USER MOD reduce.3.24.130724 H: found=0, std=0, add=1594, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1586 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: B 31 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 70 GLN :FLIP amide:sc= -3.63! C(o=-5.7!,f=-3.6!) USER MOD Set 2.1: B 39 MET CE :methyl 139:sc= -7.35! (180deg=-12!) USER MOD Set 2.2: B 59 MET CE :methyl -150:sc= -20.5! (180deg=-23.1!) USER MOD Set 3.1: B 18 GLN :FLIP amide:sc= 0.679 F(o=-1.3,f=1.8) USER MOD Set 3.2: B 27 SER OG : rot 106:sc= 1.11 USER MOD Set 4.1: A 74 GLN : amide:sc= -7.02! C(o=-14!,f=-14!) USER MOD Set 4.2: B 74 GLN : amide:sc= -7! C(o=-14!,f=-14!) USER MOD Set 5.1: A 39 MET CE :methyl 140:sc= -7.29! (180deg=-11.8!) USER MOD Set 5.2: A 59 MET CE :methyl -144:sc= -20.6! (180deg=-23.6!) USER MOD Set 6.1: A 31 SER OG : rot 180:sc= 0 USER MOD Set 6.2: A 70 GLN :FLIP amide:sc= -3.64! C(o=-5.7!,f=-3.6!) USER MOD Set 7.1: A 18 GLN :FLIP amide:sc= 0.649 F(o=-1.2,f=1.8) USER MOD Set 7.2: A 27 SER OG : rot 112:sc= 1.13 USER MOD Set 8.1: A 12 SER OG : rot 61:sc= -0.273 USER MOD Set 8.2: B 12 SER OG : rot 60:sc= -0.28 USER MOD Single : A 1 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot -146:sc= -0.0415 USER MOD Single : A 6 THR OG1 : rot -138:sc= -1 USER MOD Single : A 9 CYS SG : rot 63:sc= -1.1 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 TYR OH : rot 30:sc= -0.397 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= -0.33 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= -0.0432 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -1.66 X(o=-1.7,f=-1.7) USER MOD Single : A 41 THR OG1 : rot -75:sc= 1.16 USER MOD Single : A 47 THR OG1 : rot -43:sc= 1.03 USER MOD Single : A 48 LYS NZ :NH3+ 165:sc= -0.0272 (180deg=-0.214) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 GLN : amide:sc= -1.05 X(o=-1,f=-1) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl -157:sc= -10.3! (180deg=-11.5!) USER MOD Single : A 61 LYS NZ :NH3+ -147:sc= -0.149 (180deg=-0.533) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -0.132 X(o=-0.13,f=-0.015) USER MOD Single : A 87 CYS SG : rot 180:sc= -0.132 USER MOD Single : A 88 HIS : no HD1:sc= -6.52! C(o=-6.5!,f=-9.2!) USER MOD Single : A 90 SER OG : rot -140:sc= -1.63 USER MOD Single : A 93 LYS NZ :NH3+ 174:sc= 0.11 (180deg=0.105) USER MOD Single : A 98 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 SER OG : rot 180:sc= 0 USER MOD Single : B 4 THR OG1 : rot -147:sc= -0.0297 USER MOD Single : B 6 THR OG1 : rot -146:sc= -0.962! USER MOD Single : B 9 CYS SG : rot 50:sc= -1.03 USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 20 TYR OH : rot 30:sc= -0.413 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 29 THR OG1 : rot 180:sc= -0.339 USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 THR OG1 : rot 180:sc= -0.0425 USER MOD Single : B 37 SER OG : rot 180:sc= 0 USER MOD Single : B 40 ASN : amide:sc= -1.67 X(o=-1.7,f=-1.6) USER MOD Single : B 41 THR OG1 : rot -74:sc= 1.15 USER MOD Single : B 47 THR OG1 : rot -44:sc= 1.07 USER MOD Single : B 48 LYS NZ :NH3+ 165:sc= -0.0152 (180deg=-0.207) USER MOD Single : B 49 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 50 GLN : amide:sc= -1.01 X(o=-1,f=-0.93) USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 MET CE :methyl -158:sc= -10.3! (180deg=-11.2!) USER MOD Single : B 61 LYS NZ :NH3+ -166:sc= -0.0852 (180deg=-0.414) USER MOD Single : B 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 67 SER OG : rot 180:sc= 0 USER MOD Single : B 78 ASN : amide:sc= -0.144 X(o=-0.14,f=-0.029) USER MOD Single : B 87 CYS SG : rot -131:sc= -0.118 USER MOD Single : B 88 HIS : no HD1:sc= -6.4! C(o=-6.4!,f=-9.2!) USER MOD Single : B 90 SER OG : rot -148:sc= -1.65 USER MOD Single : B 93 LYS NZ :NH3+ 174:sc= 0.114 (180deg=0.108) USER MOD Single : B 98 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : B 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 5.819 -11.359 19.630 1.00 0.00 N ATOM 2 CA SER A 1 4.703 -10.379 19.541 1.00 0.00 C ATOM 3 C SER A 1 5.225 -8.946 19.550 1.00 0.00 C ATOM 4 O SER A 1 6.256 -8.654 20.158 1.00 0.00 O ATOM 5 CB SER A 1 3.760 -10.607 20.724 1.00 0.00 C ATOM 6 OG SER A 1 2.411 -10.388 20.351 1.00 0.00 O ATOM 0 H1 SER A 1 5.434 -12.325 19.622 1.00 0.00 H new ATOM 0 H2 SER A 1 6.457 -11.233 18.818 1.00 0.00 H new ATOM 0 H3 SER A 1 6.347 -11.204 20.512 1.00 0.00 H new ATOM 0 HA SER A 1 4.170 -10.527 18.602 1.00 0.00 H new ATOM 0 HB2 SER A 1 3.877 -11.625 21.095 1.00 0.00 H new ATOM 0 HB3 SER A 1 4.028 -9.937 21.541 1.00 0.00 H new ATOM 0 HG SER A 1 1.829 -10.542 21.124 1.00 0.00 H new ATOM 14 N ARG A 2 4.507 -8.056 18.873 1.00 0.00 N ATOM 15 CA ARG A 2 4.896 -6.652 18.801 1.00 0.00 C ATOM 16 C ARG A 2 6.286 -6.500 18.186 1.00 0.00 C ATOM 17 O ARG A 2 7.223 -6.049 18.846 1.00 0.00 O ATOM 18 CB ARG A 2 4.869 -6.023 20.197 1.00 0.00 C ATOM 19 CG ARG A 2 3.503 -5.489 20.596 1.00 0.00 C ATOM 20 CD ARG A 2 3.119 -4.270 19.773 1.00 0.00 C ATOM 21 NE ARG A 2 2.334 -4.631 18.595 1.00 0.00 N ATOM 22 CZ ARG A 2 1.038 -4.936 18.633 1.00 0.00 C ATOM 23 NH1 ARG A 2 0.380 -4.925 19.785 1.00 0.00 N ATOM 24 NH2 ARG A 2 0.400 -5.253 17.514 1.00 0.00 N ATOM 0 H ARG A 2 3.652 -8.282 18.366 1.00 0.00 H new ATOM 0 HA ARG A 2 4.180 -6.135 18.162 1.00 0.00 H new ATOM 0 HB2 ARG A 2 5.187 -6.766 20.928 1.00 0.00 H new ATOM 0 HB3 ARG A 2 5.593 -5.209 20.234 1.00 0.00 H new ATOM 0 HG2 ARG A 2 2.753 -6.269 20.464 1.00 0.00 H new ATOM 0 HG3 ARG A 2 3.508 -5.228 21.654 1.00 0.00 H new ATOM 0 HD2 ARG A 2 2.547 -3.580 20.393 1.00 0.00 H new ATOM 0 HD3 ARG A 2 4.021 -3.745 19.460 1.00 0.00 H new ATOM 0 HE ARG A 2 2.806 -4.651 17.691 1.00 0.00 H new ATOM 0 HH11 ARG A 2 0.867 -4.682 20.648 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -0.612 -5.159 19.808 1.00 0.00 H new ATOM 0 HH21 ARG A 2 0.902 -5.263 16.626 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -0.592 -5.487 17.542 1.00 0.00 H new ATOM 37 N PRO A 3 6.440 -6.879 16.904 1.00 0.00 N ATOM 38 CA PRO A 3 7.722 -6.790 16.191 1.00 0.00 C ATOM 39 C PRO A 3 8.191 -5.337 16.031 1.00 0.00 C ATOM 40 O PRO A 3 8.276 -4.602 17.014 1.00 0.00 O ATOM 41 CB PRO A 3 7.405 -7.449 14.833 1.00 0.00 C ATOM 42 CG PRO A 3 6.190 -8.262 15.089 1.00 0.00 C ATOM 43 CD PRO A 3 5.391 -7.430 16.035 1.00 0.00 C ATOM 0 HA PRO A 3 8.541 -7.276 16.721 1.00 0.00 H new ATOM 0 HB2 PRO A 3 7.226 -6.701 14.061 1.00 0.00 H new ATOM 0 HB3 PRO A 3 8.233 -8.070 14.490 1.00 0.00 H new ATOM 0 HG2 PRO A 3 5.640 -8.459 14.169 1.00 0.00 H new ATOM 0 HG3 PRO A 3 6.442 -9.230 15.523 1.00 0.00 H new ATOM 0 HD2 PRO A 3 4.832 -6.648 15.521 1.00 0.00 H new ATOM 0 HD3 PRO A 3 4.668 -8.025 16.593 1.00 0.00 H new ATOM 51 N THR A 4 8.498 -4.922 14.801 1.00 0.00 N ATOM 52 CA THR A 4 8.956 -3.560 14.546 1.00 0.00 C ATOM 53 C THR A 4 7.806 -2.662 14.125 1.00 0.00 C ATOM 54 O THR A 4 6.775 -3.120 13.635 1.00 0.00 O ATOM 55 CB THR A 4 10.063 -3.548 13.487 1.00 0.00 C ATOM 56 OG1 THR A 4 10.524 -2.228 13.263 1.00 0.00 O ATOM 57 CG2 THR A 4 9.638 -4.115 12.148 1.00 0.00 C ATOM 0 H THR A 4 8.437 -5.509 13.969 1.00 0.00 H new ATOM 0 HA THR A 4 9.365 -3.168 15.477 1.00 0.00 H new ATOM 0 HB THR A 4 10.848 -4.185 13.894 1.00 0.00 H new ATOM 0 HG1 THR A 4 10.773 -2.124 12.321 1.00 0.00 H new ATOM 0 HG21 THR A 4 10.476 -4.072 11.452 1.00 0.00 H new ATOM 0 HG22 THR A 4 9.324 -5.151 12.275 1.00 0.00 H new ATOM 0 HG23 THR A 4 8.807 -3.530 11.752 1.00 0.00 H new ATOM 65 N GLU A 5 8.004 -1.373 14.338 1.00 0.00 N ATOM 66 CA GLU A 5 7.012 -0.364 14.009 1.00 0.00 C ATOM 67 C GLU A 5 6.402 -0.595 12.628 1.00 0.00 C ATOM 68 O GLU A 5 5.181 -0.569 12.470 1.00 0.00 O ATOM 69 CB GLU A 5 7.675 1.003 14.080 1.00 0.00 C ATOM 70 CG GLU A 5 6.807 2.075 14.718 1.00 0.00 C ATOM 71 CD GLU A 5 6.064 2.910 13.693 1.00 0.00 C ATOM 72 OE1 GLU A 5 6.669 3.254 12.656 1.00 0.00 O ATOM 73 OE2 GLU A 5 4.876 3.219 13.927 1.00 0.00 O ATOM 0 H GLU A 5 8.860 -0.995 14.745 1.00 0.00 H new ATOM 0 HA GLU A 5 6.194 -0.424 14.727 1.00 0.00 H new ATOM 0 HB2 GLU A 5 8.603 0.917 14.645 1.00 0.00 H new ATOM 0 HB3 GLU A 5 7.943 1.319 13.072 1.00 0.00 H new ATOM 0 HG2 GLU A 5 6.088 1.604 15.388 1.00 0.00 H new ATOM 0 HG3 GLU A 5 7.431 2.727 15.329 1.00 0.00 H new ATOM 80 N THR A 6 7.251 -0.826 11.633 1.00 0.00 N ATOM 81 CA THR A 6 6.780 -1.065 10.277 1.00 0.00 C ATOM 82 C THR A 6 6.022 -2.383 10.194 1.00 0.00 C ATOM 83 O THR A 6 5.058 -2.503 9.440 1.00 0.00 O ATOM 84 CB THR A 6 7.954 -1.075 9.298 1.00 0.00 C ATOM 85 OG1 THR A 6 8.773 0.063 9.490 1.00 0.00 O ATOM 86 CG2 THR A 6 7.520 -1.088 7.849 1.00 0.00 C ATOM 0 H THR A 6 8.265 -0.853 11.741 1.00 0.00 H new ATOM 0 HA THR A 6 6.101 -0.256 10.006 1.00 0.00 H new ATOM 0 HB THR A 6 8.500 -1.995 9.507 1.00 0.00 H new ATOM 0 HG1 THR A 6 9.043 0.422 8.619 1.00 0.00 H new ATOM 0 HG21 THR A 6 8.400 -1.095 7.206 1.00 0.00 H new ATOM 0 HG22 THR A 6 6.923 -1.979 7.656 1.00 0.00 H new ATOM 0 HG23 THR A 6 6.924 -0.200 7.640 1.00 0.00 H new ATOM 94 N GLU A 7 6.457 -3.368 10.979 1.00 0.00 N ATOM 95 CA GLU A 7 5.816 -4.681 10.989 1.00 0.00 C ATOM 96 C GLU A 7 4.314 -4.542 11.202 1.00 0.00 C ATOM 97 O GLU A 7 3.516 -5.156 10.494 1.00 0.00 O ATOM 98 CB GLU A 7 6.421 -5.562 12.084 1.00 0.00 C ATOM 99 CG GLU A 7 7.141 -6.789 11.548 1.00 0.00 C ATOM 100 CD GLU A 7 6.224 -7.987 11.407 1.00 0.00 C ATOM 101 OE1 GLU A 7 5.026 -7.788 11.115 1.00 0.00 O ATOM 102 OE2 GLU A 7 6.703 -9.127 11.587 1.00 0.00 O ATOM 0 H GLU A 7 7.250 -3.281 11.615 1.00 0.00 H new ATOM 0 HA GLU A 7 5.989 -5.153 10.022 1.00 0.00 H new ATOM 0 HB2 GLU A 7 7.121 -4.968 12.672 1.00 0.00 H new ATOM 0 HB3 GLU A 7 5.629 -5.882 12.760 1.00 0.00 H new ATOM 0 HG2 GLU A 7 7.578 -6.554 10.577 1.00 0.00 H new ATOM 0 HG3 GLU A 7 7.965 -7.043 12.215 1.00 0.00 H new ATOM 109 N ARG A 8 3.937 -3.716 12.168 1.00 0.00 N ATOM 110 CA ARG A 8 2.531 -3.479 12.457 1.00 0.00 C ATOM 111 C ARG A 8 1.870 -2.729 11.304 1.00 0.00 C ATOM 112 O ARG A 8 0.664 -2.838 11.089 1.00 0.00 O ATOM 113 CB ARG A 8 2.380 -2.683 13.755 1.00 0.00 C ATOM 114 CG ARG A 8 1.193 -3.115 14.600 1.00 0.00 C ATOM 115 CD ARG A 8 0.571 -1.938 15.334 1.00 0.00 C ATOM 116 NE ARG A 8 1.029 -1.852 16.720 1.00 0.00 N ATOM 117 CZ ARG A 8 2.157 -1.254 17.095 1.00 0.00 C ATOM 118 NH1 ARG A 8 2.953 -0.693 16.194 1.00 0.00 N ATOM 119 NH2 ARG A 8 2.493 -1.219 18.378 1.00 0.00 N ATOM 0 H ARG A 8 4.585 -3.200 12.764 1.00 0.00 H new ATOM 0 HA ARG A 8 2.037 -4.443 12.577 1.00 0.00 H new ATOM 0 HB2 ARG A 8 3.291 -2.788 14.344 1.00 0.00 H new ATOM 0 HB3 ARG A 8 2.277 -1.625 13.513 1.00 0.00 H new ATOM 0 HG2 ARG A 8 0.444 -3.584 13.963 1.00 0.00 H new ATOM 0 HG3 ARG A 8 1.514 -3.866 15.322 1.00 0.00 H new ATOM 0 HD2 ARG A 8 0.819 -1.014 14.812 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -0.515 -2.033 15.316 1.00 0.00 H new ATOM 0 HE ARG A 8 0.448 -2.276 17.443 1.00 0.00 H new ATOM 0 HH11 ARG A 8 2.702 -0.718 15.206 1.00 0.00 H new ATOM 0 HH12 ARG A 8 3.816 -0.237 16.490 1.00 0.00 H new ATOM 0 HH21 ARG A 8 1.887 -1.650 19.076 1.00 0.00 H new ATOM 0 HH22 ARG A 8 3.357 -0.761 18.666 1.00 0.00 H new ATOM 132 N CYS A 9 2.674 -1.962 10.569 1.00 0.00 N ATOM 133 CA CYS A 9 2.178 -1.182 9.439 1.00 0.00 C ATOM 134 C CYS A 9 1.793 -2.076 8.262 1.00 0.00 C ATOM 135 O CYS A 9 0.647 -2.059 7.810 1.00 0.00 O ATOM 136 CB CYS A 9 3.233 -0.166 8.997 1.00 0.00 C ATOM 137 SG CYS A 9 3.802 0.929 10.320 1.00 0.00 S ATOM 0 H CYS A 9 3.675 -1.865 10.738 1.00 0.00 H new ATOM 0 HA CYS A 9 1.282 -0.657 9.768 1.00 0.00 H new ATOM 0 HB2 CYS A 9 4.090 -0.702 8.589 1.00 0.00 H new ATOM 0 HB3 CYS A 9 2.823 0.440 8.189 1.00 0.00 H new ATOM 0 HG CYS A 9 4.379 0.225 11.248 1.00 0.00 H new ATOM 143 N ILE A 10 2.754 -2.847 7.760 1.00 0.00 N ATOM 144 CA ILE A 10 2.504 -3.734 6.628 1.00 0.00 C ATOM 145 C ILE A 10 1.246 -4.571 6.836 1.00 0.00 C ATOM 146 O ILE A 10 0.337 -4.557 6.012 1.00 0.00 O ATOM 147 CB ILE A 10 3.685 -4.694 6.373 1.00 0.00 C ATOM 148 CG1 ILE A 10 5.021 -3.962 6.485 1.00 0.00 C ATOM 149 CG2 ILE A 10 3.552 -5.339 5.004 1.00 0.00 C ATOM 150 CD1 ILE A 10 5.791 -4.299 7.733 1.00 0.00 C ATOM 0 H ILE A 10 3.709 -2.876 8.117 1.00 0.00 H new ATOM 0 HA ILE A 10 2.375 -3.082 5.764 1.00 0.00 H new ATOM 0 HB ILE A 10 3.660 -5.473 7.135 1.00 0.00 H new ATOM 0 HG12 ILE A 10 5.632 -4.204 5.615 1.00 0.00 H new ATOM 0 HG13 ILE A 10 4.840 -2.887 6.459 1.00 0.00 H new ATOM 0 HG21 ILE A 10 4.391 -6.014 4.837 1.00 0.00 H new ATOM 0 HG22 ILE A 10 2.619 -5.901 4.956 1.00 0.00 H new ATOM 0 HG23 ILE A 10 3.550 -4.565 4.236 1.00 0.00 H new ATOM 0 HD11 ILE A 10 6.728 -3.742 7.744 1.00 0.00 H new ATOM 0 HD12 ILE A 10 5.200 -4.031 8.609 1.00 0.00 H new ATOM 0 HD13 ILE A 10 6.004 -5.368 7.752 1.00 0.00 H new ATOM 162 N GLU A 11 1.210 -5.308 7.940 1.00 0.00 N ATOM 163 CA GLU A 11 0.075 -6.171 8.253 1.00 0.00 C ATOM 164 C GLU A 11 -1.247 -5.414 8.179 1.00 0.00 C ATOM 165 O GLU A 11 -2.295 -6.007 7.926 1.00 0.00 O ATOM 166 CB GLU A 11 0.248 -6.789 9.642 1.00 0.00 C ATOM 167 CG GLU A 11 0.773 -8.216 9.604 1.00 0.00 C ATOM 168 CD GLU A 11 0.781 -8.869 10.972 1.00 0.00 C ATOM 169 OE1 GLU A 11 1.429 -8.322 11.888 1.00 0.00 O ATOM 170 OE2 GLU A 11 0.139 -9.930 11.126 1.00 0.00 O ATOM 0 H GLU A 11 1.956 -5.326 8.636 1.00 0.00 H new ATOM 0 HA GLU A 11 0.047 -6.964 7.505 1.00 0.00 H new ATOM 0 HB2 GLU A 11 0.933 -6.172 10.224 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -0.711 -6.776 10.160 1.00 0.00 H new ATOM 0 HG2 GLU A 11 0.158 -8.808 8.926 1.00 0.00 H new ATOM 0 HG3 GLU A 11 1.785 -8.217 9.199 1.00 0.00 H new ATOM 177 N SER A 12 -1.197 -4.112 8.410 1.00 0.00 N ATOM 178 CA SER A 12 -2.400 -3.293 8.378 1.00 0.00 C ATOM 179 C SER A 12 -3.060 -3.298 6.997 1.00 0.00 C ATOM 180 O SER A 12 -4.242 -3.607 6.876 1.00 0.00 O ATOM 181 CB SER A 12 -2.069 -1.859 8.789 1.00 0.00 C ATOM 182 OG SER A 12 -1.192 -1.835 9.900 1.00 0.00 O ATOM 0 H SER A 12 -0.340 -3.600 8.621 1.00 0.00 H new ATOM 0 HA SER A 12 -3.108 -3.724 9.086 1.00 0.00 H new ATOM 0 HB2 SER A 12 -1.612 -1.334 7.950 1.00 0.00 H new ATOM 0 HB3 SER A 12 -2.988 -1.327 9.036 1.00 0.00 H new ATOM 0 HG SER A 12 -0.353 -2.282 9.664 1.00 0.00 H new ATOM 188 N LEU A 13 -2.305 -2.924 5.964 1.00 0.00 N ATOM 189 CA LEU A 13 -2.837 -2.856 4.607 1.00 0.00 C ATOM 190 C LEU A 13 -3.002 -4.228 3.945 1.00 0.00 C ATOM 191 O LEU A 13 -3.853 -4.405 3.076 1.00 0.00 O ATOM 192 CB LEU A 13 -1.936 -1.970 3.763 1.00 0.00 C ATOM 193 CG LEU A 13 -2.326 -0.496 3.762 1.00 0.00 C ATOM 194 CD1 LEU A 13 -3.730 -0.320 3.225 1.00 0.00 C ATOM 195 CD2 LEU A 13 -2.240 0.100 5.152 1.00 0.00 C ATOM 0 H LEU A 13 -1.322 -2.664 6.043 1.00 0.00 H new ATOM 0 HA LEU A 13 -3.839 -2.433 4.675 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.912 -2.062 4.126 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.944 -2.336 2.736 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.621 0.028 3.116 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.992 0.738 3.231 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -3.780 -0.700 2.205 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -4.431 -0.871 3.852 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -2.525 1.152 5.115 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -2.915 -0.435 5.820 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -1.219 0.013 5.523 1.00 0.00 H new ATOM 207 N ILE A 14 -2.200 -5.198 4.335 1.00 0.00 N ATOM 208 CA ILE A 14 -2.306 -6.520 3.753 1.00 0.00 C ATOM 209 C ILE A 14 -3.607 -7.176 4.136 1.00 0.00 C ATOM 210 O ILE A 14 -4.198 -7.922 3.366 1.00 0.00 O ATOM 211 CB ILE A 14 -1.216 -7.455 4.263 1.00 0.00 C ATOM 212 CG1 ILE A 14 0.145 -6.799 4.251 1.00 0.00 C ATOM 213 CG2 ILE A 14 -1.205 -8.718 3.444 1.00 0.00 C ATOM 214 CD1 ILE A 14 1.048 -7.389 5.297 1.00 0.00 C ATOM 0 H ILE A 14 -1.475 -5.098 5.045 1.00 0.00 H new ATOM 0 HA ILE A 14 -2.224 -6.372 2.676 1.00 0.00 H new ATOM 0 HB ILE A 14 -1.442 -7.699 5.301 1.00 0.00 H new ATOM 0 HG12 ILE A 14 0.599 -6.918 3.267 1.00 0.00 H new ATOM 0 HG13 ILE A 14 0.036 -5.728 4.424 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -0.424 -9.384 3.812 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -2.172 -9.213 3.526 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -1.010 -8.473 2.400 1.00 0.00 H new ATOM 0 HD11 ILE A 14 2.019 -6.894 5.261 1.00 0.00 H new ATOM 0 HD12 ILE A 14 0.605 -7.247 6.283 1.00 0.00 H new ATOM 0 HD13 ILE A 14 1.177 -8.455 5.107 1.00 0.00 H new ATOM 226 N ALA A 15 -4.003 -6.926 5.365 1.00 0.00 N ATOM 227 CA ALA A 15 -5.185 -7.528 5.932 1.00 0.00 C ATOM 228 C ALA A 15 -6.463 -6.881 5.435 1.00 0.00 C ATOM 229 O ALA A 15 -7.472 -7.562 5.253 1.00 0.00 O ATOM 230 CB ALA A 15 -5.053 -7.493 7.434 1.00 0.00 C ATOM 0 H ALA A 15 -3.511 -6.297 6.000 1.00 0.00 H new ATOM 0 HA ALA A 15 -5.261 -8.564 5.603 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -5.936 -7.943 7.887 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.166 -8.051 7.734 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -4.961 -6.459 7.767 1.00 0.00 H new ATOM 236 N VAL A 16 -6.418 -5.581 5.160 1.00 0.00 N ATOM 237 CA VAL A 16 -7.578 -4.900 4.621 1.00 0.00 C ATOM 238 C VAL A 16 -8.055 -5.681 3.407 1.00 0.00 C ATOM 239 O VAL A 16 -9.253 -5.849 3.173 1.00 0.00 O ATOM 240 CB VAL A 16 -7.223 -3.469 4.196 1.00 0.00 C ATOM 241 CG1 VAL A 16 -6.649 -2.693 5.360 1.00 0.00 C ATOM 242 CG2 VAL A 16 -6.225 -3.497 3.061 1.00 0.00 C ATOM 0 H VAL A 16 -5.599 -4.989 5.301 1.00 0.00 H new ATOM 0 HA VAL A 16 -8.356 -4.845 5.383 1.00 0.00 H new ATOM 0 HB VAL A 16 -8.135 -2.975 3.862 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -6.404 -1.681 5.037 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -7.382 -2.650 6.165 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -5.746 -3.188 5.718 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -5.980 -2.476 2.767 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -5.319 -4.009 3.386 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -6.656 -4.026 2.211 1.00 0.00 H new ATOM 252 N PHE A 17 -7.073 -6.178 2.658 1.00 0.00 N ATOM 253 CA PHE A 17 -7.331 -6.981 1.472 1.00 0.00 C ATOM 254 C PHE A 17 -7.723 -8.406 1.872 1.00 0.00 C ATOM 255 O PHE A 17 -8.802 -8.880 1.528 1.00 0.00 O ATOM 256 CB PHE A 17 -6.087 -6.990 0.570 1.00 0.00 C ATOM 257 CG PHE A 17 -5.995 -8.167 -0.365 1.00 0.00 C ATOM 258 CD1 PHE A 17 -6.654 -8.158 -1.584 1.00 0.00 C ATOM 259 CD2 PHE A 17 -5.242 -9.278 -0.025 1.00 0.00 C ATOM 260 CE1 PHE A 17 -6.563 -9.235 -2.445 1.00 0.00 C ATOM 261 CE2 PHE A 17 -5.149 -10.359 -0.881 1.00 0.00 C ATOM 262 CZ PHE A 17 -5.810 -10.337 -2.092 1.00 0.00 C ATOM 0 H PHE A 17 -6.083 -6.035 2.857 1.00 0.00 H new ATOM 0 HA PHE A 17 -8.161 -6.544 0.917 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -6.076 -6.073 -0.020 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -5.198 -6.974 1.200 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -7.246 -7.299 -1.864 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -4.721 -9.300 0.921 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -7.080 -9.215 -3.393 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -4.560 -11.220 -0.602 1.00 0.00 H new ATOM 0 HZ PHE A 17 -5.738 -11.181 -2.763 1.00 0.00 H new ATOM 272 N GLN A 18 -6.838 -9.083 2.605 1.00 0.00 N ATOM 273 CA GLN A 18 -7.088 -10.457 3.050 1.00 0.00 C ATOM 274 C GLN A 18 -8.460 -10.612 3.692 1.00 0.00 C ATOM 275 O GLN A 18 -9.018 -11.709 3.709 1.00 0.00 O ATOM 276 CB GLN A 18 -6.030 -10.901 4.062 1.00 0.00 C ATOM 277 CG GLN A 18 -4.615 -10.537 3.669 1.00 0.00 C ATOM 278 CD GLN A 18 -3.948 -11.616 2.854 1.00 0.00 C ATOM 279 OE1 GLN A 18 -4.475 -11.840 1.659 1.00 0.00 O flip ATOM 280 NE2 GLN A 18 -2.977 -12.237 3.286 1.00 0.00 N flip ATOM 0 H GLN A 18 -5.940 -8.703 2.904 1.00 0.00 H new ATOM 0 HA GLN A 18 -7.043 -11.081 2.158 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -6.255 -10.451 5.029 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -6.095 -11.982 4.190 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -4.627 -9.609 3.097 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -4.028 -10.350 4.568 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -2.609 -12.027 4.214 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -2.541 -12.962 2.716 1.00 0.00 H new ATOM 289 N LYS A 19 -9.000 -9.530 4.237 1.00 0.00 N ATOM 290 CA LYS A 19 -10.299 -9.606 4.889 1.00 0.00 C ATOM 291 C LYS A 19 -11.401 -9.890 3.875 1.00 0.00 C ATOM 292 O LYS A 19 -12.162 -10.846 4.027 1.00 0.00 O ATOM 293 CB LYS A 19 -10.592 -8.295 5.620 1.00 0.00 C ATOM 294 CG LYS A 19 -11.407 -8.473 6.888 1.00 0.00 C ATOM 295 CD LYS A 19 -10.584 -9.116 7.992 1.00 0.00 C ATOM 296 CE LYS A 19 -9.730 -8.091 8.720 1.00 0.00 C ATOM 297 NZ LYS A 19 -8.446 -8.673 9.195 1.00 0.00 N ATOM 0 H LYS A 19 -8.568 -8.606 4.241 1.00 0.00 H new ATOM 0 HA LYS A 19 -10.274 -10.425 5.608 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -9.648 -7.810 5.870 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -11.126 -7.625 4.946 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -11.775 -7.504 7.224 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -12.280 -9.090 6.677 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -11.248 -9.608 8.703 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -9.943 -9.889 7.567 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -9.524 -7.252 8.055 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -10.285 -7.695 9.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -7.894 -7.941 9.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -8.641 -9.457 9.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -7.904 -9.028 8.382 1.00 0.00 H new ATOM 311 N TYR A 20 -11.460 -9.082 2.823 1.00 0.00 N ATOM 312 CA TYR A 20 -12.443 -9.280 1.770 1.00 0.00 C ATOM 313 C TYR A 20 -11.959 -10.351 0.805 1.00 0.00 C ATOM 314 O TYR A 20 -12.728 -11.176 0.312 1.00 0.00 O ATOM 315 CB TYR A 20 -12.729 -7.964 1.045 1.00 0.00 C ATOM 316 CG TYR A 20 -13.862 -7.182 1.671 1.00 0.00 C ATOM 317 CD1 TYR A 20 -13.728 -6.619 2.934 1.00 0.00 C ATOM 318 CD2 TYR A 20 -15.068 -7.014 1.003 1.00 0.00 C ATOM 319 CE1 TYR A 20 -14.763 -5.909 3.513 1.00 0.00 C ATOM 320 CE2 TYR A 20 -16.108 -6.307 1.576 1.00 0.00 C ATOM 321 CZ TYR A 20 -15.951 -5.756 2.830 1.00 0.00 C ATOM 322 OH TYR A 20 -16.984 -5.051 3.403 1.00 0.00 O ATOM 0 H TYR A 20 -10.839 -8.286 2.678 1.00 0.00 H new ATOM 0 HA TYR A 20 -13.378 -9.619 2.215 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -11.827 -7.351 1.045 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -12.971 -8.174 0.003 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -12.799 -6.738 3.473 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -15.195 -7.443 0.020 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -14.642 -5.476 4.495 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -17.040 -6.187 1.044 1.00 0.00 H new ATOM 0 HH TYR A 20 -16.620 -4.362 3.997 1.00 0.00 H new ATOM 332 N ALA A 21 -10.660 -10.297 0.540 1.00 0.00 N ATOM 333 CA ALA A 21 -9.992 -11.214 -0.369 1.00 0.00 C ATOM 334 C ALA A 21 -9.898 -12.622 0.212 1.00 0.00 C ATOM 335 O ALA A 21 -9.853 -13.605 -0.527 1.00 0.00 O ATOM 336 CB ALA A 21 -8.608 -10.664 -0.681 1.00 0.00 C ATOM 0 H ALA A 21 -10.035 -9.606 0.956 1.00 0.00 H new ATOM 0 HA ALA A 21 -10.577 -11.294 -1.285 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -8.093 -11.341 -1.363 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -8.703 -9.683 -1.146 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -8.036 -10.574 0.242 1.00 0.00 H new ATOM 342 N GLY A 22 -9.868 -12.711 1.537 1.00 0.00 N ATOM 343 CA GLY A 22 -9.776 -14.004 2.190 1.00 0.00 C ATOM 344 C GLY A 22 -10.883 -14.225 3.201 1.00 0.00 C ATOM 345 O GLY A 22 -11.053 -13.433 4.129 1.00 0.00 O ATOM 0 H GLY A 22 -9.906 -11.912 2.170 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -9.814 -14.791 1.437 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -8.811 -14.087 2.689 1.00 0.00 H new ATOM 349 N LYS A 23 -11.637 -15.305 3.024 1.00 0.00 N ATOM 350 CA LYS A 23 -12.733 -15.629 3.930 1.00 0.00 C ATOM 351 C LYS A 23 -12.909 -17.140 4.051 1.00 0.00 C ATOM 352 O LYS A 23 -14.014 -17.628 4.291 1.00 0.00 O ATOM 353 CB LYS A 23 -14.033 -14.986 3.441 1.00 0.00 C ATOM 354 CG LYS A 23 -14.862 -14.369 4.555 1.00 0.00 C ATOM 355 CD LYS A 23 -16.143 -15.151 4.801 1.00 0.00 C ATOM 356 CE LYS A 23 -16.006 -16.087 5.992 1.00 0.00 C ATOM 357 NZ LYS A 23 -16.795 -17.335 5.810 1.00 0.00 N ATOM 0 H LYS A 23 -11.509 -15.971 2.262 1.00 0.00 H new ATOM 0 HA LYS A 23 -12.489 -15.231 4.915 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -13.794 -14.216 2.708 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -14.631 -15.740 2.929 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -14.273 -14.337 5.472 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -15.108 -13.339 4.298 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -16.966 -14.458 4.975 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -16.395 -15.728 3.911 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -14.956 -16.339 6.136 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -16.338 -15.576 6.