 0 HH12 ARG A 23 4.395 -21.140 -4.241 1.00 0.00 H new ATOM 0 HH21 ARG A 23 7.577 -21.115 -2.724 1.00 0.00 H new ATOM 0 HH22 ARG A 23 5.834 -20.994 -2.465 1.00 0.00 H new ATOM 335 N MET A 24 9.418 -17.884 -9.198 1.00 0.00 N ATOM 336 CA MET A 24 10.572 -16.998 -9.097 1.00 0.00 C ATOM 337 C MET A 24 10.136 -15.570 -8.786 1.00 0.00 C ATOM 338 O MET A 24 9.241 -15.028 -9.436 1.00 0.00 O ATOM 339 CB MET A 24 11.378 -17.026 -10.397 1.00 0.00 C ATOM 340 CG MET A 24 12.468 -15.969 -10.459 1.00 0.00 C ATOM 341 SD MET A 24 13.167 -15.787 -12.112 1.00 0.00 S ATOM 342 CE MET A 24 14.913 -15.672 -11.730 1.00 0.00 C ATOM 0 H MET A 24 8.520 -17.403 -9.249 1.00 0.00 H new ATOM 0 HA MET A 24 11.201 -17.353 -8.280 1.00 0.00 H new ATOM 0 HB2 MET A 24 11.831 -18.011 -10.513 1.00 0.00 H new ATOM 0 HB3 MET A 24 10.700 -16.886 -11.239 1.00 0.00 H new ATOM 0 HG2 MET A 24 12.059 -15.012 -10.134 1.00 0.00 H new ATOM 0 HG3 MET A 24 13.262 -16.230 -9.760 1.00 0.00 H new ATOM 0 HE1 MET A 24 15.481 -15.556 -12.653 1.00 0.00 H new ATOM 0 HE2 MET A 24 15.088 -14.811 -11.085 1.00 0.00 H new ATOM 0 HE3 MET A 24 15.234 -16.579 -11.219 1.00 0.00 H new ATOM 352 N PHE A 25 10.773 -14.966 -7.789 1.00 0.00 N ATOM 353 CA PHE A 25 10.450 -13.601 -7.391 1.00 0.00 C ATOM 354 C PHE A 25 11.698 -12.724 -7.391 1.00 0.00 C ATOM 355 O PHE A 25 12.799 -13.195 -7.107 1.00 0.00 O ATOM 356 CB PHE A 25 9.805 -13.590 -6.003 1.00 0.00 C ATOM 357 CG PHE A 25 8.494 -14.320 -5.945 1.00 0.00 C ATOM 358 CD1 PHE A 25 8.424 -15.671 -6.247 1.00 0.00 C ATOM 359 CD2 PHE A 25 7.331 -13.656 -5.590 1.00 0.00 C ATOM 360 CE1 PHE A 25 7.219 -16.346 -6.195 1.00 0.00 C ATOM 361 CE2 PHE A 25 6.123 -14.326 -5.536 1.00 0.00 C ATOM 362 CZ PHE A 25 6.067 -15.672 -5.839 1.00 0.00 C ATOM 0 H PHE A 25 11.516 -15.400 -7.242 1.00 0.00 H new ATOM 0 HA PHE A 25 9.743 -13.196 -8.116 1.00 0.00 H new ATOM 0 HB2 PHE A 25 10.494 -14.039 -5.288 1.00 0.00 H new ATOM 0 HB3 PHE A 25 9.651 -12.557 -5.691 1.00 0.00 H new ATOM 0 HD1 PHE A 25 9.322 -16.203 -6.526 1.00 0.00 H new ATOM 0 HD2 PHE A 25 7.369 -12.603 -5.353 1.00 0.00 H new ATOM 0 HE1 PHE A 25 7.178 -17.399 -6.432 1.00 0.00 H new ATOM 0 HE2 PHE A 25 5.224 -13.797 -5.257 1.00 0.00 H new ATOM 0 HZ PHE A 25 5.124 -16.197 -5.798 1.00 0.00 H new ATOM 372 N GLN A 26 11.517 -11.447 -7.713 1.00 0.00 N ATOM 373 CA GLN A 26 12.629 -10.504 -7.751 1.00 0.00 C ATOM 374 C GLN A 26 12.901 -9.926 -6.366 1.00 0.00 C ATOM 375 O GLN A 26 11.988 -9.777 -5.554 1.00 0.00 O ATOM 376 CB GLN A 26 12.334 -9.375 -8.739 1.00 0.00 C ATOM 377 CG GLN A 26 11.383 -8.322 -8.193 1.00 0.00 C ATOM 378 CD GLN A 26 11.246 -7.126 -9.115 1.00 0.00 C ATOM 379 OE1 GLN A 26 10.139 -6.750 -9.502 1.00 0.00 O ATOM 380 NE2 GLN A 26 12.372 -6.520 -9.470 1.00 0.00 N ATOM 0 H GLN A 26 10.612 -11.042 -7.951 1.00 0.00 H new ATOM 0 HA GLN A 26 13.518 -11.042 -8.080 1.00 0.00 H new ATOM 0 HB2 GLN A 26 13.271 -8.895 -9.020 1.00 0.00 H new ATOM 0 HB3 GLN A 26 11.909 -9.801 -9.648 1.00 0.00 H new ATOM 0 HG2 GLN A 26 10.402 -8.770 -8.037 1.00 0.00 H new ATOM 0 HG3 GLN A 26 11.739 -7.986 -7.219 1.00 0.00 H new ATOM 0 HE21 GLN A 26 13.268 -6.866 -9.125 1.00 0.00 H new ATOM 0 HE22 GLN A 26 12.342 -5.709 -10.087 1.00 0.00 H new ATOM 389 N LYS A 27 14.163 -9.603 -6.103 1.00 0.00 N ATOM 390 CA LYS A 27 14.556 -9.040 -4.817 1.00 0.00 C ATOM 391 C LYS A 27 14.909 -7.562 -4.954 1.00 0.00 C ATOM 392 O LYS A 27 15.994 -7.214 -5.421 1.00 0.00 O ATOM 393 CB LYS A 27 15.749 -9.809 -4.244 1.00 0.00 C ATOM 394 CG LYS A 27 16.109 -9.404 -2.825 1.00 0.00 C ATOM 395 CD LYS A 27 17.513 -9.853 -2.456 1.00 0.00 C ATOM 396 CE LYS A 27 18.562 -8.868 -2.952 1.00 0.00 C ATOM 397 NZ LYS A 27 19.869 -9.057 -2.265 1.00 0.00 N ATOM 0 H LYS A 27 14.931 -9.722 -6.764 1.00 0.00 H new ATOM 0 HA LYS A 27 13.710 -9.131 -4.135 1.00 0.00 H new ATOM 0 HB2 LYS A 27 15.526 -10.876 -4.263 1.00 0.00 H new ATOM 0 HB3 LYS A 27 16.614 -9.653 -4.888 1.00 0.00 H new ATOM 0 HG2 LYS A 27 16.034 -8.321 -2.725 1.00 0.00 H new ATOM 0 HG3 LYS A 27 15.392 -9.839 -2.129 1.00 0.00 H new ATOM 0 HD2 LYS A 27 17.591 -9.955 -1.374 1.00 0.00 H new ATOM 0 HD3 LYS A 27 17.706 -10.837 -2.883 1.00 0.00 H new ATOM 0 HE2 LYS A 27 18.696 -8.990 -4.027 1.00 0.00 H new ATOM 0 HE3 LYS A 27 18.210 -7.849 -2.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 20.556 -8.367 -2.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 19.747 -8.915 -1.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 20.218 -10.021 -2.442 1.00 0.00 H new ATOM 411 N ARG A 28 13.986 -6.698 -4.544 1.00 0.00 N ATOM 412 CA ARG A 28 14.200 -5.258 -4.622 1.00 0.00 C ATOM 413 C ARG A 28 13.884 -4.589 -3.288 1.00 0.00 C ATOM 414 O ARG A 28 13.036 -5.062 -2.530 1.00 0.00 O ATOM 415 CB ARG A 28 13.335 -4.651 -5.727 1.00 0.00 C ATOM 416 CG ARG A 28 13.807 -4.997 -7.130 1.00 0.00 C ATOM 417 CD ARG A 28 15.111 -4.291 -7.469 1.00 0.00 C ATOM 418 NE ARG A 28 15.296 -4.145 -8.910 1.00 0.00 N ATOM 419 CZ ARG A 28 14.593 -3.304 -9.660 1.00 0.00 C ATOM 420 NH1 ARG A 28 13.663 -2.537 -9.108 1.00 0.00 N ATOM 421 NH2 ARG A 28 14.820 -3.229 -10.965 1.00 0.00 N ATOM 0 H ARG A 28 13.083 -6.970 -4.155 1.00 0.00 H new ATOM 0 HA ARG A 28 15.250 -5.084 -4.856 1.00 0.00 H new ATOM 0 HB2 ARG A 28 12.308 -4.995 -5.603 1.00 0.00 H new ATOM 0 HB3 ARG A 28 13.324 -3.567 -5.614 1.00 0.00 H new ATOM 0 HG2 ARG A 28 13.943 -6.075 -7.214 1.00 0.00 H new ATOM 0 HG3 ARG A 28 13.041 -4.715 -7.853 1.00 0.00 H new ATOM 0 HD2 ARG A 28 15.123 -3.307 -7.001 1.00 0.00 H new ATOM 0 HD3 ARG A 28 15.947 -4.853 -7.051 1.00 0.00 H new ATOM 0 HE ARG A 28 16.004 -4.721 -9.366 1.00 0.00 H new ATOM 0 HH11 ARG A 28 13.486 -2.592 -8.105 1.00 0.00 H new ATOM 0 HH12 ARG A 28 13.125 -1.892 -9.686 1.00 0.00 H new ATOM 0 HH21 ARG A 28 15.535 -3.817 -11.393 1.00 0.00 H new ATOM 0 HH22 ARG A 28 14.280 -2.583 -11.540 1.00 0.00 H new ATOM 435 N TRP A 29 14.569 -3.487 -3.007 1.00 0.00 N ATOM 436 CA TRP A 29 14.361 -2.753 -1.764 1.00 0.00 C ATOM 437 C TRP A 29 13.038 -1.996 -1.794 1.00 0.00 C ATOM 438 O TRP A 29 12.724 -1.312 -2.769 1.00 0.00 O ATOM 439 CB TRP A 29 15.515 -1.778 -1.524 1.00 0.00 C ATOM 440 CG TRP A 29 15.287 -0.862 -0.360 1.00 0.00 C ATOM 441 CD1 TRP A 29 14.949 0.460 -0.410 1.00 0.00 C ATOM 442 CD2 TRP A 29 15.383 -1.201 1.028 1.00 0.00 C ATOM 443 NE1 TRP A 29 14.828 0.963 0.862 1.00 0.00 N ATOM 444 CE2 TRP A 29 15.089 -0.036 1.763 1.00 0.00 C ATOM 445 CE3 TRP A 29 15.686 -2.376 1.722 1.00 0.00 C ATOM 446 CZ2 TRP A 29 15.091 -0.013 3.155 1.00 0.00 C ATOM 447 CZ3 TRP A 29 15.688 -2.351 3.104 1.00 0.00 C ATOM 448 CH2 TRP A 29 15.392 -1.177 3.808 1.00 0.00 C ATOM 0 H TRP A 29 15.274 -3.082 -3.623 1.00 0.00 H new ATOM 0 HA TRP A 29 14.328 -3.474 -0.947 1.00 0.00 H new ATOM 0 HB2 TRP A 29 16.431 -2.345 -1.357 1.00 0.00 H new ATOM 0 HB3 TRP A 29 15.669 -1.180 -2.423 1.00 0.00 H new ATOM 0 HD1 TRP A 29 14.799 1.027 -1.317 1.00 0.00 H new ATOM 0 HE1 TRP A 29 14.583 1.925 1.098 1.00 0.00 H new ATOM 0 HE3 TRP A 29 15.914 -3.287 1.188 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 14.863 0.891 3.700 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 15.922 -3.253 3.651 1.00 0.00 H new ATOM 0 HH2 TRP A 29 15.402 -1.191 4.888 1.00 0.00 H new ATOM 459 N VAL A 30 12.265 -2.122 -0.720 1.00 0.00 N ATOM 460 CA VAL A 30 10.975 -1.448 -0.623 1.00 0.00 C ATOM 461 C VAL A 30 10.919 -0.542 0.601 1.00 0.00 C ATOM 462 O VAL A 30 11.581 -0.797 1.608 1.00 0.00 O ATOM 463 CB VAL A 30 9.817 -2.460 -0.553 1.00 0.00 C ATOM 464 CG1 VAL A 30 8.496 -1.745 -0.316 1.00 0.00 C ATOM 465 CG2 VAL A 30 9.760 -3.295 -1.823 1.00 0.00 C ATOM 0 H VAL A 30 12.509 -2.684 0.095 1.00 0.00 H new ATOM 0 HA VAL A 30 10.865 -0.844 -1.524 1.00 0.00 H new ATOM 0 HB VAL A 30 9.996 -3.131 0.287 1.00 0.00 H new ATOM 0 HG11 VAL A 30 7.689 -2.477 -0.270 1.00 0.00 H new ATOM 0 HG12 VAL A 30 8.543 -1.196 0.625 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.307 -1.049 -1.133 1.00 0.00 H new ATOM 0 HG21 VAL A 30 8.935 -4.005 -1.755 1.00 0.00 H new ATOM 0 HG22 VAL A 30 9.607 -2.641 -2.682 1.00 0.00 H new ATOM 0 HG23 VAL A 30 10.697 -3.838 -1.944 1.00 0.00 H new ATOM 475 N LYS A 31 10.125 0.519 0.509 1.00 0.00 N ATOM 476 CA LYS A 31 9.980 1.465 1.610 1.00 0.00 C ATOM 477 C LYS A 31 8.598 2.110 1.594 1.00 0.00 C ATOM 478 O LYS A 31 8.070 2.444 0.533 1.00 0.00 O ATOM 479 CB LYS A 31 11.060 2.545 1.527 1.00 0.00 C ATOM 480 CG LYS A 31 11.102 3.458 2.741 1.00 0.00 C ATOM 481 CD LYS A 31 11.678 4.820 2.394 1.00 0.00 C ATOM 482 CE LYS A 31 11.409 5.835 3.495 1.00 0.00 C ATOM 483 NZ LYS A 31 12.213 5.556 4.716 1.00 0.00 N ATOM 0 H LYS A 31 9.571 0.746 -0.317 1.00 0.00 H new ATOM 0 HA LYS A 31 10.095 0.917 2.545 1.00 0.00 H new ATOM 0 HB2 LYS A 31 12.032 2.066 1.409 1.00 0.00 H new ATOM 0 HB3 LYS A 31 10.891 3.148 0.635 1.00 0.00 H new ATOM 0 HG2 LYS A 31 10.095 3.579 3.142 1.00 0.00 H new ATOM 0 HG3 LYS A 31 11.703 2.996 3.524 1.00 0.00 H new ATOM 0 HD2 LYS A 31 12.752 4.732 2.233 1.00 0.00 H new ATOM 0 HD3 LYS A 31 11.244 5.172 1.458 1.00 0.00 H new ATOM 0 HE2 LYS A 31 11.639 6.836 3.130 1.00 0.00 H new ATOM 0 HE3 LYS A 31 10.349 5.824 3.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 12.001 6.270 5.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 11.976 4.611 5.