USER MOD reduce.3.24.130724 H: found=0, std=0, add=1626, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1626 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 73 GLN : amide:sc= -0.0183 K(o=-0.31,f=-2.5!) USER MOD Set 1.2: B 84 MET CE :methyl -135:sc= -0.295 (180deg=-1.28) USER MOD Set 2.1: A 84 MET CE :methyl -129:sc= -0.373 (180deg=-1.25) USER MOD Set 2.2: B 73 GLN : amide:sc= -0.047 K(o=-0.42,f=-2.7!) USER MOD Set 3.1: A 15 THR OG1 : rot -172:sc= 0.465 USER MOD Set 3.2: B 3 CYS SG : rot -169:sc= -0.037 USER MOD Set 4.1: A 3 CYS SG : rot -166:sc= -0.0738 USER MOD Set 4.2: B 15 THR OG1 : rot -171:sc= 0.45 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 133:sc= 0.985 (180deg=0.36!) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 MET CE :methyl 160:sc= -0.135 (180deg=-1.28) USER MOD Single : A 14 SER OG : rot 77:sc= 0.616 USER MOD Single : A 17 HIS : no HD1:sc= 0 X(o=0,f=-0.0015) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 TYR OH : rot -70:sc= -1.66 USER MOD Single : A 20 SER OG : rot -37:sc= 1.06 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -0.165 X(o=-0.16,f=-0.029) USER MOD Single : A 31 LYS NZ :NH3+ -130:sc= -0.037 (180deg=-1.05) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 153:sc= -0.0093 (180deg=-0.628) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -170:sc= -0.052 USER MOD Single : A 56 GLN : amide:sc= -0.94 K(o=-0.94,f=-0.23) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 64:sc= 0.609 USER MOD Single : A 61 ASN : amide:sc= -2.27! C(o=-2.3!,f=-1.8!) USER MOD Single : A 64 SER OG : rot 180:sc= -0.166 USER MOD Single : A 65 ASN : amide:sc= -3.11! C(o=-3.1!,f=-3.6!) USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 CYS SG : rot 69:sc= 1.11 USER MOD Single : A 80 SER OG : rot -39:sc= 0.383 USER MOD Single : A 81 CYS SG : rot 145:sc= -2.71! USER MOD Single : A 85 MET CE :methyl 151:sc= -0.331 (180deg=-1.57!) USER MOD Single : A 86 CYS SG : rot 66:sc= 0.352 USER MOD Single : A 87 ASN : amide:sc= -2.04 K(o=-2,f=-5!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= -1.05 K(o=-1.1,f=-0.13) USER MOD Single : A 100 LYS NZ :NH3+ 159:sc= -0.141 (180deg=-0.769) USER MOD Single : A 101 LYS NZ :NH3+ -142:sc= 0 (180deg=-0.000448) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 143:sc= 1.01 (180deg=0.24) USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 MET CE :methyl 162:sc= -0.219 (180deg=-1.32!) USER MOD Single : B 14 SER OG : rot 77:sc= 0.684 USER MOD Single : B 17 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 TYR OH : rot -70:sc= -1.73 USER MOD Single : B 20 SER OG : rot -38:sc= 1.03 USER MOD Single : B 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 ASN : amide:sc= -0.122 X(o=-0.12,f=-0.017) USER MOD Single : B 31 LYS NZ :NH3+ -136:sc= -0.0897 (180deg=-0.922) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ 153:sc= -0.0149 (180deg=-0.513) USER MOD Single : B 39 THR OG1 : rot 180:sc=-0.00353 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 THR OG1 : rot -170:sc= -0.024 USER MOD Single : B 56 GLN : amide:sc= -0.979 K(o=-0.98,f=-0.22) USER MOD Single : B 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 60 SER OG : rot 73:sc= 0.809 USER MOD Single : B 61 ASN : amide:sc= -2.16 X(o=-2.2,f=-1.8!) USER MOD Single : B 64 SER OG : rot 180:sc= -0.235 USER MOD Single : B 65 ASN : amide:sc= -3.2! C(o=-3.2!,f=-3.6!) USER MOD Single : B 68 ASN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : B 75 TYR OH : rot 180:sc= 0 USER MOD Single : B 76 CYS SG : rot 70:sc= 0.968 USER MOD Single : B 80 SER OG : rot -34:sc= 0.422 USER MOD Single : B 81 CYS SG : rot 151:sc= -2.63! USER MOD Single : B 85 MET CE :methyl 150:sc= -0.254 (180deg=-1.5!) USER MOD Single : B 86 CYS SG : rot 67:sc= 0.335 USER MOD Single : B 87 ASN : amide:sc= -1.86 K(o=-1.9,f=-5.2!) USER MOD Single : B 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 97 GLN : amide:sc= -0.962 K(o=-0.96,f=-0.12) USER MOD Single : B 100 LYS NZ :NH3+ 159:sc= -0.136 (180deg=-0.69) USER MOD Single : B 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 72.605 4.723 -18.150 1.00 0.00 N ATOM 2 CA MET A 1 72.681 3.486 -18.979 1.00 0.00 C ATOM 3 C MET A 1 74.041 2.812 -18.764 1.00 0.00 C ATOM 4 O MET A 1 75.072 3.348 -19.120 1.00 0.00 O ATOM 5 CB MET A 1 72.523 3.859 -20.458 1.00 0.00 C ATOM 6 CG MET A 1 71.114 4.407 -20.709 1.00 0.00 C ATOM 7 SD MET A 1 71.023 6.121 -20.129 1.00 0.00 S ATOM 8 CE MET A 1 69.886 6.741 -21.395 1.00 0.00 C ATOM 0 H1 MET A 1 72.245 5.508 -18.730 1.00 0.00 H new ATOM 0 H2 MET A 1 71.964 4.564 -17.346 1.00 0.00 H new ATOM 0 H3 MET A 1 73.553 4.962 -17.795 1.00 0.00 H new ATOM 0 HA MET A 1 71.886 2.799 -18.688 1.00 0.00 H new ATOM 0 HB2 MET A 1 73.268 4.605 -20.736 1.00 0.00 H new ATOM 0 HB3 MET A 1 72.699 2.984 -21.084 1.00 0.00 H new ATOM 0 HG2 MET A 1 70.877 4.358 -21.772 1.00 0.00 H new ATOM 0 HG3 MET A 1 70.376 3.796 -20.189 1.00 0.00 H new ATOM 0 HE1 MET A 1 69.691 7.799 -21.222 1.00 0.00 H new ATOM 0 HE2 MET A 1 70.333 6.610 -22.381 1.00 0.00 H new ATOM 0 HE3 MET A 1 68.949 6.187 -21.345 1.00 0.00 H new ATOM 20 N ALA A 2 74.052 1.639 -18.187 1.00 0.00 N ATOM 21 CA ALA A 2 75.347 0.933 -17.954 1.00 0.00 C ATOM 22 C ALA A 2 76.312 1.860 -17.210 1.00 0.00 C ATOM 23 O ALA A 2 77.411 2.116 -17.661 1.00 0.00 O ATOM 24 CB ALA A 2 75.963 0.527 -19.294 1.00 0.00 C ATOM 0 H ALA A 2 73.222 1.140 -17.867 1.00 0.00 H new ATOM 0 HA ALA A 2 75.165 0.041 -17.355 1.00 0.00 H new ATOM 0 HB1 ALA A 2 76.908 0.012 -19.119 1.00 0.00 H new ATOM 0 HB2 ALA A 2 75.280 -0.138 -19.822 1.00 0.00 H new ATOM 0 HB3 ALA A 2 76.141 1.417 -19.897 1.00 0.00 H new ATOM 30 N CYS A 3 75.909 2.371 -16.079 1.00 0.00 N ATOM 31 CA CYS A 3 76.802 3.287 -15.315 1.00 0.00 C ATOM 32 C CYS A 3 78.034 2.499 -14.805 1.00 0.00 C ATOM 33 O CYS A 3 77.878 1.425 -14.260 1.00 0.00 O ATOM 34 CB CYS A 3 76.031 3.843 -14.116 1.00 0.00 C ATOM 35 SG CYS A 3 77.043 5.078 -13.265 1.00 0.00 S ATOM 0 H CYS A 3 75.000 2.194 -15.651 1.00 0.00 H new ATOM 0 HA CYS A 3 77.132 4.102 -15.959 1.00 0.00 H new ATOM 0 HB2 CYS A 3 75.095 4.292 -14.449 1.00 0.00 H new ATOM 0 HB3 CYS A 3 75.772 3.036 -13.431 1.00 0.00 H new ATOM 0 HG CYS A 3 76.530 5.330 -12.098 1.00 0.00 H new ATOM 41 N PRO A 4 79.252 3.002 -14.966 1.00 0.00 N ATOM 42 CA PRO A 4 80.453 2.258 -14.480 1.00 0.00 C ATOM 43 C PRO A 4 80.317 1.778 -13.023 1.00 0.00 C ATOM 44 O PRO A 4 81.164 1.067 -12.517 1.00 0.00 O ATOM 45 CB PRO A 4 81.584 3.294 -14.637 1.00 0.00 C ATOM 46 CG PRO A 4 81.052 4.472 -15.474 1.00 0.00 C ATOM 47 CD PRO A 4 79.527 4.313 -15.629 1.00 0.00 C ATOM 0 HA PRO A 4 80.623 1.337 -15.037 1.00 0.00 H new ATOM 0 HB2 PRO A 4 81.917 3.643 -13.660 1.00 0.00 H new ATOM 0 HB3 PRO A 4 82.447 2.842 -15.125 1.00 0.00 H new ATOM 0 HG2 PRO A 4 81.287 5.419 -14.987 1.00 0.00 H new ATOM 0 HG3 PRO A 4 81.532 4.489 -16.452 1.00 0.00 H new ATOM 0 HD2 PRO A 4 78.986 5.128 -15.149 1.00 0.00 H new ATOM 0 HD3 PRO A 4 79.227 4.305 -16.677 1.00 0.00 H new ATOM 55 N LEU A 5 79.263 2.151 -12.350 1.00 0.00 N ATOM 56 CA LEU A 5 79.087 1.701 -10.937 1.00 0.00 C ATOM 57 C LEU A 5 79.039 0.174 -10.912 1.00 0.00 C ATOM 58 O LEU A 5 79.567 -0.461 -10.023 1.00 0.00 O ATOM 59 CB LEU A 5 77.779 2.269 -10.365 1.00 0.00 C ATOM 60 CG LEU A 5 77.586 1.812 -8.906 1.00 0.00 C ATOM 61 CD1 LEU A 5 78.706 2.374 -8.013 1.00 0.00 C ATOM 62 CD2 LEU A 5 76.228 2.316 -8.404 1.00 0.00 C ATOM 0 H LEU A 5 78.518 2.745 -12.714 1.00 0.00 H new ATOM 0 HA LEU A 5 79.919 2.058 -10.330 1.00 0.00 H new ATOM 0 HB2 LEU A 5 77.797 3.358 -10.412 1.00 0.00 H new ATOM 0 HB3 LEU A 5 76.936 1.938 -10.971 1.00 0.00 H new ATOM 0 HG LEU A 5 77.622 0.723 -8.863 1.00 0.00 H new ATOM 0 HD11 LEU A 5 78.554 2.041 -6.986 1.00 0.00 H new ATOM 0 HD12 LEU A 5 79.671 2.016 -8.371 1.00 0.00 H new ATOM 0 HD13 LEU A 5 78.687 3.463 -8.048 1.00 0.00 H new ATOM 0 HD21 LEU A 5 76.081 1.998 -7.372 1.00 0.00 H new ATOM 0 HD22 LEU A 5 76.202 3.404 -8.456 1.00 0.00 H new ATOM 0 HD23 LEU A 5 75.434 1.904 -9.027 1.00 0.00 H new ATOM 74 N GLU A 6 78.398 -0.415 -11.880 1.00 0.00 N ATOM 75 CA GLU A 6 78.293 -1.900 -11.922 1.00 0.00 C ATOM 76 C GLU A 6 79.686 -2.534 -11.991 1.00 0.00 C ATOM 77 O GLU A 6 79.946 -3.536 -11.356 1.00 0.00 O ATOM 78 CB GLU A 6 77.495 -2.297 -13.164 1.00 0.00 C ATOM 79 CG GLU A 6 76.028 -1.911 -12.973 1.00 0.00 C ATOM 80 CD GLU A 6 75.256 -2.169 -14.267 1.00 0.00 C ATOM 81 OE1 GLU A 6 75.874 -2.596 -15.229 1.00 0.00 O ATOM 82 OE2 GLU A 6 74.058 -1.939 -14.274 1.00 0.00 O ATOM 0 H GLU A 6 77.939 0.071 -12.650 1.00 0.00 H new ATOM 0 HA GLU A 6 77.795 -2.252 -11.019 1.00 0.00 H new ATOM 0 HB2 GLU A 6 77.901 -1.799 -14.045 1.00 0.00 H new ATOM 0 HB3 GLU A 6 77.580 -3.370 -13.336 1.00 0.00 H new ATOM 0 HG2 GLU A 6 75.593 -2.488 -12.157 1.00 0.00 H new ATOM 0 HG3 GLU A 6 75.951 -0.860 -12.696 1.00 0.00 H new ATOM 89 N LYS A 7 80.585 -1.965 -12.746 1.00 0.00 N ATOM 90 CA LYS A 7 81.953 -2.549 -12.834 1.00 0.00 C ATOM 91 C LYS A 7 82.757 -2.053 -11.644 1.00 0.00 C ATOM 92 O LYS A 7 83.461 -2.796 -10.999 1.00 0.00 O ATOM 93 CB LYS A 7 82.646 -2.111 -14.142 1.00 0.00 C ATOM 94 CG LYS A 7 81.618 -1.935 -15.264 1.00 0.00 C ATOM 95 CD LYS A 7 80.909 -3.257 -15.565 1.00 0.00 C ATOM 96 CE LYS A 7 79.728 -2.973 -16.483 1.00 0.00 C ATOM 97 NZ LYS A 7 79.016 -4.245 -16.788 1.00 0.00 N ATOM 0 H LYS A 7 80.433 -1.125 -13.304 1.00 0.00 H new ATOM 0 HA LYS A 7 81.888 -3.637 -12.829 1.00 0.00 H new ATOM 0 HB2 LYS A 7 83.180 -1.175 -13.981 1.00 0.00 H new ATOM 0 HB3 LYS A 7 83.387 -2.855 -14.434 1.00 0.00 H new ATOM 0 HG2 LYS A 7 80.885 -1.181 -14.976 1.00 0.00 H new ATOM 0 HG3 LYS A 7 82.114 -1.570 -16.164 1.00 0.00 H new ATOM 0 HD2 LYS A 7 81.597 -3.957 -16.039 1.00 0.00 H new ATOM 0 HD3 LYS A 7 80.567 -3.723 -14.641 1.00 0.00 H new ATOM 0 HE2 LYS A 7 79.046 -2.268 -16.008 1.00 0.00 H new ATOM 0 HE3 LYS A 7 80.075 -2.508 -17.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 78.210 -4.050 -17.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 79.669 -4.904 -17.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 78.672 -4.671 -15.904 1.00 0.00 H new ATOM 111 N ALA A 8 82.639 -0.796 -11.342 1.00 0.00 N ATOM 112 CA ALA A 8 83.393 -0.257 -10.186 1.00 0.00 C ATOM 113 C ALA A 8 82.937 -1.023 -8.958 1.00 0.00 C ATOM 114 O ALA A 8 83.718 -1.371 -8.097 1.00 0.00 O ATOM 115 CB ALA A 8 83.132 1.243 -10.033 1.00 0.00 C ATOM 0 H ALA A 8 82.058 -0.123 -11.841 1.00 0.00 H new ATOM 0 HA ALA A 8 84.467 -0.379 -10.327 1.00 0.00 H new ATOM 0 HB1 ALA A 8 83.693 1.625 -9.180 1.00 0.00 H new ATOM 0 HB2 ALA A 8 83.450 1.762 -10.937 1.00 0.00 H new ATOM 0 HB3 ALA A 8 82.067 1.413 -9.873 1.00 0.00 H new ATOM 121 N LEU A 9 81.683 -1.349 -8.900 1.00 0.00 N ATOM 122 CA LEU A 9 81.202 -2.162 -7.764 1.00 0.00 C ATOM 123 C LEU A 9 81.990 -3.450 -7.833 1.00 0.00 C ATOM 124 O LEU A 9 82.557 -3.913 -6.862 1.00 0.00 O ATOM 125 CB LEU A 9 79.711 -2.449 -7.966 1.00 0.00 C ATOM 126 CG LEU A 9 79.140 -3.355 -6.859 1.00 0.00 C ATOM 127 CD1 LEU A 9 79.662 -4.804 -6.969 1.00 0.00 C ATOM 128 CD2 LEU A 9 79.472 -2.775 -5.473 1.00 0.00 C ATOM 0 H LEU A 9 80.975 -1.089 -9.587 1.00 0.00 H new ATOM 0 HA LEU A 9 81.331 -1.665 -6.802 1.00 0.00 H new ATOM 0 HB2 LEU A 9 79.160 -1.508 -7.984 1.00 0.00 H new ATOM 0 HB3 LEU A 9 79.562 -2.924 -8.936 1.00 0.00 H new ATOM 0 HG LEU A 9 78.058 -3.386 -6.989 1.00 0.00 H new ATOM 0 HD11 LEU A 9 79.233 -5.407 -6.168 1.00 0.00 H new ATOM 0 HD12 LEU A 9 79.373 -5.223 -7.933 1.00 0.00 H new ATOM 0 HD13 LEU A 9 80.749 -4.807 -6.883 1.00 0.00 H new ATOM 0 HD21 LEU A 9 79.063 -3.425 -4.699 1.00 0.00 H new ATOM 0 HD22 LEU A 9 80.554 -2.708 -5.356 1.00 0.00 H new ATOM 0 HD23 LEU A 9 79.035 -1.781 -5.380 1.00 0.00 H new ATOM 140 N ASP A 10 82.051 -4.015 -9.002 1.00 0.00 N ATOM 141 CA ASP A 10 82.829 -5.271 -9.170 1.00 0.00 C ATOM 142 C ASP A 10 84.299 -4.989 -8.846 1.00 0.00 C ATOM 143 O ASP A 10 84.990 -5.834 -8.321 1.00 0.00 O ATOM 144 CB ASP A 10 82.702 -5.805 -10.598 1.00 0.00 C ATOM 145 CG ASP A 10 81.282 -6.325 -10.823 1.00 0.00 C ATOM 146 OD1 ASP A 10 80.611 -6.600 -9.841 1.00 0.00 O ATOM 147 OD2 ASP A 10 80.887 -6.437 -11.972 1.00 0.00 O ATOM 0 H ASP A 10 81.598 -3.664 -9.846 1.00 0.00 H new ATOM 0 HA ASP A 10 82.435 -6.028 -8.492 1.00 0.00 H new ATOM 0 HB2 ASP A 10 82.930 -5.016 -11.314 1.00 0.00 H new ATOM 0 HB3 ASP A 10 83.424 -6.604 -10.764 1.00 0.00 H new ATOM 152 N VAL A 11 84.797 -3.812 -9.156 1.00 0.00 N ATOM 153 CA VAL A 11 86.234 -3.529 -8.847 1.00 0.00 C ATOM 154 C VAL A 11 86.445 -3.668 -7.335 1.00 0.00 C ATOM 155 O VAL A 11 87.436 -4.209 -6.887 1.00 0.00 O ATOM 156 CB VAL A 11 86.608 -2.102 -9.279 1.00 0.00 C ATOM 157 CG1 VAL A 11 88.001 -1.742 -8.750 1.00 0.00 C ATOM 158 CG2 VAL A 11 86.607 -1.998 -10.807 1.00 0.00 C ATOM 0 H VAL A 11 84.282 -3.052 -9.600 1.00 0.00 H new ATOM 0 HA VAL A 11 86.864 -4.234 -9.389 1.00 0.00 H new ATOM 0 HB VAL A 11 85.873 -1.410 -8.868 1.00 0.00 H new ATOM 0 HG11 VAL A 11 88.258 -0.729 -9.061 1.00 0.00 H new ATOM 0 HG12 VAL A 11 88.003 -1.799 -7.661 1.00 0.00 H new ATOM 0 HG13 VAL A 11 88.734 -2.442 -9.151 1.00 0.00 H new ATOM 0 HG21 VAL A 11 86.873 -0.983 -11.103 1.00 0.00 H new ATOM 0 HG22 VAL A 11 87.333 -2.699 -11.220 1.00 0.00 H new ATOM 0 HG23 VAL A 11 85.614 -2.238 -11.187 1.00 0.00 H new ATOM 168 N MET A 12 85.513 -3.200 -6.548 1.00 0.00 N ATOM 169 CA MET A 12 85.660 -3.327 -5.068 1.00 0.00 C ATOM 170 C MET A 12 85.743 -4.810 -4.703 1.00 0.00 C ATOM 171 O MET A 12 86.531 -5.218 -3.874 1.00 0.00 O ATOM 172 CB MET A 12 84.439 -2.706 -4.383 1.00 0.00 C ATOM 173 CG MET A 12 84.519 -1.177 -4.460 1.00 0.00 C ATOM 174 SD MET A 12 82.874 -0.467 -4.191 1.00 0.00 S ATOM 175 CE MET A 12 82.416 -1.454 -2.746 1.00 0.00 C ATOM 0 H MET A 12 84.660 -2.738 -6.863 1.00 0.00 H new ATOM 0 HA MET A 12 86.563 -2.813 -4.740 1.00 0.00 H new ATOM 0 HB2 MET A 12 83.525 -3.056 -4.863 1.00 0.00 H new ATOM 0 HB3 MET A 12 84.394 -3.025 -3.342 1.00 0.00 H new ATOM 0 HG2 MET A 12 85.215 -0.801 -3.710 1.00 0.00 H new ATOM 0 HG3 MET A 12 84.903 -0.872 -5.433 1.00 0.00 H new ATOM 0 HE1 MET A 12 81.612 -0.955 -2.205 1.00 0.00 H new ATOM 0 HE2 MET A 12 82.079 -2.439 -3.070 1.00 0.00 H new ATOM 0 HE3 MET A 12 83.281 -1.564 -2.091 1.00 0.00 H new ATOM 185 N VAL A 13 84.924 -5.616 -5.314 1.00 0.00 N ATOM 186 CA VAL A 13 84.937 -7.077 -5.016 1.00 0.00 C ATOM 187 C VAL A 13 86.074 -7.767 -5.779 1.00 0.00 C ATOM 188 O VAL A 13 86.780 -8.598 -5.246 1.00 0.00 O ATOM 189 CB VAL A 13 83.594 -7.678 -5.436 1.00 0.00 C ATOM 190 CG1 VAL A 13 83.589 -9.186 -5.163 1.00 0.00 C ATOM 191 CG2 VAL A 13 82.476 -7.006 -4.635 1.00 0.00 C ATOM 0 H VAL A 13 84.240 -5.325 -6.013 1.00 0.00 H new ATOM 0 HA VAL A 13 85.096 -7.228 -3.948 1.00 0.00 H new ATOM 0 HB VAL A 13 83.437 -7.512 -6.502 1.00 0.00 H new ATOM 0 HG11 VAL A 13 82.630 -9.607 -5.464 1.00 0.00 H new ATOM 0 HG12 VAL A 13 84.389 -9.661 -5.731 1.00 0.00 H new ATOM 0 HG13 VAL A 13 83.745 -9.364 -4.099 1.00 0.00 H new ATOM 0 HG21 VAL A 13 81.515 -7.428 -4.928 1.00 0.00 H new ATOM 0 HG22 VAL A 13 82.638 -7.176 -3.571 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.478 -5.935 -4.836 1.00 0.00 H new ATOM 201 N SER A 14 86.245 -7.443 -7.032 1.00 0.00 N ATOM 202 CA SER A 14 87.323 -8.096 -7.829 1.00 0.00 C ATOM 203 C SER A 14 88.690 -7.816 -7.201 1.00 0.00 C ATOM 204 O SER A 14 89.520 -8.699 -7.096 1.00 0.00 O ATOM 205 CB SER A 14 87.293 -7.557 -9.257 1.00 0.00 C ATOM 206 OG SER A 14 86.062 -7.921 -9.868 1.00 0.00 O ATOM 0 H SER A 14 85.686 -6.756 -7.538 1.00 0.00 H new ATOM 0 HA SER A 14 87.156 -9.173 -7.839 1.00 0.00 H new ATOM 0 HB2 SER A 14 87.403 -6.473 -9.252 1.00 0.00 H new ATOM 0 HB3 SER A 14 88.129 -7.960 -9.828 1.00 0.00 H new ATOM 0 HG SER A 14 85.347 -7.340 -9.535 1.00 0.00 H new ATOM 212 N THR A 15 88.939 -6.609 -6.770 1.00 0.00 N ATOM 213 CA THR A 15 90.259 -6.318 -6.144 1.00 0.00 C ATOM 214 C THR A 15 90.400 -7.198 -4.901 1.00 0.00 C ATOM 215 O THR A 15 91.435 -7.779 -4.641 1.00 0.00 O ATOM 216 CB THR A 15 90.344 -4.818 -5.784 1.00 0.00 C ATOM 217 OG1 THR A 15 91.703 -4.407 -5.801 1.00 0.00 O ATOM 218 CG2 THR A 15 89.748 -4.536 -4.398 1.00 0.00 C ATOM 0 H THR A 15 88.294 -5.821 -6.823 1.00 0.00 H new ATOM 0 HA THR A 15 91.074 -6.539 -6.834 1.00 0.00 H new ATOM 0 HB THR A 15 89.768 -4.260 -6.522 1.00 0.00 H new ATOM 0 HG1 THR A 15 91.773 -3.495 -5.450 1.00 0.00 H new ATOM 0 HG21 THR A 15 89.825 -3.471 -4.179 1.00 0.00 H new ATOM 0 HG22 THR A 15 88.700 -4.834 -4.385 1.00 0.00 H new ATOM 0 HG23 THR A 15 90.295 -5.102 -3.644 1.00 0.00 H new ATOM 226 N PHE A 16 89.342 -7.303 -4.147 1.00 0.00 N ATOM 227 CA PHE A 16 89.359 -8.145 -2.918 1.00 0.00 C ATOM 228 C PHE A 16 89.673 -9.590 -3.308 1.00 0.00 C ATOM 229 O PHE A 16 90.411 -10.285 -2.638 1.00 0.00 O ATOM 230 CB PHE A 16 87.973 -8.082 -2.270 1.00 0.00 C ATOM 231 CG PHE A 16 87.941 -8.922 -1.018 1.00 0.00 C ATOM 232 CD1 PHE A 16 87.784 -10.310 -1.109 1.00 0.00 C ATOM 233 CD2 PHE A 16 88.062 -8.312 0.235 1.00 0.00 C ATOM 234 CE1 PHE A 16 87.748 -11.088 0.054 1.00 0.00 C ATOM 235 CE2 PHE A 16 88.023 -9.088 1.398 1.00 0.00 C ATOM 236 CZ PHE A 16 87.867 -10.476 1.308 1.00 0.00 C ATOM 0 H PHE A 16 88.455 -6.835 -4.332 1.00 0.00 H new ATOM 0 HA PHE A 16 90.115 -7.785 -2.220 1.00 0.00 H new ATOM 0 HB2 PHE A 16 87.724 -7.049 -2.029 1.00 0.00 H new ATOM 0 HB3 PHE A 16 87.219 -8.436 -2.973 1.00 0.00 H new ATOM 0 HD1 PHE A 16 87.691 -10.781 -2.077 1.00 0.00 H new ATOM 0 HD2 PHE A 16 88.186 -7.241 0.304 1.00 0.00 H new ATOM 0 HE1 PHE A 16 87.629 -12.159 -0.016 1.00 0.00 H new ATOM 0 HE2 PHE A 16 88.113 -8.616 2.365 1.00 0.00 H new ATOM 0 HZ PHE A 16 87.838 -11.075 2.206 1.00 0.00 H new ATOM 246 N HIS A 17 89.116 -10.038 -4.398 1.00 0.00 N ATOM 247 CA HIS A 17 89.363 -11.431 -4.863 1.00 0.00 C ATOM 248 C HIS A 17 90.848 -11.623 -5.162 1.00 0.00 C ATOM 249 O HIS A 17 91.389 -12.693 -4.966 1.00 0.00 O ATOM 250 CB HIS A 17 88.535 -11.705 -6.124 1.00 0.00 C ATOM 251 CG HIS A 17 88.882 -13.060 -6.676 1.00 0.00 C ATOM 252 ND1 HIS A 17 88.746 -14.224 -5.931 1.00 0.00 N ATOM 253 CD2 HIS A 17 89.362 -13.453 -7.900 1.00 0.00 C ATOM 254 CE1 HIS A 17 89.137 -15.251 -6.709 1.00 0.00 C ATOM 255 NE2 HIS A 17 89.520 -14.833 -7.916 1.00 0.00 N ATOM 0 H HIS A 17 88.493 -9.492 -4.993 1.00 0.00 H new ATOM 0 HA HIS A 17 89.068 -12.130 -4.081 1.00 0.00 H new ATOM 0 HB2 HIS A 17 87.472 -11.659 -5.889 1.00 0.00 H new ATOM 0 HB3 HIS A 17 88.730 -10.937 -6.872 1.00 0.00 H new ATOM 0 HD2 HIS A 17 89.583 -12.791 -8.724 1.00 0.00 H new ATOM 0 HE1 HIS A 17 89.140 -16.284 -6.395 1.00 0.00 H new ATOM 0 HE2 HIS A 17 89.858 -15.406 -8.689 1.00 0.00 H new ATOM 264 N LYS A 18 91.521 -10.608 -5.631 1.00 0.00 N ATOM 265 CA LYS A 18 92.968 -10.781 -5.923 1.00 0.00 C ATOM 266 C LYS A 18 93.637 -11.202 -4.620 1.00 0.00 C ATOM 267 O LYS A 18 94.452 -12.101 -4.588 1.00 0.00 O ATOM 268 CB LYS A 18 93.557 -9.451 -6.416 1.00 0.00 C ATOM 269 CG LYS A 18 95.056 -9.597 -6.728 1.00 0.00 C ATOM 270 CD LYS A 18 95.263 -10.484 -7.964 1.00 0.00 C ATOM 271 CE LYS A 18 96.668 -10.255 -8.531 1.00 0.00 C ATOM 272 NZ LYS A 18 96.870 -11.123 -9.724 1.00 0.00 N ATOM 0 H LYS A 18 91.138 -9.682 -5.821 1.00 0.00 H new ATOM 0 HA LYS A 18 93.128 -11.530 -6.698 1.00 0.00 H new ATOM 0 HB2 LYS A 18 93.026 -9.122 -7.309 1.00 0.00 H new ATOM 0 HB3 LYS A 18 93.412 -8.681 -5.658 1.00 0.00 H new ATOM 0 HG2 LYS A 18 95.495 -8.614 -6.900 1.00 0.00 H new ATOM 0 HG3 LYS A 18 95.571 -10.031 -5.871 1.00 0.00 H new ATOM 0 HD2 LYS A 18 95.134 -11.533 -7.697 1.00 0.00 H new ATOM 0 HD3 LYS A 18 94.513 -10.253 -8.720 1.00 0.00 H new ATOM 0 HE2 LYS A 18 96.795 -9.208 -8.805 1.00 0.00 H new ATOM 0 HE3 LYS A 18 97.419 -10.480 -7.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 97.824 -10.968 -10.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 96.766 -12.121 -9.