USER MOD reduce.3.24.130724 H: found=0, std=0, add=1436, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1430 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 25 HIS : no HE2:sc= 1.17 K(o=1.9,f=-9.1!) USER MOD Set 1.2: B 85 HIS : no HE2:sc= 0.703 K(o=1.9,f=-7.2!) USER MOD Set 2.1: B 17 TYR OH : rot -161:sc= 0.127 USER MOD Set 2.2: B 38 ASN : amide:sc= 0.11 K(o=0.24,f=-1.6) USER MOD Set 3.1: A 82 THR OG1 : rot 75:sc= 2.03 USER MOD Set 3.2: B 71 GLN : amide:sc= 0.897 K(o=2.9,f=2.2) USER MOD Set 4.1: A 17 TYR OH : rot -174:sc= 1.03 USER MOD Set 4.2: A 38 ASN : amide:sc= 0.886 K(o=1.9,f=-1.6) USER MOD Set 5.1: A 15 HIS : no HE2:sc= 0.533 K(o=1.7,f=-5.2!) USER MOD Set 5.2: A 16 GLN : amide:sc= 1.17 K(o=1.7,f=-3.8!) USER MOD Set 6.1: A 1 SER N :NH3+ 177:sc= 1.22 (180deg=1.01) USER MOD Set 6.2: A 1 SER OG : rot 125:sc= 2.26 USER MOD Set 6.3: B 41 SER OG : rot -147:sc= 1.49 USER MOD Single : A 5 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00529) USER MOD Single : A 18 SER OG : rot 35:sc= 0.455 USER MOD Single : A 24 LYS NZ :NH3+ 171:sc=-0.00233 (180deg=-0.107) USER MOD Single : A 26 LYS NZ :NH3+ -166:sc= 0.707 (180deg=0.586) USER MOD Single : A 28 LYS NZ :NH3+ 151:sc= 1.2 (180deg=0.874) USER MOD Single : A 29 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0794) USER MOD Single : A 30 SER OG : rot 176:sc= 1.33 USER MOD Single : A 33 LYS NZ :NH3+ 174:sc= 0.809 (180deg=0.792) USER MOD Single : A 37 ASN : amide:sc= 2.61 K(o=2.6,f=-4.9!) USER MOD Single : A 41 SER OG : rot -65:sc= 1.34 USER MOD Single : A 42 HIS : no HE2:sc= 0.811 K(o=0.81,f=-3.6!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= -0.306 X(o=-0.31,f=-0.048) USER MOD Single : A 55 LYS NZ :NH3+ -170:sc=-0.00033 (180deg=-0.0982) USER MOD Single : A 57 MET CE :methyl -157:sc= -2.4 (180deg=-3.95) USER MOD Single : A 59 THR OG1 : rot 74:sc= 1.14 USER MOD Single : A 62 SER OG : rot 126:sc= 1.16 USER MOD Single : A 68 CYS SG : rot 180:sc= -0.23 USER MOD Single : A 71 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 74 MET CE :methyl -177:sc= -0.0829 (180deg=-0.0924) USER MOD Single : A 79 MET CE :methyl 177:sc= -0.106 (180deg=-0.129) USER MOD Single : A 81 THR OG1 : rot 79:sc= 1.24 USER MOD Single : A 84 CYS SG : rot -15:sc= 0.122 USER MOD Single : A 85 HIS : no HE2:sc= -0.186 K(o=-0.19,f=-2.6) USER MOD Single : B 1 SER N :NH3+ -173:sc= 0.775 (180deg=0.679) USER MOD Single : B 1 SER OG : rot -73:sc= 1.07 USER MOD Single : B 5 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0151) USER MOD Single : B 15 HIS : no HE2:sc= 0.918 K(o=0.92,f=-3.3!) USER MOD Single : B 16 GLN : amide:sc=-0.00802 X(o=-0.008,f=0) USER MOD Single : B 18 SER OG : rot 38:sc= 1.08 USER MOD Single : B 24 LYS NZ :NH3+ -154:sc= -0.18 (180deg=-1.11) USER MOD Single : B 25 HIS : no HE2:sc= 0.833 K(o=0.83,f=-3.5!) USER MOD Single : B 26 LYS NZ :NH3+ -120:sc= -0.299 (180deg=-0.396) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0169) USER MOD Single : B 30 SER OG : rot 166:sc= 1.35 USER MOD Single : B 33 LYS NZ :NH3+ -113:sc= 0.551 (180deg=0) USER MOD Single : B 37 ASN : amide:sc= 1.51 K(o=1.5,f=-6.2!) USER MOD Single : B 42 HIS : no HD1:sc= -0.074 K(o=-0.074,f=-0.73) USER MOD Single : B 48 LYS NZ :NH3+ -114:sc= -0.048 (180deg=-0.961) USER MOD Single : B 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl 170:sc= -0.678 (180deg=-0.966) USER MOD Single : B 59 THR OG1 : rot 78:sc= 1.17 USER MOD Single : B 62 SER OG : rot -166:sc= 0.788 USER MOD Single : B 68 CYS SG : rot 180:sc= -0.364 USER MOD Single : B 74 MET CE :methyl 175:sc= -0.0102 (180deg=-0.0421) USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 81 THR OG1 : rot 87:sc= 1.14 USER MOD Single : B 82 THR OG1 : rot 74:sc= 1.18 USER MOD Single : B 84 CYS SG : rot 155:sc= -0.0214 USER MOD Single : D 74 THR OG1 : rot -20:sc= 0.734 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 9.054 5.221 -12.338 1.00 0.00 N ATOM 2 CA SER A 1 8.848 4.211 -13.391 1.00 0.00 C ATOM 3 C SER A 1 7.551 3.417 -13.143 1.00 0.00 C ATOM 4 O SER A 1 6.540 4.006 -12.760 1.00 0.00 O ATOM 5 CB SER A 1 10.107 3.344 -13.538 1.00 0.00 C ATOM 6 OG SER A 1 11.270 4.151 -13.439 1.00 0.00 O ATOM 0 H1 SER A 1 9.958 5.709 -12.497 1.00 0.00 H new ATOM 0 H2 SER A 1 8.278 5.913 -12.364 1.00 0.00 H new ATOM 0 H3 SER A 1 9.071 4.755 -11.408 1.00 0.00 H new ATOM 0 HA SER A 1 8.702 4.699 -14.355 1.00 0.00 H new ATOM 0 HB2 SER A 1 10.121 2.576 -12.765 1.00 0.00 H new ATOM 0 HB3 SER A 1 10.093 2.829 -14.499 1.00 0.00 H new ATOM 0 HG SER A 1 11.853 3.799 -12.734 1.00 0.00 H new ATOM 14 N GLU A 2 7.552 2.094 -13.352 1.00 0.00 N ATOM 15 CA GLU A 2 6.341 1.281 -13.297 1.00 0.00 C ATOM 16 C GLU A 2 5.593 1.455 -11.969 1.00 0.00 C ATOM 17 O GLU A 2 4.391 1.716 -11.974 1.00 0.00 O ATOM 18 CB GLU A 2 6.683 -0.189 -13.591 1.00 0.00 C ATOM 19 CG GLU A 2 5.436 -1.079 -13.723 1.00 0.00 C ATOM 20 CD GLU A 2 4.533 -0.660 -14.882 1.00 0.00 C ATOM 21 OE1 GLU A 2 5.047 -0.642 -16.022 1.00 0.00 O ATOM 22 OE2 GLU A 2 3.352 -0.356 -14.608 1.00 0.00 O ATOM 0 H GLU A 2 8.396 1.562 -13.564 1.00 0.00 H new ATOM 0 HA GLU A 2 5.656 1.628 -14.070 1.00 0.00 H new ATOM 0 HB2 GLU A 2 7.262 -0.245 -14.513 1.00 0.00 H new ATOM 0 HB3 GLU A 2 7.316 -0.576 -12.793 1.00 0.00 H new ATOM 0 HG2 GLU A 2 5.747 -2.114 -13.866 1.00 0.00 H new ATOM 0 HG3 GLU A 2 4.868 -1.042 -12.793 1.00 0.00 H new ATOM 29 N LEU A 3 6.282 1.327 -10.828 1.00 0.00 N ATOM 30 CA LEU A 3 5.608 1.502 -9.542 1.00 0.00 C ATOM 31 C LEU A 3 4.977 2.891 -9.450 1.00 0.00 C ATOM 32 O LEU A 3 3.828 3.005 -9.038 1.00 0.00 O ATOM 33 CB LEU A 3 6.525 1.263 -8.336 1.00 0.00 C ATOM 34 CG LEU A 3 7.150 -0.139 -8.254 1.00 0.00 C ATOM 35 CD1 LEU A 3 7.927 -0.249 -6.937 1.00 0.00 C ATOM 36 CD2 LEU A 3 6.122 -1.272 -8.293 1.00 0.00 C ATOM 0 H LEU A 3 7.277 1.109 -10.770 1.00 0.00 H new ATOM 0 HA LEU A 3 4.830 0.739 -9.502 1.00 0.00 H new ATOM 0 HB2 LEU A 3 7.328 2.000 -8.359 1.00 0.00 H new ATOM 0 HB3 LEU A 3 5.954 1.442 -7.425 1.00 0.00 H new ATOM 0 HG LEU A 3 7.791 -0.251 -9.129 1.00 0.00 H new ATOM 0 HD11 LEU A 3 8.378 -1.239 -6.862 1.00 0.00 H new ATOM 0 HD12 LEU A 3 8.710 0.509 -6.912 1.00 0.00 H new ATOM 0 HD13 LEU A 3 7.247 -0.096 -6.099 1.00 0.00 H new ATOM 0 HD21 LEU A 3 6.635 -2.231 -8.231 1.00 0.00 H new ATOM 0 HD22 LEU A 3 5.438 -1.172 -7.451 1.00 0.00 H new ATOM 0 HD23 LEU A 3 5.560 -1.221 -9.225 1.00 0.00 H new ATOM 48 N GLU A 4 5.701 3.946 -9.843 1.00 0.00 N ATOM 49 CA GLU A 4 5.139 5.293 -9.838 1.00 0.00 C ATOM 50 C GLU A 4 3.876 5.344 -10.693 1.00 0.00 C ATOM 51 O GLU A 4 2.886 5.941 -10.286 1.00 0.00 O ATOM 52 CB GLU A 4 6.140 6.330 -10.353 1.00 0.00 C ATOM 53 CG GLU A 4 7.376 6.443 -9.455 1.00 0.00 C ATOM 54 CD GLU A 4 8.387 7.455 -9.991 1.00 0.00 C ATOM 55 OE1 GLU A 4 8.157 7.976 -11.104 1.00 0.00 O ATOM 56 OE2 GLU A 4 9.376 7.707 -9.270 1.00 0.00 O ATOM 0 H GLU A 4 6.667 3.890 -10.165 1.00 0.00 H new ATOM 0 HA GLU A 4 4.896 5.537 -8.804 1.00 0.00 H new ATOM 0 HB2 GLU A 4 6.451 6.061 -11.363 1.00 0.00 H new ATOM 0 HB3 GLU A 4 5.651 7.302 -10.418 1.00 0.00 H new ATOM 0 HG2 GLU A 4 7.068 6.736 -8.451 1.00 0.00 H new ATOM 0 HG3 GLU A 4 7.852 5.466 -9.370 1.00 0.00 H new ATOM 63 N LYS A 5 3.910 4.730 -11.878 1.00 0.00 N ATOM 64 CA LYS A 5 2.787 4.738 -12.806 1.00 0.00 C ATOM 65 C LYS A 5 1.571 4.091 -12.140 1.00 0.00 C ATOM 66 O LYS A 5 0.494 4.686 -12.063 1.00 0.00 O ATOM 67 CB LYS A 5 3.177 4.048 -14.122 1.00 0.00 C ATOM 68 CG LYS A 5 2.033 3.988 -15.147 1.00 0.00 C ATOM 69 CD LYS A 5 1.471 5.379 -15.478 1.00 0.00 C ATOM 70 CE LYS A 5 0.515 5.331 -16.675 1.00 0.00 C ATOM 71 NZ LYS A 5 -0.670 4.500 -16.400 1.00 0.00 N ATOM 0 H LYS A 5 4.721 4.213 -12.218 1.00 0.00 H new ATOM 0 HA LYS A 5 2.518 5.764 -13.058 1.00 0.00 H new ATOM 0 HB2 LYS A 5 4.022 4.577 -14.563 1.00 0.00 H new ATOM 0 HB3 LYS A 5 3.513 3.034 -13.905 1.00 0.00 H new ATOM 0 HG2 LYS A 5 2.393 3.517 -16.062 1.00 0.00 H new ATOM 0 HG3 LYS A 5 1.233 3.359 -14.758 1.00 0.00 H new ATOM 0 HD2 LYS A 5 0.947 5.777 -14.609 1.00 0.00 H new ATOM 0 HD3 LYS A 5 2.292 6.062 -15.695 1.00 0.00 H new ATOM 0 HE2 LYS A 5 0.198 6.343 -16.927 1.00 0.00 H new ATOM 0 HE3 LYS A 5 1.041 4.936 -17.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -1.307 4.521 -17.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -0.372 3.520 -16.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -1.168 4.871 -15.566 1.00 0.00 H new ATOM 85 N ALA A 6 1.765 2.870 -11.637 1.00 0.00 N ATOM 86 CA ALA A 6 0.762 2.137 -10.882 1.00 0.00 C ATOM 87 C ALA A 6 0.197 3.010 -9.755 1.00 0.00 C ATOM 88 O ALA A 6 -1.015 3.170 -9.613 1.00 0.00 O ATOM 89 CB ALA A 6 1.414 0.861 -10.341 1.00 0.00 C ATOM 0 H ALA A 6 2.641 2.359 -11.748 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.078 1.867 -11.522 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.681 0.292 -9.769 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.775 0.256 -11.173 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.251 1.126 -9.695 1.00 0.00 H new ATOM 95 N VAL A 7 1.088 3.600 -8.962 1.00 0.00 N ATOM 96 CA VAL A 7 0.734 4.467 -7.855 1.00 0.00 C ATOM 97 C VAL A 7 -0.122 5.652 -8.318 1.00 0.00 C ATOM 98 O VAL A 7 -1.211 5.853 -7.786 1.00 0.00 O ATOM 99 CB VAL A 7 2.018 4.869 -7.113 1.00 0.00 C ATOM 100 CG1 VAL A 7 1.818 6.117 -6.258 1.00 0.00 C ATOM 101 CG2 VAL A 7 2.481 3.697 -6.236 1.00 0.00 C ATOM 0 H VAL A 7 2.095 3.483 -9.078 1.00 0.00 H new ATOM 0 HA VAL A 7 0.099 3.936 -7.146 1.00 0.00 H new ATOM 0 HB VAL A 7 2.780 5.106 -7.856 1.00 0.00 H new ATOM 0 HG11 VAL A 7 2.751 6.365 -5.752 1.00 0.00 H new ATOM 0 HG12 VAL A 7 1.518 6.950 -6.894 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.042 5.929 -5.516 1.00 0.00 H new ATOM 0 HG21 VAL A 7 3.392 3.976 -5.707 1.00 0.00 H new ATOM 0 HG22 VAL A 7 1.702 3.453 -5.514 1.00 0.00 H new ATOM 0 HG23 VAL A 7 2.678 2.828 -6.864 1.00 0.00 H new ATOM 111 N VAL A 8 0.329 6.447 -9.292 1.00 0.00 N ATOM 112 CA VAL A 8 -0.458 7.594 -9.726 1.00 0.00 C ATOM 113 C VAL A 8 -1.796 7.139 -10.314 1.00 0.00 C ATOM 114 O VAL A 8 -2.799 7.823 -10.124 1.00 0.00 O ATOM 115 CB VAL A 8 0.316 8.577 -10.623 1.00 0.00 C ATOM 116 CG1 VAL A 8 1.561 9.120 -9.903 1.00 0.00 C ATOM 117 CG2 VAL A 8 0.693 7.991 -11.985 1.00 0.00 C ATOM 0 H VAL A 8 1.214 6.319 -9.782 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.682 8.186 -8.838 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.368 9.402 -10.822 1.00 0.00 H new ATOM 0 HG11 VAL A 8 2.088 9.812 -10.560 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.258 9.641 -8.995 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.221 8.292 -9.643 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.236 8.738 -12.565 1.00 0.00 H new ATOM 0 HG22 VAL A 8 1.324 7.114 -11.842 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -0.212 7.704 -12.520 1.00 0.00 H new ATOM 127 N ALA A 9 -1.849 5.970 -10.968 1.00 0.00 N ATOM 128 CA ALA A 9 -3.127 5.389 -11.363 1.00 0.00 C ATOM 129 C ALA A 9 -4.028 5.171 -10.140 1.00 0.00 C ATOM 130 O ALA A 9 -5.166 5.638 -10.137 1.00 0.00 O ATOM 131 CB ALA A 9 -2.932 4.102 -12.171 1.00 0.00 C ATOM 0 H ALA A 9 -1.031 5.420 -11.229 1.00 0.00 H new ATOM 0 HA ALA A 9 -3.633 6.098 -12.019 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -3.905 3.696 -12.449 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -2.360 4.321 -13.072 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -2.393 3.372 -11.568 1.00 0.00 H new ATOM 137 N LEU A 10 -3.530 4.509 -9.087 1.00 0.00 N ATOM 138 CA LEU A 10 -4.305 4.323 -7.858 1.00 0.00 C ATOM 139 C LEU A 10 -4.787 5.673 -7.313 1.00 0.00 C ATOM 140 O LEU A 10 -5.975 5.835 -7.021 1.00 0.00 O ATOM 141 CB LEU A 10 -3.490 3.600 -6.770 1.00 0.00 C ATOM 142 CG LEU A 10 -3.105 2.143 -7.070 1.00 0.00 C ATOM 143 CD1 LEU A 10 -2.206 1.632 -5.939 1.00 0.00 C ATOM 144 CD2 LEU A 10 -4.320 1.217 -7.151 1.00 0.00 C ATOM 0 H LEU A 10 -2.598 4.096 -9.064 1.00 0.00 H new ATOM 0 HA LEU A 10 -5.164 3.703 -8.115 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -2.576 4.167 -6.592 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.062 3.620 -5.843 1.00 0.00 H new ATOM 0 HG LEU A 10 -2.602 2.133 -8.037 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -1.924 0.598 -6.137 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -1.309 2.248 -5.881 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -2.745 1.686 -4.993 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -3.989 0.201 -7.365 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -4.853 1.233 -6.201 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -4.984 1.557 -7.945 1.00 0.00 H new ATOM 156 N ILE A 11 -3.869 6.639 -7.180 1.00 0.00 N ATOM 157 CA ILE A 11 -4.183 7.966 -6.659 1.00 0.00 C ATOM 158 C ILE A 11 -5.308 8.579 -7.486 1.00 0.00 C ATOM 159 O ILE A 11 -6.308 9.015 -6.926 1.00 0.00 O ATOM 160 CB ILE A 11 -2.931 8.871 -6.661 1.00 0.00 C ATOM 161 CG1 ILE A 11 -1.916 8.354 -5.628 1.00 0.00 C ATOM 162 CG2 ILE A 11 -3.289 10.337 -6.359 1.00 0.00 C ATOM 163 CD1 ILE A 11 -0.583 9.109 -5.632 1.00 0.00 C ATOM 0 H ILE A 11 -2.888 6.517 -7.432 1.00 0.00 H new ATOM 0 HA ILE A 11 -4.514 7.875 -5.624 1.00 0.00 H new ATOM 0 HB ILE A 11 -2.492 8.836 -7.658 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -2.358 8.423 -4.634 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -1.724 7.298 -5.819 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -2.383 10.942 -6.369 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -3.980 10.706 -7.116 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -3.758 10.402 -5.377 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.078 8.685 -4.876 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -0.117 9.019 -6.613 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -0.760 10.161 -5.409 1.00 0.00 H new ATOM 175 N ASP A 12 -5.153 8.609 -8.811 1.00 0.00 N ATOM 176 CA ASP A 12 -6.096 9.266 -9.700 1.00 0.00 C ATOM 177 C ASP A 12 -7.466 8.596 -9.626 1.00 0.00 C ATOM 178 O ASP A 12 -8.472 9.263 -9.388 1.00 0.00 O ATOM 179 CB ASP A 12 -5.557 9.224 -11.134 1.00 0.00 C ATOM 180 CG ASP A 12 -6.600 9.738 -12.119 1.00 0.00 C ATOM 181 OD1 ASP A 12 -6.936 10.938 -12.014 1.00 0.00 O ATOM 182 OD2 ASP A 12 -7.068 8.916 -12.936 1.00 0.00 O ATOM 0 H ASP A 12 -4.366 8.175 -9.293 1.00 0.00 H new ATOM 0 HA ASP A 12 -6.213 10.304 -9.389 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -4.653 9.829 -11.206 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -5.278 8.203 -11.393 1.00 0.00 H new ATOM 187 N VAL A 13 -7.498 7.275 -9.816 1.00 0.00 N ATOM 188 CA VAL A 13 -8.740 6.515 -9.831 1.00 0.00 C ATOM 189 C VAL A 13 -9.477 6.750 -8.514 1.00 0.00 C ATOM 190 O VAL A 13 -10.646 7.140 -8.510 1.00 0.00 O ATOM 191 CB VAL A 13 -8.441 5.029 -10.097 1.00 0.00 C ATOM 192 CG1 VAL A 13 -9.683 4.148 -9.905 1.00 0.00 C ATOM 193 CG2 VAL A 13 -7.941 4.847 -11.537 1.00 0.00 C ATOM 0 H VAL A 13 -6.663 6.708 -9.963 1.00 0.00 H new ATOM 0 HA VAL A 13 -9.392 6.849 -10.638 1.00 0.00 H new ATOM 0 HB VAL A 13 -7.680 4.723 -9.379 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -9.425 3.108 -10.103 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -10.042 4.244 -8.880 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.465 4.466 -10.595 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -7.731 3.793 -11.719 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -8.706 5.190 -12.234 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -7.031 5.428 -11.682 1.00 0.00 H new ATOM 203 N PHE A 14 -8.777 6.557 -7.393 1.00 0.00 N ATOM 204 CA PHE A 14 -9.354 6.829 -6.090 1.00 0.00 C ATOM 205 C PHE A 14 -9.861 8.272 -6.008 1.00 0.00 C ATOM 206 O PHE A 14 -11.004 8.499 -5.620 1.00 0.00 O ATOM 207 CB PHE A 14 -8.326 6.536 -4.996 1.00 0.00 C ATOM 208 CG PHE A 14 -8.851 6.830 -3.608 1.00 0.00 C ATOM 209 CD1 PHE A 14 -8.806 8.145 -3.116 1.00 0.00 C ATOM 210 CD2 PHE A 14 -9.375 5.803 -2.804 1.00 0.00 C ATOM 211 CE1 PHE A 14 -9.268 8.429 -1.825 1.00 0.00 C ATOM 212 CE2 PHE A 14 -9.817 6.088 -1.499 1.00 0.00 C ATOM 213 CZ PHE A 14 -9.762 7.401 -1.009 1.00 0.00 C ATOM 0 H PHE A 14 -7.816 6.215 -7.369 1.00 0.00 H new ATOM 0 HA PHE A 14 -10.213 6.175 -5.940 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -8.029 5.489 -5.053 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -7.431 7.132 -5.175 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -8.414 8.939 -3.735 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -9.438 4.795 -3.188 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -9.244 9.444 -1.456 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -10.199 5.295 -0.874 1.00 0.00 H new ATOM 0 HZ PHE A 14 -10.099 7.620 -0.006 1.00 0.00 H new ATOM 223 N HIS A 15 -9.009 9.245 -6.349 1.00 0.00 N ATOM 224 CA HIS A 15 -9.302 10.664 -6.206 1.00 0.00 C ATOM 225 C HIS A 15 -10.608 11.011 -6.905 1.00 0.00 C ATOM 226 O HIS A 15 -11.486 11.621 -6.298 1.00 0.00 O ATOM 227 CB HIS A 15 -8.143 11.505 -6.759 1.00 0.00 C ATOM 228 CG HIS A 15 -8.359 12.995 -6.667 1.00 0.00 C ATOM 229 ND1 HIS A 15 -9.239 13.748 -7.417 1.00 0.00 N ATOM 230 CD2 HIS A 15 -7.644 13.860 -5.884 1.00 0.00 C ATOM 231 CE1 HIS A 15 -9.062 15.035 -7.076 1.00 0.00 C ATOM 232 NE2 HIS A 15 -8.097 15.155 -6.150 1.00 0.00 N ATOM 0 H HIS A 15 -8.084 9.060 -6.737 1.00 0.00 H new ATOM 0 HA HIS A 15 -9.415 10.893 -5.146 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -7.232 11.248 -6.218 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -7.981 11.237 -7.803 1.00 0.00 H new ATOM 0 HD1 HIS A 15 -9.903 13.392 -8.105 1.00 0.00 H new ATOM 0 HD2 HIS A 15 -6.867 13.590 -5.184 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -9.620 15.861 -7.490 1.00 0.00 H new ATOM 240 N GLN A 16 -10.740 10.641 -8.182 1.00 0.00 N ATOM 241 CA GLN A 16 -11.927 11.039 -8.920 1.00 0.00 C ATOM 242 C GLN A 16 -13.176 10.390 -8.322 1.00 0.00 C ATOM 243 O GLN A 16 -14.143 11.095 -8.042 1.00 0.00 O ATOM 244 CB GLN A 16 -11.783 10.820 -10.435 1.00 0.00 C ATOM 245 CG GLN A 16 -10.467 11.306 -11.079 1.00 0.00 C ATOM 246 CD GLN A 16 -9.843 12.573 -10.483 1.00 0.00 C ATOM 247 OE1 GLN A 16 -10.514 13.431 -9.920 1.00 0.00 O ATOM 248 NE2 GLN A 16 -8.524 12.709 -10.576 1.00 0.00 N ATOM 0 H GLN A 16 -10.063 10.086 -8.706 1.00 0.00 H new ATOM 0 HA GLN A 16 -12.047 12.117 -8.809 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -11.889 9.754 -10.637 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -12.612 11.322 -10.933 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -9.736 10.501 -11.011 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -10.650 11.482 -12.139 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -7.969 11.993 -11.045 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -8.067 13.529 -10.178 1.00 0.00 H new ATOM 257 N TYR A 17 -13.156 9.079 -8.058 1.00 0.00 N ATOM 258 CA TYR A 17 -14.308 8.395 -7.468 1.00 0.00 C ATOM 259 C TYR A 17 -14.659 9.037 -6.110 1.00 0.00 C ATOM 260 O TYR A 17 -15.811 9.377 -5.840 1.00 0.00 O ATOM 261 CB TYR A 17 -14.048 6.880 -7.374 1.00 0.00 C ATOM 262 CG TYR A 17 -14.157 6.092 -8.681 1.00 0.00 C ATOM 263 CD1 TYR A 17 -13.376 6.440 -9.802 1.00 0.00 C ATOM 264 CD2 TYR A 17 -14.985 4.951 -8.756 1.00 0.00 C ATOM 265 CE1 TYR A 17 -13.385 5.640 -10.956 1.00 0.00 C ATOM 266 CE2 TYR A 17 -15.001 4.153 -9.919 1.00 0.00 C ATOM 267 CZ TYR A 17 -14.193 4.497 -11.017 1.00 0.00 C ATOM 268 OH TYR A 17 -14.154 3.730 -12.144 1.00 0.00 O ATOM 0 H TYR A 17 -12.357 8.473 -8.243 1.00 0.00 H new ATOM 0 HA TYR A 17 -15.179 8.515 -8.112 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -13.049 6.729 -6.966 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -14.752 6.456 -6.659 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -12.765 7.330 -9.773 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -15.611 4.687 -7.916 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -12.766 5.907 -11.800 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -15.633 3.279 -9.966 1.00 0.00 H new ATOM 0 HH TYR A 17 -14.833 3.026 -12.084 1.00 0.00 H new ATOM 278 N SER A 18 -13.642 9.287 -5.284 1.00 0.00 N ATOM 279 CA SER A 18 -13.735 10.004 -4.015 1.00 0.00 C ATOM 280 C SER A 18 -14.302 11.421 -4.169 1.00 0.00 C ATOM 281 O SER A 18 -14.775 12.000 -3.190 1.00 0.00 O ATOM 282 CB SER A 18 -12.371 9.998 -3.312 1.00 0.00 C ATOM 283 OG SER A 18 -12.451 10.653 -2.061 1.00 0.00 O ATOM 0 H SER A 18 -12.691 8.982 -5.492 1.00 0.00 H new ATOM 0 HA SER A 18 -14.452 9.476 -3.386 1.00 0.00 H new ATOM 0 HB2 SER A 18 -12.034 8.971 -3.170 1.00 0.00 H new ATOM 0 HB3 SER A 18 -11.630 10.492 -3.940 1.00 0.00 H new ATOM 0 HG SER A 18 -13.329 10.484 -1.659 1.00 0.00 H new ATOM 289 N GLY A 19 -14.213 12.023 -5.357 1.00 0.00 N ATOM 290 CA GLY A 19 -14.773 13.335 -5.609 1.00 0.00 C ATOM 291 C GLY A 19 -16.294 13.264 -5.732 1.00 0.00 C ATOM 292 O GLY A 19 -16.970 14.267 -5.519 1.00 0.00 O ATOM 0 H GLY A 19 -13.749 11.608 -6.165 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -14.501 14.013 -4.800 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -14.349 13.746 -6.525 1.00 0.00 H new ATOM 296 N ARG A 20 -16.839 12.099 -6.101 1.00 0.00 N ATOM 297 CA ARG A 20 -18.246 11.983 -6.456 1.00 0.00 C ATOM 298 C ARG A 20 -19.126 12.030 -5.208 1.00 0.00 C ATOM 299 O ARG A 20 -20.034 12.853 -5.124 1.00 0.00 O ATOM 300 CB ARG A 20 -18.482 10.699 -7.258 1.00 0.00 C ATOM 301 CG ARG A 20 -17.501 10.583 -8.432 1.00 0.00 C ATOM 302 CD ARG A 20 -17.804 9.375 -9.324 1.00 0.00 C ATOM 303 NE ARG A 20 -19.164 9.418 -9.885 1.00 0.00 N ATOM 304 CZ ARG A 20 -20.146 8.537 -9.635 1.00 0.00 C ATOM 305 NH1 ARG A 20 -20.050 7.647 -8.641 1.00 0.00 N ATOM 306 NH2 ARG A 20 -21.241 8.545 -10.402 1.00 0.00 N ATOM 0 H ARG