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -16.675 -17.946 6.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -17.801 -17.096 5.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -16.461 -17.836 4.962 1.00 0.00 H new ATOM 371 N ASP A 24 -11.815 -17.874 3.884 1.00 0.00 N ATOM 372 CA ASP A 24 -11.850 -19.330 3.975 1.00 0.00 C ATOM 373 C ASP A 24 -10.440 -19.903 4.086 1.00 0.00 C ATOM 374 O ASP A 24 -10.169 -21.006 3.611 1.00 0.00 O ATOM 375 CB ASP A 24 -12.559 -19.923 2.756 1.00 0.00 C ATOM 376 CG ASP A 24 -11.898 -19.525 1.451 1.00 0.00 C ATOM 377 OD1 ASP A 24 -10.977 -20.244 1.009 1.00 0.00 O ATOM 378 OD2 ASP A 24 -12.302 -18.495 0.871 1.00 0.00 O ATOM 0 H ASP A 24 -10.893 -17.486 3.685 1.00 0.00 H new ATOM 0 HA ASP A 24 -12.404 -19.598 4.874 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -12.569 -21.010 2.838 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -13.598 -19.595 2.748 1.00 0.00 H new ATOM 383 N GLY A 25 -9.545 -19.146 4.715 1.00 0.00 N ATOM 384 CA GLY A 25 -8.175 -19.597 4.876 1.00 0.00 C ATOM 385 C GLY A 25 -7.260 -19.073 3.787 1.00 0.00 C ATOM 386 O GLY A 25 -6.301 -18.354 4.066 1.00 0.00 O ATOM 0 H GLY A 25 -9.744 -18.229 5.115 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -7.801 -19.273 5.847 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -8.152 -20.687 4.873 1.00 0.00 H new ATOM 390 N HIS A 26 -7.557 -19.436 2.543 1.00 0.00 N ATOM 391 CA HIS A 26 -6.752 -18.999 1.409 1.00 0.00 C ATOM 392 C HIS A 26 -7.101 -17.567 1.014 1.00 0.00 C ATOM 393 O HIS A 26 -8.209 -17.096 1.266 1.00 0.00 O ATOM 394 CB HIS A 26 -6.964 -19.936 0.218 1.00 0.00 C ATOM 395 CG HIS A 26 -6.644 -21.368 0.518 1.00 0.00 C ATOM 396 ND1 HIS A 26 -5.387 -21.797 0.891 1.00 0.00 N ATOM 397 CD2 HIS A 26 -7.425 -22.473 0.498 1.00 0.00 C ATOM 398 CE1 HIS A 26 -5.410 -23.104 1.087 1.00 0.00 C ATOM 399 NE2 HIS A 26 -6.635 -23.538 0.856 1.00 0.00 N ATOM 0 H HIS A 26 -8.348 -20.031 2.296 1.00 0.00 H new ATOM 0 HA HIS A 26 -5.703 -19.029 1.705 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -8.001 -19.865 -0.109 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -6.344 -19.600 -0.613 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -8.475 -22.510 0.247 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -4.570 -23.713 1.385 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -6.945 -24.507 0.931 1.00 0.00 H new ATOM 408 N SER A 27 -6.146 -16.882 0.393 1.00 0.00 N ATOM 409 CA SER A 27 -6.352 -15.504 -0.039 1.00 0.00 C ATOM 410 C SER A 27 -5.311 -15.101 -1.080 1.00 0.00 C ATOM 411 O SER A 27 -4.118 -15.045 -0.787 1.00 0.00 O ATOM 412 CB SER A 27 -6.282 -14.555 1.160 1.00 0.00 C ATOM 413 OG SER A 27 -4.961 -14.470 1.667 1.00 0.00 O ATOM 0 H SER A 27 -5.223 -17.258 0.178 1.00 0.00 H new ATOM 0 HA SER A 27 -7.341 -15.435 -0.491 1.00 0.00 H new ATOM 0 HB2 SER A 27 -6.626 -13.564 0.864 1.00 0.00 H new ATOM 0 HB3 SER A 27 -6.954 -14.904 1.944 1.00 0.00 H new ATOM 0 HG SER A 27 -4.602 -13.574 1.497 1.00 0.00 H new ATOM 419 N VAL A 28 -5.773 -14.827 -2.296 1.00 0.00 N ATOM 420 CA VAL A 28 -4.878 -14.434 -3.378 1.00 0.00 C ATOM 421 C VAL A 28 -5.424 -13.232 -4.147 1.00 0.00 C ATOM 422 O VAL A 28 -4.677 -12.321 -4.501 1.00 0.00 O ATOM 423 CB VAL A 28 -4.640 -15.599 -4.359 1.00 0.00 C ATOM 424 CG1 VAL A 28 -5.943 -16.022 -5.020 1.00 0.00 C ATOM 425 CG2 VAL A 28 -3.603 -15.216 -5.405 1.00 0.00 C ATOM 0 H VAL A 28 -6.758 -14.870 -2.556 1.00 0.00 H new ATOM 0 HA VAL A 28 -3.930 -14.157 -2.916 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.256 -16.448 -3.794 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -5.751 -16.845 -5.708 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -6.650 -16.345 -4.256 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -6.362 -15.179 -5.570 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -3.449 -16.052 -6.088 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -3.954 -14.349 -5.965 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -2.662 -14.972 -4.912 1.00 0.00 H new ATOM 435 N THR A 29 -6.728 -13.238 -4.406 1.00 0.00 N ATOM 436 CA THR A 29 -7.366 -12.151 -5.134 1.00 0.00 C ATOM 437 C THR A 29 -8.666 -11.728 -4.463 1.00 0.00 C ATOM 438 O THR A 29 -9.306 -12.512 -3.762 1.00 0.00 O ATOM 439 CB THR A 29 -7.637 -12.562 -6.578 1.00 0.00 C ATOM 440 OG1 THR A 29 -8.062 -13.913 -6.646 1.00 0.00 O ATOM 441 CG2 THR A 29 -6.431 -12.411 -7.480 1.00 0.00 C ATOM 0 H THR A 29 -7.362 -13.985 -4.122 1.00 0.00 H new ATOM 0 HA THR A 29 -6.684 -11.301 -5.127 1.00 0.00 H new ATOM 0 HB THR A 29 -8.418 -11.887 -6.928 1.00 0.00 H new ATOM 0 HG1 THR A 29 -8.232 -14.156 -7.580 1.00 0.00 H new ATOM 0 HG21 THR A 29 -6.693 -12.720 -8.492 1.00 0.00 H new ATOM 0 HG22 THR A 29 -6.112 -11.369 -7.490 1.00 0.00 H new ATOM 0 HG23 THR A 29 -5.618 -13.035 -7.108 1.00 0.00 H new ATOM 449 N LEU A 30 -9.049 -10.480 -4.694 1.00 0.00 N ATOM 450 CA LEU A 30 -10.274 -9.925 -4.128 1.00 0.00 C ATOM 451 C LEU A 30 -11.302 -9.685 -5.241 1.00 0.00 C ATOM 452 O LEU A 30 -11.465 -10.525 -6.119 1.00 0.00 O ATOM 453 CB LEU A 30 -9.951 -8.625 -3.378 1.00 0.00 C ATOM 454 CG LEU A 30 -10.743 -8.388 -2.087 1.00 0.00 C ATOM 455 CD1 LEU A 30 -10.609 -6.940 -1.643 1.00 0.00 C ATOM 456 CD2 LEU A 30 -12.212 -8.757 -2.261 1.00 0.00 C ATOM 0 H LEU A 30 -8.524 -9.826 -5.275 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.705 -10.632 -3.419 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -8.888 -8.621 -3.136 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -10.128 -7.786 -4.050 1.00 0.00 H new ATOM 0 HG LEU A 30 -10.326 -9.034 -1.315 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -11.177 -6.787 -0.725 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -9.559 -6.710 -1.463 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -10.995 -6.283 -2.422 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -12.745 -8.577 -1.328 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.649 -8.147 -3.052 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.293 -9.811 -2.528 1.00 0.00 H new ATOM 468 N SER A 31 -11.981 -8.537 -5.219 1.00 0.00 N ATOM 469 CA SER A 31 -12.964 -8.215 -6.247 1.00 0.00 C ATOM 470 C SER A 31 -13.370 -6.749 -6.158 1.00 0.00 C ATOM 471 O SER A 31 -13.641 -6.235 -5.072 1.00 0.00 O ATOM 472 CB SER A 31 -14.194 -9.113 -6.116 1.00 0.00 C ATOM 473 OG SER A 31 -14.963 -9.100 -7.305 1.00 0.00 O ATOM 0 H SER A 31 -11.867 -7.820 -4.503 1.00 0.00 H new ATOM 0 HA SER A 31 -12.508 -8.391 -7.221 1.00 0.00 H new ATOM 0 HB2 SER A 31 -13.881 -10.133 -5.892 1.00 0.00 H new ATOM 0 HB3 SER A 31 -14.806 -8.777 -5.279 1.00 0.00 H new ATOM 0 HG SER A 31 -15.743 -9.683 -7.196 1.00 0.00 H new ATOM 479 N LYS A 32 -13.404 -6.078 -7.304 1.00 0.00 N ATOM 480 CA LYS A 32 -13.770 -4.666 -7.356 1.00 0.00 C ATOM 481 C LYS A 32 -15.068 -4.411 -6.594 1.00 0.00 C ATOM 482 O LYS A 32 -15.204 -3.407 -5.896 1.00 0.00 O ATOM 483 CB LYS A 32 -13.919 -4.210 -8.808 1.00 0.00 C ATOM 484 CG LYS A 32 -14.914 -5.036 -9.606 1.00 0.00 C ATOM 485 CD LYS A 32 -16.298 -4.407 -9.596 1.00 0.00 C ATOM 486 CE LYS A 32 -16.968 -4.511 -10.956 1.00 0.00 C ATOM 487 NZ LYS A 32 -18.341 -3.935 -10.946 1.00 0.00 N ATOM 0 H LYS A 32 -13.182 -6.489 -8.211 1.00 0.00 H new ATOM 0 HA LYS A 32 -12.974 -4.092 -6.882 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -14.232 -3.166 -8.822 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.946 -4.257 -9.297 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -14.565 -5.133 -10.634 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -14.968 -6.042 -9.191 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -16.917 -4.899 -8.846 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -16.220 -3.359 -9.307 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -16.362 -3.992 -11.699 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -17.016 -5.557 -11.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -18.763 -4.026 -11.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -18.927 -4.446 -10.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -18.294 -2.930 -10.683 1.00 0.00 H new ATOM 501 N THR A 33 -16.017 -5.330 -6.734 1.00 0.00 N ATOM 502 CA THR A 33 -17.299 -5.212 -6.061 1.00 0.00 C ATOM 503 C THR A 33 -17.135 -5.395 -4.554 1.00 0.00 C ATOM 504 O THR A 33 -17.665 -4.618 -3.768 1.00 0.00 O ATOM 505 CB THR A 33 -18.280 -6.242 -6.631 1.00 0.00 C ATOM 506 OG1 THR A 33 -19.002 -5.696 -7.720 1.00 0.00 O ATOM 507 CG2 THR A 33 -19.288 -6.744 -5.622 1.00 0.00 C ATOM 0 H THR A 33 -15.919 -6.166 -7.310 1.00 0.00 H new ATOM 0 HA THR A 33 -17.699 -4.213 -6.235 1.00 0.00 H new ATOM 0 HB THR A 33 -17.659 -7.082 -6.944 1.00 0.00 H new ATOM 0 HG1 THR A 33 -19.622 -6.369 -8.072 1.00 0.00 H new ATOM 0 HG21 THR A 33 -19.948 -7.469 -6.097 1.00 0.00 H new ATOM 0 HG22 THR A 33 -18.766 -7.219 -4.791 1.00 0.00 H new ATOM 0 HG23 THR A 33 -19.878 -5.906 -5.249 1.00 0.00 H new ATOM 515 N GLU A 34 -16.395 -6.422 -4.150 1.00 0.00 N ATOM 516 CA GLU A 34 -16.176 -6.671 -2.731 1.00 0.00 C ATOM 517 C GLU A 34 -15.536 -5.453 -2.073 1.00 0.00 C ATOM 518 O GLU A 34 -15.755 -5.181 -0.893 1.00 0.00 O ATOM 519 CB GLU A 34 -15.300 -7.906 -2.525 1.00 0.00 C ATOM 520 CG GLU A 34 -16.074 -9.115 -2.028 1.00 0.00 C ATOM 521 CD GLU A 34 -15.166 -10.251 -1.595 1.00 0.00 C ATOM 522 OE1 GLU A 34 -14.370 -10.726 -2.431 1.00 0.00 O ATOM 523 OE2 GLU A 34 -15.254 -10.664 -0.419 1.00 0.00 O ATOM 0 H GLU A 34 -15.942 -7.088 -4.776 1.00 0.00 H new ATOM 0 HA GLU A 34 -17.143 -6.856 -2.263 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -14.812 -8.158 -3.466 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -14.512 -7.669 -1.810 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -16.704 -8.819 -1.190 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -16.738 -9.466 -2.818 1.00 0.00 H new ATOM 530 N PHE A 35 -14.759 -4.711 -2.857 1.00 0.00 N ATOM 531 CA PHE A 35 -14.103 -3.508 -2.363 1.00 0.00 C ATOM 532 C PHE A 35 -15.138 -2.419 -2.093 1.00 0.00 C ATOM 533 O PHE A 35 -14.956 -1.574 -1.217 1.00 0.00 O ATOM 534 CB PHE A 35 -13.065 -3.012 -3.373 1.00 0.00 C ATOM 535 CG PHE A 35 -11.856 -2.409 -2.724 1.00 0.00 C ATOM 536 CD1 PHE A 35 -11.984 -1.335 -1.860 1.00 0.00 C ATOM 537 CD2 PHE A 35 -10.594 -2.919 -2.970 1.00 0.00 C ATOM 538 CE1 PHE A 35 -10.876 -0.782 -1.252 1.00 0.00 C ATOM 539 CE2 PHE A 35 -9.481 -2.369 -2.367 1.00 0.00 C ATOM 540 CZ PHE A 35 -9.621 -1.298 -1.506 1.00 0.00 C ATOM 0 H PHE A 35 -14.569 -4.923 -3.837 1.00 0.00 H new ATOM 0 HA PHE A 35 -13.592 -3.748 -1.431 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -12.754 -3.844 -4.004 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -13.527 -2.272 -4.026 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -12.963 -0.925 -1.660 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -10.478 -3.757 -3.641 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -10.990 0.054 -0.578 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -8.501 -2.776 -2.568 1.00 0.00 H new ATOM 0 HZ PHE A 35 -8.752 -0.866 -1.033 1.00 0.00 H new ATOM 550 N LEU A 36 -16.232 -2.454 -2.850 1.00 0.00 N ATOM 551 CA LEU A 36 -17.308 -1.479 -2.699 1.00 0.00 C ATOM 552 C LEU A 36 -17.760 -1.379 -1.261 1.00 0.00 C ATOM 553 O LEU A 36 -17.735 -0.311 -0.649 1.00 0.00 O ATOM 554 CB LEU A 36 -18.514 -1.901 -3.534 1.00 0.00 C ATOM 555 CG LEU A 36 -18.619 -1.231 -4.884 1.00 0.00 C ATOM 556 CD1 LEU A 36 -18.836 0.261 -4.697 1.00 0.00 C ATOM 557 CD2 LEU A 36 -17.370 -1.512 -5.702 1.00 0.00 C ATOM 0 H LEU A 36 -16.397 -3.150 -3.577 1.00 0.00 H new ATOM 0 HA LEU A 36 -16.921 -0.515 -3.030 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -18.475 -2.980 -3.682 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -19.421 -1.689 -2.968 1.00 0.00 H new ATOM 0 HG LEU A 36 -19.473 -1.634 -5.429 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -18.911 0.743 -5.672 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -19.757 0.427 -4.138 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -17.996 0.685 -4.147 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -17.454 -1.025 -6.674 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -16.497 -1.125 -5.177 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -17.262 -2.587 -5.843 1.00 0.00 H new ATOM 569 N SER A 37 -18.202 -2.508 -0.746 1.00 0.00 N ATOM 570 CA SER A 37 -18.702 -2.580 0.613 1.00 0.00 C ATOM 571 C SER A 37 -17.653 -2.109 1.618 1.00 0.00 C ATOM 572 O SER A 37 -17.948 -1.313 2.507 1.00 0.00 O ATOM 573 CB SER A 37 -19.148 -4.006 0.944 1.00 0.00 C ATOM 574 OG SER A 37 -20.465 -4.020 1.467 1.00 0.00 O ATOM 0 H SER A 37 -18.225 -3.394 -1.251 1.00 0.00 H new ATOM 0 HA SER A 37 -19.562 -1.914 0.686 1.00 0.00 H new ATOM 0 HB2 SER A 37 -19.103 -4.622 0.046 1.00 0.00 H new ATOM 0 HB3 SER A 37 -18.462 -4.447 1.667 1.00 0.00 H new ATOM 0 HG SER A 37 -20.727 -4.943 1.669 1.00 0.00 H new ATOM 580 N PHE A 38 -16.428 -2.605 1.467 1.00 0.00 N ATOM 581 CA PHE A 38 -15.335 -2.235 2.360 1.00 0.00 C ATOM 582 C PHE A 38 -15.121 -0.726 2.352 1.00 0.00 C ATOM 583 O PHE A 38 -15.074 -0.090 3.405 1.00 0.00 O ATOM 584 CB PHE A 38 -14.047 -2.951 1.941 1.00 0.00 C ATOM 585 CG PHE A 38 -12.847 -2.589 2.772 1.00 0.00 C ATOM 586 CD1 PHE A 38 -12.232 -1.356 2.627 1.00 0.00 C ATOM 587 CD2 PHE A 38 -12.330 -3.486 3.694 1.00 0.00 C ATOM 588 CE1 PHE A 38 -11.126 -1.023 3.386 1.00 0.00 C ATOM 589 CE2 PHE A 38 -11.224 -3.159 4.456 1.00 0.00 C ATOM 590 CZ PHE A 38 -10.621 -1.926 4.302 1.00 0.00 C ATOM 0 H PHE A 38 -16.168 -3.265 0.734 1.00 0.00 H new ATOM 0 HA PHE A 38 -15.599 -2.541 3.372 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -14.206 -4.028 2.001 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -13.837 -2.718 0.897 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -12.622 -0.646 1.912 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -12.797 -4.452 3.818 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -10.657 -0.058 3.263 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -10.832 -3.867 5.171 1.00 0.00 H new ATOM 0 HZ PHE A 38 -9.757 -1.668 4.896 1.00 0.00 H new ATOM 600 N MET A 39 -14.997 -0.158 1.159 1.00 0.00 N ATOM 601 CA MET A 39 -14.794 1.277 1.021 1.00 0.00 C ATOM 602 C MET A 39 -15.999 2.042 1.557 1.00 0.00 C ATOM 603 O MET A 39 -15.865 3.153 2.065 1.00 0.00 O ATOM 604 CB MET A 39 -14.548 1.645 -0.443 1.00 0.00 C ATOM 605 CG MET A 39 -14.192 3.109 -0.647 1.00 0.00 C ATOM 606 SD MET A 39 -12.493 3.345 -1.204 1.00 0.00 S ATOM 607 CE MET A 39 -11.574 2.711 0.199 1.00 0.00 C ATOM 0 H MET A 39 -15.033 -0.668 0.276 1.00 0.00 H new ATOM 0 HA MET A 39 -13.916 1.555 1.604 1.00 0.00 H new ATOM 0 HB2 MET A 39 -13.742 1.025 -0.835 1.00 0.00 H new ATOM 0 HB3 MET A 39 -15.441 1.412 -1.023 1.00 0.00 H new ATOM 0 HG2 MET A 39 -14.873 3.545 -1.378 1.00 0.00 H new ATOM 0 HG3 MET A 39 -14.341 3.648 0.289 1.00 0.00 H new ATOM 0 HE1 MET A 39 -10.716 2.140 -0.156 1.00 0.00 H new ATOM 0 HE2 MET A 39 -11.227 3.542 0.813 1.00 0.00 H new ATOM 0 HE3 MET A 39 -12.219 2.065 0.794 1.00 0.00 H new ATOM 617 N ASN A 40 -17.174 1.435 1.449 1.00 0.00 N ATOM 618 CA ASN A 40 -18.400 2.056 1.935 1.00 0.00 C ATOM 619 C ASN A 40 -18.457 2.027 3.460 1.00 0.00 C ATOM 620 O ASN A 40 -19.204 2.787 4.077 1.00 0.00 O ATOM 621 CB ASN A 40 -19.624 1.342 1.355 1.00 0.00 C ATOM 622 CG ASN A 40 -19.782 1.584 -0.133 1.00 0.00 C ATOM 623 OD1 ASN A 40 -19.525 2.681 -0.627 1.00 0.00 O ATOM 624 ND2 ASN A 40 -20.209 0.555 -0.858 1.00 0.00 N ATOM 0 H ASN A 40 -17.304 0.514 1.030 1.00 0.00 H new ATOM 0 HA ASN A 40 -18.405 3.096 1.608 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -19.538 0.271 1.539 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -20.520 1.684 1.873 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -20.335 0.658 -1.865 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -20.410 -0.338 -0.407 1.00 0.00 H new ATOM 631 N THR A 41 -17.672 1.137 4.064 1.00 0.00 N ATOM 632 CA THR A 41 -17.643 0.999 5.515 1.00 0.00 C ATOM 633 C THR A 41 -16.254 1.290 6.077 1.00 0.00 C ATOM 634 O THR A 41 -15.990 2.378 6.588 1.00 0.00 O ATOM 635 CB THR A 41 -18.072 -0.415 5.910 1.00 0.00 C ATOM 636 OG1 THR A 41 -17.627 -1.358 4.952 1.00 0.00 O ATOM 637 CG2 THR A 41 -19.567 -0.571 6.047 1.00 0.00 C ATOM 0 H THR A 41 -17.047 0.501 3.568 1.00 0.00 H new ATOM 0 HA THR A 41 -18.337 1.727 5.935 1.00 0.00 H new ATOM 0 HB THR A 41 -17.616 -0.594 6.884 1.00 0.00 H new ATOM 0 HG1 THR A 41 -18.184 -1.295 4.148 1.00 0.00 H new ATOM 0 HG21 THR A 41 -19.801 -1.598 6.329 1.00 0.00 H new ATOM 0 HG22 THR A 41 -19.935 0.109 6.815 1.00 0.00 H new ATOM 0 HG23 THR A 41 -20.046 -0.337 5.096 1.00 0.00 H new ATOM 645 N GLU A 42 -15.376 0.295 5.991 1.00 0.00 N ATOM 646 CA GLU A 42 -14.011 0.412 6.500 1.00 0.00 C ATOM 647 C GLU A 42 -13.355 1.730 6.085 1.00 0.00 C ATOM 648 O GLU A 42 -12.625 2.340 6.866 1.00 0.00 O ATOM 649 CB GLU A 42 -13.172 -0.766 6.008 1.00 0.00 C ATOM 650 CG GLU A 42 -13.807 -2.119 6.288 1.00 0.00 C ATOM 651 CD GLU A 42 -12.943 -3.000 7.171 1.00 0.00 C ATOM 652 OE1 GLU A 42 -11.706 -2.832 7.146 1.00 0.00 O ATOM 653 OE2 GLU A 42 -13.505 -3.855 7.886 1.00 0.00 O ATOM 0 H GLU A 42 -15.587 -0.610 5.570 1.00 0.00 H new ATOM 0 HA GLU A 42 -14.062 0.400 7.589 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -13.010 -0.664 4.935 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.192 -0.728 6.483 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -14.775 -1.969 6.767 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -13.994 -2.630 5.344 1.00 0.00 H new ATOM 660 N LEU A 43 -13.617 2.164 4.858 1.00 0.00 N ATOM 661 CA LEU A 43 -13.048 3.410 4.351 1.00 0.00 C ATOM 662 C LEU A 43 -14.132 4.283 3.729 1.00 0.00 C ATOM 663 O LEU A 43 -13.996 4.752 2.598 1.00 0.00 O ATOM 664 CB LEU A 43 -11.958 3.115 3.317 1.00 0.00 C ATOM 665 CG LEU A 43 -10.596 2.728 3.898 1.00 0.00 C ATOM 666 CD1 LEU A 43 -9.599 2.459 2.780 1.00 0.00 C ATOM 667 CD2 LEU A 43 -10.078 3.819 4.827 1.00 0.00 C ATOM 0 H LEU A 43 -14.218 1.674 4.196 1.00 0.00 H new ATOM 0 HA LEU A 43 -12.606 3.949 5.189 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -12.302 2.308 2.670 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -11.830 3.995 2.687 1.00 0.00 H new ATOM 0 HG LEU A 43 -10.717 1.814 4.480 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -8.636 2.185 3.210 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -9.963 1.643 2.156 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -9.483 3.356 2.172 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -9.109 3.524 5.229 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -9.972 4.750 4.271 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -10.782 3.964 5.646 1.00 0.00 H new ATOM 679 N ALA A 44 -15.211 4.494 4.474 1.00 0.00 N ATOM 680 CA ALA A 44 -16.323 5.305 3.994 1.00 0.00 C ATOM 681 C ALA A 44 -16.031 6.790 4.162 1.00 0.00 C ATOM 682 O ALA A 44 -16.429 7.609 3.335 1.00 0.00 O ATOM 683 CB ALA A 44 -17.601 4.927 4.726 1.00 0.00 C ATOM 0 H ALA A 44 -15.339 4.115 5.412 1.00 0.00 H new ATOM 0 HA ALA A 44 -16.455 5.108 2.930 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -18.425 5.539 4.359 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -17.824 3.875 4.549 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -17.471 5.096 5.795 1.00 0.00 H new ATOM 689 N ALA A 45 -15.332 7.131 5.238 1.00 0.00 N ATOM 690 CA ALA A 45 -14.984 8.518 5.516 1.00 0.00 C ATOM 691 C ALA A 45 -14.204 9.134 4.356 1.00 0.00 C ATOM 692 O ALA A 45 -14.214 10.350 4.166 1.00 0.00 O ATOM 693 CB ALA A 45 -14.183 8.607 6.806 1.00 0.00 C ATOM 0 H ALA A 45 -14.995 6.465 5.933 1.00 0.00 H new ATOM 0 HA ALA A 45 -15.907 9.085 5.634 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -13.928 9.648 7.005 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -14.778 8.215 7.631 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -13.269 8.022 6.708 1.00 0.00 H new ATOM 699 N PHE A 46 -13.533 8.286 3.581 1.00 0.00 N ATOM 700 CA PHE A 46 -12.753 8.748 2.439 1.00 0.00 C ATOM 701 C PHE A 46 -13.590 8.737 1.158 1.00 0.00 C ATOM 702 O PHE A 46 -13.053 8.829 0.054 1.00 0.00 O ATOM 703 CB PHE A 46 -11.511 7.873 2.259 1.00 0.00 C ATOM 704 CG PHE A 46 -10.612 7.857 3.463 1.00 0.00 C ATOM 705 CD1 PHE A 46 -10.945 7.110 4.582 1.00 0.00 C ATOM 706 CD2 PHE A 46 -9.436 8.589 3.476 1.00 0.00 C ATOM 707 CE1 PHE A 46 -10.121 7.094 5.692 1.00 0.00 C ATOM 708 CE2 PHE A 46 -8.608 8.576 4.582 1.00 0.00 C ATOM 709 CZ PHE A 46 -8.951 7.828 5.692 1.00 0.00 C ATOM 0 H PHE A 46 -13.514 7.276 3.724 1.00 0.00 H new ATOM 0 HA PHE A 46 -12.444 9.775 2.636 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -11.824 6.853 2.035 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -10.946 8.230 1.398 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -11.859 6.534 4.587 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -9.163 9.177 2.612 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -10.392 6.508 6.558 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -7.693 9.150 4.579 1.00 0.00 H new ATOM 0 HZ PHE A 46 -8.306 7.817 6.558 1.00 0.00 H new ATOM 719 N THR A 47 -14.906 8.630 1.317 1.00 0.00 N ATOM 720 CA THR A 47 -15.822 8.612 0.181 1.00 0.00 C ATOM 721 C THR A 47 -17.065 9.443 0.484 1.00 0.00 C ATOM 722 O THR A 47 -17.543 10.199 -0.362 1.00 0.00 O ATOM 723 CB THR A 47 -16.225 7.175 -0.153 1.00 0.00 C ATOM 724 OG1 THR A 47 -17.093 6.654 0.837 1.00 0.00 O ATOM 725 CG2 THR A 47 -15.044 6.235 -0.271 1.00 0.00 C ATOM 0 H THR A 47 -15.363 8.554 2.226 1.00 0.00 H new ATOM 0 HA THR A 47 -15.311 9.046 -0.679 1.00 0.00 H new ATOM 0 HB THR A 47 -16.722 7.232 -1.122 1.00 0.00 H new ATOM 0 HG1 THR A 47 -16.762 6.902 1.726 1.00 0.00 H new ATOM 0 HG21 THR A 47 -15.399 5.232 -0.509 1.00 0.00 H new ATOM 0 HG22 THR A 47 -14.380 6.582 -1.063 1.00 0.00 H new ATOM 0 HG23 THR A 47 -14.501 6.213 0.674 1.00 0.00 H new ATOM 733 N LYS A 48 -17.582 9.294 1.700 1.00 0.00 N ATOM 734 CA LYS A 48 -18.769 10.025 2.130 1.00 0.00 C ATOM 735 C LYS A 48 -18.535 11.531 2.068 1.00 0.00 C ATOM 736 O LYS A 48 -18.013 12.128 3.009 1.00 0.00 O ATOM 737 CB LYS A 48 -19.151 9.615 3.554 1.00 0.00 C ATOM 738 CG LYS A 48 -18.019 9.767 4.557 1.00 0.00 C ATOM 739 CD LYS A 48 -18.491 10.440 5.835 1.00 0.00 C ATOM 740 CE LYS A 48 -19.364 9.512 6.664 1.00 0.00 C ATOM 741 NZ LYS A 48 -18.588 8.374 7.230 1.00 0.00 N ATOM 0 H LYS A 48 -17.195 8.670 2.408 1.00 0.00 H new ATOM 0 HA LYS A 48 -19.586 9.776 1.452 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -19.998 10.218 3.881 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -19.482 8.577 3.547 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -17.607 8.786 4.793 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -17.214 10.353 4.112 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -17.628 10.751 6.424 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -19.050 11.342 5.587 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -19.824 10.076 7.475 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -20.174 9.126 6.