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 96.162 -10.888 -10.448 1.00 0.00 H new ATOM 286 N TYR A 19 93.253 -10.594 -3.533 1.00 0.00 N ATOM 287 CA TYR A 19 93.818 -11.005 -2.223 1.00 0.00 C ATOM 288 C TYR A 19 93.257 -12.385 -1.899 1.00 0.00 C ATOM 289 O TYR A 19 93.929 -13.236 -1.358 1.00 0.00 O ATOM 290 CB TYR A 19 93.418 -9.999 -1.140 1.00 0.00 C ATOM 291 CG TYR A 19 94.149 -8.697 -1.381 1.00 0.00 C ATOM 292 CD1 TYR A 19 93.565 -7.717 -2.190 1.00 0.00 C ATOM 293 CD2 TYR A 19 95.409 -8.475 -0.809 1.00 0.00 C ATOM 294 CE1 TYR A 19 94.235 -6.515 -2.431 1.00 0.00 C ATOM 295 CE2 TYR A 19 96.082 -7.268 -1.047 1.00 0.00 C ATOM 296 CZ TYR A 19 95.494 -6.289 -1.860 1.00 0.00 C ATOM 297 OH TYR A 19 96.158 -5.105 -2.101 1.00 0.00 O ATOM 0 H TYR A 19 92.575 -9.833 -3.497 1.00 0.00 H new ATOM 0 HA TYR A 19 94.907 -11.036 -2.263 1.00 0.00 H new ATOM 0 HB2 TYR A 19 92.341 -9.835 -1.159 1.00 0.00 H new ATOM 0 HB3 TYR A 19 93.663 -10.391 -0.153 1.00 0.00 H new ATOM 0 HD1 TYR A 19 92.594 -7.890 -2.629 1.00 0.00 H new ATOM 0 HD2 TYR A 19 95.861 -9.232 -0.186 1.00 0.00 H new ATOM 0 HE1 TYR A 19 93.782 -5.760 -3.057 1.00 0.00 H new ATOM 0 HE2 TYR A 19 97.052 -7.093 -0.605 1.00 0.00 H new ATOM 0 HH TYR A 19 96.456 -5.081 -3.034 1.00 0.00 H new ATOM 307 N SER A 20 92.011 -12.611 -2.228 1.00 0.00 N ATOM 308 CA SER A 20 91.389 -13.934 -1.939 1.00 0.00 C ATOM 309 C SER A 20 91.663 -14.295 -0.484 1.00 0.00 C ATOM 310 O SER A 20 91.483 -15.421 -0.063 1.00 0.00 O ATOM 311 CB SER A 20 92.008 -14.994 -2.848 1.00 0.00 C ATOM 312 OG SER A 20 91.412 -16.255 -2.571 1.00 0.00 O ATOM 0 H SER A 20 91.399 -11.935 -2.684 1.00 0.00 H new ATOM 0 HA SER A 20 90.315 -13.888 -2.117 1.00 0.00 H new ATOM 0 HB2 SER A 20 91.854 -14.728 -3.894 1.00 0.00 H new ATOM 0 HB3 SER A 20 93.085 -15.044 -2.687 1.00 0.00 H new ATOM 0 HG SER A 20 91.245 -16.334 -1.609 1.00 0.00 H new ATOM 318 N GLY A 21 92.116 -13.345 0.280 1.00 0.00 N ATOM 319 CA GLY A 21 92.427 -13.626 1.709 1.00 0.00 C ATOM 320 C GLY A 21 93.644 -14.549 1.767 1.00 0.00 C ATOM 321 O GLY A 21 93.540 -15.717 2.087 1.00 0.00 O ATOM 0 H GLY A 21 92.285 -12.385 -0.021 1.00 0.00 H new ATOM 0 HA2 GLY A 21 92.630 -12.697 2.242 1.00 0.00 H new ATOM 0 HA3 GLY A 21 91.573 -14.094 2.198 1.00 0.00 H new ATOM 325 N LYS A 22 94.796 -14.034 1.436 1.00 0.00 N ATOM 326 CA LYS A 22 96.029 -14.870 1.438 1.00 0.00 C ATOM 327 C LYS A 22 96.281 -15.423 2.843 1.00 0.00 C ATOM 328 O LYS A 22 96.665 -16.565 3.004 1.00 0.00 O ATOM 329 CB LYS A 22 97.209 -14.003 0.992 1.00 0.00 C ATOM 330 CG LYS A 22 97.005 -13.615 -0.474 1.00 0.00 C ATOM 331 CD LYS A 22 98.164 -12.744 -0.967 1.00 0.00 C ATOM 332 CE LYS A 22 98.221 -11.433 -0.169 1.00 0.00 C ATOM 333 NZ LYS A 22 98.852 -10.375 -1.008 1.00 0.00 N ATOM 0 H LYS A 22 94.937 -13.062 1.162 1.00 0.00 H new ATOM 0 HA LYS A 22 95.911 -15.710 0.753 1.00 0.00 H new ATOM 0 HB2 LYS A 22 97.278 -13.110 1.613 1.00 0.00 H new ATOM 0 HB3 LYS A 22 98.145 -14.548 1.112 1.00 0.00 H new ATOM 0 HG2 LYS A 22 96.932 -14.513 -1.087 1.00 0.00 H new ATOM 0 HG3 LYS A 22 96.064 -13.076 -0.586 1.00 0.00 H new ATOM 0 HD2 LYS A 22 99.105 -13.284 -0.860 1.00 0.00 H new ATOM 0 HD3 LYS A 22 98.039 -12.527 -2.028 1.00 0.00 H new ATOM 0 HE2 LYS A 22 97.217 -11.129 0.126 1.00 0.00 H new ATOM 0 HE3 LYS A 22 98.793 -11.576 0.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 98.893 -9.485 -0.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 99.816 -10.667 -1.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 98.288 -10.234 -1.871 1.00 0.00 H new ATOM 347 N GLU A 23 96.061 -14.628 3.861 1.00 0.00 N ATOM 348 CA GLU A 23 96.278 -15.105 5.268 1.00 0.00 C ATOM 349 C GLU A 23 94.936 -15.283 5.967 1.00 0.00 C ATOM 350 O GLU A 23 94.018 -14.508 5.783 1.00 0.00 O ATOM 351 CB GLU A 23 97.102 -14.076 6.040 1.00 0.00 C ATOM 352 CG GLU A 23 98.530 -14.074 5.507 1.00 0.00 C ATOM 353 CD GLU A 23 99.340 -12.992 6.222 1.00 0.00 C ATOM 354 OE1 GLU A 23 98.782 -12.334 7.085 1.00 0.00 O ATOM 355 OE2 GLU A 23 100.506 -12.841 5.898 1.00 0.00 O ATOM 0 H GLU A 23 95.739 -13.664 3.780 1.00 0.00 H new ATOM 0 HA GLU A 23 96.807 -16.057 5.239 1.00 0.00 H new ATOM 0 HB2 GLU A 23 96.660 -13.085 5.934 1.00 0.00 H new ATOM 0 HB3 GLU A 23 97.099 -14.314 7.104 1.00 0.00 H new ATOM 0 HG2 GLU A 23 98.989 -15.050 5.664 1.00 0.00 H new ATOM 0 HG3 GLU A 23 98.528 -13.891 4.432 1.00 0.00 H new ATOM 362 N GLY A 24 94.818 -16.297 6.777 1.00 0.00 N ATOM 363 CA GLY A 24 93.538 -16.525 7.496 1.00 0.00 C ATOM 364 C GLY A 24 92.523 -17.146 6.538 1.00 0.00 C ATOM 365 O GLY A 24 92.882 -17.718 5.528 1.00 0.00 O ATOM 0 H GLY A 24 95.553 -16.977 6.971 1.00 0.00 H new ATOM 0 HA2 GLY A 24 93.700 -17.184 8.349 1.00 0.00 H new ATOM 0 HA3 GLY A 24 93.155 -15.583 7.888 1.00 0.00 H new ATOM 369 N ASP A 25 91.258 -17.034 6.835 1.00 0.00 N ATOM 370 CA ASP A 25 90.233 -17.615 5.924 1.00 0.00 C ATOM 371 C ASP A 25 90.355 -16.953 4.555 1.00 0.00 C ATOM 372 O ASP A 25 90.472 -15.749 4.446 1.00 0.00 O ATOM 373 CB ASP A 25 88.837 -17.362 6.495 1.00 0.00 C ATOM 374 CG ASP A 25 88.619 -18.248 7.725 1.00 0.00 C ATOM 375 OD1 ASP A 25 89.319 -19.239 7.847 1.00 0.00 O ATOM 376 OD2 ASP A 25 87.753 -17.922 8.519 1.00 0.00 O ATOM 0 H ASP A 25 90.891 -16.568 7.665 1.00 0.00 H new ATOM 0 HA ASP A 25 90.390 -18.689 5.829 1.00 0.00 H new ATOM 0 HB2 ASP A 25 88.729 -16.312 6.766 1.00 0.00 H new ATOM 0 HB3 ASP A 25 88.080 -17.576 5.741 1.00 0.00 H new ATOM 381 N LYS A 26 90.328 -17.727 3.506 1.00 0.00 N ATOM 382 CA LYS A 26 90.442 -17.127 2.150 1.00 0.00 C ATOM 383 C LYS A 26 89.145 -16.393 1.825 1.00 0.00 C ATOM 384 O LYS A 26 89.062 -15.648 0.868 1.00 0.00 O ATOM 385 CB LYS A 26 90.712 -18.224 1.112 1.00 0.00 C ATOM 386 CG LYS A 26 89.470 -19.102 0.936 1.00 0.00 C ATOM 387 CD LYS A 26 89.830 -20.329 0.095 1.00 0.00 C ATOM 388 CE LYS A 26 88.553 -21.079 -0.295 1.00 0.00 C ATOM 389 NZ LYS A 26 88.875 -22.123 -1.307 1.00 0.00 N ATOM 0 H LYS A 26 90.233 -18.742 3.529 1.00 0.00 H new ATOM 0 HA LYS A 26 91.273 -16.422 2.126 1.00 0.00 H new ATOM 0 HB2 LYS A 26 90.986 -17.773 0.158 1.00 0.00 H new ATOM 0 HB3 LYS A 26 91.557 -18.835 1.430 1.00 0.00 H new ATOM 0 HG2 LYS A 26 89.090 -19.413 1.909 1.00 0.00 H new ATOM 0 HG3 LYS A 26 88.676 -18.535 0.450 1.00 0.00 H new ATOM 0 HD2 LYS A 26 90.371 -20.022 -0.800 1.00 0.00 H new ATOM 0 HD3 LYS A 26 90.492 -20.987 0.658 1.00 0.00 H new ATOM 0 HE2 LYS A 26 88.106 -21.539 0.586 1.00 0.00 H new ATOM 0 HE3 LYS A 26 87.819 -20.382 -0.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 88.006 -22.631 -1.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 89.283 -21.674 -2.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 89.561 -22.795 -0.907 1.00 0.00 H new ATOM 403 N PHE A 27 88.132 -16.586 2.626 1.00 0.00 N ATOM 404 CA PHE A 27 86.837 -15.885 2.377 1.00 0.00 C ATOM 405 C PHE A 27 86.834 -14.558 3.138 1.00 0.00 C ATOM 406 O PHE A 27 85.899 -13.787 3.052 1.00 0.00 O ATOM 407 CB PHE A 27 85.673 -16.743 2.883 1.00 0.00 C ATOM 408 CG PHE A 27 85.571 -18.017 2.080 1.00 0.00 C ATOM 409 CD1 PHE A 27 84.889 -18.021 0.857 1.00 0.00 C ATOM 410 CD2 PHE A 27 86.143 -19.199 2.567 1.00 0.00 C ATOM 411 CE1 PHE A 27 84.780 -19.206 0.121 1.00 0.00 C ATOM 412 CE2 PHE A 27 86.035 -20.384 1.829 1.00 0.00 C ATOM 413 CZ PHE A 27 85.354 -20.387 0.606 1.00 0.00 C ATOM 0 H PHE A 27 88.144 -17.198 3.442 1.00 0.00 H new ATOM 0 HA PHE A 27 86.724 -15.711 1.307 1.00 0.00 H new ATOM 0 HB2 PHE A 27 85.819 -16.980 3.937 1.00 0.00 H new ATOM 0 HB3 PHE A 27 84.741 -16.183 2.809 1.00 0.00 H new ATOM 0 HD1 PHE A 27 84.447 -17.110 0.482 1.00 0.00 H new ATOM 0 HD2 PHE A 27 86.667 -19.196 3.511 1.00 0.00 H new ATOM 0 HE1 PHE A 27 84.253 -19.209 -0.822 1.00 0.00 H new ATOM 0 HE2 PHE A 27 86.477 -21.296 2.203 1.00 0.00 H new ATOM 0 HZ PHE A 27 85.271 -21.301 0.036 1.00 0.00 H new ATOM 423 N LYS A 28 87.865 -14.295 3.905 1.00 0.00 N ATOM 424 CA LYS A 28 87.911 -13.024 4.700 1.00 0.00 C ATOM 425 C LYS A 28 89.340 -12.464 4.728 1.00 0.00 C ATOM 426 O LYS A 28 90.272 -13.080 4.249 1.00 0.00 O ATOM 427 CB LYS A 28 87.455 -13.304 6.133 1.00 0.00 C ATOM 428 CG LYS A 28 86.024 -13.844 6.126 1.00 0.00 C ATOM 429 CD LYS A 28 85.575 -14.122 7.560 1.00 0.00 C ATOM 430 CE LYS A 28 84.148 -14.668 7.541 1.00 0.00 C ATOM 431 NZ LYS A 28 83.680 -14.895 8.937 1.00 0.00 N ATOM 0 H LYS A 28 88.676 -14.904 4.016 1.00 0.00 H new ATOM 0 HA LYS A 28 87.250 -12.293 4.234 1.00 0.00 H new ATOM 0 HB2 LYS A 28 88.123 -14.026 6.602 1.00 0.00 H new ATOM 0 HB3 LYS A 28 87.506 -12.390 6.725 1.00 0.00 H new ATOM 0 HG2 LYS A 28 85.354 -13.123 5.658 1.00 0.00 H new ATOM 0 HG3 LYS A 28 85.972 -14.758 5.534 1.00 0.00 H new ATOM 0 HD2 LYS A 28 86.246 -14.840 8.031 1.00 0.00 H new ATOM 0 HD3 LYS A 28 85.620 -13.208 8.152 1.00 0.00 H new ATOM 0 HE2 LYS A 28 83.486 -13.965 7.035 1.00 0.00 H new ATOM 0 HE3 LYS A 28 84.113 -15.601 6.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 82.709 -15.267 8.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 84.306 -15.581 9.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 83.698 -13.996 9.460 1.00 0.00 H new ATOM 445 N LEU A 29 89.506 -11.287 5.290 1.00 0.00 N ATOM 446 CA LEU A 29 90.860 -10.643 5.372 1.00 0.00 C ATOM 447 C LEU A 29 91.190 -10.387 6.848 1.00 0.00 C ATOM 448 O LEU A 29 90.320 -10.362 7.695 1.00 0.00 O ATOM 449 CB LEU A 29 90.828 -9.297 4.596 1.00 0.00 C ATOM 450 CG LEU A 29 91.798 -9.304 3.406 1.00 0.00 C ATOM 451 CD1 LEU A 29 91.286 -10.240 2.307 1.00 0.00 C ATOM 452 CD2 LEU A 29 91.907 -7.878 2.853 1.00 0.00 C ATOM 0 H LEU A 29 88.751 -10.738 5.701 1.00 0.00 H new ATOM 0 HA LEU A 29 91.619 -11.291 4.934 1.00 0.00 H new ATOM 0 HB2 LEU A 29 89.816 -9.107 4.239 1.00 0.00 H new ATOM 0 HB3 LEU A 29 91.087 -8.481 5.271 1.00 0.00 H new ATOM 0 HG LEU A 29 92.775 -9.657 3.737 1.00 0.00 H new ATOM 0 HD11 LEU A 29 91.984 -10.234 1.470 1.00 0.00 H new ATOM 0 HD12 LEU A 29 91.201 -11.252 2.702 1.00 0.00 H new ATOM 0 HD13 LEU A 29 90.308 -9.900 1.966 1.00 0.00 H new ATOM 0 HD21 LEU A 29 92.593 -7.868 2.006 1.00 0.00 H new ATOM 0 HD22 LEU A 29 90.924 -7.538 2.527 1.00 0.00 H new ATOM 0 HD23 LEU A 29 92.281 -7.213 3.632 1.00 0.00 H new ATOM 464 N ASN A 30 92.444 -10.192 7.154 1.00 0.00 N ATOM 465 CA ASN A 30 92.849 -9.924 8.564 1.00 0.00 C ATOM 466 C ASN A 30 93.010 -8.413 8.752 1.00 0.00 C ATOM 467 O ASN A 30 93.546 -7.730 7.911 1.00 0.00 O ATOM 468 CB ASN A 30 94.181 -10.619 8.854 1.00 0.00 C ATOM 469 CG ASN A 30 93.972 -12.134 8.856 1.00 0.00 C ATOM 470 OD1 ASN A 30 94.655 -12.855 8.154 1.00 0.00 O ATOM 471 ND2 ASN A 30 93.050 -12.652 9.620 1.00 0.00 N ATOM 0 H ASN A 30 93.211 -10.207 6.482 1.00 0.00 H new ATOM 0 HA ASN A 30 92.090 -10.305 9.247 1.00 0.00 H new ATOM 0 HB2 ASN A 30 94.919 -10.343 8.101 1.00 0.00 H new ATOM 0 HB3 ASN A 30 94.572 -10.293 9.818 1.00 0.00 H new ATOM 0 HD21 ASN A 30 92.902 -13.661 9.628 1.00 0.00 H new ATOM 0 HD22 ASN A 30 92.477 -12.048 10.209 1.00 0.00 H new ATOM 478 N LYS A 31 92.531 -7.892 9.846 1.00 0.00 N ATOM 479 CA LYS A 31 92.629 -6.425 10.112 1.00 0.00 C ATOM 480 C LYS A 31 94.000 -5.901 9.683 1.00 0.00 C ATOM 481 O LYS A 31 94.135 -4.792 9.212 1.00 0.00 O ATOM 482 CB LYS A 31 92.446 -6.193 11.616 1.00 0.00 C ATOM 483 CG LYS A 31 93.471 -7.018 12.398 1.00 0.00 C ATOM 484 CD LYS A 31 93.284 -6.781 13.895 1.00 0.00 C ATOM 485 CE LYS A 31 94.308 -7.613 14.668 1.00 0.00 C ATOM 486 NZ LYS A 31 94.022 -9.060 14.459 1.00 0.00 N ATOM 0 H LYS A 31 92.068 -8.427 10.581 1.00 0.00 H new ATOM 0 HA LYS A 31 91.860 -5.898 9.547 1.00 0.00 H new ATOM 0 HB2 LYS A 31 92.566 -5.134 11.847 1.00 0.00 H new ATOM 0 HB3 LYS A 31 91.436 -6.472 11.916 1.00 0.00 H new ATOM 0 HG2 LYS A 31 93.351 -8.077 12.169 1.00 0.00 H new ATOM 0 HG3 LYS A 31 94.481 -6.740 12.099 1.00 0.00 H new ATOM 0 HD2 LYS A 31 93.408 -5.723 14.126 1.00 0.00 H new ATOM 0 HD3 LYS A 31 92.273 -7.056 14.195 1.00 0.00 H new ATOM 0 HE2 LYS A 31 95.317 -7.377 14.329 1.00 0.00 H new ATOM 0 HE3 LYS A 31 94.264 -7.371 15.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 93.993 -9.545 15.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 93.104 -9.167 13.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 94.769 -9.480 13.870 1.00 0.00 H new ATOM 500 N SER A 32 95.012 -6.693 9.822 1.00 0.00 N ATOM 501 CA SER A 32 96.356 -6.238 9.401 1.00 0.00 C ATOM 502 C SER A 32 96.301 -5.965 7.914 1.00 0.00 C ATOM 503 O SER A 32 96.851 -5.004 7.418 1.00 0.00 O ATOM 504 CB SER A 32 97.398 -7.309 9.675 1.00 0.00 C ATOM 505 OG SER A 32 97.566 -7.461 11.078 1.00 0.00 O ATOM 0 H SER A 32 94.970 -7.636 10.209 1.00 0.00 H new ATOM 0 HA SER A 32 96.634 -5.343 9.958 1.00 0.00 H new ATOM 0 HB2 SER A 32 97.088 -8.255 9.231 1.00 0.00 H new ATOM 0 HB3 SER A 32 98.346 -7.035 9.212 1.00 0.00 H new ATOM 0 HG SER A 32 98.237 -8.153 11.254 1.00 0.00 H new ATOM 511 N GLU A 33 95.617 -6.806 7.198 1.00 0.00 N ATOM 512 CA GLU A 33 95.500 -6.594 5.743 1.00 0.00 C ATOM 513 C GLU A 33 94.857 -5.252 5.537 1.00 0.00 C ATOM 514 O GLU A 33 95.055 -4.628 4.528 1.00 0.00 O ATOM 515 CB GLU A 33 94.662 -7.700 5.094 1.00 0.00 C ATOM 516 CG GLU A 33 95.420 -9.028 5.186 1.00 0.00 C ATOM 517 CD GLU A 33 96.672 -8.967 4.310 1.00 0.00 C ATOM 518 OE1 GLU A 33 96.536 -8.661 3.137 1.00 0.00 O ATOM 519 OE2 GLU A 33 97.746 -9.230 4.826 1.00 0.00 O ATOM 0 H GLU A 33 95.136 -7.629 7.561 1.00 0.00 H new ATOM 0 HA GLU A 33 96.484 -6.624 5.275 1.00 0.00 H new ATOM 0 HB2 GLU A 33 93.697 -7.783 5.595 1.00 0.00 H new ATOM 0 HB3 GLU A 33 94.460 -7.455 4.051 1.00 0.00 H new ATOM 0 HG2 GLU A 33 95.698 -9.229 6.221 1.00 0.00 H new ATOM 0 HG3 GLU A 33 94.778 -9.848 4.863 1.00 0.00 H new ATOM 526 N LEU A 34 94.118 -4.759 6.491 1.00 0.00 N ATOM 527 CA LEU A 34 93.543 -3.406 6.266 1.00 0.00 C ATOM 528 C LEU A 34 94.728 -2.480 6.081 1.00 0.00 C ATOM 529 O LEU A 34 94.723 -1.609 5.245 1.00 0.00 O ATOM 530 CB LEU A 34 92.703 -2.931 7.478 1.00 0.00 C ATOM 531 CG LEU A 34 91.969 -1.565 7.241 1.00 0.00 C ATOM 532 CD1 LEU A 34 92.851 -0.356 7.659 1.00 0.00 C ATOM 533 CD2 LEU A 34 91.534 -1.405 5.775 1.00 0.00 C ATOM 0 H LEU A 34 93.895 -5.210 7.378 1.00 0.00 H new ATOM 0 HA LEU A 34 92.877 -3.414 5.403 1.00 0.00 H new ATOM 0 HB2 LEU A 34 91.963 -3.694 7.717 1.00 0.00 H new ATOM 0 HB3 LEU A 34 93.355 -2.837 8.346 1.00 0.00 H new ATOM 0 HG LEU A 34 91.080 -1.578 7.871 1.00 0.00 H new ATOM 0 HD11 LEU A 34 92.307 0.571 7.479 1.00 0.00 H new ATOM 0 HD12 LEU A 34 93.096 -0.433 8.718 1.00 0.00 H new ATOM 0 HD13 LEU A 34 93.770 -0.356 7.073 1.00 0.00 H new ATOM 0 HD21 LEU A 34 91.029 -0.448 5.648 1.00 0.00 H new ATOM 0 HD22 LEU A 34 92.411 -1.441 5.129 1.00 0.00 H new ATOM 0 HD23 LEU A 34 90.853 -2.213 5.507 1.00 0.00 H new ATOM 545 N LYS A 35 95.756 -2.679 6.864 1.00 0.00 N ATOM 546 CA LYS A 35 96.954 -1.812 6.730 1.00 0.00 C ATOM 547 C LYS A 35 97.672 -2.125 5.413 1.00 0.00 C ATOM 548 O LYS A 35 97.928 -1.246 4.615 1.00 0.00 O ATOM 549 CB LYS A 35 97.887 -2.045 7.931 1.00 0.00 C ATOM 550 CG LYS A 35 99.244 -1.359 7.715 1.00 0.00 C ATOM 551 CD LYS A 35 99.046 0.131 7.438 1.00 0.00 C ATOM 552 CE LYS A 35 100.395 0.843 7.524 1.00 0.00 C ATOM 553 NZ LYS A 35 101.332 0.241 6.535 1.00 0.00 N ATOM 0 H LYS A 35 95.814 -3.399 7.584 1.00 0.00 H new ATOM 0 HA LYS A 35 96.655 -0.764 6.717 1.00 0.00 H new ATOM 0 HB2 LYS A 35 97.421 -1.660 8.838 1.00 0.00 H new ATOM 0 HB3 LYS A 35 98.036 -3.115 8.078 1.00 0.00 H new ATOM 0 HG2 LYS A 35 99.871 -1.492 8.597 1.00 0.00 H new ATOM 0 HG3 LYS A 35 99.766 -1.825 6.879 1.00 0.00 H new ATOM 0 HD2 LYS A 35 98.608 0.274 6.450 1.00 0.00 H new ATOM 0 HD3 LYS A 35 98.350 0.558 8.160 1.00 0.00 H new ATOM 0 HE2 LYS A 35 100.271 1.907 7.324 1.00 0.00 H new ATOM 0 HE3 LYS A 35 100.803 0.753 8.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 102.040 0.948 6.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 101.811 -0.577 6.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 100.800 -0.070 5.697 1.00 0.00 H new ATOM 567 N GLU A 36 97.995 -3.369 5.178 1.00 0.00 N ATOM 568 CA GLU A 36 98.695 -3.732 3.909 1.00 0.00 C ATOM 569 C GLU A 36 97.768 -3.502 2.714 1.00 0.00 C ATOM 570 O GLU A 36 98.186 -3.024 1.679 1.00 0.00 O ATOM 571 CB GLU A 36 99.141 -5.198 3.964 1.00 0.00 C ATOM 572 CG GLU A 36 99.764 -5.604 2.629 1.00 0.00 C ATOM 573 CD GLU A 36 100.454 -6.962 2.775 1.00 0.00 C ATOM 574 OE1 GLU A 36 100.443 -7.495 3.873 1.00 0.00 O ATOM 575 OE2 GLU A 36 100.984 -7.444 1.787 1.00 0.00 O ATOM 0 H GLU A 36 97.805 -4.149 5.808 1.00 0.00 H new ATOM 0 HA GLU A 36 99.575 -3.100 3.792 1.00 0.00 H new ATOM 0 HB2 GLU A 36 99.863 -5.337 4.769 1.00 0.00 H new ATOM 0 HB3 GLU A 36 98.288 -5.838 4.186 1.00 0.00 H new ATOM 0 HG2 GLU A 36 98.995 -5.657 1.859 1.00 0.00 H new ATOM 0 HG3 GLU A 36 100.485 -4.851 2.309 1.00 0.00 H new ATOM 582 N LEU A 37 96.513 -3.827 2.847 1.00 0.00 N ATOM 583 CA LEU A 37 95.569 -3.615 1.718 1.00 0.00 C ATOM 584 C LEU A 37 95.551 -2.132 1.384 1.00 0.00 C ATOM 585 O LEU A 37 95.456 -1.742 0.237 1.00 0.00 O ATOM 586 CB LEU A 37 94.156 -4.066 2.130 1.00 0.00 C ATOM 587 CG LEU A 37 93.156 -3.859 0.980 1.00 0.00 C ATOM 588 CD1 LEU A 37 93.535 -4.744 -0.217 1.00 0.00 C ATOM 589 CD2 LEU A 37 91.753 -4.237 1.475 1.00 0.00 C ATOM 0 H LEU A 37 96.101 -4.230 3.689 1.00 0.00 H new ATOM 0 HA LEU A 37 95.886 -4.195 0.851 1.00 0.00 H new ATOM 0 HB2 LEU A 37 94.175 -5.118 2.416 1.00 0.00 H new ATOM 0 HB3 LEU A 37 93.831 -3.503 3.005 1.00 0.00 H new ATOM 0 HG LEU A 37 93.175 -2.816 0.663 1.00 0.00 H new ATOM 0 HD11 LEU A 37 92.820 -4.589 -1.025 1.00 0.00 H new ATOM 0 HD12 LEU A 37 94.535 -4.481 -0.562 1.00 0.00 H new ATOM 0 HD13 LEU A 37 93.519 -5.791 0.085 1.00 0.00 H new ATOM 0 HD21 LEU A 37 91.032 -4.095 0.669 1.00 0.00 H new ATOM 0 HD22 LEU A 37 91.747 -5.281 1.788 1.00 0.00 H new ATOM 0 HD23 LEU A 37 91.482 -3.603 2.320 1.00 0.00 H new ATOM 601 N LEU A 38 95.597 -1.301 2.385 1.00 0.00 N ATOM 602 CA LEU A 38 95.532 0.170 2.113 1.00 0.00 C ATOM 603 C LEU A 38 96.701 0.636 1.236 1.00 0.00 C ATOM 604 O LEU A 38 96.511 1.332 0.261 1.00 0.00 O ATOM 605 CB LEU A 38 95.540 0.955 3.454 1.00 0.00 C ATOM 606 CG LEU A 38 94.292 1.853 3.566 1.00 0.00 C ATOM 607 CD1 LEU A 38 94.220 2.812 2.355 1.00 0.00 C ATOM 608 CD2 LEU A 38 93.013 0.978 3.653 1.00 0.00 C ATOM 0 H LEU A 38 95.676 -1.565 3.367 1.00 0.00 H new ATOM 0 HA LEU A 38 94.606 0.368 1.573 1.00 0.00 H new ATOM 0 HB2 LEU A 38 95.568 0.256 4.290 1.00 0.00 H new ATOM 0 HB3 LEU A 38 96.441 1.566 3.519 1.00 0.00 H new ATOM 0 HG LEU A 38 94.361 2.451 4.475 1.00 0.00 H new ATOM 0 HD11 LEU A 38 93.335 3.443 2.442 1.00 0.00 H new ATOM 0 HD12 LEU A 38 95.112 3.439 2.334 1.00 0.00 H new ATOM 0 HD13 LEU A 38 94.162 2.232 1.434 1.00 0.00 H new ATOM 0 HD21 LEU A 38 92.137 1.621 3.732 1.00 0.00 H new ATOM 0 HD22 LEU A 38 92.932 0.362 2.757 1.00 0.00 H new ATOM 0 HD23 LEU A 38 93.071 0.335 4.531 1.00 0.00 H new ATOM 620 N THR A 39 97.902 0.297 1.583 1.00 0.00 N ATOM 621 CA THR A 39 99.058 0.777 0.771 1.00 0.00 C ATOM 622 C THR A 39 99.118 0.027 -0.553 1.00 0.00 C ATOM 623 O THR A 39 99.607 0.531 -1.544 1.00 0.00 O ATOM 624 CB THR A 39 100.367 0.539 1.537 1.00 0.00 C ATOM 625 OG1 THR A 39 100.906 -0.728 1.177 1.00 0.00 O ATOM 626 CG2 THR A 39 100.089 0.553 3.037 1.00 0.00 C ATOM 0 H THR A 39 98.140 -0.286 2.385 1.00 0.00 H new ATOM 0 HA THR A 39 98.929 1.842 0.580 1.00 0.00 H new ATOM 0 HB THR A 39 101.078 1.326 1.286 1.00 0.00 H new ATOM 0 HG1 THR A 39 101.742 -0.878 1.665 1.00 0.00 H new ATOM 0 HG21 THR A 39 101.018 0.384 3.581 1.00 0.00 H new ATOM 0 HG22 THR A 39 99.673 1.520 3.321 1.00 0.00 H new ATOM 0 HG23 THR A 39 99.377 -0.235 3.282 1.00 0.00 H new ATOM 634 N ARG A 40 98.647 -1.182 -0.576 1.00 0.00 N ATOM 635 CA ARG A 40 98.707 -1.965 -1.831 1.00 0.00 C ATOM 636 C ARG A 40 97.737 -1.385 -2.849 1.00 0.00 C ATOM 637 O ARG A 40 98.025 -1.334 -4.029 1.00 0.00 O ATOM 638 CB ARG A 40 98.342 -3.426 -1.557 1.00 0.00 C ATOM 639 CG ARG A 40 99.441 -4.116 -0.738 1.00 0.00 C ATOM 640 CD ARG A 40 100.612 -4.535 -1.636 1.00 0.00 C ATOM 641 NE ARG A 40 101.626 -5.244 -0.804 1.00 0.00 N ATOM 642 CZ ARG A 40 102.586 -5.913 -1.376 1.00 0.00 C ATOM 643 NH1 ARG A 40 102.652 -5.974 -2.678 1.00 0.00 N ATOM 644 NH2 ARG A 40 103.481 -6.521 -0.648 1.00 0.00 N ATOM 0 H ARG A 40 98.224 -1.661 0.219 1.00 0.00 H new ATOM 0 HA ARG A 40 99.721 -1.916 -2.227 1.00 0.00 H new ATOM 0 HB2 ARG A 40 97.396 -3.475 -1.018 1.00 0.00 H new ATOM 0 HB3 ARG A 40 98.199 -3.953 -2.500 1.00 0.00 H new ATOM 0 HG2 ARG A 40 99.798 -3.441 0.040 1.00 0.00 H new ATOM 0 HG3 ARG A 40 99.030 -4.992 -0.237 1.00 0.00 H new ATOM 0 HD2 ARG A 40 100.260 -5.185 -2.437 1.00 0.00 H new ATOM 0 HD3 ARG A 40 101.057 -3.660 -2.109 1.00 0.00 H new ATOM 0 HE ARG A 40 101.568 -5.205 0.214 1.00 0.00 H new ATOM 0 HH11 ARG A 40 101.952 -5.498 -3.247 1.00 0.00 H new ATOM 0 HH12 ARG A 40 103.404 -6.498 -3.127 1.00 0.00 H new ATOM 0 HH21 ARG A 40 103.429 -6.473 0.370 1.00 0.00 H new ATOM 0 HH22 ARG A 40 104.233 -7.045 -1.096 1.00 0.00 H new ATOM 658 N GLU A 41 96.580 -0.960 -2.411 1.00 0.00 N ATOM 659 CA GLU A 41 95.582 -0.394 -3.369 1.00 0.00 C ATOM 660 C GLU A 41 95.597 1.113 -3.283 1.00 0.00 C ATOM 661 O GLU A 41 95.150 1.794 -4.185 1.00 0.00 O ATOM 662 CB GLU A 41 94.193 -0.920 -3.017 1.00 0.00 C ATOM 663 CG GLU A 41 94.181 -2.444 -3.156 1.00 0.00 C ATOM 664 CD GLU A 41 94.338 -2.824 -4.630 1.00 0.00 C ATOM 665 OE1 GLU A 41 93.494 -2.428 -5.416 1.00 0.00 O ATOM 666 OE2 GLU A 41 95.301 -3.503 -4.947 1.00 0.00 O ATOM 0 H GLU A 41 96.283 -0.980 -1.435 1.00 0.00 H new ATOM 0 HA GLU A 41 95.836 -0.695 -4.385 1.00 0.00 H new ATOM 0 HB2 GLU A 41 93.930 -0.634 -1.999 1.00 0.00 H new ATOM 0 HB3 GLU A 41 