USER MOD reduce.3.24.130724 H: found=0, std=0, add=1738, rem=0, adj=62 USER MOD reduce.3.24.130724 removed 1732 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 74 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: B 79 HIS : no HD1:sc= -2.28! C(o=-5.6!,f=-5.5!) USER MOD Set 1.3: B 83 SER OG : rot -125:sc= -3.36! USER MOD Set 2.1: B 32 SER OG : rot -97:sc= 0.975 USER MOD Set 2.2: B 33 GLN : amide:sc= -4.4! C(o=-6.5!,f=-15!) USER MOD Set 2.3: B 76 HIS : no HE2:sc= -3.1! C(o=-6.5!,f=-11!) USER MOD Set 3.1: B 25 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.315) USER MOD Set 3.2: B 29 ASN : amide:sc= -4.34! C(o=-4.3!,f=-8.8!) USER MOD Set 4.1: A 32 SER OG : rot -99:sc= 0.782 USER MOD Set 4.2: A 33 GLN : amide:sc= -4.41! C(o=-7!,f=-16!) USER MOD Set 4.3: A 76 HIS : no HE2:sc= -3.39! C(o=-7!,f=-11!) USER MOD Set 5.1: A 74 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: A 79 HIS : no HD1:sc= -2.55! C(o=-5.9!,f=-5.9!) USER MOD Set 5.3: A 83 SER OG : rot -133:sc= -3.39! USER MOD Set 6.1: A 25 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.285) USER MOD Set 6.2: A 29 ASN : amide:sc= -4.34! C(o=-4.3!,f=-8.6!) USER MOD Single : A 1 MET CE :methyl -153:sc= -0.197 (180deg=-1.29) USER MOD Single : A 1 MET N :NH3+ -168:sc= -0.0174 (180deg=-0.178) USER MOD Single : A 3 THR OG1 : rot -41:sc= 0.265 USER MOD Single : A 4 SER OG : rot -0:sc= 0.666 USER MOD Single : A 7 LYS NZ :NH3+ -115:sc= -2.39! (180deg=-3.63!) USER MOD Single : A 8 HIS : no HD1:sc= -0.0944 K(o=-0.094,f=-0.91) USER MOD Single : A 13 LYS NZ :NH3+ 159:sc= 0.241 (180deg=-0.526) USER MOD Single : A 15 LYS NZ :NH3+ 146:sc= -1.18 (180deg=-1.43) USER MOD Single : A 18 THR OG1 : rot -62:sc= -1.93! USER MOD Single : A 19 LYS NZ :NH3+ 143:sc= -0.251 (180deg=-1.4!) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 0:sc= -0.507 USER MOD Single : A 46 LYS NZ :NH3+ 175:sc= -7.47! (180deg=-7.52!) USER MOD Single : A 48 SER OG : rot 180:sc= -0.277 USER MOD Single : A 49 HIS : no HD1:sc= 0.322 K(o=0.32,f=-6.9!) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN :FLIP amide:sc= -8.25! C(o=-9.7!,f=-8.3!) USER MOD Single : A 57 THR OG1 : rot 133:sc= 0.613 USER MOD Single : A 58 HIS : no HD1:sc= -15.4! C(o=-15!,f=-21!) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 62 MET CE :methyl -145:sc= -0.28 (180deg=-1.78!) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -1.62! C(o=-1.6!,f=-5.5!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 66:sc= 0.809 USER MOD Single : A 87 THR OG1 : rot 74:sc= 0.383 USER MOD Single : A 92 LYS NZ :NH3+ 162:sc= 0.373 (180deg=0.246) USER MOD Single : A 104 LYS NZ :NH3+ -136:sc= -0.484 (180deg=-0.903) USER MOD Single : A 105 SER OG : rot 180:sc= -0.0669 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -153:sc= -0.152 (180deg=-1.28!) USER MOD Single : B 1 MET N :NH3+ -168:sc= -0.0204 (180deg=-0.155) USER MOD Single : B 3 THR OG1 : rot -44:sc= 0.246 USER MOD Single : B 4 SER OG : rot 4:sc= 0.664 USER MOD Single : B 7 LYS NZ :NH3+ -118:sc= -2.24! (180deg=-3.42!) USER MOD Single : B 8 HIS : no HD1:sc= -0.0889 K(o=-0.089,f=-0.89) USER MOD Single : B 13 LYS NZ :NH3+ 159:sc= 0.236 (180deg=-0.707) USER MOD Single : B 15 LYS NZ :NH3+ 163:sc= -1.23 (180deg=-1.49) USER MOD Single : B 18 THR OG1 : rot -49:sc= -1.84 USER MOD Single : B 19 LYS NZ :NH3+ 142:sc= -0.254 (180deg=-1.44!) USER MOD Single : B 36 THR OG1 : rot 180:sc= 0 USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 SER OG : rot -4:sc= -0.415 USER MOD Single : B 46 LYS NZ :NH3+ 179:sc= -8.21! (180deg=-8.26!) USER MOD Single : B 48 SER OG : rot 180:sc= -0.276 USER MOD Single : B 49 HIS : no HD1:sc= 0.148 K(o=0.15,f=-6.7!) USER MOD Single : B 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 54 GLN :FLIP amide:sc= -7.99! C(o=-9.1!,f=-8!) USER MOD Single : B 57 THR OG1 : rot 139:sc= 0.645 USER MOD Single : B 58 HIS : no HD1:sc= -15.4! C(o=-15!,f=-21!) USER MOD Single : B 61 SER OG : rot 180:sc= 0 USER MOD Single : B 62 MET CE :methyl -154:sc= -0.263 (180deg=-1.7!) USER MOD Single : B 63 THR OG1 : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= -1.44! C(o=-1.4!,f=-5.4!) USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 70 TYR OH : rot 180:sc= 0 USER MOD Single : B 75 SER OG : rot 109:sc= 0.69 USER MOD Single : B 87 THR OG1 : rot 73:sc= 0.377 USER MOD Single : B 92 LYS NZ :NH3+ 161:sc= 0.439 (180deg=0.0023!) USER MOD Single : B 104 LYS NZ :NH3+ -136:sc= -0.454 (180deg=-0.883) USER MOD Single : B 105 SER OG : rot 180:sc= -0.0914 USER MOD Single : B 106 SER OG : rot 180:sc= 0 USER MOD Single : B 110 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.744 6.064 -21.814 1.00 0.00 N ATOM 2 CA MET A 1 -4.430 7.073 -22.669 1.00 0.00 C ATOM 3 C MET A 1 -3.505 7.483 -23.817 1.00 0.00 C ATOM 4 O MET A 1 -3.947 7.773 -24.911 1.00 0.00 O ATOM 5 CB MET A 1 -4.779 8.302 -21.829 1.00 0.00 C ATOM 6 CG MET A 1 -5.665 9.245 -22.646 1.00 0.00 C ATOM 7 SD MET A 1 -5.915 10.785 -21.729 1.00 0.00 S ATOM 8 CE MET A 1 -6.797 10.069 -20.319 1.00 0.00 C ATOM 0 H1 MET A 1 -4.432 5.636 -21.162 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.330 5.323 -22.415 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.990 6.527 -21.267 1.00 0.00 H new ATOM 0 HA MET A 1 -5.344 6.642 -23.077 1.00 0.00 H new ATOM 0 HB2 MET A 1 -5.296 7.998 -20.919 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.868 8.816 -21.522 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.200 9.454 -23.609 1.00 0.00 H new ATOM 0 HG3 MET A 1 -6.625 8.772 -22.852 1.00 0.00 H new ATOM 0 HE1 MET A 1 -7.451 10.822 -19.879 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.394 9.221 -20.656 1.00 0.00 H new ATOM 0 HE3 MET A 1 -6.077 9.732 -19.573 1.00 0.00 H new ATOM 17 N ALA A 2 -2.223 7.512 -23.576 1.00 0.00 N ATOM 18 CA ALA A 2 -1.270 7.905 -24.653 1.00 0.00 C ATOM 19 C ALA A 2 -1.649 9.288 -25.186 1.00 0.00 C ATOM 20 O ALA A 2 -2.060 9.439 -26.320 1.00 0.00 O ATOM 21 CB ALA A 2 -1.339 6.885 -25.790 1.00 0.00 C ATOM 0 H ALA A 2 -1.794 7.281 -22.680 1.00 0.00 H new ATOM 0 HA ALA A 2 -0.257 7.934 -24.251 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -0.643 7.171 -26.578 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.072 5.899 -25.411 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -2.351 6.857 -26.193 1.00 0.00 H new ATOM 27 N THR A 3 -1.514 10.303 -24.374 1.00 0.00 N ATOM 28 CA THR A 3 -1.864 11.677 -24.831 1.00 0.00 C ATOM 29 C THR A 3 -0.579 12.479 -25.033 1.00 0.00 C ATOM 30 O THR A 3 -0.604 13.637 -25.402 1.00 0.00 O ATOM 31 CB THR A 3 -2.720 12.361 -23.766 1.00 0.00 C ATOM 32 OG1 THR A 3 -3.274 13.553 -24.298 1.00 0.00 O ATOM 33 CG2 THR A 3 -1.857 12.694 -22.547 1.00 0.00 C ATOM 0 H THR A 3 -1.176 10.238 -23.414 1.00 0.00 H new ATOM 0 HA THR A 3 -2.418 11.623 -25.768 1.00 0.00 H new ATOM 0 HB THR A 3 -3.525 11.691 -23.464 1.00 0.00 H new ATOM 0 HG1 THR A 3 -2.598 14.017 -24.834 1.00 0.00 H new ATOM 0 HG21 THR A 3 -2.470 13.182 -21.789 1.00 0.00 H new ATOM 0 HG22 THR A 3 -1.436 11.776 -22.137 1.00 0.00 H new ATOM 0 HG23 THR A 3 -1.049 13.362 -22.845 1.00 0.00 H new ATOM 41 N SER A 4 0.542 11.858 -24.801 1.00 0.00 N ATOM 42 CA SER A 4 1.842 12.561 -24.963 1.00 0.00 C ATOM 43 C SER A 4 2.970 11.554 -24.789 1.00 0.00 C ATOM 44 O SER A 4 3.203 10.718 -25.637 1.00 0.00 O ATOM 45 CB SER A 4 1.982 13.647 -23.903 1.00 0.00 C ATOM 46 OG SER A 4 1.101 14.721 -24.200 1.00 0.00 O ATOM 0 H SER A 4 0.613 10.885 -24.503 1.00 0.00 H new ATOM 0 HA SER A 4 1.887 13.015 -25.953 1.00 0.00 H new ATOM 0 HB2 SER A 4 1.755 13.239 -22.918 1.00 0.00 H new ATOM 0 HB3 SER A 4 3.011 14.006 -23.870 1.00 0.00 H new ATOM 0 HG SER A 4 0.605 14.520 -25.021 1.00 0.00 H new ATOM 52 N GLY A 5 3.667 11.607 -23.694 1.00 0.00 N ATOM 53 CA GLY A 5 4.787 10.646 -23.493 1.00 0.00 C ATOM 54 C GLY A 5 4.423 9.653 -22.382 1.00 0.00 C ATOM 55 O GLY A 5 3.351 9.704 -21.813 1.00 0.00 O ATOM 0 H GLY A 5 3.514 12.268 -22.932 1.00 0.00 H new ATOM 0 HA2 GLY A 5 4.990 10.110 -24.420 1.00 0.00 H new ATOM 0 HA3 GLY A 5 5.698 11.184 -23.229 1.00 0.00 H new ATOM 59 N PHE A 6 5.319 8.764 -22.061 1.00 0.00 N ATOM 60 CA PHE A 6 5.043 7.784 -20.977 1.00 0.00 C ATOM 61 C PHE A 6 6.232 7.794 -20.015 1.00 0.00 C ATOM 62 O PHE A 6 7.372 7.736 -20.430 1.00 0.00 O ATOM 63 CB PHE A 6 4.856 6.393 -21.583 1.00 0.00 C ATOM 64 CG PHE A 6 3.424 6.239 -22.048 1.00 0.00 C ATOM 65 CD1 PHE A 6 2.428 5.847 -21.142 1.00 0.00 C ATOM 66 CD2 PHE A 6 3.090 6.487 -23.387 1.00 0.00 C ATOM 67 CE1 PHE A 6 1.102 5.703 -21.573 1.00 0.00 C ATOM 68 CE2 PHE A 6 1.764 6.341 -23.816 1.00 0.00 C ATOM 69 CZ PHE A 6 0.771 5.950 -22.910 1.00 0.00 C ATOM 0 H PHE A 6 6.233 8.674 -22.504 1.00 0.00 H new ATOM 0 HA PHE A 6 4.132 8.049 -20.439 1.00 0.00 H new ATOM 0 HB2 PHE A 6 5.540 6.254 -22.421 1.00 0.00 H new ATOM 0 HB3 PHE A 6 5.095 5.627 -20.845 1.00 0.00 H new ATOM 0 HD1 PHE A 6 2.683 5.656 -20.110 1.00 0.00 H new ATOM 0 HD2 PHE A 6 3.854 6.790 -24.087 1.00 0.00 H new ATOM 0 HE1 PHE A 6 0.336 5.402 -20.874 1.00 0.00 H new ATOM 0 HE2 PHE A 6 1.508 6.531 -24.848 1.00 0.00 H new ATOM 0 HZ PHE A 6 -0.250 5.839 -23.243 1.00 0.00 H new ATOM 79 N LYS A 7 5.987 7.915 -18.737 1.00 0.00 N ATOM 80 CA LYS A 7 7.127 7.982 -17.775 1.00 0.00 C ATOM 81 C LYS A 7 7.328 6.683 -17.003 1.00 0.00 C ATOM 82 O LYS A 7 6.412 6.113 -16.441 1.00 0.00 O ATOM 83 CB LYS A 7 6.878 9.103 -16.758 1.00 0.00 C ATOM 84 CG LYS A 7 8.187 9.425 -16.028 1.00 0.00 C ATOM 85 CD LYS A 7 7.883 10.012 -14.645 1.00 0.00 C ATOM 86 CE LYS A 7 7.545 8.882 -13.668 1.00 0.00 C ATOM 87 NZ LYS A 7 6.086 8.597 -13.725 1.00 0.00 N ATOM 0 H LYS A 7 5.058 7.970 -18.320 1.00 0.00 H new ATOM 0 HA LYS A 7 8.023 8.169 -18.367 1.00 0.00 H new ATOM 0 HB2 LYS A 7 6.502 9.992 -17.264 1.00 0.00 H new ATOM 0 HB3 LYS A 7 6.115 8.797 -16.042 1.00 0.00 H new ATOM 0 HG2 LYS A 7 8.788 8.521 -15.925 1.00 0.00 H new ATOM 0 HG3 LYS A 7 8.774 10.133 -16.612 1.00 0.00 H new ATOM 0 HD2 LYS A 7 8.742 10.575 -14.281 1.00 0.00 H new ATOM 0 HD3 LYS A 7 7.049 10.710 -14.711 1.00 0.00 H new ATOM 0 HE2 LYS A 7 8.112 7.986 -13.922 1.00 0.00 H new ATOM 0 HE3 LYS A 7 7.832 9.165 -12.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 5.650 8.832 -12.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 5.649 9.171 -14.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 5.937 7.588 -13.930 1.00 0.00 H new ATOM 101 N HIS A 8 8.560 6.263 -16.930 1.00 0.00 N ATOM 102 CA HIS A 8 8.933 5.071 -16.127 1.00 0.00 C ATOM 103 C HIS A 8 10.063 5.523 -15.209 1.00 0.00 C ATOM 104 O HIS A 8 11.050 6.067 -15.665 1.00 0.00 O ATOM 105 CB HIS A 8 9.436 3.939 -17.027 1.00 0.00 C ATOM 106 CG HIS A 8 9.445 2.648 -16.251 1.00 0.00 C ATOM 107 ND1 HIS A 8 8.275 2.009 -15.864 1.00 0.00 N ATOM 108 CD2 HIS A 8 10.473 1.865 -15.775 1.00 0.00 C ATOM 109 CE1 HIS A 8 8.621 0.894 -15.190 1.00 0.00 C ATOM 110 NE2 HIS A 8 9.946 0.762 -15.110 1.00 0.00 N ATOM 0 H HIS A 8 9.343 6.710 -17.407 1.00 0.00 H new ATOM 0 HA HIS A 8 8.073 4.693 -15.574 1.00 0.00 H new ATOM 0 HB2 HIS A 8 8.795 3.845 -17.904 1.00 0.00 H new ATOM 0 HB3 HIS A 8 10.439 4.166 -17.389 1.00 0.00 H new ATOM 0 HD2 HIS A 8 11.525 2.075 -15.899 1.00 0.00 H new ATOM 0 HE1 HIS A 8 7.914 0.195 -14.768 1.00 0.00 H new ATOM 0 HE2 HIS A 8 10.464 0.010 -14.656 1.00 0.00 H new ATOM 119 N LEU A 9 9.939 5.337 -13.931 1.00 0.00 N ATOM 120 CA LEU A 9 11.022 5.803 -13.025 1.00 0.00 C ATOM 121 C LEU A 9 11.355 4.708 -12.028 1.00 0.00 C ATOM 122 O LEU A 9 10.493 3.992 -11.561 1.00 0.00 O ATOM 123 CB LEU A 9 10.575 7.066 -12.282 1.00 0.00 C ATOM 124 CG LEU A 9 11.759 7.641 -11.500 1.00 0.00 C ATOM 125 CD1 LEU A 9 11.748 9.168 -11.598 1.00 0.00 C ATOM 126 CD2 LEU A 9 11.649 7.229 -10.030 1.00 0.00 C ATOM 0 H LEU A 9 9.145 4.888 -13.475 1.00 0.00 H new ATOM 0 HA LEU A 9 11.909 6.036 -13.615 1.00 0.00 H new ATOM 0 HB2 LEU A 9 10.200 7.804 -12.990 1.00 0.00 H new ATOM 0 HB3 LEU A 9 9.756 6.831 -11.603 1.00 0.00 H new ATOM 0 HG LEU A 9 12.688 7.256 -11.920 1.00 0.00 H new ATOM 0 HD11 LEU A 9 12.592 9.574 -11.040 1.00 0.00 H new ATOM 0 HD12 LEU A 9 11.826 9.466 -12.644 1.00 0.00 H new ATOM 0 HD13 LEU A 9 10.818 9.553 -11.180 1.00 0.00 H new ATOM 0 HD21 LEU A 9 12.492 7.638 -9.473 1.00 0.00 H new ATOM 0 HD22 LEU A 9 10.718 7.613 -9.613 1.00 0.00 H new ATOM 0 HD23 LEU A 9 11.659 6.142 -9.955 1.00 0.00 H new ATOM 138 N VAL A 10 12.605 4.567 -11.708 1.00 0.00 N ATOM 139 CA VAL A 10 13.013 3.504 -10.762 1.00 0.00 C ATOM 140 C VAL A 10 13.919 4.101 -9.682 1.00 0.00 C ATOM 141 O VAL A 10 14.776 4.914 -9.959 1.00 0.00 O ATOM 142 CB VAL A 10 13.776 2.421 -11.535 1.00 0.00 C ATOM 143 CG1 VAL A 10 14.976 3.055 -12.242 1.00 0.00 C ATOM 144 CG2 VAL A 10 14.269 1.339 -10.571 1.00 0.00 C ATOM 0 H VAL A 10 13.365 5.146 -12.064 1.00 0.00 H new ATOM 0 HA VAL A 10 12.133 3.069 -10.289 1.00 0.00 H new ATOM 0 HB VAL A 10 13.110 1.969 -12.270 1.00 0.00 H new ATOM 0 HG11 VAL A 10 15.521 2.288 -12.793 1.00 0.00 H new ATOM 0 HG12 VAL A 10 14.627 3.821 -12.935 1.00 0.00 H new ATOM 0 HG13 VAL A 10 15.636 3.509 -11.503 1.00 0.00 H new ATOM 0 HG21 VAL A 10 14.810 0.574 -11.128 1.00 0.00 H new ATOM 0 HG22 VAL A 10 14.933 1.786 -9.831 1.00 0.00 H new ATOM 0 HG23 VAL A 10 13.416 0.885 -10.066 1.00 0.00 H new ATOM 154 N VAL A 11 13.757 3.679 -8.460 1.00 0.00 N ATOM 155 CA VAL A 11 14.630 4.195 -7.371 1.00 0.00 C ATOM 156 C VAL A 11 15.323 2.985 -6.774 1.00 0.00 C ATOM 157 O VAL A 11 14.704 1.963 -6.559 1.00 0.00 O ATOM 158 CB VAL A 11 13.806 4.912 -6.298 1.00 0.00 C ATOM 159 CG1 VAL A 11 14.540 6.186 -5.880 1.00 0.00 C ATOM 160 CG2 VAL A 11 12.430 5.279 -6.861 1.00 0.00 C ATOM 0 H VAL A 11 13.056 2.998 -8.168 1.00 0.00 H new ATOM 0 HA VAL A 11 15.346 4.920 -7.759 1.00 0.00 H new ATOM 0 HB VAL A 11 13.676 4.257 -5.437 1.00 0.00 H new ATOM 0 HG11 VAL A 11 13.962 6.705 -5.116 1.00 0.00 H new ATOM 0 HG12 VAL A 11 15.520 5.927 -5.480 1.00 0.00 H new ATOM 0 HG13 VAL A 11 14.662 6.836 -6.746 1.00 0.00 H new ATOM 0 HG21 VAL A 11 11.847 5.789 -6.094 1.00 0.00 H new ATOM 0 HG22 VAL A 11 12.553 5.937 -7.721 1.00 0.00 H new ATOM 0 HG23 VAL A 11 11.909 4.372 -7.169 1.00 0.00 H new ATOM 170 N VAL A 12 16.600 3.044 -6.550 1.00 0.00 N ATOM 171 CA VAL A 12 17.265 1.831 -6.016 1.00 0.00 C ATOM 172 C VAL A 12 18.272 2.140 -4.910 1.00 0.00 C ATOM 173 O VAL A 12 18.746 3.247 -4.750 1.00 0.00 O ATOM 174 CB VAL A 12 17.983 1.154 -7.172 1.00 0.00 C ATOM 175 CG1 VAL A 12 17.070 1.170 -8.399 1.00 0.00 C ATOM 176 CG2 VAL A 12 19.266 1.927 -7.488 1.00 0.00 C ATOM 0 H VAL A 12 17.199 3.855 -6.708 1.00 0.00 H new ATOM 0 HA VAL A 12 16.503 1.190 -5.574 1.00 0.00 H new ATOM 0 HB VAL A 12 18.230 0.126 -6.907 1.00 0.00 H new ATOM 0 HG11 VAL A 12 17.575 0.686 -9.235 1.00 0.00 H new ATOM 0 HG12 VAL A 12 16.148 0.634 -8.173 1.00 0.00 H new ATOM 0 HG13 VAL A 12 16.835 2.201 -8.664 1.00 0.00 H new ATOM 0 HG21 VAL A 12 19.786 1.446 -8.317 1.00 0.00 H new ATOM 0 HG22 VAL A 12 19.015 2.952 -7.763 1.00 0.00 H new ATOM 0 HG23 VAL A 12 19.912 1.934 -6.610 1.00 0.00 H new ATOM 186 N LYS A 13 18.620 1.120 -4.172 1.00 0.00 N ATOM 187 CA LYS A 13 19.633 1.250 -3.095 1.00 0.00 C ATOM 188 C LYS A 13 20.617 0.089 -3.266 1.00 0.00 C ATOM 189 O LYS A 13 20.271 -0.940 -3.812 1.00 0.00 O ATOM 190 CB LYS A 13 18.948 1.182 -1.726 1.00 0.00 C ATOM 191 CG LYS A 13 20.016 1.146 -0.627 1.00 0.00 C ATOM 192 CD LYS A 13 20.858 2.422 -0.687 1.00 0.00 C ATOM 193 CE LYS A 13 21.554 2.639 0.657 1.00 0.00 C ATOM 194 NZ LYS A 13 22.032 1.330 1.186 1.00 0.00 N ATOM 0 H LYS A 13 18.233 0.182 -4.277 1.00 0.00 H new ATOM 0 HA LYS A 13 20.155 2.205 -3.155 1.00 0.00 H new ATOM 0 HB2 LYS A 13 18.297 2.046 -1.589 1.00 0.00 H new ATOM 0 HB3 LYS A 13 18.317 0.295 -1.666 1.00 0.00 H new ATOM 0 HG2 LYS A 13 19.543 1.056 0.351 1.00 0.00 H new ATOM 0 HG3 LYS A 13 20.654 0.271 -0.754 1.00 0.00 H new ATOM 0 HD2 LYS A 13 21.598 2.345 -1.483 1.00 0.00 H new ATOM 0 HD3 LYS A 13 20.225 3.277 -0.923 1.00 0.00 H new ATOM 0 HE2 LYS A 13 22.394 3.324 0.537 1.00 0.00 H new ATOM 0 HE3 LYS A 13 20.865 3.100 1.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 22.788 1.492 1.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 21.242 0.831 1.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 22.400 0.753 0.403 1.00 0.00 H new ATOM 208 N PHE A 14 21.840 0.243 -2.842 1.00 0.00 N ATOM 209 CA PHE A 14 22.836 -0.856 -3.041 1.00 0.00 C ATOM 210 C PHE A 14 23.241 -1.501 -1.706 1.00 0.00 C ATOM 211 O PHE A 14 23.280 -0.858 -0.675 1.00 0.00 O ATOM 212 CB PHE A 14 24.074 -0.265 -3.711 1.00 0.00 C ATOM 213 CG PHE A 14 24.832 0.578 -2.713 1.00 0.00 C ATOM 214 CD1 PHE A 14 24.497 1.927 -2.534 1.00 0.00 C ATOM 215 CD2 PHE A 14 25.870 0.009 -1.965 1.00 0.00 C ATOM 216 CE1 PHE A 14 25.202 2.705 -1.608 1.00 0.00 C ATOM 217 CE2 PHE A 14 26.574 0.789 -1.039 1.00 0.00 C ATOM 218 CZ PHE A 14 26.239 2.136 -0.861 1.00 0.00 C ATOM 0 H PHE A 14 22.195 1.074 -2.369 1.00 0.00 H new ATOM 0 HA PHE A 14 22.385 -1.630 -3.662 1.00 0.00 H new ATOM 0 HB2 PHE A 14 24.713 -1.064 -4.088 1.00 0.00 H new ATOM 0 HB3 PHE A 14 23.782 0.342 -4.568 1.00 0.00 H new ATOM 0 HD1 PHE A 14 23.696 2.366 -3.110 1.00 0.00 H new ATOM 0 HD2 PHE A 14 26.128 -1.031 -2.102 1.00 0.00 H new ATOM 0 HE1 PHE A 14 24.945 3.745 -1.470 1.00 0.00 H new ATOM 0 HE2 PHE A 14 27.375 0.351 -0.462 1.00 0.00 H new ATOM 0 HZ PHE A 14 26.782 2.737 -0.146 1.00 0.00 H new ATOM 228 N LYS A 15 23.570 -2.771 -1.734 1.00 0.00 N ATOM 229 CA LYS A 15 24.030 -3.464 -0.493 1.00 0.00 C ATOM 230 C LYS A 15 25.327 -4.215 -0.806 1.00 0.00 C ATOM 231 O LYS A 15 26.104 -4.529 0.074 1.00 0.00 O ATOM 232 CB LYS A 15 22.964 -4.448 -0.002 1.00 0.00 C ATOM 233 CG LYS A 15 22.748 -5.541 -1.049 1.00 0.00 C ATOM 234 CD LYS A 15 21.605 -6.457 -0.603 1.00 0.00 C ATOM 235 CE LYS A 15 21.541 -7.672 -1.529 1.00 0.00 C ATOM 236 NZ LYS A 15 21.242 -7.228 -2.920 1.00 0.00 N ATOM 0 H LYS A 15 23.539 -3.358 -2.568 1.00 0.00 H new ATOM 0 HA LYS A 15 24.202 -2.728 0.293 1.00 0.00 H new ATOM 0 HB2 LYS A 15 23.274 -4.893 0.943 1.00 0.00 H new ATOM 0 HB3 LYS A 15 22.028 -3.921 0.186 1.00 0.00 H new ATOM 0 HG2 LYS A 15 22.514 -5.093 -2.015 1.00 0.00 H new ATOM 0 HG3 LYS A 15 23.662 -6.120 -1.180 1.00 0.00 H new ATOM 0 HD2 LYS A 15 21.762 -6.778 0.427 1.00 0.00 H new ATOM 0 HD3 LYS A 15 20.659 -5.916 -0.628 1.00 0.00 H new ATOM 0 HE2 LYS A 15 22.488 -8.210 -1.505 1.00 0.00 H new ATOM 0 HE3 LYS A 15 20.772 -8.364 -1.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 21.731 -7.849 -3.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 20.217 -7.275 -3.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 21.569 -6.249 -3.050 1.00 0.00 H new ATOM 250 N GLU A 16 25.581 -4.469 -2.062 1.00 0.00 N ATOM 251 CA GLU A 16 26.850 -5.148 -2.448 1.00 0.00 C ATOM 252 C GLU A 16 27.877 -4.049 -2.736 1.00 0.00 C ATOM 253 O GLU A 16 28.937 -3.985 -2.147 1.00 0.00 O ATOM 254 CB GLU A 16 26.628 -5.988 -3.717 1.00 0.00 C ATOM 255 CG GLU A 16 25.596 -7.087 -3.446 1.00 0.00 C ATOM 256 CD GLU A 16 25.456 -7.980 -4.685 1.00 0.00 C ATOM 257 OE1 GLU A 16 25.995 -7.617 -5.719 1.00 0.00 O ATOM 258 OE2 GLU A 16 24.812 -9.012 -4.578 1.00 0.00 O ATOM 0 H GLU A 16 24.962 -4.235 -2.838 1.00 0.00 H new ATOM 0 HA GLU A 16 27.193 -5.809 -1.653 1.00 0.00 H new ATOM 0 HB2 GLU A 16 26.285 -5.349 -4.530 1.00 0.00 H new ATOM 0 HB3 GLU A 16 27.570 -6.434 -4.037 1.00 0.00 H new ATOM 0 HG2 GLU A 16 25.903 -7.685 -2.588 1.00 0.00 H new ATOM 0 HG3 GLU A 16 24.633 -6.642 -3.196 1.00 0.00 H new ATOM 265 N ASP A 17 27.532 -3.178 -3.644 1.00 0.00 N ATOM 266 CA ASP A 17 28.402 -2.028 -4.015 1.00 0.00 C ATOM 267 C ASP A 17 28.032 -1.647 -5.445 1.00 0.00 C ATOM 268 O ASP A 17 28.810 -1.798 -6.366 1.00 0.00 O ATOM 269 CB ASP A 17 29.880 -2.419 -3.944 1.00 0.00 C ATOM 270 CG ASP A 17 30.722 -1.379 -4.688 1.00 0.00 C ATOM 271 OD1 ASP A 17 30.210 -0.301 -4.941 1.00 0.00 O ATOM 272 OD2 ASP A 17 31.867 -1.678 -4.986 1.00 0.00 O ATOM 0 H ASP A 17 26.653 -3.219 -4.160 1.00 0.00 H new ATOM 0 HA ASP A 17 28.253 -1.195 -3.328 1.00 0.00 H new ATOM 0 HB2 ASP A 17 30.200 -2.484 -2.904 1.00 0.00 H new ATOM 0 HB3 ASP A 17 30.028 -3.405 -4.385 1.00 0.00 H new ATOM 277 N THR A 18 26.820 -1.207 -5.639 1.00 0.00 N ATOM 278 CA THR A 18 26.347 -0.880 -7.014 1.00 0.00 C ATOM 279 C THR A 18 27.315 0.019 -7.773 1.00 0.00 C ATOM 280 O THR A 18 27.385 1.216 -7.565 1.00 0.00 O ATOM 281 CB THR A 18 24.990 -0.183 -6.957 1.00 0.00 C ATOM 282 OG1 THR A 18 24.056 -1.022 -6.297 1.00 0.00 O ATOM 283 CG2 THR A 18 24.520 0.089 -8.385 1.00 0.00 C ATOM 0 H THR A 18 26.133 -1.059 -4.900 1.00 0.00 H new ATOM 0 HA THR A 18 26.274 -1.830 -7.544 1.00 0.00 H new ATOM 0 HB THR A 18 25.073 0.756 -6.410 1.00 0.00 H new ATOM 0 HG1 THR A 18 23.951 -1.855 -6.802 1.00 0.00 H new ATOM 0 HG21 THR A 18 23.551 0.587 -8.360 1.00 0.00 H new ATOM 0 HG22 THR A 18 25.244 0.728 -8.891 1.00 0.00 H new ATOM 0 HG23 THR A 18 24.430 -0.854 -8.924 1.00 0.00 H new ATOM 291 N LYS A 19 28.019 -0.557 -8.704 1.00 0.00 N ATOM 292 CA LYS A 19 28.931 0.237 -9.555 1.00 0.00 C ATOM 293 C LYS A 19 28.032 1.108 -10.424 1.00 0.00 C ATOM 294 O LYS A 19 27.695 0.755 -11.534 1.00 0.00 O ATOM 295 CB LYS A 19 29.763 -0.702 -10.434 1.00 0.00 C ATOM 296 CG LYS A 19 30.204 -1.915 -9.606 1.00 0.00 C ATOM 297 CD LYS A 19 29.036 -2.896 -9.469 1.00 0.00 C ATOM 298 CE LYS A 19 29.451 -4.272 -10.002 1.00 0.00 C ATOM 299 NZ LYS A 19 30.733 -4.691 -9.370 1.00 0.00 N ATOM 0 H LYS A 19 27.998 -1.556 -8.910 1.00 0.00 H new ATOM 0 HA LYS A 19 29.621 0.839 -8.964 1.00 0.00 H new ATOM 0 HB2 LYS A 19 29.177 -1.028 -11.294 1.00 0.00 H new ATOM 0 HB3 LYS A 19 30.635 -0.177 -10.823 1.00 0.00 H new ATOM 0 HG2 LYS A 19 31.051 -2.407 -10.085 1.00 0.00 H new ATOM 0 HG3 LYS A 19 30.539 -1.593 -8.620 1.00 0.00 H new ATOM 0 HD2 LYS A 19 28.736 -2.976 -8.424 1.00 0.00 H new ATOM 0 HD3 LYS A 19 28.172 -2.527 -10.021 1.00 0.00 H new ATOM 0 HE2 LYS A 19 28.673 -5.005 -9.789 1.00 0.00 H new ATOM 0 HE3 LYS A 19 29.564 -4.234 -11.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 30.715 -5.716 -9.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 31.524 -4.462 -10.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 30.856 -4.188 -8.468 1.00 0.00 H new ATOM 313 N VAL A 20 27.604 2.222 -9.904 1.00 0.00 N ATOM 314 CA VAL A 20 26.696 3.117 -10.677 1.00 0.00 C ATOM 315 C VAL A 20 27.385 3.608 -11.953 1.00 0.00 C ATOM 316 O VAL A 20 26.792 3.659 -13.012 1.00 0.00 O ATOM 317 CB VAL A 20 26.336 4.319 -9.814 1.00 0.00 C ATOM 318 CG1 VAL A 20 25.661 3.844 -8.528 1.00 0.00 C ATOM 319 CG2 VAL A 20 27.615 5.087 -9.463 1.00 0.00 C ATOM 0 H VAL A 20 27.845 2.555 -8.970 1.00 0.00 H new ATOM 0 HA VAL A 20 25.799 2.561 -10.951 1.00 0.00 H new ATOM 0 HB VAL A 20 25.653 4.969 -10.361 1.00 0.00 H new ATOM 0 HG11 VAL A 20 25.404 4.706 -7.912 1.00 0.00 H new ATOM 0 HG12 VAL A 20 24.754 3.292 -8.775 1.00 0.00 H new ATOM 0 HG13 VAL A 20 26.342 3.195 -7.978 1.00 0.00 H new ATOM 0 HG21 VAL A 20 27.364 5.949 -8.845 1.00 0.00 H new ATOM 0 HG22 VAL A 20 28.293 4.433 -8.915 1.00 0.00 H new ATOM 0 HG23 VAL A 20 28.099 5.426 -10.379 1.00 0.00 H new ATOM 329 N ASP A 21 28.626 3.981 -11.852 1.00 0.00 N ATOM 330 CA ASP A 21 29.359 4.488 -13.047 1.00 0.00 C ATOM 331 C ASP A 21 29.535 3.373 -14.084 1.00 0.00 C ATOM 332 O ASP A 21 29.334 3.584 -15.264 1.00 0.00 O ATOM 333 CB ASP A 21 30.721 5.006 -12.605 1.00 0.00 C ATOM 334 CG ASP A 21 31.540 3.839 -12.048 1.00 0.00 C ATOM 335 OD1 ASP A 21 30.935 2.872 -11.609 1.00 0.00 O ATOM 336 OD2 ASP A 21 32.757 3.925 -12.075 1.00 0.00 O ATOM 0 H ASP A 21 29.170 3.958 -10.990 1.00 0.00 H new ATOM 0 HA ASP A 21 28.786 5.293 -13.507 1.00 0.00 H new ATOM 0 HB2 ASP A 21 31.241 5.463 -13.447 1.00 0.00 H new ATOM 0 HB3 ASP A 21 30.602 5.779 -11.846 1.00 0.00 H new ATOM 341 N GLU A 22 29.887 2.185 -13.670 1.00 0.00 N ATOM 342 CA GLU A 22 30.027 1.080 -14.660 1.00 0.00 C ATOM 343 C GLU A 22 28.625 0.721 -15.131 1.00 0.00 C ATOM 344 O GLU A 22 28.392 0.401 -16.281 1.00 0.00 O ATOM 345 CB GLU A 22 30.682 -0.134 -14.006 1.00 0.00 C ATOM 346 CG GLU A 22 32.143 0.187 -13.696 1.00 0.00 C ATOM 347 CD GLU A 22 32.823 -1.049 -13.105 1.00 0.00 C ATOM 348 OE1 GLU A 22 32.122 -1.998 -12.796 1.00 0.00 O ATOM 349 OE2 GLU A 22 34.036 -1.023 -12.968 1.00 0.00 O ATOM 0 H GLU A 22 30.081 1.934 -12.701 1.00 0.00 H new ATOM 0 HA GLU A 22 30.653 1.389 -15.497 1.00 0.00 H new ATOM 0 HB2 GLU A 22 30.153 -0.398 -13.090 1.00 0.00 H new ATOM 0 HB3 GLU A 22 30.620 -0.997 -14.669 1.00 0.00 H new ATOM 0 HG2 GLU A 22 32.658 0.499 -14.604 1.00 0.00 H new ATOM 0 HG3 GLU A 22 32.203 1.019 -12.994 1.00 0.00 H new ATOM 356 N ILE A 23 27.682 0.827 -14.245 1.00 0.00 N ATOM 357 CA ILE A 23 26.273 0.566 -14.608 1.00 0.00 C ATOM 358 C ILE A 23 25.863 1.680 -15.568 1.00 0.00 C ATOM 359 O ILE A 23 25.264 1.451 -16.602 1.00 0.00 O ATOM 360 CB ILE A 23 25.435 0.624 -13.328 1.00 0.00 C ATOM 361 CG1 ILE A 23 25.458 -0.747 -12.650 1.00 0.00 C ATOM 362 CG2 ILE A 23 23.994 1.020 -13.652 1.00 0.00 C ATOM 363 CD1 ILE A 23 24.452 -1.674 -13.333 1.00 0.00 C ATOM 0 H ILE A 23 27.833 1.088 -13.270 1.00 0.00 H new ATOM 0 HA ILE A 23 26.131 -0.408 -15.075 1.00 0.00 H new ATOM 0 HB ILE A 23 25.856 1.373 -12.657 1.00 0.00 H new ATOM 0 HG12 ILE A 23 26.459 -1.175 -12.707 1.00 0.00 H new ATOM 0 HG13 ILE A 23 25.214 -0.645 -11.593 1.00 0.00 H new ATOM 0 HG21 ILE A 23 23.411 1.057 -12.732 1.00 0.00 H new ATOM 0 HG22 ILE A 23 23.984 2.001 -14.127 1.00 0.00 H new ATOM 0 HG23 ILE A 23 23.558 0.285 -14.328 1.00 0.00 H new ATOM 0 HD11 ILE A 23 24.470 -2.650 -12.849 1.00 0.00 H new ATOM 0 HD12 ILE A 23 23.452 -1.248 -13.253 1.00 0.00 H new ATOM 0 HD13 ILE A 23 24.716 -1.786 -14.385 1.00 0.00 H new ATOM 375 N LEU A 24 26.225 2.886 -15.228 1.00 0.00 N ATOM 376 CA LEU A 24 25.918 4.051 -16.093 1.00 0.00 C ATOM 377 C LEU A 24 26.426 3.767 -17.509 1.00 0.00 C ATOM 378 O LEU A 24 25.785 4.107 -18.484 1.00 0.00 O ATOM 379 CB LEU A 24 26.630 5.274 -15.516 1.00 0.00 C ATOM 380 CG LEU A 24 26.217 6.531 -16.275 1.00 0.00 C ATOM 381 CD1 LEU A 24 24.832 6.979 -15.804 1.00 0.00 C ATOM 382 CD2 LEU A 24 27.235 7.638 -15.992 1.00 0.00 C ATOM 0 H LEU A 24 26.729 3.113 -14.371 1.00 0.00 H new ATOM 0 HA LEU A 24 24.844 4.234 -16.131 1.00 0.00 H new ATOM 0 HB2 LEU A 24 26.385 5.382 -14.459 1.00 0.00 H new ATOM 0 HB3 LEU A 24 27.710 5.139 -15.581 1.00 0.00 H new ATOM 0 HG LEU A 24 26.184 6.324 -17.345 1.00 0.00 H new ATOM 0 HD11 LEU A 24 24.536 7.877 -16.346 1.00 0.00 H new ATOM 0 HD12 LEU A 24 24.109 6.186 -15.994 1.00 0.00 H new ATOM 0 HD13 LEU A 24 24.863 7.193 -14.736 1.00 0.00 H new ATOM 0 HD21 LEU A 24 26.949 8.542 -16.530 1.00 0.00 H new ATOM 0 HD22 LEU A 24 27.259 7.845 -14.922 1.00 0.00 H new ATOM 0 HD23 LEU A 24 28.223 7.317 -16.322 1.00 0.00 H new ATOM 394 N LYS A 25 27.563 3.127 -17.639 1.00 0.00 N ATOM 395 CA LYS A 25 28.068 2.807 -19.004 1.00 0.00 C ATOM 396 C LYS A 25 27.026 1.919 -19.674 1.00 0.00 C ATOM 397 O LYS A 25 26.781 2.010 -20.860 1.00 0.00 O ATOM 398 CB LYS A 25 29.406 2.063 -18.925 1.00 0.00 C ATOM 399 CG LYS A 25 29.941 1.832 -20.341 1.00 0.00 C ATOM 400 CD LYS A 25 30.422 0.385 -20.485 1.00 0.00 C ATOM 401 CE LYS A 25 29.220 -0.561 -20.440 1.00 0.00 C ATOM 402 NZ LYS A 25 29.465 -1.722 -21.344 1.00 0.00 N ATOM 0 H LYS A 25 28.154 2.817 -16.868 1.00 0.00 H new ATOM 0 HA LYS A 25 28.229 3.724 -19.571 1.00 0.00 H new ATOM 0 HB2 LYS A 25 30.123 2.642 -18.343 1.00 0.00 H new ATOM 0 HB3 LYS A 25 29.275 1.110 -18.413 1.00 0.00 H new ATOM 0 HG2 LYS A 25 29.160 2.040 -21.073 1.00 0.00 H new ATOM 0 HG3 LYS A 25 30.761 2.520 -20.546 1.00 0.00 H new ATOM 0 HD2 LYS A 25 30.960 0.262 -21.425 1.00 0.00 H new ATOM 0 HD3 LYS A 25 31.120 0.141 -19.684 1.00 0.00 H new ATOM 0 HE2 LYS A 25 29.056 -0.909 -19.420 1.00 0.00 H new ATOM 0 HE3 LYS A 25 28.317 -0.033 -20.