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -19.142 7.915 7.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -18.385 7.684 6.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -17.694 8.727 7.627 1.00 0.00 H new ATOM 755 N ASN A 49 -18.925 12.142 0.954 1.00 0.00 N ATOM 756 CA ASN A 49 -18.758 13.579 0.772 1.00 0.00 C ATOM 757 C ASN A 49 -17.289 13.974 0.886 1.00 0.00 C ATOM 758 O ASN A 49 -16.820 14.356 1.958 1.00 0.00 O ATOM 759 CB ASN A 49 -19.588 14.346 1.805 1.00 0.00 C ATOM 760 CG ASN A 49 -20.860 14.920 1.214 1.00 0.00 C ATOM 761 OD1 ASN A 49 -20.930 16.108 0.899 1.00 0.00 O ATOM 762 ND2 ASN A 49 -21.875 14.077 1.062 1.00 0.00 N ATOM 0 H ASN A 49 -19.359 11.664 0.164 1.00 0.00 H new ATOM 0 HA ASN A 49 -19.108 13.837 -0.227 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -19.842 13.680 2.630 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -18.987 15.154 2.222 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -22.757 14.406 0.670 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -21.772 13.100 1.337 1.00 0.00 H new ATOM 769 N GLN A 50 -16.567 13.878 -0.226 1.00 0.00 N ATOM 770 CA GLN A 50 -15.150 14.223 -0.249 1.00 0.00 C ATOM 771 C GLN A 50 -14.868 15.289 -1.302 1.00 0.00 C ATOM 772 O GLN A 50 -15.351 15.204 -2.431 1.00 0.00 O ATOM 773 CB GLN A 50 -14.305 12.980 -0.526 1.00 0.00 C ATOM 774 CG GLN A 50 -14.550 11.845 0.455 1.00 0.00 C ATOM 775 CD GLN A 50 -14.152 12.205 1.874 1.00 0.00 C ATOM 776 OE1 GLN A 50 -15.000 12.525 2.707 1.00 0.00 O ATOM 777 NE2 GLN A 50 -12.855 12.154 2.156 1.00 0.00 N ATOM 0 H GLN A 50 -16.940 13.564 -1.122 1.00 0.00 H new ATOM 0 HA GLN A 50 -14.883 14.624 0.729 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -14.514 12.627 -1.536 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -13.250 13.254 -0.495 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -15.606 11.574 0.435 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -13.989 10.966 0.136 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -12.187 11.883 1.435 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -12.528 12.385 3.094 1.00 0.00 H new ATOM 786 N LYS A 51 -14.083 16.293 -0.926 1.00 0.00 N ATOM 787 CA LYS A 51 -13.734 17.377 -1.838 1.00 0.00 C ATOM 788 C LYS A 51 -13.036 16.838 -3.085 1.00 0.00 C ATOM 789 O LYS A 51 -13.099 17.446 -4.153 1.00 0.00 O ATOM 790 CB LYS A 51 -12.834 18.394 -1.132 1.00 0.00 C ATOM 791 CG LYS A 51 -13.320 19.829 -1.263 1.00 0.00 C ATOM 792 CD LYS A 51 -12.611 20.750 -0.283 1.00 0.00 C ATOM 793 CE LYS A 51 -13.576 21.734 0.357 1.00 0.00 C ATOM 794 NZ LYS A 51 -14.411 21.092 1.409 1.00 0.00 N ATOM 0 H LYS A 51 -13.676 16.379 0.005 1.00 0.00 H new ATOM 0 HA LYS A 51 -14.656 17.870 -2.147 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -12.768 18.136 -0.075 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -11.826 18.321 -1.541 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -13.151 20.180 -2.281 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -14.395 19.867 -1.087 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -12.129 20.155 0.493 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -11.823 21.297 -0.801 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -13.015 22.560 0.794 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -14.223 22.159 -0.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -15.055 21.798 1.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -14.966 20.320 0.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -13.796 20.709 2.155 1.00 0.00 H new ATOM 808 N ASP A 52 -12.374 15.695 -2.940 1.00 0.00 N ATOM 809 CA ASP A 52 -11.665 15.075 -4.053 1.00 0.00 C ATOM 810 C ASP A 52 -12.488 13.937 -4.659 1.00 0.00 C ATOM 811 O ASP A 52 -12.573 12.852 -4.084 1.00 0.00 O ATOM 812 CB ASP A 52 -10.309 14.544 -3.587 1.00 0.00 C ATOM 813 CG ASP A 52 -9.206 15.575 -3.723 1.00 0.00 C ATOM 814 OD1 ASP A 52 -9.490 16.777 -3.534 1.00 0.00 O ATOM 815 OD2 ASP A 52 -8.059 15.182 -4.020 1.00 0.00 O ATOM 0 H ASP A 52 -12.314 15.179 -2.062 1.00 0.00 H new ATOM 0 HA ASP A 52 -11.508 15.834 -4.819 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -10.383 14.231 -2.546 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -10.049 13.659 -4.168 1.00 0.00 H new ATOM 820 N PRO A 53 -13.111 14.169 -5.830 1.00 0.00 N ATOM 821 CA PRO A 53 -13.928 13.158 -6.503 1.00 0.00 C ATOM 822 C PRO A 53 -13.095 12.158 -7.304 1.00 0.00 C ATOM 823 O PRO A 53 -13.642 11.310 -8.008 1.00 0.00 O ATOM 824 CB PRO A 53 -14.795 13.996 -7.438 1.00 0.00 C ATOM 825 CG PRO A 53 -13.937 15.161 -7.793 1.00 0.00 C ATOM 826 CD PRO A 53 -13.073 15.436 -6.588 1.00 0.00 C ATOM 0 HA PRO A 53 -14.487 12.546 -5.795 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -15.085 13.431 -8.324 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -15.715 14.315 -6.948 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -13.325 14.940 -8.668 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -14.546 16.030 -8.041 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -12.055 15.699 -6.877 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -13.461 16.267 -5.999 1.00 0.00 H new ATOM 834 N GLY A 54 -11.772 12.261 -7.198 1.00 0.00 N ATOM 835 CA GLY A 54 -10.898 11.358 -7.924 1.00 0.00 C ATOM 836 C GLY A 54 -10.276 10.297 -7.034 1.00 0.00 C ATOM 837 O GLY A 54 -9.688 9.335 -7.527 1.00 0.00 O ATOM 0 H GLY A 54 -11.292 12.953 -6.623 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -11.464 10.872 -8.719 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -10.106 11.934 -8.403 1.00 0.00 H new ATOM 841 N VAL A 55 -10.399 10.471 -5.720 1.00 0.00 N ATOM 842 CA VAL A 55 -9.841 9.520 -4.764 1.00 0.00 C ATOM 843 C VAL A 55 -10.304 8.096 -5.060 1.00 0.00 C ATOM 844 O VAL A 55 -9.490 7.210 -5.315 1.00 0.00 O ATOM 845 CB VAL A 55 -10.228 9.892 -3.319 1.00 0.00 C ATOM 846 CG1 VAL A 55 -9.549 8.965 -2.325 1.00 0.00 C ATOM 847 CG2 VAL A 55 -9.877 11.343 -3.029 1.00 0.00 C ATOM 0 H VAL A 55 -10.881 11.263 -5.294 1.00 0.00 H new ATOM 0 HA VAL A 55 -8.757 9.566 -4.866 1.00 0.00 H new ATOM 0 HB VAL A 55 -11.306 9.773 -3.212 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -9.836 9.245 -1.311 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -9.856 7.937 -2.518 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -8.467 9.047 -2.432 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -10.157 11.587 -2.004 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -8.805 11.490 -3.157 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -10.417 11.993 -3.718 1.00 0.00 H new ATOM 857 N LEU A 56 -11.615 7.885 -5.027 1.00 0.00 N ATOM 858 CA LEU A 56 -12.183 6.577 -5.294 1.00 0.00 C ATOM 859 C LEU A 56 -11.977 6.194 -6.755 1.00 0.00 C ATOM 860 O LEU A 56 -11.482 5.113 -7.065 1.00 0.00 O ATOM 861 CB LEU A 56 -13.677 6.595 -4.971 1.00 0.00 C ATOM 862 CG LEU A 56 -14.508 5.589 -5.757 1.00 0.00 C ATOM 863 CD1 LEU A 56 -15.670 5.088 -4.925 1.00 0.00 C ATOM 864 CD2 LEU A 56 -15.001 6.192 -7.065 1.00 0.00 C ATOM 0 H LEU A 56 -12.303 8.608 -4.817 1.00 0.00 H new ATOM 0 HA LEU A 56 -11.681 5.840 -4.667 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -13.807 6.401 -3.906 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -14.065 7.595 -5.163 1.00 0.00 H new ATOM 0 HG LEU A 56 -13.869 4.739 -5.998 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -16.250 4.371 -5.505 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -15.291 4.604 -4.025 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -16.306 5.928 -4.645 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -15.591 5.453 -7.607 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -15.618 7.065 -6.853 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -14.147 6.490 -7.673 1.00 0.00 H new ATOM 876 N ASP A 57 -12.370 7.092 -7.645 1.00 0.00 N ATOM 877 CA ASP A 57 -12.242 6.858 -9.078 1.00 0.00 C ATOM 878 C ASP A 57 -10.801 6.522 -9.448 1.00 0.00 C ATOM 879 O ASP A 57 -10.551 5.830 -10.434 1.00 0.00 O ATOM 880 CB ASP A 57 -12.710 8.088 -9.855 1.00 0.00 C ATOM 881 CG ASP A 57 -13.440 7.723 -11.133 1.00 0.00 C ATOM 882 OD1 ASP A 57 -12.926 6.871 -11.888 1.00 0.00 O ATOM 883 OD2 ASP A 57 -14.526 8.289 -11.379 1.00 0.00 O ATOM 0 H ASP A 57 -12.782 7.993 -7.401 1.00 0.00 H new ATOM 0 HA ASP A 57 -12.870 6.008 -9.343 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -13.367 8.685 -9.223 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -11.849 8.710 -10.097 1.00 0.00 H new ATOM 888 N ARG A 58 -9.857 7.007 -8.648 1.00 0.00 N ATOM 889 CA ARG A 58 -8.444 6.746 -8.895 1.00 0.00 C ATOM 890 C ARG A 58 -8.151 5.251 -8.819 1.00 0.00 C ATOM 891 O ARG A 58 -7.482 4.697 -9.692 1.00 0.00 O ATOM 892 CB ARG A 58 -7.576 7.505 -7.887 1.00 0.00 C ATOM 893 CG ARG A 58 -6.967 8.781 -8.450 1.00 0.00 C ATOM 894 CD ARG A 58 -5.451 8.783 -8.324 1.00 0.00 C ATOM 895 NE ARG A 58 -4.994 9.623 -7.217 1.00 0.00 N ATOM 896 CZ ARG A 58 -3.715 9.904 -6.978 1.00 0.00 C ATOM 897 NH1 ARG A 58 -2.763 9.416 -7.764 1.00 0.00 N ATOM 898 NH2 ARG A 58 -3.387 10.676 -5.951 1.00 0.00 N ATOM 0 H ARG A 58 -10.044 7.581 -7.826 1.00 0.00 H new ATOM 0 HA ARG A 58 -8.203 7.096 -9.899 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -8.180 7.754 -7.015 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -6.775 6.850 -7.544 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -7.245 8.885 -9.499 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -7.377 9.643 -7.924 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -5.098 7.763 -8.174 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -5.010 9.139 -9.255 1.00 0.00 H new ATOM 0 HE ARG A 58 -5.697 10.017 -6.591 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -3.010 8.822 -8.556 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -1.785 9.635 -7.576 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -4.115 11.054 -5.344 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -2.407 10.892 -5.768 1.00 0.00 H new ATOM 911 N MET A 59 -8.652 4.600 -7.772 1.00 0.00 N ATOM 912 CA MET A 59 -8.437 3.168 -7.593 1.00 0.00 C ATOM 913 C MET A 59 -9.199 2.366 -8.639 1.00 0.00 C ATOM 914 O MET A 59 -8.619 1.545 -9.347 1.00 0.00 O ATOM 915 CB MET A 59 -8.847 2.737 -6.178 1.00 0.00 C ATOM 916 CG MET A 59 -10.328 2.436 -5.992 1.00 0.00 C ATOM 917 SD MET A 59 -10.698 1.655 -4.409 1.00 0.00 S ATOM 918 CE MET A 59 -9.703 2.657 -3.326 1.00 0.00 C ATOM 0 H MET A 59 -9.207 5.040 -7.038 1.00 0.00 H new ATOM 0 HA MET A 59 -7.374 2.966 -7.723 1.00 0.00 H new ATOM 0 HB2 MET A 59 -8.276 1.849 -5.907 1.00 0.00 H new ATOM 0 HB3 MET A 59 -8.563 3.524 -5.480 1.00 0.00 H new ATOM 0 HG2 MET A 59 -10.894 3.364 -6.074 1.00 0.00 H new ATOM 0 HG3 MET A 59 -10.664 1.785 -6.799 1.00 0.00 H new ATOM 0 HE1 MET A 59 -9.291 2.035 -2.531 1.00 0.00 H new ATOM 0 HE2 MET A 59 -8.889 3.108 -3.893 1.00 0.00 H new ATOM 0 HE3 MET A 59 -10.319 3.443 -2.889 1.00 0.00 H new ATOM 928 N MET A 60 -10.499 2.616 -8.732 1.00 0.00 N ATOM 929 CA MET A 60 -11.339 1.914 -9.696 1.00 0.00 C ATOM 930 C MET A 60 -10.857 2.162 -11.118 1.00 0.00 C ATOM 931 O MET A 60 -11.069 1.343 -12.011 1.00 0.00 O ATOM 932 CB MET A 60 -12.798 2.345 -9.550 1.00 0.00 C ATOM 933 CG MET A 60 -13.594 1.440 -8.626 1.00 0.00 C ATOM 934 SD MET A 60 -14.487 2.351 -7.361 1.00 0.00 S ATOM 935 CE MET A 60 -13.233 2.384 -6.093 1.00 0.00 C ATOM 0 H MET A 60 -10.993 3.296 -8.155 1.00 0.00 H new ATOM 0 HA MET A 60 -11.267 0.846 -9.491 1.00 0.00 H new ATOM 0 HB2 MET A 60 -12.833 3.366 -9.169 1.00 0.00 H new ATOM 0 HB3 MET A 60 -13.268 2.355 -10.533 1.00 0.00 H new ATOM 0 HG2 MET A 60 -14.302 0.858 -9.216 1.00 0.00 H new ATOM 0 HG3 MET A 60 -12.918 0.731 -8.148 1.00 0.00 H new ATOM 0 HE1 MET A 60 -13.703 2.529 -5.120 1.00 0.00 H new ATOM 0 HE2 MET A 60 -12.688 1.440 -6.096 1.00 0.00 H new ATOM 0 HE3 MET A 60 -12.541 3.203 -6.287 1.00 0.00 H new ATOM 945 N LYS A 61 -10.199 3.297 -11.319 1.00 0.00 N ATOM 946 CA LYS A 61 -9.678 3.651 -12.634 1.00 0.00 C ATOM 947 C LYS A 61 -8.659 2.616 -13.106 1.00 0.00 C ATOM 948 O LYS A 61 -8.839 1.982 -14.146 1.00 0.00 O ATOM 949 CB LYS A 61 -9.032 5.038 -12.597 1.00 0.00 C ATOM 950 CG LYS A 61 -9.952 6.149 -13.077 1.00 0.00 C ATOM 951 CD LYS A 61 -9.484 7.510 -12.587 1.00 0.00 C ATOM 952 CE LYS A 61 -10.385 8.624 -13.095 1.00 0.00 C ATOM 953 NZ LYS A 61 -10.566 8.562 -14.572 1.00 0.00 N ATOM 0 H LYS A 61 -10.014 3.987 -10.591 1.00 0.00 H new ATOM 0 HA LYS A 61 -10.511 3.667 -13.336 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -8.715 5.255 -11.577 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.134 5.028 -13.215 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -9.990 6.146 -14.166 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -10.966 5.962 -12.722 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -9.470 7.520 -11.497 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -8.462 7.686 -12.921 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -11.357 8.556 -12.607 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -9.958 9.589 -12.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -10.667 9.526 -14.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.738 8.105 -15.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -11.420 8.012 -14.794 1.00 0.00 H new ATOM 967 N LYS A 62 -7.590 2.453 -12.334 1.00 0.00 N ATOM 968 CA LYS A 62 -6.538 1.499 -12.670 1.00 0.00 C ATOM 969 C LYS A 62 -6.922 0.071 -12.278 1.00 0.00 C ATOM 970 O LYS A 62 -6.197 -0.876 -12.582 1.00 0.00 O ATOM 971 CB LYS A 62 -5.230 1.891 -11.979 1.00 0.00 C ATOM 972 CG LYS A 62 -4.005 1.746 -12.868 1.00 0.00 C ATOM 973 CD LYS A 62 -3.875 0.331 -13.410 1.00 0.00 C ATOM 974 CE LYS A 62 -2.648 0.183 -14.296 1.00 0.00 C ATOM 975 NZ LYS A 62 -1.621 -0.703 -13.679 1.00 0.00 N ATOM 0 H LYS A 62 -7.429 2.970 -11.470 1.00 0.00 H new ATOM 0 HA LYS A 62 -6.403 1.526 -13.751 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -5.303 2.925 -11.641 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -5.099 1.273 -11.090 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -4.071 2.450 -13.698 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -3.110 2.004 -12.301 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -3.813 -0.373 -12.580 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -4.769 0.075 -13.979 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -2.945 -0.224 -15.263 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -2.215 1.165 -14.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -0.801 -0.778 -14.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -1.318 -0.302 -12.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -2.026 -1.648 -13.524 1.00 0.00 H new ATOM 989 N LEU A 63 -8.057 -0.083 -11.597 1.00 0.00 N ATOM 990 CA LEU A 63 -8.515 -1.395 -11.166 1.00 0.00 C ATOM 991 C LEU A 63 -9.223 -2.145 -12.299 1.00 0.00 C ATOM 992 O LEU A 63 -9.768 -3.226 -12.087 1.00 0.00 O ATOM 993 CB LEU A 63 -9.425 -1.219 -9.941 1.00 0.00 C ATOM 994 CG LEU A 63 -10.718 -2.038 -9.896 1.00 0.00 C ATOM 995 CD1 LEU A 63 -11.359 -1.882 -8.533 1.00 0.00 C ATOM 996 CD2 LEU A 63 -11.685 -1.597 -10.990 1.00 0.00 C ATOM 0 H LEU A 63 -8.673 0.686 -11.334 1.00 0.00 H new ATOM 0 HA LEU A 63 -7.656 -2.007 -10.889 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -8.843 -1.461 -9.052 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -9.692 -0.165 -9.869 1.00 0.00 H new ATOM 0 HG LEU A 63 -10.477 -3.087 -10.070 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -12.280 -2.463 -8.496 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -10.673 -2.240 -7.765 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -11.586 -0.831 -8.356 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -12.594 -2.195 -10.935 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -11.934 -0.545 -10.853 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -11.219 -1.735 -11.965 1.00 0.00 H new ATOM 1008 N ASP A 64 -9.210 -1.574 -13.503 1.00 0.00 N ATOM 1009 CA ASP A 64 -9.849 -2.207 -14.654 1.00 0.00 C ATOM 1010 C ASP A 64 -9.295 -3.613 -14.875 1.00 0.00 C ATOM 1011 O ASP A 64 -8.372 -3.811 -15.666 1.00 0.00 O ATOM 1012 CB ASP A 64 -9.644 -1.355 -15.909 1.00 0.00 C ATOM 1013 CG ASP A 64 -10.950 -1.026 -16.605 1.00 0.00 C ATOM 1014 OD1 ASP A 64 -11.850 -0.468 -15.943 1.00 0.00 O ATOM 1015 OD2 ASP A 64 -11.072 -1.325 -17.811 1.00 0.00 O ATOM 0 H ASP A 64 -8.766 -0.678 -13.705 1.00 0.00 H new ATOM 0 HA ASP A 64 -10.917 -2.286 -14.452 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -9.137 -0.429 -15.637 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -8.990 -1.885 -16.602 1.00 0.00 H new ATOM 1020 N LEU A 65 -9.860 -4.583 -14.165 1.00 0.00 N ATOM 1021 CA LEU A 65 -9.422 -5.968 -14.274 1.00 0.00 C ATOM 1022 C LEU A 65 -9.890 -6.585 -15.589 1.00 0.00 C ATOM 1023 O LEU A 65 -11.089 -6.716 -15.834 1.00 0.00 O ATOM 1024 CB LEU A 65 -9.954 -6.787 -13.093 1.00 0.00 C ATOM 1025 CG LEU A 65 -8.999 -6.918 -11.902 1.00 0.00 C ATOM 1026 CD1 LEU A 65 -7.626 -7.384 -12.363 1.00 0.00 C ATOM 1027 CD2 LEU A 65 -8.891 -5.596 -11.152 1.00 0.00 C ATOM 0 H LEU A 65 -10.624 -4.434 -13.506 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.332 -5.982 -14.255 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -10.881 -6.332 -12.745 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.203 -7.787 -13.449 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.404 -7.667 -11.221 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.963 -7.471 -11.502 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -7.716 -8.355 -12.851 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -7.214 -6.661 -13.067 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -8.208 -5.710 -10.310 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -8.512 -4.826 -11.824 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.875 -5.305 -10.784 1.00 0.00 H new ATOM 1039 N ASN A 66 -8.933 -6.961 -16.432 1.00 0.00 N ATOM 1040 CA ASN A 66 -9.244 -7.564 -17.722 1.00 0.00 C ATOM 1041 C ASN A 66 -8.809 -9.025 -17.755 1.00 0.00 C ATOM 1042 O ASN A 66 -9.535 -9.888 -18.248 1.00 0.00 O ATOM 1043 CB ASN A 66 -8.559 -6.788 -18.849 1.00 0.00 C ATOM 1044 CG ASN A 66 -9.454 -6.624 -20.062 1.00 0.00 C ATOM 1045 OD1 ASN A 66 -9.908 -7.606 -20.651 1.00 0.00 O ATOM 1046 ND2 ASN A 66 -9.712 -5.379 -20.443 1.00 0.00 N ATOM 0 H ASN A 66 -7.936 -6.858 -16.244 1.00 0.00 H new ATOM 0 HA ASN A 66 -10.324 -7.521 -17.867 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -8.264 -5.805 -18.483 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -7.646 -7.307 -19.141 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -10.307 -5.207 -21.253 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -9.315 -4.595 -19.926 1.00 0.00 H new ATOM 1053 N SER A 67 -7.619 -9.294 -17.230 1.00 0.00 N ATOM 1054 CA SER A 67 -7.088 -10.653 -17.199 1.00 0.00 C ATOM 1055 C SER A 67 -7.284 -11.283 -15.829 1.00 0.00 C ATOM 1056 O SER A 67 -7.510 -10.585 -14.840 1.00 0.00 O ATOM 1057 CB SER A 67 -5.604 -10.655 -17.574 1.00 0.00 C ATOM 1058 OG SER A 67 -5.311 -11.694 -18.491 1.00 0.00 O ATOM 0 H SER A 67 -7.004 -8.591 -16.821 1.00 0.00 H new ATOM 0 HA SER A 67 -7.637 -11.247 -17.930 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.335 -9.693 -18.011 1.00 0.00 H new ATOM 0 HB3 SER A 67 -4.999 -10.777 -16.676 1.00 0.00 H new ATOM 0 HG SER A 67 -4.357 -11.673 -18.716 1.00 0.00 H new ATOM 1064 N ASP A 68 -7.206 -12.610 -15.779 1.00 0.00 N ATOM 1065 CA ASP A 68 -7.384 -13.351 -14.532 1.00 0.00 C ATOM 1066 C ASP A 68 -8.860 -13.423 -14.154 1.00 0.00 C ATOM 1067 O ASP A 68 -9.398 -14.504 -13.918 1.00 0.00 O ATOM 1068 CB ASP A 68 -6.583 -12.709 -13.395 1.00 0.00 C ATOM 1069 CG ASP A 68 -5.187 -12.300 -13.827 1.00 0.00 C ATOM 1070 OD1 ASP A 68 -4.261 -13.130 -13.704 1.00 0.00 O ATOM 1071 OD2 ASP A 68 -5.020 -11.151 -14.285 1.00 0.00 O ATOM 0 H ASP A 68 -7.020 -13.197 -16.592 1.00 0.00 H new ATOM 0 HA ASP A 68 -7.012 -14.363 -14.690 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -7.118 -11.833 -13.028 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -6.512 -13.411 -12.564 1.00 0.00 H new ATOM 1076 N GLY A 69 -9.510 -12.263 -14.095 1.00 0.00 N ATOM 1077 CA GLY A 69 -10.914 -12.217 -13.742 1.00 0.00 C ATOM 1078 C GLY A 69 -11.124 -11.982 -12.263 1.00 0.00 C ATOM 1079 O GLY A 69 -12.168 -12.331 -11.713 1.00 0.00 O ATOM 0 H GLY A 69 -9.087 -11.355 -14.286 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -11.403 -11.424 -14.307 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -11.390 -13.154 -14.030 1.00 0.00 H new ATOM 1083 N GLN A 70 -10.125 -11.390 -11.613 1.00 0.00 N ATOM 1084 CA GLN A 70 -10.204 -11.114 -10.184 1.00 0.00 C ATOM 1085 C GLN A 70 -9.282 -9.964 -9.787 1.00 0.00 C ATOM 1086 O GLN A 70 -8.428 -9.546 -10.567 1.00 0.00 O ATOM 1087 CB GLN A 70 -9.846 -12.370 -9.383 1.00 0.00 C ATOM 1088 CG GLN A 70 -11.057 -13.182 -8.951 1.00 0.00 C ATOM 1089 CD GLN A 70 -11.817 -12.520 -7.821 1.00 0.00 C ATOM 1090 OE1 GLN A 70 -12.612 -11.509 -8.153 1.00 0.00 O flip ATOM 1091 NE2 GLN A 70 -11.694 -12.915 -6.662 1.00 0.00 N flip ATOM 0 H GLN A 70 -9.254 -11.093 -12.053 1.00 0.00 H new ATOM 0 HA GLN A 70 -11.229 -10.820 -9.957 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -9.192 -13.001 -9.985 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -9.281 -12.078 -8.498 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -11.723 -13.319 -9.803 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -10.733 -14.174 -8.636 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -11.072 -13.696 -6.453 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -12.214 -12.462 -5.911 1.00 0.00 H new ATOM 1100 N LEU A 71 -9.460 -9.465 -8.565 1.00 0.00 N ATOM 1101 CA LEU A 71 -8.642 -8.371 -8.060 1.00 0.00 C ATOM 1102 C LEU A 71 -7.179 -8.833 -7.943 1.00 0.00 C ATOM 1103 O LEU A 71 -6.660 -9.440 -8.880 1.00 0.00 O ATOM 1104 CB LEU A 71 -9.218 -7.877 -6.718 1.00 0.00 C ATOM 1105 CG LEU A 71 -9.982 -6.540 -6.749 1.00 0.00 C ATOM 1106 CD1 LEU A 71 -9.087 -5.401 -6.276 1.00 0.00 C ATOM 1107 CD2 LEU A 71 -10.541 -6.243 -8.134 1.00 0.00 C ATOM 0 H LEU A 71 -10.164 -9.803 -7.909 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.660 -7.528 -8.751 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.889 -8.644 -6.331 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -8.397 -7.784 -6.008 1.00 0.00 H new ATOM 0 HG LEU A 71 -10.827 -6.628 -6.066 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -9.644 -4.465 -6.305 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.758 -5.596 -5.255 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -8.218 -5.326 -6.929 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -11.073 -5.292 -8.115 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -9.723 -6.187 -8.852 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -11.228 -7.037 -8.427 1.00 0.00 H new ATOM 1119 N ASP A 72 -6.508 -8.569 -6.817 1.00 0.00 N ATOM 1120 CA ASP A 72 -5.118 -8.994 -6.658 1.00 0.00 C ATOM 1121 C ASP A 72 -4.537 -8.515 -5.333 1.00 0.00 C ATOM 1122 O ASP A 72 -5.254 -7.998 -4.477 1.00 0.00 O ATOM 1123 CB ASP A 72 -4.257 -8.475 -7.816 1.00 0.00 C ATOM 1124 CG ASP A 72 -3.241 -9.498 -8.286 1.00 0.00 C ATOM 1125 OD1 ASP A 72 -3.484 -10.707 -8.095 1.00 0.00 O ATOM 1126 OD2 ASP A 72 -2.203 -9.087 -8.846 1.00 0.00 O ATOM 0 H ASP A 72 -6.898 -8.072 -6.016 1.00 0.00 H new ATOM 0 HA ASP A 72 -5.109 -10.084 -6.664 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -4.903 -8.199 -8.650 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -3.738 -7.570 -7.502 1.00 0.00 H new ATOM 1131 N PHE A 73 -3.229 -8.697 -5.174 1.00 0.00 N ATOM 1132 CA PHE A 73 -2.540 -8.293 -3.956 1.00 0.00 C ATOM 1133 C PHE A 73 -2.298 -6.786 -3.924 1.00 0.00 C ATOM 1134 O PHE A 73 -2.694 -6.109 -2.974 1.00 0.00 O ATOM 1135 CB PHE A 73 -1.214 -9.041 -3.824 1.00 0.00 C ATOM 1136 CG PHE A 73 -0.206 -8.679 -4.877 1.00 0.00 C ATOM 1137 CD1 PHE A 73 -0.237 -9.284 -6.124 1.00 0.00 C ATOM 1138 CD2 PHE A 73 0.771 -7.732 -4.619 1.00 0.00 C ATOM 1139 CE1 PHE A 73 0.689 -8.950 -7.093 1.00 0.00 C ATOM 1140 CE2 PHE A 73 1.700 -7.394 -5.585 1.00 0.00 C ATOM 1141 CZ PHE A 73 1.660 -8.004 -6.824 1.00 0.00 C ATOM 0 H PHE A 73 -2.625 -9.123 -5.877 1.00 0.00 H new ATOM 0 HA PHE A 73 -3.181 -8.548 -3.112 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -0.789 -8.837 -2.842 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -1.406 -10.113 -3.871 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -0.993 -10.024 -6.340 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.807 -7.252 -3.652 1.00 0.00 H new ATOM 0 HE1 PHE A 73 0.654 -9.428 -8.061 1.00 0.00 H new ATOM 0 HE2 PHE A 73 2.457 -6.654 -5.371 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.385 -7.742 -7.580 1.00 0.00 H new ATOM 1151 N GLN A 74 -1.652 -6.258 -4.961 1.00 0.00 N ATOM 1152 CA GLN A 74 -1.382 -4.830 -5.016 1.00 0.00 C ATOM 1153 C GLN A 74 -2.632 -4.073 -5.417 1.00 0.00 C ATOM 1154 O GLN A 74 -2.823 -2.935 -5.008 1.00 0.00 O ATOM 1155 CB GLN A 74 -0.242 -4.506 -5.984 1.00 0.00 C ATOM 1156 CG GLN A 74 0.072 -3.014 -6.074 1.00 0.00 C ATOM 1157 CD GLN A 74 0.158 -2.343 -4.711 1.00 0.00 C ATOM 1158 OE1 GLN A 74 0.616 -2.946 -3.741 1.00 0.00 O ATOM 1159 NE2 GLN A 74 -0.282 -1.086 -4.629 1.00 0.00 N ATOM 0 H GLN A 74 -1.312 -6.791 -5.761 1.00 0.00 H new ATOM 0 HA GLN A 74 -1.074 -4.516 -4.019 1.00 0.00 H new ATOM 0 HB2 GLN A 74 0.655 -5.040 -5.669 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -0.502 -4.876 -6.976 1.00 0.00 H new ATOM 0 HG2 GLN A 74 1.017 -2.878 -6.600 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -0.698 -2.521 -6.668 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -0.655 -0.621 -5.457 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -0.246 -0.590 -3.738 1.00 0.00 H new ATOM 1168 N GLU A 75 -3.491 -4.708 -6.214 1.00 0.00 N ATOM 1169 CA GLU A 75 -4.727 -4.072 -6.649 1.00 0.00 C ATOM 1170 C GLU A 75 -5.403 -3.382 -5.471 1.00 0.00 C ATOM 1171 O GLU A 75 -6.023 -2.331 -5.629 1.00 0.00 O ATOM 1172 CB GLU A 75 -5.665 -5.097 -7.285 1.00 0.00 C ATOM 1173 CG GLU A 75 -5.884 -4.859 -8.768 1.00 0.00 C ATOM 1174 CD GLU A 75 -5.617 -6.092 -9.609 1.00 0.00 C ATOM 1175 OE1 GLU A 75 -6.543 -6.913 -9.772 1.00 0.00 O ATOM 1176 OE2 GLU A 75 -4.480 -6.235 -10.106 1.00 0.00 O ATOM 0 H GLU A 75 -3.353 -5.655 -6.567 1.00 0.00 H new ATOM 0 HA GLU A 75 -4.487 -3.321 -7.402 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -5.255 -6.096 -7.140 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -6.626 -5.069 -6.772 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -6.910 -4.530 -8.930 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -5.233 -4.050 -9.101 1.00 0.00 H new ATOM 1183 N PHE A 76 -5.249 -3.965 -4.284 1.00 0.00 N ATOM 1184 CA PHE A 76 -5.817 -3.382 -3.078 1.00 0.00 C ATOM 1185 C PHE A 76 -4.921 -2.266 -2.574 1.00 0.00 C ATOM 1186 O PHE A 76 -5.364 -1.133 -2.391 1.00 0.00 O ATOM 1187 CB PHE A 76 -5.997 -4.430 -1.982 1.00 0.00 C ATOM 1188 CG PHE A 76 -7.091 -4.072 -1.018 1.00 0.00 C ATOM 1189 CD1 PHE A 76 -6.991 -2.937 -0.228 1.00 0.00 C ATOM 1190 CD2 PHE A 76 -8.226 -4.860 -0.909 1.00 0.00 C ATOM 1191 CE1 PHE A 76 -8.001 -2.597 0.652 1.00 0.00 C ATOM 1192 CE2 PHE A 76 -9.239 -4.523 -0.030 1.00 0.00 C ATOM 1193 CZ PHE A 76 -9.125 -3.391 0.751 1.00 0.00 C ATOM 0 H PHE A 76 -4.738 -4.835 -4.135 1.00 0.00 H new ATOM 0 HA PHE A 76 -6.799 -2.982 -3.330 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -6.221 -5.394 -2.439 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -5.060 -4.545 -1.437 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -6.114 -2.311 -0.301 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -8.320 -5.747 -1.517 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -7.910 -1.710 1.262 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -10.119 -5.145 0.045 1.00 0.00 H new ATOM 0 HZ PHE A 76 -9.915 -3.127 1.439 1.00 0.00 H new ATOM 1203 N LEU A 77 -3.646 -2.586 -2.368 1.00 0.00 N ATOM 1204 CA LEU A 77 -2.682 -1.601 -1.907 1.00 0.00 C ATOM 1205 C LEU A 77 -2.667 -0.414 -2.864 1.00 0.00 C ATOM 1206 O LEU A 77 -2.489 0.728 -2.453 1.00 0.00 O ATOM 1207 CB LEU A 77 -1.293 -2.226 -1.782 1.00 0.00 C ATOM 1208 CG LEU A 77 -0.958 -2.735 -0.380 1.00 0.00 C ATOM 1209 CD1 LEU A 77 0.247 -3.662 -0.409 1.00 0.00 C ATOM 1210 CD2 LEU A 77 -0.720 -1.561 0.554 1.00 0.00 C ATOM 0 H LEU A 77 -3.261 -3.519 -2.514 1.00 0.00 H new ATOM 0 HA LEU A 77 -2.975 -1.248 -0.918 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.215 -3.055 -2.485 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.547 -1.488 -2.076 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.805 -3.311 -0.007 1.00 0.00 H new ATOM 0 HD11 LEU A 77 0.463 -4.009 0.601 1.00 0.00 H new ATOM 0 HD12 LEU A 77 0.032 -4.518 -1.049 1.00 0.00 H new ATOM 0 HD13 LEU A 77 1.111 -3.124 -0.800 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.482 -1.932 1.551 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.111 -0.962 0.181 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.618 -0.945 0.601 1.00 0.00 H new ATOM 1222 N ASN A 78 -2.892 -0.703 -4.141 1.00 0.00 N ATOM 1223 CA ASN A 78 -2.948 0.328 -5.164 1.00 0.00 C ATOM 1224 C ASN A 78 -4.283 1.052 -5.057 1.00 0.00 C ATOM 1225 O ASN A 78 -4.355 2.272 -5.192 1.00 0.00 O ATOM 1226 CB ASN A 78 -2.769 -0.292 -6.562 1.00 0.00 C ATOM 1227 CG ASN A 78 -3.637 0.356 -7.625 1.00 0.00 C ATOM 1228 OD1 ASN A 78 -3.425 1.510 -8.000 1.00 0.00 O ATOM 1229 ND2 ASN A 78 -4.622 -0.386 -8.117 1.00 0.00 N ATOM 0 H ASN A 78 -3.039 -1.650 -4.491 1.00 0.00 H new ATOM 0 HA ASN A 78 -2.138 1.042 -5.014 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -1.723 -0.208 -6.857 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -3.002 -1.356 -6.512 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -5.239 -0.004 -8.834 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -4.762 -1.338 -7.778 1.00 0.00 H new ATOM 1236 N LEU A 79 -5.341 0.283 -4.796 1.00 0.00 N ATOM 1237 CA LEU A 79 -6.668 0.851 -4.654 1.00 0.00 C ATOM 1238 C LEU A 79 -6.708 1.770 -3.436 1.00 0.00 C ATOM 1239 O LEU A 79 -7.009 2.957 -3.550 1.00 0.00 O ATOM 1240 CB LEU A 79 -7.719 -0.265 -4.507 1.00 0.00 C ATOM 1241 CG LEU A 79 -8.573 -0.570 -5.753 1.00 0.00 C ATOM 1242 CD1 LEU A 79 -7.725 -0.631 -7.009 1.00 0.00 C ATOM 1243 CD2 LEU A 79 -9.333 -1.873 -5.570 1.00 0.00 C ATOM 0 H LEU A 79 -5.298 -0.730 -4.680 1.00 0.00 H new ATOM 0 HA LEU A 79 -6.900 1.429 -5.548 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -7.206 -1.180 -4.212 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -8.389 0.002 -3.690 1.00 0.00 H new ATOM 0 HG LEU A 79 -9.287 0.245 -5.870 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -8.361 -0.848 -7.867 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -7.228 0.327 -7.159 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -6.976 -1.416 -6.905 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -9.931 -2.073 -6.459 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -8.626 -2.688 -5.417 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -9.988 -1.793 -4.702 1.00 0.00 H new ATOM 1255 N ILE A 80 -6.382 1.213 -2.272 1.00 0.00 N ATOM 1256 CA ILE A 80 -6.367 1.978 -1.035 1.00 0.00 C ATOM 1257 C ILE A 80 -5.176 2.929 -0.991 1.00 0.00 C ATOM 1258 O ILE A 80 -5.314 4.092 -0.612 1.00 0.00 O ATOM 1259 CB ILE A 80 -6.363 1.070 0.212 1.00 0.00 C ATOM 1260 CG1 ILE A 80 -6.845 1.855 1.427 1.00 0.00 C ATOM 1261 CG2 ILE A 80 -4.983 0.502 0.474 1.00 0.00 C ATOM 1262 CD1 ILE A 80 -5.768 2.721 2.045 1.00 0.00 C ATOM 0 H ILE A 80 -6.125 0.232 -2.163 1.00 0.00 H new ATOM 0 HA ILE A 80 -7.287 2.562 -1.019 1.00 0.00 H new ATOM 0 HB ILE A 80 -7.040 0.236 0.027 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -7.685 2.485 1.134 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -7.216 1.158 2.178 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -5.013 -0.133 1.359 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -4.663 -0.087 -0.385 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -4.279 1.318 0.637 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -6.177 3.252 2.904 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -4.937 2.093 2.368 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -5.413 3.442 1.308 1.00 0.00 H new ATOM 1274 N GLY A 81 -4.005 2.435 -1.393 1.00 0.00 N ATOM 1275 CA GLY A 81 -2.819 3.272 -1.400 1.00 0.00 C ATOM 1276 C GLY A 81 -3.066 4.555 -2.159 1.00 0.00 C ATOM 1277 O GLY A 81 -2.809 5.646 -1.651 1.00 0.00 O ATOM 0 H GLY A 81 -3.859 1.477 -1.711 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -2.526 3.502 -0.376 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -1.990 2.730 -1.855 1.00 0.00 H new ATOM 1281 N GLY A 82 -3.596 4.424 -3.372 1.00 0.00 N ATOM 1282 CA GLY A 82 -3.904 5.598 -4.169 1.00 0.00 C ATOM 1283 C GLY A 82 -4.743 6.593 -3.389 1.00 0.00 C ATOM 1284 O GLY A 82 -4.575 7.804 -3.531 1.00 0.00 O ATOM 0 H GLY A 82 -3.816 3.532 -3.815 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -2.978 6.074 -4.491 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -4.438 5.298 -5.071 1.00 0.00 H new ATOM 1288 N LEU A 83 -5.639 6.081 -2.544 1.00 0.00 N ATOM 1289 CA LEU A 83 -6.481 6.944 -1.723 1.00 0.00 C ATOM 1290 C LEU A 83 -5.622 7.770 -0.784 1.00 0.00 C ATOM 1291 O LEU A 83 -5.815 8.976 -0.648 1.00 0.00 O ATOM 1292 CB LEU A 83 -7.476 6.121 -0.909 1.00 0.00 C ATOM 1293 CG LEU A 83 -8.098 4.946 -1.651 1.00 0.00 C ATOM 1294 CD1 LEU A 83 -9.215 4.331 -0.825 1.00 0.00 C ATOM 1295 CD2 LEU A 83 -8.608 5.391 -3.014 1.00 0.00 C ATOM 0 H LEU A 83 -5.798 5.082 -2.413 1.00 0.00 H new ATOM 0 HA LEU A 83 -7.036 7.606 -2.388 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -6.971 5.744 -0.020 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -8.275 6.779 -0.567 1.00 0.00 H new ATOM 0 HG LEU A 83 -7.334 4.185 -1.807 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -9.650 3.492 -1.369 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -8.813 3.979 0.125 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -9.984 5.080 -0.638 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -9.050 4.540 -3.533 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -9.361 6.168 -2.885 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -7.779 5.784 -3.602 1.00 0.00 H new ATOM 1307 N ALA A 84 -4.664 7.112 -0.136 1.00 0.00 N ATOM 1308 CA ALA A 84 -3.771 7.797 0.788 1.00 0.00 C ATOM 1309 C ALA A 84 -3.078 8.965 0.105 1.00 0.00 C ATOM 1310 O ALA A 84 -2.826 10.005 0.713 1.00 0.00 O ATOM 1311 CB ALA A 84 -2.726 6.837 1.320 1.00 0.00 C ATOM 0 H ALA A 84 -4.489 6.112 -0.234 1.00 0.00 H new ATOM 0 HA ALA A 84 -4.372 8.176 1.615 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.066 7.363 2.009 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -3.218 6.017 1.843 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.142 6.439 0.490 1.00 0.00 H new ATOM 1317 N VAL A 85 -2.772 8.778 -1.165 1.00 0.00 N ATOM 1318 CA VAL A 85 -2.102 9.808 -1.946 1.00 0.00 C ATOM 1319 C VAL A 85 -3.090 10.849 -2.440 1.00 0.00 C ATOM 1320 O VAL A 85 -2.705 11.946 -2.845 1.00 0.00 O ATOM 1321 CB VAL A 85 -1.307 9.230 -3.144 1.00 0.00 C ATOM 1322 CG1 VAL A 85 0.154 9.602 -3.008 1.00 0.00 C ATOM 1323 CG2 VAL A 85 -1.447 7.717 -3.254 1.00 0.00 C ATOM 0 H VAL A 85 -2.976 7.922 -1.681 1.00 0.00 H new ATOM 0 HA VAL A 85 -1.386 10.280 -1.273 1.00 0.00 H new ATOM 0 HB VAL A 85 -1.722 9.661 -4.055 1.00 0.00 H new ATOM 0 HG11 VAL A 85 0.713 9.195 -3.851 1.00 0.00 H new ATOM 0 HG12 VAL A 85 0.254 10.687 -2.996 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.549 9.192 -2.079 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -0.872 7.360 -4.108 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.072 7.250 -2.343 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -2.497 7.458 -3.389 1.00 0.00 H new ATOM 1333 N ALA A 86 -4.363 10.499 -2.410 1.00 0.00 N ATOM 1334 CA ALA A 86 -5.410 11.392 -2.858 1.00 0.00 C ATOM 1335 C ALA A 86 -6.363 11.752 -1.723 1.00 0.00 C ATOM 1336 O ALA A 86 -7.464 12.247 -1.961 1.00 0.00 O ATOM 1337 CB ALA A 86 -6.162 10.730 -3.987 1.00 0.00 C ATOM 0 H ALA A 86 -4.696 9.594 -2.077 1.00 0.00 H new ATOM 0 HA ALA A 86 -4.957 12.321 -3.205 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -6.955 11.393 -4.334 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -5.476 10.523 -4.809 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -6.599 9.796 -3.635 1.00 0.00 H new ATOM 1343 N CYS A 87 -5.942 11.493 -0.489 1.00 0.00 N ATOM 1344 CA CYS A 87 -6.782 11.788 0.667 1.00 0.00 C ATOM 1345 C CYS A 87 -5.986 11.864 1.974 1.00 0.00 C ATOM 1346 O CYS A 87 -6.402 12.550 2.908 1.00 0.00 O ATOM 1347 CB CYS A 87 -7.884 10.733 0.795 1.00 0.00 C ATOM 1348 SG CYS A 87 -9.510 11.412 1.195 1.00 0.00 S ATOM 0 H CYS A 87 -5.035 11.084 -0.265 1.00 0.00 H new ATOM 0 HA CYS A 87 -7.221 12.771 0.498 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -7.953 10.180 -0.142 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -7.600 10.018 1.567 1.00 0.00 H new ATOM 0 HG CYS A 87 -10.375 10.445 1.281 1.00 0.00 H new ATOM 1354 N HIS A 88 -4.859 11.155 2.059 1.00 0.00 N ATOM 1355 CA HIS A 88 -4.061 11.168 3.286 1.00 0.00 C ATOM 1356 C HIS A 88 -2.953 12.220 3.242 1.00 0.00 C ATOM 1357 O HIS A 88 -1.926 12.080 3.906 1.00 0.00 O ATOM 1358 CB HIS A 88 -3.463 9.789 3.559 1.00 0.00 C ATOM 1359 CG HIS A 88 -4.399 8.862 4.269 1.00 0.00 C ATOM 1360 ND1 HIS A 88 -4.250 8.509 5.593 1.00 0.00 N ATOM 1361 CD2 HIS A 88 -5.507 8.215 3.833 1.00 0.00 C ATOM 1362 CE1 HIS A 88 -5.223 7.685 5.941 1.00 0.00 C ATOM 1363 NE2 HIS A 88 -6.000 7.492 4.890 1.00 0.00 N ATOM 0 H HIS A 88 -4.484 10.575 1.309 1.00 0.00 H new ATOM 0 HA HIS A 88 -4.736 11.432 4.100 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -3.165 9.337 2.613 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -2.558 9.906 4.155 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -5.925 8.260 2.838 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -5.360 7.245 6.918 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -6.831 6.901 4.868 1.00 0.00 H new ATOM 1372 N GLU A 89 -3.177 13.283 2.477 1.00 0.00 N ATOM 1373 CA GLU A 89 -2.208 14.371 2.368 1.00 0.00 C ATOM 1374 C GLU A 89 -0.854 13.896 1.841 1.00 0.00 C ATOM 1375 O GLU A 89 0.143 14.607 1.963 1.00 0.00 O ATOM 1376 CB GLU A 89 -2.021 15.044 3.729 1.00 0.00 C ATOM 1377 CG GLU A 89 -3.019 16.157 4.000 1.00 0.00 C ATOM 1378 CD GLU A 89 -4.106 15.740 4.971 1.00 0.00 C ATOM 1379 OE1 GLU A 89 -3.775 15.413 6.130 1.00 0.00 O ATOM 1380 OE2 GLU A 89 -5.290 15.738 4.571 1.00 0.00 O ATOM 0 H GLU A 89 -4.022 13.416 1.922 1.00 0.00 H new ATOM 0 HA GLU A 89 -2.608 15.086 1.649 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -2.108 14.291 4.512 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -1.011 15.450 3.788 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -2.492 17.023 4.400 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -3.476 16.468 3.060 1.00 0.00 H new ATOM 1387 N SER A 90 -0.813 12.707 1.246 1.00 0.00 N ATOM 1388 CA SER A 90 0.436 12.185 0.702 1.00 0.00 C ATOM 1389 C SER A 90 0.805 12.940 -0.571 1.00 0.00 C ATOM 1390 O SER A 90 1.922 13.439 -0.710 1.00 0.00 O ATOM 1391 CB SER A 90 0.318 10.686 0.420 1.00 0.00 C ATOM 1392 OG SER A 90 1.302 9.955 1.131 1.00 0.00 O ATOM 0 H SER A 90 -1.620 12.094 1.129 1.00 0.00 H new ATOM 0 HA SER A 90 1.225 12.330 1.440 1.00 0.00 H new ATOM 0 HB2 SER A 90 -0.675 10.336 0.703 1.00 0.00 H new ATOM 0 HB3 SER A 90 0.427 10.504 -0.649 1.00 0.00 H new ATOM 0 HG SER A 90 1.653 9.240 0.561 1.00 0.00 H new ATOM 1398 N PHE A 91 -0.153 13.037 -1.486 1.00 0.00 N ATOM 1399 CA PHE A 91 0.048 13.753 -2.741 1.00 0.00 C ATOM 1400 C PHE A 91 -0.834 14.995 -2.773 1.00 0.00 C ATOM 1401 O PHE A 91 -0.423 16.055 -3.248 1.00 0.00 O ATOM 1402 CB PHE A 91 -0.270 12.851 -3.937 1.00 0.00 C ATOM 1403 CG PHE A 91 0.912 12.598 -4.829 1.00 0.00 C ATOM 1404 CD1 PHE A 91 2.032 11.940 -4.349 1.00 0.00 C ATOM 1405 CD2 PHE A 91 0.900 13.020 -6.150 1.00 0.00 C ATOM 1406 CE1 PHE A 91 3.121 11.707 -5.169 1.00 0.00 C ATOM 1407 CE2 PHE A 91 1.985 12.790 -6.974 1.00 0.00 C ATOM 1408 CZ PHE A 91 3.097 12.133 -6.483 1.00 0.00 C ATOM 0 H PHE A 91 -1.081 12.627 -1.381 1.00 0.00 H new ATOM 0 HA PHE A 91 1.094 14.053 -2.807 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -0.650 11.897 -3.571 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -1.067 13.307 -4.524 1.00 0.00 H new ATOM 0 HD1 PHE A 91 2.055 11.605 -3.323 1.00 0.00 H new ATOM 0 HD2 PHE A 91 0.033 13.534 -6.539 1.00 0.00 H new ATOM 0 HE1 PHE A 91 3.989 11.193 -4.783 1.00 0.00 H new ATOM 0 HE2 PHE A 91 1.964 13.123 -8.001 1.00 0.00 H new ATOM 0 HZ PHE A 91 3.946 11.953 -7.126 1.00 0.00 H new ATOM 1418 N VAL A 92 -2.049 14.852 -2.254 1.00 0.00 N ATOM 1419 CA VAL A 92 -3.003 15.955 -2.205 1.00 0.00 C ATOM 1420 C VAL A 92 -2.437 17.136 -1.422 1.00 0.00 C ATOM 1421 O VAL A 92 -2.831 18.282 -1.637 1.00 0.00 O ATOM 1422 CB VAL A 92 -4.338 15.521 -1.563 1.00 0.00 C ATOM 1423 CG1 VAL A 92 -5.218 14.818 -2.585 1.00 0.00 C ATOM 1424 CG2 VAL A 92 -4.096 14.627 -0.349 1.00 0.00 C ATOM 0 H VAL A 92 -2.398 13.979 -1.859 1.00 0.00 H new ATOM 0 HA VAL A 92 -3.187 16.258 -3.236 1.00 0.00 H new ATOM 0 HB VAL A 92 -4.857 16.416 -1.221 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -6.155 14.519 -2.114 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -5.428 15.496 -3.412 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -4.703 13.934 -2.962 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -5.053 14.335 0.085 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -3.550 13.735 -0.657 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -3.512 15.171 0.393 1.00 0.00 H new ATOM 1434 N LYS A 93 -1.509 16.849 -0.514 1.00 0.00 N ATOM 1435 CA LYS A 93 -0.887 17.888 0.300 1.00 0.00 C ATOM 1436 C LYS A 93 0.234 18.595 -0.461 1.00 0.00 C ATOM 1437 O LYS A 93 0.845 19.531 0.052 1.00 0.00 O ATOM 1438 CB LYS A 93 -0.335 17.286 1.594 1.00 0.00 C ATOM 1439 CG LYS A 93 0.027 18.325 2.643 1.00 0.00 C ATOM 1440 CD LYS A 93 1.469 18.175 3.105 1.00 0.00 C ATOM 1441 CE LYS A 93 1.640 18.610 4.552 1.00 0.00 C ATOM 1442 NZ LYS A 93 3.038 19.031 4.843 1.00 0.00 N ATOM 0 H LYS A 93 -1.171 15.906 -0.323 1.00 0.00 H new ATOM 0 HA LYS A 93 -1.653 18.625 0.541 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -1.075 16.603 2.011 1.00 0.00 H new ATOM 0 HB3 LYS A 93 0.550 16.694 1.361 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -0.122 19.324 2.233 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -0.642 18.228 3.498 1.00 0.00 H new ATOM 0 HD2 LYS A 93 1.780 17.136 2.997 1.00 0.00 H new ATOM 0 HD3 LYS A 93 2.121 18.771 2.466 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.960 19.435 4.766 1.00 0.00 H new ATOM 0 HE3 LYS A 93 1.363 17.789 5.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 3.091 19.415 5.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 3.672 18.210 4.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 3.329 19.762 4.163 1.00 0.00 H new ATOM 1456 N ALA A 94 0.503 18.145 -1.686 1.00 0.00 N ATOM 1457 CA ALA A 94 1.552 18.741 -2.504 1.00 0.00 C ATOM 1458 C ALA A 94 1.133 20.112 -3.024 1.00 0.00 C ATOM 1459 O ALA A 94 1.968 20.997 -3.211 1.00 0.00 O ATOM 1460 CB ALA A 94 1.904 17.821 -3.662 1.00 0.00 C ATOM 0 H ALA A 94 0.009 17.371 -2.131 1.00 0.00 H new ATOM 0 HA ALA A 94 2.434 18.874 -1.878 1.00 0.00 H new ATOM 0 HB1 ALA A 94 2.689 18.278 -4.265 1.00 0.00 H new ATOM 0 HB2 ALA A 94 2.256 16.865 -3.273 1.00 0.00 H new ATOM 0 HB3 ALA A 94 1.020 17.659 -4.279 1.00 0.00 H new ATOM 1466 N ALA A 95 -0.165 20.281 -3.259 1.00 0.00 N ATOM 1467 CA ALA A 95 -0.690 21.545 -3.759 1.00 0.00 C ATOM 1468 C ALA A 95 -2.036 21.881 -3.116 1.00 0.00 C ATOM 1469 O ALA A 95 -3.047 22.017 -3.805 1.00 0.00 O ATOM 1470 CB ALA A 95 -0.816 21.492 -5.276 1.00 0.00 C ATOM 0 H ALA A 95 -0.870 19.559 -3.111 1.00 0.00 H new ATOM 0 HA ALA A 95 0.009 22.337 -3.490 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -1.209 22.441 -5.642 1.00 0.00 H new ATOM 0 HB2 ALA A 95 0.165 21.312 -5.716 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -1.494 20.686 -5.557 1.00 0.00 H new ATOM 1476 N PRO A 96 -2.070 22.018 -1.778 1.00 0.00 N ATOM 1477 CA PRO A 96 -3.301 22.338 -1.045 1.00 0.00 C ATOM 1478 C PRO A 96 -3.927 23.665 -1.479 1.00 0.00 C ATOM 1479 O PRO A 96 -5.135 23.742 -1.701 1.00 0.00 O ATOM 1480 CB PRO A 96 -2.840 22.416 0.416 1.00 0.00 C ATOM 1481 CG PRO A 96 -1.577 21.634 0.459 1.00 0.00 C ATOM 1482 CD PRO A 96 -0.919 21.870 -0.868 1.00 0.00 C ATOM 0 HA PRO A 96 -4.077 21.594 -1.225 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -2.676 23.449 0.724 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -3.588 21.997 1.089 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -0.938 21.963 1.279 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -1.776 20.574 0.616 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -0.294 22.763 -0.857 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -0.279 21.036 -1.157 1.00 0.00 H new ATOM 1490 N PRO A 97 -3.118 24.736 -1.600 1.00 0.00 N ATOM 1491 CA PRO A 97 -3.613 26.055 -1.998 1.00 0.00 C ATOM 1492 C PRO A 97 -3.758 26.204 -3.510 1.00 0.00 C ATOM 1493 O PRO A 97 -4.450 27.104 -3.988 1.00 0.00 O ATOM 1494 CB PRO A 97 -2.531 26.992 -1.472 1.00 0.00 C ATOM 1495 CG PRO A 97 -1.273 26.197 -1.565 1.00 0.00 C ATOM 1496 CD PRO A 97 -1.662 24.755 -1.349 1.00 0.00 C ATOM 0 HA PRO A 97 -4.611 26.253 -1.606 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -2.470 27.903 -2.068 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -2.734 27.296 -0.445 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -0.801 26.330 -2.538 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -0.552 26.521 -0.814 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -1.131 24.092 -2.032 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -1.427 24.426 -0.337 1.00 0.00 H new ATOM 1504 N GLN A 98 -3.103 25.323 -4.262 1.00 0.00 N ATOM 1505 CA GLN A 98 -3.161 25.368 -5.721 1.00 0.00 C ATOM 1506 C GLN A 98 -4.604 25.452 -6.212 1.00 0.00 C ATOM 1507 O GLN A 98 -5.364 24.489 -6.109 1.00 0.00 O ATOM 1508 CB GLN A 98 -2.479 24.136 -6.317 1.00 0.00 C ATOM 1509 CG GLN A 98 -1.984 24.344 -7.739 1.00 0.00 C ATOM 1510 CD GLN A 98 -2.304 23.173 -8.647 1.00 0.00 C ATOM 1511 OE1 GLN A 98 -1.899 22.041 -8.385 1.00 0.00 O ATOM 1512 NE2 GLN A 98 -3.034 23.440 -9.724 1.00 0.00 N ATOM 0 H GLN A 98 -2.527 24.570 -3.886 1.00 0.00 H new ATOM 0 HA GLN A 98 -2.634 26.264 -6.050 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -1.636 23.856 -5.685 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -3.179 23.301 -6.303 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -2.434 25.249 -8.147 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -0.906 24.503 -7.724 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -3.349 24.393 -9.903 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -3.280 22.692 -10.372 1.00 0.00 H new ATOM 1521 N LYS A 99 -4.972 26.612 -6.746 1.00 0.00 N ATOM 1522 CA LYS A 99 -6.323 26.826 -7.254 1.00 0.00 C ATOM 1523 C LYS A 99 -6.649 25.838 -8.369 1.00 0.00 C ATOM 1524 O LYS A 99 -5.847 24.960 -8.689 1.00 0.00 O ATOM 1525 CB LYS A 99 -6.475 28.259 -7.767 1.00 0.00 C ATOM 1526 CG LYS A 99 -6.148 29.317 -6.724 1.00 0.00 C ATOM 1527 CD LYS A 99 -5.267 30.416 -7.298 1.00 0.00 C ATOM 1528 CE LYS A 99 -5.400 31.707 -6.508 1.00 0.00 C ATOM 1529 NZ LYS A 99 -4.372 32.709 -6.904 1.00 0.00 N ATOM 0 H LYS A 99 -4.354 27.418 -6.838 1.00 0.00 H new ATOM 0 HA LYS A 99 -7.022 26.664 -6.434 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -5.824 28.398 -8.630 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -7.498 28.406 -8.113 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -7.072 29.752 -6.344 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -5.644 28.851 -5.878 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -4.227 30.090 -7.292 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -5.539 30.595 -8.338 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -6.394 32.126 -6.663 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -5.307 31.492 -5.