A 20 -16.319 11.223 -6.160 1.00 0.00 H new ATOM 0 HA ARG A 20 -18.522 12.831 -7.082 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -18.372 9.834 -6.604 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -19.505 10.686 -7.634 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -17.544 11.493 -9.030 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -16.485 10.502 -8.047 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -17.080 9.337 -10.138 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -17.682 8.460 -8.745 1.00 0.00 H new ATOM 0 HE ARG A 20 -19.380 10.186 -10.521 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -19.217 7.627 -8.053 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -20.810 6.988 -8.471 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -21.323 9.215 -11.167 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -21.994 7.881 -10.223 1.00 0.00 H new ATOM 320 N GLU A 21 -18.849 11.158 -4.235 1.00 0.00 N ATOM 321 CA GLU A 21 -19.457 11.203 -2.913 1.00 0.00 C ATOM 322 C GLU A 21 -18.357 10.884 -1.905 1.00 0.00 C ATOM 323 O GLU A 21 -17.884 9.749 -1.823 1.00 0.00 O ATOM 324 CB GLU A 21 -20.657 10.252 -2.791 1.00 0.00 C ATOM 325 CG GLU A 21 -21.746 10.542 -3.835 1.00 0.00 C ATOM 326 CD GLU A 21 -22.991 9.677 -3.654 1.00 0.00 C ATOM 327 OE1 GLU A 21 -22.963 8.796 -2.765 1.00 0.00 O ATOM 328 OE2 GLU A 21 -23.958 9.915 -4.408 1.00 0.00 O ATOM 0 H GLU A 21 -18.186 10.392 -4.350 1.00 0.00 H new ATOM 0 HA GLU A 21 -19.869 12.193 -2.719 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -20.314 9.223 -2.904 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -21.084 10.337 -1.792 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -22.029 11.593 -3.775 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -21.338 10.378 -4.832 1.00 0.00 H new ATOM 335 N GLY A 22 -17.921 11.905 -1.174 1.00 0.00 N ATOM 336 CA GLY A 22 -16.750 11.858 -0.328 1.00 0.00 C ATOM 337 C GLY A 22 -16.124 13.240 -0.421 1.00 0.00 C ATOM 338 O GLY A 22 -16.856 14.217 -0.570 1.00 0.00 O ATOM 0 H GLY A 22 -18.391 12.810 -1.159 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -17.019 11.618 0.701 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -16.054 11.089 -0.664 1.00 0.00 H new ATOM 342 N ASP A 23 -14.793 13.328 -0.388 1.00 0.00 N ATOM 343 CA ASP A 23 -14.102 14.575 -0.685 1.00 0.00 C ATOM 344 C ASP A 23 -12.650 14.293 -1.052 1.00 0.00 C ATOM 345 O ASP A 23 -11.745 14.713 -0.336 1.00 0.00 O ATOM 346 CB ASP A 23 -14.214 15.569 0.487 1.00 0.00 C ATOM 347 CG ASP A 23 -13.555 16.916 0.180 1.00 0.00 C ATOM 348 OD1 ASP A 23 -13.508 17.282 -1.016 1.00 0.00 O ATOM 349 OD2 ASP A 23 -13.124 17.567 1.156 1.00 0.00 O ATOM 0 H ASP A 23 -14.176 12.549 -0.158 1.00 0.00 H new ATOM 0 HA ASP A 23 -14.583 15.045 -1.543 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -15.266 15.729 0.724 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -13.750 15.135 1.373 1.00 0.00 H new ATOM 354 N LYS A 24 -12.435 13.569 -2.156 1.00 0.00 N ATOM 355 CA LYS A 24 -11.135 13.361 -2.803 1.00 0.00 C ATOM 356 C LYS A 24 -10.189 12.419 -2.037 1.00 0.00 C ATOM 357 O LYS A 24 -9.569 11.547 -2.643 1.00 0.00 O ATOM 358 CB LYS A 24 -10.449 14.698 -3.115 1.00 0.00 C ATOM 359 CG LYS A 24 -11.343 15.652 -3.917 1.00 0.00 C ATOM 360 CD LYS A 24 -10.605 16.978 -4.138 1.00 0.00 C ATOM 361 CE LYS A 24 -11.455 17.976 -4.933 1.00 0.00 C ATOM 362 NZ LYS A 24 -12.670 18.371 -4.196 1.00 0.00 N ATOM 0 H LYS A 24 -13.194 13.092 -2.643 1.00 0.00 H new ATOM 0 HA LYS A 24 -11.358 12.850 -3.740 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -10.159 15.179 -2.181 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -9.533 14.509 -3.675 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -11.603 15.204 -4.876 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -12.277 15.828 -3.383 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -10.341 17.412 -3.174 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -9.672 16.791 -4.669 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -10.861 18.862 -5.156 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -11.737 17.533 -5.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.138 19.155 -4.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -13.320 17.561 -4.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -12.410 18.676 -3.236 1.00 0.00 H new ATOM 376 N HIS A 25 -10.072 12.590 -0.716 1.00 0.00 N ATOM 377 CA HIS A 25 -9.251 11.786 0.180 1.00 0.00 C ATOM 378 C HIS A 25 -10.003 10.580 0.755 1.00 0.00 C ATOM 379 O HIS A 25 -9.377 9.747 1.411 1.00 0.00 O ATOM 380 CB HIS A 25 -8.802 12.658 1.361 1.00 0.00 C ATOM 381 CG HIS A 25 -7.929 13.834 1.007 1.00 0.00 C ATOM 382 ND1 HIS A 25 -6.803 13.798 0.217 1.00 0.00 N ATOM 383 CD2 HIS A 25 -7.970 15.065 1.606 1.00 0.00 C ATOM 384 CE1 HIS A 25 -6.184 14.984 0.340 1.00 0.00 C ATOM 385 NE2 HIS A 25 -6.858 15.792 1.174 1.00 0.00 N ATOM 0 H HIS A 25 -10.573 13.330 -0.224 1.00 0.00 H new ATOM 0 HA HIS A 25 -8.409 11.417 -0.406 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -9.690 13.029 1.874 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -8.264 12.029 2.070 1.00 0.00 H new ATOM 0 HD1 HIS A 25 -6.494 13.014 -0.357 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -8.729 15.413 2.292 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -5.267 15.252 -0.164 1.00 0.00 H new ATOM 393 N LYS A 26 -11.327 10.496 0.573 1.00 0.00 N ATOM 394 CA LYS A 26 -12.176 9.525 1.255 1.00 0.00 C ATOM 395 C LYS A 26 -13.324 9.047 0.359 1.00 0.00 C ATOM 396 O LYS A 26 -14.100 9.876 -0.114 1.00 0.00 O ATOM 397 CB LYS A 26 -12.631 10.125 2.599 1.00 0.00 C ATOM 398 CG LYS A 26 -13.329 11.496 2.490 1.00 0.00 C ATOM 399 CD LYS A 26 -13.070 12.376 3.724 1.00 0.00 C ATOM 400 CE LYS A 26 -13.663 11.785 5.008 1.00 0.00 C ATOM 401 NZ LYS A 26 -13.299 12.574 6.197 1.00 0.00 N ATOM 0 H LYS A 26 -11.840 11.110 -0.060 1.00 0.00 H new ATOM 0 HA LYS A 26 -11.612 8.618 1.474 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -13.311 9.424 3.083 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -11.762 10.226 3.249 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -12.977 12.012 1.597 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -14.402 11.348 2.370 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -11.996 12.508 3.852 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -13.494 13.366 3.555 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -14.749 11.742 4.920 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -13.312 10.760 5.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -13.510 12.026 7.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -12.283 12.795 6.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -13.846 13.458 6.208 1.00 0.00 H new ATOM 415 N LEU A 27 -13.435 7.738 0.103 1.00 0.00 N ATOM 416 CA LEU A 27 -14.530 7.158 -0.682 1.00 0.00 C ATOM 417 C LEU A 27 -15.710 6.902 0.251 1.00 0.00 C ATOM 418 O LEU A 27 -15.526 6.149 1.204 1.00 0.00 O ATOM 419 CB LEU A 27 -14.107 5.794 -1.264 1.00 0.00 C ATOM 420 CG LEU A 27 -13.137 5.850 -2.451 1.00 0.00 C ATOM 421 CD1 LEU A 27 -12.541 4.454 -2.678 1.00 0.00 C ATOM 422 CD2 LEU A 27 -13.837 6.261 -3.749 1.00 0.00 C ATOM 0 H LEU A 27 -12.763 7.047 0.437 1.00 0.00 H new ATOM 0 HA LEU A 27 -14.789 7.846 -1.487 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.646 5.208 -0.469 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -15.004 5.259 -1.576 1.00 0.00 H new ATOM 0 HG LEU A 27 -12.373 6.589 -2.209 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -11.850 4.486 -3.521 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -12.007 4.136 -1.783 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -13.342 3.747 -2.892 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -13.111 6.287 -4.561 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -14.619 5.540 -3.985 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -14.280 7.249 -3.626 1.00 0.00 H new ATOM 434 N LYS A 28 -16.901 7.463 -0.004 1.00 0.00 N ATOM 435 CA LYS A 28 -18.107 7.075 0.731 1.00 0.00 C ATOM 436 C LYS A 28 -18.516 5.644 0.346 1.00 0.00 C ATOM 437 O LYS A 28 -18.098 5.153 -0.701 1.00 0.00 O ATOM 438 CB LYS A 28 -19.223 8.093 0.456 1.00 0.00 C ATOM 439 CG LYS A 28 -20.315 8.115 1.534 1.00 0.00 C ATOM 440 CD LYS A 28 -19.941 9.031 2.707 1.00 0.00 C ATOM 441 CE LYS A 28 -21.088 9.100 3.720 1.00 0.00 C ATOM 442 NZ LYS A 28 -20.740 9.953 4.871 1.00 0.00 N ATOM 0 H LYS A 28 -17.052 8.183 -0.711 1.00 0.00 H new ATOM 0 HA LYS A 28 -17.912 7.078 1.803 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -18.784 9.087 0.375 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -19.680 7.867 -0.507 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -21.253 8.453 1.094 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -20.482 7.103 1.902 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -19.040 8.659 3.194 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -19.714 10.031 2.337 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -21.982 9.490 3.233 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -21.328 8.096 4.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -21.605 10.379 5.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -20.277 9.377 5.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -20.093 10.706 4.562 1.00 0.00 H new ATOM 456 N LYS A 29 -19.333 4.966 1.165 1.00 0.00 N ATOM 457 CA LYS A 29 -19.728 3.572 0.932 1.00 0.00 C ATOM 458 C LYS A 29 -20.289 3.327 -0.471 1.00 0.00 C ATOM 459 O LYS A 29 -19.973 2.306 -1.077 1.00 0.00 O ATOM 460 CB LYS A 29 -20.693 3.082 2.025 1.00 0.00 C ATOM 461 CG LYS A 29 -21.871 4.025 2.307 1.00 0.00 C ATOM 462 CD LYS A 29 -22.748 3.430 3.417 1.00 0.00 C ATOM 463 CE LYS A 29 -23.924 4.347 3.771 1.00 0.00 C ATOM 464 NZ LYS A 29 -23.474 5.618 4.368 1.00 0.00 N ATOM 0 H LYS A 29 -19.738 5.371 2.009 1.00 0.00 H new ATOM 0 HA LYS A 29 -18.816 2.979 0.991 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -21.086 2.108 1.734 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -20.132 2.937 2.948 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -21.502 5.006 2.607 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -22.460 4.169 1.401 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -23.128 2.459 3.098 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -22.141 3.258 4.306 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -24.505 4.554 2.872 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -24.587 3.834 4.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -24.296 6.141 4.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -22.817 5.421 5.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -22.991 6.189 3.645 1.00 0.00 H new ATOM 478 N SER A 30 -21.067 4.266 -1.008 1.00 0.00 N ATOM 479 CA SER A 30 -21.533 4.250 -2.384 1.00 0.00 C ATOM 480 C SER A 30 -20.354 4.140 -3.356 1.00 0.00 C ATOM 481 O SER A 30 -20.343 3.306 -4.264 1.00 0.00 O ATOM 482 CB SER A 30 -22.294 5.561 -2.605 1.00 0.00 C ATOM 483 OG SER A 30 -21.664 6.590 -1.857 1.00 0.00 O ATOM 0 H SER A 30 -21.396 5.076 -0.482 1.00 0.00 H new ATOM 0 HA SER A 30 -22.176 3.389 -2.566 1.00 0.00 H new ATOM 0 HB2 SER A 30 -22.304 5.817 -3.664 1.00 0.00 H new ATOM 0 HB3 SER A 30 -23.333 5.451 -2.294 1.00 0.00 H new ATOM 0 HG SER A 30 -22.105 7.445 -2.041 1.00 0.00 H new ATOM 489 N GLU A 31 -19.352 4.999 -3.170 1.00 0.00 N ATOM 490 CA GLU A 31 -18.200 5.043 -4.052 1.00 0.00 C ATOM 491 C GLU A 31 -17.328 3.811 -3.870 1.00 0.00 C ATOM 492 O GLU A 31 -16.857 3.261 -4.856 1.00 0.00 O ATOM 493 CB GLU A 31 -17.397 6.332 -3.854 1.00 0.00 C ATOM 494 CG GLU A 31 -18.292 7.567 -3.963 1.00 0.00 C ATOM 495 CD GLU A 31 -19.154 7.551 -5.221 1.00 0.00 C ATOM 496 OE1 GLU A 31 -18.563 7.380 -6.311 1.00 0.00 O ATOM 497 OE2 GLU A 31 -20.388 7.681 -5.073 1.00 0.00 O ATOM 0 H GLU A 31 -19.321 5.676 -2.408 1.00 0.00 H new ATOM 0 HA GLU A 31 -18.565 5.042 -5.079 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -16.914 6.316 -2.877 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -16.605 6.388 -4.600 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -18.936 7.624 -3.085 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -17.672 8.463 -3.962 1.00 0.00 H new ATOM 504 N LEU A 32 -17.109 3.367 -2.632 1.00 0.00 N ATOM 505 CA LEU A 32 -16.347 2.155 -2.356 1.00 0.00 C ATOM 506 C LEU A 32 -17.023 0.959 -3.034 1.00 0.00 C ATOM 507 O LEU A 32 -16.374 0.190 -3.742 1.00 0.00 O ATOM 508 CB LEU A 32 -16.203 1.997 -0.835 1.00 0.00 C ATOM 509 CG LEU A 32 -15.314 0.843 -0.330 1.00 0.00 C ATOM 510 CD1 LEU A 32 -16.067 -0.490 -0.254 1.00 0.00 C ATOM 511 CD2 LEU A 32 -14.008 0.699 -1.118 1.00 0.00 C ATOM 0 H LEU A 32 -17.455 3.838 -1.796 1.00 0.00 H new ATOM 0 HA LEU A 32 -15.341 2.215 -2.771 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -15.807 2.930 -0.434 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -17.199 1.866 -0.413 1.00 0.00 H new ATOM 0 HG LEU A 32 -15.037 1.119 0.687 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.394 -1.268 0.107 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.910 -0.393 0.430 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -16.433 -0.758 -1.245 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -13.428 -0.130 -0.713 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -14.235 0.505 -2.166 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.430 1.620 -1.036 1.00 0.00 H new ATOM 523 N LYS A 33 -18.342 0.838 -2.867 1.00 0.00 N ATOM 524 CA LYS A 33 -19.141 -0.193 -3.509 1.00 0.00 C ATOM 525 C LYS A 33 -18.921 -0.145 -5.017 1.00 0.00 C ATOM 526 O LYS A 33 -18.558 -1.149 -5.635 1.00 0.00 O ATOM 527 CB LYS A 33 -20.613 0.081 -3.165 1.00 0.00 C ATOM 528 CG LYS A 33 -21.653 -0.696 -3.990 1.00 0.00 C ATOM 529 CD LYS A 33 -23.051 -0.276 -3.517 1.00 0.00 C ATOM 530 CE LYS A 33 -24.163 -0.854 -4.397 1.00 0.00 C ATOM 531 NZ LYS A 33 -24.316 -2.306 -4.212 1.00 0.00 N ATOM 0 H LYS A 33 -18.886 1.464 -2.274 1.00 0.00 H new ATOM 0 HA LYS A 33 -18.856 -1.185 -3.160 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -20.768 -0.150 -2.111 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -20.802 1.147 -3.289 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -21.531 -0.484 -5.052 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -21.515 -1.770 -3.862 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -23.198 -0.605 -2.488 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -23.120 0.812 -3.517 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -25.105 -0.358 -4.163 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -23.943 -0.643 -5.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -25.143 -2.639 -4.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -23.463 -2.792 -4.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -24.451 -2.515 -3.202 1.00 0.00 H new ATOM 545 N GLU A 34 -19.167 1.023 -5.609 1.00 0.00 N ATOM 546 CA GLU A 34 -19.105 1.186 -7.047 1.00 0.00 C ATOM 547 C GLU A 34 -17.701 0.838 -7.528 1.00 0.00 C ATOM 548 O GLU A 34 -17.555 0.035 -8.436 1.00 0.00 O ATOM 549 CB GLU A 34 -19.477 2.635 -7.398 1.00 0.00 C ATOM 550 CG GLU A 34 -19.269 2.973 -8.881 1.00 0.00 C ATOM 551 CD GLU A 34 -19.527 4.452 -9.154 1.00 0.00 C ATOM 552 OE1 GLU A 34 -20.662 4.898 -8.875 1.00 0.00 O ATOM 553 OE2 GLU A 34 -18.576 5.114 -9.624 1.00 0.00 O ATOM 0 H GLU A 34 -19.413 1.874 -5.102 1.00 0.00 H new ATOM 0 HA GLU A 34 -19.810 0.519 -7.544 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -20.521 2.809 -7.136 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -18.879 3.314 -6.790 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -18.250 2.719 -9.175 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -19.938 2.366 -9.492 1.00 0.00 H new ATOM 560 N LEU A 35 -16.678 1.432 -6.918 1.00 0.00 N ATOM 561 CA LEU A 35 -15.272 1.185 -7.198 1.00 0.00 C ATOM 562 C LEU A 35 -15.013 -0.319 -7.220 1.00 0.00 C ATOM 563 O LEU A 35 -14.507 -0.836 -8.213 1.00 0.00 O ATOM 564 CB LEU A 35 -14.459 1.932 -6.128 1.00 0.00 C ATOM 565 CG LEU A 35 -12.923 1.795 -6.107 1.00 0.00 C ATOM 566 CD1 LEU A 35 -12.420 0.392 -5.740 1.00 0.00 C ATOM 567 CD2 LEU A 35 -12.263 2.279 -7.401 1.00 0.00 C ATOM 0 H LEU A 35 -16.816 2.127 -6.185 1.00 0.00 H new ATOM 0 HA LEU A 35 -14.971 1.555 -8.178 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -14.691 2.993 -6.223 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -14.829 1.611 -5.154 1.00 0.00 H new ATOM 0 HG LEU A 35 -12.614 2.459 -5.299 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -11.330 0.382 -5.748 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -12.778 0.126 -4.745 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -12.795 -0.330 -6.465 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -11.182 2.157 -7.326 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -12.636 1.693 -8.241 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.500 3.331 -7.559 1.00 0.00 H new ATOM 579 N ILE A 36 -15.382 -1.042 -6.158 1.00 0.00 N ATOM 580 CA ILE A 36 -15.146 -2.479 -6.115 1.00 0.00 C ATOM 581 C ILE A 36 -15.850 -3.172 -7.288 1.00 0.00 C ATOM 582 O ILE A 36 -15.196 -3.849 -8.080 1.00 0.00 O ATOM 583 CB ILE A 36 -15.503 -3.054 -4.729 1.00 0.00 C ATOM 584 CG1 ILE A 36 -14.437 -2.585 -3.717 1.00 0.00 C ATOM 585 CG2 ILE A 36 -15.571 -4.586 -4.774 1.00 0.00 C ATOM 586 CD1 ILE A 36 -14.648 -3.105 -2.291 1.00 0.00 C ATOM 0 H ILE A 36 -15.838 -0.658 -5.330 1.00 0.00 H new ATOM 0 HA ILE A 36 -14.083 -2.681 -6.245 1.00 0.00 H new ATOM 0 HB ILE A 36 -16.486 -2.694 -4.425 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -13.456 -2.906 -4.066 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -14.428 -1.495 -3.696 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -15.824 -4.968 -3.785 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -16.333 -4.896 -5.489 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -14.604 -4.984 -5.080 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -13.855 -2.728 -1.645 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -15.613 -2.763 -1.918 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -14.626 -4.195 -2.294 1.00 0.00 H new ATOM 598 N ASN A 37 -17.165 -2.976 -7.426 1.00 0.00 N ATOM 599 CA ASN A 37 -17.954 -3.587 -8.498 1.00 0.00 C ATOM 600 C ASN A 37 -17.347 -3.320 -9.878 1.00 0.00 C ATOM 601 O ASN A 37 -17.212 -4.217 -10.706 1.00 0.00 O ATOM 602 CB ASN A 37 -19.381 -3.017 -8.502 1.00 0.00 C ATOM 603 CG ASN A 37 -20.300 -3.691 -7.496 1.00 0.00 C ATOM 604 OD1 ASN A 37 -21.009 -4.630 -7.837 1.00 0.00 O ATOM 605 ND2 ASN A 37 -20.315 -3.229 -6.253 1.00 0.00 N ATOM 0 H ASN A 37 -17.712 -2.389 -6.797 1.00 0.00 H new ATOM 0 HA ASN A 37 -17.961 -4.660 -8.306 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -19.339 -1.949 -8.287 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -19.805 -3.125 -9.500 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -20.926 -3.657 -5.557 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -19.716 -2.446 -5.993 1.00 0.00 H new ATOM 612 N ASN A 38 -17.045 -2.050 -10.123 1.00 0.00 N ATOM 613 CA ASN A 38 -16.667 -1.471 -11.399 1.00 0.00 C ATOM 614 C ASN A 38 -15.230 -1.792 -11.795 1.00 0.00 C ATOM 615 O ASN A 38 -14.960 -1.998 -12.974 1.00 0.00 O ATOM 616 CB ASN A 38 -16.872 0.046 -11.290 1.00 0.00 C ATOM 617 CG ASN A 38 -16.666 0.777 -12.605 1.00 0.00 C ATOM 618 OD1 ASN A 38 -15.736 1.564 -12.743 1.00 0.00 O ATOM 619 ND2 ASN A 38 -17.575 0.575 -13.553 1.00 0.00 N ATOM 0 H ASN A 38 -17.060 -1.352 -9.380 1.00 0.00 H new ATOM 0 HA ASN A 38 -17.290 -1.901 -12.183 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -17.880 0.244 -10.927 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -16.181 0.446 -10.548 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -17.514 1.084 -14.435 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -18.334 -0.089 -13.399 1.00 0.00 H new ATOM 626 N GLU A 39 -14.307 -1.771 -10.828 1.00 0.00 N ATOM 627 CA GLU A 39 -12.873 -1.849 -11.074 1.00 0.00 C ATOM 628 C GLU A 39 -12.237 -3.115 -10.493 1.00 0.00 C ATOM 629 O GLU A 39 -11.302 -3.634 -11.096 1.00 0.00 O ATOM 630 CB GLU A 39 -12.181 -0.603 -10.509 1.00 0.00 C ATOM 631 CG GLU A 39 -12.546 0.695 -11.245 1.00 0.00 C ATOM 632 CD GLU A 39 -11.930 0.768 -12.640 1.00 0.00 C ATOM 633 OE1 GLU A 39 -10.727 0.435 -12.744 1.00 0.00 O ATOM 634 OE2 GLU A 39 -12.659 1.153 -13.577 1.00 0.00 O ATOM 0 H GLU A 39 -14.544 -1.698 -9.839 1.00 0.00 H new ATOM 0 HA GLU A 39 -12.735 -1.896 -12.154 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -12.443 -0.499 -9.456 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -11.101 -0.745 -10.556 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -13.630 0.771 -11.326 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -12.210 1.549 -10.657 1.00 0.00 H new ATOM 641 N LEU A 40 -12.688 -3.615 -9.334 1.00 0.00 N ATOM 642 CA LEU A 40 -12.080 -4.788 -8.691 1.00 0.00 C ATOM 643 C LEU A 40 -12.721 -6.091 -9.202 1.00 0.00 C ATOM 644 O LEU A 40 -12.470 -7.160 -8.650 1.00 0.00 O ATOM 645 CB LEU A 40 -12.181 -4.638 -7.158 1.00 0.00 C ATOM 646 CG LEU A 40 -11.265 -5.505 -6.277 1.00 0.00 C ATOM 647 CD1 LEU A 40 -9.771 -5.281 -6.538 1.00 0.00 C ATOM 648 CD2 LEU A 40 -11.513 -5.133 -4.809 1.00 0.00 C ATOM 0 H LEU A 40 -13.477 -3.222 -8.820 1.00 0.00 H new ATOM 0 HA LEU A 40 -11.024 -4.846 -8.955 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -11.986 -3.594 -6.913 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -13.212 -4.846 -6.871 1.00 0.00 H new ATOM 0 HG LEU A 40 -11.502 -6.543 -6.510 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -9.186 -5.925 -5.881 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -9.543 -5.519 -7.577 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -9.520 -4.239 -6.341 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -10.872 -5.738 -4.167 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -11.286 -4.078 -4.658 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -12.557 -5.319 -4.558 1.00 0.00 H new ATOM 660 N SER A 41 -13.515 -6.007 -10.275 1.00 0.00 N ATOM 661 CA SER A 41 -14.390 -7.029 -10.831 1.00 0.00 C ATOM 662 C SER A 41 -13.767 -8.420 -10.997 1.00 0.00 C ATOM 663 O SER A 41 -14.468 -9.424 -10.896 1.00 0.00 O ATOM 664 CB SER A 41 -14.865 -6.500 -12.188 1.00 0.00 C ATOM 665 OG SER A 41 -15.022 -5.092 -12.119 1.00 0.00 O ATOM 0 H SER A 41 -13.561 -5.145 -10.819 1.00 0.00 H new ATOM 0 HA SER A 41 -15.200 -7.192 -10.120 1.00 0.00 H new ATOM 0 HB2 SER A 41 -14.144 -6.758 -12.963 1.00 0.00 H new ATOM 0 HB3 SER A 41 -15.810 -6.969 -12.462 1.00 0.00 H new ATOM 0 HG SER A 41 -15.737 -4.873 -11.485 1.00 0.00 H new ATOM 671 N HIS A 42 -12.474 -8.491 -11.324 1.00 0.00 N ATOM 672 CA HIS A 42 -11.785 -9.762 -11.521 1.00 0.00 C ATOM 673 C HIS A 42 -11.359 -10.342 -10.169 1.00 0.00 C ATOM 674 O HIS A 42 -11.294 -11.560 -10.013 1.00 0.00 O ATOM 675 CB HIS A 42 -10.592 -9.558 -12.470 1.00 0.00 C ATOM 676 CG HIS A 42 -9.911 -10.822 -12.946 1.00 0.00 C ATOM 677 ND1 HIS A 42 -9.867 -12.036 -12.296 1.00 0.00 N ATOM 678 CD2 HIS A 42 -9.153 -10.941 -14.081 1.00 0.00 C ATOM 679 CE1 HIS A 42 -9.104 -12.865 -13.028 1.00 0.00 C ATOM 680 NE2 HIS A 42 -8.646 -12.243 -14.126 1.00 0.00 N ATOM 0 H HIS A 42 -11.881 -7.672 -11.458 1.00 0.00 H new ATOM 0 HA HIS A 42 -12.457 -10.484 -11.984 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -10.936 -9.002 -13.342 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -9.852 -8.936 -11.966 1.00 0.00 H new ATOM 0 HD1 HIS A 42 -10.331 -12.264 -11.417 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -8.978 -10.166 -14.812 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -8.889 -13.891 -12.769 1.00 0.00 H new ATOM 688 N PHE A 43 -11.026 -9.482 -9.204 1.00 0.00 N ATOM 689 CA PHE A 43 -10.493 -9.898 -7.914 1.00 0.00 C ATOM 690 C PHE A 43 -11.640 -10.219 -6.955 1.00 0.00 C ATOM 691 O PHE A 43 -11.577 -11.221 -6.245 1.00 0.00 O ATOM 692 CB PHE A 43 -9.579 -8.811 -7.336 1.00 0.00 C ATOM 693 CG PHE A 43 -8.160 -8.771 -7.881 1.00 0.00 C ATOM 694 CD1 PHE A 43 -7.923 -8.612 -9.260 1.00 0.00 C ATOM 695 CD2 PHE A 43 -7.067 -8.791 -6.993 1.00 0.00 C ATOM 696 CE1 PHE A 43 -6.612 -8.473 -9.745 1.00 0.00 C ATOM 697 CE2 PHE A 43 -5.760 -8.599 -7.471 1.00 0.00 C ATOM 698 CZ PHE A 43 -5.531 -8.443 -8.849 1.00 0.00 C ATOM 0 H PHE A 43 -11.121 -8.471 -9.301 1.00 0.00 H new ATOM 0 HA PHE A 43 -9.896 -10.800 -8.050 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -10.043 -7.841 -7.516 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -9.528 -8.945 -6.255 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -8.754 -8.597 -9.949 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -7.235 -8.955 -5.939 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -6.435 -8.389 -10.807 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -4.931 -8.571 -6.779 1.00 0.00 H new ATOM 0 HZ PHE A 43 -4.526 -8.300 -9.218 1.00 0.00 H new ATOM 708 N LEU A 44 -12.665 -9.366 -6.903 1.00 0.00 N ATOM 709 CA LEU A 44 -13.901 -9.622 -6.179 1.00 0.00 C ATOM 710 C LEU A 44 -15.032 -9.648 -7.194 1.00 0.00 C ATOM 711 O LEU A 44 -15.065 -8.816 -8.097 1.00 0.00 O ATOM 712 CB LEU A 44 -14.184 -8.534 -5.133 1.00 0.00 C ATOM 713 CG LEU A 44 -13.554 -8.865 -3.775 1.00 0.00 C ATOM 714 CD1 LEU A 44 -12.032 -8.685 -3.802 1.00 0.00 C ATOM 715 CD2 LEU A 44 -14.137 -7.949 -2.692 1.00 0.00 C ATOM 0 H LEU A 44 -12.654 -8.461 -7.374 1.00 0.00 H new ATOM 0 HA LEU A 44 -13.815 -10.571 -5.649 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -13.797 -7.579 -5.489 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -15.261 -8.417 -5.014 1.00 0.00 H new ATOM 0 HG LEU A 44 -13.780 -9.908 -3.554 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -11.619 -8.928 -2.823 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -11.601 -9.347 -4.552 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -11.792 -7.651 -4.050 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -13.685 -8.190 -1.730 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -13.926 -6.909 -2.942 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -15.215 -8.096 -2.633 1.00 0.00 H new ATOM 727 N GLU A 45 -15.968 -10.580 -7.015 1.00 0.00 N ATOM 728 CA GLU A 45 -17.190 -10.575 -7.808 1.00 0.00 C ATOM 729 C GLU A 45 -18.091 -9.425 -7.341 1.00 0.00 C ATOM 730 O GLU A 45 -17.865 -8.859 -6.271 1.00 0.00 O ATOM 731 CB GLU A 45 -17.879 -11.948 -7.780 1.00 0.00 C ATOM 732 CG GLU A 45 -18.183 -12.462 -6.369 1.00 0.00 C ATOM 733 CD GLU A 45 -19.012 -13.740 -6.418 1.00 0.00 C ATOM 734 OE1 GLU A 45 -18.386 -14.820 -6.502 1.00 0.00 O ATOM 735 OE2 GLU A 45 -20.255 -13.613 -6.392 1.00 0.00 O ATOM 0 H GLU A 45 -15.903 -11.338 -6.336 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.952 -10.397 -8.857 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -18.811 -11.887 -8.342 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.245 -12.672 -8.291 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -17.250 -12.650 -5.838 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -18.720 -11.697 -5.808 1.00 0.00 H new ATOM 742 N GLU A 46 -19.088 -9.067 -8.158 1.00 0.00 N ATOM 743 CA GLU A 46 -19.950 -7.920 -7.932 1.00 0.00 C ATOM 744 C GLU A 46 -20.615 -7.963 -6.556 1.00 0.00 C ATOM 745 O GLU A 46 -20.860 -9.031 -5.997 1.00 0.00 O ATOM 746 CB GLU A 46 -20.953 -7.776 -9.083 1.00 0.00 C ATOM 747 CG GLU A 46 -22.051 -8.827 -8.967 1.00 0.00 C ATOM 748 CD GLU A 46 -23.038 -8.751 -10.125 1.00 0.00 C ATOM 749 OE1 GLU A 46 -22.646 -9.189 -11.229 1.00 0.00 O ATOM 750 OE2 GLU A 46 -24.159 -8.251 -9.887 1.00 0.00 O ATOM 0 H GLU A 46 -19.316 -9.582 -9.009 1.00 0.00 H new ATOM 0 HA GLU A 46 -19.334 -7.021 -7.924 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -21.393 -6.779 -9.068 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -20.438 -7.883 -10.038 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -21.601 -9.820 -8.938 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -22.585 -8.692 -8.026 1.00 0.00 H new ATOM 757 N ILE A 47 -20.910 -6.774 -6.037 1.00 0.00 N ATOM 758 CA ILE A 47 -21.386 -6.544 -4.683 1.00 0.00 C ATOM 759 C ILE A 47 -22.633 -5.674 -4.717 1.00 0.00 C ATOM 760 O ILE A 47 -22.535 -4.445 -4.737 1.00 0.00 O ATOM 761 CB ILE A 47 -20.296 -5.923 -3.783 1.00 0.00 C ATOM 762 CG1 ILE A 47 -18.937 -6.550 -4.110 1.00 0.00 C ATOM 763 CG2 ILE A 47 -20.704 -6.138 -2.317 1.00 0.00 C ATOM 764 CD1 ILE A 47 -17.891 -6.401 -3.009 1.00 0.00 C ATOM 0 H ILE A 47 -20.819 -5.911 -6.574 1.00 0.00 H new ATOM 0 HA ILE A 47 -21.639 -7.509 -4.244 1.00 0.00 H new ATOM 0 HB ILE A 47 -20.201 -4.852 -3.960 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -19.080 -7.611 -4.316 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -18.552 -6.097 -5.023 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -19.947 -5.707 -1.662 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -21.663 -5.654 -2.132 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -20.791 -7.206 -2.117 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -16.961 -6.873 -3.325 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -17.714 -5.343 -2.816 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -18.250 -6.880 -2.098 1.00 0.00 H new ATOM 776 N LYS A 48 -23.795 -6.330 -4.705 1.00 0.00 N ATOM 777 CA LYS A 48 -25.085 -5.687 -4.507 1.00 0.00 C ATOM 778 C LYS A 48 -25.262 -5.320 -3.025 1.00 0.00 C ATOM 779 O LYS A 48 -25.947 -4.357 -2.686 1.00 0.00 O ATOM 780 CB LYS A 48 -26.210 -6.600 -5.021 1.00 0.00 C ATOM 781 CG LYS A 48 -26.322 -7.950 -4.295 1.00 0.00 C ATOM 782 CD LYS A 48 -27.415 -8.802 -4.950 1.00 0.00 C ATOM 783 CE LYS A 48 -27.533 -10.156 -4.243 1.00 0.00 C ATOM 784 NZ LYS A 48 -28.574 -10.994 -4.861 1.00 0.00 N ATOM 0 H LYS A 48 -23.862 -7.339 -4.835 1.00 0.00 H new ATOM 0 HA LYS A 48 -25.131 -4.761 -5.081 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -27.159 -6.072 -4.927 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -26.052 -6.786 -6.083 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -25.367 -8.474 -4.333 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -26.555 -7.789 -3.242 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -28.369 -8.277 -4.906 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -27.183 -8.954 -6.004 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -26.575 -10.674 -4.283 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -27.767 -10.000 -3.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -28.630 -11.904 -4.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -29.492 -10.509 -4.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -28.337 -11.162 -5.859 1.00 0.00 H new ATOM 798 N GLU A 49 -24.645 -6.105 -2.134 1.00 0.00 N ATOM 799 CA GLU A 49 -24.821 -6.001 -0.696 1.00 0.00 C ATOM 800 C GLU A 49 -24.251 -4.695 -0.130 1.00 0.00 C ATOM 801 O GLU A 49 -23.141 -4.672 0.406 1.00 0.00 O ATOM 802 CB GLU A 49 -24.194 -7.230 -0.017 1.00 0.00 C ATOM 803 CG GLU A 49 -24.901 -8.545 -0.381 1.00 0.00 C ATOM 804 CD GLU A 49 -26.373 -8.550 0.026 1.00 0.00 C ATOM 805 OE1 GLU A 49 -26.654 -8.102 1.159 1.00 0.00 O ATOM 806 OE2 GLU A 49 -27.191 -8.989 -0.811 1.00 0.00 O ATOM 0 H GLU A 49 -23.997 -6.844 -2.407 1.00 0.00 H new ATOM 0 HA GLU A 49 -25.890 -5.978 -0.483 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -23.144 -7.298 -0.301 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -24.224 -7.095 1.064 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -24.824 -8.710 -1.456 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -24.390 -9.375 0.106 1.00 0.00 H new ATOM 813 N GLN A 50 -25.059 -3.629 -0.159 1.00 0.00 N ATOM 814 CA GLN A 50 -24.770 -2.368 0.524 1.00 0.00 C ATOM 815 C GLN A 50 -24.398 -2.566 2.002 1.00 0.00 C ATOM 816 O GLN A 50 -23.717 -1.717 2.575 1.00 0.00 O ATOM 817 CB GLN A 50 -25.942 -1.378 0.405 1.00 0.00 C ATOM 818 CG GLN A 50 -25.686 -0.286 -0.645 1.00 0.00 C ATOM 819 CD GLN A 50 -24.571 0.715 -0.310 1.00 0.00 C ATOM 820 OE1 GLN A 50 -24.296 1.607 -1.106 1.00 0.00 O ATOM 821 NE2 GLN A 50 -23.893 0.603 0.832 1.00 0.00 N ATOM 0 H GLN A 50 -25.944 -3.621 -0.666 1.00 0.00 H new ATOM 0 HA GLN A 50 -23.901 -1.947 0.018 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -26.849 -1.923 0.144 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -26.119 -0.911 1.374 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -25.443 -0.769 -1.592 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -26.612 0.268 -0.798 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -24.124 -0.140 1.492 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -23.143 1.260 1.046 1.00 0.00 H new ATOM 830 N GLU A 51 -24.852 -3.662 2.614 1.00 0.00 N ATOM 831 CA GLU A 51 -24.448 -4.059 3.953 1.00 0.00 C ATOM 832 C GLU A 51 -22.947 -4.374 3.986 1.00 0.00 C ATOM 833 O GLU A 51 -22.221 -3.935 4.875 1.00 0.00 O ATOM 834 CB GLU A 51 -25.251 -5.299 4.375 1.00 0.00 C ATOM 835 CG GLU A 51 -26.770 -5.059 4.384 1.00 0.00 C ATOM 836 CD GLU A 51 -27.562 -6.314 4.753 1.00 0.00 C ATOM 837 OE1 GLU A 51 -26.920 -7.316 5.139 1.00 0.00 O ATOM 838 OE2 GLU A 51 -28.804 -6.252 4.636 1.00 0.00 O ATOM 0 H GLU A 51 -25.519 -4.303 2.183 1.00 0.00 H new ATOM 0 HA GLU A 51 -24.645 -3.240 4.645 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -25.023 -6.121 3.696 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -24.932 -5.610 5.370 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -27.004 -4.265 5.093 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -27.085 -4.711 3.400 1.00 0.00 H new ATOM 845 N VAL A 52 -22.478 -5.174 3.028 1.00 0.00 N ATOM 846 CA VAL A 52 -21.131 -5.717 3.062 1.00 0.00 C ATOM 847 C VAL A 52 -20.115 -4.647 2.695 1.00 0.00 C ATOM 848 O VAL A 52 -19.076 -4.558 3.341 1.00 0.00 O ATOM 849 CB VAL A 52 -21.018 -6.956 2.166 1.00 0.00 C ATOM 850 CG1 VAL A 52 -19.547 -7.339 1.964 1.00 0.00 C ATOM 851 CG2 VAL A 52 -21.793 -8.103 2.830 1.00 0.00 C ATOM 0 H VAL A 52 -23.022 -5.459 2.214 1.00 0.00 H new ATOM 0 HA VAL A 52 -20.909 -6.040 4.079 1.00 0.00 H new ATOM 0 HB VAL A 52 -21.441 -6.746 1.183 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -19.485 -8.220 1.326 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -19.017 -6.511 1.493 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -19.092 -7.558 2.930 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -21.726 -8.996 2.208 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -21.366 -8.311 3.811 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -22.839 -7.818 2.943 1.00 0.00 H new ATOM 861 N VAL A 53 -20.390 -3.832 1.675 1.00 0.00 N ATOM 862 CA VAL A 53 -19.498 -2.734 1.342 1.00 0.00 C ATOM 863 C VAL A 53 -19.295 -1.863 2.588 1.00 0.00 C ATOM 864 O VAL A 53 -18.164 -1.543 2.954 1.00 0.00 O ATOM 865 CB VAL A 53 -20.023 -1.969 0.121 1.00 0.00 C ATOM 866 CG1 VAL A 53 -20.242 -2.936 -1.049 1.00 0.00 C ATOM 867 CG2 VAL A 53 -21.307 -1.205 0.437 1.00 0.00 C ATOM 0 H VAL A 53 -21.212 -3.914 1.077 1.00 0.00 H new ATOM 0 HA VAL A 53 -18.516 -3.105 1.049 1.00 0.00 H new ATOM 0 HB VAL A 53 -19.271 -1.232 -0.161 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -20.615 -2.384 -1.912 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -19.298 -3.416 -1.306 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -20.969 -3.696 -0.762 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -21.645 -0.677 -0.455 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -22.078 -1.906 0.758 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -21.116 -0.486 1.234 1.00 0.00 H new ATOM 877 N ASP A 54 -20.397 -1.560 3.288 1.00 0.00 N ATOM 878 CA ASP A 54 -20.348 -0.845 4.549 1.00 0.00 C ATOM 879 C ASP A 54 -19.520 -1.616 5.579 1.00 0.00 C ATOM 880 O ASP A 54 -18.712 -1.007 6.263 1.00 0.00 O ATOM 881 CB ASP A 54 -21.756 -0.549 5.072 1.00 0.00 C ATOM 882 CG ASP A 54 -21.681 0.283 6.348 1.00 0.00 C ATOM 883 OD1 ASP A 54 -21.471 1.508 6.213 1.00 0.00 O ATOM 884 OD2 ASP A 54 -21.822 -0.323 7.431 1.00 0.00 O ATOM 0 H ASP A 54 -21.340 -1.807 2.988 1.00 0.00 H new ATOM 0 HA ASP A 54 -19.857 0.112 4.376 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -22.328 -0.014 4.314 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -22.282 -1.483 5.269 1.00 0.00 H new ATOM 889 N LYS A 55 -19.697 -2.935 5.704 1.00 0.00 N ATOM 890 CA LYS A 55 -18.942 -3.738 6.663 1.00 0.00 C ATOM 891 C LYS A 55 -17.431 -3.691 6.393 1.00 0.00 C ATOM 892 O LYS A 55 -16.642 -3.434 7.306 1.00 0.00 O ATOM 893 CB LYS A 55 -19.455 -5.188 6.631 1.00 0.00 C ATOM 894 CG LYS A 55 -18.680 -6.169 7.523 1.00 0.00 C ATOM 895 CD LYS A 55 -18.773 -5.801 9.006 1.00 0.00 C ATOM 896 CE LYS A 55 -17.956 -6.766 9.876 1.00 0.00 C ATOM 897 NZ LYS A 55 -18.453 -8.153 9.795 1.00 0.00 N ATOM 0 H LYS A 55 -20.363 -3.470 5.147 1.00 0.00 H new ATOM 0 HA LYS A 55 -19.098 -3.316 7.656 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -20.502 -5.194 6.934 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -19.418 -5.548 5.603 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -19.069 -7.176 7.376 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -17.633 -6.184 7.219 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -18.413 -4.783 9.153 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -19.816 -5.819 9.322 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -16.912 -6.738 9.563 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -17.987 -6.431 10.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -17.985 -8.732 10.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -19.481 -8.163 9.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -18.244 -8.542 8.853 1.00 0.00 H new ATOM 911 N VAL A 56 -17.006 -3.957 5.154 1.00 0.00 N ATOM 912 CA VAL A 56 -15.583 -4.023 4.829 1.00 0.00 C ATOM 913 C VAL A 56 -14.956 -2.632 4.955 1.00 0.00 C ATOM 914 O VAL A 56 -13.803 -2.498 5.355 1.00 0.00 O ATOM 915 CB VAL A 56 -15.313 -4.692 3.465 1.00 0.00 C ATOM 916 CG1 VAL A 56 -15.941 -6.093 3.386 1.00 0.00 C ATOM 917 CG2 VAL A 56 -15.782 -3.851 2.276 1.00 0.00 C ATOM 0 H VAL A 56 -17.627 -4.129 4.364 1.00 0.00 H new ATOM 0 HA VAL A 56 -15.095 -4.674 5.554 1.00 0.00 H new ATOM 0 HB VAL A 56 -14.229 -4.780 3.397 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -15.730 -6.532 2.411 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -15.520 -6.725 4.168 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -17.020 -6.016 3.523 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -15.562 -4.379 1.348 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -16.856 -3.681 2.352 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -15.262 -2.893 2.280 1.00 0.00 H new ATOM 927 N MET A 57 -15.729 -1.585 4.661 1.00 0.00 N ATOM 928 CA MET A 57 -15.312 -0.225 4.942 1.00 0.00 C ATOM 929 C MET A 57 -15.193 -0.002 6.451 1.00 0.00 C ATOM 930 O MET A 57 -14.141 0.408 6.927 1.00 0.00 O ATOM 931 CB MET A 57 -16.323 0.703 4.273 1.00 0.00 C ATOM 932 CG MET A 57 -16.386 2.122 4.827 1.00 0.00 C ATOM 933 SD MET A 57 -17.469 3.196 3.869 1.00 0.00 S ATOM 934 CE MET A 57 -16.584 3.178 2.302 1.00 0.00 C ATOM 0 H MET A 57 -16.649 -1.662 4.227 1.00 0.00 H new ATOM 0 HA MET A 57 -14.321 -0.015 4.539 1.00 0.00 H new ATOM 0 HB2 MET A 57 -16.090 0.758 3.210 1.00 0.00 H new ATOM 0 HB3 MET A 57 -17.313 0.255 4.360 1.00 0.00 H new ATOM 0 HG2 MET A 57 -16.734 2.089 5.859 1.00 0.00 H new ATOM 0 HG3 MET A 57 -15.382 2.546 4.843 1.00 0.00 H new ATOM 0 HE1 MET A 57 -16.844 4.067 1.727 1.00 0.00 H new ATOM 0 HE2 MET A 57 -15.510 3.169 2.491 1.00 0.00 H new ATOM 0 HE3 MET A 57 -16.861 2.287 1.738 1.00 0.00 H new ATOM 944 N GLU A 58 -16.247 -0.310 7.207 1.00 0.00 N ATOM 945 CA GLU A 58 -16.350 -0.114 8.650 1.00 0.00 C ATOM 946 C GLU A 58 -15.162 -0.761 9.355 1.00 0.00 C ATOM 947 O GLU A 58 -14.582 -0.184 10.270 1.00 0.00 O ATOM 948 CB GLU A 58 -17.679 -0.699 9.147 1.00 0.00 C ATOM 949 CG GLU A 58 -17.813 -0.621 10.670 1.00 0.00 C ATOM 950 CD GLU A 58 -19.200 -1.066 11.121 1.00 0.00 C ATOM 951 OE1 GLU A 58 -19.467 -2.282 11.000 1.00 0.00 O ATOM 952 OE2 GLU A 58 -19.964 -0.187 11.573 1.00 0.00 O ATOM 0 H GLU A 58 -17.091 -0.722 6.809 1.00 0.00 H new ATOM 0 HA GLU A 58 -16.331 0.951 8.880 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -18.506 -0.162 8.683 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -17.757 -1.739 8.830 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -17.056 -1.250 11.138 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -17.629 0.401 11.003 1.00 0.00 H new ATOM 959 N THR A 59 -14.772 -1.934 8.863 1.00 0.00 N ATOM 960 CA THR A 59 -13.634 -2.696 9.349 1.00 0.00 C ATOM 961 C THR A 59 -12.365 -1.829 9.347 1.00 0.00 C ATOM 962 O THR A 59 -11.555 -1.946 10.262 1.00 0.00 O ATOM 963 CB THR A 59 -13.496 -3.934 8.442 1.00 0.00 C ATOM 964 OG1 THR A 59 -14.612 -4.781 8.634 1.00 0.00 O ATOM 965 CG2 THR A 59 -12.207 -4.742 8.609 1.00 0.00 C ATOM 0 H THR A 59 -15.257 -2.391 8.091 1.00 0.00 H new ATOM 0 HA THR A 59 -13.782 -3.014 10.381 1.00 0.00 H new ATOM 0 HB THR A 59 -13.452 -3.540 7.427 1.00 0.00 H new ATOM 0 HG1 THR A 59 -15.398 -4.390 8.198 1.00 0.00 H new ATOM 0 HG21 THR A 59 -12.217 -5.589 7.923 1.00 0.00 H new ATOM 0 HG22 THR A 59 -11.349 -4.107 8.390 1.00 0.00 H new ATOM 0 HG23 THR A 59 -12.136 -5.106 9.634 1.00 0.00 H new ATOM 973 N LEU A 60 -12.178 -0.979 8.329 1.00 0.00 N ATOM 974 CA LEU A 60 -11.012 -0.107 8.198 1.00 0.00 C ATOM 975 C LEU A 60 -11.300 1.362 8.532 1.00 0.00 C ATOM 976 O LEU A 60 -10.370 2.152 8.657 1.00 0.00 O ATOM 977 CB LEU A 60 -10.445 -0.231 6.778 1.00 0.00 C ATOM 978 CG LEU A 60 -10.181 -1.679 6.342 1.00 0.00 C ATOM 979 CD1 LEU A 60 -9.588 -1.676 4.931 1.00 0.00 C ATOM 980 CD2 LEU A 60 -9.214 -2.377 7.303 1.00 0.00 C ATOM 0 H LEU A 60 -12.845 -0.879 7.564 1.00 0.00 H new ATOM 0 HA LEU A 60 -10.280 -0.441 8.933 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -11.142 0.229 6.077 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -9.514 0.332 6.718 1.00 0.00 H new ATOM 0 HG LEU A 60 -11.125 -2.224 6.354 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -9.398 -2.701 4.614 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -10.291 -1.208 4.242 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -8.653 -1.117 4.931 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -9.045 -3.401 6.970 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -8.266 -1.840 7.319 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -9.642 -2.388 8.306 1.00 0.00 H new ATOM 992 N ASP A 61 -12.570 1.758 8.627 1.00 0.00 N ATOM 993 CA ASP A 61 -12.987 3.155 8.715 1.00 0.00 C ATOM 994 C ASP A 61 -12.579 3.836 10.028 1.00 0.00 C ATOM 995 O ASP A 61 -13.422 4.121 10.877 1.00 0.00 O ATOM 996 CB ASP A 61 -14.500 3.279 8.467 1.00 0.00 C ATOM 997 CG ASP A 61 -14.978 4.732 8.431 1.00 0.00 C ATOM 998 OD1 ASP A 61 -14.103 5.627 8.473 1.00 0.00 O ATOM 999 OD2 ASP A 61 -16.214 4.929 8.386 1.00 0.00 O ATOM 0 H ASP A 61 -13.351 1.103 8.645 1.00 0.00 H new ATOM 0 HA ASP A 61 -12.452 3.690 7.930 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -14.749 2.796 7.522 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -15.037 2.744 9.250 1.00 0.00 H new ATOM 1004 N SER A 62 -11.304 4.208 10.136 1.00 0.00 N ATOM 1005 CA SER A 62 -10.754 5.001 11.226 1.00 0.00 C ATOM 1006 C SER A 62 -11.553 6.281 11.507 