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 28.796 -2.485 -21.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 29.332 -1.427 -22.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 30.438 -2.065 -21.213 1.00 0.00 H new ATOM 416 N GLY A 26 26.393 1.076 -18.904 1.00 0.00 N ATOM 417 CA GLY A 26 25.333 0.206 -19.474 1.00 0.00 C ATOM 418 C GLY A 26 24.239 1.108 -20.037 1.00 0.00 C ATOM 419 O GLY A 26 23.873 1.014 -21.193 1.00 0.00 O ATOM 0 H GLY A 26 26.566 0.954 -17.906 1.00 0.00 H new ATOM 0 HA2 GLY A 26 25.743 -0.431 -20.258 1.00 0.00 H new ATOM 0 HA3 GLY A 26 24.927 -0.453 -18.707 1.00 0.00 H new ATOM 423 N LEU A 27 23.725 1.997 -19.228 1.00 0.00 N ATOM 424 CA LEU A 27 22.672 2.931 -19.711 1.00 0.00 C ATOM 425 C LEU A 27 23.098 3.497 -21.069 1.00 0.00 C ATOM 426 O LEU A 27 22.311 3.565 -21.993 1.00 0.00 O ATOM 427 CB LEU A 27 22.499 4.067 -18.695 1.00 0.00 C ATOM 428 CG LEU A 27 21.100 4.678 -18.829 1.00 0.00 C ATOM 429 CD1 LEU A 27 20.808 5.554 -17.607 1.00 0.00 C ATOM 430 CD2 LEU A 27 21.041 5.539 -20.093 1.00 0.00 C ATOM 0 H LEU A 27 23.992 2.115 -18.251 1.00 0.00 H new ATOM 0 HA LEU A 27 21.723 2.406 -19.820 1.00 0.00 H new ATOM 0 HB2 LEU A 27 22.644 3.687 -17.684 1.00 0.00 H new ATOM 0 HB3 LEU A 27 23.257 4.833 -18.860 1.00 0.00 H new ATOM 0 HG LEU A 27 20.359 3.881 -18.893 1.00 0.00 H new ATOM 0 HD11 LEU A 27 19.813 5.989 -17.701 1.00 0.00 H new ATOM 0 HD12 LEU A 27 20.854 4.946 -16.704 1.00 0.00 H new ATOM 0 HD13 LEU A 27 21.549 6.351 -17.546 1.00 0.00 H new ATOM 0 HD21 LEU A 27 20.047 5.975 -20.190 1.00 0.00 H new ATOM 0 HD22 LEU A 27 21.781 6.336 -20.025 1.00 0.00 H new ATOM 0 HD23 LEU A 27 21.253 4.920 -20.965 1.00 0.00 H new ATOM 442 N GLU A 28 24.341 3.885 -21.211 1.00 0.00 N ATOM 443 CA GLU A 28 24.795 4.414 -22.529 1.00 0.00 C ATOM 444 C GLU A 28 24.380 3.403 -23.592 1.00 0.00 C ATOM 445 O GLU A 28 24.026 3.754 -24.700 1.00 0.00 O ATOM 446 CB GLU A 28 26.320 4.578 -22.536 1.00 0.00 C ATOM 447 CG GLU A 28 26.748 5.469 -21.365 1.00 0.00 C ATOM 448 CD GLU A 28 26.115 6.854 -21.519 1.00 0.00 C ATOM 449 OE1 GLU A 28 25.734 7.187 -22.628 1.00 0.00 O ATOM 450 OE2 GLU A 28 26.020 7.555 -20.526 1.00 0.00 O ATOM 0 H GLU A 28 25.052 3.858 -20.480 1.00 0.00 H new ATOM 0 HA GLU A 28 24.348 5.389 -22.724 1.00 0.00 H new ATOM 0 HB2 GLU A 28 26.801 3.603 -22.458 1.00 0.00 H new ATOM 0 HB3 GLU A 28 26.644 5.019 -23.479 1.00 0.00 H new ATOM 0 HG2 GLU A 28 26.440 5.020 -20.421 1.00 0.00 H new ATOM 0 HG3 GLU A 28 27.834 5.555 -21.338 1.00 0.00 H new ATOM 457 N ASN A 29 24.386 2.147 -23.241 1.00 0.00 N ATOM 458 CA ASN A 29 23.963 1.099 -24.204 1.00 0.00 C ATOM 459 C ASN A 29 22.468 1.294 -24.476 1.00 0.00 C ATOM 460 O ASN A 29 22.017 1.267 -25.604 1.00 0.00 O ATOM 461 CB ASN A 29 24.231 -0.277 -23.575 1.00 0.00 C ATOM 462 CG ASN A 29 25.678 -0.371 -23.095 1.00 0.00 C ATOM 463 OD1 ASN A 29 26.482 0.497 -23.367 1.00 0.00 O ATOM 464 ND2 ASN A 29 26.041 -1.395 -22.373 1.00 0.00 N ATOM 0 H ASN A 29 24.668 1.802 -22.323 1.00 0.00 H new ATOM 0 HA ASN A 29 24.514 1.166 -25.142 1.00 0.00 H new ATOM 0 HB2 ASN A 29 23.552 -0.439 -22.738 1.00 0.00 H new ATOM 0 HB3 ASN A 29 24.031 -1.062 -24.304 1.00 0.00 H new ATOM 0 HD21 ASN A 29 27.001 -1.467 -22.036 1.00 0.00 H new ATOM 0 HD22 ASN A 29 25.365 -2.124 -22.145 1.00 0.00 H new ATOM 471 N LEU A 30 21.704 1.522 -23.437 1.00 0.00 N ATOM 472 CA LEU A 30 20.238 1.754 -23.601 1.00 0.00 C ATOM 473 C LEU A 30 20.030 2.806 -24.694 1.00 0.00 C ATOM 474 O LEU A 30 19.241 2.631 -25.602 1.00 0.00 O ATOM 475 CB LEU A 30 19.673 2.272 -22.273 1.00 0.00 C ATOM 476 CG LEU A 30 19.048 1.131 -21.453 1.00 0.00 C ATOM 477 CD1 LEU A 30 17.680 0.760 -22.023 1.00 0.00 C ATOM 478 CD2 LEU A 30 19.964 -0.095 -21.481 1.00 0.00 C ATOM 0 H LEU A 30 22.038 1.557 -22.474 1.00 0.00 H new ATOM 0 HA LEU A 30 19.731 0.830 -23.879 1.00 0.00 H new ATOM 0 HB2 LEU A 30 20.468 2.745 -21.696 1.00 0.00 H new ATOM 0 HB3 LEU A 30 18.922 3.037 -22.468 1.00 0.00 H new ATOM 0 HG LEU A 30 18.926 1.467 -20.423 1.00 0.00 H new ATOM 0 HD11 LEU A 30 17.248 -0.049 -21.434 1.00 0.00 H new ATOM 0 HD12 LEU A 30 17.022 1.628 -21.985 1.00 0.00 H new ATOM 0 HD13 LEU A 30 17.793 0.435 -23.057 1.00 0.00 H new ATOM 0 HD21 LEU A 30 19.514 -0.899 -20.898 1.00 0.00 H new ATOM 0 HD22 LEU A 30 20.098 -0.425 -22.511 1.00 0.00 H new ATOM 0 HD23 LEU A 30 20.933 0.165 -21.054 1.00 0.00 H new ATOM 490 N VAL A 31 20.749 3.900 -24.619 1.00 0.00 N ATOM 491 CA VAL A 31 20.630 4.951 -25.675 1.00 0.00 C ATOM 492 C VAL A 31 20.689 4.282 -27.045 1.00 0.00 C ATOM 493 O VAL A 31 20.073 4.724 -27.994 1.00 0.00 O ATOM 494 CB VAL A 31 21.780 5.950 -25.543 1.00 0.00 C ATOM 495 CG1 VAL A 31 21.717 6.966 -26.687 1.00 0.00 C ATOM 496 CG2 VAL A 31 21.659 6.682 -24.206 1.00 0.00 C ATOM 0 H VAL A 31 21.412 4.109 -23.873 1.00 0.00 H new ATOM 0 HA VAL A 31 19.685 5.481 -25.561 1.00 0.00 H new ATOM 0 HB VAL A 31 22.730 5.418 -25.588 1.00 0.00 H new ATOM 0 HG11 VAL A 31 22.538 7.676 -26.589 1.00 0.00 H new ATOM 0 HG12 VAL A 31 21.799 6.445 -27.641 1.00 0.00 H new ATOM 0 HG13 VAL A 31 20.768 7.501 -26.647 1.00 0.00 H new ATOM 0 HG21 VAL A 31 22.477 7.396 -24.107 1.00 0.00 H new ATOM 0 HG22 VAL A 31 20.708 7.212 -24.166 1.00 0.00 H new ATOM 0 HG23 VAL A 31 21.706 5.960 -23.390 1.00 0.00 H new ATOM 506 N SER A 32 21.418 3.207 -27.148 1.00 0.00 N ATOM 507 CA SER A 32 21.488 2.485 -28.442 1.00 0.00 C ATOM 508 C SER A 32 20.072 2.351 -29.004 1.00 0.00 C ATOM 509 O SER A 32 19.819 2.635 -30.156 1.00 0.00 O ATOM 510 CB SER A 32 22.080 1.093 -28.210 1.00 0.00 C ATOM 511 OG SER A 32 21.138 0.290 -27.510 1.00 0.00 O ATOM 0 H SER A 32 21.967 2.799 -26.391 1.00 0.00 H new ATOM 0 HA SER A 32 22.116 3.032 -29.145 1.00 0.00 H new ATOM 0 HB2 SER A 32 22.332 0.629 -29.164 1.00 0.00 H new ATOM 0 HB3 SER A 32 23.005 1.170 -27.638 1.00 0.00 H new ATOM 0 HG SER A 32 21.364 0.277 -26.556 1.00 0.00 H new ATOM 517 N GLN A 33 19.150 1.899 -28.195 1.00 0.00 N ATOM 518 CA GLN A 33 17.745 1.750 -28.668 1.00 0.00 C ATOM 519 C GLN A 33 17.055 3.118 -28.824 1.00 0.00 C ATOM 520 O GLN A 33 15.982 3.199 -29.384 1.00 0.00 O ATOM 521 CB GLN A 33 16.967 0.906 -27.653 1.00 0.00 C ATOM 522 CG GLN A 33 17.783 -0.335 -27.281 1.00 0.00 C ATOM 523 CD GLN A 33 18.191 -1.082 -28.551 1.00 0.00 C ATOM 524 OE1 GLN A 33 17.375 -1.312 -29.423 1.00 0.00 O ATOM 525 NE2 GLN A 33 19.428 -1.475 -28.696 1.00 0.00 N ATOM 0 H GLN A 33 19.311 1.626 -27.225 1.00 0.00 H new ATOM 0 HA GLN A 33 17.759 1.264 -29.644 1.00 0.00 H new ATOM 0 HB2 GLN A 33 16.756 1.496 -26.761 1.00 0.00 H new ATOM 0 HB3 GLN A 33 16.006 0.609 -28.073 1.00 0.00 H new ATOM 0 HG2 GLN A 33 18.670 -0.044 -26.718 1.00 0.00 H new ATOM 0 HG3 GLN A 33 17.196 -0.988 -26.636 1.00 0.00 H new ATOM 0 HE21 GLN A 33 20.113 -1.283 -27.965 1.00 0.00 H new ATOM 0 HE22 GLN A 33 19.709 -1.974 -29.540 1.00 0.00 H new ATOM 534 N ILE A 34 17.620 4.194 -28.327 1.00 0.00 N ATOM 535 CA ILE A 34 16.904 5.503 -28.468 1.00 0.00 C ATOM 536 C ILE A 34 17.428 6.273 -29.673 1.00 0.00 C ATOM 537 O ILE A 34 17.293 7.477 -29.748 1.00 0.00 O ATOM 538 CB ILE A 34 17.053 6.372 -27.222 1.00 0.00 C ATOM 539 CG1 ILE A 34 16.753 5.544 -25.973 1.00 0.00 C ATOM 540 CG2 ILE A 34 16.048 7.527 -27.308 1.00 0.00 C ATOM 541 CD1 ILE A 34 15.405 4.841 -26.146 1.00 0.00 C ATOM 0 H ILE A 34 18.518 4.225 -27.844 1.00 0.00 H new ATOM 0 HA ILE A 34 15.848 5.272 -28.605 1.00 0.00 H new ATOM 0 HB ILE A 34 18.071 6.756 -27.163 1.00 0.00 H new ATOM 0 HG12 ILE A 34 17.542 4.809 -25.811 1.00 0.00 H new ATOM 0 HG13 ILE A 34 16.731 6.187 -25.093 1.00 0.00 H new ATOM 0 HG21 ILE A 34 16.142 8.158 -26.424 1.00 0.00 H new ATOM 0 HG22 ILE A 34 16.251 8.120 -28.200 1.00 0.00 H new ATOM 0 HG23 ILE A 34 15.036 7.126 -27.361 1.00 0.00 H new ATOM 0 HD11 ILE A 34 15.187 4.249 -25.257 1.00 0.00 H new ATOM 0 HD12 ILE A 34 14.622 5.586 -26.287 1.00 0.00 H new ATOM 0 HD13 ILE A 34 15.445 4.187 -27.017 1.00 0.00 H new ATOM 553 N ASP A 35 17.986 5.606 -30.641 1.00 0.00 N ATOM 554 CA ASP A 35 18.447 6.353 -31.832 1.00 0.00 C ATOM 555 C ASP A 35 17.207 7.039 -32.385 1.00 0.00 C ATOM 556 O ASP A 35 17.264 7.914 -33.224 1.00 0.00 O ATOM 557 CB ASP A 35 19.017 5.381 -32.866 1.00 0.00 C ATOM 558 CG ASP A 35 20.307 4.758 -32.334 1.00 0.00 C ATOM 559 OD1 ASP A 35 20.813 5.249 -31.338 1.00 0.00 O ATOM 560 OD2 ASP A 35 20.773 3.805 -32.935 1.00 0.00 O ATOM 0 H ASP A 35 18.139 4.598 -30.658 1.00 0.00 H new ATOM 0 HA ASP A 35 19.231 7.070 -31.588 1.00 0.00 H new ATOM 0 HB2 ASP A 35 18.289 4.600 -33.085 1.00 0.00 H new ATOM 0 HB3 ASP A 35 19.214 5.905 -33.801 1.00 0.00 H new ATOM 565 N THR A 36 16.074 6.623 -31.882 1.00 0.00 N ATOM 566 CA THR A 36 14.784 7.204 -32.310 1.00 0.00 C ATOM 567 C THR A 36 14.629 8.586 -31.682 1.00 0.00 C ATOM 568 O THR A 36 13.658 9.278 -31.907 1.00 0.00 O ATOM 569 CB THR A 36 13.646 6.294 -31.831 1.00 0.00 C ATOM 570 OG1 THR A 36 13.602 6.297 -30.408 1.00 0.00 O ATOM 571 CG2 THR A 36 13.893 4.869 -32.329 1.00 0.00 C ATOM 0 H THR A 36 15.996 5.889 -31.178 1.00 0.00 H new ATOM 0 HA THR A 36 14.753 7.290 -33.396 1.00 0.00 H new ATOM 0 HB THR A 36 12.697 6.660 -32.224 1.00 0.00 H new ATOM 0 HG1 THR A 36 12.874 5.717 -30.102 1.00 0.00 H new ATOM 0 HG21 THR A 36 13.086 4.220 -31.990 1.00 0.00 H new ATOM 0 HG22 THR A 36 13.928 4.865 -33.418 1.00 0.00 H new ATOM 0 HG23 THR A 36 14.841 4.505 -31.934 1.00 0.00 H new ATOM 579 N VAL A 37 15.583 9.000 -30.896 1.00 0.00 N ATOM 580 CA VAL A 37 15.474 10.339 -30.257 1.00 0.00 C ATOM 581 C VAL A 37 14.009 10.624 -29.934 1.00 0.00 C ATOM 582 O VAL A 37 13.559 11.750 -29.978 1.00 0.00 O ATOM 583 CB VAL A 37 15.987 11.406 -31.216 1.00 0.00 C ATOM 584 CG1 VAL A 37 17.450 11.138 -31.567 1.00 0.00 C ATOM 585 CG2 VAL A 37 15.144 11.384 -32.490 1.00 0.00 C ATOM 0 H VAL A 37 16.427 8.473 -30.670 1.00 0.00 H new ATOM 0 HA VAL A 37 16.067 10.353 -29.342 1.00 0.00 H new ATOM 0 HB VAL A 37 15.911 12.383 -30.739 1.00 0.00 H new ATOM 0 HG11 VAL A 37 17.806 11.907 -32.253 1.00 0.00 H new ATOM 0 HG12 VAL A 37 18.051 11.156 -30.658 1.00 0.00 H new ATOM 0 HG13 VAL A 37 17.537 10.160 -32.041 1.00 0.00 H new ATOM 0 HG21 VAL A 37 15.507 12.146 -33.180 1.00 0.00 H new ATOM 0 HG22 VAL A 37 15.220 10.403 -32.960 1.00 0.00 H new ATOM 0 HG23 VAL A 37 14.102 11.587 -32.241 1.00 0.00 H new ATOM 595 N LYS A 38 13.270 9.608 -29.602 1.00 0.00 N ATOM 596 CA LYS A 38 11.840 9.802 -29.258 1.00 0.00 C ATOM 597 C LYS A 38 11.641 9.327 -27.826 1.00 0.00 C ATOM 598 O LYS A 38 10.684 8.657 -27.500 1.00 0.00 O ATOM 599 CB LYS A 38 10.951 8.983 -30.200 1.00 0.00 C ATOM 600 CG LYS A 38 10.566 9.833 -31.408 1.00 0.00 C ATOM 601 CD LYS A 38 9.568 9.066 -32.276 1.00 0.00 C ATOM 602 CE LYS A 38 10.277 7.890 -32.948 1.00 0.00 C ATOM 603 NZ LYS A 38 9.491 7.449 -34.134 1.00 0.00 N ATOM 0 H LYS A 38 13.598 8.644 -29.554 1.00 0.00 H new ATOM 0 HA LYS A 38 11.568 10.853 -29.360 1.00 0.00 H new ATOM 0 HB2 LYS A 38 11.478 8.087 -30.526 1.00 0.00 H new ATOM 0 HB3 LYS A 38 10.055 8.652 -29.675 1.00 0.00 H new ATOM 0 HG2 LYS A 38 10.128 10.775 -31.078 1.00 0.00 H new ATOM 0 HG3 LYS A 38 11.454 10.081 -31.989 1.00 0.00 H new ATOM 0 HD2 LYS A 38 8.741 8.705 -31.665 1.00 0.00 H new ATOM 0 HD3 LYS A 38 9.142 9.727 -33.031 1.00 0.00 H new ATOM 0 HE2 LYS A 38 11.282 8.183 -33.253 1.00 0.00 H new ATOM 0 HE3 LYS A 38 10.385 7.066 -32.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 9.973 6.649 -34.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 8.541 7.154 -33.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 9.410 8.236 -34.809 1.00 0.00 H new ATOM 617 N SER A 39 12.562 9.665 -26.970 1.00 0.00 N ATOM 618 CA SER A 39 12.468 9.225 -25.556 1.00 0.00 C ATOM 619 C SER A 39 13.561 9.927 -24.739 1.00 0.00 C ATOM 620 O SER A 39 14.368 10.652 -25.286 1.00 0.00 O ATOM 621 CB SER A 39 12.654 7.715 -25.510 1.00 0.00 C ATOM 622 OG SER A 39 11.533 7.078 -26.100 1.00 0.00 O ATOM 0 H SER A 39 13.381 10.231 -27.193 1.00 0.00 H new ATOM 0 HA SER A 39 11.497 9.483 -25.134 1.00 0.00 H new ATOM 0 HB2 SER A 39 13.564 7.435 -26.040 1.00 0.00 H new ATOM 0 HB3 SER A 39 12.771 7.384 -24.478 1.00 0.00 H new ATOM 0 HG SER A 39 10.895 7.756 -26.406 1.00 0.00 H new ATOM 628 N PHE A 40 13.586 9.761 -23.444 1.00 0.00 N ATOM 629 CA PHE A 40 14.646 10.453 -22.655 1.00 0.00 C ATOM 630 C PHE A 40 15.086 9.630 -21.443 1.00 0.00 C ATOM 631 O PHE A 40 14.365 8.791 -20.940 1.00 0.00 O ATOM 632 CB PHE A 40 14.086 11.794 -22.174 1.00 0.00 C ATOM 633 CG PHE A 40 13.630 12.593 -23.361 1.00 0.00 C ATOM 634 CD1 PHE A 40 14.543 13.388 -24.059 1.00 0.00 C ATOM 635 CD2 PHE A 40 12.294 12.538 -23.764 1.00 0.00 C ATOM 636 CE1 PHE A 40 14.117 14.132 -25.163 1.00 0.00 C ATOM 637 CE2 PHE A 40 11.866 13.281 -24.866 1.00 0.00 C ATOM 638 CZ PHE A 40 12.777 14.080 -25.567 1.00 0.00 C ATOM 0 H PHE A 40 12.934 9.189 -22.907 1.00 0.00 H new ATOM 0 HA PHE A 40 15.518 10.592 -23.294 1.00 0.00 H new ATOM 0 HB2 PHE A 40 13.254 11.630 -21.490 1.00 0.00 H new ATOM 0 HB3 PHE A 40 14.849 12.343 -21.622 1.00 0.00 H new ATOM 0 HD1 PHE A 40 15.576 13.427 -23.746 1.00 0.00 H new ATOM 0 HD2 PHE A 40 11.592 11.921 -23.223 1.00 0.00 H new ATOM 0 HE1 PHE A 40 14.821 14.747 -25.704 1.00 0.00 H new ATOM 0 HE2 PHE A 40 10.833 13.239 -25.177 1.00 0.00 H new ATOM 0 HZ PHE A 40 12.447 14.656 -26.419 1.00 0.00 H new ATOM 648 N GLU A 41 16.280 9.898 -20.962 1.00 0.00 N ATOM 649 CA GLU A 41 16.820 9.154 -19.782 1.00 0.00 C ATOM 650 C GLU A 41 17.877 10.006 -19.053 1.00 0.00 C ATOM 651 O GLU A 41 18.880 10.390 -19.620 1.00 0.00 O ATOM 652 CB GLU A 41 17.473 7.865 -20.251 1.00 0.00 C ATOM 653 CG GLU A 41 16.502 7.084 -21.135 1.00 0.00 C ATOM 654 CD GLU A 41 17.082 5.702 -21.439 1.00 0.00 C ATOM 655 OE1 GLU A 41 18.228 5.472 -21.084 1.00 0.00 O ATOM 656 OE2 GLU A 41 16.373 4.899 -22.021 1.00 0.00 O ATOM 0 H GLU A 41 16.907 10.607 -21.342 1.00 0.00 H new ATOM 0 HA GLU A 41 15.997 8.934 -19.101 1.00 0.00 H new ATOM 0 HB2 GLU A 41 18.384 8.089 -20.806 1.00 0.00 H new ATOM 0 HB3 GLU A 41 17.764 7.260 -19.392 1.00 0.00 H new ATOM 0 HG2 GLU A 41 15.539 6.983 -20.634 1.00 0.00 H new ATOM 0 HG3 GLU A 41 16.323 7.626 -22.063 1.00 0.00 H new ATOM 663 N TRP A 42 17.664 10.286 -17.793 1.00 0.00 N ATOM 664 CA TRP A 42 18.659 11.084 -17.019 1.00 0.00 C ATOM 665 C TRP A 42 19.065 10.268 -15.798 1.00 0.00 C ATOM 666 O TRP A 42 18.466 9.253 -15.511 1.00 0.00 O ATOM 667 CB TRP A 42 18.021 12.407 -16.578 1.00 0.00 C ATOM 668 CG TRP A 42 17.322 13.055 -17.733 1.00 0.00 C ATOM 669 CD1 TRP A 42 15.984 13.232 -17.826 1.00 0.00 C ATOM 670 CD2 TRP A 42 17.893 13.613 -18.953 1.00 0.00 C ATOM 671 NE1 TRP A 42 15.696 13.864 -19.021 1.00 0.00 N ATOM 672 CE2 TRP A 42 16.840 14.118 -19.753 1.00 0.00 C ATOM 673 CE3 TRP A 42 19.208 13.724 -19.443 1.00 0.00 C ATOM 674 CZ2 TRP A 42 17.082 14.716 -20.992 1.00 0.00 C ATOM 675 CZ3 TRP A 42 19.455 14.326 -20.688 1.00 0.00 C ATOM 676 CH2 TRP A 42 18.394 14.820 -21.462 1.00 0.00 C ATOM 0 H TRP A 42 16.841 9.995 -17.266 1.00 0.00 H new ATOM 0 HA TRP A 42 19.534 11.307 -17.630 1.00 0.00 H new ATOM 0 HB2 TRP A 42 17.312 12.226 -15.770 1.00 0.00 H new ATOM 0 HB3 TRP A 42 18.787 13.076 -16.186 1.00 0.00 H new ATOM 0 HD1 TRP A 42 15.258 12.929 -17.086 1.00 0.00 H new ATOM 0 HE1 TRP A 42 14.755 14.112 -19.325 1.00 0.00 H new ATOM 0 HE3 TRP A 42 20.032 13.344 -18.858 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 16.261 15.095 -21.582 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 20.468 14.409 -21.052 1.00 0.00 H new ATOM 0 HH2 TRP A 42 18.591 15.280 -22.419 1.00 0.00 H new ATOM 687 N GLY A 43 20.070 10.677 -15.072 1.00 0.00 N ATOM 688 CA GLY A 43 20.462 9.875 -13.867 1.00 0.00 C ATOM 689 C GLY A 43 20.665 10.781 -12.653 1.00 0.00 C ATOM 690 O GLY A 43 20.879 11.970 -12.780 1.00 0.00 O ATOM 0 H GLY A 43 20.628 11.512 -15.251 1.00 0.00 H new ATOM 0 HA2 GLY A 43 19.690 9.136 -13.650 1.00 0.00 H new ATOM 0 HA3 GLY A 43 21.380 9.325 -14.074 1.00 0.00 H new ATOM 694 N GLU A 44 20.612 10.225 -11.474 1.00 0.00 N ATOM 695 CA GLU A 44 20.795 11.052 -10.251 1.00 0.00 C ATOM 696 C GLU A 44 21.407 10.196 -9.148 1.00 0.00 C ATOM 697 O GLU A 44 21.110 9.027 -9.016 1.00 0.00 O ATOM 698 CB GLU A 44 19.444 11.588 -9.764 1.00 0.00 C ATOM 699 CG GLU A 44 18.595 12.034 -10.955 1.00 0.00 C ATOM 700 CD GLU A 44 17.264 12.583 -10.442 1.00 0.00 C ATOM 701 OE1 GLU A 44 17.143 12.761 -9.241 1.00 0.00 O ATOM 702 OE2 GLU A 44 16.389 12.818 -11.258 1.00 0.00 O ATOM 0 H GLU A 44 20.450 9.232 -11.306 1.00 0.00 H new ATOM 0 HA GLU A 44 21.452 11.888 -10.490 1.00 0.00 H new ATOM 0 HB2 GLU A 44 18.919 10.816 -9.202 1.00 0.00 H new ATOM 0 HB3 GLU A 44 19.600 12.426 -9.085 1.00 0.00 H new ATOM 0 HG2 GLU A 44 19.121 12.798 -11.527 1.00 0.00 H new ATOM 0 HG3 GLU A 44 18.421 11.195 -11.628 1.00 0.00 H new ATOM 709 N ASP A 45 22.236 10.791 -8.346 1.00 0.00 N ATOM 710 CA ASP A 45 22.842 10.078 -7.190 1.00 0.00 C ATOM 711 C ASP A 45 22.556 10.929 -5.953 1.00 0.00 C ATOM 712 O ASP A 45 22.469 12.138 -6.048 1.00 0.00 O ATOM 713 CB ASP A 45 24.349 9.914 -7.400 1.00 0.00 C ATOM 714 CG ASP A 45 24.936 9.059 -6.278 1.00 0.00 C ATOM 715 OD1 ASP A 45 24.883 7.843 -6.398 1.00 0.00 O ATOM 716 OD2 ASP A 45 25.426 9.626 -5.317 1.00 0.00 O ATOM 0 H ASP A 45 22.527 11.764 -8.444 1.00 0.00 H new ATOM 0 HA ASP A 45 22.422 9.078 -7.077 1.00 0.00 H new ATOM 0 HB2 ASP A 45 24.542 9.447 -8.366 1.00 0.00 H new ATOM 0 HB3 ASP A 45 24.832 10.891 -7.416 1.00 0.00 H new ATOM 721 N LYS A 46 22.385 10.344 -4.802 1.00 0.00 N ATOM 722 CA LYS A 46 22.065 11.185 -3.613 1.00 0.00 C ATOM 723 C LYS A 46 22.713 10.586 -2.366 1.00 0.00 C ATOM 724 O LYS A 46 22.481 9.444 -2.022 1.00 0.00 O ATOM 725 CB LYS A 46 20.554 11.278 -3.419 1.00 0.00 C ATOM 726 CG LYS A 46 19.881 10.086 -4.107 1.00 0.00 C ATOM 727 CD LYS A 46 20.411 8.786 -3.503 1.00 0.00 C ATOM 728 CE LYS A 46 20.010 8.706 -2.029 1.00 0.00 C ATOM 729 NZ LYS A 46 20.985 7.848 -1.294 1.00 0.00 N ATOM 0 H LYS A 46 22.451 9.340 -4.632 1.00 0.00 H new ATOM 0 HA LYS A 46 22.459 12.188 -3.777 1.00 0.00 H new ATOM 0 HB2 LYS A 46 20.312 11.283 -2.356 1.00 0.00 H new ATOM 0 HB3 LYS A 46 20.179 12.213 -3.836 1.00 0.00 H new ATOM 0 HG2 LYS A 46 18.800 10.143 -3.983 1.00 0.00 H new ATOM 0 HG3 LYS A 46 20.081 10.110 -5.178 1.00 0.00 H new ATOM 0 HD2 LYS A 46 20.010 7.930 -4.047 1.00 0.00 H new ATOM 0 HD3 LYS A 46 21.496 8.744 -3.598 1.00 0.00 H new ATOM 0 HE2 LYS A 46 19.987 9.705 -1.593 1.00 0.00 H new ATOM 0 HE3 LYS A 46 19.005 8.294 -1.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 20.762 7.862 -0.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 20.925 6.872 -1.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 21.948 8.212 -1.442 1.00 0.00 H new ATOM 743 N GLU A 47 23.526 11.354 -1.690 1.00 0.00 N ATOM 744 CA GLU A 47 24.189 10.853 -0.450 1.00 0.00 C ATOM 745 C GLU A 47 24.075 11.914 0.649 1.00 0.00 C ATOM 746 O GLU A 47 24.599 11.757 1.732 1.00 0.00 O ATOM 747 CB GLU A 47 25.670 10.552 -0.725 1.00 0.00 C ATOM 748 CG GLU A 47 25.789 9.460 -1.789 1.00 0.00 C ATOM 749 CD GLU A 47 27.264 9.103 -1.993 1.00 0.00 C ATOM 750 OE1 GLU A 47 28.104 9.805 -1.455 1.00 0.00 O ATOM 751 OE2 GLU A 47 27.528 8.130 -2.681 1.00 0.00 O ATOM 0 H GLU A 47 23.761 12.313 -1.945 1.00 0.00 H new ATOM 0 HA GLU A 47 23.698 9.935 -0.128 1.00 0.00 H new ATOM 0 HB2 GLU A 47 26.178 11.456 -1.061 1.00 0.00 H new ATOM 0 HB3 GLU A 47 26.162 10.232 0.194 1.00 0.00 H new ATOM 0 HG2 GLU A 47 25.229 8.576 -1.482 1.00 0.00 H new ATOM 0 HG3 GLU A 47 25.354 9.803 -2.728 1.00 0.00 H new ATOM 758 N SER A 48 23.395 12.999 0.376 1.00 0.00 N ATOM 759 CA SER A 48 23.265 14.077 1.401 1.00 0.00 C ATOM 760 C SER A 48 22.647 13.513 2.686 1.00 0.00 C ATOM 761 O SER A 48 22.944 12.407 3.093 1.00 0.00 O ATOM 762 CB SER A 48 22.366 15.187 0.855 1.00 0.00 C ATOM 763 OG SER A 48 21.055 14.672 0.656 1.00 0.00 O ATOM 0 H SER A 48 22.926 13.184 -0.510 1.00 0.00 H new ATOM 0 HA SER A 48 24.254 14.475 1.626 1.00 0.00 H new ATOM 0 HB2 SER A 48 22.339 16.025 1.552 1.00 0.00 H new ATOM 0 HB3 SER A 48 22.767 15.567 -0.085 1.00 0.00 H new ATOM 0 HG SER A 48 20.475 15.381 0.308 1.00 0.00 H new ATOM 769 N HIS A 49 21.782 14.259 3.322 1.00 0.00 N ATOM 770 CA HIS A 49 21.193 13.790 4.612 1.00 0.00 C ATOM 771 C HIS A 49 20.158 12.697 4.338 1.00 0.00 C ATOM 772 O HIS A 49 19.656 12.561 3.240 1.00 0.00 O ATOM 773 CB HIS A 49 20.527 14.968 5.329 1.00 0.00 C ATOM 774 CG HIS A 49 20.044 14.523 6.682 1.00 0.00 C ATOM 775 ND1 HIS A 49 18.736 14.118 6.904 1.00 0.00 N ATOM 776 CD2 HIS A 49 20.681 14.413 7.895 1.00 0.00 C ATOM 777 CE1 HIS A 49 18.626 13.787 8.204 1.00 0.00 C ATOM 778 NE2 HIS A 49 19.783 13.948 8.849 1.00 0.00 N ATOM 0 H HIS A 49 21.458 15.172 3.004 1.00 0.00 H new ATOM 0 HA HIS A 49 21.982 13.384 5.245 1.00 0.00 H new ATOM 0 HB2 HIS A 49 21.235 15.790 5.436 1.00 0.00 H new ATOM 0 HB3 HIS A 49 19.691 15.342 4.738 1.00 0.00 H new ATOM 0 HD2 HIS A 49 21.718 14.651 8.079 1.00 0.00 H new ATOM 0 HE1 HIS A 49 17.716 13.435 8.667 1.00 0.00 H new ATOM 0 HE2 HIS A 49 19.970 13.768 9.835 1.00 0.00 H new ATOM 787 N ASP A 50 19.842 11.911 5.330 1.00 0.00 N ATOM 788 CA ASP A 50 18.840 10.820 5.139 1.00 0.00 C ATOM 789 C ASP A 50 17.477 11.398 4.740 1.00 0.00 C ATOM 790 O ASP A 50 16.811 10.886 3.862 1.00 0.00 O ATOM 791 CB ASP A 50 18.691 10.036 6.442 1.00 0.00 C ATOM 792 CG ASP A 50 19.985 9.270 6.733 1.00 0.00 C ATOM 793 OD1 ASP A 50 20.589 8.790 5.788 1.00 0.00 O ATOM 794 OD2 ASP A 50 20.351 9.179 7.893 1.00 0.00 O ATOM 0 H ASP A 50 20.235 11.976 6.269 1.00 0.00 H new ATOM 0 HA ASP A 50 19.189 10.163 4.342 1.00 0.00 H new ATOM 0 HB2 ASP A 50 18.467 10.716 7.264 1.00 0.00 H new ATOM 0 HB3 ASP A 50 17.855 9.341 6.366 1.00 0.00 H new ATOM 799 N MET A 51 17.044 12.444 5.389 1.00 0.00 N ATOM 800 CA MET A 51 15.721 13.042 5.044 1.00 0.00 C ATOM 801 C MET A 51 15.759 13.677 3.647 1.00 0.00 C ATOM 802 O MET A 51 14.776 13.669 2.933 1.00 0.00 O ATOM 803 CB MET A 51 15.347 14.102 6.079 1.00 0.00 C ATOM 804 CG MET A 51 13.883 14.503 5.891 1.00 0.00 C ATOM 805 SD MET A 51 12.812 13.162 6.462 1.00 0.00 S ATOM 806 CE MET A 51 11.506 14.195 7.169 1.00 0.00 C ATOM 0 H MET A 51 17.548 12.911 6.143 1.00 0.00 H new ATOM 0 HA MET A 51 14.973 12.249 5.046 1.00 0.00 H new ATOM 0 HB2 MET A 51 15.503 13.714 7.086 1.00 0.00 H new ATOM 0 HB3 MET A 51 15.991 14.975 5.971 1.00 0.00 H new ATOM 0 HG2 MET A 51 13.670 15.415 6.449 1.00 0.00 H new ATOM 0 HG3 MET A 51 13.686 14.718 4.841 1.00 0.00 H new ATOM 0 HE1 MET A 51 10.725 13.559 7.587 1.00 0.00 H new ATOM 0 HE2 MET A 51 11.924 14.821 7.957 1.00 0.00 H new ATOM 0 HE3 MET A 51 11.081 14.828 6.390 1.00 0.00 H new ATOM 816 N LEU A 52 16.874 