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -4.497 33.575 -6.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -3.423 32.319 -6.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -4.477 32.933 -7.914 1.00 0.00 H new ATOM 1543 N ARG A 100 -7.833 25.986 -8.956 1.00 0.00 N ATOM 1544 CA ARG A 100 -8.267 25.106 -10.035 1.00 0.00 C ATOM 1545 C ARG A 100 -9.130 25.863 -11.039 1.00 0.00 C ATOM 1546 O ARG A 100 -10.351 25.705 -11.067 1.00 0.00 O ATOM 1547 CB ARG A 100 -9.043 23.916 -9.470 1.00 0.00 C ATOM 1548 CG ARG A 100 -10.123 24.312 -8.475 1.00 0.00 C ATOM 1549 CD ARG A 100 -11.437 23.605 -8.765 1.00 0.00 C ATOM 1550 NE ARG A 100 -12.383 23.731 -7.658 1.00 0.00 N ATOM 1551 CZ ARG A 100 -12.332 22.992 -6.553 1.00 0.00 C ATOM 1552 NH1 ARG A 100 -11.383 22.076 -6.401 1.00 0.00 N ATOM 1553 NH2 ARG A 100 -13.231 23.172 -5.595 1.00 0.00 N ATOM 0 H ARG A 100 -8.509 26.707 -8.702 1.00 0.00 H new ATOM 0 HA ARG A 100 -7.380 24.738 -10.551 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -9.502 23.368 -10.293 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -8.345 23.235 -8.984 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -9.794 24.070 -7.464 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -10.274 25.391 -8.511 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -11.880 24.021 -9.670 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -11.246 22.550 -8.960 1.00 0.00 H new ATOM 0 HE ARG A 100 -13.125 24.426 -7.737 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -10.688 21.936 -7.134 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -11.349 21.513 -5.551 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -13.960 23.876 -5.706 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -13.193 22.606 -4.747 1.00 0.00 H new ATOM 1566 N PHE A 101 -8.488 26.687 -11.862 1.00 0.00 N ATOM 1567 CA PHE A 101 -9.199 27.468 -12.867 1.00 0.00 C ATOM 1568 C PHE A 101 -10.213 28.402 -12.215 1.00 0.00 C ATOM 1569 O PHE A 101 -11.085 28.927 -12.939 1.00 0.00 O ATOM 1570 CB PHE A 101 -9.905 26.541 -13.859 1.00 0.00 C ATOM 1571 CG PHE A 101 -9.013 26.051 -14.963 1.00 0.00 C ATOM 1572 CD1 PHE A 101 -8.411 26.945 -15.834 1.00 0.00 C ATOM 1573 CD2 PHE A 101 -8.775 24.696 -15.128 1.00 0.00 C ATOM 1574 CE1 PHE A 101 -7.589 26.496 -16.850 1.00 0.00 C ATOM 1575 CE2 PHE A 101 -7.955 24.242 -16.143 1.00 0.00 C ATOM 1576 CZ PHE A 101 -7.360 25.143 -17.005 1.00 0.00 C ATOM 1577 OXT PHE A 101 -10.128 28.601 -10.984 1.00 0.00 O ATOM 0 H PHE A 101 -7.478 26.831 -11.852 1.00 0.00 H new ATOM 0 HA PHE A 101 -8.468 28.073 -13.403 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -10.306 25.683 -13.319 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -10.753 27.068 -14.296 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -8.586 28.004 -15.717 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -9.235 23.987 -14.456 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -7.126 27.203 -17.523 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -7.779 23.183 -16.263 1.00 0.00 H new ATOM 0 HZ PHE A 101 -6.717 24.790 -17.798 1.00 0.00 H new TER 1587 PHE A 101 ATOM 1588 N SER B 1 -9.847 11.548 17.225 1.00 0.00 N ATOM 1589 CA SER B 1 -8.751 10.571 17.455 1.00 0.00 C ATOM 1590 C SER B 1 -9.263 9.136 17.376 1.00 0.00 C ATOM 1591 O SER B 1 -10.416 8.859 17.710 1.00 0.00 O ATOM 1592 CB SER B 1 -8.140 10.840 18.831 1.00 0.00 C ATOM 1593 OG SER B 1 -6.741 10.615 18.821 1.00 0.00 O ATOM 0 H1 SER B 1 -9.468 12.515 17.285 1.00 0.00 H new ATOM 0 H2 SER B 1 -10.257 11.394 16.282 1.00 0.00 H new ATOM 0 H3 SER B 1 -10.584 11.419 17.948 1.00 0.00 H new ATOM 0 HA SER B 1 -7.996 10.691 16.678 1.00 0.00 H new ATOM 0 HB2 SER B 1 -8.344 11.869 19.128 1.00 0.00 H new ATOM 0 HB3 SER B 1 -8.610 10.195 19.573 1.00 0.00 H new ATOM 0 HG SER B 1 -6.374 10.796 19.712 1.00 0.00 H new ATOM 1601 N ARG B 2 -8.400 8.227 16.934 1.00 0.00 N ATOM 1602 CA ARG B 2 -8.764 6.820 16.810 1.00 0.00 C ATOM 1603 C ARG B 2 -9.952 6.643 15.865 1.00 0.00 C ATOM 1604 O ARG B 2 -11.027 6.209 16.280 1.00 0.00 O ATOM 1605 CB ARG B 2 -9.096 6.237 18.185 1.00 0.00 C ATOM 1606 CG ARG B 2 -7.880 5.722 18.937 1.00 0.00 C ATOM 1607 CD ARG B 2 -7.304 4.479 18.277 1.00 0.00 C ATOM 1608 NE ARG B 2 -6.242 4.804 17.328 1.00 0.00 N ATOM 1609 CZ ARG B 2 -4.998 5.116 17.686 1.00 0.00 C ATOM 1610 NH1 ARG B 2 -4.656 5.145 18.967 1.00 0.00 N ATOM 1611 NH2 ARG B 2 -4.094 5.400 16.757 1.00 0.00 N ATOM 0 H ARG B 2 -7.442 8.440 16.655 1.00 0.00 H new ATOM 0 HA ARG B 2 -7.912 6.285 16.392 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -9.587 7.002 18.786 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -9.809 5.422 18.062 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -7.118 6.501 18.977 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -8.157 5.494 19.966 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -6.913 3.810 19.044 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -8.099 3.941 17.761 1.00 0.00 H new ATOM 0 HE ARG B 2 -6.467 4.791 16.333 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -5.348 4.928 19.685 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -3.701 5.385 19.235 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -4.353 5.379 15.771 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -3.141 5.639 17.029 1.00 0.00 H new ATOM 1624 N PRO B 3 -9.773 6.980 14.576 1.00 0.00 N ATOM 1625 CA PRO B 3 -10.831 6.862 13.563 1.00 0.00 C ATOM 1626 C PRO B 3 -11.250 5.404 13.334 1.00 0.00 C ATOM 1627 O PRO B 3 -11.585 4.699 14.287 1.00 0.00 O ATOM 1628 CB PRO B 3 -10.175 7.479 12.311 1.00 0.00 C ATOM 1629 CG PRO B 3 -9.062 8.305 12.841 1.00 0.00 C ATOM 1630 CD PRO B 3 -8.536 7.507 13.986 1.00 0.00 C ATOM 0 HA PRO B 3 -11.756 7.361 13.851 1.00 0.00 H new ATOM 0 HB2 PRO B 3 -9.809 6.707 11.634 1.00 0.00 H new ATOM 0 HB3 PRO B 3 -10.886 8.085 11.749 1.00 0.00 H new ATOM 0 HG2 PRO B 3 -8.295 8.473 12.085 1.00 0.00 H new ATOM 0 HG3 PRO B 3 -9.411 9.286 13.165 1.00 0.00 H new ATOM 0 HD2 PRO B 3 -7.868 6.711 13.657 1.00 0.00 H new ATOM 0 HD3 PRO B 3 -7.976 8.122 14.691 1.00 0.00 H new ATOM 1638 N THR B 4 -11.234 4.948 12.081 1.00 0.00 N ATOM 1639 CA THR B 4 -11.617 3.576 11.763 1.00 0.00 C ATOM 1640 C THR B 4 -10.403 2.670 11.677 1.00 0.00 C ATOM 1641 O THR B 4 -9.279 3.117 11.451 1.00 0.00 O ATOM 1642 CB THR B 4 -12.419 3.526 10.457 1.00 0.00 C ATOM 1643 OG1 THR B 4 -12.813 2.198 10.165 1.00 0.00 O ATOM 1644 CG2 THR B 4 -11.664 4.050 9.254 1.00 0.00 C ATOM 0 H THR B 4 -10.961 5.508 11.274 1.00 0.00 H new ATOM 0 HA THR B 4 -12.250 3.212 12.573 1.00 0.00 H new ATOM 0 HB THR B 4 -13.279 4.173 10.630 1.00 0.00 H new ATOM 0 HG1 THR B 4 -12.829 2.068 9.194 1.00 0.00 H new ATOM 0 HG21 THR B 4 -12.297 3.982 8.369 1.00 0.00 H new ATOM 0 HG22 THR B 4 -11.387 5.091 9.423 1.00 0.00 H new ATOM 0 HG23 THR B 4 -10.763 3.455 9.102 1.00 0.00 H new ATOM 1652 N GLU B 5 -10.653 1.388 11.874 1.00 0.00 N ATOM 1653 CA GLU B 5 -9.615 0.373 11.842 1.00 0.00 C ATOM 1654 C GLU B 5 -8.672 0.563 10.655 1.00 0.00 C ATOM 1655 O GLU B 5 -7.451 0.536 10.814 1.00 0.00 O ATOM 1656 CB GLU B 5 -10.280 -0.994 11.785 1.00 0.00 C ATOM 1657 CG GLU B 5 -9.607 -2.042 12.657 1.00 0.00 C ATOM 1658 CD GLU B 5 -8.631 -2.905 11.882 1.00 0.00 C ATOM 1659 OE1 GLU B 5 -8.954 -3.285 10.736 1.00 0.00 O ATOM 1660 OE2 GLU B 5 -7.544 -3.201 12.419 1.00 0.00 O ATOM 0 H GLU B 5 -11.586 1.020 12.061 1.00 0.00 H new ATOM 0 HA GLU B 5 -9.007 0.459 12.743 1.00 0.00 H new ATOM 0 HB2 GLU B 5 -11.321 -0.894 12.092 1.00 0.00 H new ATOM 0 HB3 GLU B 5 -10.284 -1.343 10.752 1.00 0.00 H new ATOM 0 HG2 GLU B 5 -9.080 -1.547 13.473 1.00 0.00 H new ATOM 0 HG3 GLU B 5 -10.369 -2.677 13.109 1.00 0.00 H new ATOM 1667 N THR B 6 -9.239 0.757 9.469 1.00 0.00 N ATOM 1668 CA THR B 6 -8.437 0.954 8.272 1.00 0.00 C ATOM 1669 C THR B 6 -7.677 2.273 8.342 1.00 0.00 C ATOM 1670 O THR B 6 -6.552 2.372 7.855 1.00 0.00 O ATOM 1671 CB THR B 6 -9.322 0.928 7.026 1.00 0.00 C ATOM 1672 OG1 THR B 6 -10.168 -0.206 7.040 1.00 0.00 O ATOM 1673 CG2 THR B 6 -8.533 0.897 5.736 1.00 0.00 C ATOM 0 H THR B 6 -10.247 0.782 9.313 1.00 0.00 H new ATOM 0 HA THR B 6 -7.715 0.139 8.210 1.00 0.00 H new ATOM 0 HB THR B 6 -9.899 1.852 7.058 1.00 0.00 H new ATOM 0 HG1 THR B 6 -10.311 -0.519 6.122 1.00 0.00 H new ATOM 0 HG21 THR B 6 -9.220 0.880 4.890 1.00 0.00 H new ATOM 0 HG22 THR B 6 -7.903 1.784 5.674 1.00 0.00 H new ATOM 0 HG23 THR B 6 -7.907 0.005 5.714 1.00 0.00 H new ATOM 1681 N GLU B 7 -8.293 3.281 8.959 1.00 0.00 N ATOM 1682 CA GLU B 7 -7.670 4.596 9.089 1.00 0.00 C ATOM 1683 C GLU B 7 -6.273 4.469 9.682 1.00 0.00 C ATOM 1684 O GLU B 7 -5.318 5.064 9.182 1.00 0.00 O ATOM 1685 CB GLU B 7 -8.530 5.509 9.966 1.00 0.00 C ATOM 1686 CG GLU B 7 -9.085 6.716 9.224 1.00 0.00 C ATOM 1687 CD GLU B 7 -8.156 7.913 9.283 1.00 0.00 C ATOM 1688 OE1 GLU B 7 -6.925 7.707 9.315 1.00 0.00 O ATOM 1689 OE2 GLU B 7 -8.661 9.054 9.298 1.00 0.00 O ATOM 0 H GLU B 7 -9.221 3.211 9.376 1.00 0.00 H new ATOM 0 HA GLU B 7 -7.589 5.036 8.095 1.00 0.00 H new ATOM 0 HB2 GLU B 7 -9.359 4.931 10.375 1.00 0.00 H new ATOM 0 HB3 GLU B 7 -7.934 5.854 10.811 1.00 0.00 H new ATOM 0 HG2 GLU B 7 -9.261 6.448 8.182 1.00 0.00 H new ATOM 0 HG3 GLU B 7 -10.050 6.988 9.651 1.00 0.00 H new ATOM 1696 N ARG B 8 -6.158 3.676 10.738 1.00 0.00 N ATOM 1697 CA ARG B 8 -4.873 3.455 11.384 1.00 0.00 C ATOM 1698 C ARG B 8 -3.943 2.671 10.462 1.00 0.00 C ATOM 1699 O ARG B 8 -2.722 2.778 10.559 1.00 0.00 O ATOM 1700 CB ARG B 8 -5.062 2.703 12.703 1.00 0.00 C ATOM 1701 CG ARG B 8 -4.127 3.166 13.808 1.00 0.00 C ATOM 1702 CD ARG B 8 -3.719 2.015 14.714 1.00 0.00 C ATOM 1703 NE ARG B 8 -4.514 1.972 15.938 1.00 0.00 N ATOM 1704 CZ ARG B 8 -5.704 1.383 16.033 1.00 0.00 C ATOM 1705 NH1 ARG B 8 -6.246 0.788 14.977 1.00 0.00 N ATOM 1706 NH2 ARG B 8 -6.355 1.387 17.189 1.00 0.00 N ATOM 0 H ARG B 8 -6.938 3.176 11.165 1.00 0.00 H new ATOM 0 HA ARG B 8 -4.422 4.424 11.595 1.00 0.00 H new ATOM 0 HB2 ARG B 8 -6.093 2.825 13.036 1.00 0.00 H new ATOM 0 HB3 ARG B 8 -4.907 1.638 12.530 1.00 0.00 H new ATOM 0 HG2 ARG B 8 -3.237 3.616 13.368 1.00 0.00 H new ATOM 0 HG3 ARG B 8 -4.617 3.940 14.399 1.00 0.00 H new ATOM 0 HD2 ARG B 8 -3.831 1.074 14.176 1.00 0.00 H new ATOM 0 HD3 ARG B 8 -2.664 2.112 14.970 1.00 0.00 H new ATOM 0 HE ARG B 8 -4.134 2.421 16.771 1.00 0.00 H new ATOM 0 HH11 ARG B 8 -5.750 0.780 14.086 1.00 0.00 H new ATOM 0 HH12 ARG B 8 -7.158 0.339 15.057 1.00 0.00 H new ATOM 0 HH21 ARG B 8 -5.944 1.841 18.004 1.00 0.00 H new ATOM 0 HH22 ARG B 8 -7.267 0.936 17.262 1.00 0.00 H new ATOM 1719 N CYS B 9 -4.536 1.877 9.571 1.00 0.00 N ATOM 1720 CA CYS B 9 -3.773 1.063 8.631 1.00 0.00 C ATOM 1721 C CYS B 9 -3.097 1.920 7.563 1.00 0.00 C ATOM 1722 O CYS B 9 -1.874 1.894 7.419 1.00 0.00 O ATOM 1723 CB CYS B 9 -4.684 0.029 7.968 1.00 0.00 C ATOM 1724 SG CYS B 9 -5.576 -1.025 9.136 1.00 0.00 S ATOM 0 H CYS B 9 -5.548 1.781 9.482 1.00 0.00 H new ATOM 0 HA CYS B 9 -2.993 0.552 9.195 1.00 0.00 H new ATOM 0 HB2 CYS B 9 -5.407 0.548 7.338 1.00 0.00 H new ATOM 0 HB3 CYS B 9 -4.084 -0.601 7.312 1.00 0.00 H new ATOM 0 HG CYS B 9 -6.151 -0.285 10.037 1.00 0.00 H new ATOM 1730 N ILE B 10 -3.894 2.672 6.807 1.00 0.00 N ATOM 1731 CA ILE B 10 -3.360 3.523 5.748 1.00 0.00 C ATOM 1732 C ILE B 10 -2.194 4.370 6.245 1.00 0.00 C ATOM 1733 O ILE B 10 -1.104 4.333 5.679 1.00 0.00 O ATOM 1734 CB ILE B 10 -4.434 4.469 5.171 1.00 0.00 C ATOM 1735 CG1 ILE B 10 -5.757 3.734 4.961 1.00 0.00 C ATOM 1736 CG2 ILE B 10 -3.952 5.071 3.860 1.00 0.00 C ATOM 1737 CD1 ILE B 10 -6.817 4.109 5.961 1.00 0.00 C ATOM 0 H ILE B 10 -4.908 2.709 6.908 1.00 0.00 H new ATOM 0 HA ILE B 10 -3.017 2.846 4.965 1.00 0.00 H new ATOM 0 HB ILE B 10 -4.603 5.271 5.889 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -6.125 3.945 3.957 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -5.580 2.660 5.017 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -4.718 5.737 3.462 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -3.036 5.635 4.034 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -3.757 4.273 3.143 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -7.729 3.549 5.752 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -6.469 3.873 6.966 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -7.023 5.177 5.890 1.00 0.00 H new ATOM 1749 N GLU B 11 -2.436 5.143 7.297 1.00 0.00 N ATOM 1750 CA GLU B 11 -1.415 6.020 7.861 1.00 0.00 C ATOM 1751 C GLU B 11 -0.122 5.267 8.149 1.00 0.00 C ATOM 1752 O GLU B 11 0.959 5.856 8.154 1.00 0.00 O ATOM 1753 CB GLU B 11 -1.933 6.682 9.138 1.00 0.00 C ATOM 1754 CG GLU B 11 -2.426 8.103 8.923 1.00 0.00 C ATOM 1755 CD GLU B 11 -2.780 8.802 10.221 1.00 0.00 C ATOM 1756 OE1 GLU B 11 -3.642 8.281 10.959 1.00 0.00 O ATOM 1757 OE2 GLU B 11 -2.196 9.870 10.500 1.00 0.00 O ATOM 0 H GLU B 11 -3.334 5.181 7.779 1.00 0.00 H new ATOM 0 HA GLU B 11 -1.195 6.789 7.120 1.00 0.00 H new ATOM 0 HB2 GLU B 11 -2.746 6.081 9.546 1.00 0.00 H new ATOM 0 HB3 GLU B 11 -1.137 6.690 9.883 1.00 0.00 H new ATOM 0 HG2 GLU B 11 -1.657 8.676 8.405 1.00 0.00 H new ATOM 0 HG3 GLU B 11 -3.302 8.085 8.274 1.00 0.00 H new ATOM 1764 N SER B 12 -0.235 3.972 8.402 1.00 0.00 N ATOM 1765 CA SER B 12 0.933 3.158 8.704 1.00 0.00 C ATOM 1766 C SER B 12 1.924 3.121 7.538 1.00 0.00 C ATOM 1767 O SER B 12 3.100 3.431 7.713 1.00 0.00 O ATOM 1768 CB SER B 12 0.504 1.736 9.064 1.00 0.00 C ATOM 1769 OG SER B 12 -0.628 1.744 9.914 1.00 0.00 O ATOM 0 H SER B 12 -1.119 3.464 8.404 1.00 0.00 H new ATOM 0 HA SER B 12 1.438 3.616 9.554 1.00 0.00 H new ATOM 0 HB2 SER B 12 0.275 1.181 8.154 1.00 0.00 H new ATOM 0 HB3 SER B 12 1.328 1.218 9.555 1.00 0.00 H new ATOM 0 HG SER B 12 -1.372 2.196 9.464 1.00 0.00 H new ATOM 1775 N LEU B 13 1.456 2.712 6.359 1.00 0.00 N ATOM 1776 CA LEU B 13 2.316 2.601 5.186 1.00 0.00 C ATOM 1777 C LEU B 13 2.650 3.952 4.543 1.00 0.00 C ATOM 1778 O LEU B 13 3.694 4.106 3.915 1.00 0.00 O ATOM 1779 CB LEU B 13 1.655 1.685 4.169 1.00 0.00 C ATOM 1780 CG LEU B 13 2.026 0.214 4.315 1.00 0.00 C ATOM 1781 CD1 LEU B 13 3.521 0.026 4.159 1.00 0.00 C ATOM 1782 CD2 LEU B 13 1.588 -0.337 5.656 1.00 0.00 C ATOM 0 H LEU B 13 0.484 2.452 6.193 1.00 0.00 H new ATOM 0 HA LEU B 13 3.266 2.183 5.521 1.00 0.00 H new ATOM 0 HB2 LEU B 13 0.573 1.785 4.256 1.00 0.00 H new ATOM 0 HB3 LEU B 13 1.926 2.018 3.167 1.00 0.00 H new ATOM 0 HG LEU B 13 1.506 -0.333 3.529 1.00 0.00 H new ATOM 0 HD11 LEU B 13 3.768 -1.030 4.266 1.00 0.00 H new ATOM 0 HD12 LEU B 13 3.830 0.373 3.173 1.00 0.00 H new ATOM 0 HD13 LEU B 13 4.042 0.600 4.925 1.00 0.00 H new ATOM 0 HD21 LEU B 13 1.868 -1.388 5.727 1.00 0.00 H new ATOM 0 HD22 LEU B 13 2.074 0.223 6.455 1.00 0.00 H new ATOM 0 HD23 LEU B 13 0.506 -0.243 5.752 1.00 0.00 H new ATOM 1794 N ILE B 14 1.779 4.932 4.685 1.00 0.00 N ATOM 1795 CA ILE B 14 2.034 6.234 4.107 1.00 0.00 C ATOM 1796 C ILE B 14 3.199 6.908 4.788 1.00 0.00 C ATOM 1797 O ILE B 14 3.970 7.631 4.170 1.00 0.00 O ATOM 1798 CB ILE B 14 0.855 7.182 4.292 1.00 0.00 C ATOM 1799 CG1 ILE B 14 -0.461 6.519 3.954 1.00 0.00 C ATOM 1800 CG2 ILE B 14 1.059 8.416 3.458 1.00 0.00 C ATOM 1801 CD1 ILE B 14 -1.597 7.138 4.717 1.00 0.00 C ATOM 0 H ILE B 14 0.897 4.852 5.191 1.00 0.00 H new ATOM 0 HA ILE B 14 2.227 6.050 3.050 1.00 0.00 H new ATOM 0 HB ILE B 14 0.810 7.462 5.344 1.00 0.00 H new ATOM 0 HG12 ILE B 14 -0.650 6.605 2.884 1.00 0.00 H new ATOM 0 HG13 ILE B 14 -0.404 5.455 4.183 1.00 0.00 H new ATOM 0 HG21 ILE B 14 0.214 9.091 3.594 1.00 0.00 H new ATOM 0 HG22 ILE B 14 1.976 8.917 3.768 1.00 0.00 H new ATOM 0 HG23 ILE B 14 1.135 8.136 2.407 1.00 0.00 H new ATOM 0 HD11 ILE B 14 -2.529 6.639 4.451 1.00 0.00 H new ATOM 0 HD12 ILE B 14 -1.419 7.029 5.787 1.00 0.00 H new ATOM 0 HD13 ILE B 14 -1.669 8.197 4.468 1.00 0.00 H new ATOM 1813 N ALA B 15 3.268 6.698 6.084 1.00 0.00 N ATOM 1814 CA ALA B 15 4.268 7.323 6.914 1.00 0.00 C ATOM 1815 C ALA B 15 5.628 6.666 6.780 1.00 0.00 C ATOM 1816 O ALA B 15 6.653 7.345 6.839 1.00 0.00 O ATOM 1817 CB ALA B 15 3.758 7.336 8.333 1.00 0.00 C ATOM 0 H ALA B 15 2.629 6.086 6.592 1.00 0.00 H new ATOM 0 HA ALA B 15 4.429 8.349 6.583 1.00 0.00 H new ATOM 0 HB1 ALA B 15 4.498 7.805 8.981 1.00 0.00 H new ATOM 0 HB2 ALA B 15 2.826 7.899 8.380 1.00 0.00 H new ATOM 0 HB3 ALA B 15 3.580 6.313 8.665 1.00 0.00 H new ATOM 1823 N VAL B 16 5.650 5.358 6.545 1.00 0.00 N ATOM 1824 CA VAL B 16 6.905 4.665 6.343 1.00 0.00 C ATOM 1825 C VAL B 16 7.679 5.408 5.266 1.00 0.00 C ATOM 1826 O VAL B 16 8.897 5.574 5.339 1.00 0.00 O ATOM 1827 CB VAL B 16 6.664 3.218 5.888 1.00 0.00 C ATOM 1828 CG1 VAL B 16 5.808 2.479 6.890 1.00 0.00 C ATOM 1829 CG2 VAL B 16 5.989 3.207 4.535 1.00 0.00 C ATOM 0 H VAL B 16 4.820 4.767 6.491 1.00 0.00 H new ATOM 0 HA VAL B 16 7.462 4.638 7.280 1.00 0.00 H new ATOM 0 HB VAL B 16 7.629 2.716 5.815 1.00 0.00 H new ATOM 0 HG11 VAL B 16 5.649 1.456 6.549 1.00 0.00 H new ATOM 0 HG12 VAL B 16 6.310 2.465 7.857 1.00 0.00 H new ATOM 0 HG13 VAL B 16 4.846 2.982 6.988 1.00 0.00 H new ATOM 0 HG21 VAL B 16 5.822 2.177 4.220 1.00 0.00 H new ATOM 0 HG22 VAL B 16 5.033 3.726 4.601 1.00 0.00 H new ATOM 0 HG23 VAL B 16 6.625 3.710 3.807 1.00 0.00 H new ATOM 1839 N PHE B 17 6.922 5.877 4.275 1.00 0.00 N ATOM 1840 CA PHE B 17 7.478 6.642 3.168 1.00 0.00 C ATOM 1841 C PHE B 17 7.760 8.081 3.610 1.00 0.00 C ATOM 1842 O PHE B 17 8.894 8.548 3.537 1.00 0.00 O ATOM 1843 CB PHE B 17 6.505 6.617 1.979 1.00 0.00 C ATOM 1844 CG PHE B 17 6.659 7.763 1.015 1.00 0.00 C ATOM 1845 CD1 PHE B 17 7.607 7.717 0.005 1.00 0.00 C ATOM 1846 CD2 PHE B 17 5.849 8.882 1.116 1.00 0.00 C ATOM 1847 CE1 PHE B 17 7.744 8.766 -0.885 1.00 0.00 C ATOM 1848 CE2 PHE B 17 5.982 9.934 0.231 1.00 0.00 C ATOM 1849 CZ PHE B 17 6.931 9.876 -0.772 1.00 0.00 C ATOM 0 H PHE B 17 5.913 5.737 4.220 1.00 0.00 H new ATOM 0 HA PHE B 17 8.420 6.191 2.856 1.00 0.00 H new ATOM 0 HB2 PHE B 17 6.641 5.682 1.435 1.00 0.00 H new ATOM 0 HB3 PHE B 17 5.485 6.617 2.362 1.00 0.00 H new ATOM 0 HD1 PHE B 17 8.246 6.851 -0.088 1.00 0.00 H new ATOM 0 HD2 PHE B 17 5.104 8.933 1.896 1.00 0.00 H new ATOM 0 HE1 PHE B 17 8.486 8.717 -1.668 1.00 0.00 H new ATOM 0 HE2 PHE B 17 5.345 10.801 0.323 1.00 0.00 H new ATOM 0 HZ PHE B 17 7.036 10.697 -1.466 1.00 0.00 H new ATOM 1859 N GLN B 18 6.721 8.777 4.071 1.00 0.00 N ATOM 1860 CA GLN B 18 6.856 10.167 4.520 1.00 0.00 C ATOM 1861 C GLN B 18 8.020 10.348 5.485 1.00 0.00 C ATOM 1862 O GLN B 18 8.558 11.447 5.609 1.00 0.00 O ATOM 1863 CB GLN B 18 5.576 10.638 5.215 1.00 0.00 C ATOM 1864 CG GLN B 18 4.306 10.256 4.485 1.00 0.00 C ATOM 1865 CD GLN B 18 3.875 11.306 3.493 1.00 0.00 C ATOM 1866 OE1 GLN B 18 4.689 11.493 2.466 1.00 0.00 O flip ATOM 1867 NE2 GLN B 18 2.828 11.937 3.644 1.00 0.00 N flip ATOM 0 H GLN B 18 5.775 8.403 4.144 1.00 0.00 H new ATOM 0 HA GLN B 18 7.043 10.763 3.626 1.00 0.00 H new ATOM 0 HB2 GLN B 18 5.545 10.219 6.221 1.00 0.00 H new ATOM 0 HB3 GLN B 18 5.610 11.722 5.322 1.00 0.00 H new ATOM 0 HG2 GLN B 18 4.459 9.310 3.965 1.00 0.00 H new ATOM 0 HG3 GLN B 18 3.508 10.095 5.210 1.00 0.00 H new ATOM 0 HE21 GLN B 18 2.235 11.755 4.454 1.00 0.00 H new ATOM 0 HE22 GLN B 18 2.554 12.642 2.959 1.00 0.00 H new ATOM 1876 N LYS B 19 8.397 9.286 6.185 1.00 0.00 N ATOM 1877 CA LYS B 19 9.488 9.387 7.144 1.00 0.00 C ATOM 1878 C LYS B 19 10.813 9.644 6.435 1.00 0.00 C ATOM 1879 O LYS B 19 11.515 10.607 6.744 1.00 0.00 O ATOM 1880 CB LYS B 19 9.580 8.102 7.967 1.00 0.00 C ATOM 1881 CG LYS B 19 10.045 8.324 9.395 1.00 0.00 C ATOM 1882 CD LYS B 19 8.971 8.999 10.232 1.00 0.00 C ATOM 1883 CE LYS B 19 7.955 7.994 10.750 1.00 0.00 C ATOM 1884 NZ LYS B 19 6.594 8.586 10.862 1.00 0.00 N ATOM 0 H LYS B 19 7.973 8.362 6.110 1.00 0.00 H new ATOM 0 HA LYS B 19 9.284 10.227 7.807 1.00 0.00 H new ATOM 0 HB2 LYS B 19 8.602 7.621 7.983 1.00 0.00 H new ATOM 0 HB3 LYS B 19 10.266 7.413 7.474 1.00 0.00 H new ATOM 0 HG2 LYS B 19 10.311 7.367 9.845 1.00 0.00 H new ATOM 0 HG3 LYS B 19 10.946 8.937 9.394 1.00 0.00 H new ATOM 0 HD2 LYS B 19 9.434 9.516 11.072 1.00 0.00 H new ATOM 0 HD3 LYS B 19 8.464 9.755 9.633 1.00 0.00 H new ATOM 0 HE2 LYS B 19 7.922 7.134 10.082 1.00 0.00 H new ATOM 0 HE3 LYS B 19 8.273 7.627 11.726 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 5.931 7.868 11.219 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 6.619 9.391 11.520 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 6.280 8.913 9.926 1.00 0.00 H new ATOM 1898 N TYR B 20 11.135 8.803 5.459 1.00 0.00 N ATOM 1899 CA TYR B 20 12.355 8.971 4.686 1.00 0.00 C ATOM 1900 C TYR B 20 12.137 10.009 3.595 1.00 0.00 C ATOM 1901 O TYR B 20 13.009 10.821 3.289 1.00 0.00 O ATOM 1902 CB TYR B 20 12.810 7.634 4.101 1.00 0.00 C ATOM 1903 CG TYR B 20 13.743 6.877 5.020 1.00 0.00 C ATOM 1904 CD1 TYR B 20 13.289 6.354 6.224 1.00 0.00 C ATOM 1905 CD2 TYR B 20 15.079 6.692 4.688 1.00 0.00 C ATOM 1906 CE1 TYR B 20 14.139 5.668 7.070 1.00 0.00 C ATOM 1907 CE2 TYR B 20 15.935 6.007 5.529 1.00 0.00 C ATOM 1908 CZ TYR B 20 15.462 5.497 6.718 1.00 0.00 C ATOM 1909 OH TYR B 20 16.311 4.815 7.558 1.00 0.00 O ATOM 0 H TYR B 20 10.568 8.000 5.186 1.00 0.00 H new ATOM 0 HA TYR B 20 13.148 9.328 5.344 1.00 0.00 H new ATOM 0 HB2 TYR B 20 11.935 7.018 3.892 1.00 0.00 H new ATOM 0 