93.446 -0.477 -3.675 1.00 0.00 H new ATOM 0 HG2 GLU A 41 94.990 -2.880 -2.569 1.00 0.00 H new ATOM 0 HG3 GLU A 41 93.248 -2.848 -2.763 1.00 0.00 H new ATOM 673 N LEU A 42 96.120 1.646 -2.215 1.00 0.00 N ATOM 674 CA LEU A 42 96.173 3.128 -2.077 1.00 0.00 C ATOM 675 C LEU A 42 97.516 3.532 -1.444 1.00 0.00 C ATOM 676 O LEU A 42 97.575 3.853 -0.273 1.00 0.00 O ATOM 677 CB LEU A 42 95.007 3.588 -1.184 1.00 0.00 C ATOM 678 CG LEU A 42 93.694 3.651 -2.003 1.00 0.00 C ATOM 679 CD1 LEU A 42 92.486 3.429 -1.087 1.00 0.00 C ATOM 680 CD2 LEU A 42 93.567 5.024 -2.677 1.00 0.00 C ATOM 0 H LEU A 42 96.512 1.121 -1.433 1.00 0.00 H new ATOM 0 HA LEU A 42 96.086 3.600 -3.056 1.00 0.00 H new ATOM 0 HB2 LEU A 42 94.888 2.900 -0.347 1.00 0.00 H new ATOM 0 HB3 LEU A 42 95.228 4.569 -0.763 1.00 0.00 H new ATOM 0 HG LEU A 42 93.720 2.869 -2.762 1.00 0.00 H new ATOM 0 HD11 LEU A 42 91.570 3.476 -1.675 1.00 0.00 H new ATOM 0 HD12 LEU A 42 92.563 2.450 -0.613 1.00 0.00 H new ATOM 0 HD13 LEU A 42 92.464 4.203 -0.320 1.00 0.00 H new ATOM 0 HD21 LEU A 42 92.642 5.063 -3.252 1.00 0.00 H new ATOM 0 HD22 LEU A 42 93.554 5.803 -1.915 1.00 0.00 H new ATOM 0 HD23 LEU A 42 94.415 5.182 -3.343 1.00 0.00 H new ATOM 692 N PRO A 43 98.594 3.509 -2.202 1.00 0.00 N ATOM 693 CA PRO A 43 99.936 3.874 -1.659 1.00 0.00 C ATOM 694 C PRO A 43 100.143 5.398 -1.543 1.00 0.00 C ATOM 695 O PRO A 43 99.685 6.021 -0.609 1.00 0.00 O ATOM 696 CB PRO A 43 100.865 3.240 -2.708 1.00 0.00 C ATOM 697 CG PRO A 43 100.061 3.106 -4.010 1.00 0.00 C ATOM 698 CD PRO A 43 98.564 3.112 -3.643 1.00 0.00 C ATOM 0 HA PRO A 43 100.105 3.526 -0.640 1.00 0.00 H new ATOM 0 HB2 PRO A 43 101.748 3.860 -2.864 1.00 0.00 H new ATOM 0 HB3 PRO A 43 101.216 2.265 -2.371 1.00 0.00 H new ATOM 0 HG2 PRO A 43 100.291 3.928 -4.687 1.00 0.00 H new ATOM 0 HG3 PRO A 43 100.324 2.183 -4.528 1.00 0.00 H new ATOM 0 HD2 PRO A 43 97.999 3.820 -4.249 1.00 0.00 H new ATOM 0 HD3 PRO A 43 98.106 2.133 -3.786 1.00 0.00 H new ATOM 706 N SER A 44 100.841 5.998 -2.471 1.00 0.00 N ATOM 707 CA SER A 44 101.091 7.468 -2.406 1.00 0.00 C ATOM 708 C SER A 44 99.766 8.242 -2.421 1.00 0.00 C ATOM 709 O SER A 44 99.604 9.226 -1.734 1.00 0.00 O ATOM 710 CB SER A 44 101.942 7.883 -3.608 1.00 0.00 C ATOM 711 OG SER A 44 103.236 7.306 -3.484 1.00 0.00 O ATOM 0 H SER A 44 101.252 5.528 -3.278 1.00 0.00 H new ATOM 0 HA SER A 44 101.616 7.699 -1.479 1.00 0.00 H new ATOM 0 HB2 SER A 44 101.471 7.554 -4.534 1.00 0.00 H new ATOM 0 HB3 SER A 44 102.018 8.969 -3.658 1.00 0.00 H new ATOM 0 HG SER A 44 103.786 7.567 -4.252 1.00 0.00 H new ATOM 717 N PHE A 45 98.830 7.809 -3.211 1.00 0.00 N ATOM 718 CA PHE A 45 97.515 8.514 -3.301 1.00 0.00 C ATOM 719 C PHE A 45 96.860 8.633 -1.924 1.00 0.00 C ATOM 720 O PHE A 45 95.841 9.276 -1.766 1.00 0.00 O ATOM 721 CB PHE A 45 96.593 7.689 -4.181 1.00 0.00 C ATOM 722 CG PHE A 45 97.086 7.721 -5.605 1.00 0.00 C ATOM 723 CD1 PHE A 45 96.638 8.723 -6.472 1.00 0.00 C ATOM 724 CD2 PHE A 45 97.985 6.749 -6.061 1.00 0.00 C ATOM 725 CE1 PHE A 45 97.090 8.755 -7.797 1.00 0.00 C ATOM 726 CE2 PHE A 45 98.437 6.781 -7.385 1.00 0.00 C ATOM 727 CZ PHE A 45 97.990 7.785 -8.253 1.00 0.00 C ATOM 0 H PHE A 45 98.916 6.987 -3.808 1.00 0.00 H new ATOM 0 HA PHE A 45 97.681 9.512 -3.707 1.00 0.00 H new ATOM 0 HB2 PHE A 45 96.556 6.661 -3.822 1.00 0.00 H new ATOM 0 HB3 PHE A 45 95.577 8.081 -4.129 1.00 0.00 H new ATOM 0 HD1 PHE A 45 95.944 9.472 -6.120 1.00 0.00 H new ATOM 0 HD2 PHE A 45 98.329 5.975 -5.391 1.00 0.00 H new ATOM 0 HE1 PHE A 45 96.744 9.528 -8.467 1.00 0.00 H new ATOM 0 HE2 PHE A 45 99.130 6.032 -7.737 1.00 0.00 H new ATOM 0 HZ PHE A 45 98.340 7.811 -9.274 1.00 0.00 H new ATOM 737 N LEU A 46 97.415 8.001 -0.937 1.00 0.00 N ATOM 738 CA LEU A 46 96.807 8.050 0.429 1.00 0.00 C ATOM 739 C LEU A 46 97.928 8.006 1.448 1.00 0.00 C ATOM 740 O LEU A 46 98.074 8.883 2.276 1.00 0.00 O ATOM 741 CB LEU A 46 95.894 6.832 0.598 1.00 0.00 C ATOM 742 CG LEU A 46 95.133 6.882 1.952 1.00 0.00 C ATOM 743 CD1 LEU A 46 93.711 6.316 1.773 1.00 0.00 C ATOM 744 CD2 LEU A 46 95.877 6.047 3.014 1.00 0.00 C ATOM 0 H LEU A 46 98.269 7.447 -1.010 1.00 0.00 H new ATOM 0 HA LEU A 46 96.223 8.960 0.567 1.00 0.00 H new ATOM 0 HB2 LEU A 46 95.178 6.794 -0.223 1.00 0.00 H new ATOM 0 HB3 LEU A 46 96.488 5.919 0.545 1.00 0.00 H new ATOM 0 HG LEU A 46 95.079 7.920 2.282 1.00 0.00 H new ATOM 0 HD11 LEU A 46 93.182 6.353 2.725 1.00 0.00 H new ATOM 0 HD12 LEU A 46 93.173 6.911 1.035 1.00 0.00 H new ATOM 0 HD13 LEU A 46 93.771 5.283 1.432 1.00 0.00 H new ATOM 0 HD21 LEU A 46 95.333 6.091 3.958 1.00 0.00 H new ATOM 0 HD22 LEU A 46 95.944 5.011 2.681 1.00 0.00 H new ATOM 0 HD23 LEU A 46 96.881 6.448 3.155 1.00 0.00 H new ATOM 756 N GLY A 47 98.749 7.007 1.362 1.00 0.00 N ATOM 757 CA GLY A 47 99.902 6.909 2.286 1.00 0.00 C ATOM 758 C GLY A 47 100.934 7.934 1.833 1.00 0.00 C ATOM 759 O GLY A 47 102.120 7.759 1.998 1.00 0.00 O ATOM 0 H GLY A 47 98.671 6.247 0.686 1.00 0.00 H new ATOM 0 HA2 GLY A 47 99.590 7.105 3.312 1.00 0.00 H new ATOM 0 HA3 GLY A 47 100.325 5.904 2.268 1.00 0.00 H new ATOM 763 N LYS A 48 100.476 9.002 1.236 1.00 0.00 N ATOM 764 CA LYS A 48 101.405 10.052 0.740 1.00 0.00 C ATOM 765 C LYS A 48 102.377 10.468 1.860 1.00 0.00 C ATOM 766 O LYS A 48 103.267 11.266 1.652 1.00 0.00 O ATOM 767 CB LYS A 48 100.580 11.281 0.310 1.00 0.00 C ATOM 768 CG LYS A 48 101.400 12.184 -0.629 1.00 0.00 C ATOM 769 CD LYS A 48 101.323 11.662 -2.067 1.00 0.00 C ATOM 770 CE LYS A 48 102.032 12.637 -3.005 1.00 0.00 C ATOM 771 NZ LYS A 48 101.892 12.158 -4.409 1.00 0.00 N ATOM 0 H LYS A 48 99.487 9.191 1.070 1.00 0.00 H new ATOM 0 HA LYS A 48 101.975 9.662 -0.103 1.00 0.00 H new ATOM 0 HB2 LYS A 48 99.669 10.956 -0.193 1.00 0.00 H new ATOM 0 HB3 LYS A 48 100.274 11.846 1.190 1.00 0.00 H new ATOM 0 HG2 LYS A 48 101.022 13.205 -0.585 1.00 0.00 H new ATOM 0 HG3 LYS A 48 102.439 12.214 -0.301 1.00 0.00 H new ATOM 0 HD2 LYS A 48 101.786 10.677 -2.132 1.00 0.00 H new ATOM 0 HD3 LYS A 48 100.282 11.545 -2.367 1.00 0.00 H new ATOM 0 HE2 LYS A 48 101.603 13.634 -2.904 1.00 0.00 H new ATOM 0 HE3 LYS A 48 103.086 12.715 -2.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 102.374 12.819 -5.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 102.321 11.215 -4.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 100.884 12.105 -4.659 1.00 0.00 H new ATOM 785 N ARG A 49 102.188 9.956 3.050 1.00 0.00 N ATOM 786 CA ARG A 49 103.069 10.335 4.198 1.00 0.00 C ATOM 787 C ARG A 49 103.016 11.848 4.406 1.00 0.00 C ATOM 788 O ARG A 49 103.806 12.408 5.138 1.00 0.00 O ATOM 789 CB ARG A 49 104.527 9.910 3.951 1.00 0.00 C ATOM 790 CG ARG A 49 104.651 8.387 4.026 1.00 0.00 C ATOM 791 CD ARG A 49 106.112 7.982 3.812 1.00 0.00 C ATOM 792 NE ARG A 49 106.968 8.628 4.847 1.00 0.00 N ATOM 793 CZ ARG A 49 108.166 8.166 5.085 1.00 0.00 C ATOM 794 NH1 ARG A 49 108.596 7.108 4.453 1.00 0.00 N ATOM 795 NH2 ARG A 49 108.930 8.754 5.964 1.00 0.00 N ATOM 0 H ARG A 49 101.454 9.285 3.278 1.00 0.00 H new ATOM 0 HA ARG A 49 102.706 9.818 5.086 1.00 0.00 H new ATOM 0 HB2 ARG A 49 104.856 10.262 2.973 1.00 0.00 H new ATOM 0 HB3 ARG A 49 105.179 10.373 4.692 1.00 0.00 H new ATOM 0 HG2 ARG A 49 104.302 8.030 4.995 1.00 0.00 H new ATOM 0 HG3 ARG A 49 104.019 7.922 3.269 1.00 0.00 H new ATOM 0 HD2 ARG A 49 106.211 6.898 3.869 1.00 0.00 H new ATOM 0 HD3 ARG A 49 106.440 8.280 2.816 1.00 0.00 H new ATOM 0 HE ARG A 49 106.618 9.431 5.369 1.00 0.00 H new ATOM 0 HH11 ARG A 49 107.996 6.641 3.773 1.00 0.00 H new ATOM 0 HH12 ARG A 49 109.532 6.748 4.639 1.00 0.00 H new ATOM 0 HH21 ARG A 49 108.592 9.575 6.466 1.00 0.00 H new ATOM 0 HH22 ARG A 49 109.866 8.393 6.149 1.00 0.00 H new ATOM 809 N THR A 50 102.083 12.519 3.783 1.00 0.00 N ATOM 810 CA THR A 50 101.987 13.994 3.972 1.00 0.00 C ATOM 811 C THR A 50 101.454 14.273 5.380 1.00 0.00 C ATOM 812 O THR A 50 101.990 15.077 6.116 1.00 0.00 O ATOM 813 CB THR A 50 101.036 14.588 2.927 1.00 0.00 C ATOM 814 OG1 THR A 50 101.510 14.265 1.627 1.00 0.00 O ATOM 815 CG2 THR A 50 100.985 16.111 3.081 1.00 0.00 C ATOM 0 H THR A 50 101.389 12.112 3.156 1.00 0.00 H new ATOM 0 HA THR A 50 102.969 14.450 3.851 1.00 0.00 H new ATOM 0 HB THR A 50 100.037 14.176 3.071 1.00 0.00 H new ATOM 0 HG1 THR A 50 101.001 14.770 0.959 1.00 0.00 H new ATOM 0 HG21 THR A 50 100.308 16.530 2.336 1.00 0.00 H new ATOM 0 HG22 THR A 50 100.628 16.364 4.079 1.00 0.00 H new ATOM 0 HG23 THR A 50 101.983 16.525 2.937 1.00 0.00 H new ATOM 823 N ASP A 51 100.402 13.598 5.757 1.00 0.00 N ATOM 824 CA ASP A 51 99.818 13.793 7.114 1.00 0.00 C ATOM 825 C ASP A 51 98.828 12.658 7.387 1.00 0.00 C ATOM 826 O ASP A 51 97.649 12.772 7.115 1.00 0.00 O ATOM 827 CB ASP A 51 99.092 15.139 7.174 1.00 0.00 C ATOM 828 CG ASP A 51 98.500 15.341 8.570 1.00 0.00 C ATOM 829 OD1 ASP A 51 97.556 14.641 8.898 1.00 0.00 O ATOM 830 OD2 ASP A 51 99.001 16.192 9.287 1.00 0.00 O ATOM 0 H ASP A 51 99.918 12.913 5.176 1.00 0.00 H new ATOM 0 HA ASP A 51 100.608 13.785 7.865 1.00 0.00 H new ATOM 0 HB2 ASP A 51 99.785 15.948 6.941 1.00 0.00 H new ATOM 0 HB3 ASP A 51 98.301 15.171 6.425 1.00 0.00 H new ATOM 835 N GLU A 52 99.297 11.557 7.906 1.00 0.00 N ATOM 836 CA GLU A 52 98.381 10.410 8.173 1.00 0.00 C ATOM 837 C GLU A 52 97.615 10.645 9.480 1.00 0.00 C ATOM 838 O GLU A 52 96.427 10.891 9.472 1.00 0.00 O ATOM 839 CB GLU A 52 99.210 9.128 8.278 1.00 0.00 C ATOM 840 CG GLU A 52 99.822 8.803 6.914 1.00 0.00 C ATOM 841 CD GLU A 52 100.651 7.523 7.016 1.00 0.00 C ATOM 842 OE1 GLU A 52 100.861 7.063 8.127 1.00 0.00 O ATOM 843 OE2 GLU A 52 101.058 7.019 5.982 1.00 0.00 O ATOM 0 H GLU A 52 100.273 11.401 8.157 1.00 0.00 H new ATOM 0 HA GLU A 52 97.662 10.318 7.359 1.00 0.00 H new ATOM 0 HB2 GLU A 52 99.997 9.251 9.022 1.00 0.00 H new ATOM 0 HB3 GLU A 52 98.582 8.302 8.613 1.00 0.00 H new ATOM 0 HG2 GLU A 52 99.034 8.680 6.171 1.00 0.00 H new ATOM 0 HG3 GLU A 52 100.450 9.629 6.580 1.00 0.00 H new ATOM 850 N ALA A 53 98.295 10.580 10.597 1.00 0.00 N ATOM 851 CA ALA A 53 97.638 10.804 11.927 1.00 0.00 C ATOM 852 C ALA A 53 96.238 10.176 11.976 1.00 0.00 C ATOM 853 O ALA A 53 96.064 9.068 12.438 1.00 0.00 O ATOM 854 CB ALA A 53 97.532 12.307 12.191 1.00 0.00 C ATOM 0 H ALA A 53 99.294 10.378 10.647 1.00 0.00 H new ATOM 0 HA ALA A 53 98.249 10.327 12.694 1.00 0.00 H new ATOM 0 HB1 ALA A 53 97.055 12.474 13.157 1.00 0.00 H new ATOM 0 HB2 ALA A 53 98.529 12.746 12.198 1.00 0.00 H new ATOM 0 HB3 ALA A 53 96.936 12.773 11.406 1.00 0.00 H new ATOM 860 N ALA A 54 95.234 10.871 11.518 1.00 0.00 N ATOM 861 CA ALA A 54 93.858 10.300 11.562 1.00 0.00 C ATOM 862 C ALA A 54 93.874 8.918 10.932 1.00 0.00 C ATOM 863 O ALA A 54 93.301 7.979 11.446 1.00 0.00 O ATOM 864 CB ALA A 54 92.918 11.201 10.772 1.00 0.00 C ATOM 0 H ALA A 54 95.306 11.806 11.117 1.00 0.00 H new ATOM 0 HA ALA A 54 93.518 10.230 12.595 1.00 0.00 H new ATOM 0 HB1 ALA A 54 91.909 10.789 10.800 1.00 0.00 H new ATOM 0 HB2 ALA A 54 92.915 12.198 11.212 1.00 0.00 H new ATOM 0 HB3 ALA A 54 93.256 11.262 9.738 1.00 0.00 H new ATOM 870 N PHE A 55 94.540 8.773 9.836 1.00 0.00 N ATOM 871 CA PHE A 55 94.608 7.442 9.199 1.00 0.00 C ATOM 872 C PHE A 55 95.255 6.474 10.185 1.00 0.00 C ATOM 873 O PHE A 55 94.842 5.339 10.320 1.00 0.00 O ATOM 874 CB PHE A 55 95.451 7.532 7.939 1.00 0.00 C ATOM 875 CG PHE A 55 94.650 8.205 6.850 1.00 0.00 C ATOM 876 CD1 PHE A 55 93.846 7.440 5.998 1.00 0.00 C ATOM 877 CD2 PHE A 55 94.707 9.596 6.699 1.00 0.00 C ATOM 878 CE1 PHE A 55 93.098 8.067 4.994 1.00 0.00 C ATOM 879 CE2 PHE A 55 93.959 10.221 5.695 1.00 0.00 C ATOM 880 CZ PHE A 55 93.155 9.457 4.842 1.00 0.00 C ATOM 0 H PHE A 55 95.041 9.517 9.351 1.00 0.00 H new ATOM 0 HA PHE A 55 93.610 7.093 8.934 1.00 0.00 H new ATOM 0 HB2 PHE A 55 96.363 8.096 8.137 1.00 0.00 H new ATOM 0 HB3 PHE A 55 95.756 6.535 7.619 1.00 0.00 H new ATOM 0 HD1 PHE A 55 93.802 6.367 6.115 1.00 0.00 H new ATOM 0 HD2 PHE A 55 95.328 10.186 7.357 1.00 0.00 H new ATOM 0 HE1 PHE A 55 92.477 7.477 4.336 1.00 0.00 H new ATOM 0 HE2 PHE A 55 94.002 11.294 5.578 1.00 0.00 H new ATOM 0 HZ PHE A 55 92.579 9.940 4.067 1.00 0.00 H new ATOM 890 N GLN A 56 96.264 6.920 10.888 1.00 0.00 N ATOM 891 CA GLN A 56 96.922 6.019 11.876 1.00 0.00 C ATOM 892 C GLN A 56 95.912 5.667 12.950 1.00 0.00 C ATOM 893 O GLN A 56 95.940 4.596 13.519 1.00 0.00 O ATOM 894 CB GLN A 56 98.137 6.698 12.523 1.00 0.00 C ATOM 895 CG GLN A 56 99.261 6.841 11.498 1.00 0.00 C ATOM 896 CD GLN A 56 100.466 7.519 12.152 1.00 0.00 C ATOM 897 OE1 GLN A 56 100.884 7.136 13.227 1.00 0.00 O ATOM 898 NE2 GLN A 56 101.043 8.522 11.548 1.00 0.00 N ATOM 0 H GLN A 56 96.656 7.859 10.821 1.00 0.00 H new ATOM 0 HA GLN A 56 97.270 5.123 11.362 1.00 0.00 H new ATOM 0 HB2 GLN A 56 97.855 7.679 12.906 1.00 0.00 H new ATOM 0 HB3 GLN A 56 98.482 6.111 13.374 1.00 0.00 H new ATOM 0 HG2 GLN A 56 99.545 5.861 11.116 1.00 0.00 H new ATOM 0 HG3 GLN A 56 98.918 7.428 10.646 1.00 0.00 H new ATOM 0 HE21 GLN A 56 100.693 8.844 10.646 1.00 0.00 H new ATOM 0 HE22 GLN A 56 101.844 8.984 11.978 1.00 0.00 H new ATOM 907 N LYS A 57 95.003 6.554 13.215 1.00 0.00 N ATOM 908 CA LYS A 57 93.974 6.259 14.245 1.00 0.00 C ATOM 909 C LYS A 57 93.062 5.189 13.675 1.00 0.00 C ATOM 910 O LYS A 57 92.662 4.262 14.351 1.00 0.00 O ATOM 911 CB LYS A 57 93.152 7.509 14.605 1.00 0.00 C ATOM 912 CG LYS A 57 94.030 8.517 15.365 1.00 0.00 C ATOM 913 CD LYS A 57 93.158 9.539 16.117 1.00 0.00 C ATOM 914 CE LYS A 57 92.584 10.569 15.141 1.00 0.00 C ATOM 915 NZ LYS A 57 91.699 11.512 15.882 1.00 0.00 N ATOM 0 H LYS A 57 94.926 7.467 12.767 1.00 0.00 H new ATOM 0 HA LYS A 57 94.460 5.924 15.161 1.00 0.00 H new ATOM 0 HB2 LYS A 57 92.758 7.969 13.698 1.00 0.00 H new ATOM 0 HB3 LYS A 57 92.295 7.227 15.217 1.00 0.00 H new ATOM 0 HG2 LYS A 57 94.671 7.989 16.071 1.00 0.00 H new ATOM 0 HG3 LYS A 57 94.686 9.036 14.666 1.00 0.00 H new ATOM 0 HD2 LYS A 57 92.347 9.025 16.633 1.00 0.00 H new ATOM 0 HD3 LYS A 57 93.752 10.042 16.880 1.00 0.00 H new ATOM 0 HE2 LYS A 57 93.392 11.116 14.656 1.00 0.00 H new ATOM 0 HE3 LYS A 57 92.021 10.067 14.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 91.308 12.213 15.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 90.921 10.983 16.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 92.250 11.999 16.617 1.00 0.00 H new ATOM 929 N LEU A 58 92.756 5.304 12.417 1.00 0.00 N ATOM 930 CA LEU A 58 91.895 4.287 11.773 1.00 0.00 C ATOM 931 C LEU A 58 92.673 2.989 11.802 1.00 0.00 C ATOM 932 O LEU A 58 92.149 1.934 12.080 1.00 0.00 O ATOM 933 CB LEU A 58 91.600 4.698 10.324 1.00 0.00 C ATOM 934 CG LEU A 58 90.681 3.663 9.656 1.00 0.00 C ATOM 935 CD1 LEU A 58 89.284 3.697 10.305 1.00 0.00 C ATOM 936 CD2 LEU A 58 90.565 3.992 8.163 1.00 0.00 C ATOM 0 H LEU A 58 93.067 6.061 11.808 1.00 0.00 H new ATOM 0 HA LEU A 58 90.941 4.184 12.290 1.00 0.00 H new ATOM 0 HB2 LEU A 58 91.128 5.680 10.306 1.00 0.00 H new ATOM 0 HB3 LEU A 58 92.532 4.782 9.765 1.00 0.00 H new ATOM 0 HG LEU A 58 91.102 2.666 9.785 1.00 0.00 H new ATOM 0 HD11 LEU A 58 88.641 2.960 9.824 1.00 0.00 H new ATOM 0 HD12 LEU A 58 89.370 3.466 11.367 1.00 0.00 H new ATOM 0 HD13 LEU A 58 88.851 4.690 10.184 1.00 0.00 H new ATOM 0 HD21 LEU A 58 89.915 3.263 7.679 1.00 0.00 H new ATOM 0 HD22 LEU A 58 90.144 4.990 8.042 1.00 0.00 H new ATOM 0 HD23 LEU A 58 91.553 3.957 7.705 1.00 0.00 H new ATOM 948 N MET A 59 93.943 3.068 11.549 1.00 0.00 N ATOM 949 CA MET A 59 94.768 1.846 11.607 1.00 0.00 C ATOM 950 C MET A 59 94.870 1.436 13.064 1.00 0.00 C ATOM 951 O MET A 59 94.846 0.268 13.398 1.00 0.00 O ATOM 952 CB MET A 59 96.161 2.118 11.044 1.00 0.00 C ATOM 953 CG MET A 59 96.050 2.434 9.553 1.00 0.00 C ATOM 954 SD MET A 59 97.649 3.013 8.936 1.00 0.00 S ATOM 955 CE MET A 59 97.126 3.331 7.234 1.00 0.00 C ATOM 0 H MET A 59 94.441 3.924 11.306 1.00 0.00 H new ATOM 0 HA MET A 59 94.315 1.053 11.012 1.00 0.00 H new ATOM 0 HB2 MET A 59 96.622 2.953 11.571 1.00 0.00 H new ATOM 0 HB3 MET A 59 96.803 1.251 11.197 1.00 0.00 H new ATOM 0 HG2 MET A 59 95.737 1.545 9.005 1.00 0.00 H new ATOM 0 HG3 MET A 59 95.288 3.195 9.388 1.00 0.00 H new ATOM 0 HE1 MET A 59 97.972 3.704 6.657 1.00 0.00 H new ATOM 0 HE2 MET A 59 96.761 2.406 6.787 1.00 0.00 H new ATOM 0 HE3 MET A 59 96.329 4.074 7.231 1.00 0.00 H new ATOM 965 N SER A 60 94.965 2.395 13.944 1.00 0.00 N ATOM 966 CA SER A 60 95.045 2.038 15.389 1.00 0.00 C ATOM 967 C SER A 60 93.769 1.301 15.769 1.00 0.00 C ATOM 968 O SER A 60 93.749 0.520 16.700 1.00 0.00 O ATOM 969 CB SER A 60 95.179 3.291 16.252 1.00 0.00 C ATOM 970 OG SER A 60 96.260 4.083 15.777 1.00 0.00 O ATOM 0 H SER A 60 94.990 3.392 13.731 1.00 0.00 H new ATOM 0 HA SER A 60 95.921 1.411 15.557 1.00 0.00 H new ATOM 0 HB2 SER A 60 94.253 3.866 16.223 1.00 0.00 H new ATOM 0 HB3 SER A 60 95.348 3.012 17.292 1.00 0.00 H new ATOM 0 HG SER A 60 96.060 4.399 14.871 1.00 0.00 H new ATOM 976 N ASN A 61 92.701 1.523 15.049 1.00 0.00 N ATOM 977 CA ASN A 61 91.446 0.800 15.388 1.00 0.00 C ATOM 978 C ASN A 61 91.721 -0.676 15.169 1.00 0.00 C ATOM 979 O ASN A 61 91.221 -1.530 15.866 1.00 0.00 O ATOM 980 CB ASN A 61 90.281 1.250 14.504 1.00 0.00 C ATOM 981 CG ASN A 61 89.971 2.723 14.774 1.00 0.00 C ATOM 982 OD1 ASN A 61 90.329 3.254 15.805 1.00 0.00 O ATOM 983 ND2 ASN A 61 89.310 3.409 13.883 1.00 0.00 N ATOM 0 H ASN A 61 92.645 2.162 14.256 1.00 0.00 H new ATOM 0 HA ASN A 61 91.160 1.009 16.419 1.00 0.00 H new ATOM 0 HB2 ASN A 61 90.533 1.108 13.453 1.00 0.00 H new ATOM 0 HB3 ASN A 61 89.401 0.640 14.706 1.00 0.00 H new ATOM 0 HD21 ASN A 61 89.094 4.391 14.053 1.00 0.00 H new ATOM 0 HD22 ASN A 61 89.009 2.963 13.016 1.00 0.00 H new ATOM 990 N LEU A 62 92.553 -0.982 14.214 1.00 0.00 N ATOM 991 CA LEU A 62 92.899 -2.404 13.975 1.00 0.00 C ATOM 992 C LEU A 62 93.512 -2.897 15.277 1.00 0.00 C ATOM 993 O LEU A 62 93.307 -4.015 15.706 1.00 0.00 O ATOM 994 CB LEU A 62 93.941 -2.510 12.854 1.00 0.00 C ATOM 995 CG LEU A 62 93.498 -1.716 11.617 1.00 0.00 C ATOM 996 CD1 LEU A 62 94.702 -1.558 10.681 1.00 0.00 C ATOM 997 CD2 LEU A 62 92.376 -2.452 10.872 1.00 0.00 C ATOM 0 H LEU A 62 93.005 -0.311 13.593 1.00 0.00 H new ATOM 0 HA LEU A 62 92.026 -2.986 13.680 1.00 0.00 H new ATOM 0 HB2 LEU A 62 94.901 -2.134 13.208 1.00 0.00 H new ATOM 0 HB3 LEU A 62 94.088 -3.556 12.586 1.00 0.00 H new ATOM 0 HG LEU A 62 93.124 -0.742 11.933 1.00 0.00 H new ATOM 0 HD11 LEU A 62 94.404 -0.995 9.796 1.00 0.00 H new ATOM 0 HD12 LEU A 62 95.498 -1.024 11.199 1.00 0.00 H new ATOM 0 HD13 LEU A 62 95.061 -2.542 10.381 1.00 0.00 H new ATOM 0 HD21 LEU A 62 92.077 -1.872 9.999 1.00 0.00 H new ATOM 0 HD22 LEU A 62 92.733 -3.431 10.552 1.00 0.00 H new ATOM 0 HD23 LEU A 62 91.520 -2.577 11.535 1.00 0.00 H new ATOM 1009 N ASP A 63 94.237 -2.028 15.924 1.00 0.00 N ATOM 1010 CA ASP A 63 94.853 -2.374 17.225 1.00 0.00 C ATOM 1011 C ASP A 63 93.818 -2.106 18.321 1.00 0.00 C ATOM 1012 O ASP A 63 94.129 -2.100 19.495 1.00 0.00 O ATOM 1013 CB ASP A 63 96.085 -1.498 17.464 1.00 0.00 C ATOM 1014 CG ASP A 63 97.159 -1.830 16.428 1.00 0.00 C ATOM 1015 OD1 ASP A 63 97.053 -2.875 15.806 1.00 0.00 O ATOM 1016 OD2 ASP A 63 98.072 -1.036 16.275 1.00 0.00 O ATOM 0 H ASP A 63 94.429 -1.081 15.598 1.00 0.00 H new ATOM 0 HA ASP A 63 95.159 -3.420 17.232 1.00 0.00 H new ATOM 0 HB2 ASP A 63 95.813 -0.445 17.396 1.00 0.00 H new ATOM 0 HB3 ASP A 63 96.472 -1.663 18.470 1.00 0.00 H new ATOM 1021 N SER A 64 92.585 -1.864 17.939 1.00 0.00 N ATOM 1022 CA SER A 64 91.536 -1.573 18.958 1.00 0.00 C ATOM 1023 C SER A 64 91.497 -2.707 19.981 1.00 0.00 C ATOM 1024 O SER A 64 92.262 -2.731 20.920 1.00 0.00 O ATOM 1025 CB SER A 64 90.160 -1.486 18.289 1.00 0.00 C ATOM 1026 OG SER A 64 89.155 -1.432 19.292 1.00 0.00 O ATOM 0 H SER A 64 92.265 -1.856 16.970 1.00 0.00 H new ATOM 0 HA SER A 64 91.773 -0.626 19.442 1.00 0.00 H new ATOM 0 HB2 SER A 64 90.106 -0.601 17.655 1.00 0.00 H new ATOM 0 HB3 SER A 64 90.001 -2.350 17.644 1.00 0.00 H new ATOM 0 HG SER A 64 88.273 -1.375 18.869 1.00 0.00 H new ATOM 1032 N ASN A 65 90.612 -3.650 19.784 1.00 0.00 N ATOM 1033 CA ASN A 65 90.493 -4.809 20.718 1.00 0.00 C ATOM 1034 C ASN A 65 89.537 -5.837 20.098 1.00 0.00 C ATOM 1035 O ASN A 65 89.924 -6.930 19.738 1.00 0.00 O ATOM 1036 CB ASN A 65 89.923 -4.335 22.068 1.00 0.00 C ATOM 1037 CG ASN A 65 91.035 -3.727 22.927 1.00 0.00 C ATOM 1038 OD1 ASN A 65 92.080 -4.322 23.099 1.00 0.00 O ATOM 1039 ND2 ASN A 65 90.857 -2.554 23.471 1.00 0.00 N ATOM 0 H ASN A 65 89.956 -3.666 19.003 1.00 0.00 H new ATOM 0 HA ASN A 65 91.474 -5.254 20.882 1.00 0.00 H new ATOM 0 HB2 ASN A 65 89.138 -3.597 21.901 1.00 0.00 H new ATOM 0 HB3 ASN A 65 89.466 -5.174 22.593 1.00 0.00 H new ATOM 0 HD21 ASN A 65 91.595 -2.138 24.040 1.00 0.00 H new