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 13.225 5.592 4.481 1.00 0.00 H new ATOM 497 N PHE A 32 8.017 2.284 2.777 1.00 0.00 N ATOM 498 CA PHE A 32 6.697 2.890 2.898 1.00 0.00 C ATOM 499 C PHE A 32 6.761 4.174 3.721 1.00 0.00 C ATOM 500 O PHE A 32 7.246 4.175 4.853 1.00 0.00 O ATOM 501 CB PHE A 32 5.718 1.907 3.543 1.00 0.00 C ATOM 502 CG PHE A 32 4.288 2.364 3.492 1.00 0.00 C ATOM 503 CD1 PHE A 32 3.716 2.760 2.294 1.00 0.00 C ATOM 504 CD2 PHE A 32 3.516 2.396 4.642 1.00 0.00 C ATOM 505 CE1 PHE A 32 2.401 3.182 2.245 1.00 0.00 C ATOM 506 CE2 PHE A 32 2.199 2.816 4.598 1.00 0.00 C ATOM 507 CZ PHE A 32 1.641 3.208 3.398 1.00 0.00 C ATOM 0 H PHE A 32 8.440 2.014 3.665 1.00 0.00 H new ATOM 0 HA PHE A 32 6.346 3.138 1.896 1.00 0.00 H new ATOM 0 HB2 PHE A 32 5.801 0.943 3.042 1.00 0.00 H new ATOM 0 HB3 PHE A 32 6.004 1.751 4.583 1.00 0.00 H new ATOM 0 HD1 PHE A 32 4.304 2.739 1.388 1.00 0.00 H new ATOM 0 HD2 PHE A 32 3.947 2.090 5.583 1.00 0.00 H new ATOM 0 HE1 PHE A 32 1.968 3.491 1.305 1.00 0.00 H new ATOM 0 HE2 PHE A 32 1.608 2.837 5.502 1.00 0.00 H new ATOM 0 HZ PHE A 32 0.612 3.534 3.361 1.00 0.00 H new ATOM 517 N ASP A 33 6.270 5.265 3.143 1.00 0.00 N ATOM 518 CA ASP A 33 6.271 6.556 3.822 1.00 0.00 C ATOM 519 C ASP A 33 4.879 6.894 4.347 1.00 0.00 C ATOM 520 O ASP A 33 4.665 7.959 4.925 1.00 0.00 O ATOM 521 CB ASP A 33 6.753 7.654 2.873 1.00 0.00 C ATOM 522 CG ASP A 33 6.833 9.009 3.549 1.00 0.00 C ATOM 523 OD1 ASP A 33 7.569 9.129 4.552 1.00 0.00 O ATOM 524 OD2 ASP A 33 6.160 9.949 3.077 1.00 0.00 O ATOM 0 H ASP A 33 5.866 5.281 2.206 1.00 0.00 H new ATOM 0 HA ASP A 33 6.954 6.494 4.669 1.00 0.00 H new ATOM 0 HB2 ASP A 33 7.735 7.387 2.482 1.00 0.00 H new ATOM 0 HB3 ASP A 33 6.077 7.716 2.020 1.00 0.00 H new ATOM 529 N GLY A 34 3.935 5.981 4.140 1.00 0.00 N ATOM 530 CA GLY A 34 2.576 6.202 4.597 1.00 0.00 C ATOM 531 C GLY A 34 1.663 6.687 3.488 1.00 0.00 C ATOM 532 O GLY A 34 0.440 6.570 3.584 1.00 0.00 O ATOM 0 H GLY A 34 4.088 5.092 3.664 1.00 0.00 H new ATOM 0 HA2 GLY A 34 2.180 5.275 5.010 1.00 0.00 H new ATOM 0 HA3 GLY A 34 2.582 6.934 5.405 1.00 0.00 H new ATOM 536 N LEU A 35 2.256 7.235 2.433 1.00 0.00 N ATOM 537 CA LEU A 35 1.488 7.741 1.301 1.00 0.00 C ATOM 538 C LEU A 35 1.570 6.785 0.115 1.00 0.00 C ATOM 539 O LEU A 35 0.575 6.536 -0.564 1.00 0.00 O ATOM 540 CB LEU A 35 1.997 9.124 0.892 1.00 0.00 C ATOM 541 CG LEU A 35 2.094 10.162 2.011 1.00 0.00 C ATOM 542 CD1 LEU A 35 3.195 11.168 1.712 1.00 0.00 C ATOM 543 CD2 LEU A 35 0.760 10.869 2.199 1.00 0.00 C ATOM 0 H LEU A 35 3.266 7.340 2.338 1.00 0.00 H new ATOM 0 HA LEU A 35 0.445 7.820 1.608 1.00 0.00 H new ATOM 0 HB2 LEU A 35 2.984 9.008 0.445 1.00 0.00 H new ATOM 0 HB3 LEU A 35 1.340 9.516 0.116 1.00 0.00 H new ATOM 0 HG LEU A 35 2.343 9.646 2.938 1.00 0.00 H new ATOM 0 HD11 LEU A 35 3.249 11.899 2.519 1.00 0.00 H new ATOM 0 HD12 LEU A 35 4.150 10.649 1.628 1.00 0.00 H new ATOM 0 HD13 LEU A 35 2.976 11.679 0.774 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.847 11.604 2.999 1.00 0.00 H new ATOM 0 HD22 LEU A 35 0.481 11.372 1.273 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -0.006 10.138 2.460 1.00 0.00 H new ATOM 555 N SER A 36 2.763 6.251 -0.126 1.00 0.00 N ATOM 556 CA SER A 36 2.976 5.323 -1.230 1.00 0.00 C ATOM 557 C SER A 36 4.138 4.380 -0.931 1.00 0.00 C ATOM 558 O SER A 36 4.947 4.638 -0.039 1.00 0.00 O ATOM 559 CB SER A 36 3.249 6.092 -2.524 1.00 0.00 C ATOM 560 OG SER A 36 4.087 7.210 -2.287 1.00 0.00 O ATOM 0 H SER A 36 3.597 6.445 0.429 1.00 0.00 H new ATOM 0 HA SER A 36 2.071 4.728 -1.352 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.718 5.430 -3.252 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.306 6.426 -2.958 1.00 0.00 H new ATOM 0 HG SER A 36 4.286 7.655 -3.137 1.00 0.00 H new ATOM 566 N ILE A 37 4.214 3.288 -1.683 1.00 0.00 N ATOM 567 CA ILE A 37 5.277 2.307 -1.500 1.00 0.00 C ATOM 568 C ILE A 37 6.306 2.396 -2.622 1.00 0.00 C ATOM 569 O ILE A 37 6.094 1.870 -3.715 1.00 0.00 O ATOM 570 CB ILE A 37 4.716 0.874 -1.445 1.00 0.00 C ATOM 571 CG1 ILE A 37 3.708 0.741 -0.301 1.00 0.00 C ATOM 572 CG2 ILE A 37 5.847 -0.131 -1.281 1.00 0.00 C ATOM 573 CD1 ILE A 37 2.780 -0.445 -0.449 1.00 0.00 C ATOM 0 H ILE A 37 3.552 3.060 -2.425 1.00 0.00 H new ATOM 0 HA ILE A 37 5.759 2.537 -0.550 1.00 0.00 H new ATOM 0 HB ILE A 37 4.202 0.664 -2.383 1.00 0.00 H new ATOM 0 HG12 ILE A 37 4.249 0.653 0.641 1.00 0.00 H new ATOM 0 HG13 ILE A 37 3.113 1.653 -0.243 1.00 0.00 H new ATOM 0 HG21 ILE A 37 5.435 -1.139 -1.244 1.00 0.00 H new ATOM 0 HG22 ILE A 37 6.531 -0.050 -2.125 1.00 0.00 H new ATOM 0 HG23 ILE A 37 6.386 0.075 -0.356 1.00 0.00 H new ATOM 0 HD11 ILE A 37 2.093 -0.477 0.397 1.00 0.00 H new ATOM 0 HD12 ILE A 37 2.212 -0.349 -1.374 1.00 0.00 H new ATOM 0 HD13 ILE A 37 3.366 -1.364 -0.476 1.00 0.00 H new ATOM 585 N SER A 38 7.421 3.062 -2.344 1.00 0.00 N ATOM 586 CA SER A 38 8.483 3.221 -3.330 1.00 0.00 C ATOM 587 C SER A 38 9.566 2.164 -3.138 1.00 0.00 C ATOM 588 O SER A 38 10.113 2.011 -2.045 1.00 0.00 O ATOM 589 CB SER A 38 9.096 4.619 -3.229 1.00 0.00 C ATOM 590 OG SER A 38 9.671 5.015 -4.463 1.00 0.00 O ATOM 0 H SER A 38 7.613 3.501 -1.443 1.00 0.00 H new ATOM 0 HA SER A 38 8.047 3.093 -4.321 1.00 0.00 H new ATOM 0 HB2 SER A 38 8.329 5.335 -2.935 1.00 0.00 H new ATOM 0 HB3 SER A 38 9.858 4.630 -2.449 1.00 0.00 H new ATOM 0 HG SER A 38 10.548 5.421 -4.300 1.00 0.00 H new ATOM 596 N TYR A 39 9.870 1.437 -4.207 1.00 0.00 N ATOM 597 CA TYR A 39 10.885 0.392 -4.157 1.00 0.00 C ATOM 598 C TYR A 39 11.998 0.665 -5.164 1.00 0.00 C ATOM 599 O TYR A 39 11.738 0.938 -6.336 1.00 0.00 O ATOM 600 CB TYR A 39 10.255 -0.974 -4.435 1.00 0.00 C ATOM 601 CG TYR A 39 9.597 -1.073 -5.792 1.00 0.00 C ATOM 602 CD1 TYR A 39 10.328 -1.440 -6.915 1.00 0.00 C ATOM 603 CD2 TYR A 39 8.244 -0.800 -5.952 1.00 0.00 C ATOM 604 CE1 TYR A 39 9.731 -1.531 -8.158 1.00 0.00 C ATOM 605 CE2 TYR A 39 7.638 -0.890 -7.190 1.00 0.00 C ATOM 606 CZ TYR A 39 8.386 -1.255 -8.290 1.00 0.00 C ATOM 607 OH TYR A 39 7.788 -1.346 -9.526 1.00 0.00 O ATOM 0 H TYR A 39 9.428 1.552 -5.119 1.00 0.00 H new ATOM 0 HA TYR A 39 11.317 0.389 -3.156 1.00 0.00 H new ATOM 0 HB2 TYR A 39 11.024 -1.742 -4.357 1.00 0.00 H new ATOM 0 HB3 TYR A 39 9.513 -1.186 -3.665 1.00 0.00 H new ATOM 0 HD1 TYR A 39 11.381 -1.658 -6.815 1.00 0.00 H new ATOM 0 HD2 TYR A 39 7.656 -0.512 -5.093 1.00 0.00 H new ATOM 0 HE1 TYR A 39 10.314 -1.817 -9.021 1.00 0.00 H new ATOM 0 HE2 TYR A 39 6.585 -0.676 -7.296 1.00 0.00 H new ATOM 0 HH TYR A 39 6.837 -1.121 -9.447 1.00 0.00 H new ATOM 617 N TYR A 40 13.240 0.588 -4.699 1.00 0.00 N ATOM 618 CA TYR A 40 14.394 0.828 -5.557 1.00 0.00 C ATOM 619 C TYR A 40 15.269 -0.418 -5.654 1.00 0.00 C ATOM 620 O TYR A 40 14.952 -1.459 -5.081 1.00 0.00 O ATOM 621 CB TYR A 40 15.217 2.002 -5.023 1.00 0.00 C ATOM 622 CG TYR A 40 14.385 3.215 -4.672 1.00 0.00 C ATOM 623 CD1 TYR A 40 13.577 3.223 -3.542 1.00 0.00 C ATOM 624 CD2 TYR A 40 14.407 4.352 -5.470 1.00 0.00 C ATOM 625 CE1 TYR A 40 12.814 4.329 -3.217 1.00 0.00 C ATOM 626 CE2 TYR A 40 13.649 5.462 -5.152 1.00 0.00 C ATOM 627 CZ TYR A 40 12.854 5.446 -4.026 1.00 0.00 C ATOM 628 OH TYR A 40 12.097 6.549 -3.705 1.00 0.00 O ATOM 0 H TYR A 40 13.473 0.361 -3.732 1.00 0.00 H new ATOM 0 HA TYR A 40 14.029 1.072 -6.555 1.00 0.00 H new ATOM 0 HB2 TYR A 40 15.764 1.678 -4.137 1.00 0.00 H new ATOM 0 HB3 TYR A 40 15.959 2.284 -5.770 1.00 0.00 H new ATOM 0 HD1 TYR A 40 13.544 2.350 -2.907 1.00 0.00 H new ATOM 0 HD2 TYR A 40 15.027 4.368 -6.354 1.00 0.00 H new ATOM 0 HE1 TYR A 40 12.190 4.319 -2.335 1.00 0.00 H new ATOM 0 HE2 TYR A 40 13.679 6.338 -5.783 1.00 0.00 H new ATOM 0 HH TYR A 40 12.239 7.250 -4.375 1.00 0.00 H new ATOM 638 N ASN A 41 16.374 -0.302 -6.384 1.00 0.00 N ATOM 639 CA ASN A 41 17.296 -1.418 -6.558 1.00 0.00 C ATOM 640 C ASN A 41 18.655 -1.101 -5.941 1.00 0.00 C ATOM 641 O ASN A 41 19.383 -0.237 -6.427 1.00 0.00 O ATOM 642 CB ASN A 41 17.462 -1.743 -8.044 1.00 0.00 C ATOM 643 CG ASN A 41 18.453 -2.866 -8.283 1.00 0.00 C ATOM 644 OD1 ASN A 41 18.085 -4.040 -8.305 1.00 0.00 O ATOM 645 ND2 ASN A 41 19.719 -2.508 -8.462 1.00 0.00 N ATOM 0 H ASN A 41 16.652 0.554 -6.864 1.00 0.00 H new ATOM 0 HA ASN A 41 16.878 -2.286 -6.048 1.00 0.00 H new ATOM 0 HB2 ASN A 41 16.495 -2.021 -8.463 1.00 0.00 H new ATOM 0 HB3 ASN A 41 17.794 -0.850 -8.574 1.00 0.00 H new ATOM 0 HD21 ASN A 41 20.432 -3.219 -8.626 1.00 0.00 H new ATOM 0 HD22 ASN A 41 19.979 -1.522 -8.436 1.00 0.00 H new ATOM 652 N ASN A 42 18.990 -1.808 -4.866 1.00 0.00 N ATOM 653 CA ASN A 42 20.262 -1.603 -4.183 1.00 0.00 C ATOM 654 C ASN A 42 21.431 -1.744 -5.153 1.00 0.00 C ATOM 655 O ASN A 42 21.776 -2.850 -5.567 1.00 0.00 O ATOM 656 CB ASN A 42 20.415 -2.603 -3.035 1.00 0.00 C ATOM 657 CG ASN A 42 19.701 -2.151 -1.775 1.00 0.00 C ATOM 658 OD1 ASN A 42 18.705 -1.429 -1.838 1.00 0.00 O ATOM 659 ND2 ASN A 42 20.208 -2.574 -0.623 1.00 0.00 N ATOM 0 H ASN A 42 18.399 -2.527 -4.450 1.00 0.00 H new ATOM 0 HA ASN A 42 20.269 -0.591 -3.779 1.00 0.00 H new ATOM 0 HB2 ASN A 42 20.021 -3.571 -3.345 1.00 0.00 H new ATOM 0 HB3 ASN A 42 21.474 -2.744 -2.818 1.00 0.00 H new ATOM 0 HD21 ASN A 42 19.770 -2.302 0.257 1.00 0.00 H new ATOM 0 HD22 ASN A 42 21.035 -3.171 -0.618 1.00 0.00 H new ATOM 666 N GLU A 43 22.035 -0.615 -5.511 1.00 0.00 N ATOM 667 CA GLU A 43 23.165 -0.613 -6.433 1.00 0.00 C ATOM 668 C GLU A 43 23.764 0.785 -6.556 1.00 0.00 C ATOM 669 O GLU A 43 23.111 1.782 -6.249 1.00 0.00 O ATOM 670 CB GLU A 43 22.728 -1.116 -7.811 1.00 0.00 C ATOM 671 CG GLU A 43 23.877 -1.284 -8.790 1.00 0.00 C ATOM 672 CD GLU A 43 24.981 -2.171 -8.248 1.00 0.00 C ATOM 673 OE1 GLU A 43 24.739 -3.385 -8.085 1.00 0.00 O ATOM 674 OE2 GLU A 43 26.086 -1.651 -7.985 1.00 0.00 O ATOM 0 H GLU A 43 21.761 0.309 -5.177 1.00 0.00 H new ATOM 0 HA GLU A 43 23.928 -1.282 -6.035 1.00 0.00 H new ATOM 0 HB2 GLU A 43 22.218 -2.072 -7.694 1.00 0.00 H new ATOM 0 HB3 GLU A 43 22.004 -0.418 -8.230 1.00 0.00 H new ATOM 0 HG2 GLU A 43 23.498 -1.709 -9.719 1.00 0.00 H new ATOM 0 HG3 GLU A 43 24.289 -0.304 -9.032 1.00 0.00 H new ATOM 681 N LYS A 44 25.013 0.849 -7.007 1.00 0.00 N ATOM 682 CA LYS A 44 25.702 2.123 -7.172 1.00 0.00 C ATOM 683 C LYS A 44 25.260 2.819 -8.455 1.00 0.00 C ATOM 684 O LYS A 44 26.034 2.942 -9.403 1.00 0.00 O ATOM 685 CB LYS A 44 27.217 1.907 -7.193 1.00 0.00 C ATOM 686 CG LYS A 44 28.015 3.171 -6.925 1.00 0.00 C ATOM 687 CD LYS A 44 28.092 3.478 -5.439 1.00 0.00 C ATOM 688 CE LYS A 44 29.295 2.809 -4.793 1.00 0.00 C ATOM 689 NZ LYS A 44 30.572 3.470 -5.181 1.00 0.00 N ATOM 0 H LYS A 44 25.568 0.033 -7.265 1.00 0.00 H new ATOM 0 HA LYS A 44 25.443 2.760 -6.326 1.00 0.00 H new ATOM 0 HB2 LYS A 44 27.479 1.157 -6.447 1.00 0.00 H new ATOM 0 HB3 LYS A 44 27.505 1.505 -8.164 1.00 0.00 H new ATOM 0 HG2 LYS A 44 29.022 3.058 -7.327 1.00 0.00 H new ATOM 0 HG3 LYS A 44 27.555 4.010 -7.447 1.00 0.00 H new ATOM 0 HD2 LYS A 44 28.152 4.556 -5.292 1.00 0.00 H new ATOM 0 HD3 LYS A 44 27.179 3.139 -4.949 1.00 0.00 H new ATOM 0 HE2 LYS A 44 29.187 2.836 -3.709 1.00 0.00 H new ATOM 0 HE3 LYS A 44 29.326 1.759 -5.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 31.323 3.189 -4.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 30.834 3.181 -6.