14.224 3.241 1.00 0.00 N ATOM 817 CA LEU A 52 16.934 14.846 1.884 1.00 0.00 C ATOM 818 C LEU A 52 17.352 13.787 0.859 1.00 0.00 C ATOM 819 O LEU A 52 16.691 13.576 -0.138 1.00 0.00 O ATOM 820 CB LEU A 52 17.963 15.984 1.874 1.00 0.00 C ATOM 821 CG LEU A 52 17.659 16.977 3.001 1.00 0.00 C ATOM 822 CD1 LEU A 52 18.591 18.185 2.879 1.00 0.00 C ATOM 823 CD2 LEU A 52 16.206 17.450 2.893 1.00 0.00 C ATOM 0 H LEU A 52 17.737 14.268 3.782 1.00 0.00 H new ATOM 0 HA LEU A 52 15.951 15.244 1.631 1.00 0.00 H new ATOM 0 HB2 LEU A 52 18.967 15.578 1.997 1.00 0.00 H new ATOM 0 HB3 LEU A 52 17.942 16.496 0.912 1.00 0.00 H new ATOM 0 HG LEU A 52 17.812 16.488 3.963 1.00 0.00 H new ATOM 0 HD11 LEU A 52 18.376 18.893 3.680 1.00 0.00 H new ATOM 0 HD12 LEU A 52 19.627 17.854 2.955 1.00 0.00 H new ATOM 0 HD13 LEU A 52 18.434 18.669 1.915 1.00 0.00 H new ATOM 0 HD21 LEU A 52 15.993 18.156 3.696 1.00 0.00 H new ATOM 0 HD22 LEU A 52 16.053 17.938 1.930 1.00 0.00 H new ATOM 0 HD23 LEU A 52 15.537 16.593 2.976 1.00 0.00 H new ATOM 835 N ARG A 53 18.459 13.131 1.090 1.00 0.00 N ATOM 836 CA ARG A 53 18.946 12.095 0.131 1.00 0.00 C ATOM 837 C ARG A 53 17.970 10.913 0.048 1.00 0.00 C ATOM 838 O ARG A 53 18.221 9.939 -0.632 1.00 0.00 O ATOM 839 CB ARG A 53 20.310 11.591 0.603 1.00 0.00 C ATOM 840 CG ARG A 53 20.134 10.282 1.383 1.00 0.00 C ATOM 841 CD ARG A 53 21.440 9.951 2.102 1.00 0.00 C ATOM 842 NE ARG A 53 21.363 10.438 3.514 1.00 0.00 N ATOM 843 CZ ARG A 53 22.296 10.141 4.370 1.00 0.00 C ATOM 844 NH1 ARG A 53 23.309 9.414 3.997 1.00 0.00 N ATOM 845 NH2 ARG A 53 22.223 10.583 5.599 1.00 0.00 N ATOM 0 H ARG A 53 19.051 13.270 1.909 1.00 0.00 H new ATOM 0 HA ARG A 53 19.023 12.543 -0.860 1.00 0.00 H new ATOM 0 HB2 ARG A 53 20.966 11.431 -0.253 1.00 0.00 H new ATOM 0 HB3 ARG A 53 20.787 12.341 1.234 1.00 0.00 H new ATOM 0 HG2 ARG A 53 19.322 10.380 2.104 1.00 0.00 H new ATOM 0 HG3 ARG A 53 19.863 9.473 0.705 1.00 0.00 H new ATOM 0 HD2 ARG A 53 21.616 8.875 2.085 1.00 0.00 H new ATOM 0 HD3 ARG A 53 22.280 10.419 1.589 1.00 0.00 H new ATOM 0 HE ARG A 53 20.571 11.009 3.809 1.00 0.00 H new ATOM 0 HH11 ARG A 53 23.370 9.079 3.036 1.00 0.00 H new ATOM 0 HH12 ARG A 53 24.042 9.179 4.666 1.00 0.00 H new ATOM 0 HH21 ARG A 53 21.434 11.161 5.887 1.00 0.00 H new ATOM 0 HH22 ARG A 53 22.955 10.349 6.269 1.00 0.00 H new ATOM 859 N GLN A 54 16.867 10.978 0.736 1.00 0.00 N ATOM 860 CA GLN A 54 15.889 9.847 0.690 1.00 0.00 C ATOM 861 C GLN A 54 16.571 8.539 1.126 1.00 0.00 C ATOM 862 O GLN A 54 15.923 7.550 1.410 1.00 0.00 O ATOM 863 CB GLN A 54 15.331 9.698 -0.729 1.00 0.00 C ATOM 864 CG GLN A 54 13.854 10.109 -0.738 1.00 0.00 C ATOM 865 CD GLN A 54 13.032 9.085 0.046 1.00 0.00 C ATOM 866 OE1 GLN A 54 13.645 8.113 0.663 1.00 0.00 O flip ATOM 867 NE2 GLN A 54 11.822 9.171 0.100 1.00 0.00 N flip ATOM 0 H GLN A 54 16.596 11.762 1.329 1.00 0.00 H new ATOM 0 HA GLN A 54 15.069 10.061 1.375 1.00 0.00 H new ATOM 0 HB2 GLN A 54 15.898 10.320 -1.422 1.00 0.00 H new ATOM 0 HB3 GLN A 54 15.436 8.667 -1.067 1.00 0.00 H new ATOM 0 HG2 GLN A 54 13.739 11.098 -0.296 1.00 0.00 H new ATOM 0 HG3 GLN A 54 13.490 10.174 -1.763 1.00 0.00 H new ATOM 0 HE21 GLN A 54 11.343 9.931 -0.383 1.00 0.00 H new ATOM 0 HE22 GLN A 54 11.285 8.483 0.628 1.00 0.00 H new ATOM 876 N GLY A 55 17.874 8.549 1.219 1.00 0.00 N ATOM 877 CA GLY A 55 18.630 7.338 1.675 1.00 0.00 C ATOM 878 C GLY A 55 18.929 6.354 0.530 1.00 0.00 C ATOM 879 O GLY A 55 19.824 5.541 0.642 1.00 0.00 O ATOM 0 H GLY A 55 18.458 9.355 0.996 1.00 0.00 H new ATOM 0 HA2 GLY A 55 19.568 7.652 2.132 1.00 0.00 H new ATOM 0 HA3 GLY A 55 18.055 6.826 2.447 1.00 0.00 H new ATOM 883 N PHE A 56 18.198 6.384 -0.553 1.00 0.00 N ATOM 884 CA PHE A 56 18.486 5.404 -1.651 1.00 0.00 C ATOM 885 C PHE A 56 19.938 5.556 -2.122 1.00 0.00 C ATOM 886 O PHE A 56 20.860 5.546 -1.332 1.00 0.00 O ATOM 887 CB PHE A 56 17.523 5.630 -2.821 1.00 0.00 C ATOM 888 CG PHE A 56 16.132 5.864 -2.296 1.00 0.00 C ATOM 889 CD1 PHE A 56 15.660 5.107 -1.220 1.00 0.00 C ATOM 890 CD2 PHE A 56 15.316 6.836 -2.883 1.00 0.00 C ATOM 891 CE1 PHE A 56 14.368 5.321 -0.730 1.00 0.00 C ATOM 892 CE2 PHE A 56 14.024 7.052 -2.393 1.00 0.00 C ATOM 893 CZ PHE A 56 13.551 6.294 -1.317 1.00 0.00 C ATOM 0 H PHE A 56 17.428 7.030 -0.727 1.00 0.00 H new ATOM 0 HA PHE A 56 18.344 4.392 -1.271 1.00 0.00 H new ATOM 0 HB2 PHE A 56 17.848 6.487 -3.412 1.00 0.00 H new ATOM 0 HB3 PHE A 56 17.531 4.764 -3.484 1.00 0.00 H new ATOM 0 HD1 PHE A 56 16.293 4.358 -0.768 1.00 0.00 H new ATOM 0 HD2 PHE A 56 15.683 7.420 -3.714 1.00 0.00 H new ATOM 0 HE1 PHE A 56 14.001 4.736 0.100 1.00 0.00 H new ATOM 0 HE2 PHE A 56 13.393 7.803 -2.845 1.00 0.00 H new ATOM 0 HZ PHE A 56 12.553 6.460 -0.938 1.00 0.00 H new ATOM 903 N THR A 57 20.145 5.685 -3.410 1.00 0.00 N ATOM 904 CA THR A 57 21.533 5.851 -3.941 1.00 0.00 C ATOM 905 C THR A 57 21.511 6.413 -5.367 1.00 0.00 C ATOM 906 O THR A 57 22.396 7.145 -5.762 1.00 0.00 O ATOM 907 CB THR A 57 22.245 4.495 -3.956 1.00 0.00 C ATOM 908 OG1 THR A 57 23.652 4.698 -3.977 1.00 0.00 O ATOM 909 CG2 THR A 57 21.825 3.705 -5.195 1.00 0.00 C ATOM 0 H THR A 57 19.410 5.682 -4.118 1.00 0.00 H new ATOM 0 HA THR A 57 22.063 6.549 -3.293 1.00 0.00 H new ATOM 0 HB THR A 57 21.971 3.935 -3.062 1.00 0.00 H new ATOM 0 HG1 THR A 57 24.076 4.117 -3.312 1.00 0.00 H new ATOM 0 HG21 THR A 57 22.334 2.741 -5.202 1.00 0.00 H new ATOM 0 HG22 THR A 57 20.747 3.546 -5.177 1.00 0.00 H new ATOM 0 HG23 THR A 57 22.094 4.264 -6.091 1.00 0.00 H new ATOM 917 N HIS A 58 20.527 6.066 -6.152 1.00 0.00 N ATOM 918 CA HIS A 58 20.474 6.611 -7.541 1.00 0.00 C ATOM 919 C HIS A 58 19.148 6.233 -8.204 1.00 0.00 C ATOM 920 O HIS A 58 18.530 5.244 -7.867 1.00 0.00 O ATOM 921 CB HIS A 58 21.623 6.015 -8.360 1.00 0.00 C ATOM 922 CG HIS A 58 21.527 6.494 -9.786 1.00 0.00 C ATOM 923 ND1 HIS A 58 22.413 7.422 -10.316 1.00 0.00 N ATOM 924 CD2 HIS A 58 20.653 6.189 -10.803 1.00 0.00 C ATOM 925 CE1 HIS A 58 22.055 7.643 -11.595 1.00 0.00 C ATOM 926 NE2 HIS A 58 20.992 6.916 -11.939 1.00 0.00 N ATOM 0 H HIS A 58 19.766 5.437 -5.897 1.00 0.00 H new ATOM 0 HA HIS A 58 20.562 7.697 -7.500 1.00 0.00 H new ATOM 0 HB2 HIS A 58 22.581 6.309 -7.930 1.00 0.00 H new ATOM 0 HB3 HIS A 58 21.580 4.926 -8.327 1.00 0.00 H new ATOM 0 HD2 HIS A 58 19.831 5.493 -10.731 1.00 0.00 H new ATOM 0 HE1 HIS A 58 22.566 8.324 -12.259 1.00 0.00 H new ATOM 0 HE2 HIS A 58 20.525 6.897 -12.846 1.00 0.00 H new ATOM 935 N ALA A 59 18.719 7.010 -9.161 1.00 0.00 N ATOM 936 CA ALA A 59 17.433 6.712 -9.846 1.00 0.00 C ATOM 937 C ALA A 59 17.570 7.028 -11.334 1.00 0.00 C ATOM 938 O ALA A 59 18.519 7.654 -11.764 1.00 0.00 O ATOM 939 CB ALA A 59 16.308 7.558 -9.246 1.00 0.00 C ATOM 0 H ALA A 59 19.207 7.840 -9.498 1.00 0.00 H new ATOM 0 HA ALA A 59 17.192 5.657 -9.713 1.00 0.00 H new ATOM 0 HB1 ALA A 59 15.371 7.332 -9.755 1.00 0.00 H new ATOM 0 HB2 ALA A 59 16.208 7.331 -8.185 1.00 0.00 H new ATOM 0 HB3 ALA A 59 16.542 8.615 -9.370 1.00 0.00 H new ATOM 945 N PHE A 60 16.624 6.603 -12.120 1.00 0.00 N ATOM 946 CA PHE A 60 16.677 6.891 -13.575 1.00 0.00 C ATOM 947 C PHE A 60 15.301 7.360 -14.041 1.00 0.00 C ATOM 948 O PHE A 60 14.296 6.734 -13.766 1.00 0.00 O ATOM 949 CB PHE A 60 17.050 5.613 -14.334 1.00 0.00 C ATOM 950 CG PHE A 60 18.445 5.178 -13.953 1.00 0.00 C ATOM 951 CD1 PHE A 60 19.556 5.790 -14.548 1.00 0.00 C ATOM 952 CD2 PHE A 60 18.628 4.158 -13.013 1.00 0.00 C ATOM 953 CE1 PHE A 60 20.849 5.382 -14.199 1.00 0.00 C ATOM 954 CE2 PHE A 60 19.919 3.749 -12.665 1.00 0.00 C ATOM 955 CZ PHE A 60 21.030 4.361 -13.257 1.00 0.00 C ATOM 0 H PHE A 60 15.813 6.066 -11.814 1.00 0.00 H new ATOM 0 HA PHE A 60 17.421 7.664 -13.768 1.00 0.00 H new ATOM 0 HB2 PHE A 60 16.337 4.821 -14.103 1.00 0.00 H new ATOM 0 HB3 PHE A 60 16.995 5.788 -15.408 1.00 0.00 H new ATOM 0 HD1 PHE A 60 19.415 6.576 -15.275 1.00 0.00 H new ATOM 0 HD2 PHE A 60 17.771 3.686 -12.556 1.00 0.00 H new ATOM 0 HE1 PHE A 60 21.706 5.854 -14.656 1.00 0.00 H new ATOM 0 HE2 PHE A 60 20.059 2.961 -11.940 1.00 0.00 H new ATOM 0 HZ PHE A 60 22.027 4.046 -12.987 1.00 0.00 H new ATOM 965 N SER A 61 15.242 8.443 -14.758 1.00 0.00 N ATOM 966 CA SER A 61 13.922 8.952 -15.226 1.00 0.00 C ATOM 967 C SER A 61 13.798 8.647 -16.721 1.00 0.00 C ATOM 968 O SER A 61 14.355 9.332 -17.555 1.00 0.00 O ATOM 969 CB SER A 61 13.827 10.457 -14.987 1.00 0.00 C ATOM 970 OG SER A 61 14.388 10.762 -13.716 1.00 0.00 O ATOM 0 H SER A 61 16.049 8.999 -15.042 1.00 0.00 H new ATOM 0 HA SER A 61 13.115 8.468 -14.676 1.00 0.00 H new ATOM 0 HB2 SER A 61 14.357 10.997 -15.772 1.00 0.00 H new ATOM 0 HB3 SER A 61 12.786 10.779 -15.026 1.00 0.00 H new ATOM 0 HG SER A 61 14.332 11.727 -13.557 1.00 0.00 H new ATOM 976 N MET A 62 13.105 7.597 -17.064 1.00 0.00 N ATOM 977 CA MET A 62 12.941 7.258 -18.501 1.00 0.00 C ATOM 978 C MET A 62 11.587 7.718 -19.014 1.00 0.00 C ATOM 979 O MET A 62 10.551 7.350 -18.497 1.00 0.00 O ATOM 980 CB MET A 62 13.064 5.742 -18.681 1.00 0.00 C ATOM 981 CG MET A 62 14.437 5.279 -18.194 1.00 0.00 C ATOM 982 SD MET A 62 14.668 3.536 -18.615 1.00 0.00 S ATOM 983 CE MET A 62 13.290 2.882 -17.642 1.00 0.00 C ATOM 0 H MET A 62 12.647 6.961 -16.411 1.00 0.00 H new ATOM 0 HA MET A 62 13.719 7.767 -19.070 1.00 0.00 H new ATOM 0 HB2 MET A 62 12.278 5.234 -18.122 1.00 0.00 H new ATOM 0 HB3 MET A 62 12.931 5.478 -19.730 1.00 0.00 H new ATOM 0 HG2 MET A 62 15.220 5.882 -18.653 1.00 0.00 H new ATOM 0 HG3 MET A 62 14.518 5.418 -17.116 1.00 0.00 H new ATOM 0 HE1 MET A 62 13.561 1.907 -17.238 1.00 0.00 H new ATOM 0 HE2 MET A 62 13.067 3.565 -16.823 1.00 0.00 H new ATOM 0 HE3 MET A 62 12.411 2.780 -18.279 1.00 0.00 H new ATOM 993 N THR A 63 11.602 8.498 -20.054 1.00 0.00 N ATOM 994 CA THR A 63 10.336 9.019 -20.633 1.00 0.00 C ATOM 995 C THR A 63 10.295 8.601 -22.113 1.00 0.00 C ATOM 996 O THR A 63 11.316 8.544 -22.773 1.00 0.00 O ATOM 997 CB THR A 63 10.310 10.544 -20.490 1.00 0.00 C ATOM 998 OG1 THR A 63 10.403 10.877 -19.110 1.00 0.00 O ATOM 999 CG2 THR A 63 9.005 11.106 -21.059 1.00 0.00 C ATOM 0 H THR A 63 12.449 8.801 -20.535 1.00 0.00 H new ATOM 0 HA THR A 63 9.465 8.617 -20.116 1.00 0.00 H new ATOM 0 HB THR A 63 11.148 10.973 -21.039 1.00 0.00 H new ATOM 0 HG1 THR A 63 10.389 11.851 -19.007 1.00 0.00 H new ATOM 0 HG21 THR A 63 8.999 12.191 -20.952 1.00 0.00 H new ATOM 0 HG22 THR A 63 8.926 10.845 -22.114 1.00 0.00 H new ATOM 0 HG23 THR A 63 8.160 10.683 -20.517 1.00 0.00 H new ATOM 1007 N PHE A 64 9.150 8.262 -22.629 1.00 0.00 N ATOM 1008 CA PHE A 64 9.082 7.846 -24.062 1.00 0.00 C ATOM 1009 C PHE A 64 8.113 8.748 -24.825 1.00 0.00 C ATOM 1010 O PHE A 64 6.965 8.891 -24.454 1.00 0.00 O ATOM 1011 CB PHE A 64 8.572 6.397 -24.123 1.00 0.00 C ATOM 1012 CG PHE A 64 9.536 5.484 -23.403 1.00 0.00 C ATOM 1013 CD1 PHE A 64 9.383 5.247 -22.033 1.00 0.00 C ATOM 1014 CD2 PHE A 64 10.582 4.874 -24.107 1.00 0.00 C ATOM 1015 CE1 PHE A 64 10.276 4.401 -21.366 1.00 0.00 C ATOM 1016 CE2 PHE A 64 11.474 4.027 -23.440 1.00 0.00 C ATOM 1017 CZ PHE A 64 11.321 3.789 -22.070 1.00 0.00 C ATOM 0 H PHE A 64 8.262 8.253 -22.128 1.00 0.00 H new ATOM 0 HA PHE A 64 10.071 7.925 -24.514 1.00 0.00 H new ATOM 0 HB2 PHE A 64 7.584 6.330 -23.667 1.00 0.00 H new ATOM 0 HB3 PHE A 64 8.466 6.083 -25.161 1.00 0.00 H new ATOM 0 HD1 PHE A 64 8.576 5.717 -21.490 1.00 0.00 H new ATOM 0 HD2 PHE A 64 10.700 5.057 -25.165 1.00 0.00 H new ATOM 0 HE1 PHE A 64 10.159 4.220 -20.308 1.00 0.00 H new ATOM 0 HE2 PHE A 64 12.281 3.557 -23.983 1.00 0.00 H new ATOM 0 HZ PHE A 64 12.008 3.134 -21.555 1.00 0.00 H new ATOM 1027 N GLU A 65 8.549 9.333 -25.915 1.00 0.00 N ATOM 1028 CA GLU A 65 7.628 10.209 -26.693 1.00 0.00 C ATOM 1029 C GLU A 65 6.307 9.463 -26.853 1.00 0.00 C ATOM 1030 O GLU A 65 5.244 10.049 -26.908 1.00 0.00 O ATOM 1031 CB GLU A 65 8.207 10.496 -28.080 1.00 0.00 C ATOM 1032 CG GLU A 65 7.340 11.550 -28.775 1.00 0.00 C ATOM 1033 CD GLU A 65 7.783 11.705 -30.231 1.00 0.00 C ATOM 1034 OE1 GLU A 65 7.785 10.711 -30.938 1.00 0.00 O ATOM 1035 OE2 GLU A 65 8.110 12.817 -30.615 1.00 0.00 O ATOM 0 H GLU A 65 9.492 9.241 -26.293 1.00 0.00 H new ATOM 0 HA GLU A 65 7.489 11.156 -26.172 1.00 0.00 H new ATOM 0 HB2 GLU A 65 9.234 10.851 -27.993 1.00 0.00 H new ATOM 0 HB3 GLU A 65 8.235 9.582 -28.673 1.00 0.00 H new ATOM 0 HG2 GLU A 65 6.291 11.257 -28.733 1.00 0.00 H new ATOM 0 HG3 GLU A 65 7.425 12.504 -28.256 1.00 0.00 H new ATOM 1042 N ASN A 66 6.384 8.164 -26.904 1.00 0.00 N ATOM 1043 CA ASN A 66 5.162 7.333 -27.053 1.00 0.00 C ATOM 1044 C ASN A 66 5.522 5.881 -26.727 1.00 0.00 C ATOM 1045 O ASN A 66 6.677 5.544 -26.553 1.00 0.00 O ATOM 1046 CB ASN A 66 4.650 7.436 -28.488 1.00 0.00 C ATOM 1047 CG ASN A 66 5.832 7.583 -29.444 1.00 0.00 C ATOM 1048 OD1 ASN A 66 6.956 7.295 -29.087 1.00 0.00 O ATOM 1049 ND2 ASN A 66 5.625 8.021 -30.656 1.00 0.00 N ATOM 0 H ASN A 66 7.255 7.637 -26.848 1.00 0.00 H new ATOM 0 HA ASN A 66 4.381 7.680 -26.376 1.00 0.00 H new ATOM 0 HB2 ASN A 66 4.071 6.548 -28.743 1.00 0.00 H new ATOM 0 HB3 ASN A 66 3.981 8.291 -28.586 1.00 0.00 H new ATOM 0 HD21 ASN A 66 6.407 8.121 -31.303 1.00 0.00 H new ATOM 0 HD22 ASN A 66 4.681 8.263 -30.956 1.00 0.00 H new ATOM 1056 N LYS A 67 4.545 5.026 -26.618 1.00 0.00 N ATOM 1057 CA LYS A 67 4.828 3.597 -26.299 1.00 0.00 C ATOM 1058 C LYS A 67 5.764 2.965 -27.337 1.00 0.00 C ATOM 1059 O LYS A 67 6.410 1.971 -27.069 1.00 0.00 O ATOM 1060 CB LYS A 67 3.508 2.821 -26.273 1.00 0.00 C ATOM 1061 CG LYS A 67 2.618 3.367 -25.153 1.00 0.00 C ATOM 1062 CD LYS A 67 1.440 2.416 -24.924 1.00 0.00 C ATOM 1063 CE LYS A 67 0.554 2.390 -26.171 1.00 0.00 C ATOM 1064 NZ LYS A 67 -0.786 1.836 -25.822 1.00 0.00 N ATOM 0 H LYS A 67 3.558 5.255 -26.736 1.00 0.00 H new ATOM 0 HA LYS A 67 5.319 3.553 -25.327 1.00 0.00 H new ATOM 0 HB2 LYS A 67 3.000 2.913 -27.233 1.00 0.00 H new ATOM 0 HB3 LYS A 67 3.700 1.760 -26.115 1.00 0.00 H new ATOM 0 HG2 LYS A 67 3.196 3.474 -24.235 1.00 0.00 H new ATOM 0 HG3 LYS A 67 2.252 4.359 -25.417 1.00 0.00 H new ATOM 0 HD2 LYS A 67 1.806 1.413 -24.704 1.00 0.00 H new ATOM 0 HD3 LYS A 67 0.860 2.740 -24.060 1.00 0.00 H new ATOM 0 HE2 LYS A 67 0.448 3.397 -26.575 1.00 0.00 H new ATOM 0 HE3 LYS A 67 1.019 1.782 -26.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -1.387 1.819 -26.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -0.677 0.869 -25.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -1.230 2.433 -25.096 1.00 0.00 H new ATOM 1078 N ASP A 68 5.835 3.510 -28.522 1.00 0.00 N ATOM 1079 CA ASP A 68 6.722 2.903 -29.563 1.00 0.00 C ATOM 1080 C ASP A 68 8.163 2.803 -29.054 1.00 0.00 C ATOM 1081 O ASP A 68 8.841 1.825 -29.291 1.00 0.00 O ATOM 1082 CB ASP A 68 6.686 3.755 -30.836 1.00 0.00 C ATOM 1083 CG ASP A 68 7.433 3.023 -31.954 1.00 0.00 C ATOM 1084 OD1 ASP A 68 7.828 1.889 -31.731 1.00 0.00 O ATOM 1085 OD2 ASP A 68 7.598 3.606 -33.012 1.00 0.00 O ATOM 0 H ASP A 68 5.323 4.342 -28.815 1.00 0.00 H new ATOM 0 HA ASP A 68 6.359 1.899 -29.784 1.00 0.00 H new ATOM 0 HB2 ASP A 68 5.654 3.942 -31.134 1.00 0.00 H new ATOM 0 HB3 ASP A 68 7.145 4.726 -30.651 1.00 0.00 H new ATOM 1090 N GLY A 69 8.642 3.796 -28.359 1.00 0.00 N ATOM 1091 CA GLY A 69 10.032 3.715 -27.829 1.00 0.00 C ATOM 1092 C GLY A 69 10.070 2.699 -26.690 1.00 0.00 C ATOM 1093 O GLY A 69 11.031 1.977 -26.514 1.00 0.00 O ATOM 0 H GLY A 69 8.137 4.654 -28.136 1.00 0.00 H new ATOM 0 HA2 GLY A 69 10.720 3.419 -28.621 1.00 0.00 H new ATOM 0 HA3 GLY A 69 10.357 4.693 -27.473 1.00 0.00 H new ATOM 1097 N TYR A 70 9.023 2.643 -25.913 1.00 0.00 N ATOM 1098 CA TYR A 70 8.974 1.675 -24.780 1.00 0.00 C ATOM 1099 C TYR A 70 9.022 0.232 -25.304 1.00 0.00 C ATOM 1100 O TYR A 70 9.747 -0.589 -24.781 1.00 0.00 O ATOM 1101 CB TYR A 70 7.693 1.902 -23.980 1.00 0.00 C ATOM 1102 CG TYR A 70 7.651 0.964 -22.797 1.00 0.00 C ATOM 1103 CD1 TYR A 70 8.255 1.336 -21.590 1.00 0.00 C ATOM 1104 CD2 TYR A 70 7.012 -0.279 -22.904 1.00 0.00 C ATOM 1105 CE1 TYR A 70 8.227 0.468 -20.495 1.00 0.00 C ATOM 1106 CE2 TYR A 70 6.982 -1.148 -21.806 1.00 0.00 C ATOM 1107 CZ TYR A 70 7.589 -0.774 -20.601 1.00 0.00 C ATOM 1108 OH TYR A 70 7.562 -1.630 -19.519 1.00 0.00 O ATOM 0 H TYR A 70 8.195 3.229 -26.015 1.00 0.00 H new ATOM 0 HA TYR A 70 9.839 1.833 -24.136 1.00 0.00 H new ATOM 0 HB2 TYR A 70 7.647 2.936 -23.637 1.00 0.00 H new ATOM 0 HB3 TYR A 70 6.823 1.738 -24.616 1.00 0.00 H new ATOM 0 HD1 TYR A 70 8.743 2.295 -21.505 1.00 0.00 H new ATOM 0 HD2 TYR A 70 6.543 -0.567 -23.833 1.00 0.00 H new ATOM 0 HE1 TYR A 70 8.698 0.755 -19.566 1.00 0.00 H new ATOM 0 HE2 TYR A 70 6.491 -2.106 -21.889 1.00 0.00 H new ATOM 0 HH TYR A 70 7.079 -2.448 -19.761 1.00 0.00 H new ATOM 1118 N VAL A 71 8.278 -0.099 -26.330 1.00 0.00 N ATOM 1119 CA VAL A 71 8.352 -1.501 -26.845 1.00 0.00 C ATOM 1120 C VAL A 71 9.706 -1.702 -27.526 1.00 0.00 C ATOM 1121 O VAL A 71 10.247 -2.789 -27.549 1.00 0.00 O ATOM 1122 CB VAL A 71 7.218 -1.786 -27.839 1.00 0.00 C ATOM 1123 CG1 VAL A 71 5.856 -1.520 -27.193 1.00 0.00 C ATOM 1124 CG2 VAL A 71 7.380 -0.873 -29.058 1.00 0.00 C ATOM 0 H VAL A 71 7.638 0.523 -26.823 1.00 0.00 H new ATOM 0 HA VAL A 71 8.244 -2.193 -26.010 1.00 0.00 H new ATOM 0 HB VAL A 71 7.267 -2.833 -28.139 1.00 0.00 H new ATOM 0 HG11 VAL A 71 5.065 -1.728 -27.913 1.00 0.00 H new ATOM 0 HG12 VAL A 71 5.734 -2.166 -26.323 1.00 0.00 H new ATOM 0 HG13 VAL A 71 5.798 -0.477 -26.882 1.00 0.00 H new ATOM 0 HG21 VAL A 71 6.578 -1.070 -29.769 1.00 0.00 H new ATOM 0 HG22 VAL A 71 7.336 0.169 -28.741 1.00 0.00 H new ATOM 0 HG23 VAL A 71 8.342 -1.068 -29.533 1.00 0.00 H new ATOM 1134 N ALA A 72 10.266 -0.655 -28.064 1.00 0.00 N ATOM 1135 CA ALA A 72 11.582 -0.781 -28.748 1.00 0.00 C ATOM 1136 C ALA A 72 12.652 -1.167 -27.722 1.00 0.00 C ATOM 1137 O ALA A 72 13.290 -2.195 -27.833 1.00 0.00 O ATOM 1138 CB ALA A 72 11.955 0.564 -29.375 1.00 0.00 C ATOM 0 H ALA A 72 9.868 0.284 -28.059 1.00 0.00 H new ATOM 0 HA ALA A 72 11.519 -1.546 -29.522 1.00 0.00 H new ATOM 0 HB1 ALA A 72 12.918 0.477 -29.877 1.00 0.00 H new ATOM 0 HB2 ALA A 72 11.193 0.852 -30.099 1.00 0.00 H new ATOM 0 HB3 ALA A 72 12.020 1.323 -28.596 1.00 0.00 H new ATOM 1144 N PHE A 73 12.869 -0.337 -26.737 1.00 0.00 N ATOM 1145 CA PHE A 73 13.938 -0.619 -25.735 1.00 0.00 C ATOM 1146 C PHE A 73 13.721 -1.990 -25.063 1.00 0.00 C ATOM 1147 O PHE A 73 14.657 -2.735 -24.855 1.00 0.00 O ATOM 1148 CB PHE A 73 13.923 0.479 -24.668 1.00 0.00 C ATOM 1149 CG PHE A 73 13.587 -0.125 -23.322 1.00 0.00 C ATOM 1150 CD1 PHE A 73 14.599 -0.681 -22.531 1.00 0.00 C ATOM 1151 CD2 PHE A 73 12.263 -0.128 -22.866 1.00 0.00 C ATOM 1152 CE1 PHE A 73 14.288 -1.241 -21.284 1.00 0.00 C ATOM 1153 CE2 PHE A 73 11.953 -0.688 -21.619 1.00 0.00 C ATOM 1154 CZ PHE A 73 12.965 -1.245 -20.830 1.00 0.00 C ATOM 0 H PHE A 73 12.350 0.527 -26.583 1.00 0.00 H new ATOM 0 HA PHE A 73 14.900 -0.638 -26.247 1.00 0.00 H new ATOM 0 HB2 PHE A 73 14.895 0.971 -24.625 1.00 0.00 H new ATOM 0 HB3 PHE A 73 13.190 1.243 -24.928 1.00 0.00 H new ATOM 0 HD1 PHE A 73 15.620 -0.679 -22.882 1.00 0.00 H new ATOM 0 HD2 PHE A 73 11.481 0.301 -23.475 1.00 0.00 H new ATOM 0 HE1 PHE A 73 15.070 -1.669 -20.674 1.00 0.00 H new ATOM 0 HE2 PHE A 73 10.932 -0.689 -21.267 1.00 0.00 H new ATOM 0 HZ PHE A 73 12.725 -1.678 -19.870 1.00 0.00 H new ATOM 1164 N THR A 74 12.509 -2.323 -24.706 1.00 0.00 N ATOM 1165 CA THR A 74 12.275 -3.620 -24.000 1.00 0.00 C ATOM 1166 C THR A 74 12.346 -4.786 -24.992 1.00 0.00 C ATOM 1167 O THR A 74 12.753 -5.878 -24.648 1.00 0.00 O ATOM 1168 CB THR A 74 10.889 -3.611 -23.344 1.00 0.00 C ATOM 1169 OG1 THR A 74 10.684 -4.835 -22.655 1.00 0.00 O ATOM 1170 CG2 THR A 74 9.810 -3.434 -24.412 1.00 0.00 C ATOM 0 H THR A 74 11.675 -1.759 -24.870 1.00 0.00 H new ATOM 0 HA THR A 74 13.046 -3.744 -23.239 1.00 0.00 H new ATOM 0 HB THR A 74 10.830 -2.783 -22.638 1.00 0.00 H new ATOM 0 HG1 THR A 74 9.799 -4.829 -22.234 1.00 0.00 H new ATOM 0 HG21 THR A 74 8.828 -3.428 -23.939 1.00 0.00 H new ATOM 0 HG22 THR A 74 9.967 -2.490 -24.935 1.00 0.00 H new ATOM 0 HG23 THR A 74 9.865 -4.257 -25.125 1.00 0.00 H new ATOM 1178 N SER A 75 11.931 -4.573 -26.212 1.00 0.00 N ATOM 1179 CA SER A 75 11.952 -5.681 -27.212 1.00 0.00 C ATOM 1180 C SER A 75 13.388 -6.151 -27.482 1.00 0.00 C ATOM 1181 O SER A 75 13.624 -7.312 -27.747 1.00 0.00 O ATOM 1182 CB SER A 75 11.326 -5.187 -28.516 1.00 0.00 C ATOM 1183 OG SER A 75 9.938 -4.956 -28.312 1.00 0.00 O ATOM 0 H SER A 75 11.579 -3.681 -26.560 1.00 0.00 H new ATOM 0 HA SER A 75 11.385 -6.522 -26.814 1.00 0.00 H new ATOM 0 HB2 SER A 75 11.815 -4.269 -28.843 1.00 0.00 H new ATOM 0 HB3 SER A 75 11.472 -5.925 -29.305 1.00 0.00 H new ATOM 0 HG SER A 75 9.819 -4.218 -27.678 1.00 0.00 H new ATOM 1189 N HIS A 76 14.350 -5.268 -27.422 1.00 0.00 N ATOM 1190 CA HIS A 76 15.761 -5.695 -27.672 1.00 0.00 C ATOM 1191 C HIS A 76 16.267 -6.525 -26.482 1.00 0.00 C ATOM 1192 O HIS A 76 15.828 -6.344 -25.366 1.00 0.00 O ATOM 1193 CB HIS A 76 16.646 -4.455 -27.832 1.00 0.00 C ATOM 1194 CG HIS A 76 16.468 -3.876 -29.209 1.00 0.00 C ATOM 1195 ND1 HIS A 76 15.468 -2.959 -29.502 1.00 0.00 N ATOM 1196 CD2 HIS A 76 17.153 -4.070 -30.383 1.00 0.00 C ATOM 1197 CE1 HIS A 76 15.577 -2.639 -30.804 1.00 0.00 C ATOM 1198 NE2 HIS A 76 16.588 -3.288 -31.384 1.00 0.00 N ATOM 0 H HIS A 76 14.223 -4.278 -27.213 1.00 0.00 H new ATOM 0 HA HIS A 76 15.801 -6.297 -28.580 1.00 0.00 H new ATOM 0 HB2 HIS A 76 16.386 -3.712 -27.079 1.00 0.00 H new ATOM 0 HB3 HIS A 76 17.691 -4.720 -27.671 1.00 0.00 H new ATOM 0 HD1 HIS A 76 14.776 -2.594 -28.848 1.00 0.00 H new ATOM 0 HD2 HIS A 76 18.000 -4.728 -30.509 1.00 0.00 H new ATOM 0 HE1 HIS A 76 14.928 -1.944 -31.316 1.00 0.00 H new ATOM 1207 N PRO A 77 17.191 -7.422 -26.715 1.00 0.00 N ATOM 1208 CA PRO A 77 17.772 -8.282 -25.637 1.00 0.00 C ATOM 1209 C PRO A 77 18.663 -7.485 -24.666 1.00 0.00 C ATOM 1210 O PRO A 77 19.278 -8.041 -23.780 1.00 0.00 O ATOM 1211 CB PRO A 77 18.603 -9.296 -26.429 1.00 0.00 C ATOM 1212 CG PRO A 77 18.977 -8.577 -27.683 1.00 0.00 C ATOM 1213 CD PRO A 77 17.773 -7.696 -28.048 1.00 0.00 C ATOM 0 HA PRO A 77 17.007 -8.731 -25.003 1.00 0.00 H new ATOM 0 HB2 PRO A 77 19.487 -9.607 -25.871 1.00 0.00 H new ATOM 0 HB3 PRO A 77 18.029 -10.197 -26.645 1.00 0.00 H new ATOM 0 HG2 PRO A 77 19.871 -7.972 -27.533 1.00 0.00 H new ATOM 0 HG3 PRO A 77 19.200 -9.282 -28.484 1.00 0.00 H new ATOM 0 HD2 PRO A 77 18.074 -6.782 -28.560 1.00 0.00 H new ATOM 0 HD3 PRO A 77 17.071 -8.212 -28.704 1.00 0.00 H new ATOM 1221 N LEU A 78 18.737 -6.189 -24.838 1.00 0.00 N ATOM 1222 CA LEU A 78 19.583 -5.341 -23.939 1.00 0.00 C ATOM 1223 C LEU A 78 18.904 -5.121 -22.580 1.00 0.00 C ATOM 1224 O LEU A 78 19.560 -4.910 -21.578 1.00 0.00 O ATOM 1225 CB LEU A 78 19.790 -3.981 -24.607 1.00 0.00 C ATOM 1226 CG LEU A 78 20.808 -3.151 -23.820 1.00 0.00 C ATOM 1227 CD1 LEU A 78 22.191 -3.782 -23.973 1.00 0.00 C ATOM 1228 CD2 LEU A 78 20.840 -1.722 -24.371 1.00 0.00 C ATOM 0 H LEU A 78 18.244 -5.677 -25.569 1.00 0.00 H new ATOM 0 HA LEU A 78 20.533 -5.849 -23.774 1.00 0.00 H new ATOM 0 HB2 LEU A 78 20.138 -4.120 -25.631 1.00 0.00 H new ATOM 0 HB3 LEU A 78 18.841 -3.448 -24.663 1.00 0.00 H new ATOM 0 HG LEU A 78 20.526 -3.127 -22.767 1.00 0.00 H new ATOM 0 HD11 LEU A 78 22.922 -3.196 -23.415 1.00 0.00 H new ATOM 0 HD12 LEU A 78 22.171 -4.801 -23.586 1.00 0.00 H new ATOM 0 HD13 LEU A 78 22.468 -3.799 -25.027 1.00 0.00 H new ATOM 0 HD21 LEU A 78 21.565 -1.132 -23.810 1.00 0.00 H new ATOM 0 HD22 LEU A 78 21.126 -1.744 -25.423 1.00 0.00 H new ATOM 0 HD23 LEU A 78 19.852 -1.272 -24.273 1.00 0.00 H new ATOM 1240 N HIS A 79 17.600 -5.138 -22.538 1.00 0.00 N ATOM 1241 CA HIS A 79 16.893 -4.879 -21.247 1.00 0.00 C ATOM 1242 C HIS A 79 16.855 -6.150 -20.401 1.00 0.00 C ATOM 1243 O HIS A 79 17.049 -6.120 -19.201 1.00 0.00 O ATOM 1244 CB HIS A 79 15.461 -4.428 -21.534 1.00 0.00 C ATOM 1245 CG HIS A 79 14.725 -4.241 -20.235 1.00 0.00 C ATOM 1246 ND1 HIS A 79 13.411 -4.657 -20.062 1.00 0.00 N ATOM 1247 CD2 HIS A 79 15.106 -3.689 -19.037 1.00 0.00 C ATOM 1248 CE1 HIS A 79 13.053 -4.351 -18.801 1.00 0.00 C ATOM 1249 NE2 HIS A 79 14.048 -3.762 -18.138 1.00 0.00 N ATOM 0 H HIS A 79 16.993 -5.319 -23.338 1.00 0.00 H new ATOM 0 HA HIS A 79 17.428 -4.101 -20.702 1.00 0.00 H new ATOM 0 HB2 HIS A 79 15.468 -3.495 -22.098 1.00 0.00 H new ATOM 0 HB3 HIS A 79 14.951 -5.169 -22.150 1.00 0.00 H new ATOM 0 HD2 HIS A 79 16.076 -3.264 -18.826 1.00 0.00 H new ATOM 0 HE1 HIS A 79 12.080 -4.557 -18.379 1.00 0.00 H new ATOM 0 HE2 HIS A 79 14.036 -3.433 -17.172 1.00 0.00 H new ATOM 1258 N VAL A 80 16.597 -7.269 -21.014 1.00 0.00 N ATOM 1259 CA VAL A 80 16.511 -8.539 -20.246 1.00 0.00 C ATOM 1260 C VAL A 80 17.862 -8.855 -19.604 1.00 0.00 C ATOM 1261 O VAL A 80 17.975 -8.983 -18.401 1.00 0.00 O ATOM 1262 CB VAL A 80 16.121 -9.665 -21.198 1.00 0.00 C ATOM 1263 CG1 VAL A 80 17.128 -9.735 -22.346 1.00 0.00 C ATOM 1264 CG2 VAL A 80 16.118 -10.990 -20.432 1.00 0.00 C ATOM 0 H VAL A 80 16.441 -7.359 -22.018 1.00 0.00 H new ATOM 0 HA VAL A 80 15.763 -8.440 -19.460 1.00 0.00 H new ATOM 0 HB VAL A 80 15.128 -9.476 -21.605 1.00 0.00 H new ATOM 0 HG11 VAL A 80 16.849 -10.540 -23.026 1.00 0.00 H new ATOM 0 HG12 VAL A 80 17.131 -8.788 -22.886 1.00 0.00 H new ATOM 0 HG13 VAL A 80 18.123 -9.927 -21.946 1.00 0.00 H new ATOM 0 HG21 VAL A 80 15.840 -11.800 -21.107 1.00 0.00 H new ATOM 0 HG22 VAL A 80 17.113 -11.179 -20.029 1.00 0.00 H new ATOM 0 HG23 VAL A 80 15.399 -10.936 -19.614 1.00 0.00 H new ATOM 1274 N GLU A 81 18.889 -8.988 -20.397 1.00 0.00 N ATOM 1275 CA GLU A 81 20.232 -9.289 -19.832 1.00 0.00 C ATOM 1276 C GLU A 81 20.633 -8.190 -18.847 1.00 0.00 C ATOM 1277 O GLU A 81 21.207 -8.451 -17.809 1.00 0.00 O ATOM 1278 CB GLU A 81 21.256 -9.355 -20.964 1.00 0.00 C ATOM 1279 CG GLU A 81 22.590 -9.864 -20.416 1.00 0.00 C ATOM 1280 CD GLU A 81 22.449 -11.332 -20.011 1.00 0.00 C ATOM 1281 OE1 GLU A 81 21.577 -11.993 -20.549 1.00 0.00 O ATOM 1282 OE2 GLU A 81 23.216 -11.767 -19.168 1.00 0.00 O ATOM 0 H GLU A 81 18.855 -8.901 -21.413 1.00 0.00 H new ATOM 0 HA GLU A 81 20.200 -10.246 -19.312 1.00 0.00 H new ATOM 0 HB2 GLU A 81 20.899 -10.016 -21.754 1.00 0.00 H new ATOM 0 HB3 GLU A 81 21.386 -8.369 -21.409 1.00 0.00 H new ATOM 0 HG2 GLU A 81 23.370 -9.757 -21.170 1.00 0.00 H new ATOM 0 HG3 GLU A 81 22.894 -9.266 -19.557 1.00 0.00 H new ATOM 1289 N PHE A 82 20.335 -6.961 -19.165 1.00 0.00 N ATOM 1290 CA PHE A 82 20.699 -5.846 -18.247 1.00 0.00 C ATOM 1291 C PHE A 82 19.838 -5.912 -16.983 1.00 0.00 C ATOM 1292 O PHE A 82 20.323 -5.741 -15.881 1.00 0.00 O ATOM 1293 CB PHE A 82 20.464 -4.508 -18.951 1.00 0.00 C ATOM 1294 CG PHE A 82 20.856 -3.379 -18.029 1.00 0.00 C ATOM 1295 CD1 PHE A 82 22.200 -3.011 -17.904 1.00 0.00 C ATOM 1296 CD2 PHE A 82 19.873 -2.700 -17.298 1.00 0.00 C ATOM 1297 CE1 PHE A 82 22.562 -1.963 -17.048 1.00 0.00 C ATOM 1298 CE2 PHE A 82 20.235 -1.651 -16.442 1.00 0.00 C ATOM 1299 CZ PHE A 82 21.580 -1.284 -16.318 1.00 0.00 C ATOM 0 H PHE A 82 19.855 -6.681 -20.020 1.00 0.00 H new ATOM 0 HA PHE A 82 21.750 -5.937 -17.973 1.00 0.00 H new ATOM 0 HB2 PHE A 82 21.048 -4.461 -19.870 1.00 0.00 H new ATOM 0 HB3 PHE A 82 19.416 -4.413 -19.234 1.00 0.00 H new ATOM 0 HD1 PHE A 82 22.958 -3.535 -18.467 1.00 0.00 H new ATOM 0 HD2 PHE A 82 18.836 -2.985 -17.394 1.00 0.00 H new ATOM 0 HE1 PHE A 82 23.599 -1.679 -16.951 1.00 0.00 H new ATOM 0 HE2 PHE A 82 19.477 -1.127 -15.879 1.00 0.00 H new ATOM 0 HZ PHE A 82 21.860 -0.476 -15.658 1.00 0.00 H new ATOM 1309 N SER A 83 18.562 -6.155 -17.129 1.00 0.00 N ATOM 1310 CA SER A 83 17.671 -6.210 -15.934 1.00 0.00 C ATOM 1311 C SER A 83 18.150 -7.298 -14.970 1.00 0.00 C ATOM 1312 O SER A 83 18.082 -7.141 -13.767 1.00 0.00 O ATOM 1313 CB SER A 83 16.240 -6.513 -16.374 1.00 0.00 C ATOM 1314 OG SER A 83 15.806 -5.512 -17.282 1.00 0.00 O ATOM 0 H SER A 83 18.099 -6.318 -18.023 1.00 0.00 H new ATOM 0 HA SER A 83 17.700 -5.246 -15.426 1.00 0.00 H new ATOM 0 HB2 SER A 83 16.193 -7.494 -16.847 1.00 0.00 H new ATOM 0 HB3 SER A 83 15.580 -6.545 -15.507 1.00 0.00 H new ATOM 0 HG SER A 83 14.910 -5.207 -17.029 1.00 0.00 H new ATOM 1320 N ALA A 84 18.637 -8.399 -15.478 1.00 0.00 N ATOM 1321 CA ALA A 84 19.107 -9.482 -14.569 1.00 0.00 C ATOM 1322 C ALA A 84 20.211 -8.925 -13.676 1.00 0.00 C ATOM 1323 O ALA A 84 20.150 -9.007 -12.464 1.00 0.00 O ATOM 1324 CB ALA A 84 19.661 -10.648 -15.386 1.00 0.00 C ATOM 0 H ALA A 84 18.729 -8.594 -16.475 1.00 0.00 H new ATOM 0 HA ALA A 84 18.273 -9.838 -13.964 1.00 0.00 H new ATOM 0 HB1 ALA A 84 20.002 -11.434 -14.713 1.00 0.00 H new ATOM 0 HB2 ALA A 84 18.879 -11.041 -16.036 1.00 0.00 H new ATOM 0 HB3 ALA A 84 20.498 -10.302 -15.993 1.00 0.00 H new ATOM 1330 N ALA A 85 21.214 -8.342 -14.270 1.00 0.00 N ATOM 1331 CA ALA A 85 22.319 -7.767 -13.464 1.00 0.00 C ATOM 1332 C ALA A 85 21.800 -6.536 -12.726 1.00 0.00 C ATOM 1333 O ALA A 85 22.088 -6.332 -11.563 1.00 0.00 O ATOM 1334 CB ALA A 85 23.468 -7.362 -14.385 1.00 0.00 C ATOM 0 H ALA A 85 21.314 -8.240 -15.280 1.00 0.00 H new ATOM 0 HA ALA A 85 22.678 -8.506 -12.748 1.00 0.00 H new ATOM 0 HB1 ALA A 85 24.279 -6.940 -13.791 1.00 0.00 H new ATOM 0 HB2 ALA A 85 23.830 -8.239 -14.922 1.00 0.00 H new ATOM 0 HB3 ALA A 85 23.116 -6.618 -15.100 1.00 0.00 H new ATOM 1340 N PHE A 86 21.016 -5.722 -13.383 1.00 0.00 N ATOM 1341 CA PHE A 86 20.473 -4.521 -12.695 1.00 0.00 C ATOM 1342 C PHE A 86 20.023 -4.935 -11.299 1.00 0.00 C ATOM 1343 O PHE A 86 20.089 -4.164 -10.361 1.00 0.00 O ATOM 1344 CB PHE A 86 19.280 -3.961 -13.472 1.00 0.00 C ATOM 1345 CG PHE A 86 19.070 -2.512 -13.099 1.00 0.00 C ATOM 1346 CD1 PHE A 86 20.063 -1.565 -13.375 1.00 0.00 C ATOM 1347 CD2 PHE A 86 17.877 -2.115 -12.478 1.00 0.00 C ATOM 1348 CE1 PHE A 86 19.867 -0.223 -13.031 1.00 0.00 C ATOM 1349 CE2 PHE A 86 17.681 -0.772 -12.137 1.00 0.00 C ATOM 1350 CZ PHE A 86 18.675 0.174 -12.413 1.00 0.00 C ATOM 0 H PHE A 86 20.732 -5.837 -14.356 1.00 0.00 H new ATOM 0 HA PHE A 86 21.241 -3.749 -12.636 1.00 0.00 H new ATOM 0 HB2 PHE A 86 19.457 -4.050 -14.544 1.00 0.00 H new ATOM 0 HB3 PHE A 86 18.383 -4.539 -13.248 1.00 0.00 H new ATOM 0 HD1 PHE A 86 20.981 -1.870 -13.854 1.00 0.00 H new ATOM 0 HD2 PHE A 86 17.110 -2.845 -12.263 1.00 0.00 H new ATOM 0 HE1 PHE A 86 20.635 0.506 -13.242 1.00 0.00 H new ATOM 0 HE2 PHE A 86 16.762 -0.465 -11.660 1.00 0.00 H new ATOM 0 HZ PHE A 86 18.523 1.210 -12.149 1.00 0.00 H new ATOM 1360 N THR A 87 19.590 -6.157 -11.142 1.00 0.00 N ATOM 1361 CA THR A 87 19.165 -6.612 -9.795 1.00 0.00 C ATOM 1362 C THR A 87 20.412 -7.041 -9.033 1.00 0.00 C ATOM 1363 O THR A 87 20.753 -6.487 -8.009 1.00 0.00 O ATOM 1364 CB THR A 87 18.220 -7.807 -9.922 1.00 0.00 C ATOM 1365 OG1 THR A 87 17.244 -7.532 -10.916 1.00 0.00 O ATOM 1366 CG2 THR A 87 17.522 -8.064 -8.586 1.00 0.00 C ATOM 0 H THR A 87 19.514 -6.852 -11.884 1.00 0.00 H new ATOM 0 HA THR A 87 18.647 -5.807 -9.273 1.00 0.00 H new ATOM 0 HB THR A 87 18.795 -8.690 -10.203 1.00 0.00 H new ATOM 0 HG1 THR A 87 17.656 -7.589 -11.803 1.00 0.00 H new ATOM 0 HG21 THR A 87 16.850 -8.917 -8.685 1.00 0.00 H new ATOM 0 HG22 THR A 87 18.268 -8.276 -7.820 1.00 0.00 H new ATOM 0 HG23 THR A 87 16.949 -7.182 -8.299 1.00 0.00 H new ATOM 1374 N ALA A 88 21.101 -8.023 -9.542 1.00 0.00 N ATOM 1375 CA ALA A 88 22.342 -8.499 -8.875 1.00 0.00 C ATOM 1376 C ALA A 88 23.134 -7.309 -8.330 1.00 0.00 C ATOM 1377 O ALA A 88 23.919 -7.444 -7.415 1.00 0.00 O ATOM 1378 CB ALA A 88 23.213 -9.229 -9.897 1.00 0.00 C ATOM 0 H ALA A 88 20.855 -8.520 -10.398 1.00 0.00 H new ATOM 0 HA ALA A 88 22.070 -9.166 -8.057 1.00 0.00 H new ATOM 0 HB1 ALA A 88 24.125 -9.580 -9.413 1.00 0.00 H new ATOM 0 HB2 ALA A 88 22.665 -10.081 -10.300 1.00 0.00 H new ATOM 0 HB3 ALA A 88 23.472 -8.548 -10.707 1.00 0.00 H new ATOM 1384 N VAL A 89 22.949 -6.149 -8.896 1.00 0.00 N ATOM 1385 CA VAL A 89 23.710 -4.960 -8.425 1.00 0.00 C ATOM 1386 C VAL A 89 22.809 -4.025 -7.602 1.00 0.00 C ATOM 1387 O VAL A 89 23.182 -2.903 -7.311 1.00 0.00 O ATOM 1388 CB VAL A 89 24.261 -4.213 -9.641 1.00 0.00 C ATOM 1389 CG1 VAL A 89 25.003 -5.200 -10.542 1.00 0.00 C ATOM 1390 CG2 VAL A 89 23.105 -3.585 -10.428 1.00 0.00 C ATOM 0 H VAL A 89 22.303 -5.974 -9.665 1.00 0.00 H new ATOM 0 HA VAL A 89 24.529 -5.290 -7.785 1.00 0.00 H new ATOM 0 HB VAL A 89 24.941 -3.429 -9.308 1.00 0.00 H new ATOM 0 HG11 VAL A 89 25.398 -4.673 -11.411 1.00 0.00 H new ATOM 0 HG12 VAL A 89 25.825 -5.652 -9.987 1.00 0.00 H new ATOM 0 HG13 VAL A 89 24.316 -5.979 -10.872 1.00 0.00 H new ATOM 0 HG21 VAL A 89 23.500 -3.054 -11.294 1.00 0.00 H new ATOM 0 HG22 VAL A 89 22.425 -4.368 -10.763 1.00 0.00 H new ATOM 0 HG23 VAL A 89 22.567 -2.886 -9.788 1.00 0.00 H new ATOM 1400 N ILE A 90 21.636 -4.458 -7.219 1.00 0.00 N ATOM 1401 CA ILE A 90 20.755 -3.563 -6.413 1.00 0.00 C ATOM 1402 C ILE A 90 20.350 -4.246 -5.108 1.00 0.00 C ATOM 1403 O ILE A 90 20.370 -5.456 -4.986 1.00 0.00 O ATOM 1404 CB ILE A 90 19.498 -3.215 -7.216 1.00 0.00 C ATOM 1405 CG1 ILE A 90 19.855 -2.190 -8.296 1.00 0.00 C ATOM 1406 CG2 ILE A 90 18.450 -2.617 -6.270 1.00 0.00 C ATOM 1407 CD1 ILE A 90 18.646 -1.957 -9.202 1.00 0.00 C ATOM 0 H ILE A 90 21.254 -5.381 -7.426 1.00 0.00 H new ATOM 0 HA ILE A 90 21.306 -2.652 -6.179 1.00 0.00 H new ATOM 0 HB ILE A 90 19.098 -4.113 -7.687 1.00 0.00 H new ATOM 0 HG12 ILE A 90 20.162 -1.252 -7.834 1.00 0.00 H new ATOM 0 HG13 ILE A 90 20.700 -2.547 -8.885 1.00 0.00 H new ATOM 0 HG21 ILE A 90 17.552 -2.366 -6.834 1.00 0.00 H new ATOM 0 HG22 ILE A 90 18.202 -3.343 -5.496 1.00 0.00 H new ATOM 0 HG23 ILE A 90 18.851 -1.716 -5.806 1.00 0.00 H new ATOM 0 HD11 ILE A 90 18.902 -1.227 -9.970 1.00 0.00 H new ATOM 0 HD12 ILE A 90 18.359 -2.896 -9.675 1.00 0.00 H new ATOM 0 HD13 ILE A 90 17.813 -1.581 -8.608 1.00 0.00 H new ATOM 1419 N ASP A 91 19.958 -3.457 -4.142 1.00 0.00 N ATOM 1420 CA ASP A 91 19.539 -3.999 -2.818 1.00 0.00 C ATOM 1421 C ASP A 91 18.007 -4.039 -2.770 1.00 0.00 C ATOM 1422 O ASP A 91 17.406 -4.923 -2.192 1.00 0.00 O ATOM 1423 CB ASP A 91 20.037 -3.046 -1.734 1.00 0.00 C ATOM 1424 CG ASP A 91 19.568 -3.509 -0.356 1.00 0.00 C ATOM 1425 OD1 ASP A 91 18.852 -4.491 -0.286 1.00 0.00 O ATOM 1426 OD2 ASP A 91 19.940 -2.865 0.617 1.00 0.00 O ATOM 0 H ASP A 91 19.910 -2.441 -4.218 1.00 0.00 H new ATOM 0 HA ASP A 91 19.946 -4.998 -2.665 1.00 0.00 H new ATOM 0 HB2 ASP A 91 21.126 -2.998 -1.757 1.00 0.00 H new ATOM 0 HB3 ASP A 91 19.669 -2.039 -1.930 1.00 0.00 H new ATOM 1431 N LYS A 92 17.387 -3.078 -3.401 1.00 0.00 N ATOM 1432 CA LYS A 92 15.900 -2.999 -3.427 1.00 0.00 C ATOM 1433 C LYS A 92 15.461 -2.352 -4.751 1.00 0.00 C ATOM 1434 O LYS A 92 16.159 -1.522 -5.295 1.00 0.00 O ATOM 1435 CB LYS A 92 15.440 -2.119 -2.261 1.00 0.00 C ATOM 1436 CG LYS A 92 15.638 -0.641 -2.626 1.00 0.00 C ATOM 1437 CD LYS A 92 15.390 0.244 -1.393 1.00 0.00 C ATOM 1438 CE LYS A 92 15.149 1.693 -1.839 1.00 0.00 C ATOM 1439 NZ LYS A 92 14.695 2.511 -0.676 1.00 0.00 N ATOM 0 H LYS A 92 17.859 -2.330 -3.909 1.00 0.00 H new ATOM 0 HA LYS A 92 15.464 -3.994 -3.340 1.00 0.00 H new ATOM 0 HB2 LYS A 92 14.391 -2.312 -2.038 1.00 0.00 H new ATOM 0 HB3 LYS A 92 16.007 -2.362 -1.362 1.00 0.00 H new ATOM 0 HG2 LYS A 92 16.650 -0.483 -3.000 1.00 0.00 H new ATOM 0 HG3 LYS A 92 14.955 -0.361 -3.428 1.00 0.00 H new ATOM 0 HD2 LYS A 92 14.528 -0.124 -0.836 1.00 0.00 H new ATOM 0 HD3 LYS A 92 16.247 0.197 -0.721 1.00 0.00 H new ATOM 0 HE2 LYS A 92 16.065 2.112 -2.255 1.00 0.00 H new ATOM 0 HE3 LYS A 92 14.399 1.720 -2.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 14.824 3.521 -0.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 13.689 2.322 -0.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 15.255 2.261 0.164 1.00 0.00 H new ATOM 1453 N ILE A 93 14.325 -2.728 -5.291 1.00 0.00 N ATOM 1454 CA ILE A 93 13.900 -2.130 -6.596 1.00 0.00 C ATOM 1455 C ILE A 93 12.464 -1.602 -6.481 1.00 0.00 C ATOM 1456 O ILE A 93 11.573 -2.282 -6.010 1.00 0.00 O ATOM 1457 CB ILE A 93 13.999 -3.175 -7.724 1.00 0.00 C ATOM 1458 CG1 ILE A 93 13.821 -2.481 -9.082 1.00 0.00 C ATOM 1459 CG2 ILE A 93 12.912 -4.237 -7.562 1.00 0.00 C ATOM 1460 CD1 ILE A 93 15.179 -2.003 -9.606 1.00 0.00 C ATOM 0 H ILE A 93 13.683 -3.412 -4.891 1.00 0.00 H new ATOM 0 HA ILE A 93 14.565 -1.301 -6.839 1.00 0.00 H new ATOM 0 HB ILE A 93 14.977 -3.653 -7.673 1.00 0.00 H new ATOM 0 HG12 ILE A 93 13.368 -3.170 -9.795 1.00 0.00 H new ATOM 0 HG13 ILE A 93 13.142 -1.634 -8.981 1.00 0.00 H new ATOM 0 HG21 ILE A 93 12.995 -4.968 -8.366 1.00 0.00 H new ATOM 0 HG22 ILE A 93 13.033 -4.738 -6.602 1.00 0.00 H new ATOM 0 HG23 ILE A 93 11.931 -3.763 -7.602 1.00 0.00 H new ATOM 0 HD11 ILE A 93 15.045 -1.512 -10.570 1.00 0.00 H new ATOM 0 HD12 ILE A 93 15.615 -1.299 -8.897 1.00 0.00 H new ATOM 0 HD13 ILE A 93 15.845 -2.858 -9.724 1.00 0.00 H new ATOM 1472 N VAL A 94 12.245 -0.387 -6.916 1.00 0.00 N ATOM 1473 CA VAL A 94 10.872 0.214 -6.887 1.00 0.00 C ATOM 1474 C VAL A 94 10.632 0.951 -8.216 1.00 0.00 C ATOM 1475 O VAL A 94 11.518 1.606 -8.724 1.00 0.00 O ATOM 1476 CB VAL A 94 10.797 1.227 -5.735 1.00 0.00 C ATOM 1477 CG1 VAL A 94 10.567 0.503 -4.411 1.00 0.00 C ATOM 1478 CG2 VAL A 94 12.101 2.026 -5.656 1.00 0.00 C ATOM 0 H VAL A 94 12.968 0.224 -7.296 1.00 0.00 H new ATOM 0 HA VAL A 94 10.122 -0.564 -6.747 1.00 0.00 H new ATOM 0 HB VAL A 94 9.965 1.906 -5.922 1.00 0.00 H new ATOM 0 HG11 VAL A 94 10.516 1.232 -3.602 1.00 0.00 H new ATOM 0 HG12 VAL A 94 9.631 -0.053 -4.458 1.00 0.00 H new ATOM 0 HG13 VAL A 94 11.390 -0.187 -4.226 1.00 0.00 H new ATOM 0 HG21 VAL A 94 12.040 2.742 -4.837 1.00 0.00 H new ATOM 0 HG22 VAL A 94 12.935 1.346 -5.482 1.00 0.00 H new ATOM 0 HG23 VAL A 94 12.258 2.560 -6.593 1.00 0.00 H new ATOM 1488 N LEU A 95 9.457 0.859 -8.801 1.00 0.00 N ATOM 1489 CA LEU A 95 9.242 1.570 -10.106 1.00 0.00 C ATOM 1490 C LEU A 95 7.855 2.225 -10.175 1.00 0.00 C ATOM 1491 O LEU A 95 6.848 1.627 -9.847 1.00 0.00 O ATOM 1492 CB LEU A 95 9.367 0.590 -11.269 1.00 0.00 C ATOM 1493 CG LEU A 95 10.366 -0.516 -10.927 1.00 0.00 C ATOM 1494 CD1 LEU A 95 9.644 -1.648 -10.197 1.00 0.00 C ATOM 1495 CD2 LEU A 95 10.978 -1.055 -12.224 1.00 0.00 C ATOM 0 H LEU A 95 8.657 0.337 -8.443 1.00 0.00 H new ATOM 0 HA LEU A 95 10.005 2.345 -10.176 1.00 0.00 H new ATOM 0 HB2 LEU A 95 8.393 0.154 -11.492 1.00 0.00 H new ATOM 0 HB3 LEU A 95 9.692 1.118 -12.165 1.00 0.00 H new ATOM 0 HG LEU A 95 11.152 -0.117 -10.286 1.00 0.00 H new ATOM 0 HD11 LEU A 95 10.356 -2.436 -9.953 1.00 0.00 H new ATOM 0 HD12 LEU A 95 9.200 -1.264 -9.279 1.00 0.00 H new ATOM 0 HD13 LEU A 95 8.860 -2.052 -10.838 1.00 0.00 H new ATOM 0 HD21 LEU A 95 11.692 -1.844 -11.989 1.00 0.00 H new ATOM 0 HD22 LEU A 95 10.189 -1.457 -12.859 1.00 0.00 H new ATOM 0 HD23 LEU A 95 11.490 -0.248 -12.748 1.00 0.00 H new ATOM 1507 N LEU A 96 7.807 3.452 -10.639 1.00 0.00 N ATOM 1508 CA LEU A 96 6.505 4.166 -10.785 1.00 0.00 C ATOM 1509 C LEU A 96 6.271 4.501 -12.264 1.00 0.00 C ATOM 1510 O LEU A 96 7.077 5.160 -12.889 1.00 0.00 O ATOM 1511 CB LEU A 96 6.536 5.486 -10.004 1.00 0.00 C ATOM 1512 CG LEU A 96 7.279 5.314 -8.679 1.00 0.00 C ATOM 1513 CD1 LEU A 96 8.783 5.197 -8.941 1.00 0.00 C ATOM 1514 CD2 LEU A 96 7.015 6.541 -7.805 1.00 0.00 C ATOM 0 H LEU A 96 8.624 3.991 -10.925 1.00 0.00 H new ATOM 0 HA LEU A 96 5.712 3.523 -10.403 1.00 0.00 H new ATOM 0 HB2 LEU A 96 7.023 6.256 -10.602 1.00 0.00 H new ATOM 0 HB3 LEU A 96 5.518 5.826 -9.814 1.00 0.00 H new ATOM 0 HG LEU A 96 6.931 4.411 -8.177 1.00 0.00 H new ATOM 0 HD11 LEU A 96 9.309 5.075 -7.994 1.00 0.00 H new ATOM 0 HD12 LEU A 96 8.975 4.333 -9.577 1.00 0.00 H new ATOM 0 HD13 LEU A 96 9.137 6.100 -9.438 1.00 0.00 H new ATOM 0 HD21 LEU A 96 7.540 6.431 -6.856 1.00 0.00 H new ATOM 0 HD22 LEU A 96 7.372 7.435 -8.316 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.945 6.632 -7.620 1.00 0.00 H new ATOM 1526 N ASP A 97 5.170 4.073 -12.825 1.00 0.00 N ATOM 1527 CA ASP A 97 4.894 4.385 -14.260 1.00 0.00 C ATOM 1528 C ASP A 97 3.523 5.064 -14.367 1.00 0.00 C ATOM 1529 O ASP A 97 2.546 4.603 -13.811 1.00 0.00 O ATOM 1530 CB ASP A 97 4.885 3.094 -15.085 1.00 0.00 C ATOM 1531 CG ASP A 97 4.703 3.437 -16.567 1.00 0.00 C ATOM 1532 OD1 ASP A 97 4.603 4.613 -16.877 1.00 0.00 O ATOM 1533 OD2 ASP A 97 4.666 2.518 -17.369 1.00 0.00 O ATOM 0 H ASP A 97 4.452 3.523 -12.354 1.00 0.00 H new ATOM 0 HA ASP A 97 5.671 5.047 -14.643 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.818 2.550 -14.939 1.00 0.00 H new ATOM 0 HB3 ASP A 97 4.079 2.441 -14.750 1.00 0.00 H new ATOM 1538 N PHE A 98 3.443 6.165 -15.068 1.00 0.00 N ATOM 1539 CA PHE A 98 2.131 6.873 -15.200 1.00 0.00 C ATOM 1540 C PHE A 98 2.153 7.825 -16.403 1.00 0.00 C ATOM 1541 O PHE A 98 3.130 8.504 -16.635 1.00 0.00 O ATOM 1542 CB PHE A 98 1.875 7.696 -13.932 1.00 0.00 C ATOM 1543 CG PHE A 98 0.440 8.164 -13.900 1.00 0.00 C ATOM 1544 CD1 PHE A 98 -0.573 7.288 -13.492 1.00 0.00 C ATOM 1545 CD2 PHE A 98 0.122 9.476 -14.278 1.00 0.00 C ATOM 1546 CE1 PHE A 98 -1.903 7.722 -13.462 1.00 0.00 C ATOM 1547 CE2 PHE A 98 -1.209 9.909 -14.247 1.00 0.00 C ATOM 1548 CZ PHE A 98 -2.221 9.034 -13.839 1.00 0.00 C ATOM 0 H PHE A 98 4.225 6.605 -15.554 1.00 0.00 H new ATOM 0 HA PHE A 98 1.346 6.131 -15.342 1.00 0.00 H new ATOM 0 HB2 PHE A 98 2.090 7.094 -13.049 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.547 8.554 -13.904 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -0.328 6.277 -13.200 1.00 0.00 H new ATOM 0 HD2 PHE A 98 0.903 10.152 -14.593 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -2.685 7.046 -13.148 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -1.455 10.920 -14.538 1.00 0.00 H new ATOM 0 HZ PHE A 98 -3.247 9.369 -13.814 1.00 0.00 H new ATOM 1558 N PRO A 99 1.086 7.883 -17.161 1.00 0.00 N ATOM 1559 CA PRO A 99 0.994 8.791 -18.342 1.00 0.00 C ATOM 1560 C PRO A 99 1.514 10.199 -18.032 1.00 0.00 C ATOM 1561 O PRO A 99 1.014 10.870 -17.149 1.00 0.00 O ATOM 1562 CB PRO A 99 -0.501 8.821 -18.660 1.00 0.00 C ATOM 1563 CG PRO A 99 -1.014 7.492 -18.220 1.00 0.00 C ATOM 1564 CD PRO A 99 -0.154 7.075 -17.022 1.00 0.00 C ATOM 0 HA PRO A 99 1.605 8.441 -19.174 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -1.001 9.632 -18.131 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -0.675 8.979 -19.724 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -2.066 7.554 -17.941 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -0.940 6.761 -19.025 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -0.659 7.281 -16.079 1.00 0.00 H new ATOM 0 HD3 PRO A 99 0.063 6.007 -17.041 1.00 0.00 H new ATOM 1572 N VAL A 100 2.516 10.648 -18.738 1.00 0.00 N ATOM 1573 CA VAL A 100 3.054 12.014 -18.485 1.00 0.00 C ATOM 1574 C VAL A 100 2.974 12.852 -19.763 1.00 0.00 C ATOM 1575 O VAL A 100 3.167 12.356 -20.855 1.00 0.00 O ATOM 1576 CB VAL A 100 4.514 11.907 -18.032 1.00 0.00 C ATOM 1577 CG1 VAL A 100 5.215 13.251 -18.236 1.00 0.00 C ATOM 1578 CG2 VAL A 100 4.557 11.529 -16.549 1.00 0.00 C ATOM 0 H VAL A 100 2.985 10.127 -19.479 1.00 0.00 H new ATOM 0 HA VAL A 100 2.462 12.496 -17.707 1.00 0.00 H new ATOM 0 HB VAL A 100 5.022 11.143 -18.620 1.00 0.00 H new ATOM 0 HG11 VAL A 100 6.253 13.173 -17.913 1.00 0.00 H new ATOM 0 HG12 VAL A 100 5.183 13.522 -19.291 1.00 0.00 H new ATOM 0 HG13 VAL A 100 4.709 14.018 -17.649 1.00 0.00 H new ATOM 0 HG21 VAL A 100 5.594 11.452 -16.223 1.00 0.00 H new ATOM 0 HG22 VAL A 100 4.049 12.295 -15.963 1.00 0.00 H new ATOM 0 HG23 VAL A 100 4.059 10.571 -16.403 1.00 0.00 H new ATOM 1588 N ALA A 101 2.699 14.121 -19.632 1.00 0.00 N ATOM 1589 CA ALA A 101 2.615 15.000 -20.836 1.00 0.00 C ATOM 1590 C ALA A 101 3.345 16.321 -20.561 1.00 0.00 C ATOM 1591 O ALA A 101 3.064 17.009 -19.599 1.00 0.00 O ATOM 1592 CB ALA A 101 1.146 15.289 -21.147 1.00 0.00 C ATOM 0 H ALA A 101 2.528 14.589 -18.742 1.00 0.00 H new ATOM 0 HA ALA A 101 3.080 14.499 -21.685 1.00 0.00 H new ATOM 0 HB1 ALA A 101 1.080 15.931 -22.026 1.00 0.00 H new ATOM 0 HB2 ALA A 101 0.624 14.352 -21.342 1.00 0.00 H new ATOM 0 HB3 ALA A 101 0.686 15.791 -20.296 1.00 0.00 H new ATOM 1598 N ALA A 102 4.275 16.685 -21.402 1.00 0.00 N ATOM 1599 CA ALA A 102 5.011 17.961 -21.186 1.00 0.00 C ATOM 1600 C ALA A 102 4.182 19.127 -21.725 1.00 0.00 C ATOM 1601 O ALA A 102 4.489 19.696 -22.754 1.00 0.00 O ATOM 1602 CB ALA A 102 6.355 17.909 -21.913 1.00 0.00 C ATOM 0 H ALA A 102 4.556 16.155 -22.227 1.00 0.00 H new ATOM 0 HA ALA A 102 5.184 18.102 -20.119 1.00 0.00 H new ATOM 0 HB1 ALA A 102 6.892 18.844 -21.753 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.947 17.080 -21.525 1.00 0.00 H new ATOM 0 HB3 ALA A 102 6.186 17.765 -22.980 1.00 0.00 H new ATOM 1608 N VAL A 103 3.135 19.487 -21.035 1.00 0.00 N ATOM 1609 CA VAL A 103 2.273 20.604 -21.513 1.00 0.00 C ATOM 1610 C VAL A 103 1.642 21.302 -20.308 1.00 0.00 C ATOM 1611 O VAL A 103 0.645 20.861 -19.771 1.00 0.00 O ATOM 1612 CB VAL A 103 1.175 20.047 -22.418 1.00 0.00 C ATOM 1613 CG1 VAL A 103 1.808 19.248 -23.557 1.00 0.00 C ATOM 1614 CG2 VAL A 103 0.257 19.131 -21.602 1.00 0.00 C ATOM 0 H VAL A 103 2.839 19.055 -20.160 1.00 0.00 H new ATOM 0 HA VAL A 103 2.874 21.319 -22.075 1.00 0.00 H new ATOM 0 HB VAL A 103 0.594 20.871 -22.832 1.00 0.00 H new ATOM 0 HG11 VAL A 103 1.024 18.851 -24.202 1.00 0.00 H new ATOM 0 HG12 VAL A 103 2.462 19.898 -24.138 1.00 0.00 H new ATOM 0 HG13 VAL A 103 2.390 18.424 -23.144 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -0.527 18.733 -22.247 1.00 0.00 H new ATOM 0 HG22 VAL A 103 0.839 18.308 -21.188 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -0.196 19.700 -20.790 1.00 0.00 H new ATOM 1624 N LYS A 104 2.215 22.395 -19.880 1.00 0.00 N ATOM 1625 CA LYS A 104 1.651 23.125 -18.711 1.00 0.00 C ATOM 1626 C LYS A 104 1.598 24.621 -19.025 1.00 0.00 C ATOM 1627 O LYS A 104 0.849 25.059 -19.875 1.00 0.00 O ATOM 1628 CB LYS A 104 2.543 22.897 -17.489 1.00 0.00 C ATOM 1629 CG LYS A 104 2.667 21.399 -17.215 1.00 0.00 C ATOM 1630 CD LYS A 104 1.341 20.870 -16.659 1.00 0.00 C ATOM 1631 CE LYS A 104 1.562 19.490 -16.038 1.00 0.00 C ATOM 1632 NZ LYS A 104 2.234 18.599 -17.026 1.00 0.00 N ATOM 0 H LYS A 104 3.050 22.813 -20.291 1.00 0.00 H new ATOM 0 HA LYS A 104 0.646 22.758 -18.503 1.00 0.00 H new ATOM 0 HB2 LYS A 104 3.529 23.328 -17.661 1.00 0.00 H new ATOM 0 HB3 LYS A 104 2.122 23.402 -16.620 1.00 0.00 H new ATOM 0 HG2 LYS A 104 2.925 20.871 -18.133 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.472 21.214 -16.503 1.00 0.00 H new ATOM 0 HD2 LYS A 104 0.948 21.558 -15.911 1.00 0.00 H new ATOM 0 HD3 LYS A 104 0.600 20.807 -17.456 1.00 0.00 H new ATOM 0 HE2 LYS A 104 2.172 19.578 -15.139 1.00 0.00 H new ATOM 0 HE3 LYS A 104 0.608 19.059 -15.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 1.778 17.665 -17.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 2.156 19.014 -17.