ATOM 0 HD22 ASN A 65 89.980 -2.053 23.328 1.00 0.00 H new ATOM 1046 N ARG A 66 88.287 -5.477 19.977 1.00 0.00 N ATOM 1047 CA ARG A 66 87.276 -6.403 19.388 1.00 0.00 C ATOM 1048 C ARG A 66 87.640 -6.736 17.933 1.00 0.00 C ATOM 1049 O ARG A 66 87.472 -7.851 17.484 1.00 0.00 O ATOM 1050 CB ARG A 66 85.895 -5.739 19.438 1.00 0.00 C ATOM 1051 CG ARG A 66 84.831 -6.708 18.910 1.00 0.00 C ATOM 1052 CD ARG A 66 83.457 -6.038 18.964 1.00 0.00 C ATOM 1053 NE ARG A 66 83.400 -4.947 17.952 1.00 0.00 N ATOM 1054 CZ ARG A 66 82.249 -4.454 17.582 1.00 0.00 C ATOM 1055 NH1 ARG A 66 81.141 -4.918 18.094 1.00 0.00 N ATOM 1056 NH2 ARG A 66 82.208 -3.496 16.697 1.00 0.00 N ATOM 0 H ARG A 66 87.919 -4.570 20.265 1.00 0.00 H new ATOM 0 HA ARG A 66 87.261 -7.329 19.963 1.00 0.00 H new ATOM 0 HB2 ARG A 66 85.659 -5.448 20.461 1.00 0.00 H new ATOM 0 HB3 ARG A 66 85.898 -4.828 18.840 1.00 0.00 H new ATOM 0 HG2 ARG A 66 85.065 -6.999 17.886 1.00 0.00 H new ATOM 0 HG3 ARG A 66 84.826 -7.620 19.507 1.00 0.00 H new ATOM 0 HD2 ARG A 66 82.674 -6.771 18.769 1.00 0.00 H new ATOM 0 HD3 ARG A 66 83.275 -5.635 19.960 1.00 0.00 H new ATOM 0 HE ARG A 66 84.263 -4.584 17.547 1.00 0.00 H new ATOM 0 HH11 ARG A 66 81.173 -5.668 18.785 1.00 0.00 H new ATOM 0 HH12 ARG A 66 80.243 -4.531 17.803 1.00 0.00 H new ATOM 0 HH21 ARG A 66 83.074 -3.134 16.296 1.00 0.00 H new ATOM 0 HH22 ARG A 66 81.310 -3.109 16.406 1.00 0.00 H new ATOM 1070 N ASP A 67 88.119 -5.773 17.187 1.00 0.00 N ATOM 1071 CA ASP A 67 88.467 -6.037 15.758 1.00 0.00 C ATOM 1072 C ASP A 67 89.447 -7.207 15.664 1.00 0.00 C ATOM 1073 O ASP A 67 90.353 -7.338 16.463 1.00 0.00 O ATOM 1074 CB ASP A 67 89.119 -4.792 15.153 1.00 0.00 C ATOM 1075 CG ASP A 67 88.076 -3.684 15.000 1.00 0.00 C ATOM 1076 OD1 ASP A 67 86.907 -4.012 14.876 1.00 0.00 O ATOM 1077 OD2 ASP A 67 88.464 -2.528 15.010 1.00 0.00 O ATOM 0 H ASP A 67 88.284 -4.818 17.505 1.00 0.00 H new ATOM 0 HA ASP A 67 87.556 -6.283 15.212 1.00 0.00 H new ATOM 0 HB2 ASP A 67 89.934 -4.451 15.791 1.00 0.00 H new ATOM 0 HB3 ASP A 67 89.553 -5.033 14.182 1.00 0.00 H new ATOM 1082 N ASN A 68 89.271 -8.062 14.688 1.00 0.00 N ATOM 1083 CA ASN A 68 90.188 -9.229 14.533 1.00 0.00 C ATOM 1084 C ASN A 68 90.279 -9.626 13.054 1.00 0.00 C ATOM 1085 O ASN A 68 91.356 -9.810 12.521 1.00 0.00 O ATOM 1086 CB ASN A 68 89.641 -10.405 15.345 1.00 0.00 C ATOM 1087 CG ASN A 68 90.676 -11.533 15.376 1.00 0.00 C ATOM 1088 OD1 ASN A 68 91.774 -11.353 15.864 1.00 0.00 O ATOM 1089 ND2 ASN A 68 90.367 -12.695 14.871 1.00 0.00 N ATOM 0 H ASN A 68 88.529 -8.001 13.991 1.00 0.00 H new ATOM 0 HA ASN A 68 91.182 -8.962 14.892 1.00 0.00 H new ATOM 0 HB2 ASN A 68 89.409 -10.083 16.360 1.00 0.00 H new ATOM 0 HB3 ASN A 68 88.711 -10.763 14.904 1.00 0.00 H new ATOM 0 HD21 ASN A 68 91.048 -13.455 14.885 1.00 0.00 H new ATOM 0 HD22 ASN A 68 89.445 -12.844 14.462 1.00 0.00 H new ATOM 1096 N GLU A 69 89.153 -9.771 12.393 1.00 0.00 N ATOM 1097 CA GLU A 69 89.149 -10.171 10.944 1.00 0.00 C ATOM 1098 C GLU A 69 88.369 -9.137 10.119 1.00 0.00 C ATOM 1099 O GLU A 69 87.639 -8.326 10.652 1.00 0.00 O ATOM 1100 CB GLU A 69 88.477 -11.541 10.810 1.00 0.00 C ATOM 1101 CG GLU A 69 88.806 -12.152 9.449 1.00 0.00 C ATOM 1102 CD GLU A 69 88.251 -13.574 9.385 1.00 0.00 C ATOM 1103 OE1 GLU A 69 87.204 -13.808 9.966 1.00 0.00 O ATOM 1104 OE2 GLU A 69 88.883 -14.408 8.756 1.00 0.00 O ATOM 0 H GLU A 69 88.228 -9.628 12.798 1.00 0.00 H new ATOM 0 HA GLU A 69 90.174 -10.220 10.576 1.00 0.00 H new ATOM 0 HB2 GLU A 69 88.818 -12.202 11.607 1.00 0.00 H new ATOM 0 HB3 GLU A 69 87.397 -11.438 10.921 1.00 0.00 H new ATOM 0 HG2 GLU A 69 88.376 -11.546 8.652 1.00 0.00 H new ATOM 0 HG3 GLU A 69 89.885 -12.163 9.294 1.00 0.00 H new ATOM 1111 N VAL A 70 88.523 -9.168 8.818 1.00 0.00 N ATOM 1112 CA VAL A 70 87.799 -8.202 7.929 1.00 0.00 C ATOM 1113 C VAL A 70 86.826 -8.962 7.046 1.00 0.00 C ATOM 1114 O VAL A 70 87.209 -9.626 6.105 1.00 0.00 O ATOM 1115 CB VAL A 70 88.824 -7.504 7.033 1.00 0.00 C ATOM 1116 CG1 VAL A 70 88.247 -6.218 6.462 1.00 0.00 C ATOM 1117 CG2 VAL A 70 90.058 -7.171 7.850 1.00 0.00 C ATOM 0 H VAL A 70 89.126 -9.828 8.327 1.00 0.00 H new ATOM 0 HA VAL A 70 87.259 -7.475 8.535 1.00 0.00 H new ATOM 0 HB VAL A 70 89.083 -8.172 6.212 1.00 0.00 H new ATOM 0 HG11 VAL A 70 88.991 -5.736 5.827 1.00 0.00 H new ATOM 0 HG12 VAL A 70 87.360 -6.448 5.871 1.00 0.00 H new ATOM 0 HG13 VAL A 70 87.976 -5.547 7.277 1.00 0.00 H new ATOM 0 HG21 VAL A 70 90.791 -6.673 7.215 1.00 0.00 H new ATOM 0 HG22 VAL A 70 89.783 -6.511 8.673 1.00 0.00 H new ATOM 0 HG23 VAL A 70 90.488 -8.089 8.250 1.00 0.00 H new ATOM 1127 N ASP A 71 85.570 -8.824 7.310 1.00 0.00 N ATOM 1128 CA ASP A 71 84.568 -9.489 6.449 1.00 0.00 C ATOM 1129 C ASP A 71 84.419 -8.589 5.232 1.00 0.00 C ATOM 1130 O ASP A 71 84.966 -7.504 5.202 1.00 0.00 O ATOM 1131 CB ASP A 71 83.233 -9.607 7.193 1.00 0.00 C ATOM 1132 CG ASP A 71 82.309 -10.571 6.446 1.00 0.00 C ATOM 1133 OD1 ASP A 71 82.573 -10.837 5.285 1.00 0.00 O ATOM 1134 OD2 ASP A 71 81.354 -11.031 7.049 1.00 0.00 O ATOM 0 H ASP A 71 85.190 -8.280 8.085 1.00 0.00 H new ATOM 0 HA ASP A 71 84.873 -10.497 6.169 1.00 0.00 H new ATOM 0 HB2 ASP A 71 83.402 -9.964 8.209 1.00 0.00 H new ATOM 0 HB3 ASP A 71 82.763 -8.627 7.274 1.00 0.00 H new ATOM 1139 N PHE A 72 83.698 -8.985 4.235 1.00 0.00 N ATOM 1140 CA PHE A 72 83.560 -8.088 3.073 1.00 0.00 C ATOM 1141 C PHE A 72 82.953 -6.777 3.566 1.00 0.00 C ATOM 1142 O PHE A 72 83.331 -5.700 3.148 1.00 0.00 O ATOM 1143 CB PHE A 72 82.646 -8.732 2.034 1.00 0.00 C ATOM 1144 CG PHE A 72 82.455 -7.761 0.906 1.00 0.00 C ATOM 1145 CD1 PHE A 72 83.392 -7.698 -0.127 1.00 0.00 C ATOM 1146 CD2 PHE A 72 81.346 -6.914 0.903 1.00 0.00 C ATOM 1147 CE1 PHE A 72 83.221 -6.782 -1.167 1.00 0.00 C ATOM 1148 CE2 PHE A 72 81.170 -6.001 -0.136 1.00 0.00 C ATOM 1149 CZ PHE A 72 82.107 -5.931 -1.174 1.00 0.00 C ATOM 0 H PHE A 72 83.205 -9.876 4.173 1.00 0.00 H new ATOM 0 HA PHE A 72 84.530 -7.904 2.611 1.00 0.00 H new ATOM 0 HB2 PHE A 72 83.084 -9.660 1.666 1.00 0.00 H new ATOM 0 HB3 PHE A 72 81.685 -8.989 2.481 1.00 0.00 H new ATOM 0 HD1 PHE A 72 84.248 -8.357 -0.122 1.00 0.00 H new ATOM 0 HD2 PHE A 72 80.624 -6.966 1.705 1.00 0.00 H new ATOM 0 HE1 PHE A 72 83.946 -6.729 -1.965 1.00 0.00 H new ATOM 0 HE2 PHE A 72 80.310 -5.347 -0.140 1.00 0.00 H new ATOM 0 HZ PHE A 72 81.972 -5.223 -1.978 1.00 0.00 H new ATOM 1159 N GLN A 73 82.012 -6.872 4.457 1.00 0.00 N ATOM 1160 CA GLN A 73 81.358 -5.657 5.005 1.00 0.00 C ATOM 1161 C GLN A 73 82.348 -4.832 5.847 1.00 0.00 C ATOM 1162 O GLN A 73 82.341 -3.618 5.790 1.00 0.00 O ATOM 1163 CB GLN A 73 80.170 -6.078 5.872 1.00 0.00 C ATOM 1164 CG GLN A 73 79.465 -4.839 6.425 1.00 0.00 C ATOM 1165 CD GLN A 73 78.203 -5.267 7.176 1.00 0.00 C ATOM 1166 OE1 GLN A 73 77.793 -6.408 7.096 1.00 0.00 O ATOM 1167 NE2 GLN A 73 77.569 -4.395 7.910 1.00 0.00 N ATOM 0 H GLN A 73 81.663 -7.753 4.834 1.00 0.00 H new ATOM 0 HA GLN A 73 81.016 -5.037 4.176 1.00 0.00 H new ATOM 0 HB2 GLN A 73 79.471 -6.672 5.283 1.00 0.00 H new ATOM 0 HB3 GLN A 73 80.513 -6.709 6.692 1.00 0.00 H new ATOM 0 HG2 GLN A 73 80.132 -4.295 7.093 1.00 0.00 H new ATOM 0 HG3 GLN A 73 79.206 -4.161 5.612 1.00 0.00 H new ATOM 0 HE21 GLN A 73 77.914 -3.437 7.977 1.00 0.00 H new ATOM 0 HE22 GLN A 73 76.728 -4.671 8.417 1.00 0.00 H new ATOM 1176 N GLU A 74 83.195 -5.456 6.639 1.00 0.00 N ATOM 1177 CA GLU A 74 84.142 -4.662 7.464 1.00 0.00 C ATOM 1178 C GLU A 74 85.107 -3.906 6.565 1.00 0.00 C ATOM 1179 O GLU A 74 85.439 -2.766 6.819 1.00 0.00 O ATOM 1180 CB GLU A 74 84.912 -5.598 8.392 1.00 0.00 C ATOM 1181 CG GLU A 74 83.971 -6.142 9.468 1.00 0.00 C ATOM 1182 CD GLU A 74 84.722 -7.147 10.343 1.00 0.00 C ATOM 1183 OE1 GLU A 74 85.482 -6.710 11.193 1.00 0.00 O ATOM 1184 OE2 GLU A 74 84.530 -8.334 10.146 1.00 0.00 O ATOM 0 H GLU A 74 83.264 -6.468 6.743 1.00 0.00 H new ATOM 0 HA GLU A 74 83.585 -3.940 8.062 1.00 0.00 H new ATOM 0 HB2 GLU A 74 85.342 -6.421 7.820 1.00 0.00 H new ATOM 0 HB3 GLU A 74 85.742 -5.065 8.856 1.00 0.00 H new ATOM 0 HG2 GLU A 74 83.590 -5.324 10.080 1.00 0.00 H new ATOM 0 HG3 GLU A 74 83.109 -6.621 9.004 1.00 0.00 H new ATOM 1191 N TYR A 75 85.563 -4.522 5.516 1.00 0.00 N ATOM 1192 CA TYR A 75 86.510 -3.816 4.619 1.00 0.00 C ATOM 1193 C TYR A 75 85.820 -2.551 4.100 1.00 0.00 C ATOM 1194 O TYR A 75 86.415 -1.497 3.998 1.00 0.00 O ATOM 1195 CB TYR A 75 86.880 -4.736 3.447 1.00 0.00 C ATOM 1196 CG TYR A 75 87.481 -3.927 2.312 1.00 0.00 C ATOM 1197 CD1 TYR A 75 88.598 -3.116 2.547 1.00 0.00 C ATOM 1198 CD2 TYR A 75 86.912 -3.978 1.031 1.00 0.00 C ATOM 1199 CE1 TYR A 75 89.146 -2.359 1.504 1.00 0.00 C ATOM 1200 CE2 TYR A 75 87.460 -3.220 -0.010 1.00 0.00 C ATOM 1201 CZ TYR A 75 88.577 -2.411 0.226 1.00 0.00 C ATOM 1202 OH TYR A 75 89.117 -1.664 -0.802 1.00 0.00 O ATOM 0 H TYR A 75 85.324 -5.475 5.243 1.00 0.00 H new ATOM 0 HA TYR A 75 87.421 -3.548 5.154 1.00 0.00 H new ATOM 0 HB2 TYR A 75 87.591 -5.492 3.780 1.00 0.00 H new ATOM 0 HB3 TYR A 75 85.993 -5.264 3.096 1.00 0.00 H new ATOM 0 HD1 TYR A 75 89.037 -3.074 3.533 1.00 0.00 H new ATOM 0 HD2 TYR A 75 86.050 -4.603 0.848 1.00 0.00 H new ATOM 0 HE1 TYR A 75 90.008 -1.735 1.686 1.00 0.00 H new ATOM 0 HE2 TYR A 75 87.021 -3.259 -0.996 1.00 0.00 H new ATOM 0 HH TYR A 75 88.603 -1.816 -1.622 1.00 0.00 H new ATOM 1212 N CYS A 76 84.563 -2.655 3.785 1.00 0.00 N ATOM 1213 CA CYS A 76 83.809 -1.479 3.287 1.00 0.00 C ATOM 1214 C CYS A 76 83.648 -0.480 4.424 1.00 0.00 C ATOM 1215 O CYS A 76 83.764 0.713 4.230 1.00 0.00 O ATOM 1216 CB CYS A 76 82.428 -1.921 2.795 1.00 0.00 C ATOM 1217 SG CYS A 76 82.601 -3.397 1.761 1.00 0.00 S ATOM 0 H CYS A 76 84.020 -3.516 3.853 1.00 0.00 H new ATOM 0 HA CYS A 76 84.351 -1.018 2.461 1.00 0.00 H new ATOM 0 HB2 CYS A 76 81.778 -2.133 3.644 1.00 0.00 H new ATOM 0 HB3 CYS A 76 81.958 -1.118 2.226 1.00 0.00 H new ATOM 0 HG CYS A 76 82.965 -4.404 2.499 1.00 0.00 H new ATOM 1223 N VAL A 77 83.388 -0.946 5.619 1.00 0.00 N ATOM 1224 CA VAL A 77 83.239 0.017 6.735 1.00 0.00 C ATOM 1225 C VAL A 77 84.552 0.782 6.856 1.00 0.00 C ATOM 1226 O VAL A 77 84.569 1.985 7.027 1.00 0.00 O ATOM 1227 CB VAL A 77 82.942 -0.736 8.034 1.00 0.00 C ATOM 1228 CG1 VAL A 77 83.035 0.227 9.223 1.00 0.00 C ATOM 1229 CG2 VAL A 77 81.532 -1.325 7.961 1.00 0.00 C ATOM 0 H VAL A 77 83.276 -1.930 5.861 1.00 0.00 H new ATOM 0 HA VAL A 77 82.414 0.705 6.547 1.00 0.00 H new ATOM 0 HB VAL A 77 83.669 -1.537 8.166 1.00 0.00 H new ATOM 0 HG11 VAL A 77 82.823 -0.313 10.146 1.00 0.00 H new ATOM 0 HG12 VAL A 77 84.039 0.649 9.272 1.00 0.00 H new ATOM 0 HG13 VAL A 77 82.309 1.031 9.098 1.00 0.00 H new ATOM 0 HG21 VAL A 77 81.314 -1.863 8.884 1.00 0.00 H new ATOM 0 HG22 VAL A 77 80.808 -0.521 7.830 1.00 0.00 H new ATOM 0 HG23 VAL A 77 81.468 -2.012 7.117 1.00 0.00 H new ATOM 1239 N PHE A 78 85.656 0.098 6.734 1.00 0.00 N ATOM 1240 CA PHE A 78 86.961 0.799 6.806 1.00 0.00 C ATOM 1241 C PHE A 78 87.127 1.655 5.547 1.00 0.00 C ATOM 1242 O PHE A 78 87.613 2.768 5.604 1.00 0.00 O ATOM 1243 CB PHE A 78 88.105 -0.214 6.900 1.00 0.00 C ATOM 1244 CG PHE A 78 88.078 -0.895 8.254 1.00 0.00 C ATOM 1245 CD1 PHE A 78 88.284 -0.147 9.423 1.00 0.00 C ATOM 1246 CD2 PHE A 78 87.842 -2.273 8.342 1.00 0.00 C ATOM 1247 CE1 PHE A 78 88.254 -0.778 10.674 1.00 0.00 C ATOM 1248 CE2 PHE A 78 87.811 -2.902 9.593 1.00 0.00 C ATOM 1249 CZ PHE A 78 88.018 -2.154 10.758 1.00 0.00 C ATOM 0 H PHE A 78 85.708 -0.910 6.588 1.00 0.00 H new ATOM 0 HA PHE A 78 86.988 1.430 7.694 1.00 0.00 H new ATOM 0 HB2 PHE A 78 88.012 -0.956 6.107 1.00 0.00 H new ATOM 0 HB3 PHE A 78 89.061 0.289 6.755 1.00 0.00 H new ATOM 0 HD1 PHE A 78 88.466 0.916 9.359 1.00 0.00 H new ATOM 0 HD2 PHE A 78 87.684 -2.851 7.444 1.00 0.00 H new ATOM 0 HE1 PHE A 78 88.413 -0.202 11.573 1.00 0.00 H new ATOM 0 HE2 PHE A 78 87.627 -3.964 9.659 1.00 0.00 H new ATOM 0 HZ PHE A 78 87.995 -2.640 11.722 1.00 0.00 H new ATOM 1259 N LEU A 79 86.727 1.148 4.402 1.00 0.00 N ATOM 1260 CA LEU A 79 86.870 1.949 3.150 1.00 0.00 C ATOM 1261 C LEU A 79 85.955 3.176 3.237 1.00 0.00 C ATOM 1262 O LEU A 79 86.304 4.267 2.834 1.00 0.00 O ATOM 1263 CB LEU A 79 86.484 1.077 1.934 1.00 0.00 C ATOM 1264 CG LEU A 79 87.383 1.395 0.728 1.00 0.00 C ATOM 1265 CD1 LEU A 79 86.857 0.642 -0.501 1.00 0.00 C ATOM 1266 CD2 LEU A 79 87.396 2.912 0.446 1.00 0.00 C ATOM 0 H LEU A 79 86.312 0.224 4.285 1.00 0.00 H new ATOM 0 HA LEU A 79 87.902 2.278 3.031 1.00 0.00 H new ATOM 0 HB2 LEU A 79 86.575 0.022 2.193 1.00 0.00 H new ATOM 0 HB3 LEU A 79 85.441 1.252 1.672 1.00 0.00 H new ATOM 0 HG LEU A 79 88.402 1.078 0.949 1.00 0.00 H new ATOM 0 HD11 LEU A 79 87.489 0.862 -1.361 1.00 0.00 H new ATOM 0 HD12 LEU A 79 86.872 -0.430 -0.305 1.00 0.00 H new ATOM 0 HD13 LEU A 79 85.835 0.958 -0.712 1.00 0.00 H new ATOM 0 HD21 LEU A 79 88.038 3.117 -0.411 1.00 0.00 H new ATOM 0 HD22 LEU A 79 86.383 3.251 0.230 1.00 0.00 H new ATOM 0 HD23 LEU A 79 87.777 3.441 1.319 1.00 0.00 H new ATOM 1278 N SER A 80 84.783 2.989 3.766 1.00 0.00 N ATOM 1279 CA SER A 80 83.820 4.117 3.897 1.00 0.00 C ATOM 1280 C SER A 80 84.402 5.130 4.867 1.00 0.00 C ATOM 1281 O SER A 80 84.333 6.325 4.659 1.00 0.00 O ATOM 1282 CB SER A 80 82.488 3.597 4.438 1.00 0.00 C ATOM 1283 OG SER A 80 82.683 3.088 5.751 1.00 0.00 O ATOM 0 H SER A 80 84.445 2.093 4.118 1.00 0.00 H new ATOM 0 HA SER A 80 83.649 4.580 2.925 1.00 0.00 H new ATOM 0 HB2 SER A 80 81.750 4.399 4.452 1.00 0.00 H new ATOM 0 HB3 SER A 80 82.098 2.815 3.786 1.00 0.00 H new ATOM 0 HG SER A 80 83.543 2.620 5.796 1.00 0.00 H new ATOM 1289 N CYS A 81 85.008 4.654 5.913 1.00 0.00 N ATOM 1290 CA CYS A 81 85.634 5.577 6.882 1.00 0.00 C ATOM 1291 C CYS A 81 86.685 6.370 6.128 1.00 0.00 C ATOM 1292 O CYS A 81 86.882 7.547 6.358 1.00 0.00 O ATOM 1293 CB CYS A 81 86.311 4.784 8.001 1.00 0.00 C ATOM 1294 SG CYS A 81 87.016 5.932 9.209 1.00 0.00 S ATOM 0 H CYS A 81 85.095 3.663 6.136 1.00 0.00 H new ATOM 0 HA CYS A 81 84.884 6.231 7.326 1.00 0.00 H new ATOM 0 HB2 CYS A 81 85.588 4.128 8.485 1.00 0.00 H new ATOM 0 HB3 CYS A 81 87.093 4.147 7.588 1.00 0.00 H new ATOM 0 HG CYS A 81 86.913 5.425 10.401 1.00 0.00 H new ATOM 1300 N ILE A 82 87.360 5.724 5.216 1.00 0.00 N ATOM 1301 CA ILE A 82 88.400 6.448 4.435 1.00 0.00 C ATOM 1302 C ILE A 82 87.713 7.450 3.514 1.00 0.00 C ATOM 1303 O ILE A 82 88.172 8.560 3.333 1.00 0.00 O ATOM 1304 CB ILE A 82 89.234 5.459 3.613 1.00 0.00 C ATOM 1305 CG1 ILE A 82 90.101 4.636 4.570 1.00 0.00 C ATOM 1306 CG2 ILE A 82 90.128 6.229 2.627 1.00 0.00 C ATOM 1307 CD1 ILE A 82 90.797 3.510 3.808 1.00 0.00 C ATOM 0 H ILE A 82 87.238 4.739 4.981 1.00 0.00 H new ATOM 0 HA ILE A 82 89.070 6.973 5.116 1.00 0.00 H new ATOM 0 HB ILE A 82 88.578 4.797 3.048 1.00 0.00 H new ATOM 0 HG12 ILE A 82 90.843 5.278 5.044 1.00 0.00 H new ATOM 0 HG13 ILE A 82 89.484 4.220 5.366 1.00 0.00 H new ATOM 0 HG21 ILE A 82 90.719 5.523 2.044 1.00 0.00 H new ATOM 0 HG22 ILE A 82 89.505 6.820 1.956 1.00 0.00 H new ATOM 0 HG23 ILE A 82 90.794 6.890 3.180 1.00 0.00 H new ATOM 0 HD11 ILE A 82 91.411 2.930 4.497 1.00 0.00 H new ATOM 0 HD12 ILE A 82 90.048 2.860 3.355 1.00 0.00 H new ATOM 0 HD13 ILE A 82 91.429 3.935 3.028 1.00 0.00 H new ATOM 1319 N ALA A 83 86.615 7.070 2.929 1.00 0.00 N ATOM 1320 CA ALA A 83 85.906 8.008 2.024 1.00 0.00 C ATOM 1321 C ALA A 83 85.506 9.256 2.805 1.00 0.00 C ATOM 1322 O ALA A 83 85.728 10.359 2.367 1.00 0.00 O ATOM 1323 CB ALA A 83 84.658 7.338 1.470 1.00 0.00 C ATOM 0 H ALA A 83 86.180 6.154 3.038 1.00 0.00 H new ATOM 0 HA ALA A 83 86.564 8.285 1.200 1.00 0.00 H new ATOM 0 HB1 ALA A 83 84.139 8.029 0.806 1.00 0.00 H new ATOM 0 HB2 ALA A 83 84.941 6.444 0.915 1.00 0.00 H new ATOM 0 HB3 ALA A 83 83.998 7.061 2.292 1.00 0.00 H new ATOM 1329 N MET A 84 84.936 9.103 3.968 1.00 0.00 N ATOM 1330 CA MET A 84 84.556 10.309 4.758 1.00 0.00 C ATOM 1331 C MET A 84 85.825 11.022 5.188 1.00 0.00 C ATOM 1332 O MET A 84 85.876 12.234 5.267 1.00 0.00 O ATOM 1333 CB MET A 84 83.735 9.901 5.979 1.00 0.00 C ATOM 1334 CG MET A 84 82.360 9.409 5.522 1.00 0.00 C ATOM 1335 SD MET A 84 81.378 8.922 6.963 1.00 0.00 S ATOM 1336 CE MET A 84 82.318 7.437 7.401 1.00 0.00 C ATOM 0 H MET A 84 84.718 8.206 4.402 1.00 0.00 H new ATOM 0 HA MET A 84 83.947 10.977 4.149 1.00 0.00 H new ATOM 0 HB2 MET A 84 84.250 9.115 6.532 1.00 0.00 H new ATOM 0 HB3 MET A 84 83.624 10.748 6.657 1.00 0.00 H new ATOM 0 HG2 MET A 84 81.847 10.196 4.969 1.00 0.00 H new ATOM 0 HG3 MET A 84 82.472 8.563 4.843 1.00 0.00 H new ATOM 0 HE1 MET A 84 81.635 6.595 7.517 1.00 0.00 H new ATOM 0 HE2 MET A 84 83.037 7.216 6.612 1.00 0.00 H new ATOM 0 HE3 MET A 84 82.848 7.605 8.338 1.00 0.00 H new ATOM 1346 N MET A 85 86.865 10.283 5.435 1.00 0.00 N ATOM 1347 CA MET A 85 88.139 10.929 5.823 1.00 0.00 C ATOM 1348 C MET A 85 88.525 11.852 4.673 1.00 0.00 C ATOM 1349 O MET A 85 89.170 12.865 4.854 1.00 0.00 O ATOM 1350 CB MET A 85 89.220 9.867 6.029 1.00 0.00 C ATOM 1351 CG MET A 85 90.468 10.516 6.637 1.00 0.00 C ATOM 1352 SD MET A 85 90.127 11.027 8.342 1.00 0.00 S ATOM 1353 CE MET A 85 89.867 9.380 9.049 1.00 0.00 C ATOM 0 H MET A 85 86.887 9.264 5.385 1.00 0.00 H new ATOM 0 HA MET A 85 88.034 11.484 6.755 1.00 0.00 H new ATOM 0 HB2 MET A 85 88.850 9.080 6.686 1.00 0.00 H new ATOM 0 HB3 MET A 85 89.469 9.397 5.077 1.00 0.00 H new ATOM 0 HG2 MET A 85 91.300 9.813 6.618 1.00 0.00 H new ATOM 0 HG3 MET A 85 90.767 11.379 6.042 1.00 0.00 H new ATOM 0 HE1 MET A 85 90.148 9.388 10.102 1.00 0.00 H new ATOM 0 HE2 MET A 85 88.816 9.106 8.955 1.00 0.00 H new ATOM 0 HE3 MET A 85 90.480 8.654 8.515 1.00 0.00 H new ATOM 1363 N CYS A 86 88.102 11.509 3.482 1.00 0.00 N ATOM 1364 CA CYS A 86 88.406 12.364 2.306 1.00 0.00 C ATOM 1365 C CYS A 86 87.435 12.020 1.181 1.00 0.00 C ATOM 1366 O CYS A 86 87.795 11.409 0.194 1.00 0.00 O ATOM 1367 CB CYS A 86 89.847 12.132 1.850 1.00 0.00 C ATOM 1368 SG CYS A 86 90.231 13.237 0.470 1.00 0.00 S ATOM 0 H CYS A 86 87.558 10.670 3.278 1.00 0.00 H new ATOM 0 HA CYS A 86 88.294 13.414 2.575 1.00 0.00 H new ATOM 0 HB2 CYS A 86 90.534 12.313 2.676 1.00 0.00 H new ATOM 0 HB3 CYS A 86 89.980 11.094 1.546 1.00 0.00 H new ATOM 0 HG CYS A 86 90.214 14.469 0.883 1.00 0.00 H new ATOM 1374 N ASN A 87 86.197 12.393 1.338 1.00 0.00 N ATOM 1375 CA ASN A 87 85.184 12.073 0.299 1.00 0.00 C ATOM 1376 C ASN A 87 85.490 12.845 -0.983 1.00 0.00 C ATOM 1377 O ASN A 87 85.603 12.271 -2.048 1.00 0.00 O ATOM 1378 CB ASN A 87 83.797 12.468 0.810 1.00 0.00 C ATOM 1379 CG ASN A 87 82.724 11.835 -0.077 1.00 0.00 C ATOM 1380 OD1 ASN A 87 83.014 11.360 -1.157 1.00 0.00 O ATOM 1381 ND2 ASN A 87 81.486 11.808 0.337 1.00 0.00 N ATOM 0 H ASN A 87 85.843 12.907 2.144 1.00 0.00 H new ATOM 0 HA ASN A 87 85.211 11.004 0.087 1.00 0.00 H new ATOM 0 HB2 ASN A 87 83.671 12.139 1.841 1.00 0.00 H new ATOM 0 HB3 ASN A 87 83.692 13.553 0.807 1.00 0.00 H new ATOM 0 HD21 ASN A 87 80.762 11.388 -0.246 1.00 0.00 H new ATOM 0 HD22 ASN A 87 81.243 12.207 1.244 1.00 0.00 H new ATOM 1388 N GLU A 88 85.627 14.141 -0.895 1.00 0.00 N ATOM 1389 CA GLU A 88 85.923 14.935 -2.120 1.00 0.00 C ATOM 1390 C GLU A 88 86.218 16.392 -1.735 1.00 0.00 C ATOM 1391 O GLU A 88 86.941 16.668 -0.797 1.00 0.00 O ATOM 1392 CB GLU A 88 84.708 14.888 -3.062 1.00 0.00 C ATOM 1393 CG GLU A 88 85.144 15.178 -4.503 1.00 0.00 C ATOM 1394 CD GLU A 88 83.903 15.377 -5.373 1.00 0.00 C ATOM 1395 OE1 GLU A 88 82.813 15.357 -4.827 1.00 0.00 O ATOM 1396 OE2 GLU A 88 84.064 15.540 -6.571 1.00 0.00 O ATOM 0 H GLU A 88 85.547 14.681 -0.033 1.00 0.00 H new ATOM 0 HA GLU A 88 86.793 14.514 -2.623 1.00 0.00 H new ATOM 0 HB2 GLU A 88 84.234 13.908 -3.008 1.00 0.00 H new ATOM 0 HB3 GLU A 88 83.964 15.619 -2.745 1.00 0.00 H new ATOM 0 HG2 GLU A 88 85.771 16.069 -4.534 1.00 0.00 H new ATOM 0 HG3 GLU A 88 85.744 14.353 -4.887 1.00 0.00 H new ATOM 1403 N PHE A 89 85.660 17.321 -2.463 1.00 0.00 N ATOM 1404 CA PHE A 89 85.889 18.767 -2.170 1.00 0.00 C ATOM 1405 C PHE A 89 85.316 19.133 -0.799 1.00 0.00 C ATOM 1406 O PHE A 89 85.890 19.909 -0.061 1.00 0.00 O ATOM 1407 CB PHE A 89 85.215 19.619 -3.248 1.00 0.00 C ATOM 1408 CG PHE A 89 85.452 21.081 -2.953 1.00 0.00 C ATOM 1409 CD1 PHE A 89 86.583 21.719 -3.474 1.00 0.00 C ATOM 1410 CD2 PHE A 89 84.549 21.797 -2.157 1.00 0.00 C ATOM 1411 CE1 PHE A 89 86.811 23.073 -3.202 1.00 0.00 C ATOM 1412 CE2 PHE A 89 84.778 23.151 -1.885 1.00 0.00 C ATOM 1413 CZ PHE A 89 85.910 23.789 -2.408 1.00 0.00 C ATOM 0 H PHE A 89 85.048 17.138 -3.258 1.00 0.00 H new ATOM 0 HA PHE A 89 86.962 18.958 -2.165 1.00 0.00 H new ATOM 0 HB2 PHE A 89 85.614 19.365 -4.230 1.00 0.00 H new ATOM 0 HB3 PHE A 89 84.145 19.411 -3.276 1.00 0.00 H new ATOM 0 HD1 PHE A 89 87.280 21.167 -4.086 1.00 0.00 H new ATOM 0 HD2 PHE A 89 