1.00 0.00 C ATOM 1007 O SER A 62 -11.605 6.728 12.649 1.00 0.00 O ATOM 1008 CB SER A 62 -9.301 5.334 10.877 1.00 0.00 C ATOM 1009 OG SER A 62 -8.622 4.131 10.570 1.00 0.00 O ATOM 0 H SER A 62 -10.603 3.954 9.440 1.00 0.00 H new ATOM 0 HA SER A 62 -10.813 4.415 12.143 1.00 0.00 H new ATOM 0 HB2 SER A 62 -9.263 6.017 10.028 1.00 0.00 H new ATOM 0 HB3 SER A 62 -8.817 5.838 11.714 1.00 0.00 H new ATOM 0 HG SER A 62 -8.199 4.210 9.690 1.00 0.00 H new ATOM 1015 N ASP A 63 -12.146 6.895 10.475 1.00 0.00 N ATOM 1016 CA ASP A 63 -12.883 8.151 10.621 1.00 0.00 C ATOM 1017 C ASP A 63 -14.306 7.928 11.133 1.00 0.00 C ATOM 1018 O ASP A 63 -14.949 8.856 11.615 1.00 0.00 O ATOM 1019 CB ASP A 63 -12.986 8.791 9.234 1.00 0.00 C ATOM 1020 CG ASP A 63 -13.266 10.292 9.262 1.00 0.00 C ATOM 1021 OD1 ASP A 63 -12.666 10.980 10.117 1.00 0.00 O ATOM 1022 OD2 ASP A 63 -14.048 10.736 8.393 1.00 0.00 O ATOM 0 H ASP A 63 -12.127 6.535 9.521 1.00 0.00 H new ATOM 0 HA ASP A 63 -12.354 8.778 11.339 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -12.056 8.615 8.694 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -13.778 8.294 8.674 1.00 0.00 H new ATOM 1027 N GLY A 64 -14.789 6.692 11.010 1.00 0.00 N ATOM 1028 CA GLY A 64 -16.131 6.276 11.390 1.00 0.00 C ATOM 1029 C GLY A 64 -17.215 7.175 10.789 1.00 0.00 C ATOM 1030 O GLY A 64 -18.181 7.498 11.476 1.00 0.00 O ATOM 0 H GLY A 64 -14.232 5.927 10.628 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -16.295 5.248 11.066 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -16.217 6.285 12.477 1.00 0.00 H new ATOM 1034 N ASP A 65 -17.060 7.586 9.521 1.00 0.00 N ATOM 1035 CA ASP A 65 -17.960 8.530 8.857 1.00 0.00 C ATOM 1036 C ASP A 65 -18.630 7.892 7.632 1.00 0.00 C ATOM 1037 O ASP A 65 -19.196 8.585 6.790 1.00 0.00 O ATOM 1038 CB ASP A 65 -17.186 9.820 8.535 1.00 0.00 C ATOM 1039 CG ASP A 65 -18.077 10.930 7.984 1.00 0.00 C ATOM 1040 OD1 ASP A 65 -19.018 11.320 8.708 1.00 0.00 O ATOM 1041 OD2 ASP A 65 -17.793 11.376 6.850 1.00 0.00 O ATOM 0 H ASP A 65 -16.297 7.266 8.925 1.00 0.00 H new ATOM 0 HA ASP A 65 -18.780 8.797 9.523 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -16.691 10.175 9.439 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -16.404 9.596 7.810 1.00 0.00 H new ATOM 1046 N GLY A 66 -18.575 6.562 7.515 1.00 0.00 N ATOM 1047 CA GLY A 66 -19.224 5.836 6.431 1.00 0.00 C ATOM 1048 C GLY A 66 -18.531 6.065 5.085 1.00 0.00 C ATOM 1049 O GLY A 66 -19.158 6.025 4.020 1.00 0.00 O ATOM 0 H GLY A 66 -18.077 5.962 8.173 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -19.226 4.770 6.660 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -20.266 6.149 6.359 1.00 0.00 H new ATOM 1053 N GLU A 67 -17.218 6.269 5.158 1.00 0.00 N ATOM 1054 CA GLU A 67 -16.276 6.343 4.063 1.00 0.00 C ATOM 1055 C GLU A 67 -15.018 5.542 4.427 1.00 0.00 C ATOM 1056 O GLU A 67 -14.893 5.041 5.542 1.00 0.00 O ATOM 1057 CB GLU A 67 -15.942 7.817 3.765 1.00 0.00 C ATOM 1058 CG GLU A 67 -15.827 8.702 5.013 1.00 0.00 C ATOM 1059 CD GLU A 67 -14.919 8.106 6.080 1.00 0.00 C ATOM 1060 OE1 GLU A 67 -13.686 8.208 5.907 1.00 0.00 O ATOM 1061 OE2 GLU A 67 -15.492 7.528 7.029 1.00 0.00 O ATOM 0 H GLU A 67 -16.757 6.396 6.059 1.00 0.00 H new ATOM 0 HA GLU A 67 -16.710 5.911 3.161 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -15.002 7.861 3.215 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -16.713 8.227 3.112 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -15.445 9.681 4.724 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -16.820 8.858 5.434 1.00 0.00 H new ATOM 1068 N CYS A 68 -14.076 5.417 3.493 1.00 0.00 N ATOM 1069 CA CYS A 68 -12.746 4.889 3.778 1.00 0.00 C ATOM 1070 C CYS A 68 -11.724 5.839 3.166 1.00 0.00 C ATOM 1071 O CYS A 68 -11.857 6.237 2.006 1.00 0.00 O ATOM 1072 CB CYS A 68 -12.586 3.435 3.308 1.00 0.00 C ATOM 1073 SG CYS A 68 -12.519 2.367 4.766 1.00 0.00 S ATOM 0 H CYS A 68 -14.215 5.680 2.517 1.00 0.00 H new ATOM 0 HA CYS A 68 -12.583 4.842 4.855 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -13.420 3.150 2.667 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -11.677 3.326 2.716 1.00 0.00 H new ATOM 0 HG CYS A 68 -12.386 1.129 4.391 1.00 0.00 H new ATOM 1079 N ASP A 69 -10.749 6.252 3.983 1.00 0.00 N ATOM 1080 CA ASP A 69 -9.734 7.220 3.605 1.00 0.00 C ATOM 1081 C ASP A 69 -8.753 6.553 2.646 1.00 0.00 C ATOM 1082 O ASP A 69 -8.616 5.329 2.660 1.00 0.00 O ATOM 1083 CB ASP A 69 -9.029 7.753 4.862 1.00 0.00 C ATOM 1084 CG ASP A 69 -7.981 8.814 4.533 1.00 0.00 C ATOM 1085 OD1 ASP A 69 -6.830 8.409 4.255 1.00 0.00 O ATOM 1086 OD2 ASP A 69 -8.351 10.007 4.558 1.00 0.00 O ATOM 0 H ASP A 69 -10.648 5.913 4.940 1.00 0.00 H new ATOM 0 HA ASP A 69 -10.188 8.072 3.099 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -9.770 8.176 5.540 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -8.552 6.925 5.387 1.00 0.00 H new ATOM 1091 N PHE A 70 -8.047 7.348 1.844 1.00 0.00 N ATOM 1092 CA PHE A 70 -7.031 6.843 0.937 1.00 0.00 C ATOM 1093 C PHE A 70 -6.055 5.904 1.649 1.00 0.00 C ATOM 1094 O PHE A 70 -5.716 4.852 1.118 1.00 0.00 O ATOM 1095 CB PHE A 70 -6.307 8.002 0.249 1.00 0.00 C ATOM 1096 CG PHE A 70 -5.372 7.543 -0.850 1.00 0.00 C ATOM 1097 CD1 PHE A 70 -5.882 6.809 -1.934 1.00 0.00 C ATOM 1098 CD2 PHE A 70 -3.993 7.799 -0.775 1.00 0.00 C ATOM 1099 CE1 PHE A 70 -5.045 6.405 -2.984 1.00 0.00 C ATOM 1100 CE2 PHE A 70 -3.147 7.368 -1.811 1.00 0.00 C ATOM 1101 CZ PHE A 70 -3.673 6.681 -2.920 1.00 0.00 C ATOM 0 H PHE A 70 -8.167 8.360 1.808 1.00 0.00 H new ATOM 0 HA PHE A 70 -7.526 6.252 0.167 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -7.044 8.687 -0.170 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -5.739 8.561 0.992 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -6.931 6.553 -1.959 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -3.585 8.325 0.075 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -5.455 5.884 -3.837 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -2.087 7.565 -1.755 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.020 6.367 -3.721 1.00 0.00 H new ATOM 1111 N GLN A 71 -5.654 6.240 2.877 1.00 0.00 N ATOM 1112 CA GLN A 71 -4.857 5.360 3.721 1.00 0.00 C ATOM 1113 C GLN A 71 -5.507 3.976 3.859 1.00 0.00 C ATOM 1114 O GLN A 71 -4.861 2.951 3.641 1.00 0.00 O ATOM 1115 CB GLN A 71 -4.678 6.032 5.087 1.00 0.00 C ATOM 1116 CG GLN A 71 -3.869 5.167 6.060 1.00 0.00 C ATOM 1117 CD GLN A 71 -3.545 5.921 7.346 1.00 0.00 C ATOM 1118 OE1 GLN A 71 -4.186 6.912 7.679 1.00 0.00 O ATOM 1119 NE2 GLN A 71 -2.531 5.473 8.080 1.00 0.00 N ATOM 0 H GLN A 71 -5.876 7.135 3.312 1.00 0.00 H new ATOM 0 HA GLN A 71 -3.882 5.199 3.262 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -4.177 6.991 4.955 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -5.657 6.240 5.518 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -4.431 4.264 6.299 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -2.943 4.849 5.581 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -2.012 4.646 7.783 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -2.272 5.956 8.940 1.00 0.00 H new ATOM 1128 N GLU A 72 -6.787 3.939 4.239 1.00 0.00 N ATOM 1129 CA GLU A 72 -7.500 2.689 4.455 1.00 0.00 C ATOM 1130 C GLU A 72 -7.612 1.916 3.142 1.00 0.00 C ATOM 1131 O GLU A 72 -7.410 0.704 3.101 1.00 0.00 O ATOM 1132 CB GLU A 72 -8.886 2.959 5.059 1.00 0.00 C ATOM 1133 CG GLU A 72 -8.872 3.792 6.353 1.00 0.00 C ATOM 1134 CD GLU A 72 -7.890 3.301 7.417 1.00 0.00 C ATOM 1135 OE1 GLU A 72 -7.655 2.075 7.478 1.00 0.00 O ATOM 1136 OE2 GLU A 72 -7.380 4.176 8.152 1.00 0.00 O ATOM 0 H GLU A 72 -7.351 4.773 4.403 1.00 0.00 H new ATOM 0 HA GLU A 72 -6.940 2.079 5.164 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -9.496 3.475 4.318 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -9.371 2.004 5.263 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -8.629 4.824 6.102 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -9.876 3.795 6.778 1.00 0.00 H new ATOM 1143 N PHE A 73 -7.905 2.630 2.056 1.00 0.00 N ATOM 1144 CA PHE A 73 -7.884 2.065 0.716 1.00 0.00 C ATOM 1145 C PHE A 73 -6.528 1.413 0.424 1.00 0.00 C ATOM 1146 O PHE A 73 -6.489 0.248 0.038 1.00 0.00 O ATOM 1147 CB PHE A 73 -8.267 3.148 -0.293 1.00 0.00 C ATOM 1148 CG PHE A 73 -8.032 2.798 -1.748 1.00 0.00 C ATOM 1149 CD1 PHE A 73 -9.030 2.131 -2.482 1.00 0.00 C ATOM 1150 CD2 PHE A 73 -6.862 3.236 -2.397 1.00 0.00 C ATOM 1151 CE1 PHE A 73 -8.883 1.955 -3.868 1.00 0.00 C ATOM 1152 CE2 PHE A 73 -6.705 3.031 -3.779 1.00 0.00 C ATOM 1153 CZ PHE A 73 -7.726 2.411 -4.521 1.00 0.00 C ATOM 0 H PHE A 73 -8.163 3.616 2.085 1.00 0.00 H new ATOM 0 HA PHE A 73 -8.621 1.266 0.632 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -9.322 3.386 -0.161 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -7.705 4.052 -0.060 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -9.909 1.754 -1.980 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -6.085 3.730 -1.833 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -9.663 1.467 -4.434 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -5.799 3.350 -4.272 1.00 0.00 H new ATOM 0 HZ PHE A 73 -7.621 2.286 -5.589 1.00 0.00 H new ATOM 1163 N MET A 74 -5.414 2.118 0.647 1.00 0.00 N ATOM 1164 CA MET A 74 -4.087 1.549 0.446 1.00 0.00 C ATOM 1165 C MET A 74 -3.874 0.308 1.321 1.00 0.00 C ATOM 1166 O MET A 74 -3.337 -0.697 0.857 1.00 0.00 O ATOM 1167 CB MET A 74 -2.987 2.602 0.651 1.00 0.00 C ATOM 1168 CG MET A 74 -2.963 3.681 -0.446 1.00 0.00 C ATOM 1169 SD MET A 74 -2.839 3.132 -2.174 1.00 0.00 S ATOM 1170 CE MET A 74 -1.309 2.171 -2.125 1.00 0.00 C ATOM 0 H MET A 74 -5.410 3.086 0.968 1.00 0.00 H new ATOM 0 HA MET A 74 -4.019 1.221 -0.591 1.00 0.00 H new ATOM 0 HB2 MET A 74 -3.129 3.082 1.619 1.00 0.00 H new ATOM 0 HB3 MET A 74 -2.018 2.104 0.682 1.00 0.00 H new ATOM 0 HG2 MET A 74 -3.870 4.277 -0.349 1.00 0.00 H new ATOM 0 HG3 MET A 74 -2.122 4.345 -0.244 1.00 0.00 H new ATOM 0 HE1 MET A 74 -1.072 1.813 -3.127 1.00 0.00 H new ATOM 0 HE2 MET A 74 -0.496 2.800 -1.762 1.00 0.00 H new ATOM 0 HE3 MET A 74 -1.435 1.320 -1.456 1.00 0.00 H new ATOM 1180 N ALA A 75 -4.319 0.349 2.577 1.00 0.00 N ATOM 1181 CA ALA A 75 -4.253 -0.813 3.461 1.00 0.00 C ATOM 1182 C ALA A 75 -5.035 -2.002 2.881 1.00 0.00 C ATOM 1183 O ALA A 75 -4.542 -3.129 2.855 1.00 0.00 O ATOM 1184 CB ALA A 75 -4.747 -0.443 4.863 1.00 0.00 C ATOM 0 H ALA A 75 -4.730 1.178 3.006 1.00 0.00 H new ATOM 0 HA ALA A 75 -3.212 -1.125 3.541 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -4.692 -1.318 5.511 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -4.121 0.351 5.272 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -5.779 -0.098 4.806 1.00 0.00 H new ATOM 1190 N PHE A 76 -6.253 -1.753 2.395 1.00 0.00 N ATOM 1191 CA PHE A 76 -7.087 -2.770 1.762 1.00 0.00 C ATOM 1192 C PHE A 76 -6.362 -3.353 0.545 1.00 0.00 C ATOM 1193 O PHE A 76 -6.175 -4.568 0.436 1.00 0.00 O ATOM 1194 CB PHE A 76 -8.452 -2.164 1.412 1.00 0.00 C ATOM 1195 CG PHE A 76 -9.379 -3.074 0.634 1.00 0.00 C ATOM 1196 CD1 PHE A 76 -10.245 -3.969 1.297 1.00 0.00 C ATOM 1197 CD2 PHE A 76 -9.419 -2.965 -0.768 1.00 0.00 C ATOM 1198 CE1 PHE A 76 -11.103 -4.792 0.542 1.00 0.00 C ATOM 1199 CE2 PHE A 76 -10.302 -3.761 -1.513 1.00 0.00 C ATOM 1200 CZ PHE A 76 -11.122 -4.697 -0.863 1.00 0.00 C ATOM 0 H PHE A 76 -6.689 -0.832 2.431 1.00 0.00 H new ATOM 0 HA PHE A 76 -7.267 -3.598 2.448 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -8.949 -1.869 2.336 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -8.291 -1.255 0.833 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -10.250 -4.023 2.376 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -8.768 -2.266 -1.272 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -11.749 -5.499 1.042 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -10.351 -3.654 -2.587 1.00 0.00 H new ATOM 0 HZ PHE A 76 -11.767 -5.344 -1.440 1.00 0.00 H new ATOM 1210 N VAL A 77 -5.899 -2.467 -0.339 1.00 0.00 N ATOM 1211 CA VAL A 77 -5.092 -2.814 -1.497 1.00 0.00 C ATOM 1212 C VAL A 77 -3.915 -3.686 -1.067 1.00 0.00 C ATOM 1213 O VAL A 77 -3.635 -4.673 -1.738 1.00 0.00 O ATOM 1214 CB VAL A 77 -4.640 -1.535 -2.224 1.00 0.00 C ATOM 1215 CG1 VAL A 77 -3.523 -1.794 -3.246 1.00 0.00 C ATOM 1216 CG2 VAL A 77 -5.819 -0.896 -2.968 1.00 0.00 C ATOM 0 H VAL A 77 -6.082 -1.467 -0.262 1.00 0.00 H new ATOM 0 HA VAL A 77 -5.686 -3.395 -2.203 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.257 -0.870 -1.450 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.245 -0.856 -3.727 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -2.654 -2.212 -2.737 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -3.876 -2.498 -4.000 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.482 0.007 -3.477 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.211 -1.600 -3.701 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.603 -0.640 -2.255 1.00 0.00 H new ATOM 1226 N ALA A 78 -3.233 -3.359 0.034 1.00 0.00 N ATOM 1227 CA ALA A 78 -2.056 -4.105 0.454 1.00 0.00 C ATOM 1228 C ALA A 78 -2.381 -5.587 0.647 1.00 0.00 C ATOM 1229 O ALA A 78 -1.735 -6.454 0.051 1.00 0.00 O ATOM 1230 CB ALA A 78 -1.466 -3.503 1.732 1.00 0.00 C ATOM 0 H ALA A 78 -3.480 -2.582 0.647 1.00 0.00 H new ATOM 0 HA ALA A 78 -1.309 -4.031 -0.336 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -0.587 -4.074 2.031 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -1.181 -2.467 1.548 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -2.210 -3.539 2.528 1.00 0.00 H new ATOM 1236 N MET A 79 -3.403 -5.890 1.451 1.00 0.00 N ATOM 1237 CA MET A 79 -3.766 -7.278 1.711 1.00 0.00 C ATOM 1238 C MET A 79 -4.316 -7.959 0.456 1.00 0.00 C ATOM 1239 O MET A 79 -3.939 -9.092 0.156 1.00 0.00 O ATOM 1240 CB MET A 79 -4.674 -7.435 2.939 1.00 0.00 C ATOM 1241 CG MET A 79 -5.858 -6.470 3.044 1.00 0.00 C ATOM 1242 SD MET A 79 -6.888 -6.802 4.496 1.00 0.00 S ATOM 1243 CE MET A 79 -7.961 -5.356 4.470 1.00 0.00 C ATOM 0 H MET A 79 -3.985 -5.200 1.926 1.00 0.00 H new ATOM 0 HA MET A 79 -2.849 -7.807 1.971 1.00 0.00 H new ATOM 0 HB2 MET A 79 -5.063 -8.453 2.947 1.00 0.00 H new ATOM 0 HB3 MET A 79 -4.061 -7.321 3.833 1.00 0.00 H new ATOM 0 HG2 MET A 79 -5.487 -5.446 3.091 1.00 0.00 H new ATOM 0 HG3 MET A 79 -6.468 -6.547 2.144 1.00 0.00 H new ATOM 0 HE1 MET A 79 -8.694 -5.433 5.273 1.00 0.00 H new ATOM 0 HE2 MET A 79 -7.362 -4.456 4.610 1.00 0.00 H new ATOM 0 HE3 MET A 79 -8.477 -5.303 3.511 1.00 0.00 H new ATOM 1253 N ILE A 80 -5.173 -7.273 -0.304 1.00 0.00 N ATOM 1254 CA ILE A 80 -5.719 -7.813 -1.549 1.00 0.00 C ATOM 1255 C ILE A 80 -4.577 -8.203 -2.498 1.00 0.00 C ATOM 1256 O ILE A 80 -4.514 -9.328 -3.001 1.00 0.00 O ATOM 1257 CB ILE A 80 -6.663 -6.767 -2.171 1.00 0.00 C ATOM 1258 CG1 ILE A 80 -7.912 -6.552 -1.295 1.00 0.00 C ATOM 1259 CG2 ILE A 80 -7.056 -7.106 -3.615 1.00 0.00 C ATOM 1260 CD1 ILE A 80 -9.025 -7.582 -1.507 1.00 0.00 C ATOM 0 H ILE A 80 -5.505 -6.336 -0.076 1.00 0.00 H new ATOM 0 HA ILE A 80 -6.294 -8.718 -1.354 1.00 0.00 H new ATOM 0 HB ILE A 80 -6.105 -5.832 -2.210 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -7.612 -6.571 -0.247 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -8.312 -5.558 -1.494 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -7.722 -6.334 -4.002 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -6.160 -7.156 -4.234 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -7.566 -8.069 -3.637 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -9.863 -7.352 -0.849 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -9.358 -7.550 -2.544 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -8.647 -8.578 -1.278 1.00 0.00 H new ATOM 1272 N THR A 81 -3.658 -7.267 -2.726 1.00 0.00 N ATOM 1273 CA THR A 81 -2.495 -7.477 -3.569 1.00 0.00 C ATOM 1274 C THR A 81 -1.657 -8.627 -3.013 1.00 0.00 C ATOM 1275 O THR A 81 -1.224 -9.480 -3.777 1.00 0.00 O ATOM 1276 CB THR A 81 -1.676 -6.183 -3.675 1.00 0.00 C ATOM 1277 OG1 THR A 81 -2.490 -5.134 -4.146 1.00 0.00 O ATOM 1278 CG2 THR A 81 -0.511 -6.322 -4.655 1.00 0.00 C ATOM 0 H THR A 81 -3.706 -6.331 -2.323 1.00 0.00 H new ATOM 0 HA THR A 81 -2.818 -7.747 -4.575 1.00 0.00 H new ATOM 0 HB THR A 81 -1.291 -5.974 -2.677 1.00 0.00 H new ATOM 0 HG1 THR A 81 -3.044 -4.795 -3.412 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.041 -5.383 -4.699 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.153 -7.119 -4.320 1.00 0.00 H new ATOM 0 HG23 THR A 81 -0.896 -6.563 -5.646 1.00 0.00 H new ATOM 1286 N THR A 82 -1.425 -8.673 -1.697 1.00 0.00 N ATOM 1287 CA THR A 82 -0.668 -9.766 -1.095 1.00 0.00 C ATOM 1288 C THR A 82 -1.333 -11.118 -1.382 1.00 0.00 C ATOM 1289 O THR A 82 -0.653 -12.052 -1.800 1.00 0.00 O ATOM 1290 CB THR A 82 -0.442 -9.514 0.402 1.00 0.00 C ATOM 1291 OG1 THR A 82 0.249 -8.288 0.567 1.00 0.00 O ATOM 1292 CG2 THR A 82 0.403 -10.624 1.035 1.00 0.00 C ATOM 0 H THR A 82 -1.750 -7.969 -1.035 1.00 0.00 H new ATOM 0 HA THR A 82 0.319 -9.805 -1.556 1.00 0.00 H new ATOM 0 HB THR A 82 -1.417 -9.488 0.889 1.00 0.00 H new ATOM 0 HG1 THR A 82 -0.365 -7.542 0.404 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.544 -10.414 2.095 1.00 0.00 H new ATOM 0 HG22 THR A 82 -0.107 -11.580 0.919 1.00 0.00 H new ATOM 0 HG23 THR A 82 1.374 -10.668 0.542 1.00 0.00 H new ATOM 1300 N ALA A 83 -2.655 -11.229 -1.214 1.00 0.00 N ATOM 1301 CA ALA A 83 -3.361 -12.456 -1.567 1.00 0.00 C ATOM 1302 C ALA A 83 -3.111 -12.814 -3.034 1.00 0.00 C ATOM 1303 O ALA A 83 -2.788 -13.954 -3.369 1.00 0.00 O ATOM 1304 CB ALA A 83 -4.860 -12.295 -1.294 1.00 0.00 C ATOM 0 H ALA A 83 -3.249 -10.489 -0.839 1.00 0.00 H new ATOM 0 HA ALA A 83 -2.982 -13.271 -0.951 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -5.379 -13.216 -1.560 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -5.017 -12.083 -0.236 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -5.252 -11.472 -1.891 1.00 0.00 H new ATOM 1310 N CYS A 84 -3.211 -11.822 -3.919 1.00 0.00 N ATOM 1311 CA CYS A 84 -2.913 -12.043 -5.326 1.00 0.00 C ATOM 1312 C CYS A 84 -1.445 -12.424 -5.555 1.00 0.00 C ATOM 1313 O CYS A 84 -1.151 -13.249 -6.415 1.00 0.00 O ATOM 1314 CB CYS A 84 -3.379 -10.860 -6.170 1.00 0.00 C ATOM 1315 SG CYS A 84 -3.011 -11.215 -7.905 1.00 0.00 S ATOM 0 H CYS A 84 -3.493 -10.870 -3.686 1.00 0.00 H new ATOM 0 HA CYS A 84 -3.483 -12.909 -5.663 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -4.448 -10.696 -6.035 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -2.874 -9.947 -5.855 1.00 0.00 H new ATOM 0 HG CYS A 84 -2.172 -12.206 -7.977 1.00 0.00 H new ATOM 1321 N HIS A 85 -0.510 -11.891 -4.766 1.00 0.00 N ATOM 1322 CA HIS A 85 0.894 -12.267 -4.850 1.00 0.00 C ATOM 1323 C HIS A 85 1.086 -13.722 -4.423 1.00 0.00 C ATOM 1324 O HIS A 85 1.851 -14.448 -5.057 1.00 0.00 O ATOM 1325 CB HIS A 85 1.776 -11.329 -4.020 1.00 0.00 C ATOM 1326 CG HIS A 85 3.226 -11.386 -4.439 1.00 0.00 C ATOM 1327 ND1 HIS A 85 3.941 -12.516 -4.781 1.00 0.00 N ATOM 1328 CD2 HIS A 85 4.019 -10.306 -4.713 1.00 0.00 C ATOM 1329 CE1 HIS A 85 5.144 -12.115 -5.226 1.00 0.00 C ATOM 1330 NE2 HIS A 85 5.235 -10.776 -5.213 1.00 0.00 N ATOM 0 H HIS A 85 -0.709 -11.188 -4.054 1.00 0.00 H new ATOM 0 HA HIS A 85 1.205 -12.171 -5.890 1.00 0.00 H new ATOM 0 HB2 HIS A 85 1.411 -10.307 -4.121 1.00 0.00 H new ATOM 0 HB3 HIS A 85 1.694 -11.595 -2.966 1.00 0.00 H new ATOM 0 HD1 HIS A 85 3.616 -13.480 -4.709 1.00 0.00 H new ATOM 0 HD2 HIS A 85 3.751 -9.270 -4.568 1.00 0.00 H new ATOM 0 HE1 HIS A 85 5.931 -12.780 -5.550 1.00 0.00 H new ATOM 1338 N GLU A 86 0.400 -14.147 -3.358 1.00 0.00 N ATOM 1339 CA GLU A 86 0.397 -15.540 -2.936 1.00 0.00 C ATOM 1340 C GLU A 86 -0.101 -16.415 -4.089 1.00 0.00 C ATOM 1341 O GLU A 86 0.564 -17.377 -4.465 1.00 0.00 O ATOM 1342 CB GLU A 86 -0.455 -15.718 -1.673 1.00 0.00 C ATOM 1343 CG GLU A 86 0.238 -15.108 -0.445 1.00 0.00 C ATOM 1344 CD GLU A 86 -0.658 -15.130 0.791 1.00 0.00 C ATOM 1345 OE1 GLU A 86 -1.334 -16.163 0.989 1.00 0.00 O ATOM 1346 OE2 GLU A 86 -0.664 -14.108 1.510 1.00 0.00 O ATOM 0 H GLU A 86 -0.165 -13.534 -2.770 1.00 0.00 H new ATOM 0 HA GLU A 86 1.411 -15.851 -2.683 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -1.427 -15.246 -1.817 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -0.638 -16.779 -1.501 1.00 0.00 H new ATOM 0 HG2 GLU A 86 1.156 -15.658 -0.237 1.00 0.00 H new ATOM 0 HG3 GLU A 86 0.526 -14.080 -0.665 1.00 0.00 H new ATOM 1353 N PHE A 87 -1.224 -16.035 -4.712 1.00 0.00 N ATOM 1354 CA PHE A 87 -1.680 -16.683 -5.940 1.00 0.00 C ATOM 1355 C PHE A 87 -0.556 -16.763 -6.970 1.00 0.00 C ATOM 1356 O PHE A 87 -0.247 -17.835 -7.484 1.00 0.00 O ATOM 1357 CB PHE A 87 -2.934 -16.001 -6.504 1.00 0.00 C ATOM 1358 CG PHE A 87 -3.151 -16.190 -7.995 1.00 0.00 C ATOM 1359 CD1 PHE A 87 -3.212 -17.487 -8.541 1.00 0.00 C ATOM 1360 CD2 PHE A 87 -3.108 -15.077 -8.857 1.00 0.00 C ATOM 1361 CE1 PHE A 87 -3.240 -17.669 -9.933 1.00 0.00 C ATOM 1362 CE2 PHE A 87 -3.148 -15.259 -10.250 1.00 0.00 C ATOM 1363 CZ PHE A 87 -3.214 -16.555 -10.789 1.00 0.00 C ATOM 0 H PHE A 87 -1.830 -15.283 -4.383 1.00 0.00 H new ATOM 0 HA PHE A 87 -1.963 -17.706 -5.693 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -3.807 -16.383 -5.974 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -2.875 -14.933 -6.293 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -3.237 -18.345 -7.886 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -3.044 -14.080 -8.446 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -3.282 -18.666 -10.346 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -3.128 -14.402 -10.907 1.00 0.00 H new ATOM 0 