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 30.452 4.503 -5.150 1.00 0.00 H new ATOM 703 N GLU A 45 24.010 3.274 -8.475 1.00 0.00 N ATOM 704 CA GLU A 45 23.466 3.958 -9.642 1.00 0.00 C ATOM 705 C GLU A 45 22.286 4.844 -9.253 1.00 0.00 C ATOM 706 O GLU A 45 21.600 4.582 -8.265 1.00 0.00 O ATOM 707 CB GLU A 45 23.029 2.942 -10.699 1.00 0.00 C ATOM 708 CG GLU A 45 21.824 2.114 -10.285 1.00 0.00 C ATOM 709 CD GLU A 45 21.757 0.781 -11.005 1.00 0.00 C ATOM 710 OE1 GLU A 45 22.823 0.162 -11.206 1.00 0.00 O ATOM 711 OE2 GLU A 45 20.640 0.357 -11.367 1.00 0.00 O ATOM 0 H GLU A 45 23.357 3.181 -7.697 1.00 0.00 H new ATOM 0 HA GLU A 45 24.250 4.590 -10.059 1.00 0.00 H new ATOM 0 HB2 GLU A 45 22.796 3.470 -11.624 1.00 0.00 H new ATOM 0 HB3 GLU A 45 23.862 2.273 -10.915 1.00 0.00 H new ATOM 0 HG2 GLU A 45 21.859 1.940 -9.209 1.00 0.00 H new ATOM 0 HG3 GLU A 45 20.913 2.678 -10.487 1.00 0.00 H new ATOM 718 N MET A 46 22.057 5.892 -10.036 1.00 0.00 N ATOM 719 CA MET A 46 20.960 6.817 -9.774 1.00 0.00 C ATOM 720 C MET A 46 19.756 6.494 -10.653 1.00 0.00 C ATOM 721 O MET A 46 19.651 6.978 -11.781 1.00 0.00 O ATOM 722 CB MET A 46 21.411 8.259 -10.015 1.00 0.00 C ATOM 723 CG MET A 46 22.380 8.776 -8.964 1.00 0.00 C ATOM 724 SD MET A 46 23.406 10.128 -9.572 1.00 0.00 S ATOM 725 CE MET A 46 22.949 11.436 -8.438 1.00 0.00 C ATOM 0 H MET A 46 22.616 6.123 -10.857 1.00 0.00 H new ATOM 0 HA MET A 46 20.666 6.707 -8.730 1.00 0.00 H new ATOM 0 HB2 MET A 46 21.882 8.325 -10.996 1.00 0.00 H new ATOM 0 HB3 MET A 46 20.534 8.906 -10.039 1.00 0.00 H new ATOM 0 HG2 MET A 46 21.819 9.114 -8.093 1.00 0.00 H new ATOM 0 HG3 MET A 46 23.021 7.959 -8.633 1.00 0.00 H new ATOM 0 HE1 MET A 46 23.502 12.342 -8.686 1.00 0.00 H new ATOM 0 HE2 MET A 46 21.879 11.630 -8.519 1.00 0.00 H new ATOM 0 HE3 MET A 46 23.187 11.133 -7.418 1.00 0.00 H new ATOM 735 N TYR A 47 18.849 5.676 -10.130 1.00 0.00 N ATOM 736 CA TYR A 47 17.654 5.287 -10.869 1.00 0.00 C ATOM 737 C TYR A 47 16.467 5.107 -9.928 1.00 0.00 C ATOM 738 O TYR A 47 16.475 4.234 -9.060 1.00 0.00 O ATOM 739 CB TYR A 47 17.906 3.993 -11.644 1.00 0.00 C ATOM 740 CG TYR A 47 18.770 4.180 -12.871 1.00 0.00 C ATOM 741 CD1 TYR A 47 20.151 4.292 -12.763 1.00 0.00 C ATOM 742 CD2 TYR A 47 18.205 4.244 -14.139 1.00 0.00 C ATOM 743 CE1 TYR A 47 20.943 4.464 -13.881 1.00 0.00 C ATOM 744 CE2 TYR A 47 18.990 4.415 -15.263 1.00 0.00 C ATOM 745 CZ TYR A 47 20.359 4.525 -15.129 1.00 0.00 C ATOM 746 OH TYR A 47 21.145 4.694 -16.245 1.00 0.00 O ATOM 0 H TYR A 47 18.919 5.270 -9.197 1.00 0.00 H new ATOM 0 HA TYR A 47 17.418 6.084 -11.574 1.00 0.00 H new ATOM 0 HB2 TYR A 47 18.382 3.270 -10.982 1.00 0.00 H new ATOM 0 HB3 TYR A 47 16.949 3.568 -11.945 1.00 0.00 H new ATOM 0 HD1 TYR A 47 20.613 4.244 -11.788 1.00 0.00 H new ATOM 0 HD2 TYR A 47 17.134 4.159 -14.248 1.00 0.00 H new ATOM 0 HE1 TYR A 47 22.015 4.550 -13.779 1.00 0.00 H new ATOM 0 HE2 TYR A 47 18.535 4.462 -16.241 1.00 0.00 H new ATOM 0 HH TYR A 47 20.578 4.715 -17.044 1.00 0.00 H new ATOM 756 N SER A 48 15.446 5.938 -10.108 1.00 0.00 N ATOM 757 CA SER A 48 14.251 5.874 -9.275 1.00 0.00 C ATOM 758 C SER A 48 13.002 5.682 -10.129 1.00 0.00 C ATOM 759 O SER A 48 12.497 6.628 -10.734 1.00 0.00 O ATOM 760 CB SER A 48 14.119 7.147 -8.437 1.00 0.00 C ATOM 761 OG SER A 48 14.197 8.304 -9.252 1.00 0.00 O ATOM 0 H SER A 48 15.422 6.664 -10.824 1.00 0.00 H new ATOM 0 HA SER A 48 14.349 5.017 -8.609 1.00 0.00 H new ATOM 0 HB2 SER A 48 13.169 7.138 -7.903 1.00 0.00 H new ATOM 0 HB3 SER A 48 14.907 7.174 -7.685 1.00 0.00 H new ATOM 0 HG SER A 48 13.618 8.193 -10.034 1.00 0.00 H new ATOM 767 N LYS A 49 12.507 4.450 -10.174 1.00 0.00 N ATOM 768 CA LYS A 49 11.316 4.130 -10.952 1.00 0.00 C ATOM 769 C LYS A 49 10.622 2.890 -10.400 1.00 0.00 C ATOM 770 O LYS A 49 11.108 1.771 -10.560 1.00 0.00 O ATOM 771 CB LYS A 49 11.686 3.910 -12.421 1.00 0.00 C ATOM 772 CG LYS A 49 10.531 4.141 -13.380 1.00 0.00 C ATOM 773 CD LYS A 49 10.383 5.612 -13.731 1.00 0.00 C ATOM 774 CE LYS A 49 11.432 6.052 -14.741 1.00 0.00 C ATOM 775 NZ LYS A 49 11.291 7.491 -15.096 1.00 0.00 N ATOM 0 H LYS A 49 12.913 3.655 -9.680 1.00 0.00 H new ATOM 0 HA LYS A 49 10.628 4.972 -10.879 1.00 0.00 H new ATOM 0 HB2 LYS A 49 12.506 4.579 -12.685 1.00 0.00 H new ATOM 0 HB3 LYS A 49 12.053 2.891 -12.546 1.00 0.00 H new ATOM 0 HG2 LYS A 49 10.692 3.563 -14.290 1.00 0.00 H new ATOM 0 HG3 LYS A 49 9.606 3.778 -12.931 1.00 0.00 H new ATOM 0 HD2 LYS A 49 9.388 5.792 -14.137 1.00 0.00 H new ATOM 0 HD3 LYS A 49 10.472 6.214 -12.827 1.00 0.00 H new ATOM 0 HE2 LYS A 49 12.427 5.875 -14.332 1.00 0.00 H new ATOM 0 HE3 LYS A 49 11.345 5.445 -15.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 12.024 7.752 -15.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 10.351 7.656 -15.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 11.399 8.072 -14.240 1.00 0.00 H new ATOM 789 N GLY A 50 9.480 3.096 -9.749 1.00 0.00 N ATOM 790 CA GLY A 50 8.737 1.985 -9.184 1.00 0.00 C ATOM 791 C GLY A 50 8.108 2.328 -7.848 1.00 0.00 C ATOM 792 O GLY A 50 8.727 2.148 -6.799 1.00 0.00 O ATOM 0 H GLY A 50 9.057 4.013 -9.603 1.00 0.00 H new ATOM 0 HA2 GLY A 50 7.957 1.681 -9.882 1.00 0.00 H new ATOM 0 HA3 GLY A 50 9.404 1.132 -9.060 1.00 0.00 H new ATOM 796 N ILE A 51 6.876 2.823 -7.886 1.00 0.00 N ATOM 797 CA ILE A 51 6.164 3.192 -6.669 1.00 0.00 C ATOM 798 C ILE A 51 4.668 2.930 -6.806 1.00 0.00 C ATOM 799 O ILE A 51 4.087 3.134 -7.873 1.00 0.00 O ATOM 800 CB ILE A 51 6.384 4.675 -6.316 1.00 0.00 C ATOM 801 CG1 ILE A 51 5.919 4.955 -4.885 1.00 0.00 C ATOM 802 CG2 ILE A 51 5.648 5.569 -7.302 1.00 0.00 C ATOM 803 CD1 ILE A 51 6.365 6.301 -4.357 1.00 0.00 C ATOM 0 H ILE A 51 6.350 2.978 -8.746 1.00 0.00 H new ATOM 0 HA ILE A 51 6.567 2.572 -5.868 1.00 0.00 H new ATOM 0 HB ILE A 51 7.450 4.895 -6.382 1.00 0.00 H new ATOM 0 HG12 ILE A 51 4.831 4.902 -4.848 1.00 0.00 H new ATOM 0 HG13 ILE A 51 6.299 4.172 -4.228 1.00 0.00 H new ATOM 0 HG21 ILE A 51 5.813 6.614 -7.039 1.00 0.00 H new ATOM 0 HG22 ILE A 51 6.022 5.385 -8.309 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.581 5.350 -7.265 1.00 0.00 H new ATOM 0 HD11 ILE A 51 6.000 6.431 -3.338 1.00 0.00 H new ATOM 0 HD12 ILE A 51 7.454 6.351 -4.361 1.00 0.00 H new ATOM 0 HD13 ILE A 51 5.963 7.092 -4.991 1.00 0.00 H new ATOM 815 N ILE A 52 4.049 2.480 -5.720 1.00 0.00 N ATOM 816 CA ILE A 52 2.620 2.193 -5.719 1.00 0.00 C ATOM 817 C ILE A 52 1.865 3.170 -4.825 1.00 0.00 C ATOM 818 O ILE A 52 2.036 3.195 -3.606 1.00 0.00 O ATOM 819 CB ILE A 52 2.335 0.756 -5.246 1.00 0.00 C ATOM 820 CG1 ILE A 52 3.075 -0.251 -6.128 1.00 0.00 C ATOM 821 CG2 ILE A 52 0.839 0.481 -5.259 1.00 0.00 C ATOM 822 CD1 ILE A 52 3.230 -1.614 -5.491 1.00 0.00 C ATOM 0 H ILE A 52 4.515 2.306 -4.829 1.00 0.00 H new ATOM 0 HA ILE A 52 2.275 2.303 -6.747 1.00 0.00 H new ATOM 0 HB ILE A 52 2.696 0.648 -4.223 1.00 0.00 H new ATOM 0 HG12 ILE A 52 2.539 -0.359 -7.071 1.00 0.00 H new ATOM 0 HG13 ILE A 52 4.063 0.144 -6.366 1.00 0.00 H new ATOM 0 HG21 ILE A 52 0.654 -0.539 -4.922 1.00 0.00 H new ATOM 0 HG22 ILE A 52 0.335 1.181 -4.593 1.00 0.00 H new ATOM 0 HG23 ILE A 52 0.455 0.604 -6.272 1.00 0.00 H new ATOM 0 HD11 ILE A 52 3.764 -2.276 -6.173 1.00 0.00 H new ATOM 0 HD12 ILE A 52 3.793 -1.520 -4.562 1.00 0.00 H new ATOM 0 HD13 ILE A 52 2.245 -2.030 -5.278 1.00 0.00 H new ATOM 834 N PRO A 53 1.005 3.995 -5.443 1.00 0.00 N ATOM 835 CA PRO A 53 0.204 4.988 -4.722 1.00 0.00 C ATOM 836 C PRO A 53 -0.879 4.345 -3.862 1.00 0.00 C ATOM 837 O PRO A 53 -1.687 3.554 -4.351 1.00 0.00 O ATOM 838 CB PRO A 53 -0.427 5.817 -5.843 1.00 0.00 C ATOM 839 CG PRO A 53 -0.462 4.901 -7.018 1.00 0.00 C ATOM 840 CD PRO A 53 0.750 4.020 -6.893 1.00 0.00 C ATOM 0 HA PRO A 53 0.808 5.573 -4.029 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -1.428 6.152 -5.572 1.00 0.00 H new ATOM 0 HB3 PRO A 53 0.161 6.710 -6.054 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -1.377 4.308 -7.023 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -0.441 5.463 -7.952 1.00 0.00 H new ATOM 0 HD2 PRO A 53 0.563 3.021 -7.285 1.00 0.00 H new ATOM 0 HD3 PRO A 53 1.599 4.424 -7.444 1.00 0.00 H new ATOM 848 N LEU A 54 -0.891 4.688 -2.579 1.00 0.00 N ATOM 849 CA LEU A 54 -1.876 4.145 -1.650 1.00 0.00 C ATOM 850 C LEU A 54 -3.281 4.225 -2.238 1.00 0.00 C ATOM 851 O LEU A 54 -4.124 3.367 -1.976 1.00 0.00 O ATOM 852 CB LEU A 54 -1.823 4.900 -0.320 1.00 0.00 C ATOM 853 CG LEU A 54 -3.029 4.719 0.602 1.00 0.00 C ATOM 854 CD1 LEU A 54 -2.863 3.474 1.460 1.00 0.00 C ATOM 855 CD2 LEU A 54 -3.220 5.950 1.477 1.00 0.00 C ATOM 0 H LEU A 54 -0.229 5.340 -2.158 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.635 3.097 -1.475 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.929 4.585 0.218 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.710 5.963 -0.533 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.919 4.594 -0.015 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.731 3.362 2.110 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -2.775 2.598 0.817 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -1.964 3.569 2.069 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -4.083 5.804 2.127 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.329 6.106 2.086 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.385 6.823 0.846 1.00 0.00 H new ATOM 867 N SER A 55 -3.525 5.260 -3.035 1.00 0.00 N ATOM 868 CA SER A 55 -4.829 5.453 -3.659 1.00 0.00 C ATOM 869 C SER A 55 -5.181 4.271 -4.558 1.00 0.00 C ATOM 870 O SER A 55 -6.338 3.859 -4.636 1.00 0.00 O ATOM 871 CB SER A 55 -4.841 6.749 -4.472 1.00 0.00 C ATOM 872 OG SER A 55 -4.095 6.607 -5.669 1.00 0.00 O ATOM 0 H SER A 55 -2.837 5.978 -3.264 1.00 0.00 H new ATOM 0 HA SER A 55 -5.577 5.521 -2.869 1.00 0.00 H new ATOM 0 HB2 SER A 55 -5.869 7.023 -4.711 1.00 0.00 H new ATOM 0 HB3 SER A 55 -4.425 7.561 -3.875 1.00 0.00 H new ATOM 0 HG SER A 55 -4.119 7.448 -6.171 1.00 0.00 H new ATOM 878 N ALA A 56 -4.173 3.731 -5.236 1.00 0.00 N ATOM 879 CA ALA A 56 -4.375 2.596 -6.129 1.00 0.00 C ATOM 880 C ALA A 56 -4.906 1.387 -5.367 1.00 0.00 C ATOM 881 O ALA A 56 -5.818 0.701 -5.830 1.00 0.00 O ATOM 882 CB ALA A 56 -3.076 2.246 -6.839 1.00 0.00 C ATOM 0 H ALA A 56 -3.209 4.061 -5.184 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.119 2.879 -6.874 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -3.241 1.397 -7.502 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -2.738 3.102 -7.423 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -2.316 1.987 -6.101 1.00 0.00 H new ATOM 888 N ILE A 57 -4.329 1.129 -4.198 1.00 0.00 N ATOM 889 CA ILE A 57 -4.745 0.002 -3.373 1.00 0.00 C ATOM 890 C ILE A 57 -6.235 0.074 -3.055 1.00 0.00 C ATOM 891 O ILE A 57 -6.681 0.953 -2.317 1.00 0.00 O ATOM 892 CB ILE A 57 -3.952 -0.053 -2.054 1.00 0.00 C ATOM 893 CG1 ILE A 57 -2.455 -0.190 -2.338 1.00 0.00 C ATOM 894 CG2 ILE A 57 -4.440 -1.206 -1.190 1.00 0.00 C ATOM 895 CD1 ILE A 57 -1.584 0.070 -1.130 1.00 0.00 C ATOM 0 H ILE A 57 -3.572 1.686 -3.801 1.00 0.00 H new ATOM 0 HA ILE A 57 -4.542 -0.902 -3.947 1.00 0.00 H new ATOM 0 HB ILE A 57 -4.116 0.878 -1.510 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -2.255 -1.195 -2.711 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -2.179 0.505 -3.131 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -3.870 -1.232 -0.261 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -5.497 -1.068 -0.963 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -4.303 -2.145 -1.726 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.536 -0.045 -1.406 