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 3.238 18.496 -16.774 1.00 0.00 H new ATOM 1646 N SER A 105 2.382 25.412 -18.345 1.00 0.00 N ATOM 1647 CA SER A 105 2.370 26.876 -18.615 1.00 0.00 C ATOM 1648 C SER A 105 0.989 27.431 -18.269 1.00 0.00 C ATOM 1649 O SER A 105 0.790 28.627 -18.179 1.00 0.00 O ATOM 1650 CB SER A 105 2.665 27.119 -20.095 1.00 0.00 C ATOM 1651 OG SER A 105 3.611 26.158 -20.545 1.00 0.00 O ATOM 0 H SER A 105 3.028 25.108 -17.617 1.00 0.00 H new ATOM 0 HA SER A 105 3.128 27.374 -18.010 1.00 0.00 H new ATOM 0 HB2 SER A 105 1.747 27.045 -20.678 1.00 0.00 H new ATOM 0 HB3 SER A 105 3.055 28.127 -20.240 1.00 0.00 H new ATOM 0 HG SER A 105 3.803 26.308 -21.494 1.00 0.00 H new ATOM 1657 N SER A 106 0.030 26.568 -18.072 1.00 0.00 N ATOM 1658 CA SER A 106 -1.339 27.041 -17.736 1.00 0.00 C ATOM 1659 C SER A 106 -1.271 27.977 -16.530 1.00 0.00 C ATOM 1660 O SER A 106 -0.536 27.744 -15.590 1.00 0.00 O ATOM 1661 CB SER A 106 -2.226 25.840 -17.407 1.00 0.00 C ATOM 1662 OG SER A 106 -3.561 26.285 -17.197 1.00 0.00 O ATOM 0 H SER A 106 0.137 25.555 -18.130 1.00 0.00 H new ATOM 0 HA SER A 106 -1.760 27.578 -18.586 1.00 0.00 H new ATOM 0 HB2 SER A 106 -2.195 25.117 -18.222 1.00 0.00 H new ATOM 0 HB3 SER A 106 -1.855 25.333 -16.516 1.00 0.00 H new ATOM 0 HG SER A 106 -4.133 25.517 -16.988 1.00 0.00 H new ATOM 1668 N VAL A 107 -2.031 29.033 -16.552 1.00 0.00 N ATOM 1669 CA VAL A 107 -2.020 29.994 -15.415 1.00 0.00 C ATOM 1670 C VAL A 107 -3.464 30.275 -15.002 1.00 0.00 C ATOM 1671 O VAL A 107 -4.341 30.438 -15.830 1.00 0.00 O ATOM 1672 CB VAL A 107 -1.350 31.296 -15.857 1.00 0.00 C ATOM 1673 CG1 VAL A 107 -2.218 31.989 -16.908 1.00 0.00 C ATOM 1674 CG2 VAL A 107 -1.179 32.221 -14.649 1.00 0.00 C ATOM 0 H VAL A 107 -2.665 29.274 -17.314 1.00 0.00 H new ATOM 0 HA VAL A 107 -1.467 29.575 -14.574 1.00 0.00 H new ATOM 0 HB VAL A 107 -0.373 31.071 -16.284 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -1.739 32.916 -17.222 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -2.338 31.333 -17.770 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -3.196 32.212 -16.482 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -0.701 33.148 -14.966 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -2.156 32.444 -14.220 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -0.558 31.730 -13.900 1.00 0.00 H new ATOM 1684 N VAL A 108 -3.716 30.333 -13.721 1.00 0.00 N ATOM 1685 CA VAL A 108 -5.102 30.583 -13.236 1.00 0.00 C ATOM 1686 C VAL A 108 -5.119 30.563 -11.712 1.00 0.00 C ATOM 1687 O VAL A 108 -5.823 29.784 -11.100 1.00 0.00 O ATOM 1688 CB VAL A 108 -6.025 29.484 -13.761 1.00 0.00 C ATOM 1689 CG1 VAL A 108 -5.471 28.118 -13.363 1.00 0.00 C ATOM 1690 CG2 VAL A 108 -7.422 29.662 -13.165 1.00 0.00 C ATOM 0 H VAL A 108 -3.017 30.217 -12.987 1.00 0.00 H new ATOM 0 HA VAL A 108 -5.443 31.555 -13.593 1.00 0.00 H new ATOM 0 HB VAL A 108 -6.083 29.549 -14.848 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -6.130 27.335 -13.738 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -4.476 27.990 -13.790 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -5.411 28.052 -12.277 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.080 28.878 -13.540 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -7.365 29.599 -12.078 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -7.818 30.636 -13.452 1.00 0.00 H new ATOM 1700 N ALA A 109 -4.359 31.422 -11.094 1.00 0.00 N ATOM 1701 CA ALA A 109 -4.335 31.450 -9.610 1.00 0.00 C ATOM 1702 C ALA A 109 -5.507 32.298 -9.121 1.00 0.00 C ATOM 1703 O ALA A 109 -5.518 33.503 -9.277 1.00 0.00 O ATOM 1704 CB ALA A 109 -3.018 32.062 -9.132 1.00 0.00 C ATOM 0 H ALA A 109 -3.755 32.104 -11.553 1.00 0.00 H new ATOM 0 HA ALA A 109 -4.419 30.438 -9.214 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -3.001 32.082 -8.042 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.184 31.462 -9.497 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -2.929 33.078 -9.515 1.00 0.00 H new ATOM 1710 N THR A 110 -6.501 31.691 -8.537 1.00 0.00 N ATOM 1711 CA THR A 110 -7.662 32.486 -8.054 1.00 0.00 C ATOM 1712 C THR A 110 -8.063 32.013 -6.656 1.00 0.00 C ATOM 1713 O THR A 110 -9.099 31.405 -6.473 1.00 0.00 O ATOM 1714 CB THR A 110 -8.838 32.294 -9.014 1.00 0.00 C ATOM 1715 OG1 THR A 110 -8.397 32.503 -10.349 1.00 0.00 O ATOM 1716 CG2 THR A 110 -9.947 33.291 -8.681 1.00 0.00 C ATOM 0 H THR A 110 -6.560 30.686 -8.374 1.00 0.00 H new ATOM 0 HA THR A 110 -7.390 33.541 -8.013 1.00 0.00 H new ATOM 0 HB THR A 110 -9.225 31.280 -8.911 1.00 0.00 H new ATOM 0 HG1 THR A 110 -9.149 32.379 -10.965 1.00 0.00 H new ATOM 0 HG21 THR A 110 -10.782 33.150 -9.368 1.00 0.00 H new ATOM 0 HG22 THR A 110 -10.287 33.129 -7.658 1.00 0.00 H new ATOM 0 HG23 THR A 110 -9.564 34.307 -8.779 1.00 0.00 H new ATOM 1724 N PRO A 111 -7.244 32.291 -5.674 1.00 0.00 N ATOM 1725 CA PRO A 111 -7.510 31.892 -4.266 1.00 0.00 C ATOM 1726 C PRO A 111 -8.472 32.853 -3.564 1.00 0.00 C ATOM 1727 CB PRO A 111 -6.127 31.950 -3.620 1.00 0.00 C ATOM 1728 CG PRO A 111 -5.397 33.012 -4.371 1.00 0.00 C ATOM 1729 CD PRO A 111 -5.969 33.018 -5.794 1.00 0.00 C ATOM 0 HA PRO A 111 -7.987 30.914 -4.198 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -6.196 32.193 -2.560 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -5.615 30.990 -3.695 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -5.531 33.984 -3.896 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -4.326 32.809 -4.385 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -6.123 34.034 -6.157 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -5.295 32.527 -6.496 1.00 0.00 H new TER 1737 PRO A 111 ATOM 1738 N MET B 1 27.814 22.186 -7.635 1.00 0.00 N ATOM 1739 CA MET B 1 28.755 22.425 -8.767 1.00 0.00 C ATOM 1740 C MET B 1 28.106 23.373 -9.779 1.00 0.00 C ATOM 1741 O MET B 1 28.771 24.167 -10.413 1.00 0.00 O ATOM 1742 CB MET B 1 29.080 21.095 -9.449 1.00 0.00 C ATOM 1743 CG MET B 1 30.199 21.304 -10.470 1.00 0.00 C ATOM 1744 SD MET B 1 30.450 19.779 -11.411 1.00 0.00 S ATOM 1745 CE MET B 1 30.984 18.741 -10.026 1.00 0.00 C ATOM 0 H1 MET B 1 28.319 21.715 -6.857 1.00 0.00 H new ATOM 0 H2 MET B 1 27.435 23.095 -7.301 1.00 0.00 H new ATOM 0 H3 MET B 1 27.031 21.581 -7.956 1.00 0.00 H new ATOM 0 HA MET B 1 29.674 22.873 -8.388 1.00 0.00 H new ATOM 0 HB2 MET B 1 29.385 20.358 -8.706 1.00 0.00 H new ATOM 0 HB3 MET B 1 28.192 20.701 -9.943 1.00 0.00 H new ATOM 0 HG2 MET B 1 29.943 22.122 -11.144 1.00 0.00 H new ATOM 0 HG3 MET B 1 31.121 21.586 -9.962 1.00 0.00 H new ATOM 0 HE1 MET B 1 31.628 17.943 -10.396 1.00 0.00 H new ATOM 0 HE2 MET B 1 31.535 19.348 -9.307 1.00 0.00 H new ATOM 0 HE3 MET B 1 30.111 18.306 -9.540 1.00 0.00 H new ATOM 1754 N ALA B 2 26.815 23.294 -9.934 1.00 0.00 N ATOM 1755 CA ALA B 2 26.124 24.187 -10.910 1.00 0.00 C ATOM 1756 C ALA B 2 26.753 24.009 -12.294 1.00 0.00 C ATOM 1757 O ALA B 2 27.380 24.904 -12.824 1.00 0.00 O ATOM 1758 CB ALA B 2 26.280 25.641 -10.464 1.00 0.00 C ATOM 0 H ALA B 2 26.206 22.650 -9.428 1.00 0.00 H new ATOM 0 HA ALA B 2 25.066 23.931 -10.955 1.00 0.00 H new ATOM 0 HB1 ALA B 2 25.776 26.296 -11.175 1.00 0.00 H new ATOM 0 HB2 ALA B 2 25.837 25.768 -9.476 1.00 0.00 H new ATOM 0 HB3 ALA B 2 27.339 25.897 -10.422 1.00 0.00 H new ATOM 1764 N THR B 3 26.584 22.857 -12.885 1.00 0.00 N ATOM 1765 CA THR B 3 27.167 22.617 -14.236 1.00 0.00 C ATOM 1766 C THR B 3 26.041 22.590 -15.267 1.00 0.00 C ATOM 1767 O THR B 3 26.263 22.404 -16.447 1.00 0.00 O ATOM 1768 CB THR B 3 27.888 21.270 -14.243 1.00 0.00 C ATOM 1769 OG1 THR B 3 28.665 21.157 -15.424 1.00 0.00 O ATOM 1770 CG2 THR B 3 26.862 20.136 -14.192 1.00 0.00 C ATOM 0 H THR B 3 26.067 22.071 -12.490 1.00 0.00 H new ATOM 0 HA THR B 3 27.873 23.411 -14.479 1.00 0.00 H new ATOM 0 HB THR B 3 28.540 21.203 -13.372 1.00 0.00 H new ATOM 0 HG1 THR B 3 28.139 21.462 -16.192 1.00 0.00 H new ATOM 0 HG21 THR B 3 27.379 19.177 -14.197 1.00 0.00 H new ATOM 0 HG22 THR B 3 26.268 20.223 -13.282 1.00 0.00 H new ATOM 0 HG23 THR B 3 26.206 20.199 -15.060 1.00 0.00 H new ATOM 1778 N SER B 4 24.833 22.787 -14.822 1.00 0.00 N ATOM 1779 CA SER B 4 23.673 22.769 -15.751 1.00 0.00 C ATOM 1780 C SER B 4 22.424 23.184 -14.986 1.00 0.00 C ATOM 1781 O SER B 4 22.255 24.334 -14.635 1.00 0.00 O ATOM 1782 CB SER B 4 23.469 21.363 -16.303 1.00 0.00 C ATOM 1783 OG SER B 4 24.504 21.058 -17.228 1.00 0.00 O ATOM 0 H SER B 4 24.598 22.961 -13.845 1.00 0.00 H new ATOM 0 HA SER B 4 23.860 23.456 -16.576 1.00 0.00 H new ATOM 0 HB2 SER B 4 23.470 20.638 -15.489 1.00 0.00 H new ATOM 0 HB3 SER B 4 22.498 21.291 -16.792 1.00 0.00 H new ATOM 0 HG SER B 4 25.151 21.794 -17.250 1.00 0.00 H new ATOM 1789 N GLY B 5 21.549 22.264 -14.708 1.00 0.00 N ATOM 1790 CA GLY B 5 20.308 22.636 -13.973 1.00 0.00 C ATOM 1791 C GLY B 5 20.346 22.037 -12.561 1.00 0.00 C ATOM 1792 O GLY B 5 21.290 21.375 -12.178 1.00 0.00 O ATOM 0 H GLY B 5 21.635 21.278 -14.954 1.00 0.00 H new ATOM 0 HA2 GLY B 5 20.218 23.721 -13.916 1.00 0.00 H new ATOM 0 HA3 GLY B 5 19.432 22.271 -14.510 1.00 0.00 H new ATOM 1796 N PHE B 6 19.315 22.253 -11.794 1.00 0.00 N ATOM 1797 CA PHE B 6 19.277 21.690 -10.420 1.00 0.00 C ATOM 1798 C PHE B 6 17.941 20.963 -10.243 1.00 0.00 C ATOM 1799 O PHE B 6 16.896 21.488 -10.574 1.00 0.00 O ATOM 1800 CB PHE B 6 19.410 22.822 -9.400 1.00 0.00 C ATOM 1801 CG PHE B 6 20.875 23.140 -9.196 1.00 0.00 C ATOM 1802 CD1 PHE B 6 21.638 22.390 -8.289 1.00 0.00 C ATOM 1803 CD2 PHE B 6 21.473 24.186 -9.910 1.00 0.00 C ATOM 1804 CE1 PHE B 6 22.994 22.686 -8.097 1.00 0.00 C ATOM 1805 CE2 PHE B 6 22.829 24.481 -9.717 1.00 0.00 C ATOM 1806 CZ PHE B 6 23.590 23.731 -8.811 1.00 0.00 C ATOM 0 H PHE B 6 18.495 22.797 -12.062 1.00 0.00 H new ATOM 0 HA PHE B 6 20.100 20.992 -10.266 1.00 0.00 H new ATOM 0 HB2 PHE B 6 18.879 23.707 -9.750 1.00 0.00 H new ATOM 0 HB3 PHE B 6 18.954 22.530 -8.454 1.00 0.00 H new ATOM 0 HD1 PHE B 6 21.179 21.583 -7.737 1.00 0.00 H new ATOM 0 HD2 PHE B 6 20.889 24.765 -10.610 1.00 0.00 H new ATOM 0 HE1 PHE B 6 23.579 22.107 -7.398 1.00 0.00 H new ATOM 0 HE2 PHE B 6 23.289 25.288 -10.268 1.00 0.00 H new ATOM 0 HZ PHE B 6 24.635 23.959 -8.664 1.00 0.00 H new ATOM 1816 N LYS B 7 17.963 19.745 -9.771 1.00 0.00 N ATOM 1817 CA LYS B 7 16.682 18.989 -9.635 1.00 0.00 C ATOM 1818 C LYS B 7 16.198 18.900 -8.193 1.00 0.00 C ATOM 1819 O LYS B 7 16.925 18.548 -7.283 1.00 0.00 O ATOM 1820 CB LYS B 7 16.870 17.561 -10.161 1.00 0.00 C ATOM 1821 CG LYS B 7 15.495 16.921 -10.388 1.00 0.00 C ATOM 1822 CD LYS B 7 15.604 15.396 -10.277 1.00 0.00 C ATOM 1823 CE LYS B 7 15.630 14.986 -8.803 1.00 0.00 C ATOM 1824 NZ LYS B 7 17.035 14.992 -8.310 1.00 0.00 N ATOM 0 H LYS B 7 18.802 19.245 -9.477 1.00 0.00 H new ATOM 0 HA LYS B 7 15.935 19.534 -10.212 1.00 0.00 H new ATOM 0 HB2 LYS B 7 17.436 17.576 -11.093 1.00 0.00 H new ATOM 0 HB3 LYS B 7 17.446 16.971 -9.448 1.00 0.00 H new ATOM 0 HG2 LYS B 7 14.783 17.298 -9.653 1.00 0.00 H new ATOM 0 HG3 LYS B 7 15.114 17.196 -11.371 1.00 0.00 H new ATOM 0 HD2 LYS B 7 14.760 14.924 -10.781 1.00 0.00 H new ATOM 0 HD3 LYS B 7 16.508 15.049 -10.777 1.00 0.00 H new ATOM 0 HE2 LYS B 7 15.023 15.673 -8.213 1.00 0.00 H new ATOM 0 HE3 LYS B 7 15.196 13.994 -8.683 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 17.302 14.032 -8.011 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 17.669 15.306 -9.072 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 17.117 15.642 -7.502 1.00 0.00 H new ATOM 1838 N HIS B 8 14.933 19.157 -8.012 1.00 0.00 N ATOM 1839 CA HIS B 8 14.286 19.010 -6.684 1.00 0.00 C ATOM 1840 C HIS B 8 13.067 18.123 -6.909 1.00 0.00 C ATOM 1841 O HIS B 8 12.248 18.402 -7.761 1.00 0.00 O ATOM 1842 CB HIS B 8 13.829 20.367 -6.143 1.00 0.00 C ATOM 1843 CG HIS B 8 13.531 20.246 -4.670 1.00 0.00 C ATOM 1844 ND1 HIS B 8 14.531 20.050 -3.727 1.00 0.00 N ATOM 1845 CD2 HIS B 8 12.352 20.285 -3.962 1.00 0.00 C ATOM 1846 CE1 HIS B 8 13.943 19.981 -2.517 1.00 0.00 C ATOM 1847 NE2 HIS B 8 12.620 20.118 -2.607 1.00 0.00 N ATOM 0 H HIS B 8 14.306 19.472 -8.752 1.00 0.00 H new ATOM 0 HA HIS B 8 14.982 18.586 -5.960 1.00 0.00 H new ATOM 0 HB2 HIS B 8 14.604 21.116 -6.308 1.00 0.00 H new ATOM 0 HB3 HIS B 8 12.941 20.704 -6.678 1.00 0.00 H new ATOM 0 HD2 HIS B 8 11.371 20.424 -4.391 1.00 0.00 H new ATOM 0 HE1 HIS B 8 14.477 19.833 -1.590 1.00 0.00 H new ATOM 0 HE2 HIS B 8 11.945 20.103 -1.842 1.00 0.00 H new ATOM 1856 N LEU B 9 12.935 17.051 -6.187 1.00 0.00 N ATOM 1857 CA LEU B 9 11.765 16.164 -6.422 1.00 0.00 C ATOM 1858 C LEU B 9 11.134 15.799 -5.090 1.00 0.00 C ATOM 1859 O LEU B 9 11.808 15.600 -4.100 1.00 0.00 O ATOM 1860 CB LEU B 9 12.209 14.895 -7.154 1.00 0.00 C ATOM 1861 CG LEU B 9 10.977 14.080 -7.555 1.00 0.00 C ATOM 1862 CD1 LEU B 9 11.180 13.489 -8.950 1.00 0.00 C ATOM 1863 CD2 LEU B 9 10.766 12.945 -6.551 1.00 0.00 C ATOM 0 H LEU B 9 13.577 16.751 -5.453 1.00 0.00 H new ATOM 0 HA LEU B 9 11.034 16.687 -7.038 1.00 0.00 H new ATOM 0 HB2 LEU B 9 12.789 15.157 -8.039 1.00 0.00 H new ATOM 0 HB3 LEU B 9 12.859 14.300 -6.512 1.00 0.00 H new ATOM 0 HG LEU B 9 10.103 14.731 -7.561 1.00 0.00 H new ATOM 0 HD11 LEU B 9 10.301 12.910 -9.231 1.00 0.00 H new ATOM 0 HD12 LEU B 9 11.329 14.295 -9.669 1.00 0.00 H new ATOM 0 HD13 LEU B 9 12.056 12.840 -8.946 1.00 0.00 H new ATOM 0 HD21 LEU B 9 9.889 12.365 -6.837 1.00 0.00 H new ATOM 0 HD22 LEU B 9 11.643 12.297 -6.544 1.00 0.00 H new ATOM 0 HD23 LEU B 9 10.616 13.363 -5.556 1.00 0.00 H new ATOM 1875 N VAL B 10 9.838 15.718 -5.058 1.00 0.00 N ATOM 1876 CA VAL B 10 9.146 15.390 -3.791 1.00 0.00 C ATOM 1877 C VAL B 10 8.135 14.268 -4.037 1.00 0.00 C ATOM 1878 O VAL B 10 7.441 14.255 -5.033 1.00 0.00 O ATOM 1879 CB VAL B 10 8.418 16.641 -3.287 1.00 0.00 C ATOM 1880 CG1 VAL B 10 7.446 17.127 -4.364 1.00 0.00 C ATOM 1881 CG2 VAL B 10 7.638 16.314 -2.012 1.00 0.00 C ATOM 0 H VAL B 10 9.226 15.866 -5.861 1.00 0.00 H new ATOM 0 HA VAL B 10 9.870 15.060 -3.046 1.00 0.00 H new ATOM 0 HB VAL B 10 9.150 17.419 -3.069 1.00 0.00 H new ATOM 0 HG11 VAL B 10 6.926 18.017 -4.010 1.00 0.00 H new ATOM 0 HG12 VAL B 10 7.999 17.367 -5.272 1.00 0.00 H new ATOM 0 HG13 VAL B 10 6.719 16.343 -4.579 1.00 0.00 H new ATOM 0 HG21 VAL B 10 7.124 17.208 -1.661 1.00 0.00 H new ATOM 0 HG22 VAL B 10 6.906 15.534 -2.223 1.00 0.00 H new ATOM 0 HG23 VAL B 10 8.328 15.966 -1.243 1.00 0.00 H new ATOM 1891 N VAL B 11 8.023 13.347 -3.123 1.00 0.00 N ATOM 1892 CA VAL B 11 7.029 12.250 -3.287 1.00 0.00 C ATOM 1893 C VAL B 11 6.107 12.333 -2.087 1.00 0.00 C ATOM 1894 O VAL B 11 6.555 12.522 -0.974 1.00 0.00 O ATOM 1895 CB VAL B 11 7.718 10.885 -3.328 1.00 0.00 C ATOM 1896 CG1 VAL B 11 7.070 10.034 -4.420 1.00 0.00 C ATOM 1897 CG2 VAL B 11 9.207 11.064 -3.638 1.00 0.00 C ATOM 0 H VAL B 11 8.577 13.306 -2.268 1.00 0.00 H new ATOM 0 HA VAL B 11 6.483 12.358 -4.224 1.00 0.00 H new ATOM 0 HB VAL B 11 7.612 10.393 -2.361 1.00 0.00 H new ATOM 0 HG11 VAL B 11 7.555 9.058 -4.457 1.00 0.00 H new ATOM 0 HG12 VAL B 11 6.010 9.904 -4.200 1.00 0.00 H new ATOM 0 HG13 VAL B 11 7.182 10.531 -5.383 1.00 0.00 H new ATOM 0 HG21 VAL B 11 9.693 10.089 -3.666 1.00 0.00 H new ATOM 0 HG22 VAL B 11 9.321 11.554 -4.605 1.00 0.00 H new ATOM 0 HG23 VAL B 11 9.669 11.677 -2.864 1.00 0.00 H new ATOM 1907 N VAL B 12 4.825 12.253 -2.278 1.00 0.00 N ATOM 1908 CA VAL B 12 3.940 12.387 -1.094 1.00 0.00 C ATOM 1909 C VAL B 12 2.791 11.380 -1.090 1.00 0.00 C ATOM 1910 O VAL B 12 2.426 10.802 -2.096 1.00 0.00 O ATOM 1911 CB VAL B 12 3.370 13.796 -1.104 1.00 0.00 C ATOM 1912 CG1 VAL B 12 4.486 14.780 -1.464 1.00 0.00 C ATOM 1913 CG2 VAL B 12 2.261 13.882 -2.157 1.00 0.00 C ATOM 0 H VAL B 12 4.361 12.105 -3.174 1.00 0.00 H new ATOM 0 HA VAL B 12 4.532 12.189 -0.200 1.00 0.00 H new ATOM 0 HB VAL B 12 2.963 14.040 -0.123 1.00 0.00 H new ATOM 0 HG11 VAL B 12 4.087 15.794 -1.474 1.00 0.00 H new ATOM 0 HG12 VAL B 12 5.284 14.711 -0.725 1.00 0.00 H new ATOM 0 HG13 VAL B 12 4.882 14.536 -2.450 1.00 0.00 H new ATOM 0 HG21 VAL B 12 1.848 14.891 -2.169 1.00 0.00 H new ATOM 0 HG22 VAL B 12 2.672 13.647 -3.139 1.00 0.00 H new ATOM 0 HG23 VAL B 12 1.472 13.170 -1.914 1.00 0.00 H new ATOM 1923 N LYS B 13 2.201 11.212 0.062 1.00 0.00 N ATOM 1924 CA LYS B 13 1.030 10.311 0.211 1.00 0.00 C ATOM 1925 C LYS B 13 -0.033 11.088 0.994 1.00 0.00 C ATOM 1926 O LYS B 13 0.285 11.992 1.742 1.00 0.00 O ATOM 1927 CB LYS B 13 1.441 9.045 0.969 1.00 0.00 C ATOM 1928 CG LYS B 13 0.193 8.203 1.263 1.00 0.00 C ATOM 1929 CD LYS B 13 -0.472 7.794 -0.052 1.00 0.00 C ATOM 1930 CE LYS B 13 -1.371 6.582 0.186 1.00 0.00 C ATOM 1931 NZ LYS B 13 -2.084 6.738 1.487 1.00 0.00 N ATOM 0 H LYS B 13 2.491 11.674 0.924 1.00 0.00 H new ATOM 0 HA LYS B 13 0.641 10.003 -0.760 1.00 0.00 H new ATOM 0 HB2 LYS B 13 2.152 8.468 0.378 1.00 0.00 H new ATOM 0 HB3 LYS B 13 1.942 9.311 1.900 1.00 0.00 H new ATOM 0 HG2 LYS B 13 0.467 7.316 1.835 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -0.507 8.773 1.874 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -1.059 8.623 -0.448 1.00 0.00 H new ATOM 0 HD3 LYS B 13 0.287 7.556 -0.797 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -2.092 6.485 -0.626 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -0.775 5.670 0.193 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -2.930 6.134 1.494 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -1.453 6.458 2.265 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -2.367 7.731 1.611 1.00 0.00 H new ATOM 1945 N PHE B 14 -1.287 10.781 0.814 1.00 0.00 N ATOM 1946 CA PHE B 14 -2.349 11.556 1.526 1.00 0.00 C ATOM 1947 C PHE B 14 -3.061 10.699 2.585 1.00 0.00 C ATOM 1948 O PHE B 14 -3.212 9.502 2.438 1.00 0.00 O ATOM 1949 CB PHE B 14 -3.369 12.033 0.496 1.00 0.00 C ATOM 1950 CG PHE B 14 -4.195 10.859 0.026 1.00 0.00 C ATOM 1951 CD1 PHE B 14 -3.749 10.069 -1.043 1.00 0.00 C ATOM 1952 CD2 PHE B 14 -5.405 10.558 0.658 1.00 0.00 C ATOM 1953 CE1 PHE B 14 -4.516 8.981 -1.478 1.00 0.00 C ATOM 1954 CE2 PHE B 14 -6.172 9.471 0.225 1.00 0.00 C ATOM 1955 CZ PHE B 14 -5.727 8.682 -0.844 1.00 0.00 C ATOM 0 H PHE B 14 -1.624 10.032 0.209 1.00 0.00 H new ATOM 0 HA PHE B 14 -1.884 12.399 2.037 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -4.015 12.794 0.933 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -2.859 12.495 -0.350 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -2.814 10.300 -1.531 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -5.748 11.166 1.482 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -4.173 8.373 -2.302 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -7.107 9.240 0.714 1.00 0.00 H new ATOM 0 HZ PHE B 14 -6.319 7.843 -1.179 1.00 0.00 H new ATOM 1965 N LYS B 15 -3.525 11.322 3.643 1.00 0.00 N ATOM 1966 CA LYS B 15 -4.279 10.575 4.695 1.00 0.00 C ATOM 1967 C LYS B 15 -5.574 11.335 4.997 1.00 0.00 C ATOM 1968 O LYS B 15 -6.527 10.780 5.509 1.00 0.00 O ATOM 1969 CB LYS B 15 -3.438 10.451 5.969 1.00 0.00 C ATOM 1970 CG LYS B 15 -3.162 11.839 6.544 1.00 0.00 C ATOM 1971 CD LYS B 15 -2.231 11.716 7.753 1.00 0.00 C ATOM 1972 CE LYS B 15 -2.136 13.070 8.458 1.00 0.00 C ATOM 1973 NZ LYS B 15 -1.545 14.077 7.532 1.00 0.00 N ATOM 0 H LYS B 15 -3.412 12.320 3.822 1.00 0.00 H new ATOM 0 HA LYS B 15 -4.507 9.571 4.338 1.00 0.00 H new ATOM 0 HB2 LYS B 15 -3.963 9.841 6.704 1.00 0.00 H new ATOM 0 HB3 LYS B 15 -2.498 9.946 5.747 1.00 0.00 H new ATOM 0 HG2 LYS B 15 -2.707 12.475 5.785 1.00 0.00 H new ATOM 0 HG3 LYS B 15 -4.097 12.314 6.839 1.00 0.00 H new ATOM 0 HD2 LYS B 15 -2.609 10.960 8.442 1.00 0.00 H new ATOM 0 HD3 LYS B 15 -1.242 11.390 7.433 1.00 0.00 H new ATOM 0 HE2 LYS B 15 -3.126 13.394 8.779 1.00 0.00 H new ATOM 0 HE3 LYS B 15 -1.523 12.982 9.355 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 -1.741 15.034 7.889 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 -0.517 13.933 7.473 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 -1.965 13.968 6.587 1.00 0.00 H new ATOM 1987 N GLU B 16 -5.625 12.592 4.649 1.00 0.00 N ATOM 1988 CA GLU B 16 -6.870 13.380 4.864 1.00 0.00 C ATOM 1989 C GLU B 16 -7.695 13.274 3.578 1.00 0.00 C ATOM 1990 O GLU B 16 -8.833 12.848 3.575 1.00 0.00 O ATOM 1991 CB GLU B 16 -6.515 14.854 5.125 1.00 0.00 C ATOM 1992 CG GLU B 16 -5.678 14.975 6.403 1.00 0.00 C ATOM 1993 CD GLU B 16 -5.416 16.453 6.709 1.00 0.00 C ATOM 1994 OE1 GLU B 16 -5.723 17.280 5.864 1.00 0.00 O ATOM 1995 OE2 GLU B 16 -4.913 16.737 7.784 1.00 0.00 O ATOM 0 H GLU B 16 -4.855 13.108 4.224 1.00 0.00 H new ATOM 0 HA GLU B 16 -7.426 13.001 5.722 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -5.961 15.258 4.278 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -7.426 15.444 5.220 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -6.201 14.508 7.238 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -4.733 14.445 6.282 1.00 0.00 H new ATOM 2002 N ASP B 17 -7.092 13.655 2.486 1.00 0.00 N ATOM 2003 CA ASP B 17 -7.742 13.577 1.149 1.00 0.00 C ATOM 2004 C ASP B 17 -7.078 14.640 0.279 1.00 0.00 C ATOM 2005 O ASP B 17 -7.685 15.614 -0.114 1.00 0.00 O ATOM 2006 CB ASP B 17 -9.243 13.855 1.257 1.00 0.00 C ATOM 2007 CG ASP B 17 -9.810 14.158 -0.133 1.00 0.00 C ATOM 2008 OD1 ASP B 17 -9.146 13.843 -1.106 1.00 0.00 O ATOM 2009 OD2 ASP B 17 -10.905 14.695 -0.199 1.00 0.00 O ATOM 0 H ASP B 17 -6.143 14.030 2.466 1.00 0.00 H new ATOM 0 HA ASP B 17 -7.625 12.581 0.723 1.00 0.00 H new ATOM 0 HB2 ASP B 17 -9.753 12.994 1.689 1.00 0.00 H new ATOM 0 HB3 ASP B 17 -9.420 14.698 1.925 1.00 0.00 H new ATOM 2014 N THR B 18 -5.807 14.479 0.030 1.00 0.00 N ATOM 2015 CA THR B 18 -5.059 15.506 -0.749 1.00 0.00 C ATOM 2016 C THR B 18 -5.763 15.897 -2.043 1.00 0.00 C ATOM 2017 O THR B 18 -5.730 15.195 -3.035 1.00 0.00 O ATOM 2018 CB THR B 18 -3.663 14.994 -1.099 1.00 0.00 C ATOM 2019 OG1 THR B 18 -2.966 14.669 0.094 1.00 0.00 O ATOM 2020 CG2 THR B 18 -2.912 16.092 -1.853 1.00 0.00 C ATOM 0 H THR B 18 -5.253 13.678 0.333 1.00 0.00 H new ATOM 0 HA THR B 18 -5.002 16.388 -0.111 1.00 0.00 H new ATOM 0 HB THR B 18 -3.737 14.103 -1.722 1.00 0.00 H new ATOM 0 HG1 THR B 18 -3.046 15.409 0.731 1.00 0.00 H new ATOM 0 HG21 THR B 18 -1.913 15.739 -2.109 1.00 0.00 H new ATOM 0 HG22 THR B 18 -3.453 16.343 -2.765 1.00 0.00 H new ATOM 0 HG23 THR B 18 -2.834 16.978 -1.223 1.00 0.00 H new ATOM 2028 N LYS B 19 -6.346 17.060 -2.046 1.00 0.00 N ATOM 2029 CA LYS B 19 -6.994 17.571 -3.272 1.00 0.00 C ATOM 2030 C LYS B 19 -5.860 17.859 -4.249 1.00 0.00 C ATOM 2031 O LYS B 19 -5.369 18.964 -4.339 1.00 0.00 O ATOM 2032 CB LYS B 19 -7.754 18.862 -2.954 1.00 0.00 C ATOM 2033 CG LYS B 19 -8.472 18.709 -1.608 1.00 0.00 C ATOM 2034 CD LYS B 19 -7.467 18.887 -0.465 1.00 0.00 C ATOM 2035 CE LYS B 19 -7.937 20.012 0.465 1.00 0.00 C ATOM 2036 NZ LYS B 19 -9.351 19.775 0.867 1.00 0.00 N ATOM 0 H LYS B 19 -6.399 17.682 -1.240 1.00 0.00 H new ATOM 0 HA LYS B 19 -7.708 16.857 -3.684 1.00 0.00 H new ATOM 0 HB2 LYS B 19 -7.063 19.704 -2.917 1.00 0.00 H new ATOM 0 HB3 LYS B 19 -8.476 19.076 -3.742 1.00 0.00 H new ATOM 0 HG2 LYS B 19 -9.269 19.448 -1.523 1.00 0.00 H new ATOM 0 HG3 LYS B 19 -8.940 17.727 -1.544 1.00 0.00 H new ATOM 0 HD2 LYS B 19 -7.369 17.957 0.094 1.00 0.00 H new ATOM 0 HD3 LYS B 19 -6.482 19.122 -0.867 1.00 0.00 H new ATOM 0 HE2 LYS B 19 -7.300 20.056 1.349 1.00 0.00 H new ATOM 0 HE3 LYS B 19 -7.849 20.974 -0.039 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 -9.480 20.050 1.862 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 -9.982 20.343 0.266 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 -9.580 18.767 0.754 1.00 0.00 H new ATOM 2050 N VAL B 20 -5.411 16.854 -4.948 1.00 0.00 N ATOM 2051 CA VAL B 20 -4.279 17.045 -5.901 1.00 0.00 C ATOM 2052 C VAL B 20 -4.663 18.042 -6.997 1.00 0.00 C ATOM 2053 O VAL B 20 -3.886 18.896 -7.375 1.00 0.00 O ATOM 2054 CB VAL B 20 -3.948 15.705 -6.546 1.00 0.00 C ATOM 2055 CG1 VAL B 20 -3.576 14.693 -5.462 1.00 0.00 C ATOM 2056 CG2 VAL B 20 -5.176 15.199 -7.312 1.00 0.00 C ATOM 0 H VAL B 20 -5.780 15.904 -4.901 1.00 0.00 H new ATOM 0 HA VAL B 20 -3.418 17.432 -5.357 1.00 0.00 H new ATOM 0 HB VAL B 20 -3.109 15.827 -7.231 1.00 0.00 H new ATOM 0 HG11 VAL B 20 -3.339 13.735 -5.925 1.00 0.00 H new ATOM 0 HG12 VAL B 20 -2.708 15.054 -4.910 1.00 0.00 H new ATOM 0 HG13 VAL B 20 -4.415 14.568 -4.777 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -4.946 14.240 -7.776 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -6.011 15.077 -6.622 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -5.446 15.920 -8.084 1.00 0.00 H new ATOM 2066 N ASP B 21 -5.850 17.930 -7.515 1.00 0.00 N ATOM 2067 CA ASP B 21 -6.289 18.854 -8.598 1.00 0.00 C ATOM 2068 C ASP B 21 -6.400 20.289 -8.069 1.00 0.00 C ATOM 2069 O ASP B 21 -5.966 21.224 -8.713 1.00 0.00 O ATOM 2070 CB ASP B 21 -7.642 18.390 -9.123 1.00 0.00 C ATOM 2071 CG ASP B 21 -8.675 18.492 -8.000 1.00 0.00 C ATOM 2072 OD1 ASP B 21 -8.272 18.467 -6.846 1.00 0.00 O ATOM 2073 OD2 ASP B 21 -9.851 18.605 -8.305 1.00 0.00 O ATOM 0 H ASP B 21 -6.541 17.234 -7.235 1.00 0.00 H new ATOM 0 HA ASP B 21 -5.553 18.842 -9.402 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -7.947 19.003 -9.971 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -7.575 17.362 -9.480 1.00 0.00 H new ATOM 2078 N GLU B 22 -6.955 20.483 -6.902 1.00 0.00 N ATOM 2079 CA GLU B 22 -7.039 21.867 -6.357 1.00 0.00 C ATOM 2080 C GLU B 22 -5.625 22.286 -5.979 1.00 0.00 C ATOM 2081 O GLU B 22 -5.227 23.426 -6.131 1.00 0.00 O ATOM 2082 CB GLU B 22 -7.937 21.894 -5.121 1.00 0.00 C ATOM 2083 CG GLU B 22 -9.383 21.644 -5.543 1.00 0.00 C ATOM 2084 CD GLU B 22 -10.297 21.747 -4.321 1.00 0.00 C ATOM 2085 OE1 GLU B 22 -9.776 21.817 -3.221 1.00 0.00 O ATOM 2086 OE2 GLU B 22 -11.502 21.754 -4.508 1.00 0.00 O ATOM 0 H GLU B 22 -7.349 19.752 -6.310 1.00 0.00 H new ATOM 0 HA GLU B 22 -7.464 22.547 -7.096 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -7.617 21.134 -4.408 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -7.854 22.857 -4.618 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -9.684 22.371 -6.297 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -9.475 20.657 -5.997 1.00 0.00 H new ATOM 2093 N ILE B 23 -4.853 21.342 -5.531 1.00 0.00 N ATOM 2094 CA ILE B 23 -3.441 21.621 -5.195 1.00 0.00 C ATOM 2095 C ILE B 23 -2.737 21.938 -6.512 1.00 0.00 C ATOM 2096 O ILE B 23 -1.992 22.892 -6.630 1.00 0.00 O ATOM 2097 CB ILE B 23 -2.848 20.360 -4.559 1.00 0.00 C ATOM 2098 CG1 ILE B 23 -3.153 20.363 -3.060 1.00 0.00 C ATOM 2099 CG2 ILE B 23 -1.336 20.311 -4.782 1.00 0.00 C ATOM 2100 CD1 ILE B 23 -2.153 21.264 -2.335 1.00 0.00 C ATOM 0 H ILE B 23 -5.147 20.377 -5.382 1.00 0.00 H new ATOM 0 HA ILE B 23 -3.330 22.452 -4.498 1.00 0.00 H new ATOM 0 HB ILE B 23 -3.294 19.481 -5.023 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -4.169 20.717 -2.886 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -3.097 19.349 -2.665 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -0.930 19.409 -4.324 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -1.126 20.301 -5.852 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -0.873 21.188 -4.329 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -2.372 21.265 -1.267 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -1.142 20.890 -2.498 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -2.231 22.280 -2.722 1.00 0.00 H new ATOM 2112 N LEU B 24 -3.015 21.145 -7.509 1.00 0.00 N ATOM 2113 CA LEU B 24 -2.425 21.369 -8.853 1.00 0.00 C ATOM 2114 C LEU B 24 -2.697 22.811 -9.282 1.00 0.00 C ATOM 2115 O LEU B 24 -1.856 23.458 -9.876 1.00 0.00 O ATOM 2116 CB LEU B 24 -3.085 20.397 -9.830 1.00 0.00 C ATOM 2117 CG LEU B 24 -2.399 20.470 -11.190 1.00 0.00 C ATOM 2118 CD1 LEU B 24 -1.080 19.696 -11.140 1.00 0.00 C ATOM 2119 CD2 LEU B 24 -3.317 19.846 -12.243 1.00 0.00 C ATOM 0 H LEU B 24 -3.637 20.339 -7.445 1.00 0.00 H new ATOM 0 HA LEU B 24 -1.348 21.202 -8.837 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -3.026 19.381 -9.439 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -4.143 20.638 -9.935 1.00 0.00 H new ATOM 0 HG LEU B 24 -2.196 21.510 -11.446 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -0.590 19.749 -12.112 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -0.430 20.133 -10.382 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -1.279 18.654 -10.890 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -2.835 19.893 -13.220 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -3.512 18.805 -11.985 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -4.258 20.394 -12.276 1.00 0.00 H new ATOM 2131 N LYS B 25 -3.856 23.338 -8.972 1.00 0.00 N ATOM 2132 CA LYS B 25 -4.140 24.752 -9.348 1.00 0.00 C ATOM 2133 C LYS B 25 -3.102 25.622 -8.649 1.00 0.00 C ATOM 2134 O LYS B 25 -2.637 26.610 -9.182 1.00 0.00 O ATOM 2135 CB LYS B 25 -5.546 25.161 -8.895 1.00 0.00 C ATOM 2136 CG LYS B 25 -5.839 26.587 -9.378 1.00 0.00 C ATOM 2137 CD LYS B 25 -6.446 27.405 -8.235 1.00 0.00 C ATOM 2138 CE LYS B 25 -5.387 27.651 -7.160 1.00 0.00 C ATOM 2139 NZ LYS B 25 -5.597 28.995 -6.550 1.00 0.00 N ATOM 0 H LYS B 25 -4.608 22.855 -8.481 1.00 0.00 H new ATOM 0 HA LYS B 25 -4.091 24.871 -10.430 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -6.286 24.469 -9.297 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -5.620 25.110 -7.809 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -4.921 27.059 -9.728 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -6.526 26.561 -10.224 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -6.821 28.356 -8.614 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -7.297 26.875 -7.807 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -5.447 26.879 -6.393 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -4.390 27.590 -7.597 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -5.069 29.057 -5.656 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -5.259 29.730 -7.204 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -6.610 29.137 -6.364 1.00 0.00 H new ATOM 2153 N GLY B 26 -2.718 25.235 -7.463 1.00 0.00 N ATOM 2154 CA GLY B 26 -1.680 26.005 -6.734 1.00 0.00 C ATOM 2155 C GLY B 26 -0.405 25.986 -7.574 1.00 0.00 C ATOM 2156 O GLY B 26 0.154 27.014 -7.903 1.00 0.00 O ATOM 0 H GLY B 26 -3.080 24.419 -6.970 1.00 0.00 H new ATOM 0 HA2 GLY B 26 -2.012 27.030 -6.567 1.00 0.00 H new ATOM 0 HA3 GLY B 26 -1.497 25.566 -5.753 1.00 0.00 H new ATOM 2160 N LEU B 27 0.049 24.814 -7.935 1.00 0.00 N ATOM 2161 CA LEU B 27 1.273 24.711 -8.776 1.00 0.00 C ATOM 2162 C LEU B 27 1.170 25.720 -9.925 1.00 0.00 C ATOM 2163 O LEU B 27 2.116 26.420 -10.230 1.00 0.00 O ATOM 2164 CB LEU B 27 1.389 23.287 -9.332 1.00 0.00 C ATOM 2165 CG LEU B 27 2.848 22.979 -9.680 1.00 0.00 C ATOM 2166 CD1 LEU B 27 3.013 21.471 -9.893 1.00 0.00 C ATOM 2167 CD2 LEU B 27 3.230 23.715 -10.966 1.00 0.00 C ATOM 0 H LEU B 27 -0.378 23.923 -7.682 1.00 0.00 H new ATOM 0 HA LEU B 27 2.159 24.930 -8.180 1.00 0.00 H new ATOM 0 HB2 LEU B 27 1.022 22.570 -8.598 1.00 0.00 H new ATOM 0 HB3 LEU B 27 0.765 23.182 -10.219 1.00 0.00 H new ATOM 0 HG LEU B 27 3.493 23.307 -8.865 1.00 0.00 H new ATOM 0 HD11 LEU B 27 4.051 21.250 -10.141 1.00 0.00 H new ATOM 0 HD12 LEU B 27 2.737 20.942 -8.981 1.00 0.00 H new ATOM 0 HD13 LEU B 27 2.368 21.146 -10.709 1.00 0.00 H new ATOM 0 HD21 LEU B 27 4.268 23.497 -11.215 1.00 0.00 H new ATOM 0 HD22 LEU B 27 2.584 23.385 -11.780 1.00 0.00 H new ATOM 0 HD23 LEU B 27 3.110 24.788 -10.820 1.00 0.00 H new ATOM 2179 N GLU B 28 0.024 25.821 -10.552 1.00 0.00 N ATOM 2180 CA GLU B 28 -0.117 26.810 -11.658 1.00 0.00 C ATOM 2181 C GLU B 28 0.364 28.156 -11.128 1.00 0.00 C ATOM 2182 O GLU B 28 0.952 28.948 -11.839 1.00 0.00 O ATOM 2183 CB GLU B 28 -1.586 26.918 -12.087 1.00 0.00 C ATOM 2184 CG GLU B 28 -2.117 25.531 -12.462 1.00 0.00 C ATOM 2185 CD GLU B 28 -1.311 24.979 -13.642 1.00 0.00 C ATOM 2186 OE1 GLU B 28 -0.700 25.771 -14.337 1.00 0.00 O ATOM 2187 OE2 GLU B 28 -1.321 23.774 -13.827 1.00 0.00 O ATOM 0 H GLU B 28 -0.808 25.268 -10.348 1.00 0.00 H new ATOM 0 HA GLU B 28 0.468 26.500 -12.524 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -2.181 27.339 -11.277 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -1.678 27.595 -12.936 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -2.041 24.857 -11.608 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -3.173 25.593 -12.726 1.00 0.00 H new ATOM 2194 N ASN B 29 0.150 28.400 -9.865 1.00 0.00 N ATOM 2195 CA ASN B 29 0.622 29.669 -9.257 1.00 0.00 C ATOM 2196 C ASN B 29 2.154 29.653 -9.273 1.00 0.00 C ATOM 2197 O ASN B 29 2.797 30.616 -9.642 1.00 0.00 O ATOM 2198 CB ASN B 29 0.089 29.747 -7.819 1.00 0.00 C ATOM 2199 CG ASN B 29 -1.423 29.521 -7.796 1.00 0.00 C ATOM 2200 OD1 ASN B 29 -2.059 29.472 -8.829 1.00 0.00 O ATOM 2201 ND2 ASN B 29 -2.023 29.369 -6.648 1.00 0.00 N ATOM 0 H ASN B 29 -0.335 27.769 -9.227 1.00 0.00 H new ATOM 0 HA ASN B 29 0.265 30.539 -9.808 1.00 0.00 H new ATOM 0 HB2 ASN B 29 0.584 28.999 -7.200 1.00 0.00 H new ATOM 0 HB3 ASN B 29 0.324 30.721 -7.390 1.00 0.00 H new ATOM 0 HD21 ASN B 29 -3.030 29.208 -6.616 1.00 0.00 H new ATOM 0 HD22 ASN B 29 -1.485 29.411 -5.782 1.00 0.00 H new ATOM 2208 N LEU B 30 2.736 28.541 -8.897 1.00 0.00 N ATOM 2209 CA LEU B 30 4.223 28.415 -8.906 1.00 0.00 C ATOM 2210 C LEU B 30 4.745 28.901 -10.260 1.00 0.00 C ATOM 2211 O LEU B 30 5.662 29.693 -10.339 1.00 0.00 O ATOM 2212 CB LEU B 30 4.590 26.938 -8.710 1.00 0.00 C ATOM 2213 CG LEU B 30 4.921 26.639 -7.240 1.00 0.00 C ATOM 2214 CD1 LEU B 30 6.319 27.155 -6.900 1.00 0.00 C ATOM 2215 CD2 LEU B 30 3.893 27.308 -6.325 1.00 0.00 C ATOM 0 H LEU B 30 2.238 27.709 -8.582 1.00 0.00 H new ATOM 0 HA LEU B 30 4.665 29.011 -8.108 1.00 0.00 H new ATOM 0 HB2 LEU B 30 3.761 26.308 -9.034 1.00 0.00 H new ATOM 0 HB3 LEU B 30 5.446 26.687 -9.337 1.00 0.00 H new ATOM 0 HG LEU B 30 4.891 25.560 -7.088 1.00 0.00 H new ATOM 0 HD11 LEU B 30 6.543 26.938 -5.856 1.00 0.00 H new ATOM 0 HD12 LEU B 30 7.053 26.664 -7.538 1.00 0.00 H new ATOM 0 HD13 LEU B 30 6.359 28.232 -7.063 1.00 0.00 H new ATOM 0 HD21 LEU B 30 4.136 27.091 -5.285 1.00 0.00 H new ATOM 0 HD22 LEU B 30 3.911 28.386 -6.484 1.00 0.00 H new ATOM 0 HD23 LEU B 30 2.899 26.924 -6.553 1.00 0.00 H new ATOM 2227 N VAL B 31 4.154 28.434 -11.335 1.00 0.00 N ATOM 2228 CA VAL B 31 4.583 28.897 -12.690 1.00 0.00 C ATOM 2229 C VAL B 31 4.700 30.418 -12.676 1.00 0.00 C ATOM 2230 O VAL B 31 5.530 30.997 -13.350 1.00 0.00 O ATOM 2231 CB VAL B 31 3.550 28.473 -13.734 1.00 0.00 C ATOM 2232 CG1 VAL B 31 3.937 29.037 -15.103 1.00 0.00 C ATOM 2233 CG2 VAL B 31 3.507 26.947 -13.805 1.00 0.00 C ATOM 0 H VAL B 31 3.394 27.753 -11.331 1.00 0.00 H new ATOM 0 HA VAL B 31 5.545 28.452 -12.943 1.00 0.00 H new ATOM 0 HB VAL B 31 2.569 28.857 -13.453 1.00 0.00 H new ATOM 0 HG11 VAL B 31 3.198 28.732 -15.844 1.00 0.00 H new ATOM 0 HG12 VAL B 31 3.972 30.125 -15.052 1.00 0.00 H new ATOM 0 HG13 VAL B 31 4.917 28.656 -15.390 1.00 0.00 H new ATOM 0 HG21 VAL B 31 2.772 26.638 -14.548 1.00 0.00 H new ATOM 0 HG22 VAL B 31 4.489 26.568 -14.087 1.00 0.00 H new ATOM 0 HG23 VAL B 31 3.229 26.545 -12.831 1.00 0.00 H new ATOM 2243 N SER B 32 3.884 31.069 -11.898 1.00 0.00 N ATOM 2244 CA SER B 32 3.970 32.547 -11.809 1.00 0.00 C ATOM 2245 C SER B 32 5.440 32.943 -11.664 1.00 0.00 C ATOM 2246 O SER B 32 5.931 33.812 -12.353 1.00 0.00 O ATOM 2247 CB SER B 32 3.190 33.024 -10.581 1.00 0.00 C ATOM 2248 OG SER B 32 3.891 32.653 -9.402 1.00 0.00 O ATOM 0 H SER B 32 3.161 30.639 -11.320 1.00 0.00 H new ATOM 0 HA SER B 32 3.549 33.003 -12.705 1.00 0.00 H new ATOM 0 HB2 SER B 32 3.062 34.106 -10.616 1.00 0.00 H new ATOM 0 HB3 SER B 32 2.192 32.585 -10.577 1.00 0.00 H new ATOM 0 HG SER B 32 3.519 31.818 -9.050 1.00 0.00 H new ATOM 2254 N GLN B 33 6.140 32.319 -10.753 1.00 0.00 N ATOM 2255 CA GLN B 33 7.580 32.643 -10.561 1.00 0.00 C ATOM 2256 C GLN B 33 8.440 32.102 -11.718 1.00 0.00 C ATOM 2257 O GLN B 33 9.598 32.441 -11.828 1.00 0.00 O ATOM 2258 CB GLN B 33 8.057 32.019 -9.245 1.00 0.00 C ATOM 2259 CG GLN B 33 7.051 32.331 -8.132 1.00 0.00 C ATOM 2260 CD GLN B 33 6.800 33.839 -8.073 1.00 0.00 C ATOM 2261 OE1 GLN B 33 7.729 34.621 -8.082 1.00 0.00 O ATOM 2262 NE2 GLN B 33 5.575 34.281 -8.010 1.00 0.00 N ATOM 0 H GLN B 33 5.773 31.597 -10.133 1.00 0.00 H new ATOM 0 HA GLN B 33 7.689 33.727 -10.537 1.00 0.00 H new ATOM 0 HB2 GLN B 33 8.164 30.940 -9.360 1.00 0.00 H new ATOM 0 HB3 GLN B 33 9.039 32.410 -8.981 1.00 0.00 H new ATOM 0 HG2 GLN B 33 6.115 31.804 -8.316 1.00 0.00 H new ATOM 0 HG3 GLN B 33 7.433 31.978 -7.174 1.00 0.00 H new ATOM 0 HE21 GLN B 33 4.795 33.623 -8.003 1.00 0.00 H new ATOM 0 HE22 GLN B 33 5.396 35.284 -7.968 1.00 0.00 H new ATOM 2271 N ILE B 34 7.920 31.253 -12.574 1.00 0.00 N ATOM 2272 CA ILE B 34 8.794 30.720 -13.667 1.00 0.00 C ATOM 2273 C ILE B 34 8.588 31.513 -14.952 1.00 0.00 C ATOM 2274 O ILE B 34 8.872 31.034 -16.032 1.00 0.00 O ATOM 2275 CB ILE B 34 8.524 29.246 -13.948 1.00 0.00 C ATOM 2276 CG1 ILE B 34 8.495 28.463 -12.636 1.00 0.00 C ATOM 2277 CG2 ILE B 34 9.652 28.699 -14.831 1.00 0.00 C ATOM 2278 CD1 ILE B 34 9.763 28.771 -11.837 1.00 0.00 C ATOM 0 H ILE B 34 6.958 30.915 -12.566 1.00 0.00 H new ATOM 0 HA ILE B 34 9.824 30.824 -13.325 1.00 0.00 H new ATOM 0 HB ILE B 34 7.562 29.141 -14.450 1.00 0.00 H new ATOM 0 HG12 ILE B 34 7.612 28.733 -12.057 1.00 0.00 H new ATOM 0 HG13 ILE B 34 8.429 27.394 -12.838 1.00 0.00 H new ATOM 0 HG21 ILE B 34 9.472 27.645 -15.040 1.00 0.00 H new ATOM 0 HG22 ILE B 34 9.682 29.255 -15.768 1.00 0.00 H new ATOM 0 HG23 ILE B 34 10.605 28.808 -14.313 1.00 0.00 H new ATOM 0 HD11 ILE B 34 9.747 28.214 -10.900 1.00 0.00 H new ATOM 0 HD12 ILE B 34 10.638 28.479 -12.417 1.00 0.00 H new ATOM 0 HD13 ILE B 34 9.808 29.839 -11.624 1.00 0.00 H new ATOM 2290 N ASP B 35 8.144 32.734 -14.864 1.00 0.00 N ATOM 2291 CA ASP B 35 7.993 33.516 -16.111 1.00 0.00 C ATOM 2292 C ASP B 35 9.384 33.567 -16.726 1.00 0.00 C ATOM 2293 O ASP B 35 9.581 33.939 -17.864 1.00 0.00 O ATOM 2294 CB ASP B 35 7.513 34.930 -15.782 1.00 0.00 C ATOM 2295 CG ASP B 35 6.083 34.877 -15.244 1.00 0.00 C ATOM 2296 OD1 ASP B 35 5.468 33.827 -15.354 1.00 0.00 O ATOM 2297 OD2 ASP B 35 5.621 35.887 -14.740 1.00 0.00 O ATOM 0 H ASP B 35 7.885 33.213 -14.001 1.00 0.00 H new ATOM 0 HA ASP B 35 7.265 33.070 -16.789 1.00 0.00 H new ATOM 0 HB2 ASP B 35 8.173 35.386 -15.044 1.00 0.00 H new ATOM 0 HB3 ASP B 35 7.553 35.555 -16.674 1.00 0.00 H new ATOM 2302 N THR B 36 10.351 33.169 -15.942 1.00 0.00 N ATOM 2303 CA THR B 36 11.756 33.148 -16.404 1.00 0.00 C ATOM 2304 C THR B 36 11.952 31.960 -17.341 1.00 0.00 C ATOM 2305 O THR B 36 13.021 31.743 -17.873 1.00 0.00 O ATOM 2306 CB THR B 36 12.677 32.995 -15.186 1.00 0.00 C ATOM 2307 OG1 THR B 36 12.465 31.722 -14.586 1.00 0.00 O ATOM 2308 CG2 THR B 36 12.360 34.097 -14.173 1.00 0.00 C ATOM 0 H THR B 36 10.216 32.852 -14.982 1.00 0.00 H new ATOM 0 HA THR B 36 11.993 34.073 -16.930 1.00 0.00 H new ATOM 0 HB THR B 36 13.717 33.076 -15.501 1.00 0.00 H new ATOM 0 HG1 THR B 36 13.055 31.624 -13.809 1.00 0.00 H new ATOM 0 HG21 THR B 36 13.012 33.992 -13.306 1.00 0.00 H new ATOM 0 HG22 THR B 36 12.522 35.072 -14.633 1.00 0.00 H new ATOM 0 HG23 THR B 36 11.320 34.013 -13.857 1.00 0.00 H new ATOM 2316 N VAL B 37 10.926 31.186 -17.556 1.00 0.00 N ATOM 2317 CA VAL B 37 11.068 30.015 -18.462 1.00 0.00 C ATOM 2318 C VAL B 37 12.473 29.435 -18.314 1.00 0.00 C ATOM 2319 O VAL B 37 13.051 28.924 -19.252 1.00 0.00 O ATOM 2320 CB VAL B 37 10.866 30.457 -19.906 1.00 0.00 C ATOM 2321 CG1 VAL B 37 9.470 31.056 -20.080 1.00 0.00 C ATOM 2322 CG2 VAL B 37 11.920 31.506 -20.262 1.00 0.00 C ATOM 0 H VAL B 37 10.001 31.313 -17.146 1.00 0.00 H new ATOM 0 HA VAL B 37 10.323 29.264 -18.202 1.00 0.00 H new ATOM 0 HB VAL B 37 10.966 29.594 -20.565 1.00 0.00 H new ATOM 0 HG11 VAL B 37 9.335 31.369 -21.115 1.00 0.00 H new ATOM 0 HG12 VAL B 37 8.719 30.308 -19.826 1.00 0.00 H new ATOM 0 HG13 VAL B 37 9.360 31.919 -19.423 1.00 0.00 H new ATOM 0 HG21 VAL B 37 11.780 31.826 -21.295 1.00 0.00 H new ATOM 0 HG22 VAL B 37 11.817 32.365 -19.599 1.00 0.00 H new ATOM 0 HG23 VAL B 37 12.915 31.076 -20.147 1.00 0.00 H new ATOM 2332 N LYS B 38 13.018 29.502 -17.135 1.00 0.00 N ATOM 2333 CA LYS B 38 14.374 28.947 -16.903 1.00 0.00 C ATOM 2334 C LYS B 38 14.252 27.859 -15.846 1.00 0.00 C ATOM 2335 O LYS B 38 15.049 27.755 -14.938 1.00 0.00 O ATOM 2336 CB LYS B 38 15.319 30.044 -16.405 1.00 0.00 C ATOM 2337 CG LYS B 38 16.008 30.706 -17.596 1.00 0.00 C ATOM 2338 CD LYS B 38 17.055 31.700 -17.093 1.00 0.00 C ATOM 2339 CE LYS B 38 16.354 32.900 -16.456 1.00 0.00 C ATOM 2340 NZ LYS B 38 17.287 34.061 -16.425 1.00 0.00 N ATOM 0 H LYS B 38 12.577 29.921 -16.316 1.00 0.00 H new ATOM 0 HA LYS B 38 14.779 28.543 -17.831 1.00 0.00 H new ATOM 0 HB2 LYS B 38 14.761 30.787 -15.835 1.00 0.00 H new ATOM 0 HB3 LYS B 38 16.063 29.619 -15.732 1.00 0.00 H new ATOM 0 HG2 LYS B 38 16.481 29.950 -18.222 1.00 0.00 H new ATOM 0 HG3 LYS B 38 15.273 31.219 -18.216 1.00 0.00 H new ATOM 0 HD2 LYS B 38 17.709 31.219 -16.366 1.00 0.00 H new ATOM 0 HD3 LYS B 38 17.685 32.030 -17.919 1.00 0.00 H new ATOM 0 HE2 LYS B 38 15.458 33.155 -17.023 1.00 0.00 H new ATOM 0 HE3 LYS B 38 16.032 32.652 -15.445 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 16.811 34.878 -15.992 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 18.129 33.815 -15.866 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 17.574 34.302 -17.395 1.00 0.00 H new ATOM 2354 N SER B 39 13.237 27.051 -15.960 1.00 0.00 N ATOM 2355 CA SER B 39 13.022 25.975 -14.962 1.00 0.00 C ATOM 2356 C SER B 39 11.887 25.063 -15.445 1.00 0.00 C ATOM 2357 O SER B 39 11.280 25.323 -16.466 1.00 0.00 O ATOM 2358 CB SER B 39 12.660 26.617 -13.630 1.00 0.00 C ATOM 2359 OG SER B 39 13.785 27.307 -13.112 1.00 0.00 O ATOM 0 H SER B 39 12.544 27.092 -16.707 1.00 0.00 H new ATOM 0 HA SER B 39 13.924 25.376 -14.840 1.00 0.00 H new ATOM 0 HB2 SER B 39 11.827 27.307 -13.762 1.00 0.00 H new ATOM 0 HB3 SER B 39 12.333 25.854 -12.924 1.00 0.00 H new ATOM 0 HG SER B 39 14.559 27.154 -13.694 1.00 0.00 H new ATOM 2365 N PHE B 40 11.606 23.985 -14.763 1.00 0.00 N ATOM 2366 CA PHE B 40 10.505 23.100 -15.242 1.00 0.00 C ATOM 2367 C PHE B 40 9.763 22.433 -14.083 1.00 0.00 C ATOM 2368 O PHE B 40 10.281 22.271 -12.996 1.00 0.00 O ATOM 2369 CB PHE B 40 11.117 22.017 -16.134 1.00 0.00 C ATOM 2370 CG PHE B 40 11.871 22.671 -17.257 1.00 0.00 C ATOM 2371 CD1 PHE B 40 11.200 23.045 -18.424 1.00 0.00 C ATOM 2372 CD2 PHE B 40 13.243 22.904 -17.128 1.00 0.00 C ATOM 2373 CE1 PHE B 40 11.904 23.652 -19.468 1.00 0.00 C ATOM 2374 CE2 PHE B 40 13.948 23.512 -18.171 1.00 0.00 C ATOM 2375 CZ PHE B 40 13.279 23.886 -19.342 1.00 0.00 C ATOM 0 H PHE B 40 12.080 23.683 -13.912 1.00 0.00 H new ATOM 0 HA PHE B 40 9.785 23.707 -15.790 1.00 0.00 H new ATOM 0 HB2 PHE B 40 11.786 21.384 -15.551 1.00 0.00 H new ATOM 0 HB3 PHE B 40 10.334 21.372 -16.533 1.00 0.00 H new ATOM 0 HD1 PHE B 40 10.139 22.865 -18.519 1.00 0.00 H new ATOM 0 HD2 PHE B 40 13.758 22.615 -16.224 1.00 0.00 H new ATOM 0 HE1 PHE B 40 11.388 23.940 -20.372 1.00 0.00 H new ATOM 0 HE2 PHE B 40 15.008 23.693 -18.073 1.00 0.00 H new ATOM 0 HZ PHE B 40 13.823 24.355 -20.148 1.00 0.00 H new ATOM 2385 N GLU B 41 8.539 22.023 -14.337 1.00 0.00 N ATOM 2386 CA GLU B 41 7.713 21.362 -13.281 1.00 0.00 C ATOM 2387 C GLU B 41 6.645 20.458 -13.928 1.00 0.00 C ATOM 2388 O GLU B 41 5.812 20.907 -14.689 1.00 0.00 O ATOM 2389 CB GLU B 41 7.012 22.421 -12.448 1.00 0.00 C ATOM 2390 CG GLU B 41 8.033 23.442 -11.945 1.00 0.00 C ATOM 2391 CD GLU B 41 7.364 24.387 -10.945 1.00 0.00 C ATOM 2392 OE1 GLU B 41 6.152 24.313 -10.810 1.00 0.00 O ATOM 2393 OE2 GLU B 41 8.074 25.169 -10.335 1.00 0.00 O ATOM 0 H GLU B 41 8.076 22.121 -15.241 1.00 0.00 H new ATOM 0 HA GLU B 41 8.368 20.760 -12.652 1.00 0.00 H new ATOM 0 HB2 GLU B 41 6.248 22.920 -13.045 1.00 0.00 H new ATOM 0 HB3 GLU B 41 6.503 21.955 -11.604 1.00 0.00 H new ATOM 0 HG2 GLU B 41 8.871 22.930 -11.472 1.00 0.00 H new ATOM 0 HG3 GLU B 41 8.438 24.010 -12.783 1.00 0.00 H new ATOM 2400 N TRP B 42 6.657 19.188 -13.612 1.00 0.00 N ATOM 2401 CA TRP B 42 5.635 18.259 -14.180 1.00 0.00 C ATOM 2402 C TRP B 42 4.922 17.579 -13.019 1.00 0.00 C ATOM 2403 O TRP B 42 5.338 17.705 -11.885 1.00 0.00 O ATOM 2404 CB TRP B 42 6.330 17.210 -15.057 1.00 0.00 C ATOM 2405 CG TRP B 42 7.297 17.873 -15.989 1.00 0.00 C ATOM 2406 CD1 TRP B 42 8.641 17.731 -15.940 1.00 0.00 C ATOM 2407 CD2 TRP B 42 7.025 18.782 -17.096 1.00 0.00 C ATOM 2408 NE1 TRP B 42 9.212 18.487 -16.946 1.00 0.00 N ATOM 2409 CE2 TRP B 42 8.257 19.156 -17.686 1.00 0.00 C ATOM 2410 CE3 TRP B 42 5.842 19.315 -17.642 1.00 0.00 C ATOM 2411 CZ2 TRP B 42 8.312 20.026 -18.777 1.00 0.00 C ATOM 2412 CZ3 TRP B 42 5.896 20.187 -18.742 1.00 0.00 C ATOM 2413 CH2 TRP B 42 7.129 20.542 -19.308 1.00 0.00 C ATOM 0 H TRP B 42 7.333 18.754 -12.983 1.00 0.00 H new ATOM 0 HA TRP B 42 4.917 18.804 -14.793 1.00 0.00 H new ATOM 0 HB2 TRP B 42 6.855 16.490 -14.429 1.00 0.00 H new ATOM 0 HB3 TRP B 42 5.587 16.653 -15.628 1.00 0.00 H new ATOM 0 HD1 TRP B 42 9.181 17.124 -15.229 1.00 0.00 H new ATOM 0 HE1 TRP B 42 10.215 18.544 -17.121 1.00 0.00 H new ATOM 0 HE3 TRP B 42 4.887 19.052 -17.212 1.00 0.00 H new ATOM 0 HZ2 TRP B 42 9.265 20.298 -19.207 1.00 0.00 H new ATOM 0 HZ3 TRP B 42 4.982 20.587 -19.155 1.00 0.00 H new ATOM 0 HH2 TRP B 42 7.163 21.213 -20.153 1.00 0.00 H new ATOM 2424 N GLY B 43 3.857 16.866 -13.262 1.00 0.00 N ATOM 2425 CA GLY B 43 3.162 16.194 -12.117 1.00 0.00 C ATOM 2426 C GLY B 43 2.844 14.738 -12.453 1.00 0.00 C ATOM 2427 O GLY B 43 2.788 14.351 -13.605 1.00 0.00 O ATOM 0 H GLY B 43 3.441 16.718 -14.182 1.00 0.00 H new ATOM 0 HA2 GLY B 43 3.791 16.237 -11.228 1.00 0.00 H new ATOM 0 HA3 GLY B 43 2.241 16.727 -11.882 1.00 0.00 H new ATOM 2431 N GLU B 44 2.622 13.926 -11.456 1.00 0.00 N ATOM 2432 CA GLU B 44 2.317 12.494 -11.715 1.00 0.00 C ATOM 2433 C GLU B 44 1.420 11.958 -10.603 1.00 0.00 C ATOM 2434 O GLU B 44 1.554 12.319 -9.452 1.00 0.00 O ATOM 2435 CB GLU B 44 3.609 11.670 -11.742 1.00 0.00 C ATOM 2436 CG GLU B 44 4.706 12.436 -12.482 1.00 0.00 C ATOM 2437 CD GLU B 44 5.975 11.587 -12.515 1.00 0.00 C ATOM 2438 OE1 GLU B 44 5.895 10.425 -12.151 1.00 0.00 O ATOM 2439 OE2 GLU B 44 7.005 12.111 -12.905 1.00 0.00 O ATOM 0 H GLU B 44 2.639 14.195 -10.472 1.00 0.00 H new ATOM 0 HA GLU B 44 1.816 12.413 -12.679 1.00 0.00 H new ATOM 0 HB2 GLU B 44 3.931 11.451 -10.724 1.00 0.00 H new ATOM 0 HB3 GLU B 44 3.429 10.713 -12.232 1.00 0.00 H new ATOM 0 HG2 GLU B 44 4.383 12.668 -13.497 1.00 0.00 H new ATOM 0 HG3 GLU B 44 4.902 13.386 -11.984 1.00 0.00 H new ATOM 2446 N ASP B 45 0.531 11.079 -10.950 1.00 0.00 N ATOM 2447 CA ASP B 45 -0.353 10.433 -9.943 1.00 0.00 C ATOM 2448 C ASP B 45 -0.202 8.924 -10.132 1.00 0.00 C ATOM 2449 O ASP B 45 0.035 8.466 -11.234 1.00 0.00 O ATOM 2450 CB ASP B 45 -1.805 10.865 -10.158 1.00 0.00 C ATOM 2451 CG ASP B 45 -2.681 10.309 -9.035 1.00 0.00 C ATOM 2452 OD1 ASP B 45 -2.749 10.946 -7.995 1.00 0.00 O ATOM 2453 OD2 ASP B 45 -3.266 9.257 -9.228 1.00 0.00 O ATOM 0 H ASP B 45 0.374 10.772 -11.910 1.00 0.00 H new ATOM 0 HA ASP B 45 -0.077 10.725 -8.930 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -1.871 11.953 -10.179 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -2.162 10.505 -11.123 1.00 0.00 H new ATOM 2458 N LYS B 46 -0.309 8.138 -9.101 1.00 0.00 N ATOM 2459 CA LYS B 46 -0.119 6.671 -9.295 1.00 0.00 C ATOM 2460 C LYS B 46 -1.049 5.899 -8.360 1.00 0.00 C ATOM 2461 O LYS B 46 -1.018 6.073 -7.158 1.00 0.00 O ATOM 2462 CB LYS B 46 1.332 6.282 -9.023 1.00 0.00 C ATOM 2463 CG LYS B 46 1.980 7.343 -8.126 1.00 0.00 C ATOM 2464 CD LYS B 46 1.203 7.440 -6.814 1.00 0.00 C ATOM 2465 CE LYS B 46 1.318 6.118 -6.052 1.00 0.00 C ATOM 2466 NZ LYS B 46 0.136 5.954 -5.159 1.00 0.00 N ATOM 0 H LYS B 46 -0.516 8.437 -8.148 1.00 0.00 H new ATOM 0 HA LYS B 46 -0.360 6.420 -10.328 1.00 0.00 H new ATOM 0 HB2 LYS B 46 1.375 5.306 -8.540 1.00 0.00 H new ATOM 0 HB3 LYS B 46 1.880 6.198 -9.961 1.00 0.00 H new ATOM 0 HG2 LYS B 46 3.020 7.082 -7.928 1.00 0.00 H new ATOM 0 HG3 LYS B 46 1.985 8.309 -8.631 1.00 0.00 H new ATOM 0 HD2 LYS B 46 1.594 8.257 -6.207 1.00 0.00 H new ATOM 0 HD3 LYS B 46 0.156 7.666 -7.015 1.00 0.00 H new ATOM 0 HE2 LYS B 46 1.375 5.286 -6.753 1.00 0.00 H new ATOM 0 HE3 LYS B 46 2.236 6.103 -5.464 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 0.206 5.048 -4.654 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 0.110 6.733 -4.471 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -0.734 5.967 -5.729 1.00 0.00 H new ATOM 2480 N GLU B 47 -1.876 5.052 -8.909 1.00 0.00 N ATOM 2481 CA GLU B 47 -2.805 4.242 -8.067 1.00 0.00 C ATOM 2482 C GLU B 47 -2.774 2.784 -8.535 1.00 0.00 C ATOM 2483 O GLU B 47 -3.507 1.950 -8.046 1.00 0.00 O ATOM 2484 CB GLU B 47 -4.236 4.789 -8.179 1.00 0.00 C ATOM 2485 CG GLU B 47 -4.281 6.233 -7.675 1.00 0.00 C ATOM 2486 CD GLU B 47 -5.724 6.742 -7.708 1.00 0.00 C ATOM 2487 OE1 GLU B 47 -6.564 6.048 -8.257 1.00 0.00 O ATOM 2488 OE2 GLU B 47 -5.966 7.816 -7.182 1.00 0.00 O ATOM 0 H GLU B 47 -1.949 4.884 -9.912 1.00 0.00 H new ATOM 0 HA GLU B 47 -2.486 4.301 -7.026 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -4.571 4.745 -9.215 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -4.918 4.170 -7.597 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -3.888 6.287 -6.660 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -3.647 6.866 -8.296 1.00 0.00 H new ATOM 2495 N SER B 48 -1.931 2.471 -9.486 1.00 0.00 N ATOM 2496 CA SER B 48 -1.866 1.070 -9.996 1.00 0.00 C ATOM 2497 C SER B 48 -1.564 0.102 -8.846 1.00 0.00 C ATOM 2498 O SER B 48 -2.057 0.260 -7.747 1.00 0.00 O ATOM 2499 CB SER B 48 -0.759 0.964 -11.047 1.00 0.00 C ATOM 2500 OG SER B 48 0.496 1.235 -10.435 1.00 0.00 O ATOM 0 H SER B 48 -1.286 3.125 -9.930 1.00 0.00 H new ATOM 0 HA SER B 48 -2.827 0.809 -10.440 1.00 0.00 H new ATOM 0 HB2 SER B 48 -0.754 -0.033 -11.488 1.00 0.00 H new ATOM 0 HB3 SER B 48 -0.942 1.670 -11.857 1.00 0.00 H new ATOM 0 HG SER B 48 1.208 1.166 -11.105 1.00 0.00 H new ATOM 2506 N HIS B 49 -0.750 -0.892 -9.086 1.00 0.00 N ATOM 2507 CA HIS B 49 -0.463 -1.899 -8.023 1.00 0.00 C ATOM 2508 C HIS B 49 0.471 -1.292 -6.975 1.00 0.00 C ATOM 2509 O HIS B 49 1.143 -0.311 -7.221 1.00 0.00 O ATOM 2510 CB HIS B 49 0.194 -3.133 -8.650 1.00 0.00 C ATOM 2511 CG HIS B 49 0.368 -4.198 -7.600 1.00 0.00 C ATOM 2512 ND1 HIS B 49 1.560 -4.366 -6.910 1.00 0.00 N ATOM 2513 CD2 HIS B 49 -0.488 -5.154 -7.109 1.00 0.00 C ATOM 2514 CE1 HIS B 49 1.392 -5.389 -6.052 1.00 0.00 C ATOM 2515 NE2 HIS B 49 0.163 -5.901 -6.135 1.00 0.00 N ATOM 0 H HIS B 49 -0.271 -1.050 -9.973 1.00 0.00 H new ATOM 0 HA HIS B 49 -1.396 -2.192 -7.542 1.00 0.00 H new ATOM 0 HB2 HIS B 49 -0.421 -3.510 -9.467 1.00 0.00 H new ATOM 0 HB3 HIS B 49 1.161 -2.866 -9.076 1.00 0.00 H new ATOM 0 HD2 HIS B 49 -1.508 -5.302 -7.430 1.00 0.00 H new ATOM 0 HE1 HIS B 49 2.157 -5.750 -5.380 1.00 0.00 H new ATOM 0 HE2 HIS B 49 -0.219 -6.678 -5.596 1.00 0.00 H new ATOM 2524 N ASP B 50 0.510 -1.864 -5.804 1.00 0.00 N ATOM 2525 CA ASP B 50 1.399 -1.328 -4.731 1.00 0.00 C ATOM 2526 C ASP B 50 2.870 -1.383 -5.163 1.00 0.00 C ATOM 2527 O ASP B 50 3.619 -0.453 -4.953 1.00 0.00 O ATOM 2528 CB ASP B 50 1.218 -2.160 -3.461 1.00 0.00 C ATOM 2529 CG ASP B 50 -0.188 -1.938 -2.896 1.00 0.00 C ATOM 2530 OD1 ASP B 50 -0.660 -0.815 -2.962 1.00 0.00 O ATOM 2531 OD2 ASP B 50 -0.769 -2.893 -2.410 1.00 0.00 O ATOM 0 H ASP B 50 -0.037 -2.683 -5.541 1.00 0.00 H new ATOM 0 HA ASP B 50 1.128 -0.289 -4.543 1.00 0.00 H new ATOM 0 HB2 ASP B 50 1.369 -3.217 -3.682 1.00 0.00 H new ATOM 0 HB3 ASP B 50 1.967 -1.879 -2.720 1.00 0.00 H new ATOM 2536 N MET B 51 3.294 -2.472 -5.745 1.00 0.00 N ATOM 2537 CA MET B 51 4.717 -2.579 -6.180 1.00 0.00 C ATOM 2538 C MET B 51 5.006 -1.611 -7.336 1.00 0.00 C ATOM 2539 O MET B 51 6.095 -1.086 -7.449 1.00 0.00 O ATOM 2540 CB MET B 51 5.016 -4.012 -6.623 1.00 0.00 C ATOM 2541 CG MET B 51 6.524 -4.186 -6.797 1.00 0.00 C ATOM 2542 SD MET B 51 7.319 -4.211 -5.173 1.00 0.00 S ATOM 2543 CE MET B 51 8.578 -5.456 -5.552 1.00 0.00 C ATOM 0 H MET B 51 2.718 -3.291 -5.938 1.00 0.00 H new ATOM 0 HA MET B 51 5.357 -2.316 -5.338 1.00 0.00 H new ATOM 0 HB2 MET B 51 4.640 -4.719 -5.883 1.00 0.00 H new ATOM 0 HB3 MET B 51 4.503 -4.229 -7.560 1.00 0.00 H new ATOM 0 HG2 MET B 51 6.735 -5.112 -7.331 1.00 0.00 H new ATOM 0 HG3 MET B 51 6.928 -3.372 -7.399 1.00 0.00 H new ATOM 0 HE1 MET B 51 9.195 -5.630 -4.670 1.00 0.00 H new ATOM 0 HE2 MET B 51 8.093 -6.387 -5.845 1.00 0.00 H new ATOM 0 HE3 MET B 51 9.206 -5.102 -6.370 1.00 0.00 H new ATOM 2553 N LEU B 52 4.053 -1.362 -8.194 1.00 0.00 N ATOM 2554 CA LEU B 52 4.311 -0.423 -9.325 1.00 0.00 C ATOM 2555 C LEU B 52 3.968 1.006 -8.886 1.00 0.00 C ATOM 2556 O LEU B 52 4.772 1.910 -8.995 1.00 0.00 O ATOM 2557 CB LEU B 52 3.439 -0.798 -10.529 1.00 0.00 C ATOM 2558 CG LEU B 52 3.648 -2.272 -10.890 1.00 0.00 C ATOM 2559 CD1 LEU B 52 2.897 -2.589 -12.185 1.00 0.00 C ATOM 2560 CD2 LEU B 52 5.141 -2.547 -11.095 1.00 0.00 C ATOM 0 H LEU B 52 3.116 -1.763 -8.162 1.00 0.00 H new ATOM 0 HA LEU B 52 5.362 -0.486 -9.607 1.00 0.00 H new ATOM 0 HB2 LEU B 52 2.389 -0.617 -10.298 1.00 0.00 H new ATOM 0 HB3 LEU B 52 3.691 -0.167 -11.381 1.00 0.00 H new ATOM 0 HG LEU B 52 3.270 -2.897 -10.081 1.00 0.00 H new ATOM 0 HD11 LEU B 52 3.044 -3.638 -12.444 1.00 0.00 H new ATOM 0 HD12 LEU B 52 1.833 -2.396 -12.045 1.00 0.00 H new ATOM 0 HD13 LEU B 52 3.278 -1.960 -12.990 1.00 0.00 H new ATOM 0 HD21 LEU B 52 5.286 -3.596 -11.352 1.00 0.00 H new ATOM 0 HD22 LEU B 52 5.519 -1.920 -11.903 1.00 0.00 H new ATOM 0 HD23 LEU B 52 5.682 -2.320 -10.176 1.00 0.00 H new ATOM 2572 N ARG B 53 2.771 1.215 -8.407 1.00 0.00 N ATOM 2573 CA ARG B 53 2.352 2.580 -7.973 1.00 0.00 C ATOM 2574 C ARG B 53 3.186 3.064 -6.778 1.00 0.00 C ATOM 2575 O ARG B 53 2.953 4.128 -6.241 