HZ PHE A 87 -3.245 -16.695 -11.859 1.00 0.00 H new ATOM 1373 N PHE A 88 0.069 -15.623 -7.243 1.00 0.00 N ATOM 1374 CA PHE A 88 1.057 -15.464 -8.294 1.00 0.00 C ATOM 1375 C PHE A 88 2.261 -16.393 -8.114 1.00 0.00 C ATOM 1376 O PHE A 88 2.914 -16.734 -9.097 1.00 0.00 O ATOM 1377 CB PHE A 88 1.453 -13.990 -8.346 1.00 0.00 C ATOM 1378 CG PHE A 88 2.174 -13.551 -9.606 1.00 0.00 C ATOM 1379 CD1 PHE A 88 3.562 -13.748 -9.734 1.00 0.00 C ATOM 1380 CD2 PHE A 88 1.461 -12.916 -10.640 1.00 0.00 C ATOM 1381 CE1 PHE A 88 4.229 -13.328 -10.898 1.00 0.00 C ATOM 1382 CE2 PHE A 88 2.135 -12.471 -11.790 1.00 0.00 C ATOM 1383 CZ PHE A 88 3.520 -12.673 -11.918 1.00 0.00 C ATOM 0 H PHE A 88 -0.105 -14.763 -6.723 1.00 0.00 H new ATOM 0 HA PHE A 88 0.625 -15.759 -9.250 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.553 -13.386 -8.235 1.00 0.00 H new ATOM 0 HB3 PHE A 88 2.091 -13.773 -7.489 1.00 0.00 H new ATOM 0 HD1 PHE A 88 4.115 -14.222 -8.937 1.00 0.00 H new ATOM 0 HD2 PHE A 88 0.395 -12.771 -10.550 1.00 0.00 H new ATOM 0 HE1 PHE A 88 5.288 -13.509 -11.008 1.00 0.00 H new ATOM 0 HE2 PHE A 88 1.588 -11.973 -12.577 1.00 0.00 H new ATOM 0 HZ PHE A 88 4.038 -12.325 -12.799 1.00 0.00 H new ATOM 1442 N SER B 1 -10.727 -1.973 -14.263 1.00 0.00 N ATOM 1443 CA SER B 1 -9.518 -2.787 -14.035 1.00 0.00 C ATOM 1444 C SER B 1 -8.232 -1.963 -13.945 1.00 0.00 C ATOM 1445 O SER B 1 -7.145 -2.533 -13.892 1.00 0.00 O ATOM 1446 CB SER B 1 -9.402 -3.831 -15.141 1.00 0.00 C ATOM 1447 OG SER B 1 -10.544 -4.663 -15.103 1.00 0.00 O ATOM 0 H1 SER B 1 -11.570 -2.578 -14.195 1.00 0.00 H new ATOM 0 H2 SER B 1 -10.781 -1.222 -13.545 1.00 0.00 H new ATOM 0 H3 SER B 1 -10.684 -1.544 -15.210 1.00 0.00 H new ATOM 0 HA SER B 1 -9.633 -3.267 -13.063 1.00 0.00 H new ATOM 0 HB2 SER B 1 -9.322 -3.344 -16.113 1.00 0.00 H new ATOM 0 HB3 SER B 1 -8.498 -4.425 -15.006 1.00 0.00 H new ATOM 0 HG SER B 1 -10.487 -5.262 -14.330 1.00 0.00 H new ATOM 1455 N GLU B 2 -8.337 -0.635 -13.893 1.00 0.00 N ATOM 1456 CA GLU B 2 -7.175 0.241 -13.789 1.00 0.00 C ATOM 1457 C GLU B 2 -6.336 -0.154 -12.570 1.00 0.00 C ATOM 1458 O GLU B 2 -5.144 -0.447 -12.666 1.00 0.00 O ATOM 1459 CB GLU B 2 -7.636 1.703 -13.666 1.00 0.00 C ATOM 1460 CG GLU B 2 -8.592 2.151 -14.779 1.00 0.00 C ATOM 1461 CD GLU B 2 -8.009 1.916 -16.168 1.00 0.00 C ATOM 1462 OE1 GLU B 2 -7.123 2.709 -16.551 1.00 0.00 O ATOM 1463 OE2 GLU B 2 -8.448 0.937 -16.811 1.00 0.00 O ATOM 0 H GLU B 2 -9.228 -0.140 -13.922 1.00 0.00 H new ATOM 0 HA GLU B 2 -6.564 0.138 -14.686 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -8.127 1.839 -12.703 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -6.760 2.351 -13.671 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -9.534 1.610 -14.686 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -8.819 3.210 -14.656 1.00 0.00 H new ATOM 1470 N LEU B 3 -6.994 -0.201 -11.411 1.00 0.00 N ATOM 1471 CA LEU B 3 -6.340 -0.582 -10.173 1.00 0.00 C ATOM 1472 C LEU B 3 -5.872 -2.036 -10.217 1.00 0.00 C ATOM 1473 O LEU B 3 -4.817 -2.342 -9.680 1.00 0.00 O ATOM 1474 CB LEU B 3 -7.218 -0.243 -8.964 1.00 0.00 C ATOM 1475 CG LEU B 3 -8.586 -0.944 -8.944 1.00 0.00 C ATOM 1476 CD1 LEU B 3 -8.566 -2.203 -8.072 1.00 0.00 C ATOM 1477 CD2 LEU B 3 -9.619 0.041 -8.390 1.00 0.00 C ATOM 0 H LEU B 3 -7.984 0.022 -11.311 1.00 0.00 H new ATOM 0 HA LEU B 3 -5.432 0.010 -10.055 1.00 0.00 H new ATOM 0 HB2 LEU B 3 -6.677 -0.506 -8.055 1.00 0.00 H new ATOM 0 HB3 LEU B 3 -7.377 0.835 -8.939 1.00 0.00 H new ATOM 0 HG LEU B 3 -8.838 -1.251 -9.959 1.00 0.00 H new ATOM 0 HD11 LEU B 3 -9.551 -2.669 -8.084 1.00 0.00 H new ATOM 0 HD12 LEU B 3 -7.828 -2.904 -8.462 1.00 0.00 H new ATOM 0 HD13 LEU B 3 -8.305 -1.933 -7.049 1.00 0.00 H new ATOM 0 HD21 LEU B 3 -10.599 -0.435 -8.366 1.00 0.00 H new ATOM 0 HD22 LEU B 3 -9.335 0.337 -7.380 1.00 0.00 H new ATOM 0 HD23 LEU B 3 -9.659 0.923 -9.029 1.00 0.00 H new ATOM 1489 N GLU B 4 -6.608 -2.930 -10.886 1.00 0.00 N ATOM 1490 CA GLU B 4 -6.163 -4.308 -11.062 1.00 0.00 C ATOM 1491 C GLU B 4 -4.838 -4.343 -11.835 1.00 0.00 C ATOM 1492 O GLU B 4 -3.921 -5.071 -11.460 1.00 0.00 O ATOM 1493 CB GLU B 4 -7.244 -5.146 -11.756 1.00 0.00 C ATOM 1494 CG GLU B 4 -8.524 -5.217 -10.911 1.00 0.00 C ATOM 1495 CD GLU B 4 -9.631 -6.032 -11.580 1.00 0.00 C ATOM 1496 OE1 GLU B 4 -9.729 -5.968 -12.826 1.00 0.00 O ATOM 1497 OE2 GLU B 4 -10.363 -6.718 -10.833 1.00 0.00 O ATOM 0 H GLU B 4 -7.511 -2.721 -11.312 1.00 0.00 H new ATOM 0 HA GLU B 4 -5.991 -4.749 -10.080 1.00 0.00 H new ATOM 0 HB2 GLU B 4 -7.472 -4.714 -12.730 1.00 0.00 H new ATOM 0 HB3 GLU B 4 -6.867 -6.153 -11.935 1.00 0.00 H new ATOM 0 HG2 GLU B 4 -8.290 -5.657 -9.942 1.00 0.00 H new ATOM 0 HG3 GLU B 4 -8.886 -4.206 -10.723 1.00 0.00 H new ATOM 1504 N LYS B 5 -4.732 -3.541 -12.900 1.00 0.00 N ATOM 1505 CA LYS B 5 -3.527 -3.440 -13.713 1.00 0.00 C ATOM 1506 C LYS B 5 -2.381 -2.979 -12.812 1.00 0.00 C ATOM 1507 O LYS B 5 -1.343 -3.635 -12.722 1.00 0.00 O ATOM 1508 CB LYS B 5 -3.773 -2.493 -14.902 1.00 0.00 C ATOM 1509 CG LYS B 5 -2.761 -2.636 -16.050 1.00 0.00 C ATOM 1510 CD LYS B 5 -1.340 -2.185 -15.676 1.00 0.00 C ATOM 1511 CE LYS B 5 -0.462 -1.977 -16.915 1.00 0.00 C ATOM 1512 NZ LYS B 5 -0.291 -3.224 -17.682 1.00 0.00 N ATOM 0 H LYS B 5 -5.491 -2.940 -13.221 1.00 0.00 H new ATOM 0 HA LYS B 5 -3.257 -4.406 -14.140 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -4.774 -2.673 -15.293 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -3.752 -1.465 -14.542 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -2.731 -3.678 -16.369 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -3.106 -2.051 -16.903 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -1.392 -1.256 -15.108 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -0.881 -2.931 -15.027 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -0.910 -1.216 -17.554 1.00 0.00 H new ATOM 0 HE3 LYS B 5 0.515 -1.602 -16.609 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 0.389 -3.067 -18.453 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 0.065 -3.972 -17.053 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -1.206 -3.514 -18.082 1.00 0.00 H new ATOM 1526 N ALA B 6 -2.594 -1.860 -12.114 1.00 0.00 N ATOM 1527 CA ALA B 6 -1.628 -1.325 -11.166 1.00 0.00 C ATOM 1528 C ALA B 6 -1.169 -2.417 -10.189 1.00 0.00 C ATOM 1529 O ALA B 6 0.022 -2.693 -10.066 1.00 0.00 O ATOM 1530 CB ALA B 6 -2.270 -0.142 -10.437 1.00 0.00 C ATOM 0 H ALA B 6 -3.444 -1.303 -12.195 1.00 0.00 H new ATOM 0 HA ALA B 6 -0.737 -0.978 -11.690 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -1.560 0.273 -9.721 1.00 0.00 H new ATOM 0 HB2 ALA B 6 -2.546 0.625 -11.161 1.00 0.00 H new ATOM 0 HB3 ALA B 6 -3.162 -0.480 -9.909 1.00 0.00 H new ATOM 1536 N VAL B 7 -2.124 -3.069 -9.530 1.00 0.00 N ATOM 1537 CA VAL B 7 -1.909 -4.143 -8.571 1.00 0.00 C ATOM 1538 C VAL B 7 -1.026 -5.249 -9.165 1.00 0.00 C ATOM 1539 O VAL B 7 0.014 -5.580 -8.589 1.00 0.00 O ATOM 1540 CB VAL B 7 -3.295 -4.621 -8.093 1.00 0.00 C ATOM 1541 CG1 VAL B 7 -3.330 -6.022 -7.487 1.00 0.00 C ATOM 1542 CG2 VAL B 7 -3.851 -3.633 -7.058 1.00 0.00 C ATOM 0 H VAL B 7 -3.112 -2.851 -9.658 1.00 0.00 H new ATOM 0 HA VAL B 7 -1.352 -3.797 -7.701 1.00 0.00 H new ATOM 0 HB VAL B 7 -3.904 -4.664 -8.996 1.00 0.00 H new ATOM 0 HG11 VAL B 7 -4.349 -6.262 -7.183 1.00 0.00 H new ATOM 0 HG12 VAL B 7 -2.992 -6.747 -8.227 1.00 0.00 H new ATOM 0 HG13 VAL B 7 -2.674 -6.059 -6.617 1.00 0.00 H new ATOM 0 HG21 VAL B 7 -4.831 -3.972 -6.721 1.00 0.00 H new ATOM 0 HG22 VAL B 7 -3.173 -3.578 -6.206 1.00 0.00 H new ATOM 0 HG23 VAL B 7 -3.945 -2.646 -7.511 1.00 0.00 H new ATOM 1552 N VAL B 8 -1.395 -5.820 -10.318 1.00 0.00 N ATOM 1553 CA VAL B 8 -0.559 -6.862 -10.908 1.00 0.00 C ATOM 1554 C VAL B 8 0.814 -6.311 -11.301 1.00 0.00 C ATOM 1555 O VAL B 8 1.802 -7.033 -11.197 1.00 0.00 O ATOM 1556 CB VAL B 8 -1.245 -7.645 -12.041 1.00 0.00 C ATOM 1557 CG1 VAL B 8 -2.531 -8.317 -11.544 1.00 0.00 C ATOM 1558 CG2 VAL B 8 -1.533 -6.808 -13.288 1.00 0.00 C ATOM 0 H VAL B 8 -2.238 -5.586 -10.843 1.00 0.00 H new ATOM 0 HA VAL B 8 -0.399 -7.608 -10.130 1.00 0.00 H new ATOM 0 HB VAL B 8 -0.528 -8.408 -12.343 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -2.996 -8.864 -12.364 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -2.291 -9.009 -10.737 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -3.221 -7.557 -11.178 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -2.017 -7.431 -14.040 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -2.190 -5.979 -13.026 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -0.597 -6.417 -13.688 1.00 0.00 H new ATOM 1568 N ALA B 9 0.911 -5.041 -11.710 1.00 0.00 N ATOM 1569 CA ALA B 9 2.208 -4.424 -11.958 1.00 0.00 C ATOM 1570 C ALA B 9 3.066 -4.421 -10.686 1.00 0.00 C ATOM 1571 O ALA B 9 4.228 -4.821 -10.744 1.00 0.00 O ATOM 1572 CB ALA B 9 2.060 -3.023 -12.559 1.00 0.00 C ATOM 0 H ALA B 9 0.111 -4.429 -11.874 1.00 0.00 H new ATOM 0 HA ALA B 9 2.731 -5.027 -12.700 1.00 0.00 H new ATOM 0 HB1 ALA B 9 3.047 -2.594 -12.730 1.00 0.00 H new ATOM 0 HB2 ALA B 9 1.524 -3.088 -13.506 1.00 0.00 H new ATOM 0 HB3 ALA B 9 1.504 -2.388 -11.869 1.00 0.00 H new ATOM 1578 N LEU B 10 2.501 -4.027 -9.533 1.00 0.00 N ATOM 1579 CA LEU B 10 3.230 -4.069 -8.263 1.00 0.00 C ATOM 1580 C LEU B 10 3.768 -5.483 -8.021 1.00 0.00 C ATOM 1581 O LEU B 10 4.959 -5.662 -7.755 1.00 0.00 O ATOM 1582 CB LEU B 10 2.350 -3.663 -7.063 1.00 0.00 C ATOM 1583 CG LEU B 10 1.667 -2.287 -7.122 1.00 0.00 C ATOM 1584 CD1 LEU B 10 0.875 -2.065 -5.829 1.00 0.00 C ATOM 1585 CD2 LEU B 10 2.654 -1.132 -7.304 1.00 0.00 C ATOM 0 H LEU B 10 1.546 -3.678 -9.458 1.00 0.00 H new ATOM 0 HA LEU B 10 4.046 -3.351 -8.342 1.00 0.00 H new ATOM 0 HB2 LEU B 10 1.574 -4.419 -6.942 1.00 0.00 H new ATOM 0 HB3 LEU B 10 2.968 -3.694 -6.166 1.00 0.00 H new ATOM 0 HG LEU B 10 1.013 -2.292 -7.994 1.00 0.00 H new ATOM 0 HD11 LEU B 10 0.388 -1.091 -5.864 1.00 0.00 H new ATOM 0 HD12 LEU B 10 0.120 -2.845 -5.726 1.00 0.00 H new ATOM 0 HD13 LEU B 10 1.553 -2.101 -4.976 1.00 0.00 H new ATOM 0 HD21 LEU B 10 2.108 -0.189 -7.338 1.00 0.00 H new ATOM 0 HD22 LEU B 10 3.354 -1.116 -6.469 1.00 0.00 H new ATOM 0 HD23 LEU B 10 3.204 -1.267 -8.235 1.00 0.00 H new ATOM 1597 N ILE B 11 2.886 -6.484 -8.125 1.00 0.00 N ATOM 1598 CA ILE B 11 3.259 -7.878 -7.903 1.00 0.00 C ATOM 1599 C ILE B 11 4.386 -8.272 -8.855 1.00 0.00 C ATOM 1600 O ILE B 11 5.423 -8.762 -8.419 1.00 0.00 O ATOM 1601 CB ILE B 11 2.027 -8.786 -8.081 1.00 0.00 C ATOM 1602 CG1 ILE B 11 1.044 -8.504 -6.935 1.00 0.00 C ATOM 1603 CG2 ILE B 11 2.404 -10.277 -8.126 1.00 0.00 C ATOM 1604 CD1 ILE B 11 -0.313 -9.176 -7.137 1.00 0.00 C ATOM 0 H ILE B 11 1.904 -6.349 -8.363 1.00 0.00 H new ATOM 0 HA ILE B 11 3.622 -8.001 -6.883 1.00 0.00 H new ATOM 0 HB ILE B 11 1.561 -8.560 -9.040 1.00 0.00 H new ATOM 0 HG12 ILE B 11 1.479 -8.849 -5.997 1.00 0.00 H new ATOM 0 HG13 ILE B 11 0.901 -7.427 -6.843 1.00 0.00 H new ATOM 0 HG21 ILE B 11 1.503 -10.877 -8.253 1.00 0.00 H new ATOM 0 HG22 ILE B 11 3.080 -10.456 -8.962 1.00 0.00 H new ATOM 0 HG23 ILE B 11 2.897 -10.556 -7.195 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -0.965 -8.940 -6.296 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -0.766 -8.812 -8.059 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -0.178 -10.256 -7.200 1.00 0.00 H new ATOM 1616 N ASP B 12 4.196 -8.045 -10.155 1.00 0.00 N ATOM 1617 CA ASP B 12 5.122 -8.513 -11.170 1.00 0.00 C ATOM 1618 C ASP B 12 6.499 -7.885 -10.970 1.00 0.00 C ATOM 1619 O ASP B 12 7.501 -8.600 -10.915 1.00 0.00 O ATOM 1620 CB ASP B 12 4.572 -8.214 -12.567 1.00 0.00 C ATOM 1621 CG ASP B 12 5.547 -8.689 -13.639 1.00 0.00 C ATOM 1622 OD1 ASP B 12 5.907 -9.886 -13.587 1.00 0.00 O ATOM 1623 OD2 ASP B 12 5.931 -7.843 -14.474 1.00 0.00 O ATOM 0 H ASP B 12 3.396 -7.532 -10.527 1.00 0.00 H new ATOM 0 HA ASP B 12 5.233 -9.593 -11.074 1.00 0.00 H new ATOM 0 HB2 ASP B 12 3.609 -8.708 -12.698 1.00 0.00 H new ATOM 0 HB3 ASP B 12 4.398 -7.143 -12.674 1.00 0.00 H new ATOM 1628 N VAL B 13 6.538 -6.555 -10.844 1.00 0.00 N ATOM 1629 CA VAL B 13 7.769 -5.821 -10.595 1.00 0.00 C ATOM 1630 C VAL B 13 8.451 -6.377 -9.348 1.00 0.00 C ATOM 1631 O VAL B 13 9.630 -6.730 -9.387 1.00 0.00 O ATOM 1632 CB VAL B 13 7.461 -4.319 -10.460 1.00 0.00 C ATOM 1633 CG1 VAL B 13 8.672 -3.529 -9.956 1.00 0.00 C ATOM 1634 CG2 VAL B 13 7.066 -3.749 -11.826 1.00 0.00 C ATOM 0 H VAL B 13 5.711 -5.961 -10.913 1.00 0.00 H new ATOM 0 HA VAL B 13 8.454 -5.943 -11.434 1.00 0.00 H new ATOM 0 HB VAL B 13 6.649 -4.222 -9.740 1.00 0.00 H new ATOM 0 HG11 VAL B 13 8.410 -2.474 -9.876 1.00 0.00 H new ATOM 0 HG12 VAL B 13 8.970 -3.905 -8.977 1.00 0.00 H new ATOM 0 HG13 VAL B 13 9.499 -3.645 -10.656 1.00 0.00 H new ATOM 0 HG21 VAL B 13 6.848 -2.685 -11.727 1.00 0.00 H new ATOM 0 HG22 VAL B 13 7.887 -3.888 -12.529 1.00 0.00 H new ATOM 0 HG23 VAL B 13 6.181 -4.268 -12.195 1.00 0.00 H new ATOM 1644 N PHE B 14 7.711 -6.458 -8.240 1.00 0.00 N ATOM 1645 CA PHE B 14 8.278 -6.961 -7.003 1.00 0.00 C ATOM 1646 C PHE B 14 8.881 -8.352 -7.207 1.00 0.00 C ATOM 1647 O PHE B 14 10.040 -8.573 -6.865 1.00 0.00 O ATOM 1648 CB PHE B 14 7.222 -6.974 -5.900 1.00 0.00 C ATOM 1649 CG PHE B 14 7.789 -7.437 -4.576 1.00 0.00 C ATOM 1650 CD1 PHE B 14 7.896 -8.812 -4.298 1.00 0.00 C ATOM 1651 CD2 PHE B 14 8.210 -6.501 -3.616 1.00 0.00 C ATOM 1652 CE1 PHE B 14 8.392 -9.238 -3.059 1.00 0.00 C ATOM 1653 CE2 PHE B 14 8.607 -6.937 -2.339 1.00 0.00 C ATOM 1654 CZ PHE B 14 8.664 -8.309 -2.046 1.00 0.00 C ATOM 0 H PHE B 14 6.730 -6.184 -8.181 1.00 0.00 H new ATOM 0 HA PHE B 14 9.083 -6.293 -6.695 1.00 0.00 H new ATOM 0 HB2 PHE B 14 6.805 -5.973 -5.786 1.00 0.00 H new ATOM 0 HB3 PHE B 14 6.401 -7.629 -6.192 1.00 0.00 H new ATOM 0 HD1 PHE B 14 7.596 -9.538 -5.039 1.00 0.00 H new ATOM 0 HD2 PHE B 14 8.229 -5.449 -3.858 1.00 0.00 H new ATOM 0 HE1 PHE B 14 8.566 -10.289 -2.884 1.00 0.00 H new ATOM 0 HE2 PHE B 14 8.869 -6.214 -1.581 1.00 0.00 H new ATOM 0 HZ PHE B 14 8.915 -8.645 -1.051 1.00 0.00 H new ATOM 1664 N HIS B 15 8.106 -9.288 -7.764 1.00 0.00 N ATOM 1665 CA HIS B 15 8.554 -10.661 -7.948 1.00 0.00 C ATOM 1666 C HIS B 15 9.822 -10.694 -8.805 1.00 0.00 C ATOM 1667 O HIS B 15 10.748 -11.443 -8.500 1.00 0.00 O ATOM 1668 CB HIS B 15 7.422 -11.567 -8.475 1.00 0.00 C ATOM 1669 CG HIS B 15 7.624 -12.113 -9.867 1.00 0.00 C ATOM 1670 ND1 HIS B 15 7.518 -11.408 -11.045 1.00 0.00 N ATOM 1671 CD2 HIS B 15 8.043 -13.379 -10.179 1.00 0.00 C ATOM 1672 CE1 HIS B 15 7.855 -12.239 -12.045 1.00 0.00 C ATOM 1673 NE2 HIS B 15 8.180 -13.452 -11.567 1.00 0.00 N ATOM 0 H HIS B 15 7.158 -9.111 -8.096 1.00 0.00 H new ATOM 0 HA HIS B 15 8.821 -11.079 -6.978 1.00 0.00 H new ATOM 0 HB2 HIS B 15 7.301 -12.405 -7.789 1.00 0.00 H new ATOM 0 HB3 HIS B 15 6.490 -11.003 -8.456 1.00 0.00 H new ATOM 0 HD1 HIS B 15 7.235 -10.433 -11.141 1.00 0.00 H new ATOM 0 HD2 HIS B 15 8.233 -14.178 -9.477 1.00 0.00 H new ATOM 0 HE1 HIS B 15 7.864 -11.969 -13.091 1.00 0.00 H new ATOM 1681 N GLN B 16 9.872 -9.873 -9.862 1.00 0.00 N ATOM 1682 CA GLN B 16 11.018 -9.815 -10.756 1.00 0.00 C ATOM 1683 C GLN B 16 12.301 -9.587 -9.955 1.00 0.00 C ATOM 1684 O GLN B 16 13.267 -10.321 -10.132 1.00 0.00 O ATOM 1685 CB GLN B 16 10.799 -8.717 -11.806 1.00 0.00 C ATOM 1686 CG GLN B 16 11.957 -8.613 -12.808 1.00 0.00 C ATOM 1687 CD GLN B 16 11.739 -7.467 -13.790 1.00 0.00 C ATOM 1688 OE1 GLN B 16 11.700 -7.672 -14.998 1.00 0.00 O ATOM 1689 NE2 GLN B 16 11.595 -6.245 -13.282 1.00 0.00 N ATOM 0 H GLN B 16 9.117 -9.235 -10.114 1.00 0.00 H new ATOM 0 HA GLN B 16 11.124 -10.765 -11.279 1.00 0.00 H new ATOM 0 HB2 GLN B 16 9.874 -8.917 -12.346 1.00 0.00 H new ATOM 0 HB3 GLN B 16 10.673 -7.759 -11.302 1.00 0.00 H new ATOM 0 HG2 GLN B 16 12.893 -8.461 -12.271 1.00 0.00 H new ATOM 0 HG3 GLN B 16 12.052 -9.551 -13.355 1.00 0.00 H new ATOM 0 HE21 GLN B 16 11.632 -6.105 -12.272 1.00 0.00 H new ATOM 0 HE22 GLN B 16 11.448 -5.449 -13.902 1.00 0.00 H new ATOM 1698 N TYR B 17 12.310 -8.589 -9.067 1.00 0.00 N ATOM 1699 CA TYR B 17 13.474 -8.313 -8.226 1.00 0.00 C ATOM 1700 C TYR B 17 13.634 -9.368 -7.118 1.00 0.00 C ATOM 1701 O TYR B 17 14.718 -9.904 -6.889 1.00 0.00 O ATOM 1702 CB TYR B 17 13.374 -6.890 -7.664 1.00 0.00 C ATOM 1703 CG TYR B 17 13.554 -5.805 -8.711 1.00 0.00 C ATOM 1704 CD1 TYR B 17 14.835 -5.548 -9.235 1.00 0.00 C ATOM 1705 CD2 TYR B 17 12.458 -5.039 -9.149 1.00 0.00 C ATOM 1706 CE1 TYR B 17 15.016 -4.530 -10.185 1.00 0.00 C ATOM 1707 CE2 TYR B 17 12.642 -4.013 -10.095 1.00 0.00 C ATOM 1708 CZ TYR B 17 13.923 -3.757 -10.609 1.00 0.00 C ATOM 1709 OH TYR B 17 14.125 -2.747 -11.499 1.00 0.00 O ATOM 0 H TYR B 17 11.523 -7.959 -8.913 1.00 0.00 H new ATOM 0 HA TYR B 17 14.376 -8.377 -8.835 1.00 0.00 H new ATOM 0 HB2 TYR B 17 12.402 -6.765 -7.188 1.00 0.00 H new ATOM 0 HB3 TYR B 17 14.128 -6.762 -6.888 1.00 0.00 H new ATOM 0 HD1 TYR B 17 15.680 -6.135 -8.906 1.00 0.00 H new ATOM 0 HD2 TYR B 17 11.471 -5.239 -8.758 1.00 0.00 H new ATOM 0 HE1 TYR B 17 15.999 -4.341 -10.591 1.00 0.00 H new ATOM 0 HE2 TYR B 17 11.799 -3.424 -10.425 1.00 0.00 H new ATOM 0 HH TYR B 17 13.369 -2.124 -11.464 1.00 0.00 H new ATOM 1719 N SER B 18 12.543 -9.684 -6.423 1.00 0.00 N ATOM 1720 CA SER B 18 12.513 -10.619 -5.304 1.00 0.00 C ATOM 1721 C SER B 18 12.935 -12.040 -5.698 1.00 0.00 C ATOM 1722 O SER B 18 13.338 -12.825 -4.838 1.00 0.00 O ATOM 1723 CB SER B 18 11.132 -10.586 -4.645 1.00 0.00 C ATOM 1724 OG SER B 18 11.114 -11.439 -3.519 1.00 0.00 O ATOM 0 H SER B 18 11.628 -9.283 -6.631 1.00 0.00 H new ATOM 0 HA SER B 18 13.257 -10.295 -4.576 1.00 0.00 H new ATOM 0 HB2 SER B 18 10.888 -9.567 -4.344 1.00 0.00 H new ATOM 0 HB3 SER B 18 10.371 -10.898 -5.360 1.00 0.00 H new ATOM 0 HG SER B 18 11.975 -11.385 -3.054 1.00 0.00 H new ATOM 1730 N GLY B 19 12.813 -12.406 -6.975 1.00 0.00 N ATOM 1731 CA GLY B 19 13.275 -13.692 -7.462 1.00 0.00 C ATOM 1732 C GLY B 19 14.801 -13.769 -7.481 1.00 0.00 C ATOM 1733 O GLY B 19 15.353 -14.866 -7.466 1.00 0.00 O ATOM 0 H GLY B 19 12.392 -11.816 -7.693 1.00 0.00 H new ATOM 0 HA2 GLY B 19 12.878 -14.486 -6.829 1.00 0.00 H new ATOM 0 HA3 GLY B 19 12.889 -13.862 -8.467 1.00 0.00 H new ATOM 1737 N ARG B 20 15.490 -12.623 -7.553 1.00 0.00 N ATOM 1738 CA ARG B 20 16.925 -12.595 -7.802 1.00 0.00 C ATOM 1739 C ARG B 20 17.723 -12.915 -6.538 1.00 0.00 C ATOM 1740 O ARG B 20 18.550 -13.823 -6.549 1.00 0.00 O ATOM 1741 CB ARG B 20 17.330 -11.237 -8.384 1.00 0.00 C ATOM 1742 CG ARG B 20 16.393 -10.802 -9.519 1.00 0.00 C ATOM 1743 CD ARG B 20 16.850 -9.506 -10.197 1.00 0.00 C ATOM 1744 NE ARG B 20 18.202 -9.614 -10.762 1.00 0.00 N ATOM 1745 CZ ARG B 20 19.310 -9.023 -10.285 1.00 0.00 C ATOM 1746 NH1 ARG B 20 19.305 -8.362 -9.122 1.00 0.00 N ATOM 1747 NH2 ARG B 20 20.441 -9.099 -10.994 1.00 0.00 N ATOM 0 H ARG B 20 15.068 -11.701 -7.441 1.00 0.00 H new ATOM 0 HA ARG B 20 17.159 -13.371 -8.531 1.00 0.00 H new ATOM 0 HB2 ARG B 20 17.319 -10.485 -7.595 1.00 0.00 H new ATOM 0 HB3 ARG B 20 18.353 -11.292 -8.757 1.00 0.00 H new ATOM 0 HG2 ARG B 20 16.337 -11.597 -10.263 1.00 0.00 H new ATOM 0 HG3 ARG B 20 15.387 -10.665 -9.122 1.00 0.00 H new ATOM 0 HD2 ARG B 20 16.148 -9.247 -10.990 1.00 0.00 H new ATOM 0 HD3 ARG B 20 16.826 -8.692 -9.472 1.00 0.00 H new ATOM 0 HE ARG B 20 18.309 -10.192 -11.595 1.00 0.00 H new ATOM 0 HH11 ARG B 20 18.446 -8.298 -8.575 1.00 0.00 H new ATOM 0 HH12 ARG B 20 20.160 -7.922 -8.782 1.00 0.00 H new ATOM 0 HH21 ARG B 20 20.453 -9.600 -11.882 1.00 0.00 H new ATOM 0 HH22 ARG B 20 21.291 -8.656 -10.647 1.00 0.00 H new ATOM 1761 N GLU B 21 17.477 -12.177 -5.450 1.00 0.00 N ATOM 1762 CA GLU B 21 18.054 -12.467 -4.143 1.00 0.00 C ATOM 1763 C GLU B 21 16.958 -12.250 -3.103 1.00 0.00 C ATOM 1764 O GLU B 21 16.599 -11.114 -2.790 1.00 0.00 O ATOM 1765 CB GLU B 21 19.294 -11.605 -3.865 1.00 0.00 C ATOM 1766 CG GLU B 21 20.379 -11.773 -4.941 1.00 0.00 C ATOM 1767 CD GLU B 21 21.634 -10.949 -4.662 1.00 0.00 C ATOM 1768 OE1 GLU B 21 21.683 -10.306 -3.589 1.00 0.00 O ATOM 1769 OE2 GLU B 21 22.530 -10.975 -5.533 1.00 0.00 O ATOM 0 H GLU B 21 16.868 -11.359 -5.457 1.00 0.00 H new ATOM 0 HA GLU B 21 18.404 -13.499 -4.104 1.00 0.00 H new ATOM 0 HB2 GLU B 21 19.000 -10.557 -3.811 1.00 0.00 H new ATOM 0 HB3 GLU B 21 19.707 -11.871 -2.892 1.00 0.00 H new ATOM 0 HG2 GLU B 21 20.652 -12.826 -5.012 1.00 0.00 H new ATOM 0 HG3 GLU B 21 19.970 -11.484 -5.909 1.00 0.00 H new ATOM 1776 N GLY B 22 16.418 -13.353 -2.596 1.00 0.00 N ATOM 1777 CA GLY B 22 15.232 -13.386 -1.770 1.00 0.00 C ATOM 1778 C GLY B 22 14.498 -14.659 -2.162 1.00 0.00 C ATOM 1779 O GLY B 22 15.146 -15.626 -2.561 1.00 0.00 O ATOM 0 H GLY B 22 16.814 -14.279 -2.759 1.00 0.00 H new ATOM 0 HA2 GLY B 22 15.491 -13.393 -0.711 1.00 0.00 H new ATOM 0 HA3 GLY B 22 14.611 -12.507 -1.940 1.00 0.00 H new ATOM 1783 N ASP B 23 13.166 -14.660 -2.086 1.00 0.00 N ATOM 1784 CA ASP B 23 12.354 -15.826 -2.413 1.00 0.00 C ATOM 1785 C ASP B 23 11.002 -15.371 -2.961 1.00 0.00 C ATOM 1786 O ASP B 23 9.966 -15.791 -2.450 1.00 0.00 O ATOM 1787 CB ASP B 23 12.169 -16.715 -1.168 1.00 0.00 C ATOM 1788 CG ASP B 23 13.468 -17.350 -0.680 1.00 0.00 C ATOM 1789 OD1 ASP B 23 13.815 -18.422 -1.220 1.00 0.00 O ATOM 1790 OD2 ASP B 23 14.079 -16.755 0.235 1.00 0.00 O ATOM 0 H ASP B 23 12.622 -13.848 -1.795 1.00 0.00 H new ATOM 0 HA ASP B 23 12.861 -16.416 -3.176 1.00 0.00 H new ATOM 0 HB2 ASP B 23 11.741 -16.117 -0.364 1.00 0.00 H new ATOM 0 HB3 ASP B 23 11.451 -17.503 -1.396 1.00 0.00 H new ATOM 1795 N LYS B 24 10.998 -14.489 -3.969 1.00 0.00 N ATOM 1796 CA LYS B 24 9.803 -14.035 -4.694 1.00 0.00 C ATOM 1797 C LYS B 24 8.870 -13.119 -3.883 1.00 0.00 C ATOM 1798 O LYS B 24 