83.677 21.305 -1.753 1.00 0.00 H new ATOM 0 HE1 PHE A 89 87.684 23.565 -3.606 1.00 0.00 H new ATOM 0 HE2 PHE A 89 84.082 23.704 -1.272 1.00 0.00 H new ATOM 0 HZ PHE A 89 86.087 24.834 -2.198 1.00 0.00 H new ATOM 1423 N PHE A 90 84.174 18.601 -0.464 1.00 0.00 N ATOM 1424 CA PHE A 90 83.544 18.936 0.844 1.00 0.00 C ATOM 1425 C PHE A 90 84.190 18.106 1.951 1.00 0.00 C ATOM 1426 O PHE A 90 83.579 17.798 2.956 1.00 0.00 O ATOM 1427 CB PHE A 90 82.042 18.645 0.778 1.00 0.00 C ATOM 1428 CG PHE A 90 81.811 17.253 0.242 1.00 0.00 C ATOM 1429 CD1 PHE A 90 81.698 17.045 -1.138 1.00 0.00 C ATOM 1430 CD2 PHE A 90 81.701 16.171 1.124 1.00 0.00 C ATOM 1431 CE1 PHE A 90 81.476 15.757 -1.636 1.00 0.00 C ATOM 1432 CE2 PHE A 90 81.480 14.882 0.626 1.00 0.00 C ATOM 1433 CZ PHE A 90 81.366 14.675 -0.755 1.00 0.00 C ATOM 0 H PHE A 90 83.648 17.946 -1.042 1.00 0.00 H new ATOM 0 HA PHE A 90 83.693 19.994 1.060 1.00 0.00 H new ATOM 0 HB2 PHE A 90 81.601 18.740 1.770 1.00 0.00 H new ATOM 0 HB3 PHE A 90 81.549 19.377 0.138 1.00 0.00 H new ATOM 0 HD1 PHE A 90 81.782 17.880 -1.818 1.00 0.00 H new ATOM 0 HD2 PHE A 90 81.787 16.331 2.189 1.00 0.00 H new ATOM 0 HE1 PHE A 90 81.389 15.597 -2.701 1.00 0.00 H new ATOM 0 HE2 PHE A 90 81.397 14.047 1.306 1.00 0.00 H new ATOM 0 HZ PHE A 90 81.193 13.681 -1.140 1.00 0.00 H new ATOM 1443 N GLU A 91 85.433 17.760 1.775 1.00 0.00 N ATOM 1444 CA GLU A 91 86.150 16.966 2.812 1.00 0.00 C ATOM 1445 C GLU A 91 85.988 17.647 4.172 1.00 0.00 C ATOM 1446 O GLU A 91 86.160 17.034 5.208 1.00 0.00 O ATOM 1447 CB GLU A 91 87.634 16.879 2.448 1.00 0.00 C ATOM 1448 CG GLU A 91 88.405 16.191 3.578 1.00 0.00 C ATOM 1449 CD GLU A 91 89.828 15.884 3.108 1.00 0.00 C ATOM 1450 OE1 GLU A 91 90.137 16.203 1.972 1.00 0.00 O ATOM 1451 OE2 GLU A 91 90.583 15.332 3.891 1.00 0.00 O ATOM 0 H GLU A 91 85.988 17.994 0.952 1.00 0.00 H new ATOM 0 HA GLU A 91 85.732 15.960 2.861 1.00 0.00 H new ATOM 0 HB2 GLU A 91 87.758 16.322 1.519 1.00 0.00 H new ATOM 0 HB3 GLU A 91 88.035 17.878 2.277 1.00 0.00 H new ATOM 0 HG2 GLU A 91 88.431 16.833 4.459 1.00 0.00 H new ATOM 0 HG3 GLU A 91 87.900 15.270 3.870 1.00 0.00 H new ATOM 1458 N GLY A 92 85.655 18.908 4.180 1.00 0.00 N ATOM 1459 CA GLY A 92 85.477 19.627 5.475 1.00 0.00 C ATOM 1460 C GLY A 92 84.279 19.044 6.231 1.00 0.00 C ATOM 1461 O GLY A 92 83.815 19.604 7.205 1.00 0.00 O ATOM 0 H GLY A 92 85.498 19.473 3.345 1.00 0.00 H new ATOM 0 HA2 GLY A 92 86.380 19.536 6.079 1.00 0.00 H new ATOM 0 HA3 GLY A 92 85.321 20.690 5.293 1.00 0.00 H new ATOM 1465 N PHE A 93 83.775 17.922 5.793 1.00 0.00 N ATOM 1466 CA PHE A 93 82.611 17.301 6.483 1.00 0.00 C ATOM 1467 C PHE A 93 83.073 16.802 7.870 1.00 0.00 C ATOM 1468 O PHE A 93 84.151 16.252 7.982 1.00 0.00 O ATOM 1469 CB PHE A 93 82.129 16.112 5.642 1.00 0.00 C ATOM 1470 CG PHE A 93 80.767 15.662 6.111 1.00 0.00 C ATOM 1471 CD1 PHE A 93 79.613 16.241 5.566 1.00 0.00 C ATOM 1472 CD2 PHE A 93 80.655 14.666 7.087 1.00 0.00 C ATOM 1473 CE1 PHE A 93 78.349 15.823 5.998 1.00 0.00 C ATOM 1474 CE2 PHE A 93 79.391 14.248 7.520 1.00 0.00 C ATOM 1475 CZ PHE A 93 78.237 14.827 6.975 1.00 0.00 C ATOM 0 H PHE A 93 84.122 17.408 4.983 1.00 0.00 H new ATOM 0 HA PHE A 93 81.801 18.020 6.603 1.00 0.00 H new ATOM 0 HB2 PHE A 93 82.085 16.395 4.590 1.00 0.00 H new ATOM 0 HB3 PHE A 93 82.839 15.289 5.721 1.00 0.00 H new ATOM 0 HD1 PHE A 93 79.699 17.010 4.812 1.00 0.00 H new ATOM 0 HD2 PHE A 93 81.544 14.219 7.507 1.00 0.00 H new ATOM 0 HE1 PHE A 93 77.460 16.269 5.577 1.00 0.00 H new ATOM 0 HE2 PHE A 93 79.305 13.479 8.274 1.00 0.00 H new ATOM 0 HZ PHE A 93 77.262 14.505 7.309 1.00 0.00 H new ATOM 1485 N PRO A 94 82.297 16.984 8.928 1.00 0.00 N ATOM 1486 CA PRO A 94 82.730 16.514 10.276 1.00 0.00 C ATOM 1487 C PRO A 94 83.353 15.107 10.241 1.00 0.00 C ATOM 1488 O PRO A 94 83.335 14.437 9.229 1.00 0.00 O ATOM 1489 CB PRO A 94 81.411 16.540 11.065 1.00 0.00 C ATOM 1490 CG PRO A 94 80.429 17.456 10.310 1.00 0.00 C ATOM 1491 CD PRO A 94 80.962 17.652 8.877 1.00 0.00 C ATOM 0 HA PRO A 94 83.516 17.130 10.713 1.00 0.00 H new ATOM 0 HB2 PRO A 94 81.001 15.534 11.157 1.00 0.00 H new ATOM 0 HB3 PRO A 94 81.578 16.910 12.076 1.00 0.00 H new ATOM 0 HG2 PRO A 94 79.434 17.012 10.288 1.00 0.00 H new ATOM 0 HG3 PRO A 94 80.338 18.417 10.817 1.00 0.00 H new ATOM 0 HD2 PRO A 94 80.308 17.193 8.136 1.00 0.00 H new ATOM 0 HD3 PRO A 94 81.047 18.707 8.618 1.00 0.00 H new ATOM 1499 N ASP A 95 83.912 14.669 11.340 1.00 0.00 N ATOM 1500 CA ASP A 95 84.550 13.318 11.380 1.00 0.00 C ATOM 1501 C ASP A 95 83.526 12.235 11.016 1.00 0.00 C ATOM 1502 O ASP A 95 82.879 12.292 9.992 1.00 0.00 O ATOM 1503 CB ASP A 95 85.083 13.054 12.791 1.00 0.00 C ATOM 1504 CG ASP A 95 85.925 11.776 12.790 1.00 0.00 C ATOM 1505 OD1 ASP A 95 85.905 11.078 11.789 1.00 0.00 O ATOM 1506 OD2 ASP A 95 86.568 11.513 13.793 1.00 0.00 O ATOM 0 H ASP A 95 83.954 15.191 12.215 1.00 0.00 H new ATOM 0 HA ASP A 95 85.368 13.290 10.660 1.00 0.00 H new ATOM 0 HB2 ASP A 95 85.685 13.898 13.127 1.00 0.00 H new ATOM 0 HB3 ASP A 95 84.254 12.955 13.491 1.00 0.00 H new ATOM 1511 N LYS A 96 83.379 11.239 11.850 1.00 0.00 N ATOM 1512 CA LYS A 96 82.401 10.152 11.550 1.00 0.00 C ATOM 1513 C LYS A 96 81.037 10.514 12.142 1.00 0.00 C ATOM 1514 O LYS A 96 80.155 10.977 11.447 1.00 0.00 O ATOM 1515 CB LYS A 96 82.895 8.838 12.160 1.00 0.00 C ATOM 1516 CG LYS A 96 81.982 7.697 11.709 1.00 0.00 C ATOM 1517 CD LYS A 96 82.468 6.380 12.314 1.00 0.00 C ATOM 1518 CE LYS A 96 81.551 5.243 11.858 1.00 0.00 C ATOM 1519 NZ LYS A 96 82.083 3.944 12.358 1.00 0.00 N ATOM 0 H LYS A 96 83.893 11.131 12.724 1.00 0.00 H new ATOM 0 HA LYS A 96 82.306 10.036 10.470 1.00 0.00 H new ATOM 0 HB2 LYS A 96 83.921 8.643 11.849 1.00 0.00 H new ATOM 0 HB3 LYS A 96 82.899 8.908 13.248 1.00 0.00 H new ATOM 0 HG2 LYS A 96 80.956 7.895 12.020 1.00 0.00 H new ATOM 0 HG3 LYS A 96 81.978 7.629 10.621 1.00 0.00 H new ATOM 0 HD2 LYS A 96 83.494 6.181 12.004 1.00 0.00 H new ATOM 0 HD3 LYS A 96 82.471 6.446 13.402 1.00 0.00 H new ATOM 0 HE2 LYS A 96 80.541 5.403 12.234 1.00 0.00 H new ATOM 0 HE3 LYS A 96 81.487 5.227 10.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 81.460 3.171 12.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 83.039 3.791 11.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 82.122 3.962 13.397 1.00 0.00 H new ATOM 1533 N GLN A 97 80.855 10.307 13.419 1.00 0.00 N ATOM 1534 CA GLN A 97 79.545 10.641 14.050 1.00 0.00 C ATOM 1535 C GLN A 97 79.509 12.150 14.377 1.00 0.00 C ATOM 1536 O GLN A 97 80.509 12.701 14.793 1.00 0.00 O ATOM 1537 CB GLN A 97 79.393 9.843 15.348 1.00 0.00 C ATOM 1538 CG GLN A 97 79.447 8.343 15.041 1.00 0.00 C ATOM 1539 CD GLN A 97 78.204 7.937 14.247 1.00 0.00 C ATOM 1540 OE1 GLN A 97 77.105 7.955 14.766 1.00 0.00 O ATOM 1541 NE2 GLN A 97 78.332 7.568 13.002 1.00 0.00 N ATOM 0 H GLN A 97 81.556 9.922 14.052 1.00 0.00 H new ATOM 0 HA GLN A 97 78.733 10.392 13.366 1.00 0.00 H new ATOM 0 HB2 GLN A 97 80.187 10.110 16.046 1.00 0.00 H new ATOM 0 HB3 GLN A 97 78.448 10.092 15.831 1.00 0.00 H new ATOM 0 HG2 GLN A 97 80.347 8.110 14.472 1.00 0.00 H new ATOM 0 HG3 GLN A 97 79.501 7.773 15.969 1.00 0.00 H new ATOM 0 HE21 GLN A 97 79.254 7.553 12.567 1.00 0.00 H new ATOM 0 HE22 GLN A 97 77.510 7.295 12.464 1.00 0.00 H new ATOM 1550 N PRO A 98 78.386 12.829 14.209 1.00 0.00 N ATOM 1551 CA PRO A 98 78.322 14.288 14.530 1.00 0.00 C ATOM 1552 C PRO A 98 78.356 14.541 16.045 1.00 0.00 C ATOM 1553 O PRO A 98 77.349 14.456 16.718 1.00 0.00 O ATOM 1554 CB PRO A 98 76.961 14.683 13.936 1.00 0.00 C ATOM 1555 CG PRO A 98 76.133 13.398 13.801 1.00 0.00 C ATOM 1556 CD PRO A 98 77.117 12.224 13.698 1.00 0.00 C ATOM 0 HA PRO A 98 79.164 14.856 14.135 1.00 0.00 H new ATOM 0 HB2 PRO A 98 76.454 15.401 14.581 1.00 0.00 H new ATOM 0 HB3 PRO A 98 77.090 15.161 12.965 1.00 0.00 H new ATOM 0 HG2 PRO A 98 75.476 13.273 14.662 1.00 0.00 H new ATOM 0 HG3 PRO A 98 75.496 13.443 12.918 1.00 0.00 H new ATOM 0 HD2 PRO A 98 76.800 11.373 14.301 1.00 0.00 H new ATOM 0 HD3 PRO A 98 77.220 11.868 12.673 1.00 0.00 H new ATOM 1564 N ARG A 99 79.502 14.848 16.586 1.00 0.00 N ATOM 1565 CA ARG A 99 79.584 15.101 18.053 1.00 0.00 C ATOM 1566 C ARG A 99 78.836 16.392 18.396 1.00 0.00 C ATOM 1567 O ARG A 99 78.149 16.475 19.394 1.00 0.00 O ATOM 1568 CB ARG A 99 81.050 15.219 18.475 1.00 0.00 C ATOM 1569 CG ARG A 99 81.718 13.841 18.374 1.00 0.00 C ATOM 1570 CD ARG A 99 83.152 13.897 18.934 1.00 0.00 C ATOM 1571 NE ARG A 99 84.039 12.977 18.150 1.00 0.00 N ATOM 1572 CZ ARG A 99 83.680 11.749 17.876 1.00 0.00 C ATOM 1573 NH1 ARG A 99 82.615 11.228 18.419 1.00 0.00 N ATOM 1574 NH2 ARG A 99 84.425 11.020 17.089 1.00 0.00 N ATOM 0 H ARG A 99 80.383 14.935 16.079 1.00 0.00 H new ATOM 0 HA ARG A 99 79.125 14.270 18.589 1.00 0.00 H new ATOM 0 HB2 ARG A 99 81.568 15.935 17.837 1.00 0.00 H new ATOM 0 HB3 ARG A 99 81.118 15.595 19.496 1.00 0.00 H new ATOM 0 HG2 ARG A 99 81.134 13.105 18.926 1.00 0.00 H new ATOM 0 HG3 ARG A 99 81.739 13.516 17.334 1.00 0.00 H new ATOM 0 HD2 ARG A 99 83.533 14.917 18.882 1.00 0.00 H new ATOM 0 HD3 ARG A 99 83.153 13.610 19.985 1.00 0.00 H new ATOM 0 HE ARG A 99 84.943 13.316 17.823 1.00 0.00 H new ATOM 0 HH11 ARG A 99 82.051 11.779 19.066 1.00 0.00 H new ATOM 0 HH12 ARG A 99 82.346 10.269 18.197 1.00 0.00 H new ATOM 0 HH21 ARG A 99 85.281 11.409 16.692 1.00 0.00 H new ATOM 0 HH22 ARG A 99 84.151 10.062 16.871 1.00 0.00 H new ATOM 1588 N LYS A 100 78.959 17.395 17.576 1.00 0.00 N ATOM 1589 CA LYS A 100 78.252 18.677 17.854 1.00 0.00 C ATOM 1590 C LYS A 100 76.748 18.470 17.668 1.00 0.00 C ATOM 1591 O LYS A 100 76.315 17.740 16.799 1.00 0.00 O ATOM 1592 CB LYS A 100 78.750 19.745 16.878 1.00 0.00 C ATOM 1593 CG LYS A 100 80.237 20.005 17.134 1.00 0.00 C ATOM 1594 CD LYS A 100 80.750 21.070 16.165 1.00 0.00 C ATOM 1595 CE LYS A 100 82.245 21.295 16.407 1.00 0.00 C ATOM 1596 NZ LYS A 100 82.982 20.023 16.154 1.00 0.00 N ATOM 0 H LYS A 100 79.519 17.384 16.724 1.00 0.00 H new ATOM 0 HA LYS A 100 78.450 18.999 18.876 1.00 0.00 H new ATOM 0 HB2 LYS A 100 78.598 19.415 15.850 1.00 0.00 H new ATOM 0 HB3 LYS A 100 78.180 20.665 17.005 1.00 0.00 H new ATOM 0 HG2 LYS A 100 80.386 20.334 18.162 1.00 0.00 H new ATOM 0 HG3 LYS A 100 80.804 19.083 17.009 1.00 0.00 H new ATOM 0 HD2 LYS A 100 80.580 20.754 15.136 1.00 0.00 H new ATOM 0 HD3 LYS A 100 80.202 22.002 16.307 1.00 0.00 H new ATOM 0 HE2 LYS A 100 82.617 22.081 15.750 1.00 0.00 H new ATOM 0 HE3 LYS A 100 82.413 21.629 17.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 83.983 20.233 15.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 82.909 19.407 16.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 82.569 19.540 15.331 1.00 0.00 H new ATOM 1610 N LYS A 101 75.946 19.100 18.482 1.00 0.00 N ATOM 1611 CA LYS A 101 74.470 18.931 18.355 1.00 0.00 C ATOM 1612 C LYS A 101 73.941 19.857 17.257 1.00 0.00 C ATOM 1613 O LYS A 101 73.493 20.942 17.590 1.00 0.00 O ATOM 1614 CB LYS A 101 73.797 19.283 19.683 1.00 0.00 C ATOM 1615 CG LYS A 101 74.216 18.275 20.755 1.00 0.00 C ATOM 1616 CD LYS A 101 73.539 18.632 22.081 1.00 0.00 C ATOM 1617 CE LYS A 101 73.952 17.628 23.162 1.00 0.00 C ATOM 1618 NZ LYS A 101 75.312 17.975 23.666 1.00 0.00 N ATOM 1619 OXT LYS A 101 73.991 19.465 16.103 1.00 0.00 O ATOM 0 H LYS A 101 76.249 19.724 19.230 1.00 0.00 H new ATOM 0 HA LYS A 101 74.247 17.896 18.097 1.00 0.00 H new ATOM 0 HB2 LYS A 101 74.077 20.291 19.988 1.00 0.00 H new ATOM 0 HB3 LYS A 101 72.713 19.275 19.566 1.00 0.00 H new ATOM 0 HG2 LYS A 101 73.936 17.266 20.451 1.00 0.00 H new ATOM 0 HG3 LYS A 101 75.300 18.283 20.874 1.00 0.00 H new ATOM 0 HD2 LYS A 101 73.820 19.641 22.383 1.00 0.00 H new ATOM 0 HD3 LYS A 101 72.456 18.625 21.960 1.00 0.00 H new ATOM 0 HE2 LYS A 101 73.234 17.643 23.982 1.00 0.00 H new ATOM 0 HE3 LYS A 101 73.950 16.617 22.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 75.848 17.102 23.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 75.810 18.547 22.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 75.227 18.518 24.549 1.00 0.00 H new TER 1633 LYS A 101 ATOM 1634 N MET B 1 99.592 -1.259 -9.106 1.00 0.00 N ATOM 1635 CA MET B 1 99.995 0.069 -9.651 1.00 0.00 C ATOM 1636 C MET B 1 98.769 0.773 -10.245 1.00 0.00 C ATOM 1637 O MET B 1 98.210 0.338 -11.232 1.00 0.00 O ATOM 1638 CB MET B 1 101.050 -0.134 -10.745 1.00 0.00 C ATOM 1639 CG MET B 1 102.331 -0.712 -10.131 1.00 0.00 C ATOM 1640 SD MET B 1 102.115 -2.490 -9.856 1.00 0.00 S ATOM 1641 CE MET B 1 103.829 -2.984 -10.165 1.00 0.00 C ATOM 0 H1 MET B 1 100.348 -1.951 -9.282 1.00 0.00 H new ATOM 0 H2 MET B 1 99.428 -1.179 -8.082 1.00 0.00 H new ATOM 0 H3 MET B 1 98.718 -1.575 -9.573 1.00 0.00 H new ATOM 0 HA MET B 1 100.410 0.682 -8.851 1.00 0.00 H new ATOM 0 HB2 MET B 1 100.667 -0.808 -11.512 1.00 0.00 H new ATOM 0 HB3 MET B 1 101.267 0.815 -11.235 1.00 0.00 H new ATOM 0 HG2 MET B 1 103.178 -0.535 -10.794 1.00 0.00 H new ATOM 0 HG3 MET B 1 102.554 -0.211 -9.189 1.00 0.00 H new ATOM 0 HE1 MET B 1 103.923 -4.063 -10.047 1.00 0.00 H new ATOM 0 HE2 MET B 1 104.111 -2.704 -11.180 1.00 0.00 H new ATOM 0 HE3 MET B 1 104.486 -2.483 -9.454 1.00 0.00 H new ATOM 1653 N ALA B 2 98.349 1.858 -9.650 1.00 0.00 N ATOM 1654 CA ALA B 2 97.161 2.591 -10.181 1.00 0.00 C ATOM 1655 C ALA B 2 95.985 1.624 -10.332 1.00 0.00 C ATOM 1656 O ALA B 2 95.417 1.484 -11.398 1.00 0.00 O ATOM 1657 CB ALA B 2 97.502 3.200 -11.543 1.00 0.00 C ATOM 0 H ALA B 2 98.776 2.269 -8.820 1.00 0.00 H new ATOM 0 HA ALA B 2 96.887 3.386 -9.487 1.00 0.00 H new ATOM 0 HB1 ALA B 2 96.635 3.735 -11.930 1.00 0.00 H new ATOM 0 HB2 ALA B 2 98.336 3.893 -11.433 1.00 0.00 H new ATOM 0 HB3 ALA B 2 97.778 2.407 -12.237 1.00 0.00 H new ATOM 1663 N CYS B 3 95.616 0.951 -9.276 1.00 0.00 N ATOM 1664 CA CYS B 3 94.481 -0.010 -9.360 1.00 0.00 C ATOM 1665 C CYS B 3 93.168 0.766 -9.631 1.00 0.00 C ATOM 1666 O CYS B 3 92.906 1.754 -8.974 1.00 0.00 O ATOM 1667 CB CYS B 3 94.359 -0.750 -8.027 1.00 0.00 C ATOM 1668 SG CYS B 3 93.089 -2.033 -8.159 1.00 0.00 S ATOM 0 H CYS B 3 96.053 1.026 -8.357 1.00 0.00 H new ATOM 0 HA CYS B 3 94.658 -0.720 -10.168 1.00 0.00 H new ATOM 0 HB2 CYS B 3 95.316 -1.198 -7.759 1.00 0.00 H new ATOM 0 HB3 CYS B 3 94.101 -0.049 -7.233 1.00 0.00 H new ATOM 0 HG CYS B 3 92.825 -2.505 -6.977 1.00 0.00 H new ATOM 1674 N PRO B 4 92.337 0.347 -10.577 1.00 0.00 N ATOM 1675 CA PRO B 4 91.064 1.079 -10.853 1.00 0.00 C ATOM 1676 C PRO B 4 90.244 1.364 -9.580 1.00 0.00 C ATOM 1677 O PRO B 4 89.236 2.043 -9.625 1.00 0.00 O ATOM 1678 CB PRO B 4 90.321 0.123 -11.805 1.00 0.00 C ATOM 1679 CG PRO B 4 91.323 -0.935 -12.304 1.00 0.00 C ATOM 1680 CD PRO B 4 92.590 -0.855 -11.431 1.00 0.00 C ATOM 0 HA PRO B 4 91.238 2.070 -11.273 1.00 0.00 H new ATOM 0 HB2 PRO B 4 89.488 -0.356 -11.289 1.00 0.00 H new ATOM 0 HB3 PRO B 4 89.901 0.675 -12.646 1.00 0.00 H new ATOM 0 HG2 PRO B 4 90.884 -1.931 -12.245 1.00 0.00 H new ATOM 0 HG3 PRO B 4 91.572 -0.758 -13.350 1.00 0.00 H new ATOM 0 HD2 PRO B 4 92.724 -1.755 -10.831 1.00 0.00 H new ATOM 0 HD3 PRO B 4 93.490 -0.738 -12.035 1.00 0.00 H new ATOM 1688 N LEU B 5 90.664 0.857 -8.452 1.00 0.00 N ATOM 1689 CA LEU B 5 89.903 1.111 -7.191 1.00 0.00 C ATOM 1690 C LEU B 5 89.859 2.620 -6.946 1.00 0.00 C ATOM 1691 O LEU B 5 88.867 3.162 -6.503 1.00 0.00 O ATOM 1692 CB LEU B 5 90.600 0.416 -6.014 1.00 0.00 C ATOM 1693 CG LEU B 5 89.825 0.670 -4.708 1.00 0.00 C ATOM 1694 CD1 LEU B 5 88.414 0.060 -4.795 1.00 0.00 C ATOM 1695 CD2 LEU B 5 90.594 0.034 -3.542 1.00 0.00 C ATOM 0 H LEU B 5 91.498 0.280 -8.348 1.00 0.00 H new ATOM 0 HA LEU B 5 88.891 0.717 -7.282 1.00 0.00 H new ATOM 0 HB2 LEU B 5 90.666 -0.655 -6.203 1.00 0.00 H new ATOM 0 HB3 LEU B 5 91.621 0.786 -5.917 1.00 0.00 H new ATOM 0 HG LEU B 5 89.728 1.744 -4.548 1.00 0.00 H new ATOM 0 HD11 LEU B 5 87.878 0.248 -3.864 1.00 0.00 H new ATOM 0 HD12 LEU B 5 87.872 0.515 -5.624 1.00 0.00 H new ATOM 0 HD13 LEU B 5 88.492 -1.015 -4.958 1.00 0.00 H new ATOM 0 HD21 LEU B 5 90.053 0.208 -2.612 1.00 0.00 H new ATOM 0 HD22 LEU B 5 90.689 -1.039 -3.711 1.00 0.00 H new ATOM 0 HD23 LEU B 5 91.586 0.480 -3.474 1.00 0.00 H new ATOM 1707 N GLU B 6 90.939 3.295 -7.218 1.00 0.00 N ATOM 1708 CA GLU B 6 90.985 4.766 -6.992 1.00 0.00 C ATOM 1709 C GLU B 6 89.913 5.472 -7.828 1.00 0.00 C ATOM 1710 O GLU B 6 89.273 6.398 -7.370 1.00 0.00 O ATOM 1711 CB GLU B 6 92.365 5.279 -7.403 1.00 0.00 C ATOM 1712 CG GLU B 6 93.409 4.783 -6.404 1.00 0.00 C ATOM 1713 CD GLU B 6 94.806 5.188 -6.878 1.00 0.00 C ATOM 1714 OE1 GLU B 6 94.903 5.771 -7.945 1.00 0.00 O ATOM 1715 OE2 GLU B 6 95.756 4.906 -6.166 1.00 0.00 O ATOM 0 H GLU B 6 91.798 2.889 -7.590 1.00 0.00 H new ATOM 0 HA GLU B 6 90.797 4.975 -5.939 1.00 0.00 H new ATOM 0 HB2 GLU B 6 92.611 4.930 -8.406 1.00 0.00 H new ATOM 0 HB3 GLU B 6 92.365 6.369 -7.435 1.00 0.00 H new ATOM 0 HG2 GLU B 6 93.212 5.204 -5.418 1.00 0.00 H new ATOM 0 HG3 GLU B 6 93.347 3.699 -6.306 1.00 0.00 H new ATOM 1722 N LYS B 7 89.703 5.051 -9.045 1.00 0.00 N ATOM 1723 CA LYS B 7 88.665 5.707 -9.888 1.00 0.00 C ATOM 1724 C LYS B 7 87.316 5.100 -9.535 1.00 0.00 C ATOM 1725 O LYS B 7 86.332 5.786 -9.377 1.00 0.00 O ATOM 1726 CB LYS B 7 88.956 5.476 -11.387 1.00 0.00 C ATOM 1727 CG LYS B 7 90.465 5.391 -11.639 1.00 0.00 C ATOM 1728 CD LYS B 7 91.151 6.711 -11.278 1.00 0.00 C ATOM 1729 CE LYS B 7 92.660 6.489 -11.268 1.00 0.00 C ATOM 1730 NZ LYS B 7 93.347 7.749 -10.866 1.00 0.00 N ATOM 0 H LYS B 7 90.204 4.283 -9.491 1.00 0.00 H new ATOM 0 HA LYS B 7 88.667 6.781 -9.701 1.00 0.00 H new ATOM 0 HB2 LYS B 7 88.475 4.556 -11.718 1.00 0.00 H new ATOM 0 HB3 LYS B 7 88.529 6.289 -11.975 1.00 0.00 H new ATOM 0 HG2 LYS B 7 90.892 4.581 -11.048 1.00 0.00 H new ATOM 0 HG3 LYS B 7 90.651 5.154 -12.687 1.00 0.00 H new ATOM 0 HD2 LYS B 7 90.887 7.484 -12.000 1.00 0.00 H new ATOM 0 HD3 LYS B 7 90.813 7.058 -10.301 1.00 0.00 H new ATOM 0 HE2 LYS B 7 92.915 5.687 -10.576 1.00 0.00 H new ATOM 0 HE3 LYS B 7 92.999 6.177 -12.256 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 94.376 7.597 -10.859 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 93.113 8.503 -11.543 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 93.032 8.028 -9.915 1.00 0.00 H new ATOM 1744 N ALA B 8 87.274 3.811 -9.392 1.00 0.00 N ATOM 1745 CA ALA B 8 85.988 3.166 -9.038 1.00 0.00 C ATOM 1746 C ALA B 8 85.546 3.745 -7.707 1.00 0.00 C ATOM 1747 O ALA B 8 84.386 4.018 -7.483 1.00 0.00 O ATOM 1748 CB ALA B 8 86.156 1.649 -8.949 1.00 0.00 C ATOM 0 H ALA B 8 88.068 3.180 -9.504 1.00 0.00 H new ATOM 0 HA ALA B 8 85.235 3.358 -9.802 1.00 0.00 H new ATOM 0 HB1 ALA B 8 85.201 1.192 -8.688 1.00 0.00 H new ATOM 0 HB2 ALA B 8 86.492 1.263 -9.911 1.00 0.00 H new ATOM 0 HB3 ALA B 8 86.894 1.409 -8.184 1.00 0.00 H new ATOM 1754 N LEU B 9 86.477 3.999 -6.839 1.00 0.00 N ATOM 1755 CA LEU B 9 86.111 4.635 -5.556 1.00 0.00 C ATOM 1756 C LEU B 9 85.483 5.960 -5.934 1.00 0.00 C ATOM 1757 O LEU B 9 84.415 6.321 -5.479 1.00 0.00 O ATOM 1758 CB LEU B 9 87.391 4.873 -4.748 1.00 0.00 C ATOM 1759 CG LEU B 9 87.112 5.609 -3.423 1.00 0.00 C ATOM 1760 CD1 LEU B 9 86.713 7.083 -3.651 1.00 0.00 C ATOM 1761 CD2 LEU B 9 86.015 4.881 -2.629 1.00 0.00 C ATOM 0 H LEU B 9 87.469 3.795 -6.963 1.00 0.00 H new ATOM 0 HA LEU B 9 85.433 4.026 -4.957 1.00 0.00 H new ATOM 0 HB2 LEU B 9 87.869 3.916 -4.537 1.00 0.00 H new ATOM 0 HB3 LEU B 9 88.093 5.455 -5.345 1.00 0.00 H new ATOM 0 HG LEU B 9 88.038 5.605 -2.848 1.00 0.00 H new ATOM 0 HD11 LEU B 9 86.526 7.562 -2.690 1.00 0.00 H new ATOM 0 HD12 LEU B 9 87.521 7.603 -4.165 1.00 0.00 H new ATOM 0 HD13 LEU B 9 85.810 7.125 -4.260 1.00 0.00 H new ATOM 0 HD21 LEU B 9 85.828 5.412 -1.696 1.00 0.00 H new ATOM 0 HD22 LEU B 9 85.099 4.850 -3.219 1.00 0.00 H new ATOM 0 HD23 LEU B 9 86.339 3.864 -2.409 1.00 0.00 H new ATOM 1773 N ASP B 10 86.141 6.672 -6.801 1.00 0.00 N ATOM 1774 CA ASP B 10 85.583 7.973 -7.254 1.00 0.00 C ATOM 1775 C ASP B 10 84.245 7.723 -7.956 1.00 0.00 C ATOM 1776 O ASP B 10 83.343 8.527 -7.872 1.00 0.00 O ATOM 1777 CB ASP B 10 86.550 8.678 -8.209 1.00 0.00 C ATOM 1778 CG ASP B 10 87.776 9.155 -7.429 1.00 0.00 C ATOM 1779 OD1 ASP B 10 87.675 9.272 -6.219 1.00 0.00 O ATOM 1780 OD2 ASP B 10 88.796 9.394 -8.055 1.00 0.00 O ATOM 0 H ASP B 10 87.037 6.412 -7.214 1.00 0.00 H new ATOM 0 HA ASP B 10 85.434 8.617 -6.388 1.00 0.00 H new ATOM 0 HB2 ASP B 10 86.853 7.998 -9.005 1.00 0.00 H new ATOM 0 HB3 ASP B 10 86.056 9.525 -8.685 1.00 0.00 H new ATOM 1785 N VAL B 11 84.099 6.622 -8.657 1.00 0.00 N ATOM 1786 CA VAL B 11 82.798 6.373 -9.350 1.00 0.00 C ATOM 1787 C VAL B 11 81.687 6.328 -8.296 1.00 0.00 C ATOM 1788 O VAL B 11 80.609 6.854 -8.495 1.00 0.00 O ATOM 1789 CB VAL B 11 82.834 5.032 -10.102 1.00 0.00 C ATOM 1790 CG1 VAL B 11 81.435 4.685 -10.616 1.00 0.00 C ATOM 1791 CG2 VAL B 11 83.793 5.122 -11.293 1.00 0.00 C ATOM 0 H VAL B 11 84.809 5.900 -8.777 1.00 0.00 H new ATOM 0 HA VAL B 11 82.615 7.171 -10.070 1.00 0.00 H new ATOM 0 HB VAL B 11 83.177 4.258 -9.415 1.00 0.00 H new ATOM 0 HG11 VAL B 11 81.468 3.734 -11.148 1.00 0.00 H new ATOM 0 HG12 VAL B 11 80.747 4.606 -9.774 1.00 0.00 H new ATOM 0 HG13 VAL B 11 81.092 5.467 -11.293 1.00 0.00 H new ATOM 0 HG21 VAL B 11 83.811 4.167 -11.819 1.00 0.00 H new ATOM 0 HG22 VAL B 11 83.456 5.904 -11.973 1.00 0.00 H new ATOM 0 HG23 VAL B 11 84.795 5.359 -10.936 1.00 0.00 H new ATOM 1801 N MET B 12 81.944 5.718 -7.168 1.00 0.00 N ATOM 1802 CA MET B 12 80.904 5.662 -6.101 1.00 0.00 C ATOM 1803 C MET B 12 80.546 7.089 -5.680 1.00 0.00 C ATOM 1804 O MET B 12 79.399 7.424 -5.477 1.00 0.00 O ATOM 1805 CB MET B 12 81.460 4.903 -4.896 1.00 0.00 C ATOM 1806 CG MET B 12 81.493 3.400 -5.193 1.00 0.00 C ATOM 1807 SD MET B 12 82.647 2.582 -4.061 1.00 0.00 S ATOM 1808 CE MET B 12 82.080 3.366 -2.532 1.00 0.00 C ATOM 0 H MET B 12 82.826 5.258 -6.941 1.00 0.00 H new ATOM 0 HA MET B 12 80.015 5.153 -6.475 1.00 0.00 H new ATOM 0 HB2 MET B 12 82.464 5.258 -4.664 1.00 0.00 H new ATOM 0 HB3 MET B 12 80.843 5.095 -4.018 1.00 0.00 H new ATOM 0 HG2 MET B 12 80.495 2.975 -5.081 1.00 0.00 H new ATOM 0 HG3 MET B 12 81.798 3.230 -6.225 1.00 0.00 H new ATOM 0 HE1 MET B 12 82.426 2.787 -1.676 1.00 0.00 H new ATOM 0 HE2 MET B 12 82.481 4.378 -2.471 1.00 0.00 H new ATOM 0 HE3 MET B 12 80.991 3.407 -2.526 1.00 0.00 H new ATOM 1818 N VAL B 13 81.534 7.926 -5.537 1.00 0.00 N ATOM 1819 CA VAL B 13 81.275 9.335 -5.126 1.00 0.00 C ATOM 1820 C VAL B 13 80.832 10.167 -6.332 1.00 0.00 C ATOM 1821 O VAL B 13 79.911 10.954 -6.251 1.00 0.00 O ATOM 1822 CB VAL B 13 82.558 9.922 -4.534 1.00 0.00 C ATOM 1823 CG1 VAL B 13 82.322 11.379 -4.123 1.00 0.00 C ATOM 1824 CG2 VAL B 13 82.965 9.099 -3.308 1.00 0.00 C ATOM 0 H VAL B 13 82.516 7.694 -5.688 1.00 0.00 H new ATOM 0 HA VAL B 13 80.479 9.355 -4.381 1.00 0.00 H new ATOM 0 HB VAL B 13 83.353 9.889 -5.279 1.00 0.00 H new ATOM 0 HG11 VAL B 13 83.239 11.791 -3.702 1.00 0.00 H new ATOM 0 HG12 VAL B 13 82.030 11.961 -4.997 1.00 0.00 H new ATOM 0 HG13 VAL B 13 81.529 11.423 -3.377 1.00 0.00 H new ATOM 0 HG21 VAL B 13 83.879 9.511 -2.880 1.00 0.00 H new ATOM 0 HG22 VAL B 13 82.168 9.135 -2.565 1.00 0.00 H new ATOM 0 HG23 VAL B 13 83.138 8.065 -3.605 1.00 0.00 H new ATOM 1834 N SER B 14 81.493 10.018 -7.447 1.00 0.00 N ATOM 1835 CA SER B 14 81.116 10.819 -8.646 1.00 0.00 C ATOM 1836 C SER B 14 79.668 10.525 -9.047 1.00 0.00 C ATOM 1837 O SER B 14 78.916 11.423 -9.367 1.00 0.00 O ATOM 1838 CB SER B 14 82.051 10.475 -9.805 1.00 0.00 C ATOM 1839 OG SER B 14 83.381 10.833 -9.452 1.00 0.00 O ATOM 0 H SER B 14 82.276 9.378 -7.580 1.00 0.00 H new ATOM 0 HA SER B 14 81.206 11.879 -8.406 1.00 0.00 H new ATOM 0 HB2 SER B 14 81.995 9.410 -10.030 1.00 0.00 H new ATOM 0 HB3 SER B 14 81.745 11.007 -10.706 1.00 0.00 H new ATOM 0 HG SER B 14 83.749 10.162 -8.840 1.00 0.00 H new ATOM 1845 N THR B 15 79.259 9.283 -9.024 1.00 0.00 N ATOM 1846 CA THR B 15 77.850 8.977 -9.400 1.00 0.00 C ATOM 1847 C THR B 15 76.928 9.700 -8.414 1.00 0.00 C ATOM 1848 O THR B 15 75.935 10.293 -8.785 1.00 0.00 O ATOM 1849 CB THR B 15 77.622 7.450 -9.367 1.00 0.00 C ATOM 1850 OG1 THR B 15 76.595 7.111 -10.287 1.00 0.00 O ATOM 1851 CG2 THR B 15 77.224 6.969 -7.964 1.00 0.00 C ATOM 0 H THR B 15 79.831 8.479 -8.765 1.00 0.00 H new ATOM 0 HA THR B 15 77.634 9.320 -10.412 1.00 0.00 H new ATOM 0 HB THR B 15 78.557 6.961 -9.641 1.00 0.00 H new ATOM 0 HG1 THR B 15 76.349 6.170 -10.170 1.00 0.00 H new ATOM 0 HG21 THR B 15 77.072 5.890 -7.979 1.00 0.00 H new ATOM 0 HG22 THR B 15 78.017 7.214 -7.257 1.00 0.00 H new ATOM 0 HG23 THR B 15 76.301 7.461 -7.659 1.00 0.00 H new ATOM 1859 N PHE B 16 77.278 9.657 -7.160 1.00 0.00 N ATOM 1860 CA PHE B 16 76.466 10.336 -6.114 1.00 0.00 C ATOM 1861 C PHE B 16 76.405 11.834 -6.424 1.00 0.00 C ATOM 1862 O PHE B 16 75.383 12.473 -6.275 1.00 0.00 O ATOM 1863 CB PHE B 16 77.146 10.120 -4.760 1.00 0.00 C ATOM 1864 CG PHE B 16 76.357 10.792 -3.664 1.00 0.00 C ATOM 1865 CD1 PHE B 16 76.491 12.169 -3.454 1.00 0.00 C ATOM 1866 CD2 PHE B 16 75.500 10.039 -2.854 1.00 0.00 C ATOM 1867 CE1 PHE B 16 75.765 12.793 -2.432 1.00 0.00 C ATOM 1868 CE2 PHE B 16 74.778 10.661 -1.832 1.00 0.00 C ATOM 1869 CZ PHE B 16 74.909 12.040 -1.621 1.00 0.00 C ATOM 0 H PHE B 16 78.105 9.173 -6.811 1.00 0.00 H new ATOM 0 HA PHE B 16 75.455 9.930 -6.092 1.00 0.00 H new ATOM 0 HB2 PHE B 16 77.231 9.053 -4.554 1.00 0.00 H new ATOM 0 HB3 PHE B 16 78.159 10.521 -4.786 1.00 0.00 H new ATOM 0 HD1 PHE B 16 77.153 12.750 -4.079 1.00 0.00 H new ATOM 0 HD2 PHE B 16 75.396 8.977 -3.019 1.00 0.00 H new ATOM 0 HE1 PHE B 16 75.866 13.856 -2.270 1.00 0.00 H new ATOM 0 HE2 PHE B 16 74.119 10.079 -1.205 1.00 0.00 H new ATOM 0 HZ PHE B 16 74.349 12.521 -0.833 1.00 0.00 H new ATOM 1879 N HIS B 17 77.501 12.388 -6.858 1.00 0.00 N ATOM 1880 CA HIS B 17 77.541 13.838 -7.192 1.00 0.00 C ATOM 1881 C HIS B 17 76.554 14.139 -8.319 1.00 0.00 C ATOM 1882 O HIS B 17 75.962 15.199 -8.363 1.00 0.00 O ATOM 1883 CB HIS B 17 78.958 14.229 -7.618 1.00 0.00 C ATOM 1884 CG HIS B 17 78.973 15.662 -8.080 1.00 0.00 C ATOM 1885 ND1 HIS B 17 78.552 16.707 -7.269 1.00 0.00 N ATOM 1886 CD2 HIS B 17 79.352 16.237 -9.268 1.00 0.00 C ATOM 1887 CE1 HIS B 17 78.686 17.847 -7.975 1.00 0.00 C ATOM 1888 NE2 HIS B 17 79.169 17.613 -9.196 1.00 0.00 N ATOM 0 H HIS B 17 78.381 11.892 -6.997 1.00 0.00 H new ATOM 0 HA HIS B 17 77.260 14.418 -6.313 1.00 0.00 H new ATOM 0 HB2 HIS B 17 79.648 14.099 -6.784 1.00 0.00 H new ATOM 0 HB3 HIS B 17 79.300 13.575 -8.420 1.00 0.00 H new ATOM 0 HD2 HIS B 17 79.733 15.703 -10.126 1.00 0.00 H new ATOM 0 HE1 HIS B 17 78.434 18.828 -7.599 1.00 0.00 H new ATOM 0 HE2 HIS B 17 79.363 18.300 -9.924 1.00 0.00 H new ATOM 1897 N LYS B 18 76.364 13.227 -9.233 1.00 0.00 N ATOM 1898 CA LYS B 18 75.408 13.505 -10.335 1.00 0.00 C ATOM 1899 C LYS B 18 74.055 13.788 -9.692 1.00 0.00 C ATOM 1900 O LYS B 18 73.360 14.715 -10.059 1.00 0.00 O ATOM 1901 CB LYS B 18 75.315 12.276 -11.253 1.00 0.00 C ATOM 1902 CG LYS B 18 74.332 12.525 -12.409 1.00 0.00 C ATOM 1903 CD LYS B 18 74.891 13.584 -13.371 1.00 0.00 C ATOM 1904 CE LYS B 18 74.145 13.507 -14.706 1.00 0.00 C ATOM 1905 NZ LYS B 18 74.718 14.504 -15.653 1.00 0.00 N ATOM 0 H LYS B 18 76.822 12.316 -9.263 1.00 0.00 H new ATOM 0 HA LYS B 18 75.731 14.355 -10.936 1.00 0.00 H new ATOM 0 HB2 LYS B 18 76.301 12.041 -11.654 1.00 0.00 H new ATOM 0 HB3 LYS B 18 74.991 11.410 -10.676 1.00 0.00 H new ATOM 0 HG2 LYS B 18 74.152 11.595 -12.948 1.00 0.00 H new ATOM 0 HG3 LYS B 18 73.372 12.855 -12.013 1.00 0.00 H new ATOM 0 HD2 LYS B 18 74.781 14.578 -12.938 1.00 0.00 H new ATOM 0 HD3 LYS B 18 75.957 13.421 -13.528 1.00 0.00 H new ATOM 0 HE2 LYS B 18 74.228 12.504 -15.124 1.00 0.00 H new ATOM 0 HE3 LYS B 18 73.084 13.702 -14.554 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 74.212 14.452 -16.560 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 74.617 15.459 -15.254 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 75.726 14.298 -15.807 1.00 0.00 H new ATOM 1919 N TYR B 19 73.704 13.030 -8.693 1.00 0.00 N ATOM 1920 CA TYR B 19 72.429 13.294 -7.980 1.00 0.00 C ATOM 1921 C TYR B 19 72.607 14.594 -7.201 1.00 0.00 C ATOM 1922 O TYR B 19 71.708 15.400 -7.089 1.00 0.00 O ATOM 1923 CB TYR B 19 72.113 12.139 -7.026 1.00 0.00 C ATOM 1924 CG TYR B 19 71.746 10.917 -7.835 1.00 0.00 C ATOM 1925 CD1 TYR B 19 72.746 10.022 -8.227 1.00 0.00 C ATOM 1926 CD2 TYR B 19 70.414 10.683 -8.206 1.00 0.00 C ATOM 1927 CE1 TYR B 19 72.423 8.895 -8.988 1.00 0.00 C ATOM 1928 CE2 TYR B 19 70.087 9.553 -8.966 1.00 0.00 C ATOM 1929 CZ TYR B 19 71.093 8.660 -9.358 1.00 0.00 C ATOM 1930 OH TYR B 19 70.775 7.548 -10.111 1.00 0.00 O ATOM 0 H TYR B 19 74.245 12.240 -8.341 1.00 0.00 H new ATOM 0 HA TYR B 19 71.601 13.380 -8.683 1.00 0.00 H new ATOM 0 HB2 TYR B 19 72.975 11.927 -6.394 1.00 0.00 H new ATOM 0 HB3 TYR B 19 71.292 12.412 -6.364 1.00 0.00 H new ATOM 0 HD1 TYR B 19 73.772 10.202 -7.941 1.00 0.00 H new ATOM 0 HD2 TYR B 19 69.640 11.374 -7.906 1.00 0.00 H new ATOM 0 HE1 TYR B 19 73.198 8.206 -9.290 1.00 0.00 H new ATOM 0 HE2 TYR B 19 69.061 9.370 -9.249 1.00 0.00 H new ATOM 0 HH TYR B 19 71.124 7.658 -11.020 1.00 0.00 H new ATOM 1940 N SER B 20 73.775 14.801 -6.651 1.00 0.00 N ATOM 1941 CA SER B 20 74.027 16.045 -5.870 1.00 0.00 C ATOM 1942 C SER B 20 72.893 16.229 -4.869 1.00 0.00 C ATOM 1943 O SER B 20 72.721 17.280 -4.285 1.00 0.00 O ATOM 1944 CB SER B 20 74.057 17.243 -6.817 1.00 0.00 C ATOM 1945 OG SER B 20 74.310 18.424 -6.068 1.00 0.00 O ATOM 0 H SER B 20 74.566 14.160 -6.710 1.00 0.00 H new ATOM 0 HA SER B 20 74.982 15.970 -5.350 1.00 0.00 H new ATOM 0 HB2 SER B 20 74.830 17.105 -7.573 1.00 0.00 H new ATOM 0 HB3 SER B 20 73.107 17.329 -7.344 1.00 0.00 H new ATOM 0 HG SER B 20 73.841 18.373 -5.209 1.00 0.00 H new ATOM 1951 N GLY B 21 72.103 15.210 -4.686 1.00 0.00 N ATOM 1952 CA GLY B 21 70.959 15.320 -3.738 1.00 0.00 C ATOM 1953 C GLY B 21 69.932 16.285 -4.331 1.00 0.00 C ATOM 1954 O GLY B 21 69.765 17.395 -3.867 1.00 0.00 O ATOM 0 H GLY B 21 72.199 14.307 -5.150 1.00 0.00 H new ATOM 0 HA2 GLY B 21 70.508 14.341 -3.572 1.00 0.00 H new ATOM 0 HA3 GLY B 21 71.303 15.681 -2.769 1.00 0.00 H new ATOM 1958 N LYS B 22 69.262 15.872 -5.371 1.00 0.00 N ATOM 1959 CA LYS B 22 68.260 16.761 -6.026 1.00 0.00 C ATOM 1960 C LYS B 22 67.163 17.140 -5.025 1.00 0.00 C ATOM 1961 O LYS B 22 66.716 18.270 -4.990 1.00 0.00 O ATOM 1962 CB LYS B 22 67.650 16.017 -7.219 1.00 0.00 C ATOM 1963 CG LYS B 22 68.742 15.803 -8.269 1.00 0.00 C ATOM 1964 CD LYS B 22 68.178 15.060 -9.485 1.00 0.00 C ATOM 1965 CE LYS B 22 67.696 13.660 -9.078 1.00 0.00 C ATOM 1966 NZ LYS B 22 67.789 12.751 -10.255 1.00 0.00 N ATOM 0 H LYS B 22 69.366 14.952 -5.798 1.00 0.00 H new ATOM 0 HA LYS B 22 68.744 17.675 -6.370 1.00 0.00 H new ATOM 0 HB2 LYS B 22 67.240 15.059 -6.898 1.00 0.00 H new ATOM 0 HB3 LYS B 22 66.826 16.591 -7.642 1.00 0.00 H new ATOM 0 HG2 LYS B 22 69.150 16.765 -8.580 1.00 0.00 H new ATOM 0 HG3 LYS B 22 69.564 15.233 -7.836 1.00 0.00 H new ATOM 0 HD2 LYS B 22 67.351 15.626 -9.914 1.00 0.00 H new ATOM 0 HD3 LYS B 22 68.943 14.978 -10.257 1.00 0.00 H new ATOM 0 HE2 LYS B 22 68.303 13.277 -8.258 1.00 0.00 H new ATOM 0 HE3 LYS B 22 66.668 13.706 -8.719 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 67.464 11.800 -9.986 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 67.192 13.117 -11.024 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 68.776 12.701 -10.578 1.00 0.00 H new ATOM 1980 N GLU B 23 66.734 16.211 -4.205 1.00 0.00 N ATOM 1981 CA GLU B 23 65.670 16.514 -3.191 1.00 0.00 C ATOM 1982 C GLU B 23 66.277 16.538 -1.793 1.00 0.00 C ATOM 1983 O GLU B 23 67.144 15.753 -1.466 1.00 0.00 O ATOM 1984 CB GLU B 23 64.587 15.439 -3.241 1.00 0.00 C ATOM 1985 CG GLU B 23 63.800 15.577 -4.539 1.00 0.00 C ATOM 1986 CD GLU B 23 62.771 14.449 -4.636 1.00 0.00 C ATOM 1987 OE1 GLU B 23 62.699 13.659 -3.709 1.00 0.00 O ATOM 1988 OE2 GLU B 23 62.070 14.398 -5.633 1.00 0.00 O ATOM 0 H GLU B 23 67.076 15.250 -4.193 1.00 0.00 H new ATOM 0 HA GLU B 23 65.235 17.487 -3.419 1.00 0.00 H new ATOM 0 HB2 GLU B 23 65.038 14.449 -3.179 1.00 0.00 H new ATOM 0 HB3 GLU B 23 63.919 15.539 -2.385 1.00 0.00 H new ATOM 0 HG2 GLU B 23 63.299 16.544 -4.571 1.00 0.00 H new ATOM 0 HG3 GLU B 23 64.477 15.540 -5.393 1.00 0.00 H new ATOM 1995 N GLY B 24 65.822 17.434 -0.963 1.00 0.00 N ATOM 1996 CA GLY B 24 66.367 17.507 0.418 1.00 0.00 C ATOM 1997 C GLY B 24 67.731 18.196 0.389 1.00 0.00 C ATOM 1998 O GLY B 24 68.054 18.909 -0.540 1.00 0.00 O ATOM 0 H GLY B 24 65.097 18.118 -1.182 1.00 0.00 H new ATOM 0 HA2 GLY B 24 65.682 18.058 1.062 1.00 0.00 H new ATOM 0 HA3 GLY B 24 66.462 16.505 0.837 1.00 0.00 H new ATOM 2002 N ASP B 25 68.540 17.987 1.392 1.00 0.00 N ATOM 2003 CA ASP B 25 69.883 18.630 1.400 1.00 0.00 C ATOM 2004 C ASP B 25 70.666 18.154 0.180 1.00 0.00 C ATOM 2005 O ASP B 25 70.690 16.980 -0.135 1.00 0.00 O ATOM 2006 CB ASP B 25 70.631 18.240 2.678 1.00 0.00 C ATOM 2007 CG ASP B 25 69.992 18.945 3.877 1.00 0.00 C ATOM 2008 OD1 ASP B 25 69.325 19.945 3.666 1.00 0.00 O ATOM 2009 OD2 ASP B 25 70.186 18.477 4.987 1.00 0.00 O ATOM 0 H ASP B 25 68.330 17.402 2.201 1.00 0.00 H new ATOM 0 HA ASP B 25 69.775 19.714 1.368 1.00 0.00 H new ATOM 0 HB2 ASP B 25 70.597 17.159 2.817 1.00 0.00 H new ATOM 0 HB3 ASP B 25 71.682 18.518 2.597 1.00 0.00 H new ATOM 2014 N LYS B 26 71.309 19.051 -0.512 1.00 0.00 N ATOM 2015 CA LYS B 26 72.086 18.636 -1.707 1.00 0.00 C ATOM 2016 C LYS B 26 73.334 17.887 -1.248 1.00 0.00 C ATOM 2017 O LYS B 26 74.024 17.267 -2.032 1.00 0.00 O ATOM 2018 CB LYS B 26 72.472 19.868 -2.534 1.00 0.00 C ATOM 2019 CG LYS B 26 73.518 20.699 -1.787 1.00 0.00 C ATOM 2020 CD LYS B 26 73.706 22.040 -2.502 1.00 0.00 C ATOM 2021 CE LYS B 26 74.901 22.781 -1.901 1.00 0.00 C ATOM 2022 NZ LYS B 26 75.235 23.958 -2.751 1.00 0.00 N ATOM 0 H LYS B 26 71.329 20.049 -0.302 1.00 0.00 H new ATOM 0 HA LYS B 26 71.482 17.980 -2.334 1.00 0.00 H new ATOM 0 HB2 LYS B 26 72.867 19.557 -3.501 1.00 0.00 H new ATOM 0 HB3 LYS B 26 71.588 20.474 -2.731 1.00 0.00 H new ATOM 0 HG2 LYS B 26 73.200 20.864 -0.758 1.00 0.00 H new ATOM 0 HG3 LYS B 26 74.465 20.160 -1.745 1.00 0.00 H new ATOM 0 HD2 LYS B 26 73.866 21.876 -3.568 1.00 0.00 H new ATOM 0 HD3 LYS B 26 72.804 22.645 -2.405 1.00 0.00 H new ATOM 0 HE2 LYS B 26 74.668 23.106 -0.887 1.00 0.00 H new ATOM 0 HE3 LYS B 26 75.760 22.113 -1.833 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 76.048 24.462 -2.342 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 75.474 23.636 -3.711 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 74.417 24.598 -2.794 1.00 0.00 H new ATOM 2036 N PHE B 27 73.619 17.929 0.025 1.00 0.00 N ATOM 2037 CA PHE B 27 74.814 17.206 0.548 1.00 0.00 C ATOM 2038 C PHE B 27 74.400 15.793 0.966 1.00 0.00 C ATOM 2039 O PHE B 27 75.218 14.997 1.381 1.00 0.00 O ATOM 2040 CB PHE B 27 75.364 17.936 1.778 1.00 0.00 C ATOM 2041 CG PHE B 27 75.895 19.294 1.386 1.00 0.00 C ATOM 2042 CD1 PHE B 27 77.188 19.416 0.863 1.00 0.00 C ATOM 2043 CD2 PHE B 27 75.101 20.434 1.560 1.00 0.00 C ATOM 2044 CE1 PHE B 27 77.687 20.676 0.513 1.00 0.00 C ATOM 2045 CE2 PHE B 27 75.599 21.695 1.208 1.00 0.00 C ATOM 2046 CZ PHE B 27 76.892 21.815 0.686 1.00 0.00 C ATOM 0 H PHE B 27 73.076 18.433 0.726 1.00 0.00 H new ATOM 0 HA PHE B 27 75.578 17.165 -0.229 1.00 0.00 H new ATOM 0 HB2 PHE B 27 74.578 18.047 2.525 1.00 0.00 H new ATOM 0 HB3 PHE B 27 76.158 17.345 2.235 1.00 0.00 H new ATOM 0 HD1 PHE B 27 77.801 18.537 0.729 1.00 0.00 H new ATOM 0 HD2 PHE B 27 74.104 20.341 1.966 1.00 0.00 H new ATOM 0 HE1 PHE B 27 78.685 20.769 0.110 1.00 0.00 H new ATOM 0 HE2 PHE B 27 74.986 22.574 1.339 1.00 0.00 H new ATOM 0 HZ PHE B 27 77.277 22.787 0.416 1.00 0.00 H new ATOM 2056 N LYS B 28 73.128 15.482 0.884 1.00 0.00 N ATOM 2057 CA LYS B 28 72.653 14.125 1.304 1.00 0.00 C ATOM 2058 C LYS B 28 71.545 13.634 0.364 1.00 0.00 C ATOM 2059 O LYS B 28 71.088 14.350 -0.505 1.00 0.00 O ATOM 2060 CB LYS B 28 72.105 14.197 2.728 1.00 0.00 C ATOM 2061 CG LYS B 28 73.203 14.666 3.682 1.00 0.00 C ATOM 2062 CD LYS B 28 72.650 14.737 5.105 1.00 0.00 C ATOM 2063 CE LYS B 28 73.759 15.207 6.045 1.00 0.00 C ATOM 2064 NZ LYS B 28 73.252 15.224 7.447 1.00 0.00 N ATOM 0 H LYS B 28 72.399 16.109 0.545 1.00 0.00 H new ATOM 0 HA LYS B 28 73.492 13.430 1.261 1.00 0.00 H new ATOM 0 HB2 LYS B 28 71.259 14.883 2.768 1.00 0.00 H new ATOM 0 HB3 LYS B 28 71.737 13.218 3.036 1.00 0.00 H new ATOM 0 HG2 LYS B 28 74.049 13.980 3.644 1.00 0.00 H new ATOM 0 HG3 LYS B 28 73.572 15.645 3.375 1.00 0.00 H new ATOM 0 HD2 LYS B 28 71.804 15.424 5.147 1.00 0.00 H new ATOM 0 HD3 LYS B 28 72.282 13.759 5.416 1.00 0.00 H new ATOM 0 HE2 LYS B 28 74.621 14.544 5.967 1.00 0.00 H new ATOM 0 HE3 LYS B 28 74.096 16.203 5.757 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 74.008 15.544 8.086 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 72.443 15.873 7.516 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 72.951 14.266 7.719 1.00 0.00 H new ATOM 2078 N LEU B 29 71.113 12.406 0.543 1.00 0.00 N ATOM 2079 CA LEU B 29 70.032 11.822 -0.321 1.00 0.00 C ATOM 2080 C LEU B 29 68.864 11.399 0.579 1.00 0.00 C ATOM 2081 O LEU B 29 69.016 11.227 1.772 1.00 0.00 O ATOM 2082 CB LEU B 29 70.595 10.585 -1.074 1.00 0.00 C ATOM 2083 CG LEU B 29 70.572 10.789 -2.594 1.00 0.00 C ATOM 2084 CD1 LEU B 29 71.621 11.828 -3.008 1.00 0.00 C ATOM 2085 CD2 LEU B 29 70.879 9.449 -3.274 1.00 0.00 C ATOM 0 H LEU B 29 71.468 11.775 1.261 1.00 0.00 H new ATOM 0 HA LEU B 29 69.687 12.556 -1.049 1.00 0.00 H new ATOM 0 HB2 LEU B 29 71.617 10.394 -0.748 1.00 0.00 H new ATOM 0 HB3 LEU B 29 70.008 9.703 -0.816 1.00 0.00 H new ATOM 0 HG LEU B 29 69.589 11.149 -2.898 1.00 0.00 H new ATOM 0 HD11 LEU B 29 71.593 11.962 -4.089 1.00 0.00 H new ATOM 0 HD12 LEU B 29 71.405 12.778 -2.519 1.00 0.00 H new ATOM 0 HD13 LEU B 29 72.611 11.483 -2.711 1.00 0.00 H new ATOM 0 HD21 LEU B 29 70.866 9.579 -4.356 1.00 0.00 H new ATOM 0 HD22 LEU B 29 71.863 9.100 -2.962 1.00 0.00 H new ATOM 0 HD23 LEU B 29 70.126 8.715 -2.988 1.00 0.00 H new ATOM 2097 N ASN B 30 67.701 11.223 0.008 1.00 0.00 N ATOM 2098 CA ASN B 30 66.518 10.798 0.809 1.00 0.00 C ATOM 2099 C ASN B 30 66.340 9.286 0.659 1.00 0.00 C ATOM 2100 O ASN B 30 66.475 8.742 -0.412 1.00 0.00 O ATOM 2101 CB ASN B 30 65.267 11.513 0.292 1.00 0.00 C ATOM 2102 CG ASN B 30 65.358 13.001 0.628 1.00 0.00 C ATOM 2103 OD1 ASN B 30 65.242 13.842 -0.242 1.00 0.00 O ATOM 2104 ND2 ASN B 30 65.564 13.366 1.864 1.00 0.00 N ATOM 0 H ASN B 30 67.520 11.357 -0.987 1.00 0.00 H new ATOM 0 HA ASN B 30 66.669 11.053 1.858 1.00 0.00 H new ATOM 0 HB2 ASN B 30 65.176 11.377 -0.786 1.00 0.00 H new ATOM 0 HB3 ASN B 30 64.374 11.081 0.744 1.00 0.00 H new ATOM 0 HD21 ASN B 30 65.628 14.356 2.099 1.00 0.00 H new ATOM 0 HD22 ASN B 30 65.661 12.661 2.595 1.00 0.00 H new ATOM 2111 N LYS B 31 66.054 8.609 1.735 1.00 0.00 N ATOM 2112 CA LYS B 31 65.876 7.127 1.690 1.00 0.00 C ATOM 2113 C LYS B 31 65.093 6.726 0.441 1.00 0.00 C ATOM 2114 O LYS B 31 65.324 5.693 -0.149 1.00 0.00 O ATOM 2115 CB LYS B 31 65.097 6.697 2.938 1.00 0.00 C ATOM 2116 CG LYS B 31 63.772 7.459 3.013 1.00 0.00 C ATOM 2117 CD LYS B 31 63.007 7.020 4.260 1.00 0.00 C ATOM 2118 CE LYS B 31 61.680 7.778 4.341 1.00 0.00 C ATOM 2119 NZ LYS B 31 61.951 9.238 4.467 1.00 0.00 N ATOM 0 H LYS B 31 65.934 9.024 2.659 1.00 0.00 H new ATOM 0 HA LYS B 31 66.851 6.641 1.661 1.00 0.00 H new ATOM 0 HB2 LYS B 31 64.908 5.624 2.908 1.00 0.00 H new ATOM 0 HB3 LYS B 31 65.689 6.891 3.832 1.00 0.00 H new ATOM 0 HG2 LYS B 31 63.958 8.533 3.046 1.00 0.00 H new ATOM 0 HG3 LYS B 31 63.177 7.266 2.120 1.00 0.00 H new ATOM 0 HD2 LYS B 31 62.823 5.946 4.227 1.00 0.00 H new ATOM 0 HD3 LYS B 31 63.603 7.214 5.152 1.00 0.00 H new ATOM 0 HE2 LYS B 31 61.082 7.583 3.450 1.00 0.00 H new ATOM 0 HE3 LYS B 31 61.101 7.429 5.196 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 61.328 9.645 5.193 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 62.944 9.384 4.741 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 61.771 9.705 3.555 1.00 0.00 H new ATOM 2133 N SER B 32 64.184 7.542 0.020 1.00 0.00 N ATOM 2134 CA SER B 32 63.414 7.211 -1.200 1.00 0.00 C ATOM 2135 C SER B 32 64.394 7.126 -2.351 1.00 0.00 C ATOM 2136 O SER B 32 64.312 6.264 -3.201 1.00 0.00 O ATOM 2137 CB SER B 32 62.386 8.289 -1.496 1.00 0.00 C ATOM 2138 OG SER B 32 61.371 8.262 -0.502 1.00 0.00 O ATOM 0 H SER B 32 63.938 8.426 0.466 1.00 0.00 H new ATOM 0 HA SER B 32 62.886 6.268 -1.059 1.00 0.00 H new ATOM 0 HB2 SER B 32 62.865 9.268 -1.515 1.00 0.00 H new ATOM 0 HB3 SER B 32 61.949 8.129 -2.482 1.00 0.00 H new ATOM 0 HG SER B 32 60.709 8.959 -0.692 1.00 0.00 H new ATOM 2144 N GLU B 33 65.340 8.017 -2.369 1.00 0.00 N ATOM 2145 CA GLU B 33 66.346 7.987 -3.449 1.00 0.00 C ATOM 2146 C GLU B 33 67.033 6.653 -3.381 1.00 0.00 C ATOM 2147 O GLU B 33 67.532 6.173 -4.364 1.00 0.00 O ATOM 2148 CB GLU B 33 67.356 9.126 -3.285 1.00 0.00 C ATOM 2149 CG GLU B 33 66.648 10.465 -3.509 1.00 0.00 C ATOM 2150 CD GLU B 33 66.221 10.579 -4.974 1.00 0.00 C ATOM 2151 OE1 GLU B 33 67.072 10.416 -5.833 1.00 0.00 O ATOM 2152 OE2 GLU B 33 65.050 10.828 -5.212 1.00 0.00 O ATOM 0 H GLU B 33 65.457 8.762 -1.682 1.00 0.00 H new ATOM 0 HA GLU B 33 65.868 8.123 -4.419 1.00 0.00 H new ATOM 0 HB2 GLU B 33 67.796 9.096 -2.288 1.00 0.00 H new ATOM 0 HB3 GLU B 33 68.172 9.009 -3.998 1.00 0.00 H new ATOM 