1.00 0.00 O ATOM 2576 CB ARG B 53 0.876 2.538 -7.574 1.00 0.00 C ATOM 2577 CG ARG B 53 0.755 2.404 -6.052 1.00 0.00 C ATOM 2578 CD ARG B 53 -0.685 2.057 -5.692 1.00 0.00 C ATOM 2579 NE ARG B 53 -0.811 0.578 -5.521 1.00 0.00 N ATOM 2580 CZ ARG B 53 -1.913 0.050 -5.072 1.00 0.00 C ATOM 2581 NH1 ARG B 53 -2.916 0.818 -4.763 1.00 0.00 N ATOM 2582 NH2 ARG B 53 -2.015 -1.247 -4.945 1.00 0.00 N ATOM 0 H ARG B 53 2.059 0.493 -8.297 1.00 0.00 H new ATOM 0 HA ARG B 53 2.508 3.273 -8.800 1.00 0.00 H new ATOM 0 HB2 ARG B 53 0.373 3.445 -7.910 1.00 0.00 H new ATOM 0 HB3 ARG B 53 0.381 1.699 -8.063 1.00 0.00 H new ATOM 0 HG2 ARG B 53 1.430 1.629 -5.688 1.00 0.00 H new ATOM 0 HG3 ARG B 53 1.049 3.336 -5.568 1.00 0.00 H new ATOM 0 HD2 ARG B 53 -0.975 2.566 -4.773 1.00 0.00 H new ATOM 0 HD3 ARG B 53 -1.361 2.403 -6.474 1.00 0.00 H new ATOM 0 HE ARG B 53 -0.024 -0.025 -5.759 1.00 0.00 H new ATOM 0 HH11 ARG B 53 -2.837 1.829 -4.873 1.00 0.00 H new ATOM 0 HH12 ARG B 53 -3.782 0.409 -4.411 1.00 0.00 H new ATOM 0 HH21 ARG B 53 -1.230 -1.847 -5.198 1.00 0.00 H new ATOM 0 HH22 ARG B 53 -2.879 -1.659 -4.593 1.00 0.00 H new ATOM 2596 N GLN B 54 4.145 2.296 -6.348 1.00 0.00 N ATOM 2597 CA GLN B 54 4.978 2.724 -5.184 1.00 0.00 C ATOM 2598 C GLN B 54 4.087 2.989 -3.960 1.00 0.00 C ATOM 2599 O GLN B 54 4.557 3.097 -2.844 1.00 0.00 O ATOM 2600 CB GLN B 54 5.765 3.990 -5.543 1.00 0.00 C ATOM 2601 CG GLN B 54 7.257 3.648 -5.645 1.00 0.00 C ATOM 2602 CD GLN B 54 7.800 3.306 -4.257 1.00 0.00 C ATOM 2603 OE1 GLN B 54 6.978 3.250 -3.247 1.00 0.00 O flip ATOM 2604 NE2 GLN B 54 8.985 3.086 -4.091 1.00 0.00 N flip ATOM 0 H GLN B 54 4.391 1.391 -6.749 1.00 0.00 H new ATOM 0 HA GLN B 54 5.678 1.925 -4.941 1.00 0.00 H new ATOM 0 HB2 GLN B 54 5.408 4.398 -6.489 1.00 0.00 H new ATOM 0 HB3 GLN B 54 5.607 4.757 -4.785 1.00 0.00 H new ATOM 0 HG2 GLN B 54 7.402 2.806 -6.321 1.00 0.00 H new ATOM 0 HG3 GLN B 54 7.806 4.491 -6.064 1.00 0.00 H new ATOM 0 HE21 GLN B 54 9.628 3.130 -4.882 1.00 0.00 H new ATOM 0 HE22 GLN B 54 9.336 2.858 -3.161 1.00 0.00 H new ATOM 2613 N GLY B 55 2.798 3.055 -4.166 1.00 0.00 N ATOM 2614 CA GLY B 55 1.840 3.268 -3.034 1.00 0.00 C ATOM 2615 C GLY B 55 1.642 4.757 -2.692 1.00 0.00 C ATOM 2616 O GLY B 55 0.653 5.116 -2.084 1.00 0.00 O ATOM 0 H GLY B 55 2.360 2.969 -5.083 1.00 0.00 H new ATOM 0 HA2 GLY B 55 0.877 2.828 -3.292 1.00 0.00 H new ATOM 0 HA3 GLY B 55 2.205 2.743 -2.151 1.00 0.00 H new ATOM 2620 N PHE B 56 2.555 5.624 -3.036 1.00 0.00 N ATOM 2621 CA PHE B 56 2.360 7.066 -2.675 1.00 0.00 C ATOM 2622 C PHE B 56 1.046 7.583 -3.274 1.00 0.00 C ATOM 2623 O PHE B 56 0.000 6.989 -3.105 1.00 0.00 O ATOM 2624 CB PHE B 56 3.539 7.899 -3.189 1.00 0.00 C ATOM 2625 CG PHE B 56 4.828 7.169 -2.926 1.00 0.00 C ATOM 2626 CD1 PHE B 56 5.005 6.487 -1.720 1.00 0.00 C ATOM 2627 CD2 PHE B 56 5.845 7.174 -3.888 1.00 0.00 C ATOM 2628 CE1 PHE B 56 6.202 5.806 -1.471 1.00 0.00 C ATOM 2629 CE2 PHE B 56 7.042 6.494 -3.642 1.00 0.00 C ATOM 2630 CZ PHE B 56 7.221 5.810 -2.434 1.00 0.00 C ATOM 0 H PHE B 56 3.414 5.407 -3.542 1.00 0.00 H new ATOM 0 HA PHE B 56 2.312 7.157 -1.590 1.00 0.00 H new ATOM 0 HB2 PHE B 56 3.427 8.086 -4.257 1.00 0.00 H new ATOM 0 HB3 PHE B 56 3.553 8.871 -2.695 1.00 0.00 H new ATOM 0 HD1 PHE B 56 4.218 6.485 -0.980 1.00 0.00 H new ATOM 0 HD2 PHE B 56 5.705 7.703 -4.819 1.00 0.00 H new ATOM 0 HE1 PHE B 56 6.341 5.278 -0.539 1.00 0.00 H new ATOM 0 HE2 PHE B 56 7.827 6.497 -4.383 1.00 0.00 H new ATOM 0 HZ PHE B 56 8.145 5.285 -2.243 1.00 0.00 H new ATOM 2640 N THR B 57 1.093 8.695 -3.966 1.00 0.00 N ATOM 2641 CA THR B 57 -0.146 9.254 -4.589 1.00 0.00 C ATOM 2642 C THR B 57 0.200 10.274 -5.679 1.00 0.00 C ATOM 2643 O THR B 57 -0.508 10.407 -6.657 1.00 0.00 O ATOM 2644 CB THR B 57 -0.997 9.944 -3.518 1.00 0.00 C ATOM 2645 OG1 THR B 57 -2.344 10.027 -3.962 1.00 0.00 O ATOM 2646 CG2 THR B 57 -0.457 11.350 -3.256 1.00 0.00 C ATOM 0 H THR B 57 1.939 9.241 -4.126 1.00 0.00 H new ATOM 0 HA THR B 57 -0.700 8.430 -5.038 1.00 0.00 H new ATOM 0 HB THR B 57 -0.954 9.365 -2.596 1.00 0.00 H new ATOM 0 HG1 THR B 57 -2.947 9.818 -3.218 1.00 0.00 H new ATOM 0 HG21 THR B 57 -1.065 11.837 -2.494 1.00 0.00 H new ATOM 0 HG22 THR B 57 0.575 11.285 -2.910 1.00 0.00 H new ATOM 0 HG23 THR B 57 -0.495 11.932 -4.177 1.00 0.00 H new ATOM 2654 N HIS B 58 1.265 11.013 -5.518 1.00 0.00 N ATOM 2655 CA HIS B 58 1.633 12.003 -6.570 1.00 0.00 C ATOM 2656 C HIS B 58 3.007 12.605 -6.270 1.00 0.00 C ATOM 2657 O HIS B 58 3.438 12.665 -5.137 1.00 0.00 O ATOM 2658 CB HIS B 58 0.594 13.130 -6.588 1.00 0.00 C ATOM 2659 CG HIS B 58 1.001 14.175 -7.597 1.00 0.00 C ATOM 2660 ND1 HIS B 58 0.334 14.336 -8.804 1.00 0.00 N ATOM 2661 CD2 HIS B 58 2.004 15.116 -7.595 1.00 0.00 C ATOM 2662 CE1 HIS B 58 0.940 15.335 -9.473 1.00 0.00 C ATOM 2663 NE2 HIS B 58 1.961 15.842 -8.780 1.00 0.00 N ATOM 0 H HIS B 58 1.890 10.975 -4.713 1.00 0.00 H new ATOM 0 HA HIS B 58 1.662 11.499 -7.536 1.00 0.00 H new ATOM 0 HB2 HIS B 58 -0.388 12.729 -6.840 1.00 0.00 H new ATOM 0 HB3 HIS B 58 0.511 13.578 -5.598 1.00 0.00 H new ATOM 0 HD2 HIS B 58 2.715 15.268 -6.796 1.00 0.00 H new ATOM 0 HE1 HIS B 58 0.637 15.683 -10.450 1.00 0.00 H new ATOM 0 HE2 HIS B 58 2.580 16.603 -9.061 1.00 0.00 H new ATOM 2672 N ALA B 59 3.688 13.068 -7.283 1.00 0.00 N ATOM 2673 CA ALA B 59 5.033 13.664 -7.070 1.00 0.00 C ATOM 2674 C ALA B 59 5.206 14.866 -7.996 1.00 0.00 C ATOM 2675 O ALA B 59 4.427 15.081 -8.905 1.00 0.00 O ATOM 2676 CB ALA B 59 6.121 12.630 -7.367 1.00 0.00 C ATOM 0 H ALA B 59 3.368 13.058 -8.251 1.00 0.00 H new ATOM 0 HA ALA B 59 5.122 13.983 -6.031 1.00 0.00 H new ATOM 0 HB1 ALA B 59 7.102 13.078 -7.208 1.00 0.00 H new ATOM 0 HB2 ALA B 59 6.001 11.774 -6.703 1.00 0.00 H new ATOM 0 HB3 ALA B 59 6.037 12.300 -8.403 1.00 0.00 H new ATOM 2682 N PHE B 60 6.222 15.646 -7.774 1.00 0.00 N ATOM 2683 CA PHE B 60 6.469 16.820 -8.648 1.00 0.00 C ATOM 2684 C PHE B 60 7.949 16.871 -9.010 1.00 0.00 C ATOM 2685 O PHE B 60 8.809 16.786 -8.154 1.00 0.00 O ATOM 2686 CB PHE B 60 6.096 18.102 -7.895 1.00 0.00 C ATOM 2687 CG PHE B 60 4.615 18.113 -7.603 1.00 0.00 C ATOM 2688 CD1 PHE B 60 3.707 18.496 -8.598 1.00 0.00 C ATOM 2689 CD2 PHE B 60 4.150 17.749 -6.334 1.00 0.00 C ATOM 2690 CE1 PHE B 60 2.334 18.512 -8.323 1.00 0.00 C ATOM 2691 CE2 PHE B 60 2.777 17.766 -6.059 1.00 0.00 C ATOM 2692 CZ PHE B 60 1.871 18.148 -7.054 1.00 0.00 C ATOM 0 H PHE B 60 6.896 15.520 -7.019 1.00 0.00 H new ATOM 0 HA PHE B 60 5.867 16.735 -9.553 1.00 0.00 H new ATOM 0 HB2 PHE B 60 6.660 18.165 -6.964 1.00 0.00 H new ATOM 0 HB3 PHE B 60 6.365 18.975 -8.490 1.00 0.00 H new ATOM 0 HD1 PHE B 60 4.065 18.779 -9.577 1.00 0.00 H new ATOM 0 HD2 PHE B 60 4.851 17.455 -5.566 1.00 0.00 H new ATOM 0 HE1 PHE B 60 1.633 18.805 -9.090 1.00 0.00 H new ATOM 0 HE2 PHE B 60 2.418 17.485 -5.080 1.00 0.00 H new ATOM 0 HZ PHE B 60 0.812 18.162 -6.842 1.00 0.00 H new ATOM 2702 N SER B 61 8.261 17.026 -10.262 1.00 0.00 N ATOM 2703 CA SER B 61 9.694 17.068 -10.672 1.00 0.00 C ATOM 2704 C SER B 61 10.052 18.520 -11.000 1.00 0.00 C ATOM 2705 O SER B 61 9.740 19.023 -12.060 1.00 0.00 O ATOM 2706 CB SER B 61 9.915 16.183 -11.895 1.00 0.00 C ATOM 2707 OG SER B 61 9.171 14.981 -11.738 1.00 0.00 O ATOM 0 H SER B 61 7.588 17.126 -11.022 1.00 0.00 H new ATOM 0 HA SER B 61 10.328 16.698 -9.866 1.00 0.00 H new ATOM 0 HB2 SER B 61 9.601 16.705 -12.799 1.00 0.00 H new ATOM 0 HB3 SER B 61 10.975 15.957 -12.010 1.00 0.00 H new ATOM 0 HG SER B 61 9.307 14.408 -12.521 1.00 0.00 H new ATOM 2713 N MET B 62 10.670 19.209 -10.081 1.00 0.00 N ATOM 2714 CA MET B 62 11.053 20.619 -10.347 1.00 0.00 C ATOM 2715 C MET B 62 12.521 20.717 -10.726 1.00 0.00 C ATOM 2716 O MET B 62 13.397 20.298 -9.997 1.00 0.00 O ATOM 2717 CB MET B 62 10.794 21.461 -9.093 1.00 0.00 C ATOM 2718 CG MET B 62 9.310 21.395 -8.731 1.00 0.00 C ATOM 2719 SD MET B 62 8.967 22.566 -7.396 1.00 0.00 S ATOM 2720 CE MET B 62 10.060 21.824 -6.157 1.00 0.00 C ATOM 0 H MET B 62 10.925 18.855 -9.159 1.00 0.00 H new ATOM 0 HA MET B 62 10.454 20.992 -11.178 1.00 0.00 H new ATOM 0 HB2 MET B 62 11.398 21.093 -8.264 1.00 0.00 H new ATOM 0 HB3 MET B 62 11.091 22.495 -9.269 1.00 0.00 H new ATOM 0 HG2 MET B 62 8.700 21.632 -9.603 1.00 0.00 H new ATOM 0 HG3 MET B 62 9.044 20.384 -8.421 1.00 0.00 H new ATOM 0 HE1 MET B 62 9.694 22.064 -5.159 1.00 0.00 H new ATOM 0 HE2 MET B 62 10.076 20.742 -6.287 1.00 0.00 H new ATOM 0 HE3 MET B 62 11.069 22.219 -6.279 1.00 0.00 H new ATOM 2730 N THR B 63 12.784 21.302 -11.857 1.00 0.00 N ATOM 2731 CA THR B 63 14.185 21.443 -12.333 1.00 0.00 C ATOM 2732 C THR B 63 14.444 22.941 -12.572 1.00 0.00 C ATOM 2733 O THR B 63 13.561 23.670 -12.979 1.00 0.00 O ATOM 2734 CB THR B 63 14.357 20.640 -13.627 1.00 0.00 C ATOM 2735 OG1 THR B 63 14.047 19.277 -13.366 1.00 0.00 O ATOM 2736 CG2 THR B 63 15.800 20.745 -14.126 1.00 0.00 C ATOM 0 H THR B 63 12.078 21.694 -12.481 1.00 0.00 H new ATOM 0 HA THR B 63 14.898 21.061 -11.602 1.00 0.00 H new ATOM 0 HB THR B 63 13.690 21.039 -14.391 1.00 0.00 H new ATOM 0 HG1 THR B 63 14.152 18.754 -14.188 1.00 0.00 H new ATOM 0 HG21 THR B 63 15.910 20.170 -15.046 1.00 0.00 H new ATOM 0 HG22 THR B 63 16.043 21.790 -14.320 1.00 0.00 H new ATOM 0 HG23 THR B 63 16.477 20.350 -13.368 1.00 0.00 H new ATOM 2744 N PHE B 64 15.621 23.419 -12.279 1.00 0.00 N ATOM 2745 CA PHE B 64 15.899 24.869 -12.494 1.00 0.00 C ATOM 2746 C PHE B 64 17.089 25.041 -13.439 1.00 0.00 C ATOM 2747 O PHE B 64 18.158 24.518 -13.202 1.00 0.00 O ATOM 2748 CB PHE B 64 16.242 25.504 -11.137 1.00 0.00 C ATOM 2749 CG PHE B 64 15.065 25.375 -10.200 1.00 0.00 C ATOM 2750 CD1 PHE B 64 14.936 24.241 -9.393 1.00 0.00 C ATOM 2751 CD2 PHE B 64 14.104 26.392 -10.137 1.00 0.00 C ATOM 2752 CE1 PHE B 64 13.847 24.121 -8.523 1.00 0.00 C ATOM 2753 CE2 PHE B 64 13.014 26.273 -9.266 1.00 0.00 C ATOM 2754 CZ PHE B 64 12.886 25.138 -8.460 1.00 0.00 C ATOM 0 H PHE B 64 16.398 22.875 -11.903 1.00 0.00 H new ATOM 0 HA PHE B 64 15.024 25.348 -12.933 1.00 0.00 H new ATOM 0 HB2 PHE B 64 17.116 25.015 -10.707 1.00 0.00 H new ATOM 0 HB3 PHE B 64 16.498 26.555 -11.271 1.00 0.00 H new ATOM 0 HD1 PHE B 64 15.677 23.457 -9.441 1.00 0.00 H new ATOM 0 HD2 PHE B 64 14.204 27.268 -10.760 1.00 0.00 H new ATOM 0 HE1 PHE B 64 13.747 23.244 -7.900 1.00 0.00 H new ATOM 0 HE2 PHE B 64 12.273 27.057 -9.217 1.00 0.00 H new ATOM 0 HZ PHE B 64 12.045 25.045 -7.788 1.00 0.00 H new ATOM 2764 N GLU B 65 16.927 25.801 -14.496 1.00 0.00 N ATOM 2765 CA GLU B 65 18.068 26.004 -15.432 1.00 0.00 C ATOM 2766 C GLU B 65 19.302 26.322 -14.593 1.00 0.00 C ATOM 2767 O GLU B 65 20.417 25.993 -14.945 1.00 0.00 O ATOM 2768 CB GLU B 65 17.790 27.179 -16.371 1.00 0.00 C ATOM 2769 CG GLU B 65 18.876 27.227 -17.449 1.00 0.00 C ATOM 2770 CD GLU B 65 18.732 28.509 -18.271 1.00 0.00 C ATOM 2771 OE1 GLU B 65 18.739 29.575 -17.678 1.00 0.00 O ATOM 2772 OE2 GLU B 65 18.617 28.403 -19.482 1.00 0.00 O ATOM 0 H GLU B 65 16.063 26.283 -14.746 1.00 0.00 H new ATOM 0 HA GLU B 65 18.216 25.108 -16.034 1.00 0.00 H new ATOM 0 HB2 GLU B 65 16.808 27.068 -16.831 1.00 0.00 H new ATOM 0 HB3 GLU B 65 17.776 28.113 -15.810 1.00 0.00 H new ATOM 0 HG2 GLU B 65 19.862 27.189 -16.987 1.00 0.00 H new ATOM 0 HG3 GLU B 65 18.795 26.356 -18.099 1.00 0.00 H new ATOM 2779 N ASN B 66 19.088 26.948 -13.471 1.00 0.00 N ATOM 2780 CA ASN B 66 20.212 27.306 -12.571 1.00 0.00 C ATOM 2781 C ASN B 66 19.635 27.701 -11.208 1.00 0.00 C ATOM 2782 O ASN B 66 18.437 27.828 -11.047 1.00 0.00 O ATOM 2783 CB ASN B 66 20.987 28.478 -13.168 1.00 0.00 C ATOM 2784 CG ASN B 66 20.023 29.404 -13.909 1.00 0.00 C ATOM 2785 OD1 ASN B 66 18.829 29.345 -13.703 1.00 0.00 O ATOM 2786 ND2 ASN B 66 20.495 30.264 -14.770 1.00 0.00 N ATOM 0 H ASN B 66 18.167 27.230 -13.137 1.00 0.00 H new ATOM 0 HA ASN B 66 20.888 26.459 -12.455 1.00 0.00 H new ATOM 0 HB2 ASN B 66 21.501 29.027 -12.379 1.00 0.00 H new ATOM 0 HB3 ASN B 66 21.753 28.111 -13.851 1.00 0.00 H new ATOM 0 HD21 ASN B 66 19.860 30.886 -15.270 1.00 0.00 H new ATOM 0 HD22 ASN B 66 21.499 30.314 -14.943 1.00 0.00 H new ATOM 2793 N LYS B 67 20.471 27.869 -10.224 1.00 0.00 N ATOM 2794 CA LYS B 67 19.971 28.246 -8.869 1.00 0.00 C ATOM 2795 C LYS B 67 19.174 29.555 -8.911 1.00 0.00 C ATOM 2796 O LYS B 67 18.380 29.829 -8.032 1.00 0.00 O ATOM 2797 CB LYS B 67 21.166 28.413 -7.926 1.00 0.00 C ATOM 2798 CG LYS B 67 21.900 27.079 -7.790 1.00 0.00 C ATOM 2799 CD LYS B 67 22.898 27.156 -6.632 1.00 0.00 C ATOM 2800 CE LYS B 67 23.986 28.178 -6.961 1.00 0.00 C ATOM 2801 NZ LYS B 67 25.173 27.948 -6.086 1.00 0.00 N ATOM 0 H LYS B 67 21.483 27.762 -10.297 1.00 0.00 H new ATOM 0 HA LYS B 67 19.309 27.456 -8.514 1.00 0.00 H new ATOM 0 HB2 LYS B 67 21.843 29.175 -8.312 1.00 0.00 H new ATOM 0 HB3 LYS B 67 20.826 28.754 -6.948 1.00 0.00 H new ATOM 0 HG2 LYS B 67 21.185 26.276 -7.614 1.00 0.00 H new ATOM 0 HG3 LYS B 67 22.422 26.844 -8.718 1.00 0.00 H new ATOM 0 HD2 LYS B 67 22.384 27.440 -5.714 1.00 0.00 H new ATOM 0 HD3 LYS B 67 23.345 26.177 -6.458 1.00 0.00 H new ATOM 0 HE2 LYS B 67 24.273 28.093 -8.009 1.00 0.00 H new ATOM 0 HE3 LYS B 67 23.605 29.189 -6.815 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 25.911 28.645 -6.312 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 24.894 28.050 -5.089 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 25.542 26.989 -6.246 1.00 0.00 H new ATOM 2815 N ASP B 68 19.385 30.379 -9.903 1.00 0.00 N ATOM 2816 CA ASP B 68 18.640 31.675 -9.960 1.00 0.00 C ATOM 2817 C ASP B 68 17.127 31.431 -9.923 1.00 0.00 C ATOM 2818 O ASP B 68 16.395 32.151 -9.275 1.00 0.00 O ATOM 2819 CB ASP B 68 19.006 32.430 -11.241 1.00 0.00 C ATOM 2820 CG ASP B 68 18.393 33.831 -11.193 1.00 0.00 C ATOM 2821 OD1 ASP B 68 17.848 34.183 -10.158 1.00 0.00 O ATOM 2822 OD2 ASP B 68 18.476 34.531 -12.189 1.00 0.00 O ATOM 0 H ASP B 68 20.035 30.215 -10.672 1.00 0.00 H new ATOM 0 HA ASP B 68 18.920 32.272 -9.092 1.00 0.00 H new ATOM 0 HB2 ASP B 68 20.089 32.497 -11.340 1.00 0.00 H new ATOM 0 HB3 ASP B 68 18.639 31.889 -12.113 1.00 0.00 H new ATOM 2827 N GLY B 69 16.648 30.429 -10.606 1.00 0.00 N ATOM 2828 CA GLY B 69 15.185 30.151 -10.566 1.00 0.00 C ATOM 2829 C GLY B 69 14.824 29.589 -9.193 1.00 0.00 C ATOM 2830 O GLY B 69 13.770 29.861 -8.651 1.00 0.00 O ATOM 0 H GLY B 69 17.200 29.796 -11.185 1.00 0.00 H new ATOM 0 HA2 GLY B 69 14.623 31.065 -10.759 1.00 0.00 H new ATOM 0 HA3 GLY B 69 14.915 29.440 -11.347 1.00 0.00 H new ATOM 2834 N TYR B 70 15.699 28.803 -8.628 1.00 0.00 N ATOM 2835 CA TYR B 70 15.430 28.216 -7.285 1.00 0.00 C ATOM 2836 C TYR B 70 15.311 29.324 -6.228 1.00 0.00 C ATOM 2837 O TYR B 70 14.411 29.304 -5.413 1.00 0.00 O ATOM 2838 CB TYR B 70 16.564 27.259 -6.917 1.00 0.00 C ATOM 2839 CG TYR B 70 16.282 26.612 -5.581 1.00 0.00 C ATOM 2840 CD1 TYR B 70 15.512 25.446 -5.521 1.00 0.00 C ATOM 2841 CD2 TYR B 70 16.785 27.180 -4.404 1.00 0.00 C ATOM 2842 CE1 TYR B 70 15.240 24.848 -4.285 1.00 0.00 C ATOM 2843 CE2 TYR B 70 16.513 26.582 -3.166 1.00 0.00 C ATOM 2844 CZ TYR B 70 15.742 25.415 -3.108 1.00 0.00 C ATOM 2845 OH TYR B 70 15.473 24.824 -1.890 1.00 0.00 O ATOM 0 H TYR B 70 16.594 28.541 -9.042 1.00 0.00 H new ATOM 0 HA TYR B 70 14.487 27.670 -7.316 1.00 0.00 H new ATOM 0 HB2 TYR B 70 16.669 26.494 -7.686 1.00 0.00 H new ATOM 0 HB3 TYR B 70 17.509 27.801 -6.876 1.00 0.00 H new ATOM 0 HD1 TYR B 70 15.127 25.007 -6.429 1.00 0.00 H new ATOM 0 HD2 TYR B 70 17.382 28.079 -4.450 1.00 0.00 H new ATOM 0 HE1 TYR B 70 14.643 23.949 -4.240 1.00 0.00 H new ATOM 0 HE2 TYR B 70 16.898 27.021 -2.257 1.00 0.00 H new ATOM 0 HH TYR B 70 15.896 25.343 -1.174 1.00 0.00 H new ATOM 2855 N VAL B 71 16.187 30.298 -6.223 1.00 0.00 N ATOM 2856 CA VAL B 71 16.049 31.379 -5.200 1.00 0.00 C ATOM 2857 C VAL B 71 14.827 32.231 -5.549 1.00 0.00 C ATOM 2858 O VAL B 71 14.179 32.789 -4.688 1.00 0.00 O ATOM 2859 CB VAL B 71 17.305 32.261 -5.153 1.00 0.00 C ATOM 2860 CG1 VAL B 71 18.547 31.410 -4.876 1.00 0.00 C ATOM 2861 CG2 VAL B 71 17.472 32.965 -6.504 1.00 0.00 C ATOM 0 H VAL B 71 16.973 30.391 -6.866 1.00 0.00 H new ATOM 0 HA VAL B 71 15.925 30.924 -4.217 1.00 0.00 H new ATOM 0 HB VAL B 71 17.193 32.994 -4.354 1.00 0.00 H new ATOM 0 HG11 VAL B 71 19.428 32.051 -4.846 1.00 0.00 H new ATOM 0 HG12 VAL B 71 18.434 30.903 -3.918 1.00 0.00 H new ATOM 0 HG13 VAL B 71 18.664 30.669 -5.667 1.00 0.00 H new ATOM 0 HG21 VAL B 71 18.362 33.594 -6.479 1.00 0.00 H new ATOM 0 HG22 VAL B 71 17.576 32.219 -7.292 1.00 0.00 H new ATOM 0 HG23 VAL B 71 16.597 33.583 -6.703 1.00 0.00 H new ATOM 2871 N ALA B 72 14.497 32.315 -6.808 1.00 0.00 N ATOM 2872 CA ALA B 72 13.323 33.133 -7.217 1.00 0.00 C ATOM 2873 C ALA B 72 12.047 32.510 -6.642 1.00 0.00 C ATOM 2874 O ALA B 72 11.326 33.133 -5.887 1.00 0.00 O ATOM 2875 CB ALA B 72 13.225 33.143 -8.744 1.00 0.00 C ATOM 0 H ALA B 72 14.990 31.852 -7.571 1.00 0.00 H new ATOM 0 HA ALA B 72 13.439 34.151 -6.844 1.00 0.00 H new ATOM 0 HB1 ALA B 72 12.366 33.741 -9.050 1.00 0.00 H new ATOM 0 HB2 ALA B 72 14.134 33.573 -9.164 1.00 0.00 H new ATOM 0 HB3 ALA B 72 13.104 32.123 -9.108 1.00 0.00 H new ATOM 2881 N PHE B 73 11.750 31.293 -7.011 1.00 0.00 N ATOM 2882 CA PHE B 73 10.491 30.646 -6.536 1.00 0.00 C ATOM 2883 C PHE B 73 10.424 30.625 -4.997 1.00 0.00 C ATOM 2884 O PHE B 73 9.386 30.873 -4.416 1.00 0.00 O ATOM 2885 CB PHE B 73 10.438 29.211 -7.070 1.00 0.00 C ATOM 2886 CG PHE B 73 10.454 28.240 -5.910 1.00 0.00 C ATOM 2887 CD1 PHE B 73 9.257 27.891 -5.271 1.00 0.00 C ATOM 2888 CD2 PHE B 73 11.664 27.686 -5.474 1.00 0.00 C ATOM 2889 CE1 PHE B 73 9.271 26.992 -4.197 1.00 0.00 C ATOM 2890 CE2 PHE B 73 11.678 26.788 -4.400 1.00 0.00 C ATOM 2891 CZ PHE B 73 10.481 26.439 -3.762 1.00 0.00 C ATOM 0 H PHE B 73 12.327 30.716 -7.623 1.00 0.00 H new ATOM 0 HA PHE B 73 9.641 31.220 -6.905 1.00 0.00 H new ATOM 0 HB2 PHE B 73 9.537 29.067 -7.666 1.00 0.00 H new ATOM 0 HB3 PHE B 73 11.288 29.024 -7.726 1.00 0.00 H new ATOM 0 HD1 PHE B 73 8.323 28.316 -5.607 1.00 0.00 H new ATOM 0 HD2 PHE B 73 12.587 27.952 -5.967 1.00 0.00 H new ATOM 0 HE1 PHE B 73 8.348 26.725 -3.704 1.00 0.00 H new ATOM 0 HE2 PHE B 73 12.612 26.364 -4.063 1.00 0.00 H new ATOM 0 HZ PHE B 73 10.492 25.744 -2.935 1.00 0.00 H new ATOM 2901 N THR B 74 11.505 30.317 -4.332 1.00 0.00 N ATOM 2902 CA THR B 74 11.457 30.234 -2.840 1.00 0.00 C ATOM 2903 C THR B 74 11.437 31.638 -2.228 1.00 0.00 C ATOM 2904 O THR B 74 10.854 31.861 -1.184 1.00 0.00 O ATOM 2905 CB THR B 74 12.692 29.485 -2.323 1.00 0.00 C ATOM 2906 OG1 THR B 74 12.628 29.389 -0.907 1.00 0.00 O ATOM 2907 CG2 THR B 74 13.962 30.232 -2.730 1.00 0.00 C ATOM 0 H THR B 74 12.414 30.120 -4.752 1.00 0.00 H new ATOM 0 HA THR B 74 10.550 29.702 -2.552 1.00 0.00 H new ATOM 0 HB THR B 74 12.713 28.485 -2.756 1.00 0.00 H new ATOM 0 HG1 THR B 74 13.416 28.909 -0.576 1.00 0.00 H new ATOM 0 HG21 THR B 74 14.835 29.694 -2.360 1.00 0.00 H new ATOM 0 HG22 THR B 74 14.012 30.300 -3.817 1.00 0.00 H new ATOM 0 HG23 THR B 74 13.946 31.235 -2.304 1.00 0.00 H new ATOM 2915 N SER B 75 12.089 32.583 -2.851 1.00 0.00 N ATOM 2916 CA SER B 75 12.125 33.964 -2.286 1.00 0.00 C ATOM 2917 C SER B 75 10.717 34.576 -2.244 1.00 0.00 C ATOM 2918 O SER B 75 10.404 35.356 -1.369 1.00 0.00 O ATOM 2919 CB SER B 75 13.030 34.835 -3.155 1.00 0.00 C ATOM 2920 OG SER B 75 14.374 34.388 -3.027 1.00 0.00 O ATOM 0 H SER B 75 12.598 32.459 -3.726 1.00 0.00 H new ATOM 0 HA SER B 75 12.511 33.916 -1.268 1.00 0.00 H new ATOM 0 HB2 SER B 75 12.714 34.782 -4.197 1.00 0.00 H new ATOM 0 HB3 SER B 75 12.951 35.879 -2.851 1.00 0.00 H new ATOM 0 HG SER B 75 14.656 33.957 -3.861 1.00 0.00 H new ATOM 2926 N HIS B 76 9.866 34.239 -3.176 1.00 0.00 N ATOM 2927 CA HIS B 76 8.484 34.810 -3.160 1.00 0.00 C ATOM 2928 C HIS B 76 7.678 34.174 -2.017 1.00 0.00 C ATOM 2929 O HIS B 76 7.921 33.051 -1.632 1.00 0.00 O ATOM 2930 CB HIS B 76 7.793 34.507 -4.492 1.00 0.00 C ATOM 2931 CG HIS B 76 8.283 35.458 -5.548 1.00 0.00 C ATOM 2932 ND1 HIS B 76 9.417 35.200 -6.307 1.00 0.00 N ATOM 2933 CD2 HIS B 76 7.804 36.669 -5.989 1.00 0.00 C ATOM 2934 CE1 HIS B 76 9.583 36.233 -7.155 1.00 0.00 C ATOM 2935 NE2 HIS B 76 8.628 37.151 -7.001 1.00 0.00 N ATOM 0 H HIS B 76 10.064 33.597 -3.944 1.00 0.00 H new ATOM 0 HA HIS B 76 8.540 35.888 -3.011 1.00 0.00 H new ATOM 0 HB2 HIS B 76 7.997 33.479 -4.792 1.00 0.00 H new ATOM 0 HB3 HIS B 76 6.713 34.598 -4.381 1.00 0.00 H new ATOM 0 HD1 HIS B 76 10.016 34.377 -6.235 1.00 0.00 H new ATOM 0 HD2 HIS B 76 6.925 37.168 -5.609 1.00 0.00 H new ATOM 0 HE1 HIS B 76 10.389 36.309 -7.870 1.00 0.00 H new ATOM 2944 N PRO B 77 6.717 34.885 -1.482 1.00 0.00 N ATOM 2945 CA PRO B 77 5.853 34.372 -0.373 1.00 0.00 C ATOM 2946 C PRO B 77 4.900 33.257 -0.839 1.00 0.00 C ATOM 2947 O PRO B 77 4.074 32.783 -0.087 1.00 0.00 O ATOM 2948 CB PRO B 77 5.068 35.618 0.045 1.00 0.00 C ATOM 2949 CG PRO B 77 5.017 36.461 -1.185 1.00 0.00 C ATOM 2950 CD PRO B 77 6.358 36.259 -1.902 1.00 0.00 C ATOM 0 HA PRO B 77 6.432 33.920 0.432 1.00 0.00 H new ATOM 0 HB2 PRO B 77 4.067 35.359 0.390 1.00 0.00 H new ATOM 0 HB3 PRO B 77 5.562 36.141 0.864 1.00 0.00 H new ATOM 0 HG2 PRO B 77 4.186 36.165 -1.825 1.00 0.00 H new ATOM 0 HG3 PRO B 77 4.866 37.510 -0.931 1.00 0.00 H new ATOM 0 HD2 PRO B 77 6.261 36.344 -2.984 1.00 0.00 H new ATOM 0 HD3 PRO B 77 7.103 36.991 -1.590 1.00 0.00 H new ATOM 2958 N LEU B 78 5.008 32.848 -2.078 1.00 0.00 N ATOM 2959 CA LEU B 78 4.115 31.769 -2.613 1.00 0.00 C ATOM 2960 C LEU B 78 4.556 30.385 -2.116 1.00 0.00 C ATOM 2961 O LEU B 78 3.757 29.475 -2.005 1.00 0.00 O ATOM 2962 CB LEU B 78 4.189 31.788 -4.139 1.00 0.00 C ATOM 2963 CG LEU B 78 3.147 30.839 -4.735 1.00 0.00 C ATOM 2964 CD1 LEU B 78 1.752 31.409 -4.488 1.00 0.00 C ATOM 2965 CD2 LEU B 78 3.378 30.706 -6.244 1.00 0.00 C ATOM 0 H LEU B 78 5.682 33.217 -2.749 1.00 0.00 H new ATOM 0 HA LEU B 78 3.098 31.954 -2.266 1.00 0.00 H new ATOM 0 HB2 LEU B 78 4.020 32.801 -4.505 1.00 0.00 H new ATOM 0 HB3 LEU B 78 5.187 31.494 -4.465 1.00 0.00 H new ATOM 0 HG LEU B 78 3.235 29.859 -4.266 1.00 0.00 H new ATOM 0 HD11 LEU B 78 1.005 30.737 -4.910 1.00 0.00 H new ATOM 0 HD12 LEU B 78 1.585 31.510 -3.416 1.00 0.00 H new ATOM 0 HD13 LEU B 78 1.670 32.387 -4.962 1.00 0.00 H new ATOM 0 HD21 LEU B 78 2.635 30.030 -6.668 1.00 0.00 H new ATOM 0 HD22 LEU B 78 3.287 31.685 -6.714 1.00 0.00 H new ATOM 0 HD23 LEU B 78 4.376 30.308 -6.426 1.00 0.00 H new ATOM 2977 N HIS B 79 5.821 30.206 -1.850 1.00 0.00 N ATOM 2978 CA HIS B 79 6.307 28.862 -1.413 1.00 0.00 C ATOM 2979 C HIS B 79 6.045 28.664 0.078 1.00 0.00 C ATOM 2980 O HIS B 79 5.646 27.601 0.517 1.00 0.00 O ATOM 2981 CB HIS B 79 7.809 28.755 -1.673 1.00 0.00 C ATOM 2982 CG HIS B 79 8.314 27.433 -1.164 1.00 0.00 C ATOM 2983 ND1 HIS B 79 9.514 27.314 -0.475 1.00 0.00 N ATOM 2984 CD2 HIS B 79 7.793 26.164 -1.231 1.00 0.00 C ATOM 2985 CE1 HIS B 79 9.672 26.017 -0.159 1.00 0.00 C ATOM 2986 NE2 HIS B 79 8.652 25.276 -0.596 1.00 0.00 N ATOM 0 H HIS B 79 6.538 30.928 -1.915 1.00 0.00 H new ATOM 0 HA HIS B 79 5.774 28.096 -1.976 1.00 0.00 H new ATOM 0 HB2 HIS B 79 8.011 28.847 -2.740 1.00 0.00 H new ATOM 0 HB3 HIS B 79 8.334 29.572 -1.177 1.00 0.00 H new ATOM 0 HD2 HIS B 79 6.860 25.898 -1.704 1.00 0.00 H new ATOM 0 HE1 HIS B 79 10.520 25.623 0.382 1.00 0.00 H new ATOM 0 HE2 HIS B 79 8.529 24.269 -0.487 1.00 0.00 H new ATOM 2995 N VAL B 80 6.275 29.673 0.865 1.00 0.00 N ATOM 2996 CA VAL B 80 6.075 29.540 2.332 1.00 0.00 C ATOM 2997 C VAL B 80 4.602 29.261 2.636 1.00 0.00 C ATOM 2998 O VAL B 80 4.260 28.257 3.228 1.00 0.00 O ATOM 2999 CB VAL B 80 6.500 30.839 3.009 1.00 0.00 C ATOM 3000 CG1 VAL B 80 5.714 32.006 2.412 1.00 0.00 C ATOM 3001 CG2 VAL B 80 6.217 30.738 4.509 1.00 0.00 C ATOM 0 H VAL B 80 6.595 30.590 0.554 1.00 0.00 H new ATOM 0 HA VAL B 80 6.675 28.711 2.708 1.00 0.00 H new ATOM 0 HB VAL B 80 7.565 31.007 2.850 1.00 0.00 H new ATOM 0 HG11 VAL B 80 6.018 32.934 2.896 1.00 0.00 H new ATOM 0 HG12 VAL B 80 5.915 32.071 1.343 1.00 0.00 H new ATOM 0 HG13 VAL B 80 4.648 31.846 2.571 1.00 0.00 H new ATOM 0 HG21 VAL B 80 6.519 31.664 4.999 1.00 0.00 H new ATOM 0 HG22 VAL B 80 5.151 30.574 4.668 1.00 0.00 H new ATOM 0 HG23 VAL B 80 6.779 29.905 4.930 1.00 0.00 H new ATOM 3011 N GLU B 81 3.730 30.145 2.242 1.00 0.00 N ATOM 3012 CA GLU B 81 2.281 29.926 2.502 1.00 0.00 C ATOM 3013 C GLU B 81 1.837 28.611 1.860 1.00 0.00 C ATOM 3014 O GLU B 81 1.060 27.865 2.423 1.00 0.00 O ATOM 3015 CB GLU B 81 1.477 31.080 1.900 1.00 0.00 C ATOM 3016 CG GLU B 81 0.016 30.966 2.337 1.00 0.00 C ATOM 3017 CD GLU B 81 -0.090 31.240 3.838 1.00 0.00 C ATOM 3018 OE1 GLU B 81 0.791 31.896 4.365 1.00 0.00 O ATOM 3019 OE2 GLU B 81 -1.054 30.787 4.433 1.00 0.00 O ATOM 0 H GLU B 81 3.958 31.010 1.751 1.00 0.00 H new ATOM 0 HA GLU B 81 2.109 29.881 3.577 1.00 0.00 H new ATOM 0 HB2 GLU B 81 1.891 32.034 2.225 1.00 0.00 H new ATOM 0 HB3 GLU B 81 1.545 31.056 0.812 1.00 0.00 H new ATOM 0 HG2 GLU B 81 -0.597 31.677 1.783 1.00 0.00 H new ATOM 0 HG3 GLU B 81 -0.366 29.971 2.110 1.00 0.00 H new ATOM 3026 N PHE B 82 2.325 28.320 0.686 1.00 0.00 N ATOM 3027 CA PHE B 82 1.931 27.052 0.011 1.00 0.00 C ATOM 3028 C PHE B 82 2.532 25.858 0.755 1.00 0.00 C ATOM 3029 O PHE B 82 1.879 24.856 