8.285 -12.206 -4.459 1.00 0.00 O ATOM 1799 CB LYS B 24 9.018 -15.201 -5.319 1.00 0.00 C ATOM 1800 CG LYS B 24 9.863 -15.997 -6.327 1.00 0.00 C ATOM 1801 CD LYS B 24 9.164 -17.277 -6.817 1.00 0.00 C ATOM 1802 CE LYS B 24 8.197 -17.080 -7.995 1.00 0.00 C ATOM 1803 NZ LYS B 24 7.019 -16.272 -7.639 1.00 0.00 N ATOM 0 H LYS B 24 11.855 -14.057 -4.314 1.00 0.00 H new ATOM 0 HA LYS B 24 10.201 -13.417 -5.499 1.00 0.00 H new ATOM 0 HB2 LYS B 24 8.673 -15.869 -4.530 1.00 0.00 H new ATOM 0 HB3 LYS B 24 8.130 -14.813 -5.818 1.00 0.00 H new ATOM 0 HG2 LYS B 24 10.090 -15.363 -7.184 1.00 0.00 H new ATOM 0 HG3 LYS B 24 10.814 -16.263 -5.866 1.00 0.00 H new ATOM 0 HD2 LYS B 24 9.926 -18.000 -7.109 1.00 0.00 H new ATOM 0 HD3 LYS B 24 8.613 -17.714 -5.984 1.00 0.00 H new ATOM 0 HE2 LYS B 24 8.727 -16.599 -8.817 1.00 0.00 H new ATOM 0 HE3 LYS B 24 7.868 -18.055 -8.355 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 6.226 -16.520 -8.265 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 6.753 -16.462 -6.652 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 7.244 -15.263 -7.749 1.00 0.00 H new ATOM 1817 N HIS B 25 8.722 -13.348 -2.573 1.00 0.00 N ATOM 1818 CA HIS B 25 7.894 -12.570 -1.656 1.00 0.00 C ATOM 1819 C HIS B 25 8.754 -11.753 -0.665 1.00 0.00 C ATOM 1820 O HIS B 25 8.219 -11.231 0.316 1.00 0.00 O ATOM 1821 CB HIS B 25 6.960 -13.552 -0.931 1.00 0.00 C ATOM 1822 CG HIS B 25 5.694 -12.931 -0.393 1.00 0.00 C ATOM 1823 ND1 HIS B 25 5.446 -12.589 0.917 1.00 0.00 N ATOM 1824 CD2 HIS B 25 4.535 -12.731 -1.096 1.00 0.00 C ATOM 1825 CE1 HIS B 25 4.164 -12.193 0.997 1.00 0.00 C ATOM 1826 NE2 HIS B 25 3.571 -12.248 -0.206 1.00 0.00 N ATOM 0 H HIS B 25 9.201 -14.118 -2.106 1.00 0.00 H new ATOM 0 HA HIS B 25 7.306 -11.837 -2.208 1.00 0.00 H new ATOM 0 HB2 HIS B 25 6.692 -14.354 -1.619 1.00 0.00 H new ATOM 0 HB3 HIS B 25 7.505 -14.009 -0.105 1.00 0.00 H new ATOM 0 HD1 HIS B 25 6.114 -12.629 1.687 1.00 0.00 H new ATOM 0 HD2 HIS B 25 4.392 -12.914 -2.151 1.00 0.00 H new ATOM 0 HE1 HIS B 25 3.677 -11.874 1.906 1.00 0.00 H new ATOM 1834 N LYS B 26 10.072 -11.647 -0.912 1.00 0.00 N ATOM 1835 CA LYS B 26 11.086 -11.103 -0.002 1.00 0.00 C ATOM 1836 C LYS B 26 12.140 -10.293 -0.781 1.00 0.00 C ATOM 1837 O LYS B 26 12.842 -10.879 -1.603 1.00 0.00 O ATOM 1838 CB LYS B 26 11.822 -12.267 0.689 1.00 0.00 C ATOM 1839 CG LYS B 26 10.965 -13.213 1.547 1.00 0.00 C ATOM 1840 CD LYS B 26 10.353 -12.562 2.794 1.00 0.00 C ATOM 1841 CE LYS B 26 11.431 -11.893 3.652 1.00 0.00 C ATOM 1842 NZ LYS B 26 10.891 -11.341 4.900 1.00 0.00 N ATOM 0 H LYS B 26 10.475 -11.955 -1.797 1.00 0.00 H new ATOM 0 HA LYS B 26 10.583 -10.461 0.722 1.00 0.00 H new ATOM 0 HB2 LYS B 26 12.318 -12.860 -0.079 1.00 0.00 H new ATOM 0 HB3 LYS B 26 12.604 -11.847 1.322 1.00 0.00 H new ATOM 0 HG2 LYS B 26 10.161 -13.614 0.930 1.00 0.00 H new ATOM 0 HG3 LYS B 26 11.580 -14.058 1.858 1.00 0.00 H new ATOM 0 HD2 LYS B 26 9.611 -11.822 2.495 1.00 0.00 H new ATOM 0 HD3 LYS B 26 9.831 -13.316 3.383 1.00 0.00 H new ATOM 0 HE2 LYS B 26 12.208 -12.620 3.886 1.00 0.00 H new ATOM 0 HE3 LYS B 26 11.904 -11.095 3.079 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 11.063 -10.316 4.929 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 9.868 -11.522 4.945 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 11.359 -11.794 5.711 1.00 0.00 H new ATOM 1856 N LEU B 27 12.311 -8.990 -0.525 1.00 0.00 N ATOM 1857 CA LEU B 27 13.403 -8.210 -1.125 1.00 0.00 C ATOM 1858 C LEU B 27 14.579 -8.106 -0.154 1.00 0.00 C ATOM 1859 O LEU B 27 14.427 -7.498 0.906 1.00 0.00 O ATOM 1860 CB LEU B 27 12.954 -6.780 -1.459 1.00 0.00 C ATOM 1861 CG LEU B 27 11.998 -6.652 -2.650 1.00 0.00 C ATOM 1862 CD1 LEU B 27 11.496 -5.206 -2.689 1.00 0.00 C ATOM 1863 CD2 LEU B 27 12.654 -6.938 -4.003 1.00 0.00 C ATOM 0 H LEU B 27 11.706 -8.452 0.095 1.00 0.00 H new ATOM 0 HA LEU B 27 13.697 -8.728 -2.038 1.00 0.00 H new ATOM 0 HB2 LEU B 27 12.471 -6.354 -0.580 1.00 0.00 H new ATOM 0 HB3 LEU B 27 13.840 -6.177 -1.659 1.00 0.00 H new ATOM 0 HG LEU B 27 11.207 -7.388 -2.506 1.00 0.00 H new ATOM 0 HD11 LEU B 27 10.811 -5.081 -3.528 1.00 0.00 H new ATOM 0 HD12 LEU B 27 10.976 -4.976 -1.759 1.00 0.00 H new ATOM 0 HD13 LEU B 27 12.343 -4.530 -2.808 1.00 0.00 H new ATOM 0 HD21 LEU B 27 11.915 -6.827 -4.796 1.00 0.00 H new ATOM 0 HD22 LEU B 27 13.471 -6.235 -4.167 1.00 0.00 H new ATOM 0 HD23 LEU B 27 13.044 -7.956 -4.010 1.00 0.00 H new ATOM 1875 N LYS B 28 15.746 -8.653 -0.515 1.00 0.00 N ATOM 1876 CA LYS B 28 16.987 -8.425 0.223 1.00 0.00 C ATOM 1877 C LYS B 28 17.592 -7.075 -0.182 1.00 0.00 C ATOM 1878 O LYS B 28 17.243 -6.549 -1.234 1.00 0.00 O ATOM 1879 CB LYS B 28 17.926 -9.618 0.013 1.00 0.00 C ATOM 1880 CG LYS B 28 19.114 -9.585 0.984 1.00 0.00 C ATOM 1881 CD LYS B 28 19.527 -11.012 1.359 1.00 0.00 C ATOM 1882 CE LYS B 28 20.762 -10.995 2.265 1.00 0.00 C ATOM 1883 NZ LYS B 28 21.140 -12.360 2.673 1.00 0.00 N ATOM 0 H LYS B 28 15.853 -9.264 -1.325 1.00 0.00 H new ATOM 0 HA LYS B 28 16.800 -8.361 1.295 1.00 0.00 H new ATOM 0 HB2 LYS B 28 17.371 -10.546 0.149 1.00 0.00 H new ATOM 0 HB3 LYS B 28 18.295 -9.615 -1.013 1.00 0.00 H new ATOM 0 HG2 LYS B 28 19.954 -9.064 0.525 1.00 0.00 H new ATOM 0 HG3 LYS B 28 18.845 -9.028 1.882 1.00 0.00 H new ATOM 0 HD2 LYS B 28 18.703 -11.513 1.867 1.00 0.00 H new ATOM 0 HD3 LYS B 28 19.740 -11.584 0.456 1.00 0.00 H new ATOM 0 HE2 LYS B 28 21.594 -10.525 1.741 1.00 0.00 H new ATOM 0 HE3 LYS B 28 20.560 -10.391 3.149 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 21.979 -12.319 3.286 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 20.353 -12.798 3.193 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 21.355 -12.928 1.829 1.00 0.00 H new ATOM 1897 N LYS B 29 18.490 -6.505 0.634 1.00 0.00 N ATOM 1898 CA LYS B 29 18.972 -5.129 0.489 1.00 0.00 C ATOM 1899 C LYS B 29 19.505 -4.792 -0.903 1.00 0.00 C ATOM 1900 O LYS B 29 19.241 -3.703 -1.412 1.00 0.00 O ATOM 1901 CB LYS B 29 19.965 -4.790 1.615 1.00 0.00 C ATOM 1902 CG LYS B 29 21.237 -5.649 1.621 1.00 0.00 C ATOM 1903 CD LYS B 29 22.150 -5.193 2.768 1.00 0.00 C ATOM 1904 CE LYS B 29 23.488 -5.940 2.768 1.00 0.00 C ATOM 1905 NZ LYS B 29 23.316 -7.383 3.015 1.00 0.00 N ATOM 0 H LYS B 29 18.907 -6.997 1.425 1.00 0.00 H new ATOM 0 HA LYS B 29 18.104 -4.478 0.594 1.00 0.00 H new ATOM 0 HB2 LYS B 29 20.250 -3.742 1.528 1.00 0.00 H new ATOM 0 HB3 LYS B 29 19.460 -4.904 2.574 1.00 0.00 H new ATOM 0 HG2 LYS B 29 20.979 -6.701 1.742 1.00 0.00 H new ATOM 0 HG3 LYS B 29 21.757 -5.556 0.668 1.00 0.00 H new ATOM 0 HD2 LYS B 29 22.333 -4.122 2.682 1.00 0.00 H new ATOM 0 HD3 LYS B 29 21.644 -5.355 3.720 1.00 0.00 H new ATOM 0 HE2 LYS B 29 23.985 -5.793 1.809 1.00 0.00 H new ATOM 0 HE3 LYS B 29 24.139 -5.517 3.533 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 24.249 -7.836 3.091 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 22.790 -7.523 3.901 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 22.787 -7.809 2.227 1.00 0.00 H new ATOM 1919 N SER B 30 20.208 -5.728 -1.535 1.00 0.00 N ATOM 1920 CA SER B 30 20.642 -5.613 -2.913 1.00 0.00 C ATOM 1921 C SER B 30 19.446 -5.317 -3.824 1.00 0.00 C ATOM 1922 O SER B 30 19.469 -4.372 -4.613 1.00 0.00 O ATOM 1923 CB SER B 30 21.298 -6.950 -3.285 1.00 0.00 C ATOM 1924 OG SER B 30 20.683 -7.998 -2.544 1.00 0.00 O ATOM 0 H SER B 30 20.494 -6.601 -1.091 1.00 0.00 H new ATOM 0 HA SER B 30 21.349 -4.793 -3.036 1.00 0.00 H new ATOM 0 HB2 SER B 30 21.193 -7.135 -4.354 1.00 0.00 H new ATOM 0 HB3 SER B 30 22.366 -6.916 -3.071 1.00 0.00 H new ATOM 0 HG SER B 30 20.927 -8.862 -2.936 1.00 0.00 H new ATOM 1930 N GLU B 31 18.390 -6.123 -3.694 1.00 0.00 N ATOM 1931 CA GLU B 31 17.221 -6.044 -4.548 1.00 0.00 C ATOM 1932 C GLU B 31 16.420 -4.803 -4.199 1.00 0.00 C ATOM 1933 O GLU B 31 16.025 -4.061 -5.088 1.00 0.00 O ATOM 1934 CB GLU B 31 16.375 -7.316 -4.427 1.00 0.00 C ATOM 1935 CG GLU B 31 17.227 -8.573 -4.623 1.00 0.00 C ATOM 1936 CD GLU B 31 18.129 -8.488 -5.852 1.00 0.00 C ATOM 1937 OE1 GLU B 31 17.595 -8.134 -6.927 1.00 0.00 O ATOM 1938 OE2 GLU B 31 19.340 -8.755 -5.695 1.00 0.00 O ATOM 0 H GLU B 31 18.330 -6.853 -2.984 1.00 0.00 H new ATOM 0 HA GLU B 31 17.538 -5.967 -5.588 1.00 0.00 H new ATOM 0 HB2 GLU B 31 15.899 -7.346 -3.447 1.00 0.00 H new ATOM 0 HB3 GLU B 31 15.577 -7.296 -5.169 1.00 0.00 H new ATOM 0 HG2 GLU B 31 17.841 -8.732 -3.737 1.00 0.00 H new ATOM 0 HG3 GLU B 31 16.572 -9.440 -4.717 1.00 0.00 H new ATOM 1945 N LEU B 32 16.214 -4.573 -2.903 1.00 0.00 N ATOM 1946 CA LEU B 32 15.481 -3.443 -2.365 1.00 0.00 C ATOM 1947 C LEU B 32 16.090 -2.154 -2.915 1.00 0.00 C ATOM 1948 O LEU B 32 15.372 -1.306 -3.440 1.00 0.00 O ATOM 1949 CB LEU B 32 15.544 -3.529 -0.831 1.00 0.00 C ATOM 1950 CG LEU B 32 14.681 -2.546 -0.023 1.00 0.00 C ATOM 1951 CD1 LEU B 32 15.285 -1.140 0.051 1.00 0.00 C ATOM 1952 CD2 LEU B 32 13.225 -2.511 -0.495 1.00 0.00 C ATOM 0 H LEU B 32 16.569 -5.196 -2.177 1.00 0.00 H new ATOM 0 HA LEU B 32 14.432 -3.452 -2.661 1.00 0.00 H new ATOM 0 HB2 LEU B 32 15.261 -4.541 -0.540 1.00 0.00 H new ATOM 0 HB3 LEU B 32 16.582 -3.389 -0.530 1.00 0.00 H new ATOM 0 HG LEU B 32 14.675 -2.936 0.995 1.00 0.00 H new ATOM 0 HD11 LEU B 32 14.630 -0.493 0.634 1.00 0.00 H new ATOM 0 HD12 LEU B 32 16.264 -1.189 0.527 1.00 0.00 H new ATOM 0 HD13 LEU B 32 15.391 -0.736 -0.956 1.00 0.00 H new ATOM 0 HD21 LEU B 32 12.663 -1.800 0.111 1.00 0.00 H new ATOM 0 HD22 LEU B 32 13.189 -2.205 -1.540 1.00 0.00 H new ATOM 0 HD23 LEU B 32 12.785 -3.503 -0.392 1.00 0.00 H new ATOM 1964 N LYS B 33 17.416 -2.024 -2.843 1.00 0.00 N ATOM 1965 CA LYS B 33 18.100 -0.854 -3.360 1.00 0.00 C ATOM 1966 C LYS B 33 17.759 -0.643 -4.837 1.00 0.00 C ATOM 1967 O LYS B 33 17.184 0.388 -5.195 1.00 0.00 O ATOM 1968 CB LYS B 33 19.607 -1.018 -3.118 1.00 0.00 C ATOM 1969 CG LYS B 33 20.440 0.087 -3.787 1.00 0.00 C ATOM 1970 CD LYS B 33 21.901 0.059 -3.320 1.00 0.00 C ATOM 1971 CE LYS B 33 22.670 1.228 -3.951 1.00 0.00 C ATOM 1972 NZ LYS B 33 24.017 1.374 -3.370 1.00 0.00 N ATOM 0 H LYS B 33 18.033 -2.722 -2.428 1.00 0.00 H new ATOM 0 HA LYS B 33 17.768 0.043 -2.838 1.00 0.00 H new ATOM 0 HB2 LYS B 33 19.801 -1.014 -2.045 1.00 0.00 H new ATOM 0 HB3 LYS B 33 19.928 -1.988 -3.496 1.00 0.00 H new ATOM 0 HG2 LYS B 33 20.402 -0.034 -4.870 1.00 0.00 H new ATOM 0 HG3 LYS B 33 20.004 1.060 -3.559 1.00 0.00 H new ATOM 0 HD2 LYS B 33 21.946 0.126 -2.233 1.00 0.00 H new ATOM 0 HD3 LYS B 33 22.364 -0.887 -3.601 1.00 0.00 H new ATOM 0 HE2 LYS B 33 22.753 1.070 -5.026 1.00 0.00 H new ATOM 0 HE3 LYS B 33 22.110 2.152 -3.807 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 24.070 2.264 -2.835 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 24.209 0.575 -2.732 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 24.724 1.386 -4.132 1.00 0.00 H new ATOM 1986 N GLU B 34 18.108 -1.598 -5.704 1.00 0.00 N ATOM 1987 CA GLU B 34 17.931 -1.385 -7.135 1.00 0.00 C ATOM 1988 C GLU B 34 16.451 -1.168 -7.455 1.00 0.00 C ATOM 1989 O GLU B 34 16.122 -0.259 -8.206 1.00 0.00 O ATOM 1990 CB GLU B 34 18.579 -2.511 -7.960 1.00 0.00 C ATOM 1991 CG GLU B 34 17.985 -3.897 -7.681 1.00 0.00 C ATOM 1992 CD GLU B 34 18.733 -5.011 -8.409 1.00 0.00 C ATOM 1993 OE1 GLU B 34 18.447 -5.188 -9.612 1.00 0.00 O ATOM 1994 OE2 GLU B 34 19.576 -5.663 -7.755 1.00 0.00 O ATOM 0 H GLU B 34 18.504 -2.502 -5.446 1.00 0.00 H new ATOM 0 HA GLU B 34 18.456 -0.476 -7.427 1.00 0.00 H new ATOM 0 HB2 GLU B 34 18.467 -2.284 -9.020 1.00 0.00 H new ATOM 0 HB3 GLU B 34 19.648 -2.534 -7.750 1.00 0.00 H new ATOM 0 HG2 GLU B 34 18.008 -4.089 -6.608 1.00 0.00 H new ATOM 0 HG3 GLU B 34 16.938 -3.908 -7.985 1.00 0.00 H new ATOM 2001 N LEU B 35 15.564 -1.956 -6.845 1.00 0.00 N ATOM 2002 CA LEU B 35 14.119 -1.828 -6.959 1.00 0.00 C ATOM 2003 C LEU B 35 13.689 -0.392 -6.660 1.00 0.00 C ATOM 2004 O LEU B 35 13.078 0.242 -7.519 1.00 0.00 O ATOM 2005 CB LEU B 35 13.491 -2.869 -6.016 1.00 0.00 C ATOM 2006 CG LEU B 35 11.982 -2.848 -5.722 1.00 0.00 C ATOM 2007 CD1 LEU B 35 11.643 -1.965 -4.517 1.00 0.00 C ATOM 2008 CD2 LEU B 35 11.101 -2.466 -6.910 1.00 0.00 C ATOM 0 H LEU B 35 15.847 -2.726 -6.238 1.00 0.00 H new ATOM 0 HA LEU B 35 13.772 -2.028 -7.973 1.00 0.00 H new ATOM 0 HB2 LEU B 35 13.726 -3.853 -6.422 1.00 0.00 H new ATOM 0 HB3 LEU B 35 14.006 -2.788 -5.059 1.00 0.00 H new ATOM 0 HG LEU B 35 11.748 -3.887 -5.489 1.00 0.00 H new ATOM 0 HD11 LEU B 35 10.567 -1.980 -4.346 1.00 0.00 H new ATOM 0 HD12 LEU B 35 12.156 -2.343 -3.633 1.00 0.00 H new ATOM 0 HD13 LEU B 35 11.965 -0.942 -4.713 1.00 0.00 H new ATOM 0 HD21 LEU B 35 10.054 -2.479 -6.606 1.00 0.00 H new ATOM 0 HD22 LEU B 35 11.367 -1.466 -7.254 1.00 0.00 H new ATOM 0 HD23 LEU B 35 11.252 -3.180 -7.720 1.00 0.00 H new ATOM 2020 N ILE B 36 14.037 0.164 -5.494 1.00 0.00 N ATOM 2021 CA ILE B 36 13.560 1.502 -5.164 1.00 0.00 C ATOM 2022 C ILE B 36 14.194 2.532 -6.105 1.00 0.00 C ATOM 2023 O ILE B 36 13.478 3.376 -6.632 1.00 0.00 O ATOM 2024 CB ILE B 36 13.725 1.851 -3.671 1.00 0.00 C ATOM 2025 CG1 ILE B 36 12.939 0.870 -2.781 1.00 0.00 C ATOM 2026 CG2 ILE B 36 13.165 3.257 -3.405 1.00 0.00 C ATOM 2027 CD1 ILE B 36 13.051 1.196 -1.288 1.00 0.00 C ATOM 0 H ILE B 36 14.627 -0.277 -4.788 1.00 0.00 H new ATOM 0 HA ILE B 36 12.482 1.526 -5.326 1.00 0.00 H new ATOM 0 HB ILE B 36 14.788 1.795 -3.436 1.00 0.00 H new ATOM 0 HG12 ILE B 36 11.889 0.885 -3.073 1.00 0.00 H new ATOM 0 HG13 ILE B 36 13.304 -0.142 -2.955 1.00 0.00 H new ATOM 0 HG21 ILE B 36 13.283 3.502 -2.349 1.00 0.00 H new ATOM 0 HG22 ILE B 36 13.707 3.985 -4.009 1.00 0.00 H new ATOM 0 HG23 ILE B 36 12.108 3.283 -3.668 1.00 0.00 H new ATOM 0 HD11 ILE B 36 12.476 0.470 -0.713 1.00 0.00 H new ATOM 0 HD12 ILE B 36 14.097 1.154 -0.984 1.00 0.00 H new ATOM 0 HD13 ILE B 36 12.660 2.196 -1.104 1.00 0.00 H new ATOM 2039 N ASN B 37 15.508 2.473 -6.348 1.00 0.00 N ATOM 2040 CA ASN B 37 16.157 3.436 -7.247 1.00 0.00 C ATOM 2041 C ASN B 37 15.487 3.418 -8.623 1.00 0.00 C ATOM 2042 O ASN B 37 15.120 4.453 -9.174 1.00 0.00 O ATOM 2043 CB ASN B 37 17.649 3.124 -7.430 1.00 0.00 C ATOM 2044 CG ASN B 37 18.505 3.578 -6.257 1.00 0.00 C ATOM 2045 OD1 ASN B 37 19.111 4.642 -6.285 1.00 0.00 O ATOM 2046 ND2 ASN B 37 18.594 2.767 -5.215 1.00 0.00 N ATOM 0 H ASN B 37 16.136 1.780 -5.942 1.00 0.00 H new ATOM 0 HA ASN B 37 16.053 4.419 -6.788 1.00 0.00 H new ATOM 0 HB2 ASN B 37 17.775 2.050 -7.569 1.00 0.00 H new ATOM 0 HB3 ASN B 37 18.006 3.607 -8.340 1.00 0.00 H new ATOM 0 HD21 ASN B 37 19.175 3.024 -4.417 1.00 0.00 H new ATOM 0 HD22 ASN B 37 18.082 1.885 -5.210 1.00 0.00 H new ATOM 2053 N ASN B 38 15.371 2.216 -9.183 1.00 0.00 N ATOM 2054 CA ASN B 38 14.840 1.963 -10.509 1.00 0.00 C ATOM 2055 C ASN B 38 13.396 2.440 -10.613 1.00 0.00 C ATOM 2056 O ASN B 38 13.026 3.089 -11.591 1.00 0.00 O ATOM 2057 CB ASN B 38 14.928 0.459 -10.791 1.00 0.00 C ATOM 2058 CG ASN B 38 14.428 0.109 -12.183 1.00 0.00 C ATOM 2059 OD1 ASN B 38 13.278 -0.287 -12.356 1.00 0.00 O ATOM 2060 ND2 ASN B 38 15.310 0.208 -13.172 1.00 0.00 N ATOM 0 H ASN B 38 15.657 1.363 -8.703 1.00 0.00 H new ATOM 0 HA ASN B 38 15.424 2.513 -11.247 1.00 0.00 H new ATOM 0 HB2 ASN B 38 15.962 0.130 -10.684 1.00 0.00 H new ATOM 0 HB3 ASN B 38 14.343 -0.084 -10.049 1.00 0.00 H new ATOM 0 HD21 ASN B 38 15.042 -0.050 -14.122 1.00 0.00 H new ATOM 0 HD22 ASN B 38 16.255 0.542 -12.981 1.00 0.00 H new ATOM 2067 N GLU B 39 12.572 2.079 -9.626 1.00 0.00 N ATOM 2068 CA GLU B 39 11.141 2.287 -9.713 1.00 0.00 C ATOM 2069 C GLU B 39 10.705 3.652 -9.190 1.00 0.00 C ATOM 2070 O GLU B 39 9.899 4.308 -9.841 1.00 0.00 O ATOM 2071 CB GLU B 39 10.413 1.159 -8.987 1.00 0.00 C ATOM 2072 CG GLU B 39 10.589 -0.192 -9.702 1.00 0.00 C ATOM 2073 CD GLU B 39 9.890 -0.259 -11.058 1.00 0.00 C ATOM 2074 OE1 GLU B 39 8.996 0.586 -11.291 1.00 0.00 O ATOM 2075 OE2 GLU B 39 10.236 -1.178 -11.830 1.00 0.00 O ATOM 0 H GLU B 39 12.881 1.641 -8.759 1.00 0.00 H new ATOM 0 HA GLU B 39 10.871 2.272 -10.769 1.00 0.00 H new ATOM 0 HB2 GLU B 39 10.789 1.082 -7.967 1.00 0.00 H new ATOM 0 HB3 GLU B 39 9.352 1.397 -8.918 1.00 0.00 H new ATOM 0 HG2 GLU B 39 11.653 -0.385 -9.841 1.00 0.00 H new ATOM 0 HG3 GLU B 39 10.202 -0.986 -9.063 1.00 0.00 H new ATOM 2082 N LEU B 40 11.236 4.110 -8.054 1.00 0.00 N ATOM 2083 CA LEU B 40 10.933 5.432 -7.509 1.00 0.00 C ATOM 2084 C LEU B 40 11.936 6.436 -8.084 1.00 0.00 C ATOM 2085 O LEU B 40 12.521 7.234 -7.356 1.00 0.00 O ATOM 2086 CB LEU B 40 10.935 5.420 -5.967 1.00 0.00 C ATOM 2087 CG LEU B 40 9.634 4.880 -5.355 1.00 0.00 C ATOM 2088 CD1 LEU B 40 9.467 3.370 -5.546 1.00 0.00 C ATOM 2089 CD2 LEU B 40 9.611 5.206 -3.858 1.00 0.00 C ATOM 0 H LEU B 40 11.890 3.572 -7.486 1.00 0.00 H new ATOM 0 HA LEU B 40 9.927 5.731 -7.802 1.00 0.00 H new ATOM 0 HB2 LEU B 40 11.770 4.813 -5.618 1.00 0.00 H new ATOM 0 HB3 LEU B 40 11.104 6.434 -5.604 1.00 0.00 H new ATOM 0 HG LEU B 40 8.806 5.363 -5.874 1.00 0.00 H new ATOM 0 HD11 LEU B 40 8.530 3.047 -5.093 1.00 0.00 H new ATOM 0 HD12 LEU B 40 9.454 3.137 -6.611 1.00 0.00 H new ATOM 0 HD13 LEU B 40 10.298 2.849 -5.071 1.00 0.00 H new ATOM 0 HD21 LEU B 40 8.690 4.825 -3.417 1.00 0.00 H new ATOM 0 HD22 LEU B 40 10.467 4.739 -3.371 1.00 0.00 H new ATOM 0 HD23 LEU B 40 9.660 6.286 -3.720 1.00 0.00 H new ATOM 2101 N SER B 41 12.117 6.398 -9.404 1.00 0.00 N ATOM 2102 CA SER B 41 13.156 7.107 -10.130 1.00 0.00 C ATOM 2103 C SER B 41 12.962 8.624 -10.102 1.00 0.00 C ATOM 2104 O SER B 41 13.910 9.375 -10.322 1.00 0.00 O ATOM 2105 CB SER B 41 13.143 6.568 -11.562 1.00 0.00 C ATOM 2106 OG SER B 41 11.799 6.433 -11.998 1.00 0.00 O ATOM 0 H SER B 41 11.515 5.848 -10.017 1.00 0.00 H new ATOM 0 HA SER B 41 14.122 6.935 -9.656 1.00 0.00 H new ATOM 0 HB2 SER B 41 13.686 7.244 -12.223 1.00 0.00 H new ATOM 0 HB3 SER B 41 13.650 5.604 -11.605 1.00 0.00 H new ATOM 0 HG SER B 41 11.728 5.668 -12.606 1.00 0.00 H new ATOM 2112 N HIS B 42 11.723 9.083 -9.928 1.00 0.00 N ATOM 2113 CA HIS B 42 11.390 10.486 -9.704 1.00 0.00 C ATOM 2114 C HIS B 42 11.038 10.716 -8.234 1.00 0.00 C ATOM 2115 O HIS B 42 11.407 11.730 -7.648 1.00 0.00 O ATOM 2116 CB HIS B 42 10.259 10.896 -10.652 1.00 0.00 C ATOM 2117 CG HIS B 42 10.602 10.660 -12.104 1.00 0.00 C ATOM 2118 ND1 HIS B 42 11.857 10.387 -12.605 1.00 0.00 N ATOM 2119 CD2 HIS B 42 9.722 10.623 -13.152 1.00 0.00 C ATOM 2120 CE1 HIS B 42 11.730 10.193 -13.928 1.00 0.00 C ATOM 2121 NE2 HIS B 42 10.449 10.333 -14.310 1.00 0.00 N ATOM 0 H HIS B 42 10.905 8.474 -9.939 1.00 0.00 H new ATOM 0 HA HIS B 42 12.251 11.118 -9.924 1.00 0.00 H new ATOM 0 HB2 HIS B 42 9.358 10.336 -10.400 1.00 0.00 H new ATOM 0 HB3 HIS B 42 10.031 11.951 -10.504 1.00 0.00 H new ATOM 0 HD2 HIS B 42 8.656 10.788 -13.094 1.00 0.00 H new ATOM 0 HE1 HIS B 42 12.546 9.957 -14.594 1.00 0.00 H new ATOM 0 HE2 HIS B 42 10.081 10.245 -15.257 1.00 0.00 H new ATOM 2129 N PHE B 43 10.289 9.775 -7.655 1.00 0.00 N ATOM 2130 CA PHE B 43 9.788 9.839 -6.292 1.00 0.00 C ATOM 2131 C PHE B 43 10.920 10.002 -5.274 1.00 0.00 C ATOM 2132 O PHE B 43 10.783 10.826 -4.373 1.00 0.00 O ATOM 2133 CB PHE B 43 8.940 8.593 -5.991 1.00 0.00 C ATOM 2134 CG PHE B 43 7.459 8.669 -6.332 1.00 0.00 C ATOM 2135 CD1 PHE B 43 6.987 9.373 -7.459 1.00 0.00 C ATOM 2136 CD2 PHE B 43 6.549 7.932 -5.554 1.00 0.00 C ATOM 2137 CE1 PHE B 43 5.626 9.313 -7.809 1.00 0.00 C ATOM 2138 CE2 PHE B 43 5.175 7.947 -5.847 1.00 0.00 C ATOM 2139 CZ PHE B 43 4.723 8.584 -7.015 1.00 0.00 C ATOM 0 H PHE B 43 10.009 8.924 -8.142 1.00 0.00 H new ATOM 0 HA PHE B 43 9.158 10.724 -6.201 1.00 0.00 H new ATOM 0 HB2 PHE B 43 9.370 7.751 -6.533 1.00 0.00 H new ATOM 0 HB3 PHE B 43 9.032 8.368 -4.928 1.00 0.00 H new ATOM 0 HD1 PHE B 43 7.672 9.959 -8.054 1.00 0.00 H new ATOM 0 HD2 PHE B 43 6.911 7.347 -4.721 1.00 0.00 H new ATOM 0 HE1 PHE B 43 5.273 9.828 -8.690 1.00 0.00 H new ATOM 0 HE2 PHE B 43 4.471 7.472 -5.179 1.00 0.00 H new ATOM 0 HZ PHE B 43 3.684 8.514 -7.302 1.00 0.00 H new ATOM 2149 N LEU B 44 11.994 9.207 -5.375 1.00 0.00 N ATOM 2150 CA LEU B 44 13.178 9.321 -4.527 1.00 0.00 C ATOM 2151 C LEU B 44 14.411 9.699 -5.353 1.00 0.00 C ATOM 2152 O LEU B 44 14.458 9.481 -6.561 1.00 0.00 O ATOM 2153 CB LEU B 44 13.418 8.016 -3.742 1.00 0.00 C ATOM 2154 CG LEU B 44 13.042 8.151 -2.257 1.00 0.00 C ATOM 2155 CD1 LEU B 44 11.527 8.211 -2.040 1.00 0.00 C ATOM 2156 CD2 LEU B 44 13.609 6.973 -1.459 1.00 0.00 C ATOM 0 H LEU B 44 12.061 8.455 -6.061 1.00 0.00 H new ATOM 0 HA LEU B 44 13.001 10.120 -3.807 1.00 0.00 H new ATOM 0 HB2 LEU B 44 12.834 7.212 -4.191 1.00 0.00 H new ATOM 0 HB3 LEU B 44 14.467 7.733 -3.825 1.00 0.00 H new ATOM 0 HG LEU B 44 13.472 9.090 -1.909 1.00 0.00 H new ATOM 0 HD11 LEU B 44 11.315 8.306 -0.975 1.00 0.00 H new ATOM 0 HD12 LEU B 44 11.117 9.071 -2.570 1.00 0.00 H new ATOM 0 HD13 LEU B 44 11.068 7.298 -2.421 1.00 0.00 H new ATOM 0 HD21 LEU B 44 13.336 7.080 -0.409 1.00 0.00 H new ATOM 0 HD22 LEU B 44 13.200 6.040 -1.847 1.00 0.00 H new ATOM 0 HD23 LEU B 44 14.695 6.960 -1.552 1.00 0.00 H new ATOM 2168 N GLU B 45 15.418 10.259 -4.673 1.00 0.00 N ATOM 2169 CA GLU B 45 16.747 10.495 -5.222 1.00 0.00 C ATOM 2170 C GLU B 45 17.549 9.192 -5.109 1.00 0.00 C ATOM 2171 O GLU B 45 17.219 8.336 -4.290 1.00 0.00 O ATOM 2172 CB GLU B 45 17.393 11.659 -4.447 1.00 0.00 C ATOM 2173 CG GLU B 45 18.826 12.024 -4.862 1.00 0.00 C ATOM 2174 CD GLU B 45 18.933 12.398 -6.338 1.00 0.00 C ATOM 2175 OE1 GLU B 45 18.729 13.593 -6.641 1.00 0.00 O ATOM 2176 OE2 GLU B 45 19.212 11.476 -7.135 1.00 0.00 O ATOM 0 H GLU B 45 15.324 10.565 -3.705 1.00 0.00 H new ATOM 0 HA GLU B 45 16.714 10.777 -6.274 1.00 0.00 H new ATOM 0 HB2 GLU B 45 16.765 12.542 -4.564 1.00 0.00 H new ATOM 0 HB3 GLU B 45 17.395 11.408 -3.386 1.00 