HB3 TYR B 20 13.310 7.811 3.149 1.00 0.00 H new ATOM 0 HD1 TYR B 20 12.254 6.486 6.504 1.00 0.00 H new ATOM 0 HD2 TYR B 20 15.455 7.090 3.757 1.00 0.00 H new ATOM 0 HE1 TYR B 20 13.770 5.267 8.002 1.00 0.00 H new ATOM 0 HE2 TYR B 20 16.971 5.872 5.255 1.00 0.00 H new ATOM 0 HH TYR B 20 15.804 4.144 8.062 1.00 0.00 H new ATOM 1919 N ALA B 21 10.948 9.940 3.011 1.00 0.00 N ATOM 1920 CA ALA B 21 10.538 10.825 1.932 1.00 0.00 C ATOM 1921 C ALA B 21 10.305 12.250 2.425 1.00 0.00 C ATOM 1922 O ALA B 21 10.453 13.210 1.668 1.00 0.00 O ATOM 1923 CB ALA B 21 9.277 10.259 1.294 1.00 0.00 C ATOM 0 H ALA B 21 10.235 9.261 3.277 1.00 0.00 H new ATOM 0 HA ALA B 21 11.338 10.878 1.193 1.00 0.00 H new ATOM 0 HB1 ALA B 21 8.956 10.911 0.482 1.00 0.00 H new ATOM 0 HB2 ALA B 21 9.484 9.264 0.900 1.00 0.00 H new ATOM 0 HB3 ALA B 21 8.487 10.196 2.043 1.00 0.00 H new ATOM 1929 N GLY B 22 9.938 12.382 3.694 1.00 0.00 N ATOM 1930 CA GLY B 22 9.689 13.695 4.261 1.00 0.00 C ATOM 1931 C GLY B 22 10.502 13.953 5.513 1.00 0.00 C ATOM 1932 O GLY B 22 10.427 13.192 6.479 1.00 0.00 O ATOM 0 H GLY B 22 9.808 11.604 4.341 1.00 0.00 H new ATOM 0 HA2 GLY B 22 9.922 14.458 3.518 1.00 0.00 H new ATOM 0 HA3 GLY B 22 8.629 13.791 4.495 1.00 0.00 H new ATOM 1936 N LYS B 23 11.282 15.029 5.499 1.00 0.00 N ATOM 1937 CA LYS B 23 12.111 15.386 6.643 1.00 0.00 C ATOM 1938 C LYS B 23 12.258 16.901 6.757 1.00 0.00 C ATOM 1939 O LYS B 23 13.266 17.402 7.256 1.00 0.00 O ATOM 1940 CB LYS B 23 13.490 14.735 6.523 1.00 0.00 C ATOM 1941 CG LYS B 23 14.006 14.156 7.832 1.00 0.00 C ATOM 1942 CD LYS B 23 15.185 14.951 8.370 1.00 0.00 C ATOM 1943 CE LYS B 23 14.752 15.924 9.456 1.00 0.00 C ATOM 1944 NZ LYS B 23 15.567 17.171 9.443 1.00 0.00 N ATOM 0 H LYS B 23 11.357 15.668 4.708 1.00 0.00 H new ATOM 0 HA LYS B 23 11.621 15.018 7.544 1.00 0.00 H new ATOM 0 HB2 LYS B 23 13.444 13.941 5.777 1.00 0.00 H new ATOM 0 HB3 LYS B 23 14.202 15.475 6.157 1.00 0.00 H new ATOM 0 HG2 LYS B 23 13.203 14.151 8.569 1.00 0.00 H new ATOM 0 HG3 LYS B 23 14.305 13.119 7.679 1.00 0.00 H new ATOM 0 HD2 LYS B 23 15.934 14.267 8.770 1.00 0.00 H new ATOM 0 HD3 LYS B 23 15.657 15.500 7.555 1.00 0.00 H new ATOM 0 HE2 LYS B 23 13.701 16.176 9.319 1.00 0.00 H new ATOM 0 HE3 LYS B 23 14.840 15.443 10.430 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 15.240 17.807 10.198 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 16.567 16.934 9.599 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 15.463 17.644 8.523 1.00 0.00 H new ATOM 1958 N ASP B 24 11.244 17.626 6.292 1.00 0.00 N ATOM 1959 CA ASP B 24 11.261 19.084 6.342 1.00 0.00 C ATOM 1960 C ASP B 24 9.872 19.654 6.072 1.00 0.00 C ATOM 1961 O ASP B 24 9.736 20.741 5.510 1.00 0.00 O ATOM 1962 CB ASP B 24 12.261 19.640 5.327 1.00 0.00 C ATOM 1963 CG ASP B 24 11.953 19.198 3.910 1.00 0.00 C ATOM 1964 OD1 ASP B 24 11.178 19.898 3.225 1.00 0.00 O ATOM 1965 OD2 ASP B 24 12.486 18.150 3.486 1.00 0.00 O ATOM 0 H ASP B 24 10.402 17.228 5.877 1.00 0.00 H new ATOM 0 HA ASP B 24 11.568 19.384 7.344 1.00 0.00 H new ATOM 0 HB2 ASP B 24 12.255 20.729 5.374 1.00 0.00 H new ATOM 0 HB3 ASP B 24 13.266 19.315 5.596 1.00 0.00 H new ATOM 1970 N GLY B 25 8.845 18.915 6.476 1.00 0.00 N ATOM 1971 CA GLY B 25 7.481 19.364 6.269 1.00 0.00 C ATOM 1972 C GLY B 25 6.871 18.803 5.000 1.00 0.00 C ATOM 1973 O GLY B 25 5.869 18.088 5.047 1.00 0.00 O ATOM 0 H GLY B 25 8.933 18.013 6.943 1.00 0.00 H new ATOM 0 HA2 GLY B 25 6.871 19.068 7.123 1.00 0.00 H new ATOM 0 HA3 GLY B 25 7.463 20.453 6.226 1.00 0.00 H new ATOM 1977 N HIS B 26 7.475 19.126 3.862 1.00 0.00 N ATOM 1978 CA HIS B 26 6.985 18.649 2.574 1.00 0.00 C ATOM 1979 C HIS B 26 7.418 17.208 2.327 1.00 0.00 C ATOM 1980 O HIS B 26 8.423 16.748 2.869 1.00 0.00 O ATOM 1981 CB HIS B 26 7.496 19.548 1.446 1.00 0.00 C ATOM 1982 CG HIS B 26 7.118 20.988 1.609 1.00 0.00 C ATOM 1983 ND1 HIS B 26 5.809 21.423 1.636 1.00 0.00 N ATOM 1984 CD2 HIS B 26 7.884 22.095 1.755 1.00 0.00 C ATOM 1985 CE1 HIS B 26 5.787 22.736 1.790 1.00 0.00 C ATOM 1986 NE2 HIS B 26 7.033 23.166 1.865 1.00 0.00 N ATOM 0 H HIS B 26 8.305 19.716 3.805 1.00 0.00 H new ATOM 0 HA HIS B 26 5.896 18.684 2.592 1.00 0.00 H new ATOM 0 HB2 HIS B 26 8.582 19.470 1.394 1.00 0.00 H new ATOM 0 HB3 HIS B 26 7.104 19.183 0.496 1.00 0.00 H new ATOM 0 HD2 HIS B 26 8.963 22.129 1.780 1.00 0.00 H new ATOM 0 HE1 HIS B 26 4.901 23.351 1.845 1.00 0.00 H new ATOM 0 HE2 HIS B 26 7.317 24.138 1.985 1.00 0.00 H new ATOM 1995 N SER B 27 6.650 16.498 1.505 1.00 0.00 N ATOM 1996 CA SER B 27 6.951 15.107 1.185 1.00 0.00 C ATOM 1997 C SER B 27 6.210 14.668 -0.073 1.00 0.00 C ATOM 1998 O SER B 27 4.980 14.616 -0.093 1.00 0.00 O ATOM 1999 CB SER B 27 6.575 14.199 2.357 1.00 0.00 C ATOM 2000 OG SER B 27 5.168 14.124 2.512 1.00 0.00 O ATOM 0 H SER B 27 5.814 16.864 1.049 1.00 0.00 H new ATOM 0 HA SER B 27 8.022 15.025 1.002 1.00 0.00 H new ATOM 0 HB2 SER B 27 6.980 13.200 2.192 1.00 0.00 H new ATOM 0 HB3 SER B 27 7.026 14.578 3.274 1.00 0.00 H new ATOM 0 HG SER B 27 4.850 13.253 2.195 1.00 0.00 H new ATOM 2006 N VAL B 28 6.964 14.356 -1.122 1.00 0.00 N ATOM 2007 CA VAL B 28 6.373 13.925 -2.383 1.00 0.00 C ATOM 2008 C VAL B 28 7.093 12.702 -2.949 1.00 0.00 C ATOM 2009 O VAL B 28 6.458 11.776 -3.452 1.00 0.00 O ATOM 2010 CB VAL B 28 6.398 15.057 -3.430 1.00 0.00 C ATOM 2011 CG1 VAL B 28 7.829 15.464 -3.748 1.00 0.00 C ATOM 2012 CG2 VAL B 28 5.661 14.636 -4.693 1.00 0.00 C ATOM 0 H VAL B 28 7.983 14.394 -1.124 1.00 0.00 H new ATOM 0 HA VAL B 28 5.338 13.659 -2.169 1.00 0.00 H new ATOM 0 HB VAL B 28 5.885 15.923 -3.011 1.00 0.00 H new ATOM 0 HG11 VAL B 28 7.824 16.264 -4.489 1.00 0.00 H new ATOM 0 HG12 VAL B 28 8.318 15.814 -2.839 1.00 0.00 H new ATOM 0 HG13 VAL B 28 8.372 14.606 -4.144 1.00 0.00 H new ATOM 0 HG21 VAL B 28 5.690 15.448 -5.419 1.00 0.00 H new ATOM 0 HG22 VAL B 28 6.140 13.753 -5.117 1.00 0.00 H new ATOM 0 HG23 VAL B 28 4.624 14.404 -4.449 1.00 0.00 H new ATOM 2022 N THR B 29 8.421 12.704 -2.867 1.00 0.00 N ATOM 2023 CA THR B 29 9.216 11.596 -3.373 1.00 0.00 C ATOM 2024 C THR B 29 10.302 11.201 -2.380 1.00 0.00 C ATOM 2025 O THR B 29 10.746 12.010 -1.564 1.00 0.00 O ATOM 2026 CB THR B 29 9.850 11.963 -4.713 1.00 0.00 C ATOM 2027 OG1 THR B 29 10.283 13.311 -4.713 1.00 0.00 O ATOM 2028 CG2 THR B 29 8.913 11.778 -5.887 1.00 0.00 C ATOM 0 H THR B 29 8.966 13.461 -2.455 1.00 0.00 H new ATOM 0 HA THR B 29 8.550 10.745 -3.513 1.00 0.00 H new ATOM 0 HB THR B 29 10.692 11.281 -4.831 1.00 0.00 H new ATOM 0 HG1 THR B 29 10.687 13.525 -5.580 1.00 0.00 H new ATOM 0 HG21 THR B 29 9.425 12.056 -6.808 1.00 0.00 H new ATOM 0 HG22 THR B 29 8.604 10.734 -5.945 1.00 0.00 H new ATOM 0 HG23 THR B 29 8.035 12.410 -5.755 1.00 0.00 H new ATOM 2036 N LEU B 30 10.726 9.948 -2.465 1.00 0.00 N ATOM 2037 CA LEU B 30 11.763 9.417 -1.589 1.00 0.00 C ATOM 2038 C LEU B 30 13.041 9.145 -2.393 1.00 0.00 C ATOM 2039 O LEU B 30 13.426 9.957 -3.228 1.00 0.00 O ATOM 2040 CB LEU B 30 11.255 8.141 -0.903 1.00 0.00 C ATOM 2041 CG LEU B 30 11.692 7.948 0.554 1.00 0.00 C ATOM 2042 CD1 LEU B 30 11.441 6.515 0.995 1.00 0.00 C ATOM 2043 CD2 LEU B 30 13.157 8.318 0.749 1.00 0.00 C ATOM 0 H LEU B 30 10.364 9.273 -3.139 1.00 0.00 H new ATOM 0 HA LEU B 30 12.001 10.150 -0.818 1.00 0.00 H new ATOM 0 HB2 LEU B 30 10.166 8.141 -0.939 1.00 0.00 H new ATOM 0 HB3 LEU B 30 11.593 7.281 -1.481 1.00 0.00 H new ATOM 0 HG LEU B 30 11.096 8.617 1.174 1.00 0.00 H new ATOM 0 HD11 LEU B 30 11.756 6.393 2.031 1.00 0.00 H new ATOM 0 HD12 LEU B 30 10.378 6.289 0.910 1.00 0.00 H new ATOM 0 HD13 LEU B 30 12.009 5.834 0.361 1.00 0.00 H new ATOM 0 HD21 LEU B 30 13.434 8.170 1.793 1.00 0.00 H new ATOM 0 HD22 LEU B 30 13.779 7.686 0.115 1.00 0.00 H new ATOM 0 HD23 LEU B 30 13.307 9.363 0.479 1.00 0.00 H new ATOM 2055 N SER B 31 13.687 8.002 -2.162 1.00 0.00 N ATOM 2056 CA SER B 31 14.897 7.651 -2.894 1.00 0.00 C ATOM 2057 C SER B 31 15.261 6.190 -2.658 1.00 0.00 C ATOM 2058 O SER B 31 15.245 5.712 -1.522 1.00 0.00 O ATOM 2059 CB SER B 31 16.057 8.558 -2.483 1.00 0.00 C ATOM 2060 OG SER B 31 17.104 8.510 -3.436 1.00 0.00 O ATOM 0 H SER B 31 13.391 7.308 -1.476 1.00 0.00 H new ATOM 0 HA SER B 31 14.705 7.794 -3.957 1.00 0.00 H new ATOM 0 HB2 SER B 31 15.702 9.583 -2.379 1.00 0.00 H new ATOM 0 HB3 SER B 31 16.435 8.251 -1.508 1.00 0.00 H new ATOM 0 HG SER B 31 17.833 9.100 -3.151 1.00 0.00 H new ATOM 2066 N LYS B 32 15.583 5.482 -3.736 1.00 0.00 N ATOM 2067 CA LYS B 32 15.945 4.071 -3.647 1.00 0.00 C ATOM 2068 C LYS B 32 17.004 3.846 -2.572 1.00 0.00 C ATOM 2069 O LYS B 32 16.953 2.865 -1.830 1.00 0.00 O ATOM 2070 CB LYS B 32 16.457 3.569 -4.998 1.00 0.00 C ATOM 2071 CG LYS B 32 17.626 4.374 -5.542 1.00 0.00 C ATOM 2072 CD LYS B 32 18.959 3.750 -5.159 1.00 0.00 C ATOM 2073 CE LYS B 32 19.954 3.813 -6.307 1.00 0.00 C ATOM 2074 NZ LYS B 32 21.276 3.244 -5.927 1.00 0.00 N ATOM 0 H LYS B 32 15.601 5.862 -4.682 1.00 0.00 H new ATOM 0 HA LYS B 32 15.052 3.509 -3.373 1.00 0.00 H new ATOM 0 HB2 LYS B 32 16.759 2.527 -4.898 1.00 0.00 H new ATOM 0 HB3 LYS B 32 15.641 3.596 -5.720 1.00 0.00 H new ATOM 0 HG2 LYS B 32 17.551 4.438 -6.628 1.00 0.00 H new ATOM 0 HG3 LYS B 32 17.577 5.393 -5.159 1.00 0.00 H new ATOM 0 HD2 LYS B 32 19.369 4.268 -4.292 1.00 0.00 H new ATOM 0 HD3 LYS B 32 18.805 2.711 -4.866 1.00 0.00 H new ATOM 0 HE2 LYS B 32 19.556 3.267 -7.163 1.00 0.00 H new ATOM 0 HE3 LYS B 32 20.081 4.849 -6.621 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 21.926 3.306 -6.736 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 21.668 3.780 -5.127 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 21.159 2.248 -5.652 1.00 0.00 H new ATOM 2088 N THR B 33 17.962 4.764 -2.494 1.00 0.00 N ATOM 2089 CA THR B 33 19.030 4.673 -1.514 1.00 0.00 C ATOM 2090 C THR B 33 18.487 4.904 -0.105 1.00 0.00 C ATOM 2091 O THR B 33 18.796 4.155 0.816 1.00 0.00 O ATOM 2092 CB THR B 33 20.128 5.689 -1.848 1.00 0.00 C ATOM 2093 OG1 THR B 33 21.102 5.110 -2.698 1.00 0.00 O ATOM 2094 CG2 THR B 33 20.848 6.227 -0.632 1.00 0.00 C ATOM 0 H THR B 33 18.017 5.581 -3.102 1.00 0.00 H new ATOM 0 HA THR B 33 19.458 3.671 -1.548 1.00 0.00 H new ATOM 0 HB THR B 33 19.611 6.516 -2.335 1.00 0.00 H new ATOM 0 HG1 THR B 33 21.794 5.773 -2.902 1.00 0.00 H new ATOM 0 HG21 THR B 33 21.610 6.940 -0.946 1.00 0.00 H new ATOM 0 HG22 THR B 33 20.133 6.725 0.023 1.00 0.00 H new ATOM 0 HG23 THR B 33 21.320 5.404 -0.095 1.00 0.00 H new ATOM 2102 N GLU B 34 17.673 5.940 0.064 1.00 0.00 N ATOM 2103 CA GLU B 34 17.100 6.234 1.373 1.00 0.00 C ATOM 2104 C GLU B 34 16.309 5.034 1.883 1.00 0.00 C ATOM 2105 O GLU B 34 16.218 4.802 3.087 1.00 0.00 O ATOM 2106 CB GLU B 34 16.206 7.472 1.308 1.00 0.00 C ATOM 2107 CG GLU B 34 16.833 8.699 1.946 1.00 0.00 C ATOM 2108 CD GLU B 34 15.850 9.843 2.098 1.00 0.00 C ATOM 2109 OE1 GLU B 34 15.295 10.289 1.072 1.00 0.00 O ATOM 2110 OE2 GLU B 34 15.636 10.295 3.242 1.00 0.00 O ATOM 0 H GLU B 34 17.397 6.583 -0.678 1.00 0.00 H new ATOM 0 HA GLU B 34 17.915 6.439 2.067 1.00 0.00 H new ATOM 0 HB2 GLU B 34 15.975 7.691 0.265 1.00 0.00 H new ATOM 0 HB3 GLU B 34 15.260 7.255 1.805 1.00 0.00 H new ATOM 0 HG2 GLU B 34 17.229 8.432 2.926 1.00 0.00 H new ATOM 0 HG3 GLU B 34 17.677 9.028 1.340 1.00 0.00 H new ATOM 2117 N PHE B 35 15.755 4.265 0.952 1.00 0.00 N ATOM 2118 CA PHE B 35 14.989 3.075 1.300 1.00 0.00 C ATOM 2119 C PHE B 35 15.917 2.000 1.861 1.00 0.00 C ATOM 2120 O PHE B 35 15.512 1.182 2.687 1.00 0.00 O ATOM 2121 CB PHE B 35 14.241 2.543 0.076 1.00 0.00 C ATOM 2122 CG PHE B 35 12.904 1.956 0.413 1.00 0.00 C ATOM 2123 CD1 PHE B 35 12.802 0.912 1.317 1.00 0.00 C ATOM 2124 CD2 PHE B 35 11.749 2.453 -0.162 1.00 0.00 C ATOM 2125 CE1 PHE B 35 11.574 0.373 1.639 1.00 0.00 C ATOM 2126 CE2 PHE B 35 10.516 1.919 0.154 1.00 0.00 C ATOM 2127 CZ PHE B 35 10.428 0.877 1.057 1.00 0.00 C ATOM 0 H PHE B 35 15.822 4.445 -0.050 1.00 0.00 H new ATOM 0 HA PHE B 35 14.257 3.342 2.062 1.00 0.00 H new ATOM 0 HB2 PHE B 35 14.105 3.354 -0.640 1.00 0.00 H new ATOM 0 HB3 PHE B 35 14.851 1.784 -0.414 1.00 0.00 H new ATOM 0 HD1 PHE B 35 13.695 0.515 1.776 1.00 0.00 H new ATOM 0 HD2 PHE B 35 11.812 3.269 -0.867 1.00 0.00 H new ATOM 0 HE1 PHE B 35 11.509 -0.442 2.345 1.00 0.00 H new ATOM 0 HE2 PHE B 35 9.622 2.315 -0.304 1.00 0.00 H new ATOM 0 HZ PHE B 35 9.465 0.458 1.307 1.00 0.00 H new ATOM 2137 N LEU B 36 17.167 2.016 1.406 1.00 0.00 N ATOM 2138 CA LEU B 36 18.166 1.051 1.859 1.00 0.00 C ATOM 2139 C LEU B 36 18.236 0.998 3.367 1.00 0.00 C ATOM 2140 O LEU B 36 18.052 -0.050 3.986 1.00 0.00 O ATOM 2141 CB LEU B 36 19.546 1.450 1.344 1.00 0.00 C ATOM 2142 CG LEU B 36 19.988 0.737 0.088 1.00 0.00 C ATOM 2143 CD1 LEU B 36 20.145 -0.746 0.373 1.00 0.00 C ATOM 2144 CD2 LEU B 36 18.991 0.987 -1.029 1.00 0.00 C ATOM 0 H LEU B 36 17.513 2.689 0.722 1.00 0.00 H new ATOM 0 HA LEU B 36 17.872 0.075 1.473 1.00 0.00 H new ATOM 0 HB2 LEU B 36 19.551 2.524 1.155 1.00 0.00 H new ATOM 0 HB3 LEU B 36 20.279 1.261 2.128 1.00 0.00 H new ATOM 0 HG LEU B 36 20.954 1.125 -0.236 1.00 0.00 H new ATOM 0 HD11 LEU B 36 20.464 -1.259 -0.534 1.00 0.00 H new ATOM 0 HD12 LEU B 36 20.893 -0.889 1.153 1.00 0.00 H new ATOM 0 HD13 LEU B 36 19.191 -1.156 0.705 1.00 0.00 H new ATOM 0 HD21 LEU B 36 19.318 0.469 -1.931 1.00 0.00 H new ATOM 0 HD22 LEU B 36 18.011 0.615 -0.732 1.00 0.00 H new ATOM 0 HD23 LEU B 36 18.928 2.057 -1.228 1.00 0.00 H new ATOM 2156 N SER B 37 18.535 2.145 3.941 1.00 0.00 N ATOM 2157 CA SER B 37 18.674 2.262 5.379 1.00 0.00 C ATOM 2158 C SER B 37 17.402 1.820 6.098 1.00 0.00 C ATOM 2159 O SER B 37 17.456 1.053 7.059 1.00 0.00 O ATOM 2160 CB SER B 37 19.027 3.700 5.767 1.00 0.00 C ATOM 2161 OG SER B 37 20.167 3.737 6.608 1.00 0.00 O ATOM 0 H SER B 37 18.687 3.015 3.431 1.00 0.00 H new ATOM 0 HA SER B 37 19.484 1.602 5.689 1.00 0.00 H new ATOM 0 HB2 SER B 37 19.216 4.287 4.868 1.00 0.00 H new ATOM 0 HB3 SER B 37 18.181 4.161 6.276 1.00 0.00 H new ATOM 0 HG SER B 37 20.372 4.667 6.840 1.00 0.00 H new ATOM 2167 N PHE B 38 16.258 2.306 5.624 1.00 0.00 N ATOM 2168 CA PHE B 38 14.971 1.960 6.221 1.00 0.00 C ATOM 2169 C PHE B 38 14.760 0.451 6.206 1.00 0.00 C ATOM 2170 O PHE B 38 14.444 -0.151 7.233 1.00 0.00 O ATOM 2171 CB PHE B 38 13.835 2.657 5.463 1.00 0.00 C ATOM 2172 CG PHE B 38 12.461 2.318 5.972 1.00 0.00 C ATOM 2173 CD1 PHE B 38 11.898 1.077 5.715 1.00 0.00 C ATOM 2174 CD2 PHE B 38 11.730 3.241 6.703 1.00 0.00 C ATOM 2175 CE1 PHE B 38 10.634 0.765 6.178 1.00 0.00 C ATOM 2176 CE2 PHE B 38 10.466 2.935 7.168 1.00 0.00 C ATOM 2177 CZ PHE B 38 9.917 1.695 6.905 1.00 0.00 C ATOM 0 H PHE B 38 16.196 2.941 4.828 1.00 0.00 H new ATOM 0 HA PHE B 38 14.969 2.299 7.257 1.00 0.00 H new ATOM 0 HB2 PHE B 38 13.978 3.736 5.526 1.00 0.00 H new ATOM 0 HB3 PHE B 38 13.897 2.388 4.409 1.00 0.00 H new ATOM 0 HD1 PHE B 38 12.454 0.346 5.146 1.00 0.00 H new ATOM 0 HD2 PHE B 38 12.154 4.212 6.912 1.00 0.00 H new ATOM 0 HE1 PHE B 38 10.207 -0.205 5.972 1.00 0.00 H new ATOM 0 HE2 PHE B 38 9.908 3.664 7.736 1.00 0.00 H new ATOM 0 HZ PHE B 38 8.929 1.453 7.267 1.00 0.00 H new ATOM 2187 N MET B 39 14.941 -0.156 5.040 1.00 0.00 N ATOM 2188 CA MET B 39 14.775 -1.596 4.901 1.00 0.00 C ATOM 2189 C MET B 39 15.799 -2.337 5.752 1.00 0.00 C ATOM 2190 O MET B 39 15.536 -3.432 6.243 1.00 0.00 O ATOM 2191 CB MET B 39 14.908 -2.011 3.435 1.00 0.00 C ATOM 2192 CG MET B 39 14.610 -3.482 3.194 1.00 0.00 C ATOM 2193 SD MET B 39 13.107 -3.743 2.231 1.00 0.00 S ATOM 2194 CE MET B 39 11.865 -3.069 3.333 1.00 0.00 C ATOM 0 H MET B 39 15.202 0.325 4.179 1.00 0.00 H new ATOM 0 HA MET B 39 13.777 -1.860 5.249 1.00 0.00 H new ATOM 0 HB2 MET B 39 14.230 -1.407 2.831 1.00 0.00 H new ATOM 0 HB3 MET B 39 15.920 -1.792 3.094 1.00 0.00 H new ATOM 0 HG2 MET B 39 15.453 -3.938 2.674 1.00 0.00 H new ATOM 0 HG3 MET B 39 14.514 -3.990 4.153 1.00 0.00 H new ATOM 0 HE1 MET B 39 11.138 -2.498 2.756 1.00 0.00 H new ATOM 0 HE2 MET B 39 11.358 -3.883 3.852 1.00 0.00 H new ATOM 0 HE3 MET B 39 12.342 -2.415 4.063 1.00 0.00 H new ATOM 2204 N ASN B 40 16.967 -1.729 5.927 1.00 0.00 N ATOM 2205 CA ASN B 40 18.026 -2.329 6.728 1.00 0.00 C ATOM 2206 C ASN B 40 17.692 -2.251 8.217 1.00 0.00 C ATOM 2207 O ASN B 40 18.254 -2.988 9.028 1.00 0.00 O ATOM 2208 CB ASN B 40 19.359 -1.630 6.457 1.00 0.00 C ATOM 2209 CG ASN B 40 19.891 -1.918 5.067 1.00 0.00 C ATOM 2210 OD1 ASN B 40 19.763 -3.033 4.560 1.00 0.00 O ATOM 2211 ND2 ASN B 40 20.492 -0.912 4.443 1.00 0.00 N ATOM 0 H ASN B 40 17.204 -0.822 5.525 1.00 0.00 H new ATOM 0 HA ASN B 40 18.110 -3.378 6.446 1.00 0.00 H new ATOM 0 HB2 ASN B 40 19.233 -0.554 6.579 1.00 0.00 H new ATOM 0 HB3 ASN B 40 20.092 -1.951 7.197 1.00 0.00 H new ATOM 0 HD21 ASN B 40 20.870 -1.046 3.505 1.00 0.00 H new ATOM 0 HD22 ASN B 40 20.576 -0.005 4.901 1.00 0.00 H new ATOM 2218 N THR B 41 16.782 -1.346 8.571 1.00 0.00 N ATOM 2219 CA THR B 41 16.385 -1.161 9.962 1.00 0.00 C ATOM 2220 C THR B 41 14.896 -1.440 10.161 1.00 0.00 C ATOM 2221 O THR B 41 14.508 -2.512 10.621 1.00 0.00 O ATOM 2222 CB THR B 41 16.704 0.267 10.408 1.00 0.00 C ATOM 2223 OG1 THR B 41 16.522 1.177 9.338 1.00 0.00 O ATOM 2224 CG2 THR B 41 18.116 0.433 10.916 1.00 0.00 C ATOM 0 H THR B 41 16.306 -0.730 7.912 1.00 0.00 H new ATOM 0 HA THR B 41 16.947 -1.872 10.568 1.00 0.00 H new ATOM 0 HB THR B 41 16.015 0.476 11.226 1.00 0.00 H new ATOM 0 HG1 THR B 41 17.257 1.079 8.697 1.00 0.00 H new ATOM 0 HG21 THR B 41 18.275 1.469 11.216 1.00 0.00 H new ATOM 0 HG22 THR B 41 18.273 -0.221 11.774 1.00 0.00 H new ATOM 0 HG23 THR B 41 18.820 0.171 10.126 1.00 0.00 H new ATOM 2232 N GLU B 42 14.074 -0.452 9.821 1.00 0.00 N ATOM 2233 CA GLU B 42 12.624 -0.558 9.968 1.00 0.00 C ATOM 2234 C GLU B 42 12.090 -1.891 9.442 1.00 0.00 C ATOM 2235 O GLU B 42 11.182 -2.479 10.031 1.00 0.00 O ATOM 2236 CB GLU B 42 11.943 0.601 9.242 1.00 0.00 C ATOM 2237 CG GLU B 42 12.492 1.965 9.630 1.00 0.00 C ATOM 2238 CD GLU B 42 11.436 2.870 10.235 1.00 0.00 C ATOM 2239 OE1 GLU B 42 10.244 2.698 9.901 1.00 0.00 O ATOM 2240 OE2 GLU B 42 11.800 3.751 11.042 1.00 0.00 O ATOM 0 H GLU B 42 14.390 0.439 9.438 1.00 0.00 H new ATOM 0 HA GLU B 42 12.396 -0.511 11.033 1.00 0.00 H new ATOM 0 HB2 GLU B 42 12.058 0.464 8.167 1.00 0.00 H new ATOM 0 HB3 GLU B 42 10.874 0.574 9.454 1.00 0.00 H new ATOM 0 HG2 GLU B 42 13.306 1.835 10.344 1.00 0.00 H new ATOM 0 HG3 GLU B 42 12.915 2.446 8.748 1.00 0.00 H new ATOM 2247 N LEU B 43 12.655 -2.364 8.337 1.00 0.00 N ATOM 2248 CA LEU B 43 12.228 -3.627 7.743 1.00 0.00 C ATOM 2249 C LEU B 43 13.430 -4.515 7.446 1.00 0.00 C ATOM 2250 O LEU B 43 13.585 -5.021 6.334 1.00 0.00 O ATOM 2251 CB LEU B 43 11.438 -3.371 6.456 1.00 0.00 C ATOM 2252 CG LEU B 43 9.974 -2.970 6.657 1.00 0.00 C ATOM 2253 CD1 LEU B 43 9.297 -2.741 5.314 1.00 0.00 C ATOM 2254 CD2 LEU B 43 9.233 -4.032 7.459 1.00 0.00 C ATOM 0 H LEU B 43 13.408 -1.894 7.835 1.00 0.00 H new ATOM 0 HA LEU B 43 11.584 -4.139 8.458 1.00 0.00 H new ATOM 0 HB2 LEU B 43 11.939 -2.584 5.892 1.00 0.00 H new ATOM 0 HB3 LEU B 43 11.470 -4.272 5.844 1.00 0.00 H new ATOM 0 HG LEU B 43 9.946 -2.037 7.220 1.00 0.00 H new ATOM 0 HD11 LEU B 43 8.257 -2.457 5.475 1.00 0.00 H new ATOM 0 HD12 LEU B 43 9.812 -1.944 4.778 1.00 0.00 H new ATOM 0 HD13 LEU B 43 9.336 -3.658 4.726 1.00 0.00 H new ATOM 0 HD21 LEU B 43 8.194 -3.729 7.591 1.00 0.00 H new ATOM 0 HD22 LEU B 43 9.269 -4.982 6.925 1.00 0.00 H new ATOM 0 HD23 LEU B 43 9.705 -4.146 8.435 1.00 0.00 H new ATOM 2266 N ALA B 44 14.284 -4.698 8.448 1.00 0.00 N ATOM 2267 CA ALA B 44 15.478 -5.519 8.294 1.00 0.00 C ATOM 2268 C ALA B 44 15.146 -6.999 8.430 1.00 0.00 C ATOM 2269 O ALA B 44 15.739 -7.842 7.758 1.00 0.00 O ATOM 2270 CB ALA B 44 16.529 -5.112 9.315 1.00 0.00 C ATOM 0 H ALA B 44 14.171 -4.288 9.375 1.00 0.00 H new ATOM 0 HA ALA B 44 15.878 -5.356 7.293 1.00 0.00 H new ATOM 0 HB1 ALA B 44 17.417 -5.732 9.190 1.00 0.00 H new ATOM 0 HB2 ALA B 44 16.794 -4.065 9.167 1.00 0.00 H new ATOM 0 HB3 ALA B 44 16.131 -5.247 10.321 1.00 0.00 H new ATOM 2276 N ALA B 45 14.194 -7.308 9.303 1.00 0.00 N ATOM 2277 CA ALA B 45 13.782 -8.687 9.527 1.00 0.00 C ATOM 2278 C ALA B 45 13.320 -9.343 8.227 1.00 0.00 C ATOM 2279 O ALA B 45 13.374 -10.565 8.086 1.00 0.00 O ATOM 2280 CB ALA B 45 12.678 -8.738 10.572 1.00 0.00 C ATOM 0 H ALA B 45 13.693 -6.621 9.867 1.00 0.00 H new ATOM 0 HA ALA B 45 14.643 -9.246 9.894 1.00 0.00 H new ATOM 0 HB1 ALA B 45 12.377 -9.773 10.733 1.00 0.00 H new ATOM 0 HB2 ALA B 45 13.044 -8.317 11.509 1.00 0.00 H new ATOM 0 HB3 ALA B 45 11.821 -8.160 10.225 1.00 0.00 H new ATOM 2286 N PHE B 46 12.872 -8.523 7.280 1.00 0.00 N ATOM 2287 CA PHE B 46 12.407 -9.025 5.991 1.00 0.00 C ATOM 2288 C PHE B 46 13.543 -9.053 4.968 1.00 0.00 C ATOM 2289 O PHE B 46 13.305 -9.182 3.767 1.00 0.00 O ATOM 2290 CB PHE B 46 11.256 -8.161 5.473 1.00 0.00 C ATOM 2291 CG PHE B 46 10.080 -8.110 6.408 1.00 0.00 C ATOM 2292 CD1 PHE B 46 10.120 -7.326 7.549 1.00 0.00 C ATOM 2293 CD2 PHE B 46 8.937 -8.846 6.143 1.00 0.00 C ATOM 2294 CE1 PHE B 46 9.041 -7.277 8.411 1.00 0.00 C ATOM 2295 CE2 PHE B 46 7.854 -8.802 7.002 1.00 0.00 C ATOM 2296 CZ PHE B 46 7.907 -8.016 8.137 1.00 0.00 C ATOM 0 H PHE B 46 12.821 -7.509 7.381 1.00 0.00 H new ATOM 0 HA PHE B 46 12.053 -10.046 6.134 1.00 0.00 H new ATOM 0 HB2 PHE B 46 11.620 -7.148 5.303 1.00 0.00 H new ATOM 0 HB3 PHE B 46 10.927 -8.547 4.508 1.00 0.00 H new ATOM 0 HD1 PHE B 46 11.005 -6.746 7.768 1.00 0.00 H new ATOM 0 HD2 PHE B 46 8.891 -9.461 5.256 1.00 0.00 H new ATOM 0 HE1 PHE B 46 9.085 -6.662 9.298 1.00 0.00 H new ATOM 0 HE2 PHE B 46 6.968 -9.381 6.786 1.00 0.00 H new ATOM 0 HZ PHE B 46 7.062 -7.980 8.809 1.00 0.00 H new ATOM 2306 N THR B 47 14.777 -8.934 5.453 1.00 0.00 N ATOM 2307 CA THR B 47 15.951 -8.948 4.588 1.00 0.00 C ATOM 2308 C THR B 47 17.072 -9.765 5.224 1.00 0.00 C ATOM 2309 O THR B 47 17.746 -10.546 4.552 1.00 0.00 O ATOM 2310 CB THR B 47 16.432 -7.522 4.320 1.00 0.00 C ATOM 2311 OG1 THR B 47 17.022 -6.966 5.482 1.00 0.00 O ATOM 2312 CG2 THR B 47 15.326 -6.591 3.877 1.00 0.00 C ATOM 0 H THR B 47 14.989 -8.826 6.445 1.00 0.00 H new ATOM 0 HA THR B 47 15.674 -9.410 3.641 1.00 0.00 H new ATOM 0 HB THR B 47 17.157 -7.609 3.511 1.00 0.00 H new ATOM 0 HG1 THR B 47 16.466 -7.172 6.262 1.00 0.00 H new ATOM 0 HG21 THR B 47 15.736 -5.596 3.704 1.00 0.00 H new ATOM 0 HG22 THR B 47 14.882 -6.966 2.955 1.00 0.00 H new ATOM 0 HG23 THR B 47 14.562 -6.539 4.652 1.00 0.00 H new ATOM 2320 N LYS B 48 17.264 -9.574 6.526 1.00 0.00 N ATOM 2321 CA LYS B 48 18.298 -10.287 7.267 1.00 0.00 C ATOM 2322 C LYS B 48 18.081 -11.795 7.196 1.00 0.00 C ATOM 2323 O LYS B 48 17.334 -12.363 7.992 1.00 0.00 O ATOM 2324 CB LYS B 48 18.306 -9.829 8.728 1.00 0.00 C ATOM 2325 CG LYS B 48 16.955 -9.954 9.413 1.00 0.00 C ATOM 2326 CD LYS B 48 17.082 -10.584 10.790 1.00 0.00 C ATOM 2327 CE LYS B 48 17.720 -9.627 11.785 1.00 0.00 C ATOM 2328 NZ LYS B 48 16.829 -8.473 12.097 1.00 0.00 N ATOM 0 H LYS B 48 16.714 -8.928 7.092 1.00 0.00 H new ATOM 0 HA LYS B 48 19.262 -10.058 6.812 1.00 0.00 H new ATOM 0 HB2 LYS B 48 19.039 -10.417 9.280 1.00 0.00 H new ATOM 0 HB3 LYS B 48 18.632 -8.790 8.772 1.00 0.00 H new ATOM 0 HG2 LYS B 48 16.500 -8.968 9.504 1.00 0.00 H new ATOM 0 HG3 LYS B 48 16.288 -10.557 8.797 1.00 0.00 H new ATOM 0 HD2 LYS B 48 16.096 -10.879 11.149 1.00 0.00 H new ATOM 0 HD3 LYS B 48 17.681 -11.492 10.722 1.00 0.00 H new ATOM 0 HE2 LYS B 48 17.955 -10.163 12.705 1.00 0.00 H new ATOM 0 HE3 LYS B 48 18.663 -9.259 11.381 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 17.175 -7.988 12.949 