0.973 1.00 0.00 O ATOM 3030 CB PHE B 82 2.441 27.064 -1.431 1.00 0.00 C ATOM 3031 CG PHE B 82 2.019 25.790 -2.125 1.00 0.00 C ATOM 3032 CD1 PHE B 82 0.725 25.671 -2.644 1.00 0.00 C ATOM 3033 CD2 PHE B 82 2.924 24.727 -2.244 1.00 0.00 C ATOM 3034 CE1 PHE B 82 0.336 24.489 -3.286 1.00 0.00 C ATOM 3035 CE2 PHE B 82 2.533 23.545 -2.887 1.00 0.00 C ATOM 3036 CZ PHE B 82 1.239 23.426 -3.407 1.00 0.00 C ATOM 0 H PHE B 82 2.979 28.905 0.165 1.00 0.00 H new ATOM 0 HA PHE B 82 0.844 26.966 0.015 1.00 0.00 H new ATOM 0 HB2 PHE B 82 2.043 27.929 -1.962 1.00 0.00 H new ATOM 0 HB3 PHE B 82 3.527 27.155 -1.443 1.00 0.00 H new ATOM 0 HD1 PHE B 82 0.027 26.490 -2.550 1.00 0.00 H new ATOM 0 HD2 PHE B 82 3.922 24.819 -1.841 1.00 0.00 H new ATOM 0 HE1 PHE B 82 -0.662 24.397 -3.688 1.00 0.00 H new ATOM 0 HE2 PHE B 82 3.230 22.726 -2.981 1.00 0.00 H new ATOM 0 HZ PHE B 82 0.937 22.514 -3.901 1.00 0.00 H new ATOM 3046 N SER B 83 3.779 25.948 1.142 1.00 0.00 N ATOM 3047 CA SER B 83 4.424 24.807 1.853 1.00 0.00 C ATOM 3048 C SER B 83 3.656 24.484 3.137 1.00 0.00 C ATOM 3049 O SER B 83 3.521 23.336 3.512 1.00 0.00 O ATOM 3050 CB SER B 83 5.866 25.167 2.199 1.00 0.00 C ATOM 3051 OG SER B 83 6.573 25.479 1.008 1.00 0.00 O ATOM 0 H SER B 83 4.376 26.762 0.996 1.00 0.00 H new ATOM 0 HA SER B 83 4.412 23.933 1.202 1.00 0.00 H new ATOM 0 HB2 SER B 83 5.887 26.017 2.881 1.00 0.00 H new ATOM 0 HB3 SER B 83 6.347 24.335 2.713 1.00 0.00 H new ATOM 0 HG SER B 83 7.370 24.913 0.943 1.00 0.00 H new ATOM 3057 N ALA B 84 3.146 25.477 3.815 1.00 0.00 N ATOM 3058 CA ALA B 84 2.398 25.199 5.074 1.00 0.00 C ATOM 3059 C ALA B 84 1.220 24.284 4.750 1.00 0.00 C ATOM 3060 O ALA B 84 1.047 23.238 5.343 1.00 0.00 O ATOM 3061 CB ALA B 84 1.875 26.503 5.670 1.00 0.00 C ATOM 0 H ALA B 84 3.214 26.461 3.554 1.00 0.00 H new ATOM 0 HA ALA B 84 3.061 24.721 5.795 1.00 0.00 H new ATOM 0 HB1 ALA B 84 1.330 26.290 6.590 1.00 0.00 H new ATOM 0 HB2 ALA B 84 2.713 27.164 5.890 1.00 0.00 H new ATOM 0 HB3 ALA B 84 1.208 26.987 4.957 1.00 0.00 H new ATOM 3067 N ALA B 85 0.419 24.669 3.798 1.00 0.00 N ATOM 3068 CA ALA B 85 -0.742 23.826 3.420 1.00 0.00 C ATOM 3069 C ALA B 85 -0.227 22.565 2.729 1.00 0.00 C ATOM 3070 O ALA B 85 -0.692 21.472 2.982 1.00 0.00 O ATOM 3071 CB ALA B 85 -1.648 24.597 2.464 1.00 0.00 C ATOM 0 H ALA B 85 0.520 25.533 3.266 1.00 0.00 H new ATOM 0 HA ALA B 85 -1.311 23.558 4.311 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -2.500 23.975 2.188 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -2.004 25.504 2.952 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -1.088 24.863 1.567 1.00 0.00 H new ATOM 3077 N PHE B 86 0.750 22.702 1.870 1.00 0.00 N ATOM 3078 CA PHE B 86 1.293 21.498 1.187 1.00 0.00 C ATOM 3079 C PHE B 86 1.431 20.386 2.220 1.00 0.00 C ATOM 3080 O PHE B 86 1.286 19.220 1.915 1.00 0.00 O ATOM 3081 CB PHE B 86 2.664 21.807 0.582 1.00 0.00 C ATOM 3082 CG PHE B 86 2.968 20.813 -0.516 1.00 0.00 C ATOM 3083 CD1 PHE B 86 2.156 20.754 -1.654 1.00 0.00 C ATOM 3084 CD2 PHE B 86 4.066 19.950 -0.393 1.00 0.00 C ATOM 3085 CE1 PHE B 86 2.437 19.834 -2.669 1.00 0.00 C ATOM 3086 CE2 PHE B 86 4.348 19.032 -1.412 1.00 0.00 C ATOM 3087 CZ PHE B 86 3.535 18.974 -2.548 1.00 0.00 C ATOM 0 H PHE B 86 1.189 23.587 1.616 1.00 0.00 H new ATOM 0 HA PHE B 86 0.621 21.193 0.385 1.00 0.00 H new ATOM 0 HB2 PHE B 86 2.676 22.821 0.182 1.00 0.00 H new ATOM 0 HB3 PHE B 86 3.433 21.759 1.353 1.00 0.00 H new ATOM 0 HD1 PHE B 86 1.311 21.420 -1.749 1.00 0.00 H new ATOM 0 HD2 PHE B 86 4.693 19.993 0.485 1.00 0.00 H new ATOM 0 HE1 PHE B 86 1.808 19.787 -3.545 1.00 0.00 H new ATOM 0 HE2 PHE B 86 5.195 18.368 -1.320 1.00 0.00 H new ATOM 0 HZ PHE B 86 3.754 18.265 -3.333 1.00 0.00 H new ATOM 3097 N THR B 87 1.685 20.738 3.453 1.00 0.00 N ATOM 3098 CA THR B 87 1.806 19.691 4.499 1.00 0.00 C ATOM 3099 C THR B 87 0.401 19.342 4.974 1.00 0.00 C ATOM 3100 O THR B 87 -0.055 18.225 4.850 1.00 0.00 O ATOM 3101 CB THR B 87 2.616 20.224 5.680 1.00 0.00 C ATOM 3102 OG1 THR B 87 3.781 20.876 5.196 1.00 0.00 O ATOM 3103 CG2 THR B 87 3.025 19.069 6.595 1.00 0.00 C ATOM 0 H THR B 87 1.812 21.697 3.775 1.00 0.00 H new ATOM 0 HA THR B 87 2.310 18.813 4.094 1.00 0.00 H new ATOM 0 HB THR B 87 2.006 20.930 6.244 1.00 0.00 H new ATOM 0 HG1 THR B 87 3.532 21.732 4.789 1.00 0.00 H new ATOM 0 HG21 THR B 87 3.602 19.457 7.435 1.00 0.00 H new ATOM 0 HG22 THR B 87 2.132 18.567 6.969 1.00 0.00 H new ATOM 0 HG23 THR B 87 3.632 18.358 6.035 1.00 0.00 H new ATOM 3111 N ALA B 88 -0.292 20.310 5.507 1.00 0.00 N ATOM 3112 CA ALA B 88 -1.681 20.067 5.985 1.00 0.00 C ATOM 3113 C ALA B 88 -2.418 19.148 5.010 1.00 0.00 C ATOM 3114 O ALA B 88 -3.371 18.488 5.368 1.00 0.00 O ATOM 3115 CB ALA B 88 -2.428 21.397 6.054 1.00 0.00 C ATOM 0 H ALA B 88 0.047 21.264 5.632 1.00 0.00 H new ATOM 0 HA ALA B 88 -1.640 19.600 6.969 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -3.446 21.225 6.404 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -1.916 22.067 6.745 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -2.456 21.850 5.063 1.00 0.00 H new ATOM 3121 N VAL B 89 -1.997 19.115 3.775 1.00 0.00 N ATOM 3122 CA VAL B 89 -2.692 18.258 2.776 1.00 0.00 C ATOM 3123 C VAL B 89 -1.853 17.011 2.449 1.00 0.00 C ATOM 3124 O VAL B 89 -2.144 16.301 1.504 1.00 0.00 O ATOM 3125 CB VAL B 89 -2.924 19.075 1.503 1.00 0.00 C ATOM 3126 CG1 VAL B 89 -3.596 20.399 1.873 1.00 0.00 C ATOM 3127 CG2 VAL B 89 -1.583 19.366 0.823 1.00 0.00 C ATOM 0 H VAL B 89 -1.202 19.644 3.416 1.00 0.00 H new ATOM 0 HA VAL B 89 -3.645 17.927 3.189 1.00 0.00 H new ATOM 0 HB VAL B 89 -3.561 18.511 0.821 1.00 0.00 H new ATOM 0 HG11 VAL B 89 -3.764 20.986 0.970 1.00 0.00 H new ATOM 0 HG12 VAL B 89 -4.551 20.199 2.359 1.00 0.00 H new ATOM 0 HG13 VAL B 89 -2.952 20.956 2.554 1.00 0.00 H new ATOM 0 HG21 VAL B 89 -1.753 19.948 -0.083 1.00 0.00 H new ATOM 0 HG22 VAL B 89 -0.945 19.931 1.503 1.00 0.00 H new ATOM 0 HG23 VAL B 89 -1.095 18.426 0.564 1.00 0.00 H new ATOM 3137 N ILE B 90 -0.826 16.727 3.206 1.00 0.00 N ATOM 3138 CA ILE B 90 -0.012 15.516 2.905 1.00 0.00 C ATOM 3139 C ILE B 90 0.068 14.608 4.133 1.00 0.00 C ATOM 3140 O ILE B 90 -0.112 15.035 5.256 1.00 0.00 O ATOM 3141 CB ILE B 90 1.403 15.930 2.489 1.00 0.00 C ATOM 3142 CG1 ILE B 90 1.369 16.482 1.061 1.00 0.00 C ATOM 3143 CG2 ILE B 90 2.320 14.704 2.542 1.00 0.00 C ATOM 3144 CD1 ILE B 90 2.740 17.052 0.699 1.00 0.00 C ATOM 0 H ILE B 90 -0.519 17.275 4.010 1.00 0.00 H new ATOM 0 HA ILE B 90 -0.489 14.972 2.090 1.00 0.00 H new ATOM 0 HB ILE B 90 1.778 16.697 3.166 1.00 0.00 H new ATOM 0 HG12 ILE B 90 1.096 15.692 0.361 1.00 0.00 H new ATOM 0 HG13 ILE B 90 0.608 17.258 0.978 1.00 0.00 H new ATOM 0 HG21 ILE B 90 3.329 14.991 2.247 1.00 0.00 H new ATOM 0 HG22 ILE B 90 2.338 14.307 3.557 1.00 0.00 H new ATOM 0 HG23 ILE B 90 1.946 13.940 1.860 1.00 0.00 H new ATOM 0 HD11 ILE B 90 2.714 17.444 -0.318 1.00 0.00 H new ATOM 0 HD12 ILE B 90 2.995 17.854 1.391 1.00 0.00 H new ATOM 0 HD13 ILE B 90 3.490 16.264 0.765 1.00 0.00 H new ATOM 3156 N ASP B 91 0.365 13.356 3.905 1.00 0.00 N ATOM 3157 CA ASP B 91 0.471 12.368 5.017 1.00 0.00 C ATOM 3158 C ASP B 91 1.954 12.168 5.351 1.00 0.00 C ATOM 3159 O ASP B 91 2.334 11.977 6.489 1.00 0.00 O ATOM 3160 CB ASP B 91 -0.104 11.039 4.530 1.00 0.00 C ATOM 3161 CG ASP B 91 0.052 9.963 5.604 1.00 0.00 C ATOM 3162 OD1 ASP B 91 0.630 10.251 6.636 1.00 0.00 O ATOM 3163 OD2 ASP B 91 -0.418 8.857 5.371 1.00 0.00 O ATOM 0 H ASP B 91 0.542 12.970 2.977 1.00 0.00 H new ATOM 0 HA ASP B 91 -0.069 12.719 5.896 1.00 0.00 H new ATOM 0 HB2 ASP B 91 -1.158 11.162 4.280 1.00 0.00 H new ATOM 0 HB3 ASP B 91 0.406 10.728 3.618 1.00 0.00 H new ATOM 3168 N LYS B 92 2.784 12.231 4.344 1.00 0.00 N ATOM 3169 CA LYS B 92 4.250 12.052 4.534 1.00 0.00 C ATOM 3170 C LYS B 92 4.992 12.897 3.486 1.00 0.00 C ATOM 3171 O LYS B 92 4.505 13.094 2.392 1.00 0.00 O ATOM 3172 CB LYS B 92 4.590 10.574 4.322 1.00 0.00 C ATOM 3173 CG LYS B 92 4.633 10.270 2.818 1.00 0.00 C ATOM 3174 CD LYS B 92 4.752 8.754 2.590 1.00 0.00 C ATOM 3175 CE LYS B 92 5.231 8.484 1.156 1.00 0.00 C ATOM 3176 NZ LYS B 92 5.558 7.036 0.997 1.00 0.00 N ATOM 0 H LYS B 92 2.500 12.402 3.379 1.00 0.00 H new ATOM 0 HA LYS B 92 4.546 12.364 5.536 1.00 0.00 H new ATOM 0 HB2 LYS B 92 5.552 10.342 4.779 1.00 0.00 H new ATOM 0 HB3 LYS B 92 3.846 9.945 4.810 1.00 0.00 H new ATOM 0 HG2 LYS B 92 3.731 10.649 2.336 1.00 0.00 H new ATOM 0 HG3 LYS B 92 5.479 10.782 2.359 1.00 0.00 H new ATOM 0 HD2 LYS B 92 5.452 8.322 3.305 1.00 0.00 H new ATOM 0 HD3 LYS B 92 3.788 8.274 2.758 1.00 0.00 H new ATOM 0 HE2 LYS B 92 4.458 8.772 0.444 1.00 0.00 H new ATOM 0 HE3 LYS B 92 6.109 9.091 0.936 1.00 0.00 H new ATOM 0 HZ1 LYS B 92 5.567 6.791 -0.014 1.00 0.00 H new ATOM 0 HZ2 LYS B 92 6.494 6.844 1.408 1.00 0.00 H new ATOM 0 HZ3 LYS B 92 4.841 6.463 1.485 1.00 0.00 H new ATOM 3190 N ILE B 93 6.156 13.415 3.802 1.00 0.00 N ATOM 3191 CA ILE B 93 6.877 14.263 2.802 1.00 0.00 C ATOM 3192 C ILE B 93 8.318 13.764 2.642 1.00 0.00 C ATOM 3193 O ILE B 93 9.026 13.539 3.606 1.00 0.00 O ATOM 3194 CB ILE B 93 6.868 15.740 3.242 1.00 0.00 C ATOM 3195 CG1 ILE B 93 7.367 16.622 2.088 1.00 0.00 C ATOM 3196 CG2 ILE B 93 7.780 15.940 4.453 1.00 0.00 C ATOM 3197 CD1 ILE B 93 6.190 17.031 1.197 1.00 0.00 C ATOM 0 H ILE B 93 6.631 13.289 4.696 1.00 0.00 H new ATOM 0 HA ILE B 93 6.366 14.188 1.842 1.00 0.00 H new ATOM 0 HB ILE B 93 5.849 16.018 3.511 1.00 0.00 H new ATOM 0 HG12 ILE B 93 7.860 17.510 2.484 1.00 0.00 H new ATOM 0 HG13 ILE B 93 8.109 16.081 1.500 1.00 0.00 H new ATOM 0 HG21 ILE B 93 7.763 16.988 4.752 1.00 0.00 H new ATOM 0 HG22 ILE B 93 7.429 15.321 5.279 1.00 0.00 H new ATOM 0 HG23 ILE B 93 8.799 15.653 4.192 1.00 0.00 H new ATOM 0 HD11 ILE B 93 6.552 17.656 0.381 1.00 0.00 H new ATOM 0 HD12 ILE B 93 5.716 16.139 0.788 1.00 0.00 H new ATOM 0 HD13 ILE B 93 5.464 17.589 1.787 1.00 0.00 H new ATOM 3209 N VAL B 94 8.750 13.591 1.417 1.00 0.00 N ATOM 3210 CA VAL B 94 10.157 13.146 1.145 1.00 0.00 C ATOM 3211 C VAL B 94 10.717 13.978 -0.021 1.00 0.00 C ATOM 3212 O VAL B 94 10.017 14.244 -0.976 1.00 0.00 O ATOM 3213 CB VAL B 94 10.138 11.665 0.736 1.00 0.00 C ATOM 3214 CG1 VAL B 94 10.035 10.779 1.974 1.00 0.00 C ATOM 3215 CG2 VAL B 94 8.943 11.392 -0.183 1.00 0.00 C ATOM 0 H VAL B 94 8.183 13.740 0.583 1.00 0.00 H new ATOM 0 HA VAL B 94 10.774 13.279 2.033 1.00 0.00 H new ATOM 0 HB VAL B 94 11.063 11.438 0.207 1.00 0.00 H new ATOM 0 HG11 VAL B 94 10.022 9.732 1.672 1.00 0.00 H new ATOM 0 HG12 VAL B 94 10.892 10.959 2.623 1.00 0.00 H new ATOM 0 HG13 VAL B 94 9.117 11.012 2.513 1.00 0.00 H new ATOM 0 HG21 VAL B 94 8.936 10.340 -0.469 1.00 0.00 H new ATOM 0 HG22 VAL B 94 8.018 11.631 0.342 1.00 0.00 H new ATOM 0 HG23 VAL B 94 9.023 12.010 -1.077 1.00 0.00 H new ATOM 3225 N LEU B 95 11.960 14.402 0.028 1.00 0.00 N ATOM 3226 CA LEU B 95 12.488 15.226 -1.110 1.00 0.00 C ATOM 3227 C LEU B 95 13.931 14.842 -1.470 1.00 0.00 C ATOM 3228 O LEU B 95 14.787 14.703 -0.617 1.00 0.00 O ATOM 3229 CB LEU B 95 12.466 16.709 -0.743 1.00 0.00 C ATOM 3230 CG LEU B 95 11.300 17.006 0.200 1.00 0.00 C ATOM 3231 CD1 LEU B 95 11.742 16.771 1.645 1.00 0.00 C ATOM 3232 CD2 LEU B 95 10.878 18.468 0.028 1.00 0.00 C ATOM 0 H LEU B 95 12.618 14.220 0.786 1.00 0.00 H new ATOM 0 HA LEU B 95 11.844 15.033 -1.968 1.00 0.00 H new ATOM 0 HB2 LEU B 95 13.407 16.987 -0.268 1.00 0.00 H new ATOM 0 HB3 LEU B 95 12.375 17.313 -1.646 1.00 0.00 H new ATOM 0 HG LEU B 95 10.461 16.350 -0.033 1.00 0.00 H new ATOM 0 HD11 LEU B 95 10.911 16.982 2.318 1.00 0.00 H new ATOM 0 HD12 LEU B 95 12.052 15.733 1.766 1.00 0.00 H new ATOM 0 HD13 LEU B 95 12.578 17.430 1.882 1.00 0.00 H new ATOM 0 HD21 LEU B 95 10.046 18.688 0.697 1.00 0.00 H new ATOM 0 HD22 LEU B 95 11.718 19.120 0.267 1.00 0.00 H new ATOM 0 HD23 LEU B 95 10.568 18.638 -1.003 1.00 0.00 H new ATOM 3244 N LEU B 96 14.201 14.707 -2.747 1.00 0.00 N ATOM 3245 CA LEU B 96 15.581 14.373 -3.208 1.00 0.00 C ATOM 3246 C LEU B 96 16.116 15.517 -4.079 1.00 0.00 C ATOM 3247 O LEU B 96 15.518 15.877 -5.072 1.00 0.00 O ATOM 3248 CB LEU B 96 15.558 13.100 -4.063 1.00 0.00 C ATOM 3249 CG LEU B 96 14.573 12.081 -3.492 1.00 0.00 C ATOM 3250 CD1 LEU B 96 13.140 12.534 -3.775 1.00 0.00 C ATOM 3251 CD2 LEU B 96 14.816 10.730 -4.170 1.00 0.00 C ATOM 0 H LEU B 96 13.515 14.816 -3.494 1.00 0.00 H new ATOM 0 HA LEU B 96 16.214 14.224 -2.333 1.00 0.00 H new ATOM 0 HB2 LEU B 96 15.278 13.349 -5.087 1.00 0.00 H new ATOM 0 HB3 LEU B 96 16.557 12.665 -4.102 1.00 0.00 H new ATOM 0 HG LEU B 96 14.717 11.994 -2.415 1.00 0.00 H new ATOM 0 HD11 LEU B 96 12.440 11.805 -3.366 1.00 0.00 H new ATOM 0 HD12 LEU B 96 12.966 13.504 -3.309 1.00 0.00 H new ATOM 0 HD13 LEU B 96 12.990 12.616 -4.852 1.00 0.00 H new ATOM 0 HD21 LEU B 96 14.119 9.992 -3.772 1.00 0.00 H new ATOM 0 HD22 LEU B 96 14.664 10.830 -5.245 1.00 0.00 H new ATOM 0 HD23 LEU B 96 15.838 10.405 -3.977 1.00 0.00 H new ATOM 3263 N ASP B 97 17.247 16.076 -3.733 1.00 0.00 N ATOM 3264 CA ASP B 97 17.813 17.186 -4.560 1.00 0.00 C ATOM 3265 C ASP B 97 19.249 16.824 -4.961 1.00 0.00 C ATOM 3266 O ASP B 97 20.047 16.415 -4.141 1.00 0.00 O ATOM 3267 CB ASP B 97 17.825 18.486 -3.753 1.00 0.00 C ATOM 3268 CG ASP B 97 18.308 19.636 -4.645 1.00 0.00 C ATOM 3269 OD1 ASP B 97 18.593 19.381 -5.803 1.00 0.00 O ATOM 3270 OD2 ASP B 97 18.383 20.750 -4.154 1.00 0.00 O ATOM 0 H ASP B 97 17.801 15.814 -2.918 1.00 0.00 H new ATOM 0 HA ASP B 97 17.199 17.326 -5.450 1.00 0.00 H new ATOM 0 HB2 ASP B 97 16.826 18.701 -3.374 1.00 0.00 H new ATOM 0 HB3 ASP B 97 18.479 18.383 -2.887 1.00 0.00 H new ATOM 3275 N PHE B 98 19.584 16.961 -6.217 1.00 0.00 N ATOM 3276 CA PHE B 98 20.968 16.616 -6.664 1.00 0.00 C ATOM 3277 C PHE B 98 21.274 17.269 -8.019 1.00 0.00 C ATOM 3278 O PHE B 98 20.440 17.289 -8.897 1.00 0.00 O ATOM 3279 CB PHE B 98 21.081 15.095 -6.821 1.00 0.00 C ATOM 3280 CG PHE B 98 22.530 14.695 -6.964 1.00 0.00 C ATOM 3281 CD1 PHE B 98 23.345 14.600 -5.831 1.00 0.00 C ATOM 3282 CD2 PHE B 98 23.057 14.418 -8.233 1.00 0.00 C ATOM 3283 CE1 PHE B 98 24.687 14.228 -5.964 1.00 0.00 C ATOM 3284 CE2 PHE B 98 24.400 14.046 -8.365 1.00 0.00 C ATOM 3285 CZ PHE B 98 25.215 13.949 -7.231 1.00 0.00 C ATOM 0 H PHE B 98 18.961 17.296 -6.952 1.00 0.00 H new ATOM 0 HA PHE B 98 21.676 16.980 -5.920 1.00 0.00 H new ATOM 0 HB2 PHE B 98 20.642 14.599 -5.955 1.00 0.00 H new ATOM 0 HB3 PHE B 98 20.518 14.769 -7.695 1.00 0.00 H new ATOM 0 HD1 PHE B 98 22.938 14.814 -4.854 1.00 0.00 H new ATOM 0 HD2 PHE B 98 22.428 14.491 -9.108 1.00 0.00 H new ATOM 0 HE1 PHE B 98 25.316 14.156 -5.089 1.00 0.00 H new ATOM 0 HE2 PHE B 98 24.808 13.834 -9.342 1.00 0.00 H new ATOM 0 HZ PHE B 98 26.250 13.659 -7.333 1.00 0.00 H new ATOM 3295 N PRO B 99 22.461 17.796 -8.193 1.00 0.00 N ATOM 3296 CA PRO B 99 22.869 18.435 -9.478 1.00 0.00 C ATOM 3297 C PRO B 99 22.463 17.599 -10.696 1.00 0.00 C ATOM 3298 O PRO B 99 22.866 16.460 -10.835 1.00 0.00 O ATOM 3299 CB PRO B 99 24.391 18.532 -9.367 1.00 0.00 C ATOM 3300 CG PRO B 99 24.662 18.669 -7.907 1.00 0.00 C ATOM 3301 CD PRO B 99 23.555 17.884 -7.192 1.00 0.00 C ATOM 0 HA PRO B 99 22.385 19.400 -9.625 1.00 0.00 H new ATOM 0 HB2 PRO B 99 24.874 17.645 -9.777 1.00 0.00 H new ATOM 0 HB3 PRO B 99 24.774 19.389 -9.922 1.00 0.00 H new ATOM 0 HG2 PRO B 99 25.646 18.273 -7.655 1.00 0.00 H new ATOM 0 HG3 PRO B 99 24.653 19.717 -7.606 1.00 0.00 H new ATOM 0 HD2 PRO B 99 23.900 16.895 -6.892 1.00 0.00 H new ATOM 0 HD3 PRO B 99 23.226 18.395 -6.287 1.00 0.00 H new ATOM 3309 N VAL B 100 21.665 18.144 -11.573 1.00 0.00 N ATOM 3310 CA VAL B 100 21.248 17.380 -12.781 1.00 0.00 C ATOM 3311 C VAL B 100 21.653 18.138 -14.047 1.00 0.00 C ATOM 3312 O VAL B 100 21.605 19.353 -14.096 1.00 0.00 O ATOM 3313 CB VAL B 100 19.728 17.192 -12.760 1.00 0.00 C ATOM 3314 CG1 VAL B 100 19.233 16.863 -14.171 1.00 0.00 C ATOM 3315 CG2 VAL B 100 19.372 16.041 -11.816 1.00 0.00 C ATOM 0 H VAL B 100 21.283 19.087 -11.504 1.00 0.00 H new ATOM 0 HA VAL B 100 21.740 16.407 -12.778 1.00 0.00 H new ATOM 0 HB VAL B 100 19.253 18.110 -12.414 1.00 0.00 H new ATOM 0 HG11 VAL B 100 18.151 16.729 -14.155 1.00 0.00 H new ATOM 0 HG12 VAL B 100 19.488 17.680 -14.846 1.00 0.00 H new ATOM 0 HG13 VAL B 100 19.707 15.945 -14.518 1.00 0.00 H new ATOM 0 HG21 VAL B 100 18.291 15.905 -11.799 1.00 0.00 H new ATOM 0 HG22 VAL B 100 19.847 15.124 -12.165 1.00 0.00 H new ATOM 0 HG23 VAL B 100 19.724 16.273 -10.811 1.00 0.00 H new ATOM 3325 N ALA B 101 22.042 17.430 -15.070 1.00 0.00 N ATOM 3326 CA ALA B 101 22.443 18.106 -16.342 1.00 0.00 C ATOM 3327 C ALA B 101 21.831 17.362 -17.535 1.00 0.00 C ATOM 3328 O ALA B 101 22.007 16.170 -17.694 1.00 0.00 O ATOM 3329 CB ALA B 101 23.968 18.089 -16.461 1.00 0.00 C ATOM 0 H ALA B 101 22.101 16.412 -15.083 1.00 0.00 H new ATOM 0 HA ALA B 101 22.085 19.136 -16.336 1.00 0.00 H new ATOM 0 HB1 ALA B 101 24.266 18.581 -17.387 1.00 0.00 H new ATOM 0 HB2 ALA B 101 24.405 18.616 -15.613 1.00 0.00 H new ATOM 0 HB3 ALA B 101 24.321 17.058 -16.468 1.00 0.00 H new ATOM 3335 N ALA B 102 21.116 18.056 -18.380 1.00 0.00 N ATOM 3336 CA ALA B 102 20.506 17.385 -19.559 1.00 0.00 C ATOM 3337 C ALA B 102 21.547 17.257 -20.671 1.00 0.00 C ATOM 3338 O ALA B 102 21.500 17.957 -21.665 1.00 0.00 O ATOM 3339 CB ALA B 102 19.320 18.210 -20.063 1.00 0.00 C ATOM 0 H ALA B 102 20.930 19.056 -18.303 1.00 0.00 H new ATOM 0 HA ALA B 102 20.160 16.393 -19.270 1.00 0.00 H new ATOM 0 HB1 ALA B 102 18.875 17.717 -20.927 1.00 0.00 H new ATOM 0 HB2 ALA B 102 18.576 18.298 -19.272 1.00 0.00 H new ATOM 0 HB3 ALA B 102 19.664 19.204 -20.350 1.00 0.00 H new ATOM 3345 N VAL B 103 22.488 16.368 -20.511 1.00 0.00 N ATOM 3346 CA VAL B 103 23.543 16.200 -21.549 1.00 0.00 C ATOM 3347 C VAL B 103 24.019 14.748 -21.552 1.00 0.00 C ATOM 3348 O VAL B 103 24.842 14.349 -20.752 1.00 0.00 O ATOM 3349 CB VAL B 103 24.719 17.126 -21.234 1.00 0.00 C ATOM 3350 CG1 VAL B 103 24.219 18.565 -21.116 1.00 0.00 C ATOM 3351 CG2 VAL B 103 25.362 16.699 -19.912 1.00 0.00 C ATOM 0 H VAL B 103 22.572 15.749 -19.704 1.00 0.00 H new ATOM 0 HA VAL B 103 23.138 16.452 -22.529 1.00 0.00 H new ATOM 0 HB VAL B 103 25.456 17.063 -22.035 1.00 0.00 H new ATOM 0 HG11 VAL B 103 25.057 19.224 -20.892 1.00 0.00 H new ATOM 0 HG12 VAL B 103 23.760 18.869 -22.057 1.00 0.00 H new ATOM 0 HG13 VAL B 103 23.482 18.630 -20.315 1.00 0.00 H new ATOM 0 HG21 VAL B 103 26.200 17.358 -19.686 1.00 0.00 H new ATOM 0 HG22 VAL B 103 24.625 16.762 -19.112 1.00 0.00 H new ATOM 0 HG23 VAL B 103 25.719 15.673 -19.996 1.00 0.00 H new ATOM 3361 N LYS B 104 23.508 13.952 -22.454 1.00 0.00 N ATOM 3362 CA LYS B 104 23.929 12.524 -22.513 1.00 0.00 C ATOM 3363 C LYS B 104 24.207 12.139 -23.968 1.00 0.00 C ATOM 3364 O LYS B 104 25.138 12.623 -24.579 1.00 0.00 O ATOM 3365 CB LYS B 104 22.810 11.639 -21.961 1.00 0.00 C ATOM 3366 CG LYS B 104 22.470 12.070 -20.535 1.00 0.00 C ATOM 3367 CD LYS B 104 23.602 11.654 -19.592 1.00 0.00 C ATOM 3368 CE LYS B 104 23.117 11.732 -18.144 1.00 0.00 C ATOM 3369 NZ LYS B 104 22.536 13.081 -17.884 1.00 0.00 N ATOM 0 H LYS B 104 22.818 14.230 -23.152 1.00 0.00 H new ATOM 0 HA LYS B 104 24.831 12.385 -21.917 1.00 0.00 H new ATOM 0 HB2 LYS B 104 21.927 11.715 -22.595 1.00 0.00 H new ATOM 0 HB3 LYS B 104 23.121 10.594 -21.971 1.00 0.00 H new ATOM 0 HG2 LYS B 104 22.327 13.150 -20.494 1.00 0.00 H new ATOM 0 HG3 LYS B 104 21.533 11.612 -20.219 1.00 0.00 H new ATOM 0 HD2 LYS B 104 23.927 10.640 -19.823 1.00 0.00 H new ATOM 0 HD3 LYS B 104 24.464 12.305 -19.733 1.00 0.00 H new ATOM 0 HE2 LYS B 104 22.370 10.961 -17.958 1.00 0.00 H new ATOM 0 HE3 LYS B 104 23.946 11.544 -17.461 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 22.874 13.433 -16.966 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 22.831 13.737 -18.636 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 21.498 13.015 -17.869 1.00 0.00 H new ATOM 3383 N SER B 105 23.412 11.269 -24.527 1.00 0.00 N ATOM 3384 CA SER B 105 23.641 10.863 -25.941 1.00 0.00 C ATOM 3385 C SER B 105 24.989 10.153 -26.040 1.00 0.00 C ATOM 3386 O SER B 105 25.300 9.518 -27.028 1.00 0.00 O ATOM 3387 CB SER B 105 23.649 12.107 -26.830 1.00 0.00 C ATOM 3388 OG SER B 105 22.698 13.040 -26.334 1.00 0.00 O ATOM 0 H SER B 105 22.617 10.824 -24.068 1.00 0.00 H new ATOM 0 HA SER B 105 22.847 10.192 -26.269 1.00 0.00 H new ATOM 0 HB2 SER B 105 24.643 12.554 -26.842 1.00 0.00 H new ATOM 0 HB3 SER B 105 23.409 11.836 -27.858 1.00 0.00 H new ATOM 0 HG SER B 105 22.700 13.841 -26.899 1.00 0.00 H new ATOM 3394 N SER B 106 25.796 10.255 -25.020 1.00 0.00 N ATOM 3395 CA SER B 106 27.124 9.590 -25.051 1.00 0.00 C ATOM 3396 C SER B 106 26.943 8.111 -25.394 1.00 0.00 C ATOM 3397 O SER B 106 26.027 7.462 -24.930 1.00 0.00 O ATOM 3398 CB SER B 106 27.794 9.723 -23.683 1.00 0.00 C ATOM 3399 OG SER B 106 29.108 9.181 -23.748 1.00 0.00 O ATOM 0 H SER B 106 25.590 10.772 -24.165 1.00 0.00 H new ATOM 0 HA SER B 106 27.752 10.063 -25.806 1.00 0.00 H new ATOM 0 HB2 SER B 106 27.835 10.771 -23.386 1.00 0.00 H new ATOM 0 HB3 SER B 106 27.209 9.200 -22.927 1.00 0.00 H new ATOM 0 HG SER B 106 29.541 9.266 -22.873 1.00 0.00 H new ATOM 3405 N VAL B 107 27.810 7.577 -26.205 1.00 0.00 N ATOM 3406 CA VAL B 107 27.703 6.144 -26.587 1.00 0.00 C ATOM 3407 C VAL B 107 29.070 5.486 -26.401 1.00 0.00 C ATOM 3408 O VAL B 107 30.095 6.050 -26.734 1.00 0.00 O ATOM 3409 CB VAL B 107 27.278 6.038 -28.053 1.00 0.00 C ATOM 3410 CG1 VAL B 107 28.395 6.571 -28.950 1.00 0.00 C ATOM 3411 CG2 VAL B 107 26.998 4.575 -28.403 1.00 0.00 C ATOM 0 H VAL B 107 28.595 8.076 -26.623 1.00 0.00 H new ATOM 0 HA VAL B 107 26.962 5.645 -25.963 1.00 0.00 H new ATOM 0 HB VAL B 107 26.374 6.627 -28.209 1.00 0.00 H new ATOM 0 HG11 VAL B 107 28.091 6.495 -29.994 1.00 0.00 H new ATOM 0 HG12 VAL B 107 28.592 7.615 -28.705 1.00 0.00 H new ATOM 0 HG13 VAL B 107 29.300 5.984 -28.792 1.00 0.00 H new ATOM 0 HG21 VAL B 107 26.695 4.502 -29.448 1.00 0.00 H new ATOM 0 HG22 VAL B 107 27.900 3.984 -28.244 1.00 0.00 H new ATOM 0 HG23 VAL B 107 26.199 4.195 -27.767 1.00 0.00 H new ATOM 3421 N VAL B 108 29.088 4.292 -25.872 1.00 0.00 N ATOM 3422 CA VAL B 108 30.383 3.590 -25.641 1.00 0.00 C ATOM 3423 C VAL B 108 30.119 2.241 -24.982 1.00 0.00 C ATOM 3424 O VAL B 108 30.601 1.961 -23.902 1.00 0.00 O ATOM 3425 CB VAL B 108 31.256 4.437 -24.716 1.00 0.00 C ATOM 3426 CG1 VAL B 108 30.485 4.753 -23.435 1.00 0.00 C ATOM 3427 CG2 VAL B 108 32.530 3.666 -24.369 1.00 0.00 C ATOM 0 H VAL B 108 28.258 3.771 -25.589 1.00 0.00 H new ATOM 0 HA VAL B 108 30.891 3.439 -26.594 1.00 0.00 H new ATOM 0 HB VAL B 108 31.521 5.367 -25.218 1.00 0.00 H new ATOM 0 HG11 VAL B 108 31.108 5.357 -22.775 1.00 0.00 H new ATOM 0 HG12 VAL B 108 29.578 5.304 -23.683 1.00 0.00 H new ATOM 0 HG13 VAL B 108 30.219 3.823 -22.932 1.00 0.00 H new ATOM 0 HG21 VAL B 108 33.153 4.270 -23.709 1.00 0.00 H new ATOM 0 HG22 VAL B 108 32.267 2.735 -23.867 1.00 0.00 H new ATOM 0 HG23 VAL B 108 33.080 3.442 -25.283 1.00 0.00 H new ATOM 3437 N ALA B 109 29.365 1.398 -25.628 1.00 0.00 N ATOM 3438 CA ALA B 109 29.077 0.066 -25.038 1.00 0.00 C ATOM 3439 C ALA B 109 30.230 -0.876 -25.375 1.00 0.00 C ATOM 3440 O ALA B 109 30.407 -1.268 -26.512 1.00 0.00 O ATOM 3441 CB ALA B 109 27.772 -0.480 -25.623 1.00 0.00 C ATOM 0 H ALA B 109 28.937 1.574 -26.537 1.00 0.00 H new ATOM 0 HA ALA B 109 28.972 0.149 -23.956 1.00 0.00 H new ATOM 0 HB1 ALA B 109 27.560 -1.458 -25.190 1.00 0.00 H new ATOM 0 HB2 ALA B 109 26.955 0.204 -25.392 1.00 0.00 H new ATOM 0 HB3 ALA B 109 27.870 -0.575 -26.704 1.00 0.00 H new ATOM 3447 N THR B 110 31.025 -1.242 -24.411 1.00 0.00 N ATOM 3448 CA THR B 110 32.162 -2.156 -24.706 1.00 0.00 C ATOM 3449 C THR B 110 32.243 -3.238 -23.627 1.00 0.00 C ATOM 3450 O THR B 110 33.153 -3.253 -22.823 1.00 0.00 O ATOM 3451 CB THR B 110 33.463 -1.351 -24.720 1.00 0.00 C ATOM 3452 OG1 THR B 110 33.300 -0.206 -25.546 1.00 0.00 O ATOM 3453 CG2 THR B 110 34.600 -2.216 -25.266 1.00 0.00 C ATOM 0 H THR B 110 30.938 -0.950 -23.437 1.00 0.00 H new ATOM 0 HA THR B 110 32.011 -2.627 -25.677 1.00 0.00 H new ATOM 0 HB THR B 110 33.705 -1.038 -23.704 1.00 0.00 H new ATOM 0 HG1 THR B 110 34.132 0.312 -25.555 1.00 0.00 H new ATOM 0 HG21 THR B 110 35.525 -1.639 -25.274 1.00 0.00 H new ATOM 0 HG22 THR B 110 34.726 -3.094 -24.632 1.00 0.00 H new ATOM 0 HG23 THR B 110 34.361 -2.533 -26.281 1.00 0.00 H new ATOM 3461 N PRO B 111 31.296 -4.139 -23.613 1.00 0.00 N ATOM 3462 CA PRO B 111 31.252 -5.245 -22.620 1.00 0.00 C ATOM 3463 C PRO B 111 32.175 -6.405 -23.003 1.00 0.00 C ATOM 3464 CB PRO B 111 29.789 -5.688 -22.658 1.00 0.00 C ATOM 3465 CG PRO B 111 29.339 -5.409 -24.052 1.00 0.00 C ATOM 3466 CD PRO B 111 30.152 -4.205 -24.544 1.00 0.00 C ATOM 0 HA PRO B 111 31.591 -4.927 -21.634 1.00 0.00 H new ATOM 0 HB2 PRO B 111 29.690 -6.746 -22.415 1.00 0.00 H new ATOM 0 HB3 PRO B 111 29.191 -5.137 -21.932 1.00 0.00 H new ATOM 0 HG2 PRO B 111 29.504 -6.275 -24.693 1.00 0.00 H new ATOM 0 HG3 PRO B 111 28.271 -5.192 -24.078 1.00 0.00 H new ATOM 0 HD2 PRO B 111 30.483 -4.341 -25.574 1.00 0.00 H new ATOM 0 HD3 PRO B 111 29.563 -3.288 -24.517 1.00 0.00 H new TER 3474 PRO B 111