0.00 H new ATOM 0 HG2 GLU B 45 19.175 12.858 -4.254 1.00 0.00 H new ATOM 0 HG3 GLU B 45 19.486 11.181 -4.656 1.00 0.00 H new ATOM 2183 N GLU B 46 18.600 9.050 -5.923 1.00 0.00 N ATOM 2184 CA GLU B 46 19.484 7.893 -5.949 1.00 0.00 C ATOM 2185 C GLU B 46 19.942 7.522 -4.538 1.00 0.00 C ATOM 2186 O GLU B 46 20.641 8.292 -3.882 1.00 0.00 O ATOM 2187 CB GLU B 46 20.681 8.198 -6.863 1.00 0.00 C ATOM 2188 CG GLU B 46 21.749 7.096 -6.823 1.00 0.00 C ATOM 2189 CD GLU B 46 22.881 7.387 -7.801 1.00 0.00 C ATOM 2190 OE1 GLU B 46 22.734 6.985 -8.975 1.00 0.00 O ATOM 2191 OE2 GLU B 46 23.868 8.014 -7.357 1.00 0.00 O ATOM 0 H GLU B 46 18.863 9.764 -6.602 1.00 0.00 H new ATOM 0 HA GLU B 46 18.944 7.033 -6.345 1.00 0.00 H new ATOM 0 HB2 GLU B 46 20.329 8.321 -7.887 1.00 0.00 H new ATOM 0 HB3 GLU B 46 21.130 9.145 -6.564 1.00 0.00 H new ATOM 0 HG2 GLU B 46 22.150 7.012 -5.813 1.00 0.00 H new ATOM 0 HG3 GLU B 46 21.293 6.136 -7.066 1.00 0.00 H new ATOM 2198 N ILE B 47 19.590 6.318 -4.091 1.00 0.00 N ATOM 2199 CA ILE B 47 19.742 5.878 -2.712 1.00 0.00 C ATOM 2200 C ILE B 47 21.128 5.262 -2.533 1.00 0.00 C ATOM 2201 O ILE B 47 21.279 4.073 -2.265 1.00 0.00 O ATOM 2202 CB ILE B 47 18.578 4.957 -2.304 1.00 0.00 C ATOM 2203 CG1 ILE B 47 17.262 5.489 -2.898 1.00 0.00 C ATOM 2204 CG2 ILE B 47 18.479 4.934 -0.771 1.00 0.00 C ATOM 2205 CD1 ILE B 47 16.071 4.589 -2.628 1.00 0.00 C ATOM 0 H ILE B 47 19.181 5.606 -4.696 1.00 0.00 H new ATOM 0 HA ILE B 47 19.685 6.725 -2.028 1.00 0.00 H new ATOM 0 HB ILE B 47 18.755 3.949 -2.680 1.00 0.00 H new ATOM 0 HG12 ILE B 47 17.061 6.478 -2.487 1.00 0.00 H new ATOM 0 HG13 ILE B 47 17.380 5.609 -3.975 1.00 0.00 H new ATOM 0 HG21 ILE B 47 17.657 4.284 -0.469 1.00 0.00 H new ATOM 0 HG22 ILE B 47 19.412 4.558 -0.352 1.00 0.00 H new ATOM 0 HG23 ILE B 47 18.297 5.944 -0.403 1.00 0.00 H new ATOM 0 HD11 ILE B 47 15.177 5.024 -3.075 1.00 0.00 H new ATOM 0 HD12 ILE B 47 16.252 3.606 -3.063 1.00 0.00 H new ATOM 0 HD13 ILE B 47 15.927 4.489 -1.552 1.00 0.00 H new ATOM 2217 N LYS B 48 22.142 6.103 -2.737 1.00 0.00 N ATOM 2218 CA LYS B 48 23.550 5.739 -2.800 1.00 0.00 C ATOM 2219 C LYS B 48 23.994 4.901 -1.593 1.00 0.00 C ATOM 2220 O LYS B 48 24.598 3.840 -1.741 1.00 0.00 O ATOM 2221 CB LYS B 48 24.339 7.053 -2.901 1.00 0.00 C ATOM 2222 CG LYS B 48 25.854 6.860 -3.029 1.00 0.00 C ATOM 2223 CD LYS B 48 26.584 8.179 -3.334 1.00 0.00 C ATOM 2224 CE LYS B 48 26.356 9.276 -2.281 1.00 0.00 C ATOM 2225 NZ LYS B 48 25.153 10.085 -2.557 1.00 0.00 N ATOM 0 H LYS B 48 21.992 7.103 -2.869 1.00 0.00 H new ATOM 0 HA LYS B 48 23.736 5.104 -3.666 1.00 0.00 H new ATOM 0 HB2 LYS B 48 23.980 7.615 -3.763 1.00 0.00 H new ATOM 0 HB3 LYS B 48 24.133 7.658 -2.018 1.00 0.00 H new ATOM 0 HG2 LYS B 48 26.244 6.436 -2.103 1.00 0.00 H new ATOM 0 HG3 LYS B 48 26.061 6.140 -3.821 1.00 0.00 H new ATOM 0 HD2 LYS B 48 27.653 7.981 -3.413 1.00 0.00 H new ATOM 0 HD3 LYS B 48 26.256 8.548 -4.306 1.00 0.00 H new ATOM 0 HE2 LYS B 48 26.263 8.816 -1.297 1.00 0.00 H new ATOM 0 HE3 LYS B 48 27.228 9.929 -2.247 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 25.435 11.061 -2.781 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 24.640 9.679 -3.365 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 24.536 10.086 -1.720 1.00 0.00 H new ATOM 2239 N GLU B 49 23.741 5.419 -0.391 1.00 0.00 N ATOM 2240 CA GLU B 49 24.270 4.884 0.853 1.00 0.00 C ATOM 2241 C GLU B 49 23.584 3.562 1.229 1.00 0.00 C ATOM 2242 O GLU B 49 22.464 3.560 1.742 1.00 0.00 O ATOM 2243 CB GLU B 49 24.138 5.974 1.930 1.00 0.00 C ATOM 2244 CG GLU B 49 24.598 5.549 3.330 1.00 0.00 C ATOM 2245 CD GLU B 49 26.004 4.964 3.368 1.00 0.00 C ATOM 2246 OE1 GLU B 49 26.096 3.728 3.194 1.00 0.00 O ATOM 2247 OE2 GLU B 49 26.946 5.756 3.584 1.00 0.00 O ATOM 0 H GLU B 49 23.150 6.239 -0.258 1.00 0.00 H new ATOM 0 HA GLU B 49 25.325 4.630 0.748 1.00 0.00 H new ATOM 0 HB2 GLU B 49 24.717 6.844 1.620 1.00 0.00 H new ATOM 0 HB3 GLU B 49 23.096 6.288 1.984 1.00 0.00 H new ATOM 0 HG2 GLU B 49 24.557 6.413 3.993 1.00 0.00 H new ATOM 0 HG3 GLU B 49 23.898 4.812 3.723 1.00 0.00 H new ATOM 2254 N GLN B 50 24.282 2.436 1.036 1.00 0.00 N ATOM 2255 CA GLN B 50 23.799 1.105 1.396 1.00 0.00 C ATOM 2256 C GLN B 50 23.364 1.031 2.869 1.00 0.00 C ATOM 2257 O GLN B 50 22.415 0.325 3.204 1.00 0.00 O ATOM 2258 CB GLN B 50 24.850 0.038 1.050 1.00 0.00 C ATOM 2259 CG GLN B 50 24.230 -1.371 1.017 1.00 0.00 C ATOM 2260 CD GLN B 50 25.268 -2.459 0.757 1.00 0.00 C ATOM 2261 OE1 GLN B 50 25.441 -3.366 1.564 1.00 0.00 O ATOM 2262 NE2 GLN B 50 25.958 -2.388 -0.377 1.00 0.00 N ATOM 0 H GLN B 50 25.213 2.428 0.618 1.00 0.00 H new ATOM 0 HA GLN B 50 22.908 0.899 0.803 1.00 0.00 H new ATOM 0 HB2 GLN B 50 25.295 0.264 0.081 1.00 0.00 H new ATOM 0 HB3 GLN B 50 25.655 0.066 1.785 1.00 0.00 H new ATOM 0 HG2 GLN B 50 23.732 -1.568 1.966 1.00 0.00 H new ATOM 0 HG3 GLN B 50 23.465 -1.410 0.241 1.00 0.00 H new ATOM 0 HE21 GLN B 50 25.791 -1.621 -1.028 1.00 0.00 H new ATOM 0 HE22 GLN B 50 26.654 -3.101 -0.596 1.00 0.00 H new ATOM 2271 N GLU B 51 24.011 1.791 3.759 1.00 0.00 N ATOM 2272 CA GLU B 51 23.586 1.829 5.154 1.00 0.00 C ATOM 2273 C GLU B 51 22.116 2.266 5.235 1.00 0.00 C ATOM 2274 O GLU B 51 21.341 1.724 6.022 1.00 0.00 O ATOM 2275 CB GLU B 51 24.498 2.773 5.950 1.00 0.00 C ATOM 2276 CG GLU B 51 24.241 2.703 7.461 1.00 0.00 C ATOM 2277 CD GLU B 51 25.123 3.692 8.218 1.00 0.00 C ATOM 2278 OE1 GLU B 51 25.019 4.898 7.906 1.00 0.00 O ATOM 2279 OE2 GLU B 51 25.891 3.225 9.087 1.00 0.00 O ATOM 0 H GLU B 51 24.817 2.377 3.540 1.00 0.00 H new ATOM 0 HA GLU B 51 23.668 0.834 5.592 1.00 0.00 H new ATOM 0 HB2 GLU B 51 25.539 2.521 5.750 1.00 0.00 H new ATOM 0 HB3 GLU B 51 24.346 3.796 5.606 1.00 0.00 H new ATOM 0 HG2 GLU B 51 23.192 2.918 7.664 1.00 0.00 H new ATOM 0 HG3 GLU B 51 24.434 1.692 7.819 1.00 0.00 H new ATOM 2286 N VAL B 52 21.717 3.226 4.396 1.00 0.00 N ATOM 2287 CA VAL B 52 20.356 3.720 4.398 1.00 0.00 C ATOM 2288 C VAL B 52 19.424 2.712 3.731 1.00 0.00 C ATOM 2289 O VAL B 52 18.329 2.504 4.241 1.00 0.00 O ATOM 2290 CB VAL B 52 20.258 5.129 3.801 1.00 0.00 C ATOM 2291 CG1 VAL B 52 18.799 5.605 3.825 1.00 0.00 C ATOM 2292 CG2 VAL B 52 21.090 6.103 4.643 1.00 0.00 C ATOM 0 H VAL B 52 22.326 3.671 3.709 1.00 0.00 H new ATOM 0 HA VAL B 52 20.025 3.823 5.431 1.00 0.00 H new ATOM 0 HB VAL B 52 20.627 5.100 2.776 1.00 0.00 H new ATOM 0 HG11 VAL B 52 18.736 6.607 3.400 1.00 0.00 H new ATOM 0 HG12 VAL B 52 18.184 4.922 3.239 1.00 0.00 H new ATOM 0 HG13 VAL B 52 18.440 5.625 4.854 1.00 0.00 H new ATOM 0 HG21 VAL B 52 21.019 7.104 4.217 1.00 0.00 H new ATOM 0 HG22 VAL B 52 20.711 6.116 5.665 1.00 0.00 H new ATOM 0 HG23 VAL B 52 22.132 5.783 4.646 1.00 0.00 H new ATOM 2302 N VAL B 53 19.819 2.058 2.630 1.00 0.00 N ATOM 2303 CA VAL B 53 18.952 1.043 2.041 1.00 0.00 C ATOM 2304 C VAL B 53 18.652 -0.050 3.077 1.00 0.00 C ATOM 2305 O VAL B 53 17.500 -0.442 3.271 1.00 0.00 O ATOM 2306 CB VAL B 53 19.473 0.516 0.690 1.00 0.00 C ATOM 2307 CG1 VAL B 53 20.085 1.629 -0.165 1.00 0.00 C ATOM 2308 CG2 VAL B 53 20.378 -0.719 0.770 1.00 0.00 C ATOM 0 H VAL B 53 20.704 2.210 2.146 1.00 0.00 H new ATOM 0 HA VAL B 53 18.000 1.506 1.781 1.00 0.00 H new ATOM 0 HB VAL B 53 18.579 0.155 0.182 1.00 0.00 H new ATOM 0 HG11 VAL B 53 20.439 1.211 -1.108 1.00 0.00 H new ATOM 0 HG12 VAL B 53 19.331 2.390 -0.366 1.00 0.00 H new ATOM 0 HG13 VAL B 53 20.922 2.079 0.369 1.00 0.00 H new ATOM 0 HG21 VAL B 53 20.689 -1.008 -0.234 1.00 0.00 H new ATOM 0 HG22 VAL B 53 21.258 -0.487 1.370 1.00 0.00 H new ATOM 0 HG23 VAL B 53 19.831 -1.542 1.231 1.00 0.00 H new ATOM 2318 N ASP B 54 19.693 -0.491 3.796 1.00 0.00 N ATOM 2319 CA ASP B 54 19.532 -1.399 4.921 1.00 0.00 C ATOM 2320 C ASP B 54 18.586 -0.799 5.969 1.00 0.00 C ATOM 2321 O ASP B 54 17.650 -1.462 6.407 1.00 0.00 O ATOM 2322 CB ASP B 54 20.890 -1.750 5.533 1.00 0.00 C ATOM 2323 CG ASP B 54 20.717 -2.794 6.631 1.00 0.00 C ATOM 2324 OD1 ASP B 54 20.699 -3.992 6.272 1.00 0.00 O ATOM 2325 OD2 ASP B 54 20.591 -2.374 7.802 1.00 0.00 O ATOM 0 H ASP B 54 20.660 -0.226 3.610 1.00 0.00 H new ATOM 0 HA ASP B 54 19.083 -2.323 4.557 1.00 0.00 H new ATOM 0 HB2 ASP B 54 21.558 -2.131 4.760 1.00 0.00 H new ATOM 0 HB3 ASP B 54 21.355 -0.854 5.943 1.00 0.00 H new ATOM 2330 N LYS B 55 18.802 0.458 6.366 1.00 0.00 N ATOM 2331 CA LYS B 55 17.989 1.095 7.394 1.00 0.00 C ATOM 2332 C LYS B 55 16.512 1.141 6.996 1.00 0.00 C ATOM 2333 O LYS B 55 15.654 0.800 7.811 1.00 0.00 O ATOM 2334 CB LYS B 55 18.531 2.494 7.712 1.00 0.00 C ATOM 2335 CG LYS B 55 17.758 3.224 8.823 1.00 0.00 C ATOM 2336 CD LYS B 55 16.638 4.114 8.263 1.00 0.00 C ATOM 2337 CE LYS B 55 16.024 4.978 9.368 1.00 0.00 C ATOM 2338 NZ LYS B 55 14.982 5.865 8.824 1.00 0.00 N ATOM 0 H LYS B 55 19.538 1.053 5.986 1.00 0.00 H new ATOM 0 HA LYS B 55 18.053 0.492 8.300 1.00 0.00 H new ATOM 0 HB2 LYS B 55 19.577 2.409 8.006 1.00 0.00 H new ATOM 0 HB3 LYS B 55 18.503 3.099 6.806 1.00 0.00 H new ATOM 0 HG2 LYS B 55 17.330 2.491 9.507 1.00 0.00 H new ATOM 0 HG3 LYS B 55 18.450 3.835 9.403 1.00 0.00 H new ATOM 0 HD2 LYS B 55 17.036 4.753 7.475 1.00 0.00 H new ATOM 0 HD3 LYS B 55 15.866 3.492 7.810 1.00 0.00 H new ATOM 0 HE2 LYS B 55 15.596 4.338 10.140 1.00 0.00 H new ATOM 0 HE3 LYS B 55 16.803 5.574 9.844 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 14.581 6.441 9.592 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 15.399 6.490 8.104 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 14.230 5.292 8.391 1.00 0.00 H new ATOM 2352 N VAL B 56 16.181 1.588 5.780 1.00 0.00 N ATOM 2353 CA VAL B 56 14.784 1.734 5.388 1.00 0.00 C ATOM 2354 C VAL B 56 14.084 0.373 5.361 1.00 0.00 C ATOM 2355 O VAL B 56 12.918 0.289 5.745 1.00 0.00 O ATOM 2356 CB VAL B 56 14.587 2.548 4.093 1.00 0.00 C ATOM 2357 CG1 VAL B 56 15.187 3.958 4.210 1.00 0.00 C ATOM 2358 CG2 VAL B 56 15.137 1.847 2.852 1.00 0.00 C ATOM 0 H VAL B 56 16.855 1.851 5.061 1.00 0.00 H new ATOM 0 HA VAL B 56 14.298 2.336 6.156 1.00 0.00 H new ATOM 0 HB VAL B 56 13.508 2.633 3.966 1.00 0.00 H new ATOM 0 HG11 VAL B 56 15.028 4.500 3.278 1.00 0.00 H new ATOM 0 HG12 VAL B 56 14.703 4.493 5.027 1.00 0.00 H new ATOM 0 HG13 VAL B 56 16.256 3.883 4.408 1.00 0.00 H new ATOM 0 HG21 VAL B 56 14.967 2.472 1.975 1.00 0.00 H new ATOM 0 HG22 VAL B 56 16.207 1.677 2.974 1.00 0.00 H new ATOM 0 HG23 VAL B 56 14.631 0.891 2.720 1.00 0.00 H new ATOM 2368 N MET B 57 14.776 -0.709 4.972 1.00 0.00 N ATOM 2369 CA MET B 57 14.171 -2.022 5.161 1.00 0.00 C ATOM 2370 C MET B 57 14.052 -2.350 6.647 1.00 0.00 C ATOM 2371 O MET B 57 12.965 -2.695 7.094 1.00 0.00 O ATOM 2372 CB MET B 57 14.821 -3.139 4.342 1.00 0.00 C ATOM 2373 CG MET B 57 16.275 -3.491 4.658 1.00 0.00 C ATOM 2374 SD MET B 57 16.766 -5.153 4.159 1.00 0.00 S ATOM 2375 CE MET B 57 16.012 -5.217 2.525 1.00 0.00 C ATOM 0 H MET B 57 15.704 -0.701 4.548 1.00 0.00 H new ATOM 0 HA MET B 57 13.162 -1.963 4.752 1.00 0.00 H new ATOM 0 HB2 MET B 57 14.222 -4.041 4.468 1.00 0.00 H new ATOM 0 HB3 MET B 57 14.763 -2.862 3.289 1.00 0.00 H new ATOM 0 HG2 MET B 57 16.926 -2.770 4.164 1.00 0.00 H new ATOM 0 HG3 MET B 57 16.437 -3.384 5.731 1.00 0.00 H new ATOM 0 HE1 MET B 57 16.362 -6.104 1.997 1.00 0.00 H new ATOM 0 HE2 MET B 57 14.928 -5.259 2.626 1.00 0.00 H new ATOM 0 HE3 MET B 57 16.290 -4.327 1.961 1.00 0.00 H new ATOM 2385 N GLU B 58 15.126 -2.196 7.428 1.00 0.00 N ATOM 2386 CA GLU B 58 15.161 -2.550 8.845 1.00 0.00 C ATOM 2387 C GLU B 58 13.995 -1.895 9.588 1.00 0.00 C ATOM 2388 O GLU B 58 13.321 -2.532 10.393 1.00 0.00 O ATOM 2389 CB GLU B 58 16.511 -2.116 9.430 1.00 0.00 C ATOM 2390 CG GLU B 58 16.606 -2.405 10.931 1.00 0.00 C ATOM 2391 CD GLU B 58 18.008 -2.120 11.457 1.00 0.00 C ATOM 2392 OE1 GLU B 58 18.370 -0.923 11.473 1.00 0.00 O ATOM 2393 OE2 GLU B 58 18.690 -3.100 11.827 1.00 0.00 O ATOM 0 H GLU B 58 16.008 -1.816 7.085 1.00 0.00 H new ATOM 0 HA GLU B 58 15.055 -3.629 8.961 1.00 0.00 H new ATOM 0 HB2 GLU B 58 17.315 -2.635 8.909 1.00 0.00 H new ATOM 0 HB3 GLU B 58 16.655 -1.050 9.256 1.00 0.00 H new ATOM 0 HG2 GLU B 58 15.881 -1.794 11.469 1.00 0.00 H new ATOM 0 HG3 GLU B 58 16.348 -3.447 11.121 1.00 0.00 H new ATOM 2400 N THR B 59 13.723 -0.642 9.234 1.00 0.00 N ATOM 2401 CA THR B 59 12.636 0.171 9.756 1.00 0.00 C ATOM 2402 C THR B 59 11.293 -0.554 9.592 1.00 0.00 C ATOM 2403 O THR B 59 10.445 -0.471 10.477 1.00 0.00 O ATOM 2404 CB THR B 59 12.656 1.507 8.987 1.00 0.00 C ATOM 2405 OG1 THR B 59 13.833 2.220 9.312 1.00 0.00 O ATOM 2406 CG2 THR B 59 11.444 2.415 9.213 1.00 0.00 C ATOM 0 H THR B 59 14.283 -0.145 8.542 1.00 0.00 H new ATOM 0 HA THR B 59 12.763 0.353 10.823 1.00 0.00 H new ATOM 0 HB THR B 59 12.622 1.230 7.933 1.00 0.00 H new ATOM 0 HG1 THR B 59 14.591 1.843 8.818 1.00 0.00 H new ATOM 0 HG21 THR B 59 11.558 3.327 8.627 1.00 0.00 H new ATOM 0 HG22 THR B 59 10.537 1.895 8.903 1.00 0.00 H new ATOM 0 HG23 THR B 59 11.373 2.670 10.270 1.00 0.00 H new ATOM 2414 N LEU B 60 11.086 -1.243 8.465 1.00 0.00 N ATOM 2415 CA LEU B 60 9.844 -1.942 8.151 1.00 0.00 C ATOM 2416 C LEU B 60 9.944 -3.457 8.325 1.00 0.00 C ATOM 2417 O LEU B 60 8.926 -4.135 8.239 1.00 0.00 O ATOM 2418 CB LEU B 60 9.412 -1.604 6.718 1.00 0.00 C ATOM 2419 CG LEU B 60 9.329 -0.091 6.460 1.00 0.00 C ATOM 2420 CD1 LEU B 60 8.858 0.144 5.026 1.00 0.00 C ATOM 2421 CD2 LEU B 60 8.357 0.586 7.431 1.00 0.00 C ATOM 0 H LEU B 60 11.793 -1.330 7.735 1.00 0.00 H new ATOM 0 HA LEU B 60 9.095 -1.598 8.864 1.00 0.00 H new ATOM 0 HB2 LEU B 60 10.118 -2.049 6.017 1.00 0.00 H new ATOM 0 HB3 LEU B 60 8.439 -2.055 6.521 1.00 0.00 H new ATOM 0 HG LEU B 60 10.318 0.341 6.612 1.00 0.00 H new ATOM 0 HD11 LEU B 60 8.796 1.215 4.834 1.00 0.00 H new ATOM 0 HD12 LEU B 60 9.566 -0.309 4.332 1.00 0.00 H new ATOM 0 HD13 LEU B 60 7.875 -0.307 4.887 1.00 0.00 H new ATOM 0 HD21 LEU B 60 8.321 1.655 7.223 1.00 0.00 H new ATOM 0 HD22 LEU B 60 7.362 0.158 7.307 1.00 0.00 H new ATOM 0 HD23 LEU B 60 8.696 0.427 8.455 1.00 0.00 H new ATOM 2433 N ASP B 61 11.144 -4.005 8.528 1.00 0.00 N ATOM 2434 CA ASP B 61 11.400 -5.442 8.489 1.00 0.00 C ATOM 2435 C ASP B 61 10.818 -6.170 9.700 1.00 0.00 C ATOM 2436 O ASP B 61 11.552 -6.668 10.551 1.00 0.00 O ATOM 2437 CB ASP B 61 12.901 -5.730 8.312 1.00 0.00 C ATOM 2438 CG ASP B 61 13.196 -7.221 8.128 1.00 0.00 C ATOM 2439 OD1 ASP B 61 12.253 -7.964 7.778 1.00 0.00 O ATOM 2440 OD2 ASP B 61 14.366 -7.612 8.341 1.00 0.00 O ATOM 0 H ASP B 61 11.977 -3.452 8.727 1.00 0.00 H new ATOM 0 HA ASP B 61 10.881 -5.839 7.617 1.00 0.00 H new ATOM 0 HB2 ASP B 61 13.273 -5.180 7.448 1.00 0.00 H new ATOM 0 HB3 ASP B 61 13.443 -5.361 9.182 1.00 0.00 H new ATOM 2445 N SER B 62 9.491 -6.293 9.717 1.00 0.00 N ATOM 2446 CA SER B 62 8.703 -7.106 10.629 1.00 0.00 C ATOM 2447 C SER B 62 9.343 -8.482 10.823 1.00 0.00 C ATOM 2448 O SER B 62 9.402 -9.003 11.934 1.00 0.00 O ATOM 2449 CB SER B 62 7.307 -7.254 10.016 1.00 0.00 C ATOM 2450 OG SER B 62 7.415 -7.844 8.735 1.00 0.00 O ATOM 0 H SER B 62 8.905 -5.793 9.049 1.00 0.00 H new ATOM 0 HA SER B 62 8.650 -6.631 11.609 1.00 0.00 H new ATOM 0 HB2 SER B 62 6.679 -7.869 10.660 1.00 0.00 H new ATOM 0 HB3 SER B 62 6.826 -6.279 9.940 1.00 0.00 H new ATOM 0 HG SER B 62 6.570 -7.733 8.251 1.00 0.00 H new ATOM 2456 N ASP B 63 9.819 -9.062 9.720 1.00 0.00 N ATOM 2457 CA ASP B 63 10.348 -10.414 9.680 1.00 0.00 C ATOM 2458 C ASP B 63 11.714 -10.511 10.366 1.00 0.00 C ATOM 2459 O ASP B 63 12.163 -11.620 10.644 1.00 0.00 O ATOM 2460 CB ASP B 63 10.487 -10.870 8.219 1.00 0.00 C ATOM 2461 CG ASP B 63 9.250 -10.569 7.378 1.00 0.00 C ATOM 2462 OD1 ASP B 63 9.207 -9.446 6.826 1.00 0.00 O ATOM 2463 OD2 ASP B 63 8.391 -11.470 7.279 1.00 0.00 O ATOM 0 H ASP B 63 9.845 -8.591 8.816 1.00 0.00 H new ATOM 0 HA ASP B 63 9.651 -11.058 10.216 1.00 0.00 H new ATOM 0 HB2 ASP B 63 11.351 -10.379 7.772 1.00 0.00 H new ATOM 0 HB3 ASP B 63 10.682 -11.942 8.196 1.00 0.00 H new ATOM 2468 N GLY B 64 12.385 -9.378 10.619 1.00 0.00 N ATOM 2469 CA GLY B 64 13.707 -9.325 11.227 1.00 0.00 C ATOM 2470 C GLY B 64 14.683 -10.284 10.547 1.00 0.00 C ATOM 2471 O GLY B 64 15.464 -10.952 11.220 1.00 0.00 O ATOM 0 H GLY B 64 12.008 -8.456 10.399 1.00 0.00 H new ATOM 0 HA2 GLY B 64 14.095 -8.308 11.166 1.00 0.00 H new ATOM 0 HA3 GLY B 64 13.631 -9.574 12.285 1.00 0.00 H new ATOM 2475 N ASP B 65 14.623 -10.356 9.213 1.00 0.00 N ATOM 2476 CA ASP B 65 15.321 -11.360 8.416 1.00 0.00 C ATOM 2477 C ASP B 65 16.373 -10.717 7.510 1.00 0.00 C ATOM 2478 O ASP B 65 17.109 -11.413 6.818 1.00 0.00 O ATOM 2479 CB ASP B 65 14.279 -12.148 7.608 1.00 0.00 C ATOM 2480 CG ASP B 65 14.865 -13.370 6.904 1.00 0.00 C ATOM 2481 OD1 ASP B 65 15.636 -14.101 7.563 1.00 0.00 O ATOM 2482 OD2 ASP B 65 14.499 -13.573 5.726 1.00 0.00 O ATOM 0 H ASP B 65 14.077 -9.704 8.650 1.00 0.00 H new ATOM 0 HA ASP B 65 15.859 -12.043 9.073 1.00 0.00 H new ATOM 0 HB2 ASP B 65 13.479 -12.469 8.274 1.00 0.00 H new ATOM 0 HB3 ASP B 65 13.830 -11.489 6.865 1.00 0.00 H new ATOM 2487 N GLY B 66 16.435 -9.381 7.482 1.00 0.00 N ATOM 2488 CA GLY B 66 17.371 -8.656 6.635 1.00 0.00 C ATOM 2489 C GLY B 66 16.934 -8.645 5.168 1.00 0.00 C ATOM 2490 O GLY B 66 17.696 -8.235 4.292 1.00 0.00 O ATOM 0 H GLY B 66 15.836 -8.779 8.047 1.00 0.00 H new ATOM 0 HA2 GLY B 66 17.463 -7.630 6.993 1.00 0.00 H new ATOM 0 HA3 GLY B 66 18.358 -9.111 6.715 1.00 0.00 H new ATOM 2494 N GLU B 67 15.701 -9.077 4.899 1.00 0.00 N ATOM 2495 CA GLU B 67 15.021 -8.956 3.633 1.00 0.00 C ATOM 2496 C GLU B 67 13.559 -8.678 3.979 1.00 0.00 C ATOM 2497 O GLU B 67 13.022 -9.300 4.897 1.00 0.00 O ATOM 2498 CB GLU B 67 15.243 -10.217 2.785 1.00 0.00 C ATOM 2499 CG GLU B 67 15.145 -11.529 3.570 1.00 0.00 C ATOM 2500 CD GLU B 67 15.331 -12.734 2.653 1.00 0.00 C ATOM 2501 OE1 GLU B 67 16.458 -12.876 2.130 1.00 0.00 O ATOM 2502 OE2 GLU B 67 14.343 -13.475 2.468 1.00 0.00 O ATOM 0 H GLU B 67 15.130 -9.544 5.604 1.00 0.00 H new ATOM 0 HA GLU B 67 15.403 -8.145 3.014 1.00 0.00 H new ATOM 0 HB2 GLU B 67 14.509 -10.233 1.980 1.00 0.00 H new ATOM 0 HB3 GLU B 67 16.226 -10.159 2.319 1.00 0.00 H new ATOM 0 HG2 GLU B 67 15.902 -11.545 4.354 1.00 0.00 H new ATOM 0 HG3 GLU B 67 14.175 -11.590 4.063 1.00 0.00 H new ATOM 2509 N CYS B 68 12.949 -7.697 3.310 1.00 0.00 N ATOM 2510 CA CYS B 68 11.630 -7.180 3.671 1.00 0.00 C ATOM 2511 C CYS B 68 10.559 -7.922 2.885 1.00 0.00 C ATOM 2512 O CYS B 68 10.713 -8.139 1.682 1.00 0.00 O ATOM 2513 CB CYS B 68 11.541 -5.664 3.430 1.00 0.00 C ATOM 2514 SG CYS B 68 11.582 -4.813 5.022 1.00 0.00 S ATOM 0 H CYS B 68 13.360 -7.237 2.498 1.00 0.00 H new ATOM 0 HA CYS B 68 11.467 -7.347 4.736 1.00 0.00 H new ATOM 0 HB2 CYS B 68 12.370 -5.333 2.805 1.00 0.00 H new ATOM 0 HB3 CYS B 68 10.622 -5.421 2.897 1.00 0.00 H new ATOM 0 HG CYS B 68 11.510 -3.529 4.830 1.00 0.00 H new ATOM 2520 N ASP B 69 9.479 -8.322 3.564 1.00 0.00 N ATOM 2521 CA ASP B 69 8.404 -9.072 2.942 1.00 0.00 C ATOM 2522 C ASP B 69 7.579 -8.165 2.035 1.00 0.00 C ATOM 2523 O ASP B 69 7.529 -6.949 2.240 1.00 0.00 O ATOM 2524 CB ASP B 69 7.538 -9.740 4.021 1.00 0.00 C ATOM 2525 CG ASP B 69 6.477 -10.655 3.423 1.00 0.00 C ATOM 2526 OD1 ASP B 69 6.805 -11.841 3.203 1.00 0.00 O ATOM 2527 OD2 ASP B 69 5.363 -10.147 3.166 1.00 0.00 O ATOM 0 H ASP B 69 9.334 -8.132 4.556 1.00 0.00 H new ATOM 0 HA ASP B 69 8.827 -9.859 2.318 1.00 0.00 H new ATOM 0 HB2 ASP B 69 8.176 -10.316 4.691 1.00 0.00 H new ATOM 0 HB3 ASP B 69 7.054 -8.971 4.624 1.00 0.00 H new ATOM 2532 N PHE B 70 6.892 -8.769 1.064 1.00 0.00 N ATOM 2533 CA PHE B 70 5.963 -8.057 0.200 1.00 0.00 C ATOM 2534 C PHE B 70 4.995 -7.172 1.000 1.00 0.00 C ATOM 2535 O PHE B 70 4.736 -6.041 0.603 1.00 0.00 O ATOM 2536 CB PHE B 70 5.208 -9.051 -0.684 1.00 0.00 C ATOM 2537 CG PHE B 70 4.318 -8.368 -1.698 1.00 0.00 C ATOM 2538 CD1 PHE B 70 4.918 -7.625 -2.723 1.00 0.00 C ATOM 2539 CD2 PHE B 70 2.922 -8.344 -1.548 1.00 0.00 C ATOM 2540 CE1 PHE B 70 4.140 -6.884 -3.623 1.00 0.00 C ATOM 2541 CE2 PHE B 70 2.139 -7.574 -2.426 1.00 0.00 C ATOM 2542 CZ PHE B 70 2.750 -6.835 -3.458 1.00 0.00 C ATOM 0 H PHE B 70 6.967 -9.765 0.858 1.00 0.00 H new ATOM 0 HA PHE B 70 6.540 -7.387 -0.438 1.00 0.00 H new ATOM 0 HB2 PHE B 70 5.925 -9.686 -1.205 1.00 0.00 H new ATOM 0 HB3 PHE B 70 4.602 -9.703 -0.055 1.00 0.00 H new ATOM 0 HD1 PHE B 70 5.994 -7.623 -2.821 1.00 0.00 H new ATOM 0 HD2 PHE B 70 2.452 -8.915 -0.761 1.00 0.00 H new ATOM 0 HE1 PHE B 70 4.609 -6.354 -4.439 1.00 0.00 H new ATOM 0 HE2 PHE B 70 1.066 -7.549 -2.309 1.00 0.00 H new ATOM 0 HZ PHE B 70 2.148 -6.232 -4.121 1.00 0.00 H new ATOM 2552 N GLN B 71 4.504 -7.649 2.149 1.00 0.00 N ATOM 2553 CA GLN B 71 3.710 -6.847 3.079 1.00 0.00 C ATOM 2554 C GLN B 71 4.421 -5.539 3.455 1.00 0.00 C ATOM 2555 O GLN B 71 3.829 -4.462 3.418 1.00 0.00 O ATOM 2556 CB GLN B 71 3.441 -7.664 4.350 1.00 0.00 C ATOM 2557 CG GLN B 71 2.401 -8.771 4.131 1.00 0.00 C ATOM 2558 CD GLN B 71 0.978 -8.258 4.353 1.00 0.00 C ATOM 2559 OE1 GLN B 71 0.514 -8.191 5.486 1.00 0.00 O ATOM 2560 NE2 GLN B 71 0.256 -7.893 3.297 1.00 0.00 N ATOM 0 H GLN B 71 4.649 -8.610 2.460 1.00 0.00 H new ATOM 0 HA GLN B 71 2.773 -6.589 2.586 1.00 0.00 H new ATOM 0 HB2 GLN B 71 4.374 -8.110 4.695 1.00 0.00 H new ATOM 0 HB3 GLN B 71 3.095 -6.997 5.140 1.00 0.00 H new ATOM 0 HG2 GLN B 71 2.493 -9.163 3.118 1.00 0.00 H new ATOM 0 HG3 GLN B 71 2.601 -9.598 4.812 1.00 0.00 H new ATOM 0 HE21 GLN B 71 0.655 -7.954 2.360 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -0.697 -7.552 3.424 1.00 0.00 H new ATOM 2569 N GLU B 72 5.694 -5.621 3.843 1.00 0.00 N ATOM 2570 CA GLU B 72 6.434 -4.456 4.303 1.00 0.00 C ATOM 2571 C GLU B 72 6.696 -3.510 3.129 1.00 0.00 C ATOM 2572 O GLU B 72 6.547 -2.293 3.242 1.00 0.00 O