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -1.755 1.084 -0.769 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -1.832 -0.642 -0.343 1.00 0.00 H new ATOM 907 N SER A 58 -6.999 -0.857 -3.615 1.00 0.00 N ATOM 908 CA SER A 58 -8.440 -0.899 -3.393 1.00 0.00 C ATOM 909 C SER A 58 -8.782 -1.808 -2.217 1.00 0.00 C ATOM 910 O SER A 58 -9.763 -1.583 -1.507 1.00 0.00 O ATOM 911 CB SER A 58 -9.158 -1.385 -4.654 1.00 0.00 C ATOM 912 OG SER A 58 -9.497 -0.299 -5.499 1.00 0.00 O ATOM 0 H SER A 58 -6.645 -1.593 -4.226 1.00 0.00 H new ATOM 0 HA SER A 58 -8.776 0.111 -3.159 1.00 0.00 H new ATOM 0 HB2 SER A 58 -8.519 -2.084 -5.194 1.00 0.00 H new ATOM 0 HB3 SER A 58 -10.061 -1.929 -4.375 1.00 0.00 H new ATOM 0 HG SER A 58 -9.953 -0.636 -6.298 1.00 0.00 H new ATOM 918 N THR A 59 -7.965 -2.838 -2.015 1.00 0.00 N ATOM 919 CA THR A 59 -8.181 -3.782 -0.927 1.00 0.00 C ATOM 920 C THR A 59 -6.986 -4.716 -0.764 1.00 0.00 C ATOM 921 O THR A 59 -6.274 -5.002 -1.727 1.00 0.00 O ATOM 922 CB THR A 59 -9.449 -4.625 -1.157 1.00 0.00 C ATOM 923 OG1 THR A 59 -9.953 -5.104 0.095 1.00 0.00 O ATOM 924 CG2 THR A 59 -9.157 -5.803 -2.075 1.00 0.00 C ATOM 0 H THR A 59 -7.148 -3.039 -2.591 1.00 0.00 H new ATOM 0 HA THR A 59 -8.306 -3.193 -0.018 1.00 0.00 H new ATOM 0 HB THR A 59 -10.198 -3.991 -1.632 1.00 0.00 H new ATOM 0 HG1 THR A 59 -10.760 -5.638 -0.060 1.00 0.00 H new ATOM 0 HG21 THR A 59 -10.068 -6.384 -2.223 1.00 0.00 H new ATOM 0 HG22 THR A 59 -8.801 -5.435 -3.037 1.00 0.00 H new ATOM 0 HG23 THR A 59 -8.393 -6.435 -1.623 1.00 0.00 H new ATOM 932 N VAL A 60 -6.773 -5.189 0.459 1.00 0.00 N ATOM 933 CA VAL A 60 -5.665 -6.092 0.747 1.00 0.00 C ATOM 934 C VAL A 60 -6.165 -7.396 1.359 1.00 0.00 C ATOM 935 O VAL A 60 -7.105 -7.401 2.154 1.00 0.00 O ATOM 936 CB VAL A 60 -4.648 -5.445 1.706 1.00 0.00 C ATOM 937 CG1 VAL A 60 -3.442 -6.352 1.897 1.00 0.00 C ATOM 938 CG2 VAL A 60 -4.222 -4.080 1.187 1.00 0.00 C ATOM 0 H VAL A 60 -7.353 -4.962 1.267 1.00 0.00 H new ATOM 0 HA VAL A 60 -5.174 -6.304 -0.203 1.00 0.00 H new ATOM 0 HB VAL A 60 -5.126 -5.307 2.676 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -2.735 -5.878 2.578 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -3.766 -7.305 2.316 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -2.960 -6.524 0.935 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -3.503 -3.637 1.876 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -3.762 -4.191 0.205 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -5.095 -3.432 1.107 1.00 0.00 H new ATOM 948 N ARG A 61 -5.529 -8.501 0.982 1.00 0.00 N ATOM 949 CA ARG A 61 -5.909 -9.813 1.493 1.00 0.00 C ATOM 950 C ARG A 61 -4.677 -10.681 1.734 1.00 0.00 C ATOM 951 O ARG A 61 -3.711 -10.630 0.973 1.00 0.00 O ATOM 952 CB ARG A 61 -6.854 -10.511 0.514 1.00 0.00 C ATOM 953 CG ARG A 61 -6.598 -10.152 -0.941 1.00 0.00 C ATOM 954 CD ARG A 61 -7.343 -8.889 -1.343 1.00 0.00 C ATOM 955 NE ARG A 61 -8.706 -9.173 -1.781 1.00 0.00 N ATOM 956 CZ ARG A 61 -9.008 -9.646 -2.985 1.00 0.00 C ATOM 957 NH1 ARG A 61 -8.046 -9.887 -3.866 1.00 0.00 N ATOM 958 NH2 ARG A 61 -10.273 -9.880 -3.310 1.00 0.00 N ATOM 0 H ARG A 61 -4.749 -8.514 0.325 1.00 0.00 H new ATOM 0 HA ARG A 61 -6.423 -9.670 2.444 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -6.757 -11.590 0.636 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -7.882 -10.252 0.768 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -5.529 -10.011 -1.099 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -6.909 -10.978 -1.581 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -7.370 -8.200 -0.499 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -6.801 -8.389 -2.146 1.00 0.00 H new ATOM 0 HE ARG A 61 -9.469 -8.999 -1.127 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -7.072 -9.709 -3.619 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -8.280 -10.250 -4.790 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -11.015 -9.697 -2.635 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -10.503 -10.243 -4.235 1.00 0.00 H new ATOM 972 N VAL A 62 -4.718 -11.476 2.798 1.00 0.00 N ATOM 973 CA VAL A 62 -3.606 -12.355 3.139 1.00 0.00 C ATOM 974 C VAL A 62 -3.646 -13.637 2.314 1.00 0.00 C ATOM 975 O VAL A 62 -4.717 -14.106 1.930 1.00 0.00 O ATOM 976 CB VAL A 62 -3.618 -12.720 4.635 1.00 0.00 C ATOM 977 CG1 VAL A 62 -3.505 -11.468 5.491 1.00 0.00 C ATOM 978 CG2 VAL A 62 -4.875 -13.503 4.982 1.00 0.00 C ATOM 0 H VAL A 62 -5.510 -11.529 3.439 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.690 -11.809 2.913 1.00 0.00 H new ATOM 0 HB VAL A 62 -2.755 -13.352 4.844 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -3.515 -11.746 6.545 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -2.573 -10.953 5.261 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -4.346 -10.807 5.282 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -4.867 -13.753 6.043 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -5.754 -12.898 4.758 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -4.906 -14.420 4.394 1.00 0.00 H new ATOM 988 N GLN A 63 -2.472 -14.199 2.046 1.00 0.00 N ATOM 989 CA GLN A 63 -2.373 -15.427 1.266 1.00 0.00 C ATOM 990 C GLN A 63 -2.009 -16.610 2.157 1.00 0.00 C ATOM 991 O GLN A 63 -1.305 -16.455 3.155 1.00 0.00 O ATOM 992 CB GLN A 63 -1.331 -15.269 0.157 1.00 0.00 C ATOM 993 CG GLN A 63 -1.507 -16.254 -0.988 1.00 0.00 C ATOM 994 CD GLN A 63 -2.460 -15.747 -2.053 1.00 0.00 C ATOM 995 OE1 GLN A 63 -3.671 -15.950 -1.966 1.00 0.00 O ATOM 996 NE2 GLN A 63 -1.916 -15.082 -3.065 1.00 0.00 N ATOM 0 H GLN A 63 -1.576 -13.824 2.357 1.00 0.00 H new ATOM 0 HA GLN A 63 -3.346 -15.621 0.815 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -1.383 -14.254 -0.237 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -0.336 -15.395 0.584 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -0.536 -16.456 -1.441 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -1.878 -17.200 -0.594 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -0.907 -14.937 -3.096 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -2.507 -14.716 -3.811 1.00 0.00 H new ATOM 1005 N GLY A 64 -2.494 -17.792 1.790 1.00 0.00 N ATOM 1006 CA GLY A 64 -2.209 -18.984 2.568 1.00 0.00 C ATOM 1007 C GLY A 64 -0.819 -19.529 2.306 1.00 0.00 C ATOM 1008 O GLY A 64 -0.503 -20.655 2.691 1.00 0.00 O ATOM 0 H GLY A 64 -3.079 -17.946 0.969 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -2.312 -18.755 3.629 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -2.947 -19.752 2.334 1.00 0.00 H new ATOM 1012 N ASP A 65 0.014 -18.730 1.648 1.00 0.00 N ATOM 1013 CA ASP A 65 1.378 -19.138 1.334 1.00 0.00 C ATOM 1014 C ASP A 65 2.371 -18.038 1.694 1.00 0.00 C ATOM 1015 O ASP A 65 3.027 -17.470 0.822 1.00 0.00 O ATOM 1016 CB ASP A 65 1.500 -19.486 -0.151 1.00 0.00 C ATOM 1017 CG ASP A 65 0.900 -20.839 -0.479 1.00 0.00 C ATOM 1018 OD1 ASP A 65 1.592 -21.860 -0.280 1.00 0.00 O ATOM 1019 OD2 ASP A 65 -0.262 -20.877 -0.935 1.00 0.00 O ATOM 0 H ASP A 65 -0.232 -17.795 1.322 1.00 0.00 H new ATOM 0 HA ASP A 65 1.612 -20.022 1.927 1.00 0.00 H new ATOM 0 HB2 ASP A 65 1.003 -18.718 -0.743 1.00 0.00 H new ATOM 0 HB3 ASP A 65 2.552 -19.479 -0.438 1.00 0.00 H new ATOM 1024 N ASN A 66 2.476 -17.742 2.986 1.00 0.00 N ATOM 1025 CA ASN A 66 3.388 -16.709 3.462 1.00 0.00 C ATOM 1026 C ASN A 66 3.462 -15.550 2.472 1.00 0.00 C ATOM 1027 O ASN A 66 4.523 -14.962 2.264 1.00 0.00 O ATOM 1028 CB ASN A 66 4.784 -17.294 3.684 1.00 0.00 C ATOM 1029 CG ASN A 66 4.738 -18.704 4.241 1.00 0.00 C ATOM 1030 OD1 ASN A 66 3.693 -19.169 4.697 1.00 0.00 O ATOM 1031 ND2 ASN A 66 5.874 -19.391 4.206 1.00 0.00 N ATOM 0 H ASN A 66 1.941 -18.203 3.721 1.00 0.00 H new ATOM 0 HA ASN A 66 3.005 -16.331 4.410 1.00 0.00 H new ATOM 0 HB2 ASN A 66 5.328 -17.297 2.740 1.00 0.00 H new ATOM 0 HB3 ASN A 66 5.339 -16.653 4.370 1.00 0.00 H new ATOM 0 HD21 ASN A 66 5.905 -20.345 4.566 1.00 0.00 H new ATOM 0 HD22 ASN A 66 6.716 -18.965 3.819 1.00 0.00 H new ATOM 1038 N LYS A 67 2.326 -15.227 1.863 1.00 0.00 N ATOM 1039 CA LYS A 67 2.259 -14.137 0.896 1.00 0.00 C ATOM 1040 C LYS A 67 0.969 -13.341 1.062 1.00 0.00 C ATOM 1041 O LYS A 67 0.114 -13.688 1.877 1.00 0.00 O ATOM 1042 CB LYS A 67 2.352 -14.687 -0.530 1.00 0.00 C ATOM 1043 CG LYS A 67 3.765 -15.051 -0.950 1.00 0.00 C ATOM 1044 CD LYS A 67 3.804 -15.583 -2.373 1.00 0.00 C ATOM 1045 CE LYS A 67 3.620 -17.093 -2.408 1.00 0.00 C ATOM 1046 NZ LYS A 67 3.456 -17.599 -3.799 1.00 0.00 N ATOM 0 H LYS A 67 1.439 -15.705 2.022 1.00 0.00 H new ATOM 0 HA LYS A 67 3.102 -13.471 1.078 1.00 0.00 H new ATOM 0 HB2 LYS A 67 1.719 -15.570 -0.612 1.00 0.00 H new ATOM 0 HB3 LYS A 67 1.956 -13.945 -1.223 1.00 0.00 H new ATOM 0 HG2 LYS A 67 4.407 -14.173 -0.871 1.00 0.00 H new ATOM 0 HG3 LYS A 67 4.166 -15.801 -0.269 1.00 0.00 H new ATOM 0 HD2 LYS A 67 3.021 -15.106 -2.963 1.00 0.00 H new ATOM 0 HD3 LYS A 67 4.756 -15.320 -2.835 1.00 0.00 H new ATOM 0 HE2 LYS A 67 4.481 -17.575 -1.945 1.00 0.00 H new ATOM 0 HE3 LYS A 67 2.746 -17.366 -1.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 3.333 -18.632 -3.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 2.619 -17.159 -4.