0 HG2 GLU B 33 65.777 10.541 -2.858 1.00 0.00 H new ATOM 0 HG3 GLU B 33 67.313 11.288 -3.248 1.00 0.00 H new ATOM 2159 N LEU B 34 67.037 6.007 -2.248 1.00 0.00 N ATOM 2160 CA LEU B 34 67.684 4.670 -2.241 1.00 0.00 C ATOM 2161 C LEU B 34 66.911 3.830 -3.239 1.00 0.00 C ATOM 2162 O LEU B 34 67.471 3.073 -3.993 1.00 0.00 O ATOM 2163 CB LEU B 34 67.615 4.006 -0.840 1.00 0.00 C ATOM 2164 CG LEU B 34 68.381 2.641 -0.754 1.00 0.00 C ATOM 2165 CD1 LEU B 34 67.471 1.443 -1.151 1.00 0.00 C ATOM 2166 CD2 LEU B 34 69.643 2.650 -1.635 1.00 0.00 C ATOM 0 H LEU B 34 66.640 6.329 -1.365 1.00 0.00 H new ATOM 0 HA LEU B 34 68.740 4.757 -2.497 1.00 0.00 H new ATOM 0 HB2 LEU B 34 68.029 4.692 -0.101 1.00 0.00 H new ATOM 0 HB3 LEU B 34 66.570 3.844 -0.575 1.00 0.00 H new ATOM 0 HG LEU B 34 68.680 2.515 0.287 1.00 0.00 H new ATOM 0 HD11 LEU B 34 68.039 0.515 -1.079 1.00 0.00 H new ATOM 0 HD12 LEU B 34 66.615 1.398 -0.478 1.00 0.00 H new ATOM 0 HD13 LEU B 34 67.121 1.575 -2.175 1.00 0.00 H new ATOM 0 HD21 LEU B 34 70.151 1.689 -1.553 1.00 0.00 H new ATOM 0 HD22 LEU B 34 69.361 2.823 -2.673 1.00 0.00 H new ATOM 0 HD23 LEU B 34 70.312 3.444 -1.304 1.00 0.00 H new ATOM 2178 N LYS B 35 65.611 3.979 -3.249 1.00 0.00 N ATOM 2179 CA LYS B 35 64.795 3.195 -4.211 1.00 0.00 C ATOM 2180 C LYS B 35 65.041 3.705 -5.635 1.00 0.00 C ATOM 2181 O LYS B 35 65.374 2.949 -6.523 1.00 0.00 O ATOM 2182 CB LYS B 35 63.309 3.323 -3.836 1.00 0.00 C ATOM 2183 CG LYS B 35 62.410 2.736 -4.934 1.00 0.00 C ATOM 2184 CD LYS B 35 62.789 1.280 -5.207 1.00 0.00 C ATOM 2185 CE LYS B 35 61.708 0.630 -6.069 1.00 0.00 C ATOM 2186 NZ LYS B 35 61.582 1.373 -7.356 1.00 0.00 N ATOM 0 H LYS B 35 65.087 4.605 -2.637 1.00 0.00 H new ATOM 0 HA LYS B 35 65.080 2.144 -4.169 1.00 0.00 H new ATOM 0 HB2 LYS B 35 63.122 2.807 -2.894 1.00 0.00 H new ATOM 0 HB3 LYS B 35 63.059 4.372 -3.679 1.00 0.00 H new ATOM 0 HG2 LYS B 35 61.365 2.796 -4.629 1.00 0.00 H new ATOM 0 HG3 LYS B 35 62.510 3.322 -5.847 1.00 0.00 H new ATOM 0 HD2 LYS B 35 63.753 1.232 -5.714 1.00 0.00 H new ATOM 0 HD3 LYS B 35 62.896 0.738 -4.268 1.00 0.00 H new ATOM 0 HE2 LYS B 35 61.961 -0.413 -6.262 1.00 0.00 H new ATOM 0 HE3 LYS B 35 60.755 0.634 -5.540 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 61.229 0.731 -8.094 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 60.916 2.163 -7.237 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 62.513 1.744 -7.635 1.00 0.00 H new ATOM 2200 N GLU B 36 64.882 4.982 -5.856 1.00 0.00 N ATOM 2201 CA GLU B 36 65.108 5.538 -7.224 1.00 0.00 C ATOM 2202 C GLU B 36 66.587 5.421 -7.598 1.00 0.00 C ATOM 2203 O GLU B 36 66.927 5.098 -8.719 1.00 0.00 O ATOM 2204 CB GLU B 36 64.651 7.001 -7.272 1.00 0.00 C ATOM 2205 CG GLU B 36 65.005 7.616 -8.627 1.00 0.00 C ATOM 2206 CD GLU B 36 64.307 8.971 -8.772 1.00 0.00 C ATOM 2207 OE1 GLU B 36 63.604 9.355 -7.852 1.00 0.00 O ATOM 2208 OE2 GLU B 36 64.485 9.599 -9.803 1.00 0.00 O ATOM 0 H GLU B 36 64.606 5.665 -5.150 1.00 0.00 H new ATOM 0 HA GLU B 36 64.524 4.968 -7.946 1.00 0.00 H new ATOM 0 HB2 GLU B 36 63.575 7.060 -7.107 1.00 0.00 H new ATOM 0 HB3 GLU B 36 65.128 7.566 -6.471 1.00 0.00 H new ATOM 0 HG2 GLU B 36 66.085 7.741 -8.711 1.00 0.00 H new ATOM 0 HG3 GLU B 36 64.698 6.949 -9.432 1.00 0.00 H new ATOM 2215 N LEU B 37 67.472 5.667 -6.674 1.00 0.00 N ATOM 2216 CA LEU B 37 68.921 5.556 -6.985 1.00 0.00 C ATOM 2217 C LEU B 37 69.207 4.128 -7.425 1.00 0.00 C ATOM 2218 O LEU B 37 70.012 3.883 -8.301 1.00 0.00 O ATOM 2219 CB LEU B 37 69.751 5.881 -5.729 1.00 0.00 C ATOM 2220 CG LEU B 37 71.257 5.776 -6.023 1.00 0.00 C ATOM 2221 CD1 LEU B 37 71.671 6.835 -7.057 1.00 0.00 C ATOM 2222 CD2 LEU B 37 72.031 5.999 -4.717 1.00 0.00 C ATOM 0 H LEU B 37 67.253 5.940 -5.716 1.00 0.00 H new ATOM 0 HA LEU B 37 69.188 6.258 -7.775 1.00 0.00 H new ATOM 0 HB2 LEU B 37 69.514 6.887 -5.382 1.00 0.00 H new ATOM 0 HB3 LEU B 37 69.485 5.195 -4.925 1.00 0.00 H new ATOM 0 HG LEU B 37 71.482 4.789 -6.427 1.00 0.00 H new ATOM 0 HD11 LEU B 37 72.739 6.750 -7.257 1.00 0.00 H new ATOM 0 HD12 LEU B 37 71.115 6.678 -7.981 1.00 0.00 H new ATOM 0 HD13 LEU B 37 71.452 7.829 -6.667 1.00 0.00 H new ATOM 0 HD21 LEU B 37 73.101 5.927 -4.911 1.00 0.00 H new ATOM 0 HD22 LEU B 37 71.800 6.988 -4.321 1.00 0.00 H new ATOM 0 HD23 LEU B 37 71.743 5.241 -3.989 1.00 0.00 H new ATOM 2234 N LEU B 38 68.584 3.178 -6.788 1.00 0.00 N ATOM 2235 CA LEU B 38 68.867 1.753 -7.148 1.00 0.00 C ATOM 2236 C LEU B 38 68.518 1.460 -8.616 1.00 0.00 C ATOM 2237 O LEU B 38 69.304 0.886 -9.341 1.00 0.00 O ATOM 2238 CB LEU B 38 68.062 0.804 -6.221 1.00 0.00 C ATOM 2239 CG LEU B 38 69.007 -0.162 -5.477 1.00 0.00 C ATOM 2240 CD1 LEU B 38 69.854 -0.961 -6.494 1.00 0.00 C ATOM 2241 CD2 LEU B 38 69.921 0.629 -4.502 1.00 0.00 C ATOM 0 H LEU B 38 67.900 3.318 -6.044 1.00 0.00 H new ATOM 0 HA LEU B 38 69.935 1.582 -7.014 1.00 0.00 H new ATOM 0 HB2 LEU B 38 67.491 1.389 -5.500 1.00 0.00 H new ATOM 0 HB3 LEU B 38 67.343 0.235 -6.811 1.00 0.00 H new ATOM 0 HG LEU B 38 68.412 -0.865 -4.895 1.00 0.00 H new ATOM 0 HD11 LEU B 38 70.518 -1.640 -5.960 1.00 0.00 H new ATOM 0 HD12 LEU B 38 69.195 -1.535 -7.145 1.00 0.00 H new ATOM 0 HD13 LEU B 38 70.447 -0.272 -7.095 1.00 0.00 H new ATOM 0 HD21 LEU B 38 70.584 -0.063 -3.982 1.00 0.00 H new ATOM 0 HD22 LEU B 38 70.516 1.348 -5.064 1.00 0.00 H new ATOM 0 HD23 LEU B 38 69.305 1.157 -3.774 1.00 0.00 H new ATOM 2253 N THR B 39 67.347 1.808 -9.050 1.00 0.00 N ATOM 2254 CA THR B 39 66.970 1.493 -10.458 1.00 0.00 C ATOM 2255 C THR B 39 67.717 2.408 -11.421 1.00 0.00 C ATOM 2256 O THR B 39 67.973 2.058 -12.556 1.00 0.00 O ATOM 2257 CB THR B 39 65.460 1.695 -10.650 1.00 0.00 C ATOM 2258 OG1 THR B 39 65.212 3.020 -11.104 1.00 0.00 O ATOM 2259 CG2 THR B 39 64.741 1.484 -9.321 1.00 0.00 C ATOM 0 H THR B 39 66.636 2.292 -8.502 1.00 0.00 H new ATOM 0 HA THR B 39 67.234 0.456 -10.664 1.00 0.00 H new ATOM 0 HB THR B 39 65.094 0.977 -11.384 1.00 0.00 H new ATOM 0 HG1 THR B 39 64.248 3.148 -11.228 1.00 0.00 H new ATOM 0 HG21 THR B 39 63.670 1.628 -9.460 1.00 0.00 H new ATOM 0 HG22 THR B 39 64.928 0.471 -8.963 1.00 0.00 H new ATOM 0 HG23 THR B 39 65.111 2.202 -8.589 1.00 0.00 H new ATOM 2267 N ARG B 40 68.046 3.586 -10.988 1.00 0.00 N ATOM 2268 CA ARG B 40 68.748 4.526 -11.892 1.00 0.00 C ATOM 2269 C ARG B 40 70.165 4.037 -12.150 1.00 0.00 C ATOM 2270 O ARG B 40 70.677 4.154 -13.246 1.00 0.00 O ATOM 2271 CB ARG B 40 68.796 5.921 -11.260 1.00 0.00 C ATOM 2272 CG ARG B 40 67.394 6.544 -11.226 1.00 0.00 C ATOM 2273 CD ARG B 40 67.020 7.132 -12.593 1.00 0.00 C ATOM 2274 NE ARG B 40 65.687 7.789 -12.485 1.00 0.00 N ATOM 2275 CZ ARG B 40 65.262 8.564 -13.443 1.00 0.00 C ATOM 2276 NH1 ARG B 40 66.010 8.772 -14.490 1.00 0.00 N ATOM 2277 NH2 ARG B 40 64.089 9.128 -13.355 1.00 0.00 N ATOM 0 H ARG B 40 67.860 3.938 -10.049 1.00 0.00 H new ATOM 0 HA ARG B 40 68.207 4.577 -12.837 1.00 0.00 H new ATOM 0 HB2 ARG B 40 69.196 5.855 -10.248 1.00 0.00 H new ATOM 0 HB3 ARG B 40 69.471 6.561 -11.828 1.00 0.00 H new ATOM 0 HG2 ARG B 40 66.663 5.788 -10.939 1.00 0.00 H new ATOM 0 HG3 ARG B 40 67.358 7.326 -10.468 1.00 0.00 H new ATOM 0 HD2 ARG B 40 67.772 7.854 -12.912 1.00 0.00 H new ATOM 0 HD3 ARG B 40 66.993 6.346 -13.347 1.00 0.00 H new ATOM 0 HE ARG B 40 65.107 7.632 -11.661 1.00 0.00 H new ATOM 0 HH11 ARG B 40 66.926 8.329 -14.559 1.00 0.00 H new ATOM 0 HH12 ARG B 40 65.679 9.378 -15.241 1.00 0.00 H new ATOM 0 HH21 ARG B 40 63.504 8.963 -12.536 1.00 0.00 H new ATOM 0 HH22 ARG B 40 63.757 9.734 -14.105 1.00 0.00 H new ATOM 2291 N GLU B 41 70.813 3.500 -11.149 1.00 0.00 N ATOM 2292 CA GLU B 41 72.215 3.015 -11.338 1.00 0.00 C ATOM 2293 C GLU B 41 72.214 1.512 -11.478 1.00 0.00 C ATOM 2294 O GLU B 41 73.155 0.933 -11.985 1.00 0.00 O ATOM 2295 CB GLU B 41 73.056 3.427 -10.132 1.00 0.00 C ATOM 2296 CG GLU B 41 73.085 4.954 -10.039 1.00 0.00 C ATOM 2297 CD GLU B 41 73.868 5.524 -11.224 1.00 0.00 C ATOM 2298 OE1 GLU B 41 75.036 5.195 -11.353 1.00 0.00 O ATOM 2299 OE2 GLU B 41 73.285 6.280 -11.984 1.00 0.00 O ATOM 0 H GLU B 41 70.434 3.376 -10.210 1.00 0.00 H new ATOM 0 HA GLU B 41 72.639 3.455 -12.240 1.00 0.00 H new ATOM 0 HB2 GLU B 41 72.638 3.003 -9.219 1.00 0.00 H new ATOM 0 HB3 GLU B 41 74.069 3.037 -10.229 1.00 0.00 H new ATOM 0 HG2 GLU B 41 72.069 5.348 -10.038 1.00 0.00 H new ATOM 0 HG3 GLU B 41 73.548 5.263 -9.102 1.00 0.00 H new ATOM 2306 N LEU B 42 71.165 0.872 -11.050 1.00 0.00 N ATOM 2307 CA LEU B 42 71.098 -0.611 -11.169 1.00 0.00 C ATOM 2308 C LEU B 42 69.669 -1.025 -11.566 1.00 0.00 C ATOM 2309 O LEU B 42 68.906 -1.483 -10.738 1.00 0.00 O ATOM 2310 CB LEU B 42 71.473 -1.234 -9.811 1.00 0.00 C ATOM 2311 CG LEU B 42 73.012 -1.273 -9.643 1.00 0.00 C ATOM 2312 CD1 LEU B 42 73.386 -1.190 -8.153 1.00 0.00 C ATOM 2313 CD2 LEU B 42 73.564 -2.578 -10.237 1.00 0.00 C ATOM 0 H LEU B 42 70.350 1.311 -10.622 1.00 0.00 H new ATOM 0 HA LEU B 42 71.792 -0.961 -11.933 1.00 0.00 H new ATOM 0 HB2 LEU B 42 71.027 -0.655 -9.002 1.00 0.00 H new ATOM 0 HB3 LEU B 42 71.067 -2.243 -9.742 1.00 0.00 H new ATOM 0 HG LEU B 42 73.445 -0.421 -10.167 1.00 0.00 H new ATOM 0 HD11 LEU B 42 74.471 -1.218 -8.048 1.00 0.00 H new ATOM 0 HD12 LEU B 42 73.005 -0.259 -7.734 1.00 0.00 H new ATOM 0 HD13 LEU B 42 72.948 -2.034 -7.620 1.00 0.00 H new ATOM 0 HD21 LEU B 42 74.647 -2.603 -10.117 1.00 0.00 H new ATOM 0 HD22 LEU B 42 73.122 -3.429 -9.719 1.00 0.00 H new ATOM 0 HD23 LEU B 42 73.315 -2.629 -11.297 1.00 0.00 H new ATOM 2325 N PRO B 43 69.300 -0.860 -12.820 1.00 0.00 N ATOM 2326 CA PRO B 43 67.929 -1.224 -13.280 1.00 0.00 C ATOM 2327 C PRO B 43 67.758 -2.739 -13.520 1.00 0.00 C ATOM 2328 O PRO B 43 67.561 -3.499 -12.596 1.00 0.00 O ATOM 2329 CB PRO B 43 67.822 -0.411 -14.583 1.00 0.00 C ATOM 2330 CG PRO B 43 69.255 -0.120 -15.065 1.00 0.00 C ATOM 2331 CD PRO B 43 70.206 -0.297 -13.863 1.00 0.00 C ATOM 0 HA PRO B 43 67.151 -1.003 -12.550 1.00 0.00 H new ATOM 0 HB2 PRO B 43 67.269 -0.969 -15.339 1.00 0.00 H new ATOM 0 HB3 PRO B 43 67.279 0.518 -14.412 1.00 0.00 H new ATOM 0 HG2 PRO B 43 69.531 -0.798 -15.873 1.00 0.00 H new ATOM 0 HG3 PRO B 43 69.326 0.893 -15.461 1.00 0.00 H new ATOM 0 HD2 PRO B 43 71.030 -0.972 -14.093 1.00 0.00 H new ATOM 0 HD3 PRO B 43 70.647 0.650 -13.551 1.00 0.00 H new ATOM 2339 N SER B 44 67.818 -3.178 -14.749 1.00 0.00 N ATOM 2340 CA SER B 44 67.644 -4.630 -15.048 1.00 0.00 C ATOM 2341 C SER B 44 68.719 -5.458 -14.334 1.00 0.00 C ATOM 2342 O SER B 44 68.461 -6.531 -13.834 1.00 0.00 O ATOM 2343 CB SER B 44 67.748 -4.844 -16.559 1.00 0.00 C ATOM 2344 OG SER B 44 66.630 -4.237 -17.194 1.00 0.00 O ATOM 0 H SER B 44 67.981 -2.588 -15.565 1.00 0.00 H new ATOM 0 HA SER B 44 66.666 -4.953 -14.692 1.00 0.00 H new ATOM 0 HB2 SER B 44 68.675 -4.412 -16.937 1.00 0.00 H new ATOM 0 HB3 SER B 44 67.777 -5.910 -16.787 1.00 0.00 H new ATOM 0 HG SER B 44 66.692 -4.370 -18.163 1.00 0.00 H new ATOM 2350 N PHE B 45 69.924 -4.972 -14.304 1.00 0.00 N ATOM 2351 CA PHE B 45 71.038 -5.723 -13.648 1.00 0.00 C ATOM 2352 C PHE B 45 70.698 -6.050 -12.194 1.00 0.00 C ATOM 2353 O PHE B 45 71.424 -6.754 -11.521 1.00 0.00 O ATOM 2354 CB PHE B 45 72.270 -4.835 -13.647 1.00 0.00 C ATOM 2355 CG PHE B 45 72.776 -4.664 -15.057 1.00 0.00 C ATOM 2356 CD1 PHE B 45 73.715 -5.563 -15.575 1.00 0.00 C ATOM 2357 CD2 PHE B 45 72.310 -3.606 -15.846 1.00 0.00 C ATOM 2358 CE1 PHE B 45 74.189 -5.405 -16.883 1.00 0.00 C ATOM 2359 CE2 PHE B 45 72.782 -3.447 -17.154 1.00 0.00 C ATOM 2360 CZ PHE B 45 73.722 -4.347 -17.672 1.00 0.00 C ATOM 0 H PHE B 45 70.193 -4.076 -14.710 1.00 0.00 H new ATOM 0 HA PHE B 45 71.204 -6.652 -14.194 1.00 0.00 H new ATOM 0 HB2 PHE B 45 72.029 -3.863 -13.217 1.00 0.00 H new ATOM 0 HB3 PHE B 45 73.047 -5.276 -13.023 1.00 0.00 H new ATOM 0 HD1 PHE B 45 74.074 -6.379 -14.966 1.00 0.00 H new ATOM 0 HD2 PHE B 45 71.586 -2.912 -15.445 1.00 0.00 H new ATOM 0 HE1 PHE B 45 74.914 -6.098 -17.283 1.00 0.00 H new ATOM 0 HE2 PHE B 45 72.422 -2.631 -17.763 1.00 0.00 H new ATOM 0 HZ PHE B 45 74.087 -4.225 -18.681 1.00 0.00 H new ATOM 2370 N LEU B 46 69.623 -5.525 -11.695 1.00 0.00 N ATOM 2371 CA LEU B 46 69.250 -5.778 -10.269 1.00 0.00 C ATOM 2372 C LEU B 46 67.738 -5.809 -10.171 1.00 0.00 C ATOM 2373 O LEU B 46 67.146 -6.776 -9.736 1.00 0.00 O ATOM 2374 CB LEU B 46 69.806 -4.635 -9.415 1.00 0.00 C ATOM 2375 CG LEU B 46 69.554 -4.891 -7.903 1.00 0.00 C ATOM 2376 CD1 LEU B 46 70.756 -4.387 -7.082 1.00 0.00 C ATOM 2377 CD2 LEU B 46 68.282 -4.150 -7.443 1.00 0.00 C ATOM 0 H LEU B 46 68.977 -4.927 -12.210 1.00 0.00 H new ATOM 0 HA LEU B 46 69.658 -6.726 -9.918 1.00 0.00 H new ATOM 0 HB2 LEU B 46 70.876 -4.529 -9.596 1.00 0.00 H new ATOM 0 HB3 LEU B 46 69.339 -3.696 -9.711 1.00 0.00 H new ATOM 0 HG LEU B 46 69.424 -5.962 -7.747 1.00 0.00 H new ATOM 0 HD11 LEU B 46 70.575 -4.569 -6.023 1.00 0.00 H new ATOM 0 HD12 LEU B 46 71.656 -4.917 -7.392 1.00 0.00 H new ATOM 0 HD13 LEU B 46 70.888 -3.318 -7.249 1.00 0.00 H new ATOM 0 HD21 LEU B 46 68.116 -4.337 -6.382 1.00 0.00 H new ATOM 0 HD22 LEU B 46 68.405 -3.080 -7.608 1.00 0.00 H new ATOM 0 HD23 LEU B 46 67.425 -4.509 -8.013 1.00 0.00 H new ATOM 2389 N GLY B 47 67.108 -4.768 -10.619 1.00 0.00 N ATOM 2390 CA GLY B 47 65.627 -4.732 -10.608 1.00 0.00 C ATOM 2391 C GLY B 47 65.145 -5.641 -11.733 1.00 0.00 C ATOM 2392 O GLY B 47 64.106 -5.431 -12.320 1.00 0.00 O ATOM 0 H GLY B 47 67.559 -3.934 -10.995 1.00 0.00 H new ATOM 0 HA2 GLY B 47 65.241 -5.072 -9.647 1.00 0.00 H new ATOM 0 HA3 GLY B 47 65.266 -3.714 -10.755 1.00 0.00 H new ATOM 2396 N LYS B 48 65.921 -6.643 -12.049 1.00 0.00 N ATOM 2397 CA LYS B 48 65.551 -7.577 -13.146 1.00 0.00 C ATOM 2398 C LYS B 48 64.112 -8.086 -12.942 1.00 0.00 C ATOM 2399 O LYS B 48 63.579 -8.807 -13.761 1.00 0.00 O ATOM 2400 CB LYS B 48 66.516 -8.777 -13.122 1.00 0.00 C ATOM 2401 CG LYS B 48 66.502 -9.515 -14.473 1.00 0.00 C ATOM 2402 CD LYS B 48 67.425 -8.809 -15.476 1.00 0.00 C ATOM 2403 CE LYS B 48 67.520 -9.640 -16.755 1.00 0.00 C ATOM 2404 NZ LYS B 48 68.431 -8.960 -17.718 1.00 0.00 N ATOM 0 H LYS B 48 66.805 -6.855 -11.587 1.00 0.00 H new ATOM 0 HA LYS B 48 65.615 -7.057 -14.102 1.00 0.00 H new ATOM 0 HB2 LYS B 48 67.526 -8.433 -12.901 1.00 0.00 H new ATOM 0 HB3 LYS B 48 66.231 -9.463 -12.324 1.00 0.00 H new ATOM 0 HG2 LYS B 48 66.825 -10.547 -14.335 1.00 0.00 H new ATOM 0 HG3 LYS B 48 65.486 -9.549 -14.866 1.00 0.00 H new ATOM 0 HD2 LYS B 48 67.040 -7.815 -15.703 1.00 0.00 H new ATOM 0 HD3 LYS B 48 68.416 -8.675 -15.042 1.00 0.00 H new ATOM 0 HE2 LYS B 48 67.893 -10.638 -16.527 1.00 0.00 H new ATOM 0 HE3 LYS B 48 66.531 -9.763 -17.197 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 68.498 -9.523 -18.590 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 68.056 -8.016 -17.943 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 69.376 -8.865 -17.294 1.00 0.00 H new ATOM 2418 N ARG B 49 63.496 -7.740 -11.839 1.00 0.00 N ATOM 2419 CA ARG B 49 62.109 -8.218 -11.550 1.00 0.00 C ATOM 2420 C ARG B 49 62.084 -9.747 -11.552 1.00 0.00 C ATOM 2421 O ARG B 49 61.033 -10.356 -11.550 1.00 0.00 O ATOM 2422 CB ARG B 49 61.109 -7.695 -12.595 1.00 0.00 C ATOM 2423 CG ARG B 49 60.885 -6.194 -12.406 1.00 0.00 C ATOM 2424 CD ARG B 49 59.869 -5.699 -13.436 1.00 0.00 C ATOM 2425 NE ARG B 49 58.580 -6.425 -13.252 1.00 0.00 N ATOM 2426 CZ ARG B 49 57.478 -5.939 -13.756 1.00 0.00 C ATOM 2427 NH1 ARG B 49 57.495 -4.792 -14.377 1.00 0.00 N ATOM 2428 NH2 ARG B 49 56.358 -6.597 -13.630 1.00 0.00 N ATOM 0 H ARG B 49 63.899 -7.140 -11.119 1.00 0.00 H new ATOM 0 HA ARG B 49 61.817 -7.837 -10.571 1.00 0.00 H new ATOM 0 HB2 ARG B 49 61.485 -7.890 -13.599 1.00 0.00 H new ATOM 0 HB3 ARG B 49 60.162 -8.226 -12.501 1.00 0.00 H new ATOM 0 HG2 ARG B 49 60.524 -5.993 -11.397 1.00 0.00 H new ATOM 0 HG3 ARG B 49 61.827 -5.657 -12.521 1.00 0.00 H new ATOM 0 HD2 ARG B 49 59.714 -4.626 -13.323 1.00 0.00 H new ATOM 0 HD3 ARG B 49 60.249 -5.861 -14.445 1.00 0.00 H new ATOM 0 HE ARG B 49 58.559 -7.302 -12.732 1.00 0.00 H new ATOM 0 HH11 ARG B 49 58.369 -4.275 -14.469 1.00 0.00 H new ATOM 0 HH12 ARG B 49 56.634 -4.412 -14.771 1.00 0.00 H new ATOM 0 HH21 ARG B 49 56.344 -7.490 -13.138 1.00 0.00 H new ATOM 0 HH22 ARG B 49 55.497 -6.218 -14.023 1.00 0.00 H new ATOM 2442 N THR B 50 63.228 -10.377 -11.540 1.00 0.00 N ATOM 2443 CA THR B 50 63.245 -11.867 -11.525 1.00 0.00 C ATOM 2444 C THR B 50 62.800 -12.349 -10.143 1.00 0.00 C ATOM 2445 O THR B 50 61.957 -13.214 -10.012 1.00 0.00 O ATOM 2446 CB THR B 50 64.662 -12.371 -11.817 1.00 0.00 C ATOM 2447 OG1 THR B 50 65.087 -11.877 -13.080 1.00 0.00 O ATOM 2448 CG2 THR B 50 64.663 -13.901 -11.844 1.00 0.00 C ATOM 0 H THR B 50 64.144 -9.928 -11.540 1.00 0.00 H new ATOM 0 HA THR B 50 62.569 -12.253 -12.288 1.00 0.00 H new ATOM 0 HB THR B 50 65.341 -12.020 -11.040 1.00 0.00 H new ATOM 0 HG1 THR B 50 65.921 -12.320 -13.341 1.00 0.00 H new ATOM 0 HG21 THR B 50 65.671 -14.261 -12.052 1.00 0.00 H new ATOM 0 HG22 THR B 50 64.334 -14.282 -10.877 1.00 0.00 H new ATOM 0 HG23 THR B 50 63.985 -14.252 -12.622 1.00 0.00 H new ATOM 2456 N ASP B 51 63.359 -11.780 -9.110 1.00 0.00 N ATOM 2457 CA ASP B 51 62.979 -12.174 -7.723 1.00 0.00 C ATOM 2458 C ASP B 51 63.536 -11.131 -6.751 1.00 0.00 C ATOM 2459 O ASP B 51 64.631 -11.267 -6.243 1.00 0.00 O ATOM 2460 CB ASP B 51 63.572 -13.549 -7.400 1.00 0.00 C ATOM 2461 CG ASP B 51 63.170 -13.959 -5.981 1.00 0.00 C ATOM 2462 OD1 ASP B 51 63.668 -13.353 -5.046 1.00 0.00 O ATOM 2463 OD2 ASP B 51 62.370 -14.871 -5.853 1.00 0.00 O ATOM 0 H ASP B 51 64.070 -11.051 -9.168 1.00 0.00 H new ATOM 0 HA ASP B 51 61.894 -12.226 -7.632 1.00 0.00 H new ATOM 0 HB2 ASP B 51 63.216 -14.288 -8.118 1.00 0.00 H new ATOM 0 HB3 ASP B 51 64.658 -13.518 -7.487 1.00 0.00 H new ATOM 2468 N GLU B 52 62.800 -10.084 -6.500 1.00 0.00 N ATOM 2469 CA GLU B 52 63.300 -9.027 -5.574 1.00 0.00 C ATOM 2470 C GLU B 52 63.095 -9.466 -4.119 1.00 0.00 C ATOM 2471 O GLU B 52 64.040 -9.768 -3.421 1.00 0.00 O ATOM 2472 CB GLU B 52 62.534 -7.730 -5.841 1.00 0.00 C ATOM 2473 CG GLU B 52 62.885 -7.209 -7.236 1.00 0.00 C ATOM 2474 CD GLU B 52 62.119 -5.911 -7.505 1.00 0.00 C ATOM 2475 OE1 GLU B 52 61.247 -5.587 -6.716 1.00 0.00 O ATOM 2476 OE2 GLU B 52 62.421 -5.263 -8.493 1.00 0.00 O ATOM 0 H GLU B 52 61.875 -9.914 -6.895 1.00 0.00 H new ATOM 0 HA GLU B 52 64.365 -8.865 -5.742 1.00 0.00 H new ATOM 0 HB2 GLU B 52 61.461 -7.907 -5.766 1.00 0.00 H new ATOM 0 HB3 GLU B 52 62.787 -6.984 -5.088 1.00 0.00 H new ATOM 0 HG2 GLU B 52 63.958 -7.032 -7.310 1.00 0.00 H new ATOM 0 HG3 GLU B 52 62.632 -7.956 -7.989 1.00 0.00 H new ATOM 2483 N ALA B 53 61.866 -9.514 -3.670 1.00 0.00 N ATOM 2484 CA ALA B 53 61.566 -9.943 -2.264 1.00 0.00 C ATOM 2485 C ALA B 53 62.600 -9.389 -1.275 1.00 0.00 C ATOM 2486 O ALA B 53 62.400 -8.358 -0.668 1.00 0.00 O ATOM 2487 CB ALA B 53 61.567 -11.470 -2.194 1.00 0.00 C ATOM 0 H ALA B 53 61.045 -9.271 -4.224 1.00 0.00 H new ATOM 0 HA ALA B 53 60.588 -9.549 -1.988 1.00 0.00 H new ATOM 0 HB1 ALA B 53 61.350 -11.788 -1.174 1.00 0.00 H new ATOM 0 HB2 ALA B 53 60.807 -11.866 -2.867 1.00 0.00 H new ATOM 0 HB3 ALA B 53 62.546 -11.847 -2.491 1.00 0.00 H new ATOM 2493 N ALA B 54 63.697 -10.068 -1.092 1.00 0.00 N ATOM 2494 CA ALA B 54 64.719 -9.571 -0.128 1.00 0.00 C ATOM 2495 C ALA B 54 65.040 -8.120 -0.445 1.00 0.00 C ATOM 2496 O ALA B 54 65.130 -7.284 0.430 1.00 0.00 O ATOM 2497 CB ALA B 54 65.986 -10.405 -0.265 1.00 0.00 C ATOM 0 H ALA B 54 63.930 -10.941 -1.565 1.00 0.00 H new ATOM 0 HA ALA B 54 64.335 -9.650 0.889 1.00 0.00 H new ATOM 0 HB1 ALA B 54 66.737 -10.045 0.439 1.00 0.00 H new ATOM 0 HB2 ALA B 54 65.759 -11.449 -0.050 1.00 0.00 H new ATOM 0 HB3 ALA B 54 66.370 -10.319 -1.281 1.00 0.00 H new ATOM 2503 N PHE B 55 65.196 -7.806 -1.688 1.00 0.00 N ATOM 2504 CA PHE B 55 65.483 -6.402 -2.050 1.00 0.00 C ATOM 2505 C PHE B 55 64.324 -5.537 -1.565 1.00 0.00 C ATOM 2506 O PHE B 55 64.515 -4.451 -1.057 1.00 0.00 O ATOM 2507 CB PHE B 55 65.612 -6.293 -3.559 1.00 0.00 C ATOM 2508 CG PHE B 55 66.943 -6.860 -3.988 1.00 0.00 C ATOM 2509 CD1 PHE B 55 68.069 -6.032 -4.050 1.00 0.00 C ATOM 2510 CD2 PHE B 55 67.053 -8.216 -4.318 1.00 0.00 C ATOM 2511 CE1 PHE B 55 69.304 -6.560 -4.440 1.00 0.00 C ATOM 2512 CE2 PHE B 55 68.288 -8.743 -4.710 1.00 0.00 C ATOM 2513 CZ PHE B 55 69.415 -7.916 -4.770 1.00 0.00 C ATOM 0 H PHE B 55 65.138 -8.458 -2.470 1.00 0.00 H new ATOM 0 HA PHE B 55 66.413 -6.069 -1.589 1.00 0.00 H new ATOM 0 HB2 PHE B 55 64.800 -6.834 -4.045 1.00 0.00 H new ATOM 0 HB3 PHE B 55 65.531 -5.251 -3.868 1.00 0.00 H new ATOM 0 HD1 PHE B 55 67.985 -4.985 -3.797 1.00 0.00 H new ATOM 0 HD2 PHE B 55 66.184 -8.855 -4.270 1.00 0.00 H new ATOM 0 HE1 PHE B 55 70.173 -5.921 -4.487 1.00 0.00 H new ATOM 0 HE2 PHE B 55 68.372 -9.789 -4.966 1.00 