ATOM 2573 CB GLU B 72 7.716 -4.904 5.018 1.00 0.00 C ATOM 2574 CG GLU B 72 7.454 -5.940 6.127 1.00 0.00 C ATOM 2575 CD GLU B 72 6.279 -5.592 7.040 1.00 0.00 C ATOM 2576 OE1 GLU B 72 6.159 -4.409 7.423 1.00 0.00 O ATOM 2577 OE2 GLU B 72 5.513 -6.535 7.343 1.00 0.00 O ATOM 0 H GLU B 72 6.232 -6.488 3.846 1.00 0.00 H new ATOM 0 HA GLU B 72 5.847 -3.896 5.031 1.00 0.00 H new ATOM 0 HB2 GLU B 72 8.404 -5.328 4.287 1.00 0.00 H new ATOM 0 HB3 GLU B 72 8.208 -4.033 5.451 1.00 0.00 H new ATOM 0 HG2 GLU B 72 7.268 -6.910 5.667 1.00 0.00 H new ATOM 0 HG3 GLU B 72 8.354 -6.043 6.734 1.00 0.00 H new ATOM 2584 N PHE B 73 7.029 -4.078 1.970 1.00 0.00 N ATOM 2585 CA PHE B 73 7.087 -3.312 0.732 1.00 0.00 C ATOM 2586 C PHE B 73 5.753 -2.593 0.482 1.00 0.00 C ATOM 2587 O PHE B 73 5.746 -1.400 0.195 1.00 0.00 O ATOM 2588 CB PHE B 73 7.506 -4.235 -0.414 1.00 0.00 C ATOM 2589 CG PHE B 73 7.160 -3.746 -1.810 1.00 0.00 C ATOM 2590 CD1 PHE B 73 8.058 -2.937 -2.531 1.00 0.00 C ATOM 2591 CD2 PHE B 73 5.958 -4.158 -2.414 1.00 0.00 C ATOM 2592 CE1 PHE B 73 7.768 -2.577 -3.860 1.00 0.00 C ATOM 2593 CE2 PHE B 73 5.643 -3.744 -3.720 1.00 0.00 C ATOM 2594 CZ PHE B 73 6.563 -2.982 -4.457 1.00 0.00 C ATOM 0 H PHE B 73 7.262 -5.066 1.866 1.00 0.00 H new ATOM 0 HA PHE B 73 7.840 -2.528 0.806 1.00 0.00 H new ATOM 0 HB2 PHE B 73 8.584 -4.387 -0.359 1.00 0.00 H new ATOM 0 HB3 PHE B 73 7.038 -5.208 -0.263 1.00 0.00 H new ATOM 0 HD1 PHE B 73 8.969 -2.593 -2.064 1.00 0.00 H new ATOM 0 HD2 PHE B 73 5.275 -4.795 -1.872 1.00 0.00 H new ATOM 0 HE1 PHE B 73 8.475 -1.987 -4.424 1.00 0.00 H new ATOM 0 HE2 PHE B 73 4.692 -4.012 -4.157 1.00 0.00 H new ATOM 0 HZ PHE B 73 6.345 -2.708 -5.479 1.00 0.00 H new ATOM 2604 N MET B 74 4.621 -3.283 0.635 1.00 0.00 N ATOM 2605 CA MET B 74 3.303 -2.681 0.481 1.00 0.00 C ATOM 2606 C MET B 74 3.083 -1.552 1.488 1.00 0.00 C ATOM 2607 O MET B 74 2.519 -0.520 1.137 1.00 0.00 O ATOM 2608 CB MET B 74 2.203 -3.749 0.542 1.00 0.00 C ATOM 2609 CG MET B 74 2.206 -4.603 -0.733 1.00 0.00 C ATOM 2610 SD MET B 74 0.892 -4.292 -1.943 1.00 0.00 S ATOM 2611 CE MET B 74 0.902 -2.494 -2.129 1.00 0.00 C ATOM 0 H MET B 74 4.596 -4.275 0.869 1.00 0.00 H new ATOM 0 HA MET B 74 3.249 -2.225 -0.508 1.00 0.00 H new ATOM 0 HB2 MET B 74 2.356 -4.386 1.413 1.00 0.00 H new ATOM 0 HB3 MET B 74 1.231 -3.271 0.663 1.00 0.00 H new ATOM 0 HG2 MET B 74 3.165 -4.461 -1.232 1.00 0.00 H new ATOM 0 HG3 MET B 74 2.152 -5.651 -0.438 1.00 0.00 H new ATOM 0 HE1 MET B 74 0.199 -2.205 -2.910 1.00 0.00 H new ATOM 0 HE2 MET B 74 0.609 -2.029 -1.188 1.00 0.00 H new ATOM 0 HE3 MET B 74 1.904 -2.162 -2.402 1.00 0.00 H new ATOM 2621 N ALA B 75 3.551 -1.715 2.725 1.00 0.00 N ATOM 2622 CA ALA B 75 3.524 -0.637 3.710 1.00 0.00 C ATOM 2623 C ALA B 75 4.338 0.571 3.222 1.00 0.00 C ATOM 2624 O ALA B 75 3.884 1.713 3.319 1.00 0.00 O ATOM 2625 CB ALA B 75 4.011 -1.139 5.072 1.00 0.00 C ATOM 0 H ALA B 75 3.954 -2.587 3.069 1.00 0.00 H new ATOM 0 HA ALA B 75 2.493 -0.304 3.832 1.00 0.00 H new ATOM 0 HB1 ALA B 75 3.984 -0.321 5.792 1.00 0.00 H new ATOM 0 HB2 ALA B 75 3.364 -1.946 5.415 1.00 0.00 H new ATOM 0 HB3 ALA B 75 5.033 -1.507 4.980 1.00 0.00 H new ATOM 2631 N PHE B 76 5.532 0.326 2.672 1.00 0.00 N ATOM 2632 CA PHE B 76 6.371 1.386 2.119 1.00 0.00 C ATOM 2633 C PHE B 76 5.624 2.098 0.987 1.00 0.00 C ATOM 2634 O PHE B 76 5.453 3.318 1.005 1.00 0.00 O ATOM 2635 CB PHE B 76 7.721 0.830 1.654 1.00 0.00 C ATOM 2636 CG PHE B 76 8.661 1.880 1.099 1.00 0.00 C ATOM 2637 CD1 PHE B 76 9.331 2.776 1.960 1.00 0.00 C ATOM 2638 CD2 PHE B 76 8.869 1.952 -0.291 1.00 0.00 C ATOM 2639 CE1 PHE B 76 10.196 3.744 1.418 1.00 0.00 C ATOM 2640 CE2 PHE B 76 9.757 2.900 -0.823 1.00 0.00 C ATOM 2641 CZ PHE B 76 10.411 3.805 0.028 1.00 0.00 C ATOM 0 H PHE B 76 5.939 -0.607 2.599 1.00 0.00 H new ATOM 0 HA PHE B 76 6.583 2.118 2.898 1.00 0.00 H new ATOM 0 HB2 PHE B 76 8.205 0.331 2.493 1.00 0.00 H new ATOM 0 HB3 PHE B 76 7.547 0.073 0.890 1.00 0.00 H new ATOM 0 HD1 PHE B 76 9.180 2.719 3.028 1.00 0.00 H new ATOM 0 HD2 PHE B 76 8.344 1.276 -0.950 1.00 0.00 H new ATOM 0 HE1 PHE B 76 10.697 4.443 2.071 1.00 0.00 H new ATOM 0 HE2 PHE B 76 9.937 2.933 -1.887 1.00 0.00 H new ATOM 0 HZ PHE B 76 11.079 4.548 -0.383 1.00 0.00 H new ATOM 2651 N VAL B 77 5.120 1.319 0.028 1.00 0.00 N ATOM 2652 CA VAL B 77 4.290 1.813 -1.058 1.00 0.00 C ATOM 2653 C VAL B 77 3.152 2.653 -0.481 1.00 0.00 C ATOM 2654 O VAL B 77 2.913 3.748 -0.975 1.00 0.00 O ATOM 2655 CB VAL B 77 3.777 0.637 -1.911 1.00 0.00 C ATOM 2656 CG1 VAL B 77 2.636 1.037 -2.865 1.00 0.00 C ATOM 2657 CG2 VAL B 77 4.922 0.044 -2.745 1.00 0.00 C ATOM 0 H VAL B 77 5.283 0.313 -0.011 1.00 0.00 H new ATOM 0 HA VAL B 77 4.876 2.452 -1.718 1.00 0.00 H new ATOM 0 HB VAL B 77 3.387 -0.099 -1.208 1.00 0.00 H new ATOM 0 HG11 VAL B 77 2.318 0.166 -3.438 1.00 0.00 H new ATOM 0 HG12 VAL B 77 1.794 1.417 -2.286 1.00 0.00 H new ATOM 0 HG13 VAL B 77 2.987 1.812 -3.547 1.00 0.00 H new ATOM 0 HG21 VAL B 77 4.545 -0.786 -3.343 1.00 0.00 H new ATOM 0 HG22 VAL B 77 5.327 0.811 -3.405 1.00 0.00 H new ATOM 0 HG23 VAL B 77 5.708 -0.315 -2.081 1.00 0.00 H new ATOM 2667 N ALA B 78 2.462 2.180 0.560 1.00 0.00 N ATOM 2668 CA ALA B 78 1.351 2.904 1.160 1.00 0.00 C ATOM 2669 C ALA B 78 1.781 4.289 1.646 1.00 0.00 C ATOM 2670 O ALA B 78 1.161 5.281 1.259 1.00 0.00 O ATOM 2671 CB ALA B 78 0.713 2.084 2.285 1.00 0.00 C ATOM 0 H ALA B 78 2.662 1.285 1.006 1.00 0.00 H new ATOM 0 HA ALA B 78 0.595 3.057 0.390 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -0.115 2.644 2.719 1.00 0.00 H new ATOM 0 HB2 ALA B 78 0.342 1.141 1.883 1.00 0.00 H new ATOM 0 HB3 ALA B 78 1.457 1.882 3.055 1.00 0.00 H new ATOM 2677 N MET B 79 2.839 4.386 2.463 1.00 0.00 N ATOM 2678 CA MET B 79 3.274 5.693 2.962 1.00 0.00 C ATOM 2679 C MET B 79 3.668 6.610 1.797 1.00 0.00 C ATOM 2680 O MET B 79 3.223 7.756 1.719 1.00 0.00 O ATOM 2681 CB MET B 79 4.373 5.589 4.040 1.00 0.00 C ATOM 2682 CG MET B 79 5.619 4.806 3.611 1.00 0.00 C ATOM 2683 SD MET B 79 7.117 4.963 4.610 1.00 0.00 S ATOM 2684 CE MET B 79 6.592 4.207 6.157 1.00 0.00 C ATOM 0 H MET B 79 3.396 3.595 2.785 1.00 0.00 H new ATOM 0 HA MET B 79 2.424 6.150 3.469 1.00 0.00 H new ATOM 0 HB2 MET B 79 4.675 6.595 4.330 1.00 0.00 H new ATOM 0 HB3 MET B 79 3.950 5.115 4.926 1.00 0.00 H new ATOM 0 HG2 MET B 79 5.352 3.750 3.576 1.00 0.00 H new ATOM 0 HG3 MET B 79 5.866 5.106 2.593 1.00 0.00 H new ATOM 0 HE1 MET B 79 7.415 4.232 6.872 1.00 0.00 H new ATOM 0 HE2 MET B 79 5.743 4.758 6.562 1.00 0.00 H new ATOM 0 HE3 MET B 79 6.300 3.173 5.976 1.00 0.00 H new ATOM 2694 N ILE B 80 4.480 6.093 0.872 1.00 0.00 N ATOM 2695 CA ILE B 80 4.976 6.833 -0.280 1.00 0.00 C ATOM 2696 C ILE B 80 3.794 7.368 -1.096 1.00 0.00 C ATOM 2697 O ILE B 80 3.721 8.553 -1.429 1.00 0.00 O ATOM 2698 CB ILE B 80 5.877 5.888 -1.098 1.00 0.00 C ATOM 2699 CG1 ILE B 80 7.183 5.530 -0.363 1.00 0.00 C ATOM 2700 CG2 ILE B 80 6.190 6.439 -2.487 1.00 0.00 C ATOM 2701 CD1 ILE B 80 8.241 6.637 -0.336 1.00 0.00 C ATOM 0 H ILE B 80 4.815 5.130 0.908 1.00 0.00 H new ATOM 0 HA ILE B 80 5.566 7.698 0.025 1.00 0.00 H new ATOM 0 HB ILE B 80 5.299 4.972 -1.219 1.00 0.00 H new ATOM 0 HG12 ILE B 80 6.940 5.257 0.664 1.00 0.00 H new ATOM 0 HG13 ILE B 80 7.616 4.647 -0.834 1.00 0.00 H new ATOM 0 HG21 ILE B 80 6.828 5.735 -3.022 1.00 0.00 H new ATOM 0 HG22 ILE B 80 5.261 6.580 -3.040 1.00 0.00 H new ATOM 0 HG23 ILE B 80 6.705 7.395 -2.392 1.00 0.00 H new ATOM 0 HD11 ILE B 80 9.121 6.286 0.204 1.00 0.00 H new ATOM 0 HD12 ILE B 80 8.521 6.897 -1.357 1.00 0.00 H new ATOM 0 HD13 ILE B 80 7.835 7.516 0.164 1.00 0.00 H new ATOM 2713 N THR B 81 2.866 6.471 -1.420 1.00 0.00 N ATOM 2714 CA THR B 81 1.688 6.747 -2.219 1.00 0.00 C ATOM 2715 C THR B 81 0.793 7.764 -1.510 1.00 0.00 C ATOM 2716 O THR B 81 0.295 8.685 -2.149 1.00 0.00 O ATOM 2717 CB THR B 81 0.964 5.421 -2.491 1.00 0.00 C ATOM 2718 OG1 THR B 81 1.815 4.606 -3.262 1.00 0.00 O ATOM 2719 CG2 THR B 81 -0.362 5.579 -3.228 1.00 0.00 C ATOM 0 H THR B 81 2.921 5.498 -1.119 1.00 0.00 H new ATOM 0 HA THR B 81 1.967 7.191 -3.175 1.00 0.00 H new ATOM 0 HB THR B 81 0.729 4.980 -1.522 1.00 0.00 H new ATOM 0 HG1 THR B 81 2.412 4.103 -2.669 1.00 0.00 H new ATOM 0 HG21 THR B 81 -0.812 4.598 -3.382 1.00 0.00 H new ATOM 0 HG22 THR B 81 -1.036 6.198 -2.636 1.00 0.00 H new ATOM 0 HG23 THR B 81 -0.187 6.054 -4.193 1.00 0.00 H new ATOM 2727 N THR B 82 0.591 7.625 -0.196 1.00 0.00 N ATOM 2728 CA THR B 82 -0.176 8.596 0.577 1.00 0.00 C ATOM 2729 C THR B 82 0.489 9.975 0.499 1.00 0.00 C ATOM 2730 O THR B 82 -0.176 10.974 0.225 1.00 0.00 O ATOM 2731 CB THR B 82 -0.369 8.098 2.017 1.00 0.00 C ATOM 2732 OG1 THR B 82 -0.996 6.832 1.982 1.00 0.00 O ATOM 2733 CG2 THR B 82 -1.268 9.033 2.833 1.00 0.00 C ATOM 0 H THR B 82 0.951 6.844 0.353 1.00 0.00 H new ATOM 0 HA THR B 82 -1.173 8.704 0.150 1.00 0.00 H new ATOM 0 HB THR B 82 0.615 8.056 2.484 1.00 0.00 H new ATOM 0 HG1 THR B 82 -0.352 6.156 1.684 1.00 0.00 H new ATOM 0 HG21 THR B 82 -1.377 8.642 3.845 1.00 0.00 H new ATOM 0 HG22 THR B 82 -0.819 10.025 2.874 1.00 0.00 H new ATOM 0 HG23 THR B 82 -2.249 9.098 2.362 1.00 0.00 H new ATOM 2741 N ALA B 83 1.807 10.039 0.704 1.00 0.00 N ATOM 2742 CA ALA B 83 2.534 11.296 0.594 1.00 0.00 C ATOM 2743 C ALA B 83 2.359 11.902 -0.803 1.00 0.00 C ATOM 2744 O ALA B 83 2.061 13.090 -0.938 1.00 0.00 O ATOM 2745 CB ALA B 83 4.010 11.058 0.920 1.00 0.00 C ATOM 0 H ALA B 83 2.387 9.235 0.946 1.00 0.00 H new ATOM 0 HA ALA B 83 2.130 12.012 1.310 1.00 0.00 H new ATOM 0 HB1 ALA B 83 4.557 11.997 0.838 1.00 0.00 H new ATOM 0 HB2 ALA B 83 4.101 10.672 1.935 1.00 0.00 H new ATOM 0 HB3 ALA B 83 4.425 10.334 0.219 1.00 0.00 H new ATOM 2751 N CYS B 84 2.496 11.077 -1.847 1.00 0.00 N ATOM 2752 CA CYS B 84 2.289 11.531 -3.217 1.00 0.00 C ATOM 2753 C CYS B 84 0.868 12.062 -3.398 1.00 0.00 C ATOM 2754 O CYS B 84 0.694 13.161 -3.910 1.00 0.00 O ATOM 2755 CB CYS B 84 2.585 10.427 -4.232 1.00 0.00 C ATOM 2756 SG CYS B 84 2.199 11.088 -5.871 1.00 0.00 S ATOM 0 H CYS B 84 2.749 10.092 -1.764 1.00 0.00 H new ATOM 0 HA CYS B 84 2.992 12.343 -3.403 1.00 0.00 H new ATOM 0 HB2 CYS B 84 3.630 10.124 -4.176 1.00 0.00 H new ATOM 0 HB3 CYS B 84 1.985 9.542 -4.023 1.00 0.00 H new ATOM 0 HG CYS B 84 2.896 10.457 -6.769 1.00 0.00 H new ATOM 2762 N HIS B 85 -0.142 11.308 -2.958 1.00 0.00 N ATOM 2763 CA HIS B 85 -1.549 11.685 -3.023 1.00 0.00 C ATOM 2764 C HIS B 85 -1.752 13.065 -2.412 1.00 0.00 C ATOM 2765 O HIS B 85 -2.261 13.966 -3.076 1.00 0.00 O ATOM 2766 CB HIS B 85 -2.393 10.618 -2.312 1.00 0.00 C ATOM 2767 CG HIS B 85 -3.866 10.920 -2.188 1.00 0.00 C ATOM 2768 ND1 HIS B 85 -4.891 10.265 -2.836 1.00 0.00 N ATOM 2769 CD2 HIS B 85 -4.436 11.758 -1.267 1.00 0.00 C ATOM 2770 CE1 HIS B 85 -6.048 10.739 -2.344 1.00 0.00 C ATOM 2771 NE2 HIS B 85 -5.823 11.644 -1.379 1.00 0.00 N ATOM 0 H HIS B 85 0.005 10.392 -2.535 1.00 0.00 H new ATOM 0 HA HIS B 85 -1.871 11.739 -4.063 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -2.279 9.675 -2.847 1.00 0.00 H new ATOM 0 HB3 HIS B 85 -1.987 10.468 -1.312 1.00 0.00 H new ATOM 0 HD1 HIS B 85 -4.790 9.551 -3.557 1.00 0.00 H new ATOM 0 HD2 HIS B 85 -3.906 12.395 -0.575 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -7.028 10.433 -2.680 1.00 0.00 H new ATOM 2779 N GLU B 86 -1.343 13.225 -1.152 1.00 0.00 N ATOM 2780 CA GLU B 86 -1.492 14.484 -0.443 1.00 0.00 C ATOM 2781 C GLU B 86 -0.819 15.610 -1.233 1.00 0.00 C ATOM 2782 O GLU B 86 -1.454 16.620 -1.536 1.00 0.00 O ATOM 2783 CB GLU B 86 -0.877 14.331 0.957 1.00 0.00 C ATOM 2784 CG GLU B 86 -1.711 13.413 1.865 1.00 0.00 C ATOM 2785 CD GLU B 86 -3.067 14.020 2.211 1.00 0.00 C ATOM 2786 OE1 GLU B 86 -3.060 15.162 2.720 1.00 0.00 O ATOM 2787 OE2 GLU B 86 -4.081 13.334 1.960 1.00 0.00 O ATOM 0 H GLU B 86 -0.903 12.487 -0.603 1.00 0.00 H new ATOM 0 HA GLU B 86 -2.546 14.742 -0.339 1.00 0.00 H new ATOM 0 HB2 GLU B 86 0.132 13.929 0.866 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -0.788 15.313 1.421 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -1.860 12.454 1.370 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -1.159 13.215 2.784 1.00 0.00 H new ATOM 2794 N PHE B 87 0.432 15.392 -1.646 1.00 0.00 N ATOM 2795 CA PHE B 87 1.222 16.407 -2.335 1.00 0.00 C ATOM 2796 C PHE B 87 0.548 16.817 -3.646 1.00 0.00 C ATOM 2797 O PHE B 87 0.389 17.995 -3.955 1.00 0.00 O ATOM 2798 CB PHE B 87 2.627 15.841 -2.575 1.00 0.00 C ATOM 2799 CG PHE B 87 3.533 16.674 -3.463 1.00 0.00 C ATOM 2800 CD1 PHE B 87 4.365 17.664 -2.909 1.00 0.00 C ATOM 2801 CD2 PHE B 87 3.582 16.419 -4.847 1.00 0.00 C ATOM 2802 CE1 PHE B 87 5.276 18.360 -3.723 1.00 0.00 C ATOM 2803 CE2 PHE B 87 4.479 17.129 -5.664 1.00 0.00 C ATOM 2804 CZ PHE B 87 5.336 18.089 -5.101 1.00 0.00 C ATOM 0 H PHE B 87 0.922 14.508 -1.511 1.00 0.00 H new ATOM 0 HA PHE B 87 1.296 17.307 -1.724 1.00 0.00 H new ATOM 0 HB2 PHE B 87 3.116 15.712 -1.609 1.00 0.00 H new ATOM 0 HB3 PHE B 87 2.528 14.850 -3.017 1.00 0.00 H new ATOM 0 HD1 PHE B 87 4.304 17.890 -1.855 1.00 0.00 H new ATOM 0 HD2 PHE B 87 2.929 15.677 -5.282 1.00 0.00 H new ATOM 0 HE1 PHE B 87 5.929 19.103 -3.290 1.00 0.00 H new ATOM 0 HE2 PHE B 87 4.509 16.936 -6.726 1.00 0.00 H new ATOM 0 HZ PHE B 87 6.040 18.618 -5.726 1.00 0.00 H new ATOM 2814 N PHE B 88 0.167 15.810 -4.427 1.00 0.00 N ATOM 2815 CA PHE B 88 -0.362 15.945 -5.769 1.00 0.00 C ATOM 2816 C PHE B 88 -1.753 16.570 -5.738 1.00 0.00 C ATOM 2817 O PHE B 88 -2.093 17.360 -6.615 1.00 0.00 O ATOM 2818 CB PHE B 88 -0.378 14.549 -6.398 1.00 0.00 C ATOM 2819 CG PHE B 88 -0.876 14.484 -7.828 1.00 0.00 C ATOM 2820 CD1 PHE B 88 -0.131 15.083 -8.861 1.00 0.00 C ATOM 2821 CD2 PHE B 88 -2.073 13.808 -8.130 1.00 0.00 C ATOM 2822 CE1 PHE B 88 -0.577 14.999 -10.191 1.00 0.00 C ATOM 2823 CE2 PHE B 88 -2.513 13.715 -9.462 1.00 0.00 C ATOM 2824 CZ PHE B 88 -1.764 14.310 -10.493 1.00 0.00 C ATOM 0 H PHE B 88 0.223 14.838 -4.123 1.00 0.00 H new ATOM 0 HA PHE B 88 0.261 16.610 -6.368 1.00 0.00 H new ATOM 0 HB2 PHE B 88 0.633 14.143 -6.365 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -1.003 13.900 -5.784 1.00 0.00 H new ATOM 0 HD1 PHE B 88 0.785 15.608 -8.631 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -2.654 13.360 -7.338 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -0.007 15.464 -10.982 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -3.426 13.187 -9.694 1.00 0.00 H new ATOM 0 HZ PHE B 88 -2.101 14.237 -11.517 1.00 0.00 H new ATOM 3136 N PHE C 76 -18.082 -12.674 -1.813 1.00 0.00 N ATOM 3137 CA PHE C 76 -17.049 -11.974 -2.566 1.00 0.00 C ATOM 3138 C PHE C 76 -15.675 -12.439 -2.086 1.00 0.00 C ATOM 3139 O PHE C 76 -14.802 -12.778 -2.887 1.00 0.00 O ATOM 3140 CB PHE C 76 -17.221 -10.452 -2.415 1.00 0.00 C ATOM 3141 CG PHE C 76 -18.654 -10.019 -2.172 1.00 0.00 C ATOM 3142 CD1 PHE C 76 -19.587 -10.055 -3.224 1.00 0.00 C ATOM 3143 CD2 PHE C 76 -19.108 -9.874 -0.849 1.00 0.00 C ATOM 3144 CE1 PHE C 76 -20.962 -9.947 -2.956 1.00 0.00 C ATOM 3145 CE2 PHE C 76 -20.482 -9.790 -0.582 1.00 0.00 C ATOM 3146 CZ PHE C 76 -21.408 -9.790 -1.634 1.00 0.00 C ATOM 0 HA PHE C 76 -17.139 -12.207 -3.627 1.00 0.00 H new ATOM 0 HB2 PHE C 76 -16.602 -10.106 -1.588 1.00 0.00 H new ATOM 0 HB3 PHE C 76 -16.851 -9.963 -3.316 1.00 0.00 H new ATOM 0 HD1 PHE C 76 -19.245 -10.166 -4.242 1.00 0.00 H new ATOM 0 HD2 PHE C 76 -18.397 -9.827 -0.037 1.00 0.00 H new ATOM 0 HE1 PHE C 76 -21.675 -9.985 -3.766 1.00 0.00 H new ATOM 0 HE2 PHE C 76 -20.828 -9.725 0.439 1.00 0.00 H new ATOM 0 HZ PHE C 76 -22.461 -9.670 -1.428 1.00 0.00 H new ATOM 3156 N LEU C 77 -15.486 -12.463 -0.761 1.00 0.00 N ATOM 3157 CA LEU C 77 -14.203 -12.790 -0.156 1.00 0.00 C ATOM 3158 C LEU C 77 -13.729 -14.197 -0.521 1.00 0.00 C ATOM 3159 O LEU C 77 -12.525 -14.437 -0.478 1.00 0.00 O ATOM 3160 CB LEU C 77 -14.226 -12.588 1.365 1.00 0.00 C ATOM 3161 CG LEU C 77 -14.520 -11.146 1.818 1.00 0.00 C ATOM 3162 CD1 LEU C 77 -14.337 -11.066 3.338 1.00 0.00 C ATOM 3163 CD2 LEU C 77 -13.618 -10.102 1.150 1.00 0.00 C ATOM 0 H LEU C 77 -16.221 -12.256 -0.085 1.00 0.00 H new ATOM 0 HA LEU C 77 -13.477 -12.092 -0.573 1.00 0.00 H new ATOM 0 HB2 LEU C 77 -14.978 -13.250 1.794 1.00 0.00 H new ATOM 0 HB3 LEU C 77 -13.262 -12.893 1.773 1.00 0.00 H new ATOM 0 HG LEU C 77 -15.543 -10.915 1.520 1.00 0.00 H new ATOM 0 HD11 LEU C 77 -14.542 -10.050 3.676 1.00 0.00 H new ATOM 0 HD12 LEU C 77 -15.026 -11.756 3.824 1.00 0.00 H new ATOM 0 HD13 LEU C 77 -13.313 -11.335 3.596 1.00 0.00 H new ATOM 0 HD21 LEU C 77 -13.879 -9.109 1.515 1.00 0.00 H new ATOM 0 HD22 LEU C 77 -12.576 -10.314 1.390 1.00 0.00 H new ATOM 0 HD23 LEU C 77 -13.756 -10.140 0.069 1.00 0.00 H new ATOM 3588 N THR D 74 18.267 12.446 4.913 1.00 0.00 N ATOM 3589 CA THR D 74 17.723 13.647 4.311 1.00 0.00 C ATOM 3590 C THR D 74 18.015 13.741 2.813 1.00 0.00 C ATOM 3591 O THR D 74 17.127 14.149 2.067 1.00 0.00 O ATOM 3592 CB THR D 74 18.242 14.860 5.095 1.00 0.00 C ATOM 3593 OG1 THR D 74 19.528 14.573 5.608 1.00 0.00 O ATOM 3594 CG2 THR D 74 17.336 15.152 6.293 1.00 0.00 C ATOM 0 HA THR D 74 16.635 13.619 4.375 1.00 0.00 H new ATOM 0 HB THR D 74 18.264 15.715 4.419 1.00 0.00 H new ATOM 0 HG1 THR D 74 19.659 13.602 5.639 1.00 0.00 H new ATOM 0 HG21 THR D 74 17.719 16.015 6.837 1.00 0.00 H new ATOM 0 HG22 THR D 74 16.326 15.363 5.942 1.00 0.00 H new ATOM 0 HG23 THR D 74 17.317 14.286 6.954 1.00 0.00 H new ATOM 3602 N GLU D 75 19.214 13.352 2.356 1.00 0.00 N ATOM 3603 CA GLU D 75 19.536 13.405 0.930 1.00 0.00 C ATOM 3604 C GLU D 75 18.486 12.694 0.066 1.00 0.00 C ATOM 3605 O GLU D 75 18.284 13.087 -1.081 1.00 0.00 O ATOM 3606 CB GLU D 75 20.961 12.908 0.627 1.00 0.00 C ATOM 3607 CG GLU D 75 21.282 11.529 1.215 1.00 0.00 C ATOM 3608 CD GLU D 75 22.620 10.974 0.724 1.00 0.00 C ATOM 3609 OE1 GLU D 75 22.874 11.069 -0.497 1.00 0.00 O ATOM 3610 OE2 GLU D 75 23.374 10.457 1.577 1.00 0.00 O ATOM 0 H GLU D 75 19.967 13.002 2.949 1.00 0.00 H new ATOM 0 HA GLU D 75 19.509 14.459 0.655 1.00 0.00 H new ATOM 0 HB2 GLU D 75 21.099 12.871 -0.454 1.00 0.00 H new ATOM 0 HB3 GLU D 75 21.677 13.632 1.016 1.00 0.00 H new ATOM 0 HG2 GLU D 75 21.299 11.598 2.303 1.00 0.00 H new ATOM 0 HG3 GLU D 75 20.486 10.832 0.952 1.00 0.00 H new ATOM 3617 N PHE D 76 17.806 11.676 0.609 1.00 0.00 N ATOM 3618 CA PHE D 76 16.698 11.023 -0.075 1.00 0.00 C ATOM 3619 C PHE D 76 15.369 11.543 0.470 1.00 0.00 C ATOM 3620 O PHE D 76 14.510 11.977 -0.294 1.00 0.00 O ATOM 3621 CB PHE D 76 16.803 9.497 0.055 1.00 0.00 C ATOM 3622 CG PHE D 76 18.219 8.954 0.004 1.00 0.00 C ATOM 3623 CD1 PHE D 76 19.087 9.314 -1.045 1.00 0.00 C ATOM 3624 CD2 PHE D 76 18.721 8.238 1.104 1.00 0.00 C ATOM 3625 CE1 PHE D 76 20.452 8.983 -0.973 1.00 0.00 C ATOM 3626 CE2 PHE D 76 20.068 7.843 1.136 1.00 0.00 C ATOM 3627 CZ PHE D 76 20.933 8.211 0.097 1.00 0.00 C ATOM 0 H PHE D 76 18.012 11.288 1.530 1.00 0.00 H new ATOM 0 HA PHE D 76 16.746 11.262 -1.137 1.00 0.00 H new ATOM 0 HB2 PHE D 76 16.345 9.194 0.997 1.00 0.00 H new ATOM 0 HB3 PHE D 76 16.222 9.037 -0.745 1.00 0.00 H new ATOM 0 HD1 PHE D 76 18.704 9.844 -1.905 1.00 0.00 H new ATOM 0 HD2 PHE D 76 18.068 7.991 1.928 1.00 0.00 H new ATOM 0 HE1 PHE D 76 21.131 9.323 -1.741 1.00 0.00 H new ATOM 0 HE2 PHE D 76 20.438 7.255 1.963 1.00 0.00 H new ATOM 0 HZ PHE D 76 21.968 7.902 0.119 1.00 0.00 H new ATOM 3637 N LEU D 77 15.181 11.491 1.792 1.00 0.00 N ATOM 3638 CA LEU D 77 13.884 11.748 2.405 1.00 0.00 C ATOM 3639 C LEU D 77 13.446 13.214 2.360 1.00 0.00 C ATOM 3640 O LEU D 77 12.270 13.475 2.593 1.00 0.00 O ATOM 3641 CB LEU D 77 13.831 11.205 3.843 1.00 0.00 C ATOM 3642 CG LEU D 77 14.002 9.678 3.964 1.00 0.00 C ATOM 3643 CD1 LEU D 77 13.776 9.270 5.425 1.00 0.00 C ATOM 3644 CD2 LEU D 77 13.011 8.891 3.094 1.00 0.00 C ATOM 0 H LEU D 77 15.921 11.271 2.459 1.00 0.00 H new ATOM 0 HA LEU D 77 13.164 11.206 1.792 1.00 0.00 H new ATOM 0 HB2 LEU D 77 14.611 11.691 4.429 1.00 0.00 H new ATOM 0 HB3 LEU D 77 12.876 11.486 4.288 1.00 0.00 H new ATOM 0 HG LEU D 77 15.009 9.441 3.621 1.00 0.00 H new ATOM 0 HD11 LEU D 77 13.894 8.191 5.524 1.00 0.00 H new ATOM 0 HD12 LEU D 77 14.504 9.775 6.060 1.00 0.00 H new ATOM 0 HD13 LEU D 77 12.769 9.554 5.731 1.00 0.00 H new ATOM 0 HD21 LEU D 77 13.182 7.822 3.223 1.00 0.00 H new ATOM 0 HD22 LEU D 77 11.991 9.134 3.393 1.00 0.00 H new ATOM 0 HD23 LEU D 77 13.155 9.157 2.047 1.00 0.00 H new ATOM 3656 N ARG D 78 14.319 14.181 2.059 1.00 0.00 N ATOM 3657 CA ARG D 78 13.947 15.599 2.005 1.00 0.00 C ATOM 3658 C ARG D 78 12.652 15.819 1.206 1.00 0.00 C ATOM 3659 O ARG D 78 11.738 16.522 1.646 1.00 0.00 O ATOM 3660 CB ARG D 78 15.137 16.414 1.468 1.00 0.00 C ATOM 3661 CG ARG D 78 14.846 17.912 1.307 1.00 0.00 C ATOM 3662 CD ARG D 78 14.290 18.264 -0.082 1.00 0.00 C ATOM 3663 NE ARG D 78 13.108 19.123 0.031 1.00 0.00 N ATOM 3664 CZ ARG D 78 13.096 20.440 0.273 1.00 0.00 C ATOM 3665 NH1 ARG D 78 14.230 21.144 0.338 1.00 0.00 N ATOM 3666 NH2 ARG D 78 11.915 21.032 0.463 1.00 0.00 N ATOM 0 H ARG D 78 15.301 14.004 1.846 1.00 0.00 H new ATOM 0 HA ARG D 78 13.724 15.955 3.011 1.00 0.00 H new ATOM 0 HB2 ARG D 78 15.984 16.289 2.143 1.00 0.00 H new ATOM 0 HB3 ARG D 78 15.437 16.007 0.502 1.00 0.00 H new ATOM 0 HG2 ARG D 78 14.131 18.223 2.069 1.00 0.00 H new ATOM 0 HG3 ARG D 78 15.762 18.476 1.480 1.00 0.00 H new ATOM 0 HD2 ARG D 78 15.057 18.770 -0.668 1.00 0.00 H new ATOM 0 HD3 ARG D 78 14.031 17.350 -0.617 1.00 0.00 H new ATOM 0 HE ARG D 78 12.201 18.671 -0.087 1.00 0.00 H new ATOM 0 HH11 ARG D 78 15.128 20.679 0.202 1.00 0.00 H new ATOM 0 HH12 ARG D 78 14.198 22.146 0.523 1.00 0.00 H new ATOM 0 HH21 ARG D 78 11.057 20.483 0.422 1.00 0.00 H new ATOM 0 HH22 ARG D 78 11.871 22.034 0.650 1.00 0.00 H new