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 4.301 -17.361 -4.357 1.00 0.00 H new ATOM 1060 N PHE A 68 0.834 -12.272 0.283 1.00 0.00 N ATOM 1061 CA PHE A 68 -0.352 -11.427 0.344 1.00 0.00 C ATOM 1062 C PHE A 68 -0.622 -10.770 -1.007 1.00 0.00 C ATOM 1063 O PHE A 68 0.307 -10.393 -1.721 1.00 0.00 O ATOM 1064 CB PHE A 68 -0.185 -10.353 1.421 1.00 0.00 C ATOM 1065 CG PHE A 68 1.003 -9.462 1.200 1.00 0.00 C ATOM 1066 CD1 PHE A 68 2.289 -9.935 1.407 1.00 0.00 C ATOM 1067 CD2 PHE A 68 0.835 -8.151 0.785 1.00 0.00 C ATOM 1068 CE1 PHE A 68 3.385 -9.118 1.204 1.00 0.00 C ATOM 1069 CE2 PHE A 68 1.927 -7.329 0.580 1.00 0.00 C ATOM 1070 CZ PHE A 68 3.204 -7.812 0.791 1.00 0.00 C ATOM 0 H PHE A 68 1.532 -11.971 -0.398 1.00 0.00 H new ATOM 0 HA PHE A 68 -1.204 -12.058 0.599 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -1.086 -9.741 1.455 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -0.091 -10.836 2.393 1.00 0.00 H new ATOM 0 HD1 PHE A 68 2.437 -10.955 1.731 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -0.161 -7.767 0.620 1.00 0.00 H new ATOM 0 HE1 PHE A 68 4.382 -9.500 1.368 1.00 0.00 H new ATOM 0 HE2 PHE A 68 1.782 -6.309 0.255 1.00 0.00 H new ATOM 0 HZ PHE A 68 4.058 -7.171 0.634 1.00 0.00 H new ATOM 1080 N GLU A 69 -1.899 -10.638 -1.350 1.00 0.00 N ATOM 1081 CA GLU A 69 -2.291 -10.028 -2.615 1.00 0.00 C ATOM 1082 C GLU A 69 -2.718 -8.578 -2.411 1.00 0.00 C ATOM 1083 O GLU A 69 -3.479 -8.266 -1.495 1.00 0.00 O ATOM 1084 CB GLU A 69 -3.430 -10.822 -3.258 1.00 0.00 C ATOM 1085 CG GLU A 69 -3.524 -10.641 -4.764 1.00 0.00 C ATOM 1086 CD GLU A 69 -4.548 -11.561 -5.399 1.00 0.00 C ATOM 1087 OE1 GLU A 69 -5.571 -11.852 -4.744 1.00 0.00 O ATOM 1088 OE2 GLU A 69 -4.328 -11.989 -6.551 1.00 0.00 O ATOM 0 H GLU A 69 -2.680 -10.945 -0.770 1.00 0.00 H new ATOM 0 HA GLU A 69 -1.427 -10.043 -3.279 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -3.295 -11.880 -3.036 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -4.374 -10.519 -2.805 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -3.784 -9.606 -4.986 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -2.547 -10.828 -5.210 1.00 0.00 H new ATOM 1095 N VAL A 70 -2.223 -7.694 -3.272 1.00 0.00 N ATOM 1096 CA VAL A 70 -2.553 -6.276 -3.187 1.00 0.00 C ATOM 1097 C VAL A 70 -3.314 -5.815 -4.425 1.00 0.00 C ATOM 1098 O VAL A 70 -2.743 -5.692 -5.509 1.00 0.00 O ATOM 1099 CB VAL A 70 -1.288 -5.414 -3.025 1.00 0.00 C ATOM 1100 CG1 VAL A 70 -1.653 -3.940 -2.935 1.00 0.00 C ATOM 1101 CG2 VAL A 70 -0.498 -5.852 -1.801 1.00 0.00 C ATOM 0 H VAL A 70 -1.592 -7.935 -4.036 1.00 0.00 H new ATOM 0 HA VAL A 70 -3.184 -6.150 -2.307 1.00 0.00 H new ATOM 0 HB VAL A 70 -0.659 -5.554 -3.904 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -0.746 -3.347 -2.821 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -2.172 -3.638 -3.844 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -2.303 -3.778 -2.075 1.00 0.00 H new ATOM 0 HG21 VAL A 70 0.393 -5.232 -1.702 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -1.117 -5.743 -0.910 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -0.203 -6.895 -1.912 1.00 0.00 H new ATOM 1111 N VAL A 71 -4.608 -5.560 -4.257 1.00 0.00 N ATOM 1112 CA VAL A 71 -5.448 -5.109 -5.360 1.00 0.00 C ATOM 1113 C VAL A 71 -5.228 -3.629 -5.650 1.00 0.00 C ATOM 1114 O VAL A 71 -5.358 -2.784 -4.764 1.00 0.00 O ATOM 1115 CB VAL A 71 -6.941 -5.345 -5.061 1.00 0.00 C ATOM 1116 CG1 VAL A 71 -7.793 -4.960 -6.260 1.00 0.00 C ATOM 1117 CG2 VAL A 71 -7.182 -6.795 -4.668 1.00 0.00 C ATOM 0 H VAL A 71 -5.097 -5.658 -3.367 1.00 0.00 H new ATOM 0 HA VAL A 71 -5.162 -5.694 -6.234 1.00 0.00 H new ATOM 0 HB VAL A 71 -7.231 -4.712 -4.222 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -8.844 -5.134 -6.030 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -7.641 -3.906 -6.491 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -7.505 -5.565 -7.120 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -8.242 -6.944 -4.460 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -6.877 -7.449 -5.485 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -6.601 -7.032 -3.777 1.00 0.00 H new ATOM 1127 N THR A 72 -4.892 -3.320 -6.899 1.00 0.00 N ATOM 1128 CA THR A 72 -4.653 -1.942 -7.308 1.00 0.00 C ATOM 1129 C THR A 72 -5.375 -1.621 -8.611 1.00 0.00 C ATOM 1130 O THR A 72 -5.804 -2.521 -9.334 1.00 0.00 O ATOM 1131 CB THR A 72 -3.148 -1.663 -7.486 1.00 0.00 C ATOM 1132 OG1 THR A 72 -2.580 -2.604 -8.403 1.00 0.00 O ATOM 1133 CG2 THR A 72 -2.421 -1.745 -6.152 1.00 0.00 C ATOM 0 H THR A 72 -4.779 -4.007 -7.645 1.00 0.00 H new ATOM 0 HA THR A 72 -5.043 -1.305 -6.514 1.00 0.00 H new ATOM 0 HB THR A 72 -3.033 -0.655 -7.883 1.00 0.00 H new ATOM 0 HG1 THR A 72 -1.665 -2.819 -8.126 1.00 0.00 H new ATOM 0 HG21 THR A 72 -1.360 -1.545 -6.303 1.00 0.00 H new ATOM 0 HG22 THR A 72 -2.836 -1.007 -5.466 1.00 0.00 H new ATOM 0 HG23 THR A 72 -2.545 -2.743 -5.731 1.00 0.00 H new ATOM 1141 N THR A 73 -5.508 -0.332 -8.907 1.00 0.00 N ATOM 1142 CA THR A 73 -6.179 0.108 -10.123 1.00 0.00 C ATOM 1143 C THR A 73 -5.528 -0.498 -11.361 1.00 0.00 C ATOM 1144 O THR A 73 -6.171 -1.225 -12.118 1.00 0.00 O ATOM 1145 CB THR A 73 -6.164 1.643 -10.249 1.00 0.00 C ATOM 1146 OG1 THR A 73 -6.783 2.235 -9.101 1.00 0.00 O ATOM 1147 CG2 THR A 73 -6.890 2.090 -11.510 1.00 0.00 C ATOM 0 H THR A 73 -5.159 0.426 -8.320 1.00 0.00 H new ATOM 0 HA THR A 73 -7.212 -0.234 -10.055 1.00 0.00 H new ATOM 0 HB THR A 73 -5.126 1.970 -10.311 1.00 0.00 H new ATOM 0 HG1 THR A 73 -6.768 3.211 -9.188 1.00 0.00 H new ATOM 0 HG21 THR A 73 -6.866 3.178 -11.577 1.00 0.00 H new ATOM 0 HG22 THR A 73 -6.399 1.662 -12.384 1.00 0.00 H new ATOM 0 HG23 THR A 73 -7.925 1.751 -11.473 1.00 0.00 H new ATOM 1155 N GLN A 74 -4.250 -0.195 -11.560 1.00 0.00 N ATOM 1156 CA GLN A 74 -3.512 -0.712 -12.707 1.00 0.00 C ATOM 1157 C GLN A 74 -3.748 -2.209 -12.876 1.00 0.00 C ATOM 1158 O GLN A 74 -4.357 -2.644 -13.854 1.00 0.00 O ATOM 1159 CB GLN A 74 -2.017 -0.434 -12.545 1.00 0.00 C ATOM 1160 CG GLN A 74 -1.659 1.041 -12.628 1.00 0.00 C ATOM 1161 CD GLN A 74 -0.212 1.312 -12.267 1.00 0.00 C ATOM 1162 OE1 GLN A 74 0.266 0.893 -11.212 1.00 0.00 O ATOM 1163 NE2 GLN A 74 0.496 2.015 -13.143 1.00 0.00 N ATOM 0 H GLN A 74 -3.704 0.406 -10.943 1.00 0.00 H new ATOM 0 HA GLN A 74 -3.874 -0.203 -13.600 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -1.685 -0.826 -11.584 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -1.470 -0.976 -13.316 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -1.851 1.401 -13.639 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -2.308 1.607 -11.960 1.00 0.00 H new ATOM 0 HE21 GLN A 74 0.060 2.343 -14.005 1.00 0.00 H new ATOM 0 HE22 GLN A 74 1.476 2.227 -12.954 1.00 0.00 H new ATOM 1172 N ARG A 75 -3.262 -2.992 -11.919 1.00 0.00 N ATOM 1173 CA ARG A 75 -3.419 -4.441 -11.963 1.00 0.00 C ATOM 1174 C ARG A 75 -3.063 -5.068 -10.619 1.00 0.00 C ATOM 1175 O ARG A 75 -2.234 -4.541 -9.875 1.00 0.00 O ATOM 1176 CB ARG A 75 -2.540 -5.037 -13.065 1.00 0.00 C ATOM 1177 CG ARG A 75 -1.061 -5.063 -12.715 1.00 0.00 C ATOM 1178 CD ARG A 75 -0.339 -6.192 -13.435 1.00 0.00 C ATOM 1179 NE ARG A 75 -0.159 -5.909 -14.856 1.00 0.00 N ATOM 1180 CZ ARG A 75 0.553 -6.676 -15.674 1.00 0.00 C ATOM 1181 NH1 ARG A 75 1.149 -7.767 -15.214 1.00 0.00 N ATOM 1182 NH2 ARG A 75 0.670 -6.352 -16.955 1.00 0.00 N ATOM 0 H ARG A 75 -2.756 -2.647 -11.103 1.00 0.00 H new ATOM 0 HA ARG A 75 -4.464 -4.662 -12.181 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -2.873 -6.053 -13.274 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -2.678 -4.461 -13.980 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -0.606 -4.109 -12.982 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -0.943 -5.182 -11.638 1.00 0.00 H new ATOM 0 HD2 ARG A 75 0.634 -6.353 -12.972 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -0.905 -7.116 -13.318 1.00 0.00 H new ATOM 0 HE ARG A 75 -0.605 -5.076 -15.242 1.00 0.00 H new ATOM 0 HH11 ARG A 75 1.061 -8.019 -14.230 1.00 0.00 H new ATOM 0 HH12 ARG A 75 1.695 -8.354 -15.844 1.00 0.00 H new ATOM 0 HH21 ARG A 75 0.213 -5.513 -17.313 1.00 0.00 H new ATOM 0 HH22 ARG A 75 1.217 -6.942 -17.582 1.00 0.00 H new ATOM 1196 N THR A 76 -3.696 -6.196 -10.311 1.00 0.00 N ATOM 1197 CA THR A 76 -3.448 -6.894 -9.056 1.00 0.00 C ATOM 1198 C THR A 76 -1.992 -7.331 -8.949 1.00 0.00 C ATOM 1199 O THR A 76 -1.422 -7.867 -9.900 1.00 0.00 O ATOM 1200 CB THR A 76 -4.356 -8.130 -8.912 1.00 0.00 C ATOM 1201 OG1 THR A 76 -5.731 -7.731 -8.914 1.00 0.00 O ATOM 1202 CG2 THR A 76 -4.044 -8.884 -7.628 1.00 0.00 C ATOM 0 H THR A 76 -4.385 -6.646 -10.914 1.00 0.00 H new ATOM 0 HA THR A 76 -3.673 -6.192 -8.253 1.00 0.00 H new ATOM 0 HB THR A 76 -4.169 -8.791 -9.758 1.00 0.00 H new ATOM 0 HG1 THR A 76 -6.301 -8.523 -8.824 1.00 0.00 H new ATOM 0 HG21 THR A 76 -4.698 -9.753 -7.548 1.00 0.00 H new ATOM 0 HG22 THR A 76 -3.005 -9.212 -7.642 1.00 0.00 H new ATOM 0 HG23 THR A 76 -4.206 -8.228 -6.772 1.00 0.00 H new ATOM 1210 N PHE A 77 -1.394 -7.101 -7.785 1.00 0.00 N ATOM 1211 CA PHE A 77 -0.003 -7.472 -7.553 1.00 0.00 C ATOM 1212 C PHE A 77 0.099 -8.578 -6.508 1.00 0.00 C ATOM 1213 O PHE A 77 -0.882 -8.909 -5.841 1.00 0.00 O ATOM 1214 CB PHE A 77 0.804 -6.252 -7.101 1.00 0.00 C ATOM 1215 CG PHE A 77 0.915 -5.184 -8.151 1.00 0.00 C ATOM 1216 CD1 PHE A 77 1.763 -5.345 -9.235 1.00 0.00 C ATOM 1217 CD2 PHE A 77 0.170 -4.020 -8.055 1.00 0.00 C ATOM 1218 CE1 PHE A 77 1.867 -4.363 -10.202 1.00 0.00 C ATOM 1219 CE2 PHE A 77 0.270 -3.034 -9.019 1.00 0.00 C ATOM 1220 CZ PHE A 77 1.119 -3.207 -10.095 1.00 0.00 C ATOM 0 H PHE A 77 -1.851 -6.659 -6.987 1.00 0.00 H new ATOM 0 HA PHE A 77 0.408 -7.844 -8.491 1.00 0.00 H new ATOM 0 HB2 PHE A 77 0.339 -5.828 -6.211 1.00 0.00 H new ATOM 0 HB3 PHE A 77 1.805 -6.574 -6.815 1.00 0.00 H new ATOM 0 HD1 PHE A 77 2.349 -6.248 -9.325 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -0.497 -3.881 -7.217 1.00 0.00 H new ATOM 0 HE1 PHE A 77 2.533 -4.500 -11.041 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -0.315 -2.130 -8.931 1.00 0.00 H new ATOM 0 HZ PHE A 77 1.198 -2.440 -10.851 1.00 0.00 H new ATOM 1230 N VAL A 78 1.292 -9.148 -6.371 1.00 0.00 N ATOM 1231 CA VAL A 78 1.523 -10.217 -5.407 1.00 0.00 C ATOM 1232 C VAL A 78 2.931 -10.140 -4.828 1.00 0.00 C ATOM 1233 O VAL A 78 3.917 -10.350 -5.534 1.00 0.00 O ATOM 1234 CB VAL A 78 1.318 -11.603 -6.047 1.00 0.00 C ATOM 1235 CG1 VAL A 78 1.405 -12.696 -4.992 1.00 0.00 C ATOM 1236 CG2 VAL A 78 -0.015 -11.661 -6.777 1.00 0.00 C ATOM 0 H VAL A 78 2.114 -8.887 -6.916 1.00 0.00 H new ATOM 0 HA VAL A 78 0.796 -10.084 -4.606 1.00 0.00 H new ATOM 0 HB VAL A 78 2.112 -11.769 -6.775 1.00 0.00 H new ATOM 0 HG11 VAL A 78 1.258 -13.668 -5.462 1.00 0.00 H new ATOM 0 HG12 VAL A 78 2.386 -12.667 -4.518 1.00 0.00 H new ATOM 0 HG13 VAL A 78 0.633 -12.537 -4.239 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -0.143 -12.647 -7.223 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -0.825 -11.474 -6.072 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -0.034 -10.903 -7.560 1.00 0.00 H new ATOM 1246 N PHE A 79 3.018 -9.838 -3.536 1.00 0.00 N ATOM 1247 CA PHE A 79 4.306 -9.732 -2.861 1.00 0.00 C ATOM 1248 C PHE A 79 4.542 -10.933 -1.950 1.00 0.00 C ATOM 1249 O PHE A 79 3.649 -11.756 -1.746 1.00 0.00 O ATOM 1250 CB PHE A 79 4.374 -8.439 -2.046 1.00 0.00 C ATOM 1251 CG PHE A 79 4.578 -7.211 -2.887 1.00 0.00 C ATOM 1252 CD1 PHE A 79 5.844 -6.860 -3.328 1.00 0.00 C ATOM 1253 CD2 PHE A 79 3.504 -6.408 -3.236 1.00 0.00 C ATOM 1254 CE1 PHE A 79 6.035 -5.731 -4.102 1.00 0.00 C ATOM 1255 CE2 PHE A 79 3.689 -5.278 -4.010 1.00 0.00 C ATOM 1256 CZ PHE A 79 4.957 -4.938 -4.442 1.00 0.00 C ATOM 0 H PHE A 79 2.212 -9.663 -2.936 1.00 0.00 H new ATOM 0 HA PHE A 79 5.087 -9.715 -3.622 1.00 0.00 H new ATOM 0 HB2 PHE A 79 3.452 -8.330 -1.475 1.00 0.00 H new ATOM 0 HB3 PHE A 79 5.188 -8.515 -1.325 1.00 0.00 H new ATOM 0 HD1 PHE A 79 6.691 -7.476 -3.064 1.00 0.00 H new ATOM 0 HD2 PHE A 79 2.511 -6.668 -2.899 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.027 -5.469 -4.441 1.00 0.00 H new ATOM 0 HE2 PHE A 79 2.844 -4.661 -4.277 1.00 0.00 H new ATOM 0 HZ PHE A 79 5.104 -4.054 -5.044 1.00 0.00 H new ATOM 1266 N ARG A 80 5.751 -11.027 -1.406 1.00 0.00 N ATOM 1267 CA ARG A 80 6.106 -12.128 -0.518 1.00 0.00 C ATOM 1268 C ARG A 80 7.005 -11.644 0.615 1.00 0.00 C ATOM 1269 O ARG A 80 7.775 -10.697 0.450 1.00 0.00 O ATOM 1270 CB ARG A 80 6.809 -13.237 -1.303 1.00 0.00 C ATOM 1271 CG ARG A 80 7.311 -14.376 -0.430 1.00 0.00 C ATOM 1272 CD ARG A 80 8.121 -15.379 -1.236 1.00 0.00 C ATOM 1273 NE ARG A 80 8.450 -16.569 -0.456 1.00 0.00 N ATOM 1274 CZ ARG A 80 9.424 -16.611 0.447 1.00 0.00 C ATOM 1275 NH1 ARG A 80 10.160 -15.533 0.682 1.00 0.00 N ATOM 1276 NH2 ARG A 80 9.663 -17.731 1.116 1.00 0.00 N ATOM 0 H ARG A 80 6.501 -10.354 -1.564 1.00 0.00 H new ATOM 0 HA ARG A 80 5.187 -12.524 -0.086 1.00 0.00 H new ATOM 0 HB2 ARG A 80 6.120 -13.637 -2.047 1.00 0.00 H new ATOM 0 HB3 ARG A 80 7.651 -12.808 -1.846 1.00 0.00 H new ATOM 0 HG2 ARG A 80 7.925 -13.975 0.376 1.00 0.00 H new ATOM 0 HG3 ARG A 80 6.464 -14.880 0.035 1.00 0.00 H new ATOM 0 HD2 ARG A 80 7.558 -15.671 -2.123 1.00 0.00 H new ATOM 0 HD3 ARG A 80 9.040 -14.907 -1.583 1.00 0.00 H new ATOM 0 HE ARG A 80 7.902 -17.415 -0.613 1.00 0.00 H new ATOM 0 HH11 ARG A 80 9.979 -14.670 0.169 1.00 0.00 H new ATOM 0 HH12 ARG A 80 10.907 -15.567 1.375 1.00 0.00 H new ATOM 0 HH21 ARG A 80 9.099 -18.562 0.938 1.00 0.00 H new ATOM 0 HH22 ARG A 80 10.411 -17.762 1.809 1.00 0.00 H new ATOM 1290 N VAL A 81 6.902 -12.299 1.767 1.00 0.00 N ATOM 1291 CA VAL A 81 7.706 -11.936 2.928 1.00 0.00 C ATOM 1292 C VAL A 81 8.534 -13.120 3.414 1.00 0.00 C ATOM 1293 O VAL A 81 8.386 -14.237 2.922 1.00 0.00 O ATOM 1294 CB VAL A 81 6.824 -11.431 4.086 1.00 0.00 C ATOM 1295 CG1 VAL A 81 6.486 -9.960 3.897 1.00 0.00 C ATOM 1296 CG2 VAL A 81 5.558 -12.267 4.195 1.00 0.00 C ATOM 0 H VAL A 81 6.269 -13.084 1.921 1.00 0.00 H new ATOM 0 HA VAL A 81 8.373 -11.134 2.613 1.00 0.00 H new ATOM 0 HB VAL A 81 7.382 -11.535 5.017 1.00 0.00 H new ATOM 0 HG11 VAL A 81 5.863 -9.621 4.724 1.00 0.00 H new ATOM 0 HG12 VAL A 81 7.406 -9.376 3.872 1.00 0.00 H new ATOM 0 HG13 VAL A 81 5.947 -9.828 2.959 1.00 0.00 H new ATOM 0 HG21 VAL A 81 4.947 -11.896 5.018 1.00 0.00 H new ATOM 0 HG22 VAL A 81 4.995 -12.197 3.265 1.00 0.00 H new ATOM 0 HG23 VAL A 81 5.824 -13.308 4.381 1.00 0.00 H new ATOM 1306 N GLU A 82 9.407 -12.865 4.385 1.00 0.00 N ATOM 1307 CA GLU A 82 10.260 -13.911 4.937 1.00 0.00 C ATOM 1308 C GLU A 82 9.686 -14.447 6.246 1.00 0.00 C ATOM 1309 O GLU A 82 9.794 -15.636 6.544 1.00 0.00 O ATOM 1310 CB GLU A 82 11.675 -13.376 5.170 1.00 0.00 C ATOM 1311 CG GLU A 82 12.595 -13.550 3.973 1.00 0.00 C ATOM 1312 CD GLU A 82 14.007 -13.073 4.250 1.00 0.00 C ATOM 1313 OE1 GLU A 82 14.162 -12.040 4.933 1.00 0.00 O ATOM 1314 OE2 GLU A 82 14.958 -13.734 3.782 1.00 0.00 O ATOM 0 H GLU A 82 9.541 -11.945 4.804 1.00 0.00 H new ATOM 0 HA GLU A 82 10.302 -14.728 4.217 1.00 0.00 H new ATOM 0 HB2 GLU A 82 11.617 -12.317 5.423 1.00 0.00 H new ATOM 0 HB3 GLU A 82 12.110 -13.886 6.030 1.00 0.00 H new ATOM 0 HG2 GLU A 82 12.620 -14.602 3.688 1.00 0.00 H new ATOM 0 HG3 GLU A 82 12.189 -12.999 3.124 1.00 0.00 H new ATOM 1321 N LYS A 83 9.075 -13.560 7.024 1.00 0.00 N ATOM 1322 CA LYS A 83 8.482 -13.941 8.301 1.00 0.00 C ATOM 1323 C LYS A 83 6.980 -13.675 8.304 1.00 0.00 C ATOM 1324 O LYS A 83 6.504 -12.750 7.647 1.00 0.00 O ATOM 1325 CB LYS A 83 9.149 -13.174 9.445 1.00 0.00 C ATOM 1326 CG LYS A 83 10.563 -13.641 9.747 1.00 0.00 C ATOM 1327 CD LYS A 83 11.394 -12.533 10.372 1.00 0.00 C ATOM 1328 CE LYS A 83 12.876 -12.873 10.359 1.00 0.00 C ATOM 1329 NZ LYS A 83 13.722 -11.681 10.646 1.00 0.00 N ATOM 0 H LYS A 83 8.977 -12.571 6.792 1.00 0.00 H new ATOM 0 HA LYS A 83 8.644 -15.009 8.445 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.171 -12.113 9.196 1.00 0.00 H new ATOM 0 HB3 LYS A 83 8.541 -13.278 10.344 1.00 0.00 H new ATOM 0 HG2 LYS A 83 10.528 -14.496 10.422 1.00 0.00 H new ATOM 0 HG3 LYS A 83 11.040 -13.980 8.827 1.00 0.00 H new ATOM 0 HD2 LYS A 83 11.228 -11.602 9.829 1.00 0.00 H new ATOM 0 HD3 LYS A 83 11.067 -12.366 11.398 1.00 0.00 H new ATOM 0 HE2 LYS A 83 13.077 -13.648 11.099 1.00 0.00 H new ATOM 0 HE3 LYS A 83 13.146 -13.284 9.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 14.725 -11.955 10.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 13.549 -10.951 9.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 13.483 -11.304 11.585 1.00 0.00 H new ATOM 1343 N GLU A 84 6.241 -14.491 9.049 1.00 0.00 N ATOM 1344 CA GLU A 84 4.793 -14.342 9.137 1.00 0.00 C ATOM 1345 C GLU A 84 4.421 -12.979 9.714 1.00 0.00 C ATOM 1346 O GLU A 84 3.549 -12.289 9.188 1.00 0.00 O ATOM 1347 CB GLU A 84 4.196 -15.455 10.001 1.00 0.00 C ATOM 1348 CG GLU A 84 2.706 -15.296 10.253 1.00 0.00 C ATOM 1349 CD GLU A 84 2.259 -15.953 11.545 1.00 0.00 C ATOM 1350 OE1 GLU A 84 1.968 -17.167 11.522 1.00 0.00 O ATOM 1351 OE2 GLU A 84 2.200 -15.253 12.577 1.00 0.00 O ATOM 0 H GLU A 84 6.621 -15.261 9.600 1.00 0.00 H new ATOM 0 HA GLU A 84 4.383 -14.415 8.130 1.00 0.00 H new ATOM 0 HB2 GLU A 84 4.374 -16.415 9.516 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.717 -15.480 10.958 1.00 0.00 H new ATOM 0 HG2 GLU A 84 2.458 -14.235 10.285 1.00 0.00 H new ATOM 0 HG3 GLU A 84 2.152 -15.728 9.420 1.00 0.00 H new ATOM 1358 N GLU A 85 5.088 -12.601 10.800 1.00 0.00 N ATOM 1359 CA GLU A 85 4.826 -11.322 11.449 1.00 0.00 C ATOM 1360 C GLU A 85 4.881 -10.178 10.441 1.00 0.00 C ATOM 1361 O GLU A 85 4.031 -9.288 10.450 1.00 0.00 O ATOM 1362 CB GLU A 85 5.838 -11.077 12.570 1.00 0.00 C ATOM 1363 CG GLU A 85 5.564 -11.888 13.826 1.00 0.00 C ATOM 1364 CD GLU A 85 4.249 -11.518 14.484 1.00 0.00 C ATOM 1365 OE1 GLU A 85 4.034 -10.316 14.745 1.00 0.00 O ATOM 1366 OE2 GLU A 85 3.436 -12.431 14.737 1.00 0.00 O ATOM 0 H GLU A 85 5.813 -13.162 11.248 1.00 0.00 H new ATOM 0 HA GLU A 85 3.824 -11.359 11.875 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.837 -11.315 12.205 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.836 -10.017 12.824 1.00 0.00 H new ATOM 0 HG2 GLU A 85 5.554 -12.948 13.574 1.00 0.00 H new ATOM 0 HG3 GLU A 85 6.377 -11.736 14.536 1.00 0.00 H new ATOM 1373 N GLU A 86 5.887 -10.210 9.573 1.00 0.00 N ATOM 1374 CA GLU A 86 6.054 -9.175 8.559 1.00 0.00 C ATOM 1375 C GLU A 86 4.805 -9.060 7.689 1.00 0.00 C ATOM 1376 O GLU A 86 4.345 -7.958 7.389 1.00 0.00 O ATOM 1377 CB GLU A 86 7.272 -9.479 7.684 1.00 0.00 C ATOM 1378 CG GLU A 86 8.597 -9.150 8.350 1.00 0.00 C ATOM 1379 CD GLU A 86 9.789 -9.460 7.465 1.00 0.00 C ATOM 1380 OE1 GLU A 86 10.195 -10.640 7.409 1.00 0.00 O ATOM 1381 OE2 GLU A 86 10.315 -8.524 6.828 1.00 0.00 O ATOM 0 H GLU A 86 6.598 -10.941 9.551 1.00 0.00 H new ATOM 0 HA GLU A 86 6.210 -8.224 9.069 1.00 0.00 H new ATOM 0 HB2 GLU A 86 7.262 -10.536 7.416 1.00 0.00 H new ATOM 0 HB3 GLU A 86 7.192 -8.914 6.755 1.00 0.00 H new ATOM 0 HG2 GLU A 86 8.613 -8.093 8.617 1.00 0.00 H new ATOM 0 HG3 GLU A 86 8.682 -9.714 9.279 1.00 0.00 H new ATOM 1388 N ARG A 87 4.264 -10.205 7.287 1.00 0.00 N ATOM 1389 CA ARG A 87 3.070 -10.233 6.450 1.00 0.00 C ATOM 1390 C ARG A 87 1.958 -9.387 7.062 1.00 0.00 C ATOM 1391 O ARG A 87 1.405 -8.504 6.407 1.00 0.00 O ATOM 1392 CB ARG A 87 2.587 -11.672 6.263 1.00 0.00 C ATOM 1393 CG ARG A 87 1.831 -11.897 4.964 1.00 0.00 C ATOM 1394 CD ARG A 87 0.339 -11.655 5.138 1.00 0.00 C ATOM 1395 NE ARG A 87 -0.184 -12.303 6.337 1.00 0.00 N ATOM 1396 CZ ARG A 87 -0.488 -13.595 6.401 1.00 0.00 C ATOM 1397 NH1 ARG A 87 -0.321 -14.372 5.340 1.00 0.00 N ATOM 1398 NH2 ARG A 87 -0.959 -14.112 7.529 1.00 0.00 N ATOM 0 H ARG A 87 4.633 -11.125 7.527 1.00 0.00 H new ATOM 0 HA ARG A 87 3.328 -9.814 5.477 1.00 0.00 H new ATOM 0 HB2 ARG A 87 3.447 -12.342 6.294 1.00 0.00 H new ATOM 0 HB3 ARG A 87 1.943 -11.942 7.100 1.00 0.00 H new ATOM 0 HG2 ARG A 87 2.221 -11.231 4.195 1.00 0.00 H new ATOM 0 HG3 ARG A 87 1.997 -12.917 4.617 1.00 0.00 H new ATOM 0 HD2 ARG A 87 0.150 -10.583 5.193 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -0.193 -12.028 4.263 1.00 0.00 H new ATOM 0 HE ARG A 87 -0.324 -11.733 7.171 1.00 0.00 H new ATOM 0 HH11 ARG A 87 0.042 -13.978 4.472 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -0.555 -15.363 5.392 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -1.088 -13.517 8.348 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -1.192 -15.104 7.577 1.00 0.00 H new ATOM 1412 N ASN A 88 1.634 -9.664 8.320 1.00 0.00 N ATOM 1413 CA ASN A 88 0.587 -8.929 9.020 1.00 0.00 C ATOM 1414 C ASN A 88 0.981 -7.467 9.208 1.00 0.00 C ATOM 1415 O ASN A 88 0.178 -6.562 8.975 1.00 0.00 O ATOM 1416 CB ASN A 88 0.305 -9.571 10.380 1.00 0.00 C ATOM 1417 CG ASN A 88 1.247 -9.075 11.460 1.00 0.00 C ATOM 1418 OD1 ASN A 88 1.256 -7.891 11.796 1.00 0.00 O ATOM 1419 ND2 ASN A 88 2.047 -9.982 12.009 1.00 0.00 N ATOM 0 H ASN A 88 2.082 -10.393 8.876 1.00 0.00 H new ATOM 0 HA ASN A 88 -0.317 -8.968 8.413 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -0.723 -9.358 10.673 1.00 0.00 H new ATOM 0 HB3 ASN A 88 0.394 -10.654 10.293 1.00 0.00 H new ATOM 0 HD21 ASN A 88 2.703 -9.708 12.740 1.00 0.00 H new ATOM 0 HD22 ASN A 88 2.005 -10.953 11.699 1.00 0.00 H new ATOM 1426 N ASP A 89 2.220 -7.243 9.629 1.00 0.00 N ATOM 1427 CA ASP A 89 2.722 -5.891 9.846 1.00 0.00 C ATOM 1428 C ASP A 89 2.510 -5.027 8.607 1.00 0.00 C ATOM 1429 O ASP A 89 1.841 -3.996 8.665 1.00 0.00 O ATOM 1430 CB ASP A 89 4.207 -5.928 10.210 1.00 0.00 C ATOM 1431 CG ASP A 89 4.701 -4.604 10.760 1.00 0.00 C ATOM 1432 OD1 ASP A 89 4.541 -4.369 11.976 1.00 0.00 O ATOM 1433 OD2 ASP A 89 5.249 -3.803 9.974 1.00 0.00 O ATOM 0 H ASP A 89 2.896 -7.980 9.827 1.00 0.00 H new ATOM 0 HA ASP A 89 2.164 -5.451 10.673 1.00 0.00 H new ATOM 0 HB2 ASP A 89 4.378 -6.711 10.948 1.00 0.00 H new ATOM 0 HB3 ASP A 89 4.788 -6.191 9.326 1.00 0.00 H new ATOM 1438 N TRP A 90 3.086 -5.455 7.489 1.00 0.00 N ATOM 1439 CA TRP A 90 2.961 -4.719 6.236 1.00 0.00 C ATOM 1440 C TRP A 90 1.513 -4.314 5.985 1.00 0.00 C ATOM 1441 O TRP A 90 1.183 -3.128 5.981 1.00 0.00 O ATOM 1442 CB TRP A 90 3.476 -5.566 5.071 1.00 0.00 C ATOM 1443 CG TRP A 90 4.958 -5.467 4.874 1.00 0.00 C ATOM 1444 CD1 TRP A 90 5.886 -6.436 5.131 1.00 0.00 C ATOM 1445 CD2 TRP A 90 5.684 -4.335 4.381 1.00 0.00 C ATOM 1446 NE1 TRP A 90 7.144 -5.975 4.828 1.00 0.00 N ATOM 1447 CE2 TRP A 90 7.047 -4.689 4.365 1.00 0.00 C ATOM 1448 CE3 TRP A 90 5.315 -3.058 3.950 1.00 0.00 C ATOM 1449 CZ2 TRP A 90 8.039 -3.811 3.936 1.00 0.00 C ATOM 1450 CZ3 TRP A 90 6.300 -2.188 3.525 1.00 0.00 C ATOM 1451 CH2 TRP A 90 7.649 -2.568 3.519 1.00 0.00 C ATOM 0 H TRP A 90 3.643 -6.307 7.425 1.00 0.00 H new ATOM 0 HA TRP A 90 3.563 -3.814 6.313 1.00 0.00 H new ATOM 0 HB2 TRP A 90 3.209 -6.609 5.243 1.00 0.00 H new ATOM 0 HB3 TRP A 90 2.973 -5.255 4.155 1.00 0.00 H new ATOM 0 HD1 