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 16.828 -7.809 11.297 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 15.861 -8.816 12.263 1.00 0.00 H new ATOM 2342 N ASN B 49 18.740 -12.439 6.238 1.00 0.00 N ATOM 2343 CA ASN B 49 18.618 -13.883 6.066 1.00 0.00 C ATOM 2344 C ASN B 49 17.167 -14.279 5.815 1.00 0.00 C ATOM 2345 O ASN B 49 16.439 -14.629 6.744 1.00 0.00 O ATOM 2346 CB ASN B 49 19.155 -14.612 7.300 1.00 0.00 C ATOM 2347 CG ASN B 49 20.534 -15.200 7.072 1.00 0.00 C ATOM 2348 OD1 ASN B 49 20.678 -16.396 6.823 1.00 0.00 O ATOM 2349 ND2 ASN B 49 21.557 -14.358 7.157 1.00 0.00 N ATOM 0 H ASN B 49 19.363 -11.985 5.570 1.00 0.00 H new ATOM 0 HA ASN B 49 19.209 -14.173 5.197 1.00 0.00 H new ATOM 0 HB2 ASN B 49 19.194 -13.918 8.140 1.00 0.00 H new ATOM 0 HB3 ASN B 49 18.465 -15.409 7.576 1.00 0.00 H new ATOM 0 HD21 ASN B 49 22.509 -14.696 7.014 1.00 0.00 H new ATOM 0 HD22 ASN B 49 21.391 -13.373 7.366 1.00 0.00 H new ATOM 2356 N GLN B 50 16.753 -14.222 4.554 1.00 0.00 N ATOM 2357 CA GLN B 50 15.388 -14.575 4.181 1.00 0.00 C ATOM 2358 C GLN B 50 15.379 -15.675 3.125 1.00 0.00 C ATOM 2359 O GLN B 50 16.133 -15.623 2.154 1.00 0.00 O ATOM 2360 CB GLN B 50 14.645 -13.343 3.657 1.00 0.00 C ATOM 2361 CG GLN B 50 14.638 -12.177 4.632 1.00 0.00 C ATOM 2362 CD GLN B 50 13.890 -12.493 5.913 1.00 0.00 C ATOM 2363 OE1 GLN B 50 14.496 -12.782 6.944 1.00 0.00 O ATOM 2364 NE2 GLN B 50 12.564 -12.438 5.854 1.00 0.00 N ATOM 0 H GLN B 50 17.343 -13.935 3.773 1.00 0.00 H new ATOM 0 HA GLN B 50 14.880 -14.947 5.071 1.00 0.00 H new ATOM 0 HB2 GLN B 50 15.105 -13.022 2.723 1.00 0.00 H new ATOM 0 HB3 GLN B 50 13.616 -13.620 3.427 1.00 0.00 H new ATOM 0 HG2 GLN B 50 15.665 -11.904 4.873 1.00 0.00 H new ATOM 0 HG3 GLN B 50 14.182 -11.311 4.153 1.00 0.00 H new ATOM 0 HE21 GLN B 50 12.102 -12.194 4.978 1.00 0.00 H new ATOM 0 HE22 GLN B 50 12.008 -12.640 6.685 1.00 0.00 H new ATOM 2373 N LYS B 51 14.519 -16.669 3.322 1.00 0.00 N ATOM 2374 CA LYS B 51 14.410 -17.783 2.386 1.00 0.00 C ATOM 2375 C LYS B 51 14.056 -17.287 0.986 1.00 0.00 C ATOM 2376 O LYS B 51 14.386 -17.929 -0.012 1.00 0.00 O ATOM 2377 CB LYS B 51 13.355 -18.781 2.871 1.00 0.00 C ATOM 2378 CG LYS B 51 13.853 -20.217 2.915 1.00 0.00 C ATOM 2379 CD LYS B 51 12.913 -21.108 3.711 1.00 0.00 C ATOM 2380 CE LYS B 51 13.680 -22.069 4.607 1.00 0.00 C ATOM 2381 NZ LYS B 51 14.222 -21.388 5.815 1.00 0.00 N ATOM 0 H LYS B 51 13.888 -16.726 4.121 1.00 0.00 H new ATOM 0 HA LYS B 51 15.378 -18.282 2.339 1.00 0.00 H new ATOM 0 HB2 LYS B 51 13.022 -18.490 3.867 1.00 0.00 H new ATOM 0 HB3 LYS B 51 12.486 -18.726 2.215 1.00 0.00 H new ATOM 0 HG2 LYS B 51 13.948 -20.602 1.900 1.00 0.00 H new ATOM 0 HG3 LYS B 51 14.847 -20.245 3.361 1.00 0.00 H new ATOM 0 HD2 LYS B 51 12.253 -20.490 4.320 1.00 0.00 H new ATOM 0 HD3 LYS B 51 12.280 -21.673 3.027 1.00 0.00 H new ATOM 0 HE2 LYS B 51 13.023 -22.883 4.913 1.00 0.00 H new ATOM 0 HE3 LYS B 51 14.499 -22.515 4.043 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 14.738 -22.076 6.400 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 14.869 -20.628 5.524 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 13.438 -20.984 6.367 1.00 0.00 H new ATOM 2395 N ASP B 52 13.383 -16.142 0.919 1.00 0.00 N ATOM 2396 CA ASP B 52 12.984 -15.562 -0.357 1.00 0.00 C ATOM 2397 C ASP B 52 13.939 -14.441 -0.769 1.00 0.00 C ATOM 2398 O ASP B 52 13.879 -13.337 -0.226 1.00 0.00 O ATOM 2399 CB ASP B 52 11.555 -15.022 -0.268 1.00 0.00 C ATOM 2400 CG ASP B 52 10.520 -16.062 -0.648 1.00 0.00 C ATOM 2401 OD1 ASP B 52 10.742 -17.256 -0.357 1.00 0.00 O ATOM 2402 OD2 ASP B 52 9.487 -15.683 -1.240 1.00 0.00 O ATOM 0 H ASP B 52 13.103 -15.598 1.735 1.00 0.00 H new ATOM 0 HA ASP B 52 13.024 -16.346 -1.114 1.00 0.00 H new ATOM 0 HB2 ASP B 52 11.363 -14.676 0.748 1.00 0.00 H new ATOM 0 HB3 ASP B 52 11.455 -14.157 -0.924 1.00 0.00 H new ATOM 2407 N PRO B 53 14.839 -14.709 -1.734 1.00 0.00 N ATOM 2408 CA PRO B 53 15.805 -13.715 -2.209 1.00 0.00 C ATOM 2409 C PRO B 53 15.208 -12.745 -3.228 1.00 0.00 C ATOM 2410 O PRO B 53 15.919 -11.917 -3.795 1.00 0.00 O ATOM 2411 CB PRO B 53 16.878 -14.580 -2.864 1.00 0.00 C ATOM 2412 CG PRO B 53 16.134 -15.759 -3.389 1.00 0.00 C ATOM 2413 CD PRO B 53 14.990 -15.999 -2.436 1.00 0.00 C ATOM 0 HA PRO B 53 16.167 -13.077 -1.403 1.00 0.00 H new ATOM 0 HB2 PRO B 53 17.387 -14.043 -3.664 1.00 0.00 H new ATOM 0 HB3 PRO B 53 17.641 -14.879 -2.145 1.00 0.00 H new ATOM 0 HG2 PRO B 53 15.766 -15.569 -4.397 1.00 0.00 H new ATOM 0 HG3 PRO B 53 16.782 -16.633 -3.446 1.00 0.00 H new ATOM 0 HD2 PRO B 53 14.079 -16.275 -2.967 1.00 0.00 H new ATOM 0 HD3 PRO B 53 15.212 -16.809 -1.741 1.00 0.00 H new ATOM 2421 N GLY B 54 13.901 -12.851 -3.459 1.00 0.00 N ATOM 2422 CA GLY B 54 13.245 -11.974 -4.412 1.00 0.00 C ATOM 2423 C GLY B 54 12.420 -10.888 -3.745 1.00 0.00 C ATOM 2424 O GLY B 54 11.982 -9.945 -4.402 1.00 0.00 O ATOM 0 H GLY B 54 13.287 -13.527 -3.004 1.00 0.00 H new ATOM 0 HA2 GLY B 54 13.998 -11.511 -5.050 1.00 0.00 H new ATOM 0 HA3 GLY B 54 12.600 -12.567 -5.060 1.00 0.00 H new ATOM 2428 N VAL B 55 12.204 -11.020 -2.439 1.00 0.00 N ATOM 2429 CA VAL B 55 11.424 -10.041 -1.687 1.00 0.00 C ATOM 2430 C VAL B 55 11.955 -8.626 -1.901 1.00 0.00 C ATOM 2431 O VAL B 55 11.236 -7.750 -2.383 1.00 0.00 O ATOM 2432 CB VAL B 55 11.430 -10.364 -0.180 1.00 0.00 C ATOM 2433 CG1 VAL B 55 10.524 -9.407 0.578 1.00 0.00 C ATOM 2434 CG2 VAL B 55 11.009 -11.807 0.057 1.00 0.00 C ATOM 0 H VAL B 55 12.558 -11.796 -1.879 1.00 0.00 H new ATOM 0 HA VAL B 55 10.401 -10.095 -2.060 1.00 0.00 H new ATOM 0 HB VAL B 55 12.446 -10.237 0.195 1.00 0.00 H new ATOM 0 HG11 VAL B 55 10.543 -9.652 1.640 1.00 0.00 H new ATOM 0 HG12 VAL B 55 10.874 -8.385 0.436 1.00 0.00 H new ATOM 0 HG13 VAL B 55 9.505 -9.497 0.203 1.00 0.00 H new ATOM 0 HG21 VAL B 55 11.019 -12.018 1.126 1.00 0.00 H new ATOM 0 HG22 VAL B 55 10.003 -11.962 -0.334 1.00 0.00 H new ATOM 0 HG23 VAL B 55 11.703 -12.477 -0.451 1.00 0.00 H new ATOM 2444 N LEU B 56 13.214 -8.407 -1.542 1.00 0.00 N ATOM 2445 CA LEU B 56 13.837 -7.106 -1.698 1.00 0.00 C ATOM 2446 C LEU B 56 14.012 -6.771 -3.173 1.00 0.00 C ATOM 2447 O LEU B 56 13.617 -5.702 -3.635 1.00 0.00 O ATOM 2448 CB LEU B 56 15.199 -7.108 -1.004 1.00 0.00 C ATOM 2449 CG LEU B 56 16.208 -6.125 -1.583 1.00 0.00 C ATOM 2450 CD1 LEU B 56 17.121 -5.592 -0.499 1.00 0.00 C ATOM 2451 CD2 LEU B 56 17.016 -6.767 -2.703 1.00 0.00 C ATOM 0 H LEU B 56 13.823 -9.119 -1.139 1.00 0.00 H new ATOM 0 HA LEU B 56 13.195 -6.351 -1.245 1.00 0.00 H new ATOM 0 HB2 LEU B 56 15.054 -6.880 0.052 1.00 0.00 H new ATOM 0 HB3 LEU B 56 15.618 -8.113 -1.058 1.00 0.00 H new ATOM 0 HG LEU B 56 15.655 -5.286 -2.006 1.00 0.00 H new ATOM 0 HD11 LEU B 56 17.834 -4.892 -0.935 1.00 0.00 H new ATOM 0 HD12 LEU B 56 16.527 -5.081 0.258 1.00 0.00 H new ATOM 0 HD13 LEU B 56 17.661 -6.419 -0.039 1.00 0.00 H new ATOM 0 HD21 LEU B 56 17.729 -6.043 -3.098 1.00 0.00 H new ATOM 0 HD22 LEU B 56 17.554 -7.631 -2.314 1.00 0.00 H new ATOM 0 HD23 LEU B 56 16.344 -7.087 -3.499 1.00 0.00 H new ATOM 2463 N ASP B 57 14.616 -7.695 -3.905 1.00 0.00 N ATOM 2464 CA ASP B 57 14.859 -7.508 -5.329 1.00 0.00 C ATOM 2465 C ASP B 57 13.561 -7.190 -6.065 1.00 0.00 C ATOM 2466 O ASP B 57 13.572 -6.532 -7.104 1.00 0.00 O ATOM 2467 CB ASP B 57 15.503 -8.761 -5.922 1.00 0.00 C ATOM 2468 CG ASP B 57 16.536 -8.434 -6.982 1.00 0.00 C ATOM 2469 OD1 ASP B 57 16.236 -7.609 -7.871 1.00 0.00 O ATOM 2470 OD2 ASP B 57 17.648 -9.003 -6.924 1.00 0.00 O ATOM 0 H ASP B 57 14.948 -8.586 -3.535 1.00 0.00 H new ATOM 0 HA ASP B 57 15.539 -6.665 -5.451 1.00 0.00 H new ATOM 0 HB2 ASP B 57 15.974 -9.336 -5.125 1.00 0.00 H new ATOM 0 HB3 ASP B 57 14.729 -9.393 -6.356 1.00 0.00 H new ATOM 2475 N ARG B 58 12.441 -7.654 -5.517 1.00 0.00 N ATOM 2476 CA ARG B 58 11.139 -7.407 -6.124 1.00 0.00 C ATOM 2477 C ARG B 58 10.842 -5.911 -6.174 1.00 0.00 C ATOM 2478 O ARG B 58 10.421 -5.388 -7.206 1.00 0.00 O ATOM 2479 CB ARG B 58 10.040 -8.137 -5.348 1.00 0.00 C ATOM 2480 CG ARG B 58 9.588 -9.433 -6.006 1.00 0.00 C ATOM 2481 CD ARG B 58 8.090 -9.437 -6.271 1.00 0.00 C ATOM 2482 NE ARG B 58 7.364 -10.241 -5.290 1.00 0.00 N ATOM 2483 CZ ARG B 58 6.065 -10.520 -5.376 1.00 0.00 C ATOM 2484 NH1 ARG B 58 5.347 -10.060 -6.394 1.00 0.00 N ATOM 2485 NH2 ARG B 58 5.482 -11.259 -4.442 1.00 0.00 N ATOM 0 H ARG B 58 12.410 -8.201 -4.657 1.00 0.00 H new ATOM 0 HA ARG B 58 11.161 -7.790 -7.144 1.00 0.00 H new ATOM 0 HB2 ARG B 58 10.401 -8.356 -4.343 1.00 0.00 H new ATOM 0 HB3 ARG B 58 9.181 -7.475 -5.241 1.00 0.00 H new ATOM 0 HG2 ARG B 58 10.124 -9.571 -6.945 1.00 0.00 H new ATOM 0 HG3 ARG B 58 9.846 -10.276 -5.365 1.00 0.00 H new ATOM 0 HD2 ARG B 58 7.715 -8.414 -6.250 1.00 0.00 H new ATOM 0 HD3 ARG B 58 7.900 -9.826 -7.271 1.00 0.00 H new ATOM 0 HE ARG B 58 7.883 -10.610 -4.493 1.00 0.00 H new ATOM 0 HH11 ARG B 58 5.790 -9.490 -7.115 1.00 0.00 H new ATOM 0 HH12 ARG B 58 4.352 -10.277 -6.455 1.00 0.00 H new ATOM 0 HH21 ARG B 58 6.029 -11.614 -3.657 1.00 0.00 H new ATOM 0 HH22 ARG B 58 4.487 -11.473 -4.508 1.00 0.00 H new ATOM 2498 N MET B 59 11.064 -5.224 -5.055 1.00 0.00 N ATOM 2499 CA MET B 59 10.815 -3.787 -4.983 1.00 0.00 C ATOM 2500 C MET B 59 11.823 -3.018 -5.826 1.00 0.00 C ATOM 2501 O MET B 59 11.445 -2.222 -6.684 1.00 0.00 O ATOM 2502 CB MET B 59 10.853 -3.310 -3.526 1.00 0.00 C ATOM 2503 CG MET B 59 12.239 -2.997 -2.978 1.00 0.00 C ATOM 2504 SD MET B 59 12.197 -2.164 -1.377 1.00 0.00 S ATOM 2505 CE MET B 59 10.954 -3.136 -0.554 1.00 0.00 C ATOM 0 H MET B 59 11.414 -5.637 -4.191 1.00 0.00 H new ATOM 0 HA MET B 59 9.821 -3.592 -5.385 1.00 0.00 H new ATOM 0 HB2 MET B 59 10.235 -2.416 -3.438 1.00 0.00 H new ATOM 0 HB3 MET B 59 10.397 -4.076 -2.899 1.00 0.00 H new ATOM 0 HG2 MET B 59 12.804 -3.925 -2.883 1.00 0.00 H new ATOM 0 HG3 MET B 59 12.773 -2.371 -3.693 1.00 0.00 H new ATOM 0 HE1 MET B 59 10.425 -2.514 0.168 1.00 0.00 H new ATOM 0 HE2 MET B 59 10.247 -3.520 -1.289 1.00 0.00 H new ATOM 0 HE3 MET B 59 11.428 -3.970 -0.036 1.00 0.00 H new ATOM 2515 N MET B 60 13.101 -3.264 -5.577 1.00 0.00 N ATOM 2516 CA MET B 60 14.163 -2.590 -6.316 1.00 0.00 C ATOM 2517 C MET B 60 14.057 -2.887 -7.805 1.00 0.00 C ATOM 2518 O MET B 60 14.494 -2.095 -8.640 1.00 0.00 O ATOM 2519 CB MET B 60 15.535 -3.010 -5.790 1.00 0.00 C ATOM 2520 CG MET B 60 16.073 -2.074 -4.722 1.00 0.00 C ATOM 2521 SD MET B 60 16.610 -2.939 -3.242 1.00 0.00 S ATOM 2522 CE MET B 60 15.074 -2.937 -2.337 1.00 0.00 C ATOM 0 H MET B 60 13.429 -3.923 -4.871 1.00 0.00 H new ATOM 0 HA MET B 60 14.048 -1.516 -6.169 1.00 0.00 H new ATOM 0 HB2 MET B 60 15.468 -4.018 -5.381 1.00 0.00 H new ATOM 0 HB3 MET B 60 16.240 -3.048 -6.620 1.00 0.00 H new ATOM 0 HG2 MET B 60 16.910 -1.508 -5.130 1.00 0.00 H new ATOM 0 HG3 MET B 60 15.301 -1.353 -4.455 1.00 0.00 H new ATOM 0 HE1 MET B 60 15.278 -3.065 -1.274 1.00 0.00 H new ATOM 0 HE2 MET B 60 14.559 -1.989 -2.496 1.00 0.00 H new ATOM 0 HE3 MET B 60 14.444 -3.755 -2.687 1.00 0.00 H new ATOM 2532 N LYS B 61 13.468 -4.029 -8.131 1.00 0.00 N ATOM 2533 CA LYS B 61 13.298 -4.428 -9.523 1.00 0.00 C ATOM 2534 C LYS B 61 12.438 -3.413 -10.272 1.00 0.00 C ATOM 2535 O LYS B 61 12.879 -2.813 -11.251 1.00 0.00 O ATOM 2536 CB LYS B 61 12.659 -5.816 -9.606 1.00 0.00 C ATOM 2537 CG LYS B 61 13.666 -6.937 -9.802 1.00 0.00 C ATOM 2538 CD LYS B 61 13.083 -8.284 -9.404 1.00 0.00 C ATOM 2539 CE LYS B 61 14.079 -9.410 -9.629 1.00 0.00 C ATOM 2540 NZ LYS B 61 14.630 -9.396 -11.012 1.00 0.00 N ATOM 0 H LYS B 61 13.100 -4.695 -7.452 1.00 0.00 H new ATOM 0 HA LYS B 61 14.282 -4.464 -9.990 1.00 0.00 H new ATOM 0 HB2 LYS B 61 12.094 -6.002 -8.693 1.00 0.00 H new ATOM 0 HB3 LYS B 61 11.946 -5.830 -10.431 1.00 0.00 H new ATOM 0 HG2 LYS B 61 13.979 -6.969 -10.846 1.00 0.00 H new ATOM 0 HG3 LYS B 61 14.557 -6.735 -9.208 1.00 0.00 H new ATOM 0 HD2 LYS B 61 12.791 -8.259 -8.354 1.00 0.00 H new ATOM 0 HD3 LYS B 61 12.179 -8.476 -9.982 1.00 0.00 H new ATOM 0 HE2 LYS B 61 14.895 -9.321 -8.912 1.00 0.00 H new ATOM 0 HE3 LYS B 61 13.593 -10.367 -9.442 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 15.112 -10.297 -11.203 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 13.855 -9.267 -11.693 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 15.308 -8.613 -11.108 1.00 0.00 H new ATOM 2554 N LYS B 62 11.207 -3.230 -9.804 1.00 0.00 N ATOM 2555 CA LYS B 62 10.280 -2.291 -10.428 1.00 0.00 C ATOM 2556 C LYS B 62 10.558 -0.850 -9.996 1.00 0.00 C ATOM 2557 O LYS B 62 9.939 0.084 -10.505 1.00 0.00 O ATOM 2558 CB LYS B 62 8.838 -2.667 -10.081 1.00 0.00 C ATOM 2559 CG LYS B 62 7.880 -2.556 -11.257 1.00 0.00 C ATOM 2560 CD LYS B 62 7.899 -1.159 -11.859 1.00 0.00 C ATOM 2561 CE LYS B 62 6.938 -1.044 -13.033 1.00 0.00 C ATOM 2562 NZ LYS B 62 5.793 -0.144 -12.727 1.00 0.00 N ATOM 0 H LYS B 62 10.828 -3.720 -8.994 1.00 0.00 H new ATOM 0 HA LYS B 62 10.425 -2.352 -11.507 1.00 0.00 H new ATOM 0 HB2 LYS B 62 8.819 -3.689 -9.703 1.00 0.00 H new ATOM 0 HB3 LYS B 62 8.487 -2.022 -9.275 1.00 0.00 H new ATOM 0 HG2 LYS B 62 8.152 -3.286 -12.020 1.00 0.00 H new ATOM 0 HG3 LYS B 62 6.869 -2.799 -10.929 1.00 0.00 H new ATOM 0 HD2 LYS B 62 7.631 -0.429 -11.095 1.00 0.00 H new ATOM 0 HD3 LYS B 62 8.909 -0.918 -12.190 1.00 0.00 H new ATOM 0 HE2 LYS B 62 7.473 -0.667 -13.905 1.00 0.00 H new ATOM 0 HE3 LYS B 62 6.562 -2.034 -13.293 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 5.162 -0.093 -13.552 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 5.267 -0.517 -11.911 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 6.149 0.807 -12.504 1.00 0.00 H new ATOM 2576 N LEU B 63 11.483 -0.670 -9.055 1.00 0.00 N ATOM 2577 CA LEU B 63 11.821 0.657 -8.563 1.00 0.00 C ATOM 2578 C LEU B 63 12.798 1.374 -9.502 1.00 0.00 C ATOM 2579 O LEU B 63 13.275 2.463 -9.192 1.00 0.00 O ATOM 2580 CB LEU B 63 12.387 0.525 -7.141 1.00 0.00 C ATOM 2581 CG LEU B 63 13.630 1.350 -6.795 1.00 0.00 C ATOM 2582 CD1 LEU B 63 13.902 1.241 -5.309 1.00 0.00 C ATOM 2583 CD2 LEU B 63 14.842 0.878 -7.591 1.00 0.00 C ATOM 0 H LEU B 63 12.009 -1.428 -8.621 1.00 0.00 H new ATOM 0 HA LEU B 63 10.922 1.273 -8.534 1.00 0.00 H new ATOM 0 HB2 LEU B 63 11.598 0.795 -6.439 1.00 0.00 H new ATOM 0 HB3 LEU B 63 12.622 -0.525 -6.969 1.00 0.00 H new ATOM 0 HG LEU B 63 13.446 2.391 -7.059 1.00 0.00 H new ATOM 0 HD11 LEU B 63 14.786 1.827 -5.057 1.00 0.00 H new ATOM 0 HD12 LEU B 63 13.045 1.621 -4.753 1.00 0.00 H new ATOM 0 HD13 LEU B 63 14.071 0.197 -5.046 1.00 0.00 H new ATOM 0 HD21 LEU B 63 15.710 1.482 -7.325 1.00 0.00 H new ATOM 0 HD22 LEU B 63 15.043 -0.168 -7.361 1.00 0.00 H new ATOM 0 HD23 LEU B 63 14.640 0.983 -8.657 1.00 0.00 H new ATOM 2595 N ASP B 64 13.089 0.764 -10.650 1.00 0.00 N ATOM 2596 CA ASP B 64 14.003 1.362 -11.620 1.00 0.00 C ATOM 2597 C ASP B 64 13.529 2.757 -12.021 1.00 0.00 C ATOM 2598 O ASP B 64 12.840 2.926 -13.026 1.00 0.00 O ATOM 2599 CB ASP B 64 14.121 0.470 -12.858 1.00 0.00 C ATOM 2600 CG ASP B 64 15.560 0.124 -13.187 1.00 0.00 C ATOM 2601 OD1 ASP B 64 16.260 -0.410 -12.300 1.00 0.00 O ATOM 2602 OD2 ASP B 64 15.987 0.384 -14.331 1.00 0.00 O ATOM 0 H ASP B 64 12.707 -0.139 -10.930 1.00 0.00 H new ATOM 0 HA ASP B 64 14.984 1.452 -11.154 1.00 0.00 H new ATOM 0 HB2 ASP B 64 13.558 -0.449 -12.695 1.00 0.00 H new ATOM 0 HB3 ASP B 64 13.668 0.975 -13.711 1.00 0.00 H new ATOM 2607 N LEU B 65 13.900 3.752 -11.221 1.00 0.00 N ATOM 2608 CA LEU B 65 13.510 5.133 -11.483 1.00 0.00 C ATOM 2609 C LEU B 65 14.299 5.708 -12.655 1.00 0.00 C ATOM 2610 O LEU B 65 15.521 5.837 -12.589 1.00 0.00 O ATOM 2611 CB LEU B 65 13.726 5.990 -10.232 1.00 0.00 C ATOM 2612 CG LEU B 65 12.499 6.155 -9.329 1.00 0.00 C ATOM 2613 CD1 LEU B 65 11.292 6.602 -10.140 1.00 0.00 C ATOM 2614 CD2 LEU B 65 12.199 4.859 -8.589 1.00 0.00 C ATOM 0 H LEU B 65 14.471 3.627 -10.385 1.00 0.00 H new ATOM 0 HA LEU B 65 12.452 5.145 -11.744 1.00 0.00 H new ATOM 0 HB2 LEU B 65 14.532 5.549 -9.645 1.00 0.00 H new ATOM 0 HB3 LEU B 65 14.063 6.979 -10.543 1.00 0.00 H new ATOM 0 HG LEU B 65 12.719 6.926 -8.591 1.00 0.00 H new ATOM 0 HD11 LEU B 65 10.431 6.713 -9.480 1.00 0.00 H new ATOM 0 HD12 LEU B 65 11.509 7.557 -10.618 1.00 0.00 H new ATOM 0 HD13 LEU B 65 11.070 5.856 -10.903 1.00 0.00 H new ATOM 0 HD21 LEU B 65 11.324 4.997 -7.953 1.00 0.00 H new ATOM 0 HD22 LEU B 65 12.002 4.066 -9.310 1.00 0.00 H new ATOM 0 HD23 LEU B 65 13.056 4.585 -7.973 1.00 0.00 H new ATOM 2626 N ASN B 66 13.590 6.053 -13.725 1.00 0.00 N ATOM 2627 CA ASN B 66 14.222 6.615 -14.912 1.00 0.00 C ATOM 2628 C ASN B 66 13.817 8.073 -15.103 1.00 0.00 C ATOM 2629 O ASN B 66 14.649 8.922 -15.420 1.00 0.00 O ATOM 2630 CB ASN B 66 13.846 5.801 -16.151 1.00 0.00 C ATOM 2631 CG ASN B 66 15.019 5.601 -17.091 1.00 0.00 C ATOM 2632 OD1 ASN B 66 15.611 6.565 -17.576 1.00 0.00 O ATOM 2633 ND2 ASN B 66 15.361 4.346 -17.352 1.00 0.00 N ATOM 0 H ASN B 66 12.577 5.953 -13.794 1.00 0.00 H new ATOM 0 HA ASN B 66 15.302 6.571 -14.774 1.00 0.00 H new ATOM 0 HB2 ASN B 66 13.463 4.829 -15.841 1.00 0.00 H new ATOM 0 HB3 ASN B 66 13.040 6.306 -16.683 1.00 0.00 H new ATOM 0 HD21 ASN B 66 16.143 4.150 -17.977 1.00 0.00 H new ATOM 0 HD22 ASN B 66 14.842 3.577 -16.928 1.00 0.00 H new ATOM 2640 N SER B 67 12.533 8.354 -14.905 1.00 0.00 N ATOM 2641 CA SER B 67 12.019 9.710 -15.056 1.00 0.00 C ATOM 2642 C SER B 67 11.861 10.385 -13.701 1.00 0.00 C ATOM 2643 O SER B 67 11.825 9.721 -12.665 1.00 0.00 O ATOM 2644 CB SER B 67 10.679 9.694 -15.795 1.00 0.00 C ATOM 2645 OG SER B 67 10.634 10.702 -16.790 1.00 0.00 O ATOM 0 H SER B 67 11.831 7.663 -14.640 1.00 0.00 H new ATOM 0 HA SER B 67 12.739 10.281 -15.643 1.00 0.00 H new ATOM 0 HB2 SER B 67 10.525 8.718 -16.255 1.00 0.00 H new ATOM 0 HB3 SER B 67 9.866 9.843 -15.084 1.00 0.00 H new ATOM 0 HG SER B 67 9.769 10.670 -17.249 1.00 0.00 H new ATOM 2651 N ASP B 68 11.778 11.713 -13.716 1.00 0.00 N ATOM 2652 CA ASP B 68 11.636 12.495 -12.490 1.00 0.00 C ATOM 2653 C ASP B 68 12.968 12.584 -11.750 1.00 0.00 C ATOM 2654 O ASP B 68 13.432 13.675 -11.420 1.00 0.00 O ATOM 2655 CB ASP B 68 10.569 11.886 -11.574 1.00 0.00 C ATOM 2656 CG ASP B 68 9.327 11.458 -12.333 1.00 0.00 C ATOM 2657 OD1 ASP B 68 8.404 12.287 -12.477 1.00 0.00 O ATOM 2658 OD2 ASP B 68 9.277 10.294 -12.782 1.00 0.00 O ATOM 0 H ASP B 68 11.807 12.273 -14.568 1.00 0.00 H new ATOM 0 HA ASP B 68 11.321 13.500 -12.770 1.00 0.00 H new ATOM 0 HB2 ASP B 68 10.989 11.024 -11.055 1.00 0.00 H new ATOM 0 HB3 ASP B 68 10.292 12.613 -10.811 1.00 0.00 H new ATOM 2663 N GLY B 69 13.575 11.430 -11.490 1.00 0.00 N ATOM 2664 CA GLY B 69 14.843 11.401 -10.790 1.00 0.00 C ATOM 2665 C GLY B 69 14.667 11.215 -9.298 1.00 0.00 C ATOM 2666 O GLY B 69 15.539 11.586 -8.513 1.00 0.00 O ATOM 0 H GLY B 69 13.210 10.515 -11.753 1.00 0.00 H new ATOM 0 HA2 GLY B 69 15.456 10.591 -11.186 1.00 0.00 H new ATOM 0 HA3 GLY B 69 15.381 12.330 -10.978 1.00 0.00 H new ATOM 2670 N GLN B 70 13.534 10.640 -8.907 1.00 0.00 N ATOM 2671 CA GLN B 70 13.245 10.410 -7.496 1.00 0.00 C ATOM 2672 C GLN B 70 12.247 9.271 -7.311 1.00 0.00 C ATOM 2673 O GLN B 70 11.619 8.823 -8.269 1.00 0.00 O ATOM 2674 CB GLN B 70 12.700 11.689 -6.854 1.00 0.00 C ATOM 2675 CG GLN B 70 13.763 12.520 -6.153 1.00 0.00 C ATOM 2676 CD GLN B 70 14.207 11.898 -4.847 1.00 0.00 C ATOM 2677 OE1 GLN B 70 15.057 10.880 -4.932 1.00 0.00 O flip ATOM 2678 NE2 GLN B 70 13.794 12.330 -3.770 1.00 0.00 N flip ATOM 0 H GLN B 70 12.803 10.326 -9.545 1.00 0.00 H new ATOM 0 HA GLN B 70 14.177 10.127 -7.006 1.00 0.00 H new ATOM 0 HB2 GLN B 70 12.224 12.297 -7.623 1.00 0.00 H new ATOM 0 HB3 GLN B 70 11.926 11.423 -6.134 1.00 0.00 H new ATOM 0 HG2 GLN B 70 14.625 12.634 -6.811 1.00 0.00 H new ATOM 0 HG3 GLN B 70 13.373 13.520 -5.963 1.00 0.00 H new ATOM 0 HE21 GLN B 70 13.142 13.114 -3.751 1.00 0.00 H new ATOM 0 HE22 GLN B 70 14.104 11.904 -2.897 1.00 0.00 H new ATOM 2687 N LEU B 71 12.105 8.811 -6.069 1.00 0.00 N ATOM 2688 CA LEU B 71 11.182 7.730 -5.753 1.00 0.00 C ATOM 2689 C LEU B 71 9.739 8.190 -6.028 1.00 0.00 C ATOM 2690 O LEU B 71 9.477 8.764 -7.085 1.00 0.00 O ATOM 2691 CB LEU B 71 11.394 7.281 -4.294 1.00 0.00 C ATOM 2692 CG LEU B 71 12.135 5.947 -4.086 1.00 0.00 C ATOM 2693 CD1 LEU B 71 11.144 4.821 -3.821 1.00 0.00 C ATOM 2694 CD2 LEU B 71 13.028 5.610 -5.273 1.00 0.00 C ATOM 0 H LEU B 71 12.620 9.173 -5.266 1.00 0.00 H new ATOM 0 HA LEU B 71 11.373 6.865 -6.388 1.00 0.00 H new ATOM 0 HB2 LEU B 71 11.947 8.063 -3.773 1.00 0.00 H new ATOM 0 HB3 LEU B 71 10.418 7.207 -3.815 1.00 0.00 H new ATOM 0 HG LEU B 71 12.778 6.058 -3.213 1.00 0.00 H new ATOM 0 HD11 LEU B 71 11.686 3.886 -3.677 1.00 0.00 H new ATOM 0 HD12 LEU B 71 10.566 5.048 -2.925 1.00 0.00 H new ATOM 0 HD13 LEU B 71 10.470 4.722 -4.672 1.00 0.00 H new ATOM 0 HD21 LEU B 71 13.534 4.662 -5.090 1.00 0.00 H new ATOM 0 HD22 LEU B 71 12.420 5.528 -6.174 1.00 0.00 H new ATOM 0 HD23 LEU B 71 13.770 6.398 -5.406 1.00 0.00 H new ATOM 2706 N ASP B 72 8.802 7.960 -5.102 1.00 0.00 N ATOM 2707 CA ASP B 72 7.418 8.384 -5.317 1.00 0.00 C ATOM 2708 C ASP B 72 6.517 7.945 -4.169 1.00 0.00 C ATOM 2709 O ASP B 72 6.989 7.459 -3.142 1.00 0.00 O ATOM 2710 CB ASP B 72 6.880 7.823 -6.638 1.00 0.00 C ATOM 2711 CG ASP B 72 6.023 8.826 -7.386 1.00 0.00 C ATOM 2712 OD1 ASP B 72 6.214 10.043 -7.177 1.00 0.00 O ATOM 2713 OD2 ASP B 72 5.159 8.395 -8.178 1.00 0.00 O ATOM 0 H ASP B 72 8.973 7.491 -4.212 1.00 0.00 H new ATOM 0 HA ASP B 72 7.414 9.473 -5.361 1.00 0.00 H new ATOM 0 HB2 ASP B 72 7.716 7.522 -7.269 1.00 0.00 H new ATOM 0 HB3 ASP B 72 6.293 6.927 -6.437 1.00 0.00 H new ATOM 2718 N PHE B 73 5.213 8.126 -4.355 1.00 0.00 N ATOM 2719 CA PHE B 73 4.234 7.759 -3.340 1.00 0.00 C ATOM 2720 C PHE B 73 3.986 6.253 -3.323 1.00 0.00 C ATOM 2721 O PHE B 73 4.125 5.609 -2.282 1.00 0.00 O ATOM 2722 CB PHE B 73 2.922 8.506 -3.575 1.00 0.00 C ATOM 2723 CG PHE B 73 2.214 8.106 -4.838 1.00 0.00 C ATOM 2724 CD1 PHE B 73 2.564 8.670 -6.054 1.00 0.00 C ATOM 2725 CD2 PHE B 73 1.200 7.164 -4.808 1.00 0.00 C ATOM 2726 CE1 PHE B 73 1.914 8.302 -7.217 1.00 0.00 C ATOM 2727 CE2 PHE B 73 0.547 6.791 -5.967 1.00 0.00 C ATOM 2728 CZ PHE B 73 0.905 7.361 -7.173 1.00 0.00 C ATOM 0 H PHE B 73 4.810 8.526 -5.202 1.00 0.00 H new ATOM 0 HA PHE B 73 4.638 8.044 -2.369 1.00 0.00 H new ATOM 0 HB2 PHE B 73 2.259 8.332 -2.727 1.00 0.00 H new ATOM 0 HB3 PHE B 73 3.125 9.576 -3.607 1.00 0.00 H new ATOM 0 HD1 PHE B 73 3.354 9.406 -6.094 1.00 0.00 H new ATOM 0 HD2 PHE B 73 0.916 6.715 -3.868 1.00 0.00 H new ATOM 0 HE1 PHE B 73 2.195 8.750 -8.159 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -0.242 6.055 -5.930 1.00 0.00 H new ATOM 0 HZ PHE B 73 0.396 7.071 -8.080 1.00 0.00 H new ATOM 2738 N GLN B 74 3.622 5.689 -4.472 1.00 0.00 N ATOM 2739 CA GLN B 74 3.369 4.260 -4.548 1.00 0.00 C ATOM 2740 C GLN B 74 4.678 3.495 -4.593 1.00 0.00 C ATOM 2741 O GLN B 74 4.754 2.371 -4.113 1.00 0.00 O ATOM 2742 CB GLN B 74 2.513 3.900 -5.765 1.00 0.00 C ATOM 2743 CG GLN B 74 2.227 2.403 -5.883 1.00 0.00 C ATOM 2744 CD GLN B 74 1.793 1.777 -4.567 1.00 0.00 C ATOM 2745 OE1 GLN B 74 1.105 2.410 -3.765 1.00 0.00 O ATOM 2746 NE2 GLN B 74 2.192 0.525 -4.334 1.00 0.00 N ATOM 0 H GLN B 74 3.498 6.194 -5.349 1.00 0.00 H new ATOM 0 HA GLN B 74 2.815 3.977 -3.653 1.00 0.00 H new ATOM 0 HB2 GLN B 74 1.568 4.440 -5.708 1.00 0.00 H new ATOM 0 HB3 GLN B 74 3.019 4.238 -6.669 1.00 0.00 H new ATOM 0 HG2 GLN B 74 1.448 2.245 -6.629 1.00 0.00 H new ATOM 0 HG3 GLN B 74 3.121 1.895 -6.244 1.00 0.00 H new ATOM 0 HE21 GLN B 74 2.761 0.034 -5.024 1.00 0.00 H new ATOM 0 HE22 GLN B 74 1.928 0.059 -3.466 1.00 0.00 H new ATOM 2755 N GLU B 75 5.714 4.107 -5.165 1.00 0.00 N ATOM 2756 CA GLU B 75 7.017 3.462 -5.249 1.00 0.00 C ATOM 2757 C GLU B 75 7.368 2.813 -3.917 1.00 0.00 C ATOM 2758 O GLU B 75 8.003 1.760 -3.876 1.00 0.00 O ATOM 2759 CB GLU B 75 8.092 4.470 -5.658 1.00 0.00 C ATOM 2760 CG GLU B 75 8.681 4.185 -7.029 1.00 0.00 C ATOM 2761 CD GLU B 75 8.642 5.389 -7.948 1.00 0.00 C ATOM 2762 OE1 GLU B 75 9.582 6.208 -7.895 1.00 0.00 O ATOM 2763 OE2 GLU B 75 7.670 5.512 -8.723 1.00 0.00 O ATOM 0 H GLU B 75 5.674 5.041 -5.573 1.00 0.00 H new ATOM 0 HA GLU B 75 6.973 2.686 -6.013 1.00 0.00 H new ATOM 0 HB2 GLU B 75 7.663 5.472 -5.654 1.00 0.00 H new ATOM 0 HB3 GLU B 75 8.891 4.462 -4.916 1.00 0.00 H new ATOM 0 HG2 GLU B 75 9.713 3.855 -6.914 1.00 0.00 H new ATOM 0 HG3 GLU B 75 8.133 3.364 -7.491 1.00 0.00 H new ATOM 2770 N PHE B 76 6.920 3.435 -2.828 1.00 0.00 N ATOM 2771 CA PHE B 76 7.159 2.893 -1.499 1.00 0.00 C ATOM 2772 C PHE B 76 6.159 1.789 -1.204 1.00 0.00 C ATOM 2773 O PHE B 76 6.536 0.665 -0.878 1.00 0.00 O ATOM 2774 CB PHE B 76 7.057 3.976 -0.427 1.00 0.00 C ATOM 2775 CG PHE B 76 7.869 3.654 0.796 1.00 0.00 C ATOM 2776 CD1 PHE B 76 7.565 2.544 1.568 1.00 0.00 C ATOM 2777 CD2 PHE B 76 8.941 4.449 1.165 1.00 0.00 C ATOM 2778 CE1 PHE B 76 8.315 2.236 2.688 1.00 0.00 C ATOM 2779 CE2 PHE B 76 9.696 4.145 2.282 1.00 0.00 C ATOM 2780 CZ PHE B 76 9.382 3.037 3.045 1.00 0.00 C ATOM 0 H PHE B 76 6.393 4.308 -2.843 1.00 0.00 H new ATOM 0 HA PHE B 76 8.171 2.489 -1.479 1.00 0.00 H new ATOM 0 HB2 PHE B 76 7.393 4.926 -0.842 1.00 0.00 H new ATOM 0 HB3 PHE B 76 6.013 4.104 -0.142 1.00 0.00 H new ATOM 0 HD1 PHE B 76 6.733 1.913 1.292 1.00 0.00 H new ATOM 0 HD2 PHE B 76 9.190 5.317 0.573 1.00 0.00 H new ATOM 0 HE1 PHE B 76 8.067 1.370 3.283 1.00 0.00 H new ATOM 0 HE2 PHE B 76 10.530 4.773 2.558 1.00 0.00 H new ATOM 0 HZ PHE B 76 9.970 2.798 3.919 1.00 0.00 H new ATOM 2790 N LEU B 77 4.875 2.111 -1.340 1.00 0.00 N ATOM 2791 CA LEU B 77 3.821 1.137 -1.109 1.00 0.00 C ATOM 2792 C LEU B 77 4.045 -0.079 -1.999 1.00 0.00 C ATOM 2793 O LEU B 77 3.764 -1.210 -1.611 1.00 0.00 O ATOM 2794 CB LEU B 77 2.449 1.761 -1.362 1.00 0.00 C ATOM 2795 CG LEU B 77 1.770 2.312 -0.109 1.00 0.00 C ATOM 2796 CD1 LEU B 77 0.617 3.233 -0.474 1.00 0.00 C ATOM 2797 CD2 LEU B 77 1.297 1.168 0.771 1.00 0.00 C ATOM 0 H LEU B 77 4.544 3.038 -1.608 1.00 0.00 H new ATOM 0 HA LEU B 77 3.850 0.816 -0.068 1.00 0.00 H new ATOM 0 HB2 LEU B 77 2.557 2.568 -2.087 1.00 0.00 H new ATOM 0 HB3 LEU B 77 1.799 1.011 -1.814 1.00 0.00 H new ATOM 0 HG LEU B 77 2.497 2.902 0.449 1.00 0.00 H new ATOM 0 HD11 LEU B 77 0.151 3.611 0.436 1.00 0.00 H new ATOM 0 HD12 LEU B 77 0.992 4.069 -1.064 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -0.120 2.680 -1.056 1.00 0.00 H new ATOM 0 HD21 LEU B 77 0.814 1.570 1.662 1.00 0.00 H new ATOM 0 HD22 LEU B 77 0.586 0.554 0.219 1.00 0.00 H new ATOM 0 HD23 LEU B 77 2.151 0.558 1.065 1.00 0.00 H new ATOM 2809 N ASN B 78 4.589 0.168 -3.185 1.00 0.00 N ATOM 2810 CA ASN B 78 4.900 -0.894 -4.126 1.00 0.00 C ATOM 2811 C ASN B 78 6.161 -1.608 -3.658 1.00 0.00 C ATOM 2812 O ASN B 78 6.260 -2.834 -3.731 1.00 0.00 O ATOM 2813 CB ASN B 78 5.086 -0.320 -5.544 1.00 0.00 C ATOM 2814 CG ASN B 78 6.194 -0.999 -6.329 1.00 0.00 C ATOM 2815 OD1 ASN B 78 6.079 -2.165 -6.707 1.00 0.00 O ATOM 2816 ND2 ASN B 78 7.274 -0.269 -6.576 1.00 0.00 N ATOM 0 H ASN B 78 4.824 1.103 -3.517 1.00 0.00 H new ATOM 0 HA ASN B 78 4.076 -1.606 -4.165 1.00 0.00 H new ATOM 0 HB2 ASN B 78 4.149 -0.418 -6.093 1.00 0.00 H new ATOM 0 HB3 ASN B 78 5.303 0.746 -5.471 1.00 0.00 H new ATOM 0 HD21 ASN B 78 8.052 -0.671 -7.099 1.00 0.00 H new ATOM 0 HD22 ASN B 78 7.326 0.694 -6.243 1.00 0.00 H new ATOM 2823 N LEU B 79 7.120 -0.828 -3.163 1.00 0.00 N ATOM 2824 CA LEU B 79 8.365 -1.385 -2.667 1.00 0.00 C ATOM 2825 C LEU B 79 8.089 -2.264 -1.452 1.00 0.00 C ATOM 2826 O LEU B 79 8.404 -3.453 -1.447 1.00 0.00 O ATOM 2827 CB LEU B 79 9.350 -0.261 -2.294 1.00 0.00 C ATOM 2828 CG LEU B 79 10.493 0.007 -3.291 1.00 0.00 C ATOM 2829 CD1 LEU B 79 9.994 0.024 -4.722 1.00 0.00 C ATOM 2830 CD2 LEU B 79 11.187 1.319 -2.963 1.00 0.00 C ATOM 0 H LEU B 79 7.054 0.188 -3.097 1.00 0.00 H new ATOM 0 HA LEU B 79 8.815 -1.991 -3.453 1.00 0.00 H new ATOM 0 HB2 LEU B 79 8.784 0.662 -2.168 1.00 0.00 H new ATOM 0 HB3 LEU B 79 9.790 -0.500 -1.326 1.00 0.00 H new ATOM 0 HG LEU B 79 11.209 -0.809 -3.197 1.00 0.00 H new ATOM 0 HD11 LEU B 79 10.829 0.216 -5.396 1.00 0.00 H new ATOM 0 HD12 LEU B 79 9.547 -0.941 -4.963 1.00 0.00 H new ATOM 0 HD13 LEU B 79 9.247 0.809 -4.837 1.00 0.00 H new ATOM 0 HD21 LEU B 79 11.992 1.493 -3.677 1.00 0.00 H new ATOM 0 HD22 LEU B 79 10.467 2.136 -3.021 1.00 0.00 H new ATOM 0 HD23 LEU B 79 11.600 1.270 -1.955 1.00 0.00 H new ATOM 2842 N ILE B 80 7.480 -1.672 -0.427 1.00 0.00 N ATOM 2843 CA ILE B 80 7.146 -2.396 0.789 1.00 0.00 C ATOM 2844 C ILE B 80 5.979 -3.350 0.558 1.00 0.00 C ATOM 2845 O ILE B 80 6.012 -4.500 0.996 1.00 0.00 O ATOM 2846 CB ILE B 80 6.829 -1.448 1.963 1.00 0.00 C ATOM 2847 CG1 ILE B 80 6.982 -2.192 3.286 1.00 0.00 C ATOM 2848 CG2 ILE B 80 5.430 -0.879 1.846 1.00 0.00 C ATOM 2849 CD1 ILE B 80 5.780 -3.043 3.636 1.00 0.00 C ATOM 0 H ILE B 80 7.208 -0.689 -0.418 1.00 0.00 H new ATOM 0 HA ILE B 80 8.029 -2.976 1.059 1.00 0.00 H new ATOM 0 HB ILE B 80 7.534 -0.618 1.930 1.00 0.00 H new ATOM 0 HG12 ILE B 80 7.867 -2.827 3.238 1.00 0.00 H new ATOM 0 HG13 ILE B 80 7.152 -1.469 4.084 1.00 0.00 H new ATOM 0 HG21 ILE B 80 5.236 -0.215 2.688 1.00 0.00 H new ATOM 0 HG22 ILE B 80 5.341 -0.320 0.915 1.00 0.00 H new ATOM 0 HG23 ILE B 80 4.705 -1.693 1.851 1.00 0.00 H new ATOM 0 HD11 ILE B 80 5.954 -3.545 4.588 1.00 0.00 H new ATOM 0 HD12 ILE B 80 4.897 -2.410 3.716 1.00 0.00 H new ATOM 0 HD13 ILE B 80 5.623 -3.788 2.857 1.00 0.00 H new ATOM 2861 N GLY B 81 4.953 -2.874 -0.144 1.00 0.00 N ATOM 2862 CA GLY B 81 3.804 -3.717 -0.427 1.00 0.00 C ATOM 2863 C GLY B 81 4.230 -5.022 -1.056 1.00 0.00 C ATOM 2864 O GLY B 81 3.848 -6.098 -0.596 1.00 0.00 O ATOM 0 H GLY B 81 4.897 -1.927 -0.519 1.00 0.00 H new ATOM 0 HA2 GLY B 81 3.258 -3.915 0.496 1.00 0.00 H new ATOM 0 HA3 GLY B 81 3.121 -3.193 -1.095 1.00 0.00 H new ATOM 2868 N GLY B 82 5.053 -4.928 -2.097 1.00 0.00 N ATOM 2869 CA GLY B 82 5.549 -6.126 -2.752 1.00 0.00 C ATOM 2870 C GLY B 82 6.158 -7.092 -1.752 1.00 0.00 C ATOM 2871 O GLY B 82 6.025 -8.307 -1.894 1.00 0.00 O ATOM 0 H GLY B 82 5.384 -4.050 -2.497 1.00 0.00 H new ATOM 0 HA2 GLY B 82 4.733 -6.616 -3.283 1.00 0.00 H new ATOM 0 HA3 GLY B 82 6.296 -5.852 -3.497 1.00 0.00 H new ATOM 2875 N LEU B 83 6.810 -6.550 -0.723 1.00 0.00 N ATOM 2876 CA LEU B 83 7.412 -7.381 0.312 1.00 0.00 C ATOM 2877 C LEU B 83 6.338 -8.180 1.028 1.00 0.00 C ATOM 2878 O LEU B 83 6.485 -9.380 1.247 1.00 0.00 O ATOM 2879 CB LEU B 83 8.169 -6.529 1.327 1.00 0.00 C ATOM 2880 CG LEU B 83 8.966 -5.376 0.730 1.00 0.00 C ATOM 2881 CD1 LEU B 83 9.837 -4.729 1.793 1.00 0.00 C ATOM 2882 CD2 LEU B 83 9.804 -5.862 -0.442 1.00 0.00 C ATOM 0 H LEU B 83 6.933 -5.547 -0.587 1.00 0.00 H new ATOM 0 HA LEU B 83 8.116 -8.060 -0.169 1.00 0.00 H new ATOM 0 HB2 LEU B 83 7.455 -6.125 2.044 1.00 0.00 H new ATOM 0 HB3 LEU B 83 8.850 -7.173 1.883 1.00 0.00 H new ATOM 0 HG LEU B 83 8.270 -4.623 0.359 1.00 0.00 H new ATOM 0 HD11 LEU B 83 10.400 -3.907 1.351 1.00 0.00 H new ATOM 0 HD12 LEU B 83 9.207 -4.347 2.596 1.00 0.00 H new ATOM 0 HD13 LEU B 83 10.530 -5.468 2.195 1.00 0.00 H new ATOM 0 HD21 LEU B 83 10.367 -5.027 -0.858 1.00 0.00 H new ATOM 0 HD22 LEU B 83 10.496 -6.632 -0.100 1.00 0.00 H new ATOM 0 HD23 LEU B 83 9.150 -6.276 -1.210 1.00 0.00 H new ATOM 2894 N ALA B 84 5.250 -7.505 1.388 1.00 0.00 N ATOM 2895 CA ALA B 84 4.147 -8.165 2.077 1.00 0.00 C ATOM 2896 C ALA B 84 3.646 -9.356 1.277 1.00 0.00 C ATOM 2897 O ALA B 84 3.244 -10.378 1.834 1.00 0.00 O ATOM 2898 CB ALA B 84 3.006 -7.192 2.293 1.00 0.00 C ATOM 0 H ALA B 84 5.109 -6.510 1.216 1.00 0.00 H new ATOM 0 HA ALA B 84 4.515 -8.515 3.041 1.00 0.00 H new ATOM 0 HB1 ALA B 84 2.189 -7.698 2.808 1.00 0.00 H new ATOM 0 HB2 ALA B 84 3.352 -6.353 2.897 1.00 0.00 H new ATOM 0 HB3 ALA B 84 2.654 -6.824 1.329 1.00 0.00 H new ATOM 2904 N VAL B 85 3.675 -9.213 -0.035 1.00 0.00 N ATOM 2905 CA VAL B 85 3.223 -10.269 -0.927 1.00 0.00 C ATOM 2906 C VAL B 85 4.300 -11.323 -1.119 1.00 0.00 C ATOM 2907 O VAL B 85 4.025 -12.434 -1.573 1.00 0.00 O ATOM 2908 CB VAL B 85 2.762 -9.733 -2.306 1.00 0.00 C ATOM 2909 CG1 VAL B 85 1.312 -10.107 -2.536 1.00 0.00 C ATOM 2910 CG2 VAL B 85 2.931 -8.223 -2.426 1.00 0.00 C ATOM 0 H VAL B 85 4.008 -8.374 -0.510 1.00 0.00 H new ATOM 0 HA VAL B 85 2.357 -10.722 -0.444 1.00 0.00 H new ATOM 0 HB VAL B 85 3.395 -10.192 -3.066 1.00 0.00 H new ATOM 0 HG11 VAL B 85 0.988 -9.730 -3.506 1.00 0.00 H new ATOM 0 HG12 VAL B 85 1.208 -11.192 -2.516 1.00 0.00 H new ATOM 0 HG13 VAL B 85 0.694 -9.669 -1.752 1.00 0.00 H new ATOM 0 HG21 VAL B 85 2.594 -7.896 -3.410 1.00 0.00 H new ATOM 0 HG22 VAL B 85 2.338 -7.728 -1.657 1.00 0.00 H new ATOM 0 HG23 VAL B 85 3.982 -7.963 -2.297 1.00 0.00 H new ATOM 2920 N ALA B 86 5.524 -10.965 -0.777 1.00 0.00 N ATOM 2921 CA ALA B 86 6.646 -11.868 -0.915 1.00 0.00 C ATOM 2922 C ALA B 86 7.277 -12.188 0.437 1.00 0.00 C ATOM 2923 O ALA B 86 8.401 -12.686 0.503 1.00 0.00 O ATOM 2924 CB ALA B 86 7.665 -11.240 -1.835 1.00 0.00 C ATOM 0 H ALA B 86 5.765 -10.049 -0.399 1.00 0.00 H new ATOM 0 HA ALA B 86 6.291 -12.809 -1.336 1.00 0.00 H new ATOM 0 HB1 ALA B 86 8.516 -11.911 -1.947 1.00 0.00 H new ATOM 0 HB2 ALA B 86 7.213 -11.061 -2.811 1.00 0.00 H new ATOM 0 HB3 ALA B 86 8.002 -10.294 -1.412 1.00 0.00 H new ATOM 2930 N CYS B 87 6.557 -11.891 1.514 1.00 0.00 N ATOM 2931 CA CYS B 87 7.073 -12.145 2.855 1.00 0.00 C ATOM 2932 C CYS B 87 5.970 -12.182 3.918 1.00 0.00 C ATOM 2933 O CYS B 87 6.130 -12.837 4.948 1.00 0.00 O ATOM 2934 CB CYS B 87 8.110 -11.082 3.225 1.00 0.00 C ATOM 2935 SG CYS B 87 9.578 -11.740 4.049 1.00 0.00 S ATOM 0 H CYS B 87 5.624 -11.479 1.486 1.00 0.00 H new ATOM 0 HA CYS B 87 7.536 -13.132 2.836 1.00 0.00 H new ATOM 0 HB2 CYS B 87 8.418 -10.559 2.319 1.00 0.00 H new ATOM 0 HB3 CYS B 87 7.642 -10.343 3.875 1.00 0.00 H new ATOM 0 HG CYS B 87 9.822 -11.045 5.120 1.00 0.00 H new ATOM 2941 N HIS B 88 4.861 -11.476 3.689 1.00 0.00 N ATOM 2942 CA HIS B 88 3.777 -11.453 4.673 1.00 0.00 C ATOM 2943 C HIS B 88 2.712 -12.510 4.381 1.00 0.00 C ATOM 2944 O HIS B 88 1.551 -12.352 4.756 1.00 0.00 O ATOM 2945 CB HIS B 88 3.134 -10.067 4.739 1.00 0.00 C ATOM 2946 CG HIS B 88 3.864 -9.114 5.634 1.00 0.00 C ATOM 2947 ND1 HIS B 88 3.383 -8.719 6.864 1.00 0.00 N ATOM 2948 CD2 HIS B 88 5.049 -8.479 5.474 1.00 0.00 C ATOM 2949 CE1 HIS B 88 4.239 -7.881 7.422 1.00 0.00 C ATOM 2950 NE2 HIS B 88 5.258 -7.719 6.599 1.00 0.00 N ATOM 0 H HIS B 88 4.691 -10.923 2.849 1.00 0.00 H new ATOM 0 HA HIS B 88 4.221 -11.688 5.640 1.00 0.00 H new ATOM 0 HB2 HIS B 88 3.089 -9.648 3.734 1.00 0.00 H new ATOM 0 HB3 HIS B 88 2.107 -10.168 5.089 1.00 0.00 H new ATOM 0 HD2 HIS B 88 5.707 -8.556 4.621 1.00 0.00 H new ATOM 0 HE1 HIS B 88 4.124 -7.409 8.387 1.00 0.00 H new ATOM 0 HE2 HIS B 88 6.070 -7.125 6.771 1.00 0.00 H new ATOM 2959 N GLU B 89 3.119 -13.596 3.734 1.00 0.00 N ATOM 2960 CA GLU B 89 2.206 -14.691 3.416 1.00 0.00 C ATOM 2961 C GLU B 89 1.033 -14.238 2.545 1.00 0.00 C ATOM 2962 O GLU B 89 0.034 -14.949 2.433 1.00 0.00 O ATOM 2963 CB GLU B 89 1.674 -15.321 4.705 1.00 0.00 C ATOM 2964 CG GLU B 89 2.566 -16.420 5.258 1.00 0.00 C ATOM 2965 CD GLU B 89 3.373 -15.966 6.459 1.00 0.00 C ATOM 2966 OE1 GLU B 89 2.758 -15.605 7.485 1.00 0.00 O ATOM 2967 OE2 GLU B 89 4.619 -15.970 6.373 1.00 0.00 O ATOM 0 H GLU B 89 4.078 -13.743 3.418 1.00 0.00 H new ATOM 0 HA GLU B 89 2.774 -15.427 2.847 1.00 0.00 H new ATOM 0 HB2 GLU B 89 1.560 -14.543 5.460 1.00 0.00 H new ATOM 0 HB3 GLU B 89 0.681 -15.730 4.517 1.00 0.00 H new ATOM 0 HG2 GLU B 89 1.951 -17.275 5.540 1.00 0.00 H new ATOM 0 HG3 GLU B 89 3.245 -16.760 4.476 1.00 0.00 H new ATOM 2974 N SER B 90 1.150 -13.070 1.922 1.00 0.00 N ATOM 2975 CA SER B 90 0.084 -12.570 1.061 1.00 0.00 C ATOM 2976 C SER B 90 0.048 -13.368 -0.239 1.00 0.00 C ATOM 2977 O SER B 90 -0.999 -13.876 -0.642 1.00 0.00 O ATOM 2978 CB SER B 90 0.275 -11.081 0.770 1.00 0.00 C ATOM 2979 OG SER B 90 -0.854 -10.331 1.185 1.00 0.00 O ATOM 0 H SER B 90 1.962 -12.458 1.995 1.00 0.00 H new ATOM 0 HA SER B 90 -0.868 -12.693 1.578 1.00 0.00 H new ATOM 0 HB2 SER B 90 1.165 -10.718 1.284 1.00 0.00 H new ATOM 0 HB3 SER B 90 0.441 -10.934 -0.297 1.00 0.00 H new ATOM 0 HG SER B 90 -0.970 -9.560 0.592 1.00 0.00 H new ATOM 2985 N PHE B 91 1.207 -13.491 -0.876 1.00 0.00 N ATOM 2986 CA PHE B 91 1.329 -14.247 -2.117 1.00 0.00 C ATOM 2987 C PHE B 91 2.185 -15.487 -1.884 1.00 0.00 C ATOM 2988 O PHE B 91 1.904 -16.561 -2.413 1.00 0.00 O ATOM 2989 CB PHE B 91 1.946 -13.382 -3.220 1.00 0.00 C ATOM 2990 CG PHE B 91 1.031 -13.163 -4.393 1.00 0.00 C ATOM 2991 CD1 PHE B 91 -0.171 -12.494 -4.235 1.00 0.00 C ATOM 2992 CD2 PHE B 91 1.376 -13.627 -5.652 1.00 0.00 C ATOM 2993 CE1 PHE B 91 -1.014 -12.292 -5.312 1.00 0.00 C ATOM 2994 CE2 PHE B 91 0.538 -13.428 -6.733 1.00 0.00 C ATOM 2995 CZ PHE B 91 -0.658 -12.760 -6.562 1.00 0.00 C ATOM 0 H PHE B 91 2.080 -13.075 -0.551 1.00 0.00 H new ATOM 0 HA PHE B 91 0.333 -14.552 -2.438 1.00 0.00 H new ATOM 0 HB2 PHE B 91 2.223 -12.415 -2.800 1.00 0.00 H new ATOM 0 HB3 PHE B 91 2.865 -13.853 -3.569 1.00 0.00 H new ATOM 0 HD1 PHE B 91 -0.453 -12.126 -3.260 1.00 0.00 H new ATOM 0 HD2 PHE B 91 2.311 -14.150 -5.790 1.00 0.00 H new ATOM 0 HE1 PHE B 91 -1.949 -11.769 -5.176 1.00 0.00 H new ATOM 0 HE2 PHE B 91 0.818 -13.794 -7.710 1.00 0.00 H new ATOM 0 HZ PHE B 91 -1.315 -12.603 -7.405 1.00 0.00 H new ATOM 3005 N VAL B 92 3.228 -15.322 -1.076 1.00 0.00 N ATOM 3006 CA VAL B 92 4.132 -16.417 -0.750 1.00 0.00 C ATOM 3007 C VAL B 92 3.382 -17.575 -0.100 1.00 0.00 C ATOM 3008 O VAL B 92 3.813 -18.726 -0.170 1.00 0.00 O ATOM 3009 CB VAL B 92 5.262 -15.958 0.197 1.00 0.00 C ATOM 3010 CG1 VAL B 92 6.376 -15.285 -0.589 1.00 0.00 C ATOM 3011 CG2 VAL B 92 4.723 -15.026 1.280 1.00 0.00 C ATOM 0 H VAL B 92 3.468 -14.435 -0.633 1.00 0.00 H new ATOM 0 HA VAL B 92 4.571 -16.751 -1.690 1.00 0.00 H new ATOM 0 HB VAL B 92 5.673 -16.840 0.688 1.00 0.00 H new ATOM 0 HG11 VAL B 92 7.164 -14.968 0.095 1.00 0.00 H new ATOM 0 HG12 VAL B 92 6.786 -15.988 -1.314 1.00 0.00 H new ATOM 0 HG13 VAL B 92 5.978 -14.415 -1.112 1.00 0.00 H new ATOM 0 HG21 VAL B 92 5.539 -14.717 1.933 1.00 0.00 H new ATOM 0 HG22 VAL B 92 4.278 -14.146 0.815 1.00 0.00 H new ATOM 0 HG23 VAL B 92 3.967 -15.548 1.866 1.00 0.00 H new ATOM 3021 N LYS B 93 2.254 -17.263 0.532 1.00 0.00 N ATOM 3022 CA LYS B 93 1.441 -18.277 1.194 1.00 0.00 C ATOM 3023 C LYS B 93 0.548 -19.014 0.195 1.00 0.00 C ATOM 3024 O LYS B 93 -0.180 -19.935 0.565 1.00 0.00 O ATOM 3025 CB LYS B 93 0.580 -17.636 2.283 1.00 0.00 C ATOM 3026 CG LYS B 93 -0.043 -18.643 3.239 1.00 0.00 C ATOM 3027 CD LYS B 93 -1.554 -18.483 3.313 1.00 0.00 C ATOM 3028 CE LYS B 93 -2.090 -18.872 4.682 1.00 0.00 C ATOM 3029 NZ LYS B 93 -3.517 -19.290 4.621 1.00 0.00 N ATOM 0 H LYS B 93 1.883 -16.315 0.599 1.00 0.00 H new ATOM 0 HA LYS B 93 2.117 -19.002 1.647 1.00 0.00 H new ATOM 0 HB2 LYS B 93 1.191 -16.937 2.853 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -0.213 -17.055 1.812 1.00 0.00 H new ATOM 0 HG2 LYS B 93 0.201 -19.654 2.913 1.00 0.00 H new ATOM 0 HG3 LYS B 93 0.386 -18.516 4.233 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -1.822 -17.449 3.097 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -2.024 -19.101 2.548 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -1.490 -19.686 5.089 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -1.988 -18.029 5.365 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -3.815 -19.643 5.553 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -4.106 -18.476 4.354 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -3.628 -20.044 3.913 1.00 0.00 H new ATOM 3043 N ALA B 94 0.602 -18.605 -1.071 1.00 0.00 N ATOM 3044 CA ALA B 94 -0.206 -19.230 -2.110 1.00 0.00 C ATOM 3045 C ALA B 94 0.325 -20.615 -2.463 1.00 0.00 C ATOM 3046 O ALA B 94 -0.439 -21.509 -2.828 1.00 0.00 O ATOM 3047 CB ALA B 94 -0.249 -18.349 -3.349 1.00 0.00 C ATOM 0 H ALA B 94 1.197 -17.844 -1.399 1.00 0.00 H new ATOM 0 HA ALA B 94 -1.219 -19.346 -1.724 1.00 0.00 H new ATOM 0 HB1 ALA B 94 -0.856 -18.829 -4.116 1.00 0.00 H new ATOM 0 HB2 ALA B 94 -0.685 -17.383 -3.094 1.00 0.00 H new ATOM 0 HB3 ALA B 94 0.763 -18.202 -3.726 1.00 0.00 H new ATOM 3053 N ALA B 95 1.639 -20.787 -2.354 1.00 0.00 N ATOM 3054 CA ALA B 95 2.269 -22.065 -2.663 1.00 0.00 C ATOM 3055 C ALA B 95 3.406 -22.374 -1.687 1.00 0.00 C ATOM 3056 O ALA B 95 4.558 -22.528 -2.091 1.00 0.00 O ATOM 3057 CB ALA B 95 2.778 -22.060 -4.098 1.00 0.00 C ATOM 0 H ALA B 95 2.287 -20.058 -2.054 1.00 0.00 H new ATOM 0 HA ALA B 95 1.521 -22.851 -2.556 1.00 0.00 H new ATOM 0 HB1 ALA B 95 3.247 -23.018 -4.321 1.00 0.00 H new ATOM 0 HB2 ALA B 95 1.943 -21.898 -4.780 1.00 0.00 H new ATOM 0 HB3 ALA B 95 3.509 -21.261 -4.222 1.00 0.00 H new ATOM 3063 N PRO B 96 3.096 -22.468 -0.381 1.00 0.00 N ATOM 3064 CA PRO B 96 4.099 -22.758 0.652 1.00 0.00 C ATOM 3065 C PRO B 96 4.809 -24.097 0.434 1.00 0.00 C ATOM 3066 O PRO B 96 6.033 -24.175 0.530 1.00 0.00 O ATOM 3067 CB PRO B 96 3.281 -22.791 1.949 1.00 0.00 C ATOM 3068 CG PRO B 96 2.051 -22.013 1.642 1.00 0.00 C ATOM 3069 CD PRO B 96 1.753 -22.296 0.201 1.00 0.00 C ATOM 0 HA PRO B 96 4.898 -22.016 0.652 1.00 0.00 H new ATOM 0 HB2 PRO B 96 3.040 -23.814 2.239 1.00 0.00 H new ATOM 0 HB3 PRO B 96 3.834 -22.347 2.777 1.00 0.00 H new ATOM 0 HG2 PRO B 96 1.223 -22.318 2.282 1.00 0.00 H new ATOM 0 HG3 PRO B 96 2.208 -20.947 1.809 1.00 0.00 H new ATOM 0 HD2 PRO B 96 1.143 -23.191 0.082 1.00 0.00 H new ATOM 0 HD3 PRO B 96 1.210 -21.476 -0.269 1.00 0.00 H new ATOM 3077 N PRO B 97 4.053 -25.174 0.147 1.00 0.00 N ATOM 3078 CA PRO B 97 4.628 -26.503 -0.070 1.00 0.00 C ATOM 3079 C PRO B 97 5.153 -26.701 -1.490 1.00 0.00 C ATOM 3080 O PRO B 97 5.940 -27.612 -1.747 1.00 0.00 O ATOM 3081 CB PRO B 97 3.443 -27.427 0.193 1.00 0.00 C ATOM 3082 CG PRO B 97 2.255 -26.640 -0.243 1.00 0.00 C ATOM 3083 CD PRO B 97 2.581 -25.190 0.019 1.00 0.00 C ATOM 0 HA PRO B 97 5.493 -26.683 0.568 1.00 0.00 H new ATOM 0 HB2 PRO B 97 3.532 -28.357 -0.369 1.00 0.00 H new ATOM 0 HB3 PRO B 97 3.376 -27.697 1.247 1.00 0.00 H new ATOM 0 HG2 PRO B 97 2.047 -26.806 -1.300 1.00 0.00 H new ATOM 0 HG3 PRO B 97 1.365 -26.943 0.309 1.00 0.00 H new ATOM 0 HD2 PRO B 97 2.244 -24.551 -0.797 1.00 0.00 H new ATOM 0 HD3 PRO B 97 2.097 -24.829 0.927 1.00 0.00 H new ATOM 3091 N GLN B 98 4.714 -25.847 -2.411 1.00 0.00 N ATOM 3092 CA GLN B 98 5.142 -25.938 -3.805 1.00 0.00 C ATOM 3093 C GLN B 98 6.663 -26.032 -3.909 1.00 0.00 C ATOM 3094 O GLN B 98 7.375 -25.063 -3.646 1.00 0.00 O ATOM 3095 CB GLN B 98 4.641 -24.729 -4.596 1.00 0.00 C ATOM 3096 CG GLN B 98 4.524 -24.985 -6.089 1.00 0.00 C ATOM 3097 CD GLN B 98 5.069 -23.842 -6.923 1.00 0.00 C ATOM 3098 OE1 GLN B 98 4.615 -22.703 -6.808 1.00 0.00 O ATOM 3099 NE2 GLN B 98 6.048 -24.141 -7.768 1.00 0.00 N ATOM 0 H GLN B 98 4.063 -25.085 -2.218 1.00 0.00 H new ATOM 0 HA GLN B 98 4.712 -26.846 -4.228 1.00 0.00 H new ATOM 0 HB2 GLN B 98 3.666 -24.431 -4.209 1.00 0.00 H new ATOM 0 HB3 GLN B 98 5.319 -23.891 -4.431 1.00 0.00 H new ATOM 0 HG2 GLN B 98 5.060 -25.900 -6.340 1.00 0.00 H new ATOM 0 HG3 GLN B 98 3.477 -25.149 -6.344 1.00 0.00 H new ATOM 0 HE21 GLN B 98 6.393 -25.099 -7.830 1.00 0.00 H new ATOM 0 HE22 GLN B 98 6.455 -23.413 -8.355 1.00 0.00 H new ATOM 3108 N LYS B 99 7.151 -27.207 -4.294 1.00 0.00 N ATOM 3109 CA LYS B 99 8.584 -27.432 -4.435 1.00 0.00 C ATOM 3110 C LYS B 99 9.189 -26.479 -5.460 1.00 0.00 C ATOM 3111 O LYS B 99 8.499 -25.616 -6.002 1.00 0.00 O ATOM 3112 CB LYS B 99 8.856 -28.881 -4.846 1.00 0.00 C ATOM 3113 CG LYS B 99 8.270 -29.906 -3.887 1.00 0.00 C ATOM 3114 CD LYS B 99 7.559 -31.025 -4.631 1.00 0.00 C ATOM 3115 CE LYS B 99 7.481 -32.290 -3.792 1.00 0.00 C ATOM 3116 NZ LYS B 99 6.584 -33.308 -4.404 1.00 0.00 N ATOM 0 H LYS B 99 6.574 -28.019 -4.514 1.00 0.00 H new ATOM 0 HA LYS B 99 9.052 -27.241 -3.469 1.00 0.00 H new ATOM 0 HB2 LYS B 99 8.445 -29.051 -5.841 1.00 0.00 H new ATOM 0 HB3 LYS B 99 9.933 -29.034 -4.915 1.00 0.00 H new ATOM 0 HG2 LYS B 99 9.065 -30.326 -3.271 1.00 0.00 H new ATOM 0 HG3 LYS B 99 7.570 -29.415 -3.212 1.00 0.00 H new ATOM 0 HD2 LYS B 99 6.553 -30.703 -4.900 1.00 0.00 H new ATOM 0 HD3 LYS B 99 8.085 -31.236 -5.562 1.00 0.00 H new ATOM 0 HE2 LYS B 99 8.480 -32.710 -3.675 1.00 0.00 H new ATOM 0 HE3 LYS B 99 7.121 -32.042 -2.794 1.00 0.00 H new ATOM 0 HZ1 LYS B 99 6.558 -34.155 -3.801 1.00 0.00 H new ATOM 0 HZ2 LYS B 99 5.624 -32.917 -4.493 1.00 0.00 H new ATOM 0 HZ3 LYS B 99 6.942 -33.564 -5.346 1.00 0.00 H new ATOM 3130 N ARG B 100 10.482 -26.641 -5.721 1.00 0.00 N ATOM 3131 CA ARG B 100 11.179 -25.795 -6.682 1.00 0.00 C ATOM 3132 C ARG B 100 12.268 -26.580 -7.407 1.00 0.00 C ATOM 3133 O ARG B 100 13.457 -26.417 -7.128 1.00 0.00 O ATOM 3134 CB ARG B 100 11.791 -24.583 -5.976 1.00 0.00 C ATOM 3135 CG ARG B 100 12.581 -24.942 -4.726 1.00 0.00 C ATOM 3136 CD ARG B 100 13.929 -24.240 -4.695 1.00 0.00 C ATOM 3137 NE ARG B 100 14.561 -24.326 -3.380 1.00 0.00 N ATOM 3138 CZ ARG B 100 14.232 -23.554 -2.348 1.00 0.00 C ATOM 3139 NH1 ARG B 100 13.280 -22.637 -2.472 1.00 0.00 N ATOM 3140 NH2 ARG B 100 14.857 -23.698 -1.187 1.00 0.00 N ATOM 0 H ARG B 100 11.068 -27.350 -5.280 1.00 0.00 H new ATOM 0 HA ARG B 100 10.454 -25.449 -7.419 1.00 0.00 H new ATOM 0 HB2 ARG B 100 12.446 -24.060 -6.672 1.00 0.00 H new ATOM 0 HB3 ARG B 100 10.994 -23.890 -5.706 1.00 0.00 H new ATOM 0 HG2 ARG B 100 12.007 -24.668 -3.841 1.00 0.00 H new ATOM 0 HG3 ARG B 100 12.731 -26.021 -4.687 1.00 0.00 H new ATOM 0 HD2 ARG B 100 14.586 -24.684 -5.443 1.00 0.00 H new ATOM 0 HD3 ARG B 100 13.799 -23.193 -4.967 1.00 0.00 H new ATOM 0 HE ARG B 100 15.298 -25.019 -3.246 1.00 0.00 H new ATOM 0 HH11 ARG B 100 12.796 -22.521 -3.362 1.00 0.00 H new ATOM 0 HH12 ARG B 100 13.032 -22.048 -1.677 1.00 0.00 H new ATOM 0 HH21 ARG B 100 15.590 -24.400 -1.086 1.00 0.00 H new ATOM 0 HH22 ARG B 100 14.605 -23.106 -0.395 1.00 0.00 H new ATOM 3153 N PHE B 101 11.854 -27.433 -8.339 1.00 0.00 N ATOM 3154 CA PHE B 101 12.794 -28.243 -9.105 1.00 0.00 C ATOM 3155 C PHE B 101 13.604 -29.151 -8.185 1.00 0.00 C ATOM 3156 O PHE B 101 14.630 -29.695 -8.645 1.00 0.00 O ATOM 3157 CB PHE B 101 13.734 -27.346 -9.912 1.00 0.00 C ATOM 3158 CG PHE B 101 13.154 -26.894 -11.222 1.00 0.00 C ATOM 3159 CD1 PHE B 101 12.790 -27.819 -12.189 1.00 0.00 C ATOM 3160 CD2 PHE B 101 12.973 -25.546 -11.487 1.00 0.00 C ATOM 3161 CE1 PHE B 101 12.257 -27.407 -13.396 1.00 0.00 C ATOM 3162 CE2 PHE B 101 12.440 -25.128 -12.692 1.00 0.00 C ATOM 3163 CZ PHE B 101 12.081 -26.059 -13.648 1.00 0.00 C ATOM 3164 OXT PHE B 101 13.207 -29.310 -7.011 1.00 0.00 O ATOM 0 H PHE B 101 10.874 -27.581 -8.582 1.00 0.00 H new ATOM 0 HA PHE B 101 12.222 -28.867 -9.791 1.00 0.00 H new ATOM 0 HB2 PHE B 101 13.989 -26.470 -9.315 1.00 0.00 H new ATOM 0 HB3 PHE B 101 14.663 -27.884 -10.101 1.00 0.00 H new ATOM 0 HD1 PHE B 101 12.924 -28.873 -11.997 1.00 0.00 H new ATOM 0 HD2 PHE B 101 13.252 -24.814 -10.744 1.00 0.00 H new ATOM 0 HE1 PHE B 101 11.978 -28.137 -14.141 1.00 0.00 H new ATOM 0 HE2 PHE B 101 12.304 -24.074 -12.886 1.00 0.00 H new ATOM 0 HZ PHE B 101 11.664 -25.734 -14.590 1.00 0.00 H new TER 3174 PHE B 101