TRP A 90 5.663 -7.420 5.516 1.00 0.00 H new ATOM 0 HE1 TRP A 90 8.010 -6.504 4.931 1.00 0.00 H new ATOM 0 HE3 TRP A 90 4.278 -2.757 3.949 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 9.079 -4.101 3.933 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 6.026 -1.198 3.192 1.00 0.00 H new ATOM 0 HH2 TRP A 90 8.395 -1.866 3.178 1.00 0.00 H new ATOM 1462 N ILE A 91 0.653 -5.305 5.776 1.00 0.00 N ATOM 1463 CA ILE A 91 -0.760 -5.050 5.525 1.00 0.00 C ATOM 1464 C ILE A 91 -1.336 -4.086 6.557 1.00 0.00 C ATOM 1465 O ILE A 91 -1.803 -2.999 6.214 1.00 0.00 O ATOM 1466 CB ILE A 91 -1.580 -6.354 5.544 1.00 0.00 C ATOM 1467 CG1 ILE A 91 -1.090 -7.306 4.451 1.00 0.00 C ATOM 1468 CG2 ILE A 91 -3.060 -6.051 5.366 1.00 0.00 C ATOM 1469 CD1 ILE A 91 -1.583 -8.725 4.620 1.00 0.00 C ATOM 0 H ILE A 91 0.910 -6.292 5.776 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.828 -4.602 4.534 1.00 0.00 H new ATOM 0 HB ILE A 91 -1.442 -6.839 6.510 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -1.415 -6.930 3.481 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -0.000 -7.307 4.443 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -3.626 -6.982 5.382 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -3.399 -5.406 6.177 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -3.216 -5.547 4.412 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -1.197 -9.343 3.810 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -1.236 -9.120 5.575 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -2.673 -8.737 4.597 1.00 0.00 H new ATOM 1481 N SER A 92 -1.298 -4.490 7.823 1.00 0.00 N ATOM 1482 CA SER A 92 -1.818 -3.663 8.905 1.00 0.00 C ATOM 1483 C SER A 92 -1.497 -2.191 8.667 1.00 0.00 C ATOM 1484 O SER A 92 -2.341 -1.319 8.872 1.00 0.00 O ATOM 1485 CB SER A 92 -1.234 -4.114 10.246 1.00 0.00 C ATOM 1486 OG SER A 92 -1.521 -5.479 10.494 1.00 0.00 O ATOM 0 H SER A 92 -0.912 -5.385 8.124 1.00 0.00 H new ATOM 0 HA SER A 92 -2.901 -3.781 8.930 1.00 0.00 H new ATOM 0 HB2 SER A 92 -0.155 -3.960 10.246 1.00 0.00 H new ATOM 0 HB3 SER A 92 -1.644 -3.501 11.049 1.00 0.00 H new ATOM 0 HG SER A 92 -0.754 -6.028 10.229 1.00 0.00 H new ATOM 1492 N ILE A 93 -0.270 -1.923 8.232 1.00 0.00 N ATOM 1493 CA ILE A 93 0.163 -0.557 7.964 1.00 0.00 C ATOM 1494 C ILE A 93 -0.598 0.040 6.786 1.00 0.00 C ATOM 1495 O ILE A 93 -0.967 1.215 6.802 1.00 0.00 O ATOM 1496 CB ILE A 93 1.674 -0.493 7.671 1.00 0.00 C ATOM 1497 CG1 ILE A 93 2.474 -0.899 8.910 1.00 0.00 C ATOM 1498 CG2 ILE A 93 2.066 0.904 7.215 1.00 0.00 C ATOM 1499 CD1 ILE A 93 3.968 -0.946 8.676 1.00 0.00 C ATOM 0 H ILE A 93 0.441 -2.633 8.058 1.00 0.00 H new ATOM 0 HA ILE A 93 -0.050 0.023 8.862 1.00 0.00 H new ATOM 0 HB ILE A 93 1.903 -1.194 6.868 1.00 0.00 H new ATOM 0 HG12 ILE A 93 2.263 -0.196 9.716 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.136 -1.879 9.246 1.00 0.00 H new ATOM 0 HG21 ILE A 93 3.136 0.933 7.012 1.00 0.00 H new ATOM 0 HG22 ILE A 93 1.517 1.158 6.308 1.00 0.00 H new ATOM 0 HG23 ILE A 93 1.825 1.623 7.998 1.00 0.00 H new ATOM 0 HD11 ILE A 93 4.471 -1.241 9.597 1.00 0.00 H new ATOM 0 HD12 ILE A 93 4.191 -1.670 7.893 1.00 0.00 H new ATOM 0 HD13 ILE A 93 4.320 0.039 8.370 1.00 0.00 H new ATOM 1511 N LEU A 94 -0.831 -0.777 5.764 1.00 0.00 N ATOM 1512 CA LEU A 94 -1.551 -0.330 4.577 1.00 0.00 C ATOM 1513 C LEU A 94 -3.008 -0.023 4.906 1.00 0.00 C ATOM 1514 O LEU A 94 -3.499 1.074 4.636 1.00 0.00 O ATOM 1515 CB LEU A 94 -1.478 -1.396 3.481 1.00 0.00 C ATOM 1516 CG LEU A 94 -0.074 -1.805 3.036 1.00 0.00 C ATOM 1517 CD1 LEU A 94 -0.129 -3.069 2.191 1.00 0.00 C ATOM 1518 CD2 LEU A 94 0.592 -0.675 2.265 1.00 0.00 C ATOM 0 H LEU A 94 -0.532 -1.752 5.734 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.078 0.585 4.219 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.000 -2.286 3.832 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -2.022 -1.031 2.610 1.00 0.00 H new ATOM 0 HG LEU A 94 0.522 -2.012 3.925 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.880 -3.345 1.883 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.564 -3.879 2.776 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.742 -2.890 1.307 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.591 -0.984 1.956 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -0.003 -0.436 1.383 1.00 0.00 H new ATOM 0 HD23 LEU A 94 0.666 0.206 2.902 1.00 0.00 H new ATOM 1530 N LEU A 95 -3.695 -0.997 5.493 1.00 0.00 N ATOM 1531 CA LEU A 95 -5.096 -0.830 5.863 1.00 0.00 C ATOM 1532 C LEU A 95 -5.282 0.395 6.753 1.00 0.00 C ATOM 1533 O LEU A 95 -6.212 1.178 6.561 1.00 0.00 O ATOM 1534 CB LEU A 95 -5.606 -2.079 6.583 1.00 0.00 C ATOM 1535 CG LEU A 95 -6.031 -3.244 5.687 1.00 0.00 C ATOM 1536 CD1 LEU A 95 -6.417 -4.451 6.528 1.00 0.00 C ATOM 1537 CD2 LEU A 95 -7.185 -2.829 4.786 1.00 0.00 C ATOM 0 H LEU A 95 -3.304 -1.911 5.723 1.00 0.00 H new ATOM 0 HA LEU A 95 -5.672 -0.684 4.949 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -4.824 -2.431 7.256 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -6.456 -1.795 7.203 1.00 0.00 H new ATOM 0 HG LEU A 95 -5.185 -3.521 5.058 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -6.716 -5.270 5.874 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -5.564 -4.762 7.131 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -7.248 -4.188 7.183 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -7.475 -3.670 4.155 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -8.034 -2.525 5.399 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -6.874 -1.994 4.158 1.00 0.00 H new ATOM 1549 N ASN A 96 -4.390 0.556 7.725 1.00 0.00 N ATOM 1550 CA ASN A 96 -4.455 1.687 8.643 1.00 0.00 C ATOM 1551 C ASN A 96 -4.363 3.008 7.886 1.00 0.00 C ATOM 1552 O ASN A 96 -5.079 3.961 8.190 1.00 0.00 O ATOM 1553 CB ASN A 96 -3.330 1.598 9.675 1.00 0.00 C ATOM 1554 CG ASN A 96 -3.660 2.341 10.956 1.00 0.00 C ATOM 1555 OD1 ASN A 96 -4.615 3.115 11.009 1.00 0.00 O ATOM 1556 ND2 ASN A 96 -2.867 2.107 11.996 1.00 0.00 N ATOM 0 H ASN A 96 -3.614 -0.083 7.897 1.00 0.00 H new ATOM 0 HA ASN A 96 -5.415 1.650 9.158 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -3.134 0.551 9.906 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -2.415 2.006 9.247 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -3.039 2.578 12.884 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -2.086 1.457 11.906 1.00 0.00 H new ATOM 1563 N ALA A 97 -3.475 3.056 6.898 1.00 0.00 N ATOM 1564 CA ALA A 97 -3.290 4.259 6.095 1.00 0.00 C ATOM 1565 C ALA A 97 -4.491 4.503 5.187 1.00 0.00 C ATOM 1566 O ALA A 97 -4.930 5.641 5.014 1.00 0.00 O ATOM 1567 CB ALA A 97 -2.016 4.153 5.271 1.00 0.00 C ATOM 0 H ALA A 97 -2.873 2.276 6.635 1.00 0.00 H new ATOM 0 HA ALA A 97 -3.201 5.108 6.773 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -1.891 5.058 4.677 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -1.161 4.035 5.937 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -2.082 3.290 4.608 1.00 0.00 H new ATOM 1573 N LEU A 98 -5.017 3.429 4.609 1.00 0.00 N ATOM 1574 CA LEU A 98 -6.168 3.527 3.717 1.00 0.00 C ATOM 1575 C LEU A 98 -7.328 4.241 4.402 1.00 0.00 C ATOM 1576 O LEU A 98 -7.972 5.109 3.812 1.00 0.00 O ATOM 1577 CB LEU A 98 -6.607 2.133 3.266 1.00 0.00 C ATOM 1578 CG LEU A 98 -5.730 1.462 2.208 1.00 0.00 C ATOM 1579 CD1 LEU A 98 -6.121 0.003 2.037 1.00 0.00 C ATOM 1580 CD2 LEU A 98 -5.832 2.202 0.883 1.00 0.00 C ATOM 0 H LEU A 98 -4.666 2.481 4.742 1.00 0.00 H new ATOM 0 HA LEU A 98 -5.872 4.109 2.844 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.645 1.485 4.142 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -7.623 2.202 2.876 1.00 0.00 H new ATOM 0 HG LEU A 98 -4.694 1.502 2.545 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -5.486 -0.458 1.280 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.995 -0.521 2.984 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -7.163 -0.060 1.724 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -5.201 1.710 0.142 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -6.867 2.195 0.541 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -5.501 3.232 1.015 1.00 0.00 H new ATOM 1592 N LYS A 99 -7.589 3.873 5.652 1.00 0.00 N ATOM 1593 CA LYS A 99 -8.669 4.480 6.420 1.00 0.00 C ATOM 1594 C LYS A 99 -8.626 6.001 6.311 1.00 0.00 C ATOM 1595 O LYS A 99 -9.649 6.672 6.445 1.00 0.00 O ATOM 1596 CB LYS A 99 -8.578 4.059 7.888 1.00 0.00 C ATOM 1597 CG LYS A 99 -8.811 2.575 8.112 1.00 0.00 C ATOM 1598 CD LYS A 99 -8.347 2.140 9.492 1.00 0.00 C ATOM 1599 CE LYS A 99 -9.428 2.364 10.539 1.00 0.00 C ATOM 1600 NZ LYS A 99 -9.423 3.762 11.050 1.00 0.00 N ATOM 0 H LYS A 99 -7.066 3.156 6.155 1.00 0.00 H new ATOM 0 HA LYS A 99 -9.616 4.131 6.007 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -7.594 4.326 8.273 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -9.310 4.624 8.465 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -9.871 2.351 7.996 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -8.279 2.003 7.351 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -8.074 1.085 9.469 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -7.451 2.696 9.768 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -10.403 2.138 10.108 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -9.279 1.673 11.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -9.643 3.761 12.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -8.484 4.183 10.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -10.138 4.320 10.541 1.00 0.00 H new ATOM 1614 N SER A 100 -7.434 6.538 6.068 1.00 0.00 N ATOM 1615 CA SER A 100 -7.257 7.980 5.944 1.00 0.00 C ATOM 1616 C SER A 100 -7.813 8.484 4.615 1.00 0.00 C ATOM 1617 O SER A 100 -8.604 9.425 4.579 1.00 0.00 O ATOM 1618 CB SER A 100 -5.776 8.346 6.063 1.00 0.00 C ATOM 1619 OG SER A 100 -5.614 9.667 6.549 1.00 0.00 O ATOM 0 H SER A 100 -6.577 5.996 5.953 1.00 0.00 H new ATOM 0 HA SER A 100 -7.808 8.459 6.753 1.00 0.00 H new ATOM 0 HB2 SER A 100 -5.278 7.645 6.733 1.00 0.00 H new ATOM 0 HB3 SER A 100 -5.296 8.252 5.089 1.00 0.00 H new ATOM 0 HG SER A 100 -4.659 9.876 6.617 1.00 0.00 H new ATOM 1625 N GLN A 101 -7.391 7.849 3.527 1.00 0.00 N ATOM 1626 CA GLN A 101 -7.845 8.233 2.195 1.00 0.00 C ATOM 1627 C GLN A 101 -9.291 7.805 1.969 1.00 0.00 C ATOM 1628 O GLN A 101 -9.877 8.091 0.925 1.00 0.00 O ATOM 1629 CB GLN A 101 -6.943 7.611 1.127 1.00 0.00 C ATOM 1630 CG GLN A 101 -7.185 6.124 0.918 1.00 0.00 C ATOM 1631 CD GLN A 101 -6.371 5.557 -0.229 1.00 0.00 C ATOM 1632 OE1 GLN A 101 -5.384 6.154 -0.660 1.00 0.00 O ATOM 1633 NE2 GLN A 101 -6.782 4.397 -0.729 1.00 0.00 N ATOM 0 H GLN A 101 -6.736 7.067 3.541 1.00 0.00 H new ATOM 0 HA GLN A 101 -7.791 9.319 2.119 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -7.099 8.132 0.183 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -5.901 7.765 1.408 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -6.938 5.587 1.834 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -8.244 5.956 0.725 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -7.606 3.937 -0.341 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -6.274 3.966 -1.501 1.00 0.00 H new ATOM 1642 N SER A 102 -9.861 7.118 2.954 1.00 0.00 N ATOM 1643 CA SER A 102 -11.237 6.647 2.860 1.00 0.00 C ATOM 1644 C SER A 102 -12.202 7.668 3.455 1.00 0.00 C ATOM 1645 O SER A 102 -12.459 7.669 4.660 1.00 0.00 O ATOM 1646 CB SER A 102 -11.390 5.305 3.580 1.00 0.00 C ATOM 1647 OG SER A 102 -10.946 4.235 2.763 1.00 0.00 O ATOM 0 H SER A 102 -9.391 6.875 3.826 1.00 0.00 H new ATOM 0 HA SER A 102 -11.478 6.515 1.805 1.00 0.00 H new ATOM 0 HB2 SER A 102 -10.819 5.319 4.508 1.00 0.00 H new ATOM 0 HB3 SER A 102 -12.435 5.151 3.851 1.00 0.00 H new ATOM 0 HG SER A 102 -11.052 3.389 3.246 1.00 0.00 H new ATOM 1653 N LEU A 103 -12.735 8.536 2.602 1.00 0.00 N ATOM 1654 CA LEU A 103 -13.672 9.564 3.042 1.00 0.00 C ATOM 1655 C LEU A 103 -14.824 9.709 2.052 1.00 0.00 C ATOM 1656 O LEU A 103 -14.788 9.153 0.954 1.00 0.00 O ATOM 1657 CB LEU A 103 -12.952 10.903 3.204 1.00 0.00 C ATOM 1658 CG LEU A 103 -11.947 10.990 4.353 1.00 0.00 C ATOM 1659 CD1 LEU A 103 -10.964 12.127 4.118 1.00 0.00 C ATOM 1660 CD2 LEU A 103 -12.669 11.172 5.680 1.00 0.00 C ATOM 0 H LEU A 103 -12.534 8.548 1.602 1.00 0.00 H new ATOM 0 HA LEU A 103 -14.081 9.260 4.006 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -12.430 11.127 2.274 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -13.702 11.681 3.344 1.00 0.00 H new ATOM 0 HG LEU A 103 -11.387 10.056 4.392 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -10.257 12.173 4.946 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -10.423 11.954 3.188 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -11.507 13.070 4.052 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -11.938 11.232 6.487 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -13.255 12.091 5.652 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -13.332 10.324 5.853 1.00 0.00 H new ATOM 1672 N THR A 104 -15.846 10.462 2.447 1.00 0.00 N ATOM 1673 CA THR A 104 -17.007 10.682 1.595 1.00 0.00 C ATOM 1674 C THR A 104 -17.284 9.467 0.718 1.00 0.00 C ATOM 1675 O THR A 104 -17.601 9.601 -0.463 1.00 0.00 O ATOM 1676 CB THR A 104 -16.818 11.918 0.696 1.00 0.00 C ATOM 1677 OG1 THR A 104 -18.060 12.266 0.074 1.00 0.00 O ATOM 1678 CG2 THR A 104 -15.767 11.654 -0.372 1.00 0.00 C ATOM 0 H THR A 104 -15.893 10.930 3.352 1.00 0.00 H new ATOM 0 HA THR A 104 -17.857 10.850 2.257 1.00 0.00 H new ATOM 0 HB THR A 104 -16.480 12.746 1.320 1.00 0.00 H new ATOM 0 HG1 THR A 104 -18.413 11.489 -0.408 1.00 0.00 H new ATOM 0 HG21 THR A 104 -15.651 12.541 -0.995 1.00 0.00 H new ATOM 0 HG22 THR A 104 -14.816 11.418 0.104 1.00 0.00 H new ATOM 0 HG23 THR A 104 -16.081 10.814 -0.992 1.00 0.00 H new ATOM 1686 N SER A 105 -17.163 8.280 1.304 1.00 0.00 N ATOM 1687 CA SER A 105 -17.397 7.039 0.575 1.00 0.00 C ATOM 1688 C SER A 105 -18.793 6.494 0.864 1.00 0.00 C ATOM 1689 O SER A 105 -19.507 7.014 1.720 1.00 0.00 O ATOM 1690 CB SER A 105 -16.342 5.996 0.948 1.00 0.00 C ATOM 1691 OG SER A 105 -16.101 5.107 -0.129 1.00 0.00 O ATOM 0 H SER A 105 -16.904 8.152 2.282 1.00 0.00 H new ATOM 0 HA SER A 105 -17.323 7.254 -0.491 1.00 0.00 H new ATOM 0 HB2 SER A 105 -15.414 6.496 1.226 1.00 0.00 H new ATOM 0 HB3 SER A 105 -16.675 5.434 1.821 1.00 0.00 H new ATOM 0 HG SER A 105 -15.422 4.451 0.134 1.00 0.00 H new ATOM 1697 N GLN A 106 -19.172 5.445 0.142 1.00 0.00 N ATOM 1698 CA GLN A 106 -20.482 4.829 0.320 1.00 0.00 C ATOM 1699 C GLN A 106 -20.483 3.890 1.522 1.00 0.00 C ATOM 1700 O GLN A 106 -20.796 2.706 1.396 1.00 0.00 O ATOM 1701 CB GLN A 106 -20.885 4.064 -0.941 1.00 0.00 C ATOM 1702 CG GLN A 106 -21.134 4.960 -2.143 1.00 0.00 C ATOM 1703 CD GLN A 106 -21.535 4.180 -3.380 1.00 0.00 C ATOM 1704 OE1 GLN A 106 -21.001 3.103 -3.648 1.00 0.00 O ATOM 1705 NE2 GLN A 106 -22.479 4.720 -4.142 1.00 0.00 N ATOM 0 H GLN A 106 -18.591 5.004 -0.571 1.00 0.00 H new ATOM 0 HA GLN A 106 -21.207 5.622 0.502 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -20.101 3.349 -1.188 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -21.787 3.489 -0.734 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -21.918 5.677 -1.900 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -20.232 5.534 -2.357 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -22.894 5.615 -3.882 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -22.789 4.240 -4.987 1.00 0.00 H new ATOM 1714 N SER A 107 -20.131 4.426 2.686 1.00 0.00 N ATOM 1715 CA SER A 107 -20.088 3.634 3.910 1.00 0.00 C ATOM 1716 C SER A 107 -19.930 4.533 5.133 1.00 0.00 C ATOM 1717 O SER A 107 -19.533 5.692 5.017 1.00 0.00 O ATOM 1718 CB SER A 107 -18.937 2.628 3.851 1.00 0.00 C ATOM 1719 OG SER A 107 -19.211 1.492 4.652 1.00 0.00 O ATOM 0 H SER A 107 -19.872 5.405 2.808 1.00 0.00 H new ATOM 0 HA SER A 107 -21.030 3.093 3.997 1.00 0.00 H new ATOM 0 HB2 SER A 107 -18.773 2.318 2.819 1.00 0.00 H new ATOM 0 HB3 SER A 107 -18.017 3.103 4.191 1.00 0.00 H new ATOM 0 HG SER A 107 -18.461 0.864 4.596 1.00 0.00 H new ATOM 1725 N GLN A 108 -20.245 3.989 6.304 1.00 0.00 N ATOM 1726 CA GLN A 108 -20.140 4.741 7.548 1.00 0.00 C ATOM 1727 C GLN A 108 -18.933 4.282 8.361 1.00 0.00 C ATOM 1728 O GLN A 108 -19.027 3.349 9.157 1.00 0.00 O ATOM 1729 CB GLN A 108 -21.416 4.581 8.375 1.00 0.00 C ATOM 1730 CG GLN A 108 -21.487 5.516 9.572 1.00 0.00 C ATOM 1731 CD GLN A 108 -22.840 5.487 10.256 1.00 0.00 C ATOM 1732 OE1 GLN A 108 -23.776 4.844 9.780 1.00 0.00 O ATOM 1733 NE2 GLN A 108 -22.950 6.184 11.381 1.00 0.00 N ATOM 0 H GLN A 108 -20.575 3.030 6.417 1.00 0.00 H new ATOM 0 HA GLN A 108 -20.008 5.793 7.297 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -22.279 4.759 7.734 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -21.486 3.551 8.725 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -20.715 5.240 10.290 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -21.270 6.534 9.247 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -22.148 6.703 11.740 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -23.836 6.201 11.886 1.00 0.00 H new ATOM 1742 N ALA A 109 -17.800 4.946 8.154 1.00 0.00 N ATOM 1743 CA ALA A 109 -16.575 4.607 8.868 1.00 0.00 C ATOM 1744 C ALA A 109 -15.916 5.854 9.449 1.00 0.00 C ATOM 1745 O ALA A 109 -15.087 6.489 8.798 1.00 0.00 O ATOM 1746 CB ALA A 109 -15.610 3.879 7.945 1.00 0.00 C ATOM 0 H ALA A 109 -17.705 5.721 7.498 1.00 0.00 H new ATOM 0 HA ALA A 109 -16.836 3.947 9.695 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -14.700 3.632 8.492 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -16.075 2.962 7.582 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -15.362 4.520 7.099 1.00 0.00 H new ATOM 1752 N SER A 110 -16.291 6.198 10.677 1.00 0.00 N ATOM 1753 CA SER A 110 -15.739 7.372 11.343 1.00 0.00 C ATOM 1754 C SER A 110 -14.246 7.198 11.602 1.00 0.00 C ATOM 1755 O SER A 110 -13.824 6.244 12.254 1.00 0.00 O ATOM 1756 CB SER A 110 -16.470 7.626 12.663 1.00 0.00 C ATOM 1757 OG SER A 110 -17.712 8.271 12.441 1.00 0.00 O ATOM 0 H SER A 110 -16.974 5.681 11.230 1.00 0.00 H new ATOM 0 HA SER A 110 -15.879 8.231 10.686 1.00 0.00 H new ATOM 0 HB2 SER A 110 -16.635 6.680 13.179 1.00 0.00 H new ATOM 0 HB3 SER A 110 -15.849 8.241 13.314 1.00 0.00 H new ATOM 0 HG SER A 110 -18.161 8.421 13.299 1.00 0.00 H new ATOM 1763 N GLY A 111 -13.449 8.129 11.084 1.00 0.00 N ATOM 1764 CA GLY A 111 -12.011 8.061 11.269 1.00 0.00 C ATOM 1765 C GLY A 111 -11.506 9.085 12.265 1.00 0.00 C ATOM 1766 O GLY A 111 -12.029 10.196 12.365 1.00 0.00 O ATOM 0 H GLY A 111 -13.774 8.928 10.540 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -11.738 7.062 11.610 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -11.517 8.217 10.310 1.00 0.00 H new ATOM 1770 N PRO A 112 -10.466 8.714 13.026 1.00 0.00 N ATOM 1771 CA PRO A 112 -9.867 9.595 14.034 1.00 0.00 C ATOM 1772 C PRO A 112 -9.118 10.766 13.408 1.00 0.00 C ATOM 1773 O PRO A 112 -8.561 10.647 12.317 1.00 0.00 O ATOM 1774 CB PRO A 112 -8.896 8.674 14.777 1.00 0.00 C ATOM 1775 CG PRO A 112 -8.558 7.607 13.795 1.00 0.00 C ATOM 1776 CD PRO A 112 -9.793 7.406 12.960 1.00 0.00 C ATOM 0 HA PRO A 112 -10.620 10.051 14.677 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -8.005 9.214 15.097 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -9.354 8.256 15.673 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -7.711 7.901 13.175 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -8.276 6.685 14.303 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -9.545 7.133 11.934 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -10.422 6.610 13.358 1.00 0.00 H new ATOM 1784 N SER A 113 -9.106 11.897 14.107 1.00 0.00 N ATOM 1785 CA SER A 113 -8.428 13.091 13.618 1.00 0.00 C ATOM 1786 C SER A 113 -6.913 12.930 13.709 1.00 0.00 C ATOM 1787 O SER A 113 -6.329 13.041 14.787 1.00 0.00 O ATOM 1788 CB SER A 113 -8.870 14.318 14.417 1.00 0.00 C ATOM 1789 OG SER A 113 -8.651 14.130 15.804 1.00 0.00 O ATOM 0 H SER A 113 -9.558 12.011 15.014 1.00 0.00 H new ATOM 0 HA SER A 113 -8.700 13.231 12.572 1.00 0.00 H new ATOM 0 HB2 SER A 113 -8.321 15.195 14.075 1.00 0.00 H new ATOM 0 HB3 SER A 113 -9.927 14.512 14.236 1.00 0.00 H new ATOM 0 HG SER A 113 -7.800 13.664 15.941 1.00 0.00 H new ATOM 1795 N SER A 114 -6.283 12.669 12.568 1.00 0.00 N ATOM 1796 CA SER A 114 -4.836 12.489 12.518 1.00 0.00 C ATOM 1797 C SER A 114 -4.183 13.571 11.664 1.00 0.00 C ATOM 1798 O SER A 114 -3.209 14.199 12.076 1.00 0.00 O ATOM 1799 CB SER A 114 -4.492 11.106 11.960 1.00 0.00 C ATOM 1800 OG SER A 114 -4.632 10.106 12.954 1.00 0.00 O ATOM 0 H SER A 114 -6.751 12.577 11.666 1.00 0.00 H new ATOM 0 HA SER A 114 -4.449 12.570 13.534 1.00 0.00 H new ATOM 0 HB2 SER A 114 -5.144 10.878 11.116 1.00 0.00 H new ATOM 0 HB3 SER A 114 -3.470 11.107 11.582 1.00 0.00 H new ATOM 0 HG SER A 114 -4.408 9.232 12.572 1.00 0.00 H new ATOM 1806 N GLY A 115 -4.730 13.785 10.471 1.00 0.00 N ATOM 1807 CA GLY A 115 -4.188 14.791 9.577 1.00 0.00 C ATOM 1808 C GLY A 115 -4.415 14.453 8.117 1.00 0.00 C ATOM 1809 O GLY A 115 -3.462 14.252 7.364 1.00 0.00 O ATOM 0 H GLY A 115 -5.538 13.280 10.108 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -4.646 15.755 9.799 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -3.119 14.897 9.760 1.00 0.00 H new TER 1813 GLY A 115