0.00 H new ATOM 0 HZ PHE B 55 70.369 -8.323 -5.070 1.00 0.00 H new ATOM 2523 N GLN B 56 63.116 -6.020 -1.707 1.00 0.00 N ATOM 2524 CA GLN B 56 61.947 -5.222 -1.236 1.00 0.00 C ATOM 2525 C GLN B 56 62.054 -5.059 0.267 1.00 0.00 C ATOM 2526 O GLN B 56 61.634 -4.068 0.828 1.00 0.00 O ATOM 2527 CB GLN B 56 60.626 -5.920 -1.581 1.00 0.00 C ATOM 2528 CG GLN B 56 60.393 -5.876 -3.091 1.00 0.00 C ATOM 2529 CD GLN B 56 59.073 -6.574 -3.424 1.00 0.00 C ATOM 2530 OE1 GLN B 56 58.060 -6.307 -2.809 1.00 0.00 O ATOM 2531 NE2 GLN B 56 59.046 -7.475 -4.368 1.00 0.00 N ATOM 0 H GLN B 56 62.891 -6.923 -2.124 1.00 0.00 H new ATOM 0 HA GLN B 56 61.955 -4.251 -1.732 1.00 0.00 H new ATOM 0 HB2 GLN B 56 60.651 -6.954 -1.238 1.00 0.00 H new ATOM 0 HB3 GLN B 56 59.801 -5.432 -1.063 1.00 0.00 H new ATOM 0 HG2 GLN B 56 60.367 -4.842 -3.436 1.00 0.00 H new ATOM 0 HG3 GLN B 56 61.217 -6.365 -3.611 1.00 0.00 H new ATOM 0 HE21 GLN B 56 59.897 -7.699 -4.884 1.00 0.00 H new ATOM 0 HE22 GLN B 56 58.174 -7.955 -4.590 1.00 0.00 H new ATOM 2540 N LYS B 57 62.634 -6.017 0.923 1.00 0.00 N ATOM 2541 CA LYS B 57 62.785 -5.904 2.397 1.00 0.00 C ATOM 2542 C LYS B 57 63.807 -4.818 2.662 1.00 0.00 C ATOM 2543 O LYS B 57 63.662 -4.005 3.554 1.00 0.00 O ATOM 2544 CB LYS B 57 63.257 -7.227 3.025 1.00 0.00 C ATOM 2545 CG LYS B 57 62.141 -8.281 2.930 1.00 0.00 C ATOM 2546 CD LYS B 57 62.395 -9.433 3.918 1.00 0.00 C ATOM 2547 CE LYS B 57 63.495 -10.358 3.389 1.00 0.00 C ATOM 2548 NZ LYS B 57 63.782 -11.416 4.398 1.00 0.00 N ATOM 0 H LYS B 57 63.009 -6.870 0.507 1.00 0.00 H new ATOM 0 HA LYS B 57 61.821 -5.664 2.845 1.00 0.00 H new ATOM 0 HB2 LYS B 57 64.150 -7.584 2.513 1.00 0.00 H new ATOM 0 HB3 LYS B 57 63.530 -7.067 4.068 1.00 0.00 H new ATOM 0 HG2 LYS B 57 61.178 -7.818 3.144 1.00 0.00 H new ATOM 0 HG3 LYS B 57 62.089 -8.672 1.914 1.00 0.00 H new ATOM 0 HD2 LYS B 57 62.685 -9.031 4.889 1.00 0.00 H new ATOM 0 HD3 LYS B 57 61.476 -10.000 4.070 1.00 0.00 H new ATOM 0 HE2 LYS B 57 63.182 -10.812 2.449 1.00 0.00 H new ATOM 0 HE3 LYS B 57 64.398 -9.785 3.181 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 64.529 -12.044 4.039 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 64.098 -10.974 5.285 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 62.920 -11.970 4.575 1.00 0.00 H new ATOM 2562 N LEU B 58 64.834 -4.789 1.866 1.00 0.00 N ATOM 2563 CA LEU B 58 65.865 -3.742 2.038 1.00 0.00 C ATOM 2564 C LEU B 58 65.185 -2.421 1.743 1.00 0.00 C ATOM 2565 O LEU B 58 65.378 -1.437 2.420 1.00 0.00 O ATOM 2566 CB LEU B 58 67.018 -3.982 1.056 1.00 0.00 C ATOM 2567 CG LEU B 58 68.105 -2.909 1.234 1.00 0.00 C ATOM 2568 CD1 LEU B 58 68.812 -3.091 2.590 1.00 0.00 C ATOM 2569 CD2 LEU B 58 69.128 -3.046 0.101 1.00 0.00 C ATOM 0 H LEU B 58 65.002 -5.446 1.104 1.00 0.00 H new ATOM 0 HA LEU B 58 66.282 -3.750 3.045 1.00 0.00 H new ATOM 0 HB2 LEU B 58 67.444 -4.972 1.221 1.00 0.00 H new ATOM 0 HB3 LEU B 58 66.643 -3.963 0.033 1.00 0.00 H new ATOM 0 HG LEU B 58 67.647 -1.920 1.206 1.00 0.00 H new ATOM 0 HD11 LEU B 58 69.580 -2.326 2.706 1.00 0.00 H new ATOM 0 HD12 LEU B 58 68.083 -2.999 3.395 1.00 0.00 H new ATOM 0 HD13 LEU B 58 69.274 -4.077 2.630 1.00 0.00 H new ATOM 0 HD21 LEU B 58 69.904 -2.289 0.218 1.00 0.00 H new ATOM 0 HD22 LEU B 58 69.580 -4.037 0.137 1.00 0.00 H new ATOM 0 HD23 LEU B 58 68.629 -2.909 -0.858 1.00 0.00 H new ATOM 2581 N MET B 59 64.354 -2.406 0.747 1.00 0.00 N ATOM 2582 CA MET B 59 63.622 -1.161 0.439 1.00 0.00 C ATOM 2583 C MET B 59 62.619 -0.935 1.554 1.00 0.00 C ATOM 2584 O MET B 59 62.383 0.179 1.980 1.00 0.00 O ATOM 2585 CB MET B 59 62.896 -1.286 -0.896 1.00 0.00 C ATOM 2586 CG MET B 59 63.922 -1.395 -2.023 1.00 0.00 C ATOM 2587 SD MET B 59 63.085 -1.836 -3.565 1.00 0.00 S ATOM 2588 CE MET B 59 64.566 -1.963 -4.598 1.00 0.00 C ATOM 0 H MET B 59 64.152 -3.198 0.137 1.00 0.00 H new ATOM 0 HA MET B 59 64.315 -0.323 0.365 1.00 0.00 H new ATOM 0 HB2 MET B 59 62.251 -2.164 -0.891 1.00 0.00 H new ATOM 0 HB3 MET B 59 62.254 -0.420 -1.056 1.00 0.00 H new ATOM 0 HG2 MET B 59 64.449 -0.448 -2.141 1.00 0.00 H new ATOM 0 HG3 MET B 59 64.670 -2.148 -1.776 1.00 0.00 H new ATOM 0 HE1 MET B 59 64.279 -2.232 -5.614 1.00 0.00 H new ATOM 0 HE2 MET B 59 65.085 -1.005 -4.609 1.00 0.00 H new ATOM 0 HE3 MET B 59 65.227 -2.729 -4.193 1.00 0.00 H new ATOM 2598 N SER B 60 62.035 -1.992 2.050 1.00 0.00 N ATOM 2599 CA SER B 60 61.058 -1.819 3.162 1.00 0.00 C ATOM 2600 C SER B 60 61.788 -1.198 4.345 1.00 0.00 C ATOM 2601 O SER B 60 61.191 -0.544 5.178 1.00 0.00 O ATOM 2602 CB SER B 60 60.467 -3.162 3.582 1.00 0.00 C ATOM 2603 OG SER B 60 59.959 -3.837 2.440 1.00 0.00 O ATOM 0 H SER B 60 62.188 -2.952 1.740 1.00 0.00 H new ATOM 0 HA SER B 60 60.242 -1.178 2.828 1.00 0.00 H new ATOM 0 HB2 SER B 60 61.230 -3.771 4.067 1.00 0.00 H new ATOM 0 HB3 SER B 60 59.671 -3.009 4.310 1.00 0.00 H new ATOM 0 HG SER B 60 60.705 -4.166 1.896 1.00 0.00 H new ATOM 2609 N ASN B 61 63.079 -1.380 4.425 1.00 0.00 N ATOM 2610 CA ASN B 61 63.819 -0.767 5.562 1.00 0.00 C ATOM 2611 C ASN B 61 63.680 0.736 5.412 1.00 0.00 C ATOM 2612 O ASN B 61 63.599 1.470 6.372 1.00 0.00 O ATOM 2613 CB ASN B 61 65.299 -1.158 5.545 1.00 0.00 C ATOM 2614 CG ASN B 61 65.436 -2.666 5.753 1.00 0.00 C ATOM 2615 OD1 ASN B 61 64.536 -3.307 6.257 1.00 0.00 O ATOM 2616 ND2 ASN B 61 66.536 -3.262 5.382 1.00 0.00 N ATOM 0 H ASN B 61 63.643 -1.916 3.766 1.00 0.00 H new ATOM 0 HA ASN B 61 63.409 -1.118 6.509 1.00 0.00 H new ATOM 0 HB2 ASN B 61 65.750 -0.870 4.596 1.00 0.00 H new ATOM 0 HB3 ASN B 61 65.835 -0.623 6.329 1.00 0.00 H new ATOM 0 HD21 ASN B 61 66.641 -4.268 5.515 1.00 0.00 H new ATOM 0 HD22 ASN B 61 67.291 -2.722 4.959 1.00 0.00 H new ATOM 2623 N LEU B 62 63.614 1.201 4.196 1.00 0.00 N ATOM 2624 CA LEU B 62 63.435 2.657 3.979 1.00 0.00 C ATOM 2625 C LEU B 62 62.125 3.010 4.668 1.00 0.00 C ATOM 2626 O LEU B 62 61.968 4.053 5.269 1.00 0.00 O ATOM 2627 CB LEU B 62 63.316 2.956 2.478 1.00 0.00 C ATOM 2628 CG LEU B 62 64.463 2.297 1.696 1.00 0.00 C ATOM 2629 CD1 LEU B 62 64.116 2.304 0.204 1.00 0.00 C ATOM 2630 CD2 LEU B 62 65.774 3.064 1.905 1.00 0.00 C ATOM 0 H LEU B 62 63.676 0.636 3.349 1.00 0.00 H new ATOM 0 HA LEU B 62 64.277 3.229 4.369 1.00 0.00 H new ATOM 0 HB2 LEU B 62 62.359 2.591 2.105 1.00 0.00 H new ATOM 0 HB3 LEU B 62 63.331 4.034 2.315 1.00 0.00 H new ATOM 0 HG LEU B 62 64.592 1.276 2.056 1.00 0.00 H new ATOM 0 HD11 LEU B 62 64.924 1.838 -0.360 1.00 0.00 H new ATOM 0 HD12 LEU B 62 63.193 1.747 0.042 1.00 0.00 H new ATOM 0 HD13 LEU B 62 63.983 3.332 -0.134 1.00 0.00 H new ATOM 0 HD21 LEU B 62 66.572 2.580 1.342 1.00 0.00 H new ATOM 0 HD22 LEU B 62 65.655 4.090 1.557 1.00 0.00 H new ATOM 0 HD23 LEU B 62 66.028 3.068 2.965 1.00 0.00 H new ATOM 2642 N ASP B 63 61.193 2.101 4.605 1.00 0.00 N ATOM 2643 CA ASP B 63 59.886 2.304 5.270 1.00 0.00 C ATOM 2644 C ASP B 63 60.022 1.851 6.725 1.00 0.00 C ATOM 2645 O ASP B 63 59.048 1.708 7.436 1.00 0.00 O ATOM 2646 CB ASP B 63 58.816 1.460 4.573 1.00 0.00 C ATOM 2647 CG ASP B 63 58.598 1.981 3.150 1.00 0.00 C ATOM 2648 OD1 ASP B 63 59.020 3.091 2.875 1.00 0.00 O ATOM 2649 OD2 ASP B 63 58.014 1.257 2.359 1.00 0.00 O ATOM 0 H ASP B 63 61.288 1.213 4.112 1.00 0.00 H new ATOM 0 HA ASP B 63 59.595 3.353 5.220 1.00 0.00 H new ATOM 0 HB2 ASP B 63 59.124 0.415 4.545 1.00 0.00 H new ATOM 0 HB3 ASP B 63 57.882 1.503 5.134 1.00 0.00 H new ATOM 2654 N SER B 64 61.232 1.601 7.168 1.00 0.00 N ATOM 2655 CA SER B 64 61.427 1.132 8.571 1.00 0.00 C ATOM 2656 C SER B 64 60.772 2.126 9.530 1.00 0.00 C ATOM 2657 O SER B 64 59.586 2.072 9.777 1.00 0.00 O ATOM 2658 CB SER B 64 62.922 1.064 8.899 1.00 0.00 C ATOM 2659 OG SER B 64 63.083 0.831 10.291 1.00 0.00 O ATOM 0 H SER B 64 62.086 1.702 6.620 1.00 0.00 H new ATOM 0 HA SER B 64 60.980 0.144 8.677 1.00 0.00 H new ATOM 0 HB2 SER B 64 63.396 0.267 8.327 1.00 0.00 H new ATOM 0 HB3 SER B 64 63.412 1.995 8.615 1.00 0.00 H new ATOM 0 HG SER B 64 64.038 0.785 10.507 1.00 0.00 H new ATOM 2665 N ASN B 65 61.548 3.040 10.054 1.00 0.00 N ATOM 2666 CA ASN B 65 61.011 4.064 10.996 1.00 0.00 C ATOM 2667 C ASN B 65 62.102 5.114 11.245 1.00 0.00 C ATOM 2668 O ASN B 65 61.979 6.262 10.867 1.00 0.00 O ATOM 2669 CB ASN B 65 60.633 3.401 12.333 1.00 0.00 C ATOM 2670 CG ASN B 65 59.260 2.733 12.223 1.00 0.00 C ATOM 2671 OD1 ASN B 65 58.307 3.346 11.785 1.00 0.00 O ATOM 2672 ND2 ASN B 65 59.120 1.491 12.602 1.00 0.00 N ATOM 0 H ASN B 65 62.547 3.120 9.865 1.00 0.00 H new ATOM 0 HA ASN B 65 60.124 4.529 10.567 1.00 0.00 H new ATOM 0 HB2 ASN B 65 61.385 2.660 12.605 1.00 0.00 H new ATOM 0 HB3 ASN B 65 60.619 4.148 13.127 1.00 0.00 H new ATOM 0 HD21 ASN B 65 58.210 1.035 12.530 1.00 0.00 H new ATOM 0 HD22 ASN B 65 59.920 0.977 12.970 1.00 0.00 H new ATOM 2679 N ARG B 66 63.169 4.713 11.884 1.00 0.00 N ATOM 2680 CA ARG B 66 64.289 5.655 12.178 1.00 0.00 C ATOM 2681 C ARG B 66 64.891 6.189 10.871 1.00 0.00 C ATOM 2682 O ARG B 66 65.252 7.345 10.774 1.00 0.00 O ATOM 2683 CB ARG B 66 65.368 4.922 12.984 1.00 0.00 C ATOM 2684 CG ARG B 66 66.478 5.901 13.380 1.00 0.00 C ATOM 2685 CD ARG B 66 67.549 5.161 14.184 1.00 0.00 C ATOM 2686 NE ARG B 66 68.277 4.217 13.290 1.00 0.00 N ATOM 2687 CZ ARG B 66 69.423 3.714 13.662 1.00 0.00 C ATOM 2688 NH1 ARG B 66 69.938 4.042 14.817 1.00 0.00 N ATOM 2689 NH2 ARG B 66 70.054 2.884 12.878 1.00 0.00 N ATOM 0 H ARG B 66 63.314 3.761 12.219 1.00 0.00 H new ATOM 0 HA ARG B 66 63.907 6.496 12.756 1.00 0.00 H new ATOM 0 HB2 ARG B 66 64.928 4.477 13.877 1.00 0.00 H new ATOM 0 HB3 ARG B 66 65.784 4.106 12.393 1.00 0.00 H new ATOM 0 HG2 ARG B 66 66.920 6.346 12.489 1.00 0.00 H new ATOM 0 HG3 ARG B 66 66.063 6.717 13.972 1.00 0.00 H new ATOM 0 HD2 ARG B 66 68.247 5.874 14.623 1.00 0.00 H new ATOM 0 HD3 ARG B 66 67.089 4.616 15.008 1.00 0.00 H new ATOM 0 HE ARG B 66 67.879 3.963 12.386 1.00 0.00 H new ATOM 0 HH11 ARG B 66 69.445 4.692 15.429 1.00 0.00 H new ATOM 0 HH12 ARG B 66 70.833 3.648 15.106 1.00 0.00 H new ATOM 0 HH21 ARG B 66 69.652 2.629 11.976 1.00 0.00 H new ATOM 0 HH22 ARG B 66 70.949 2.490 13.167 1.00 0.00 H new ATOM 2703 N ASP B 67 65.026 5.353 9.874 1.00 0.00 N ATOM 2704 CA ASP B 67 65.630 5.815 8.587 1.00 0.00 C ATOM 2705 C ASP B 67 64.871 7.034 8.058 1.00 0.00 C ATOM 2706 O ASP B 67 63.660 7.106 8.130 1.00 0.00 O ATOM 2707 CB ASP B 67 65.548 4.689 7.553 1.00 0.00 C ATOM 2708 CG ASP B 67 66.506 3.562 7.940 1.00 0.00 C ATOM 2709 OD1 ASP B 67 67.484 3.847 8.611 1.00 0.00 O ATOM 2710 OD2 ASP B 67 66.244 2.434 7.558 1.00 0.00 O ATOM 0 H ASP B 67 64.745 4.373 9.894 1.00 0.00 H new ATOM 0 HA ASP B 67 66.671 6.086 8.762 1.00 0.00 H new ATOM 0 HB2 ASP B 67 64.528 4.309 7.496 1.00 0.00 H new ATOM 0 HB3 ASP B 67 65.802 5.071 6.564 1.00 0.00 H new ATOM 2715 N ASN B 68 65.581 7.997 7.524 1.00 0.00 N ATOM 2716 CA ASN B 68 64.913 9.219 6.987 1.00 0.00 C ATOM 2717 C ASN B 68 65.745 9.803 5.837 1.00 0.00 C ATOM 2718 O ASN B 68 65.227 10.103 4.779 1.00 0.00 O ATOM 2719 CB ASN B 68 64.793 10.258 8.104 1.00 0.00 C ATOM 2720 CG ASN B 68 63.910 11.417 7.636 1.00 0.00 C ATOM 2721 OD1 ASN B 68 62.755 11.225 7.310 1.00 0.00 O ATOM 2722 ND2 ASN B 68 64.412 12.621 7.584 1.00 0.00 N ATOM 0 H ASN B 68 66.597 7.988 7.437 1.00 0.00 H new ATOM 0 HA ASN B 68 63.922 8.957 6.617 1.00 0.00 H new ATOM 0 HB2 ASN B 68 64.366 9.800 8.996 1.00 0.00 H new ATOM 0 HB3 ASN B 68 65.781 10.628 8.378 1.00 0.00 H new ATOM 0 HD21 ASN B 68 63.835 13.401 7.270 1.00 0.00 H new ATOM 0 HD22 ASN B 68 65.381 12.782 7.858 1.00 0.00 H new ATOM 2729 N GLU B 69 67.030 9.980 6.046 1.00 0.00 N ATOM 2730 CA GLU B 69 67.918 10.560 4.982 1.00 0.00 C ATOM 2731 C GLU B 69 69.086 9.605 4.699 1.00 0.00 C ATOM 2732 O GLU B 69 69.362 8.701 5.463 1.00 0.00 O ATOM 2733 CB GLU B 69 68.461 11.903 5.474 1.00 0.00 C ATOM 2734 CG GLU B 69 69.053 12.686 4.303 1.00 0.00 C ATOM 2735 CD GLU B 69 69.451 14.083 4.781 1.00 0.00 C ATOM 2736 OE1 GLU B 69 69.891 14.195 5.913 1.00 0.00 O ATOM 2737 OE2 GLU B 69 69.310 15.016 4.009 1.00 0.00 O ATOM 0 H GLU B 69 67.507 9.745 6.917 1.00 0.00 H new ATOM 0 HA GLU B 69 67.348 10.702 4.064 1.00 0.00 H new ATOM 0 HB2 GLU B 69 67.662 12.479 5.941 1.00 0.00 H new ATOM 0 HB3 GLU B 69 69.223 11.740 6.236 1.00 0.00 H new ATOM 0 HG2 GLU B 69 69.923 12.164 3.904 1.00 0.00 H new ATOM 0 HG3 GLU B 69 68.326 12.759 3.494 1.00 0.00 H new ATOM 2744 N VAL B 70 69.774 9.807 3.601 1.00 0.00 N ATOM 2745 CA VAL B 70 70.934 8.929 3.241 1.00 0.00 C ATOM 2746 C VAL B 70 72.212 9.748 3.262 1.00 0.00 C ATOM 2747 O VAL B 70 72.470 10.546 2.383 1.00 0.00 O ATOM 2748 CB VAL B 70 70.721 8.395 1.823 1.00 0.00 C ATOM 2749 CG1 VAL B 70 71.570 7.156 1.583 1.00 0.00 C ATOM 2750 CG2 VAL B 70 69.258 8.034 1.642 1.00 0.00 C ATOM 0 H VAL B 70 69.579 10.551 2.931 1.00 0.00 H new ATOM 0 HA VAL B 70 71.010 8.107 3.953 1.00 0.00 H new ATOM 0 HB VAL B 70 71.013 9.166 1.111 1.00 0.00 H new ATOM 0 HG11 VAL B 70 71.404 6.792 0.569 1.00 0.00 H new ATOM 0 HG12 VAL B 70 72.623 7.406 1.711 1.00 0.00 H new ATOM 0 HG13 VAL B 70 71.292 6.381 2.297 1.00 0.00 H new ATOM 0 HG21 VAL B 70 69.099 7.653 0.633 1.00 0.00 H new ATOM 0 HG22 VAL B 70 68.980 7.269 2.367 1.00 0.00 H new ATOM 0 HG23 VAL B 70 68.643 8.921 1.796 1.00 0.00 H new ATOM 2760 N ASP B 71 73.036 9.518 4.227 1.00 0.00 N ATOM 2761 CA ASP B 71 74.328 10.236 4.273 1.00 0.00 C ATOM 2762 C ASP B 71 75.239 9.495 3.307 1.00 0.00 C ATOM 2763 O ASP B 71 74.874 8.453 2.799 1.00 0.00 O ATOM 2764 CB ASP B 71 74.906 10.187 5.692 1.00 0.00 C ATOM 2765 CG ASP B 71 76.045 11.200 5.819 1.00 0.00 C ATOM 2766 OD1 ASP B 71 76.551 11.627 4.795 1.00 0.00 O ATOM 2767 OD2 ASP B 71 76.393 11.534 6.941 1.00 0.00 O ATOM 0 H ASP B 71 72.873 8.862 4.991 1.00 0.00 H new ATOM 0 HA ASP B 71 74.221 11.286 4.002 1.00 0.00 H new ATOM 0 HB2 ASP B 71 74.126 10.409 6.421 1.00 0.00 H new ATOM 0 HB3 ASP B 71 75.272 9.184 5.912 1.00 0.00 H new ATOM 2772 N PHE B 72 76.408 9.978 3.040 1.00 0.00 N ATOM 2773 CA PHE B 72 77.275 9.232 2.111 1.00 0.00 C ATOM 2774 C PHE B 72 77.497 7.841 2.698 1.00 0.00 C ATOM 2775 O PHE B 72 77.504 6.845 2.002 1.00 0.00 O ATOM 2776 CB PHE B 72 78.609 9.957 1.962 1.00 0.00 C ATOM 2777 CG PHE B 72 79.500 9.132 1.082 1.00 0.00 C ATOM 2778 CD1 PHE B 72 79.420 9.258 -0.306 1.00 0.00 C ATOM 2779 CD2 PHE B 72 80.395 8.227 1.656 1.00 0.00 C ATOM 2780 CE1 PHE B 72 80.238 8.477 -1.123 1.00 0.00 C ATOM 2781 CE2 PHE B 72 81.215 7.449 0.841 1.00 0.00 C ATOM 2782 CZ PHE B 72 81.139 7.570 -0.551 1.00 0.00 C ATOM 0 H PHE B 72 76.796 10.843 3.418 1.00 0.00 H new ATOM 0 HA PHE B 72 76.812 9.157 1.127 1.00 0.00 H new ATOM 0 HB2 PHE B 72 78.457 10.945 1.528 1.00 0.00 H new ATOM 0 HB3 PHE B 72 79.071 10.105 2.938 1.00 0.00 H new ATOM 0 HD1 PHE B 72 78.726 9.959 -0.747 1.00 0.00 H new ATOM 0 HD2 PHE B 72 80.452 8.130 2.730 1.00 0.00 H new ATOM 0 HE1 PHE B 72 80.176 8.572 -2.197 1.00 0.00 H new ATOM 0 HE2 PHE B 72 81.910 6.752 1.284 1.00 0.00 H new ATOM 0 HZ PHE B 72 81.773 6.966 -1.183 1.00 0.00 H new ATOM 2792 N GLN B 73 77.675 7.776 3.984 1.00 0.00 N ATOM 2793 CA GLN B 73 77.894 6.471 4.658 1.00 0.00 C ATOM 2794 C GLN B 73 76.630 5.594 4.585 1.00 0.00 C ATOM 2795 O GLN B 73 76.722 4.398 4.393 1.00 0.00 O ATOM 2796 CB GLN B 73 78.266 6.723 6.121 1.00 0.00 C ATOM 2797 CG GLN B 73 78.497 5.389 6.835 1.00 0.00 C ATOM 2798 CD GLN B 73 79.025 5.657 8.245 1.00 0.00 C ATOM 2799 OE1 GLN B 73 79.368 6.775 8.576 1.00 0.00 O ATOM 2800 NE2 GLN B 73 79.102 4.673 9.098 1.00 0.00 N ATOM 0 H GLN B 73 77.678 8.584 4.606 1.00 0.00 H new ATOM 0 HA GLN B 73 78.702 5.943 4.151 1.00 0.00 H new ATOM 0 HB2 GLN B 73 79.166 7.336 6.177 1.00 0.00 H new ATOM 0 HB3 GLN B 73 77.470 7.279 6.617 1.00 0.00 H new ATOM 0 HG2 GLN B 73 77.567 4.823 6.884 1.00 0.00 H new ATOM 0 HG3 GLN B 73 79.210 4.783 6.276 1.00 0.00 H new ATOM 0 HE21 GLN B 73 78.814 3.734 8.821 1.00 0.00 H new ATOM 0 HE22 GLN B 73 79.450 4.842 10.042 1.00 0.00 H new ATOM 2809 N GLU B 74 75.449 6.152 4.749 1.00 0.00 N ATOM 2810 CA GLU B 74 74.231 5.305 4.696 1.00 0.00 C ATOM 2811 C GLU B 74 74.069 4.718 3.303 1.00 0.00 C ATOM 2812 O GLU B 74 73.701 3.572 3.144 1.00 0.00 O ATOM 2813 CB GLU B 74 73.011 6.148 5.055 1.00 0.00 C ATOM 2814 CG GLU B 74 73.056 6.509 6.541 1.00 0.00 C ATOM 2815 CD GLU B 74 71.880 7.426 6.880 1.00 0.00 C ATOM 2816 OE1 GLU B 74 70.777 6.920 7.008 1.00 0.00 O ATOM 2817 OE2 GLU B 74 72.102 8.619 7.004 1.00 0.00 O ATOM 0 H GLU B 74 75.287 7.145 4.915 1.00 0.00 H new ATOM 0 HA GLU B 74 74.326 4.488 5.411 1.00 0.00 H new ATOM 0 HB2 GLU B 74 72.992 7.055 4.451 1.00 0.00 H new ATOM 0 HB3 GLU B 74 72.097 5.597 4.832 1.00 0.00 H new ATOM 0 HG2 GLU B 74 73.012 5.604 7.147 1.00 0.00 H new ATOM 0 HG3 GLU B 74 73.997 7.005 6.777 1.00 0.00 H new ATOM 2824 N TYR B 75 74.338 5.486 2.290 1.00 0.00 N ATOM 2825 CA TYR B 75 74.186 4.945 0.917 1.00 0.00 C ATOM 2826 C TYR B 75 75.103 3.725 0.780 1.00 0.00 C ATOM 2827 O TYR B 75 74.745 2.722 0.193 1.00 0.00 O ATOM 2828 CB TYR B 75 74.584 6.024 -0.100 1.00 0.00 C ATOM 2829 CG TYR B 75 74.857 5.397 -1.455 1.00 0.00 C ATOM 2830 CD1 TYR B 75 73.870 4.624 -2.079 1.00 0.00 C ATOM 2831 CD2 TYR B 75 76.101 5.577 -2.076 1.00 0.00 C ATOM 2832 CE1 TYR B 75 74.125 4.035 -3.324 1.00 0.00 C ATOM 2833 CE2 TYR B 75 76.355 4.987 -3.320 1.00 0.00 C ATOM 2834 CZ TYR B 75 75.368 4.217 -3.944 1.00 0.00 C ATOM 2835 OH TYR B 75 75.620 3.633 -5.168 1.00 0.00 O ATOM 0 H TYR B 75 74.653 6.454 2.351 1.00 0.00 H new ATOM 0 HA TYR B 75 73.153 4.653 0.730 1.00 0.00 H new ATOM 0 HB2 TYR B 75 73.787 6.762 -0.188 1.00 0.00 H new ATOM 0 HB3 TYR B 75 75.471 6.552 0.249 1.00 0.00 H new ATOM 0 HD1 TYR B 75 72.912 4.482 -1.600 1.00 0.00 H new ATOM 0 HD2 TYR B 75 76.864 6.171 -1.595 1.00 0.00 H new ATOM 0 HE1 TYR B 75 73.363 3.440 -3.806 1.00 0.00 H new ATOM 0 HE2 TYR B 75 77.313 5.126 -3.798 1.00 0.00 H new ATOM 0 HH TYR B 75 76.528 3.860 -5.458 1.00 0.00 H new ATOM 2845 N CYS B 76 76.277 3.808 1.332 1.00 0.00 N ATOM 2846 CA CYS B 76 77.228 2.670 1.263 1.00 0.00 C ATOM 2847 C CYS B 76 76.689 1.526 2.110 1.00 0.00 C ATOM 2848 O CYS B 76 76.769 0.376 1.731 1.00 0.00 O ATOM 2849 CB CYS B 76 78.593 3.106 1.800 1.00 0.00 C ATOM 2850 SG CYS B 76 79.044 4.705 1.080 1.00 0.00 S ATOM 0 H CYS B 76 76.622 4.626 1.834 1.00 0.00 H new ATOM 0 HA CYS B 76 77.339 2.345 0.229 1.00 0.00 H new ATOM 0 HB2 CYS B 76 78.561 3.181 2.887 1.00 0.00 H new ATOM 0 HB3 CYS B 76 79.348 2.359 1.554 1.00 0.00 H new ATOM 0 HG CYS B 76 78.274 5.633 1.567 1.00 0.00 H new ATOM 2856 N VAL B 77 76.127 1.821 3.254 1.00 0.00 N ATOM 2857 CA VAL B 77 75.587 0.719 4.084 1.00 0.00 C ATOM 2858 C VAL B 77 74.518 0.010 3.261 1.00 0.00 C ATOM 2859 O VAL B 77 74.447 -1.202 3.227 1.00 0.00 O ATOM 2860 CB VAL B 77 74.981 1.291 5.368 1.00 0.00 C ATOM 2861 CG1 VAL B 77 74.204 0.201 6.113 1.00 0.00 C ATOM 2862 CG2 VAL B 77 76.109 1.814 6.263 1.00 0.00 C ATOM 0 H VAL B 77 76.023 2.760 3.638 1.00 0.00 H new ATOM 0 HA VAL B 77 76.374 0.019 4.365 1.00 0.00 H new ATOM 0 HB VAL B 77 74.299 2.103 5.115 1.00 0.00 H new ATOM 0 HG11 VAL B 77 73.777 0.618 7.025 1.00 0.00 H new ATOM 0 HG12 VAL B 77 73.403 -0.175 5.476 1.00 0.00 H new ATOM 0 HG13 VAL B 77 74.878 -0.616 6.369 1.00 0.00 H new ATOM 0 HG21 VAL B 77 75.686 2.223 7.180 1.00 0.00 H new ATOM 0 HG22 VAL B 77 76.787 0.997 6.509 1.00 0.00 H new ATOM 0 HG23 VAL B 77 76.658 2.595 5.737 1.00 0.00 H new ATOM 2872 N PHE B 78 73.703 0.758 2.569 1.00 0.00 N ATOM 2873 CA PHE B 78 72.668 0.116 1.722 1.00 0.00 C ATOM 2874 C PHE B 78 73.356 -0.564 0.535 1.00 0.00 C ATOM 2875 O PHE B 78 72.987 -1.650 0.133 1.00 0.00 O ATOM 2876 CB PHE B 78 71.672 1.164 1.215 1.00 0.00 C ATOM 2877 CG PHE B 78 70.822 1.663 2.367 1.00 0.00 C ATOM 2878 CD1 PHE B 78 69.963 0.783 3.042 1.00 0.00 C ATOM 2879 CD2 PHE B 78 70.895 3.005 2.763 1.00 0.00 C ATOM 2880 CE1 PHE B 78 69.180 1.247 4.108 1.00 0.00 C ATOM 2881 CE2 PHE B 78 70.113 3.467 3.829 1.00 0.00 C ATOM 2882 CZ PHE B 78 69.257 2.588 4.501 1.00 0.00 C ATOM 0 H PHE B 78 73.711 1.778 2.555 1.00 0.00 H new ATOM 0 HA PHE B 78 72.123 -0.622 2.310 1.00 0.00 H new ATOM 0 HB2 PHE B 78 72.207 1.997 0.758 1.00 0.00 H new ATOM 0 HB3 PHE B 78 71.036 0.731 0.442 1.00 0.00 H new ATOM 0 HD1 PHE B 78 69.905 -0.252 2.740 1.00 0.00 H new ATOM 0 HD2 PHE B 78 71.556 3.685 2.245 1.00 0.00 H new ATOM 0 HE1 PHE B 78 68.517 0.570 4.626 1.00 0.00 H new ATOM 0 HE2 PHE B 78 70.171 4.502 4.132 1.00 0.00 H new ATOM 0 HZ PHE B 78 68.655 2.945 5.324 1.00 0.00 H new ATOM 2892 N LEU B 79 74.361 0.064 -0.035 1.00 0.00 N ATOM 2893 CA LEU B 79 75.063 -0.563 -1.196 1.00 0.00 C ATOM 2894 C LEU B 79 75.776 -1.833 -0.718 1.00 0.00 C ATOM 2895 O LEU B 79 75.799 -2.845 -1.387 1.00 0.00 O ATOM 2896 CB LEU B 79 76.085 0.439 -1.779 1.00 0.00 C ATOM 2897 CG LEU B 79 76.140 0.335 -3.312 1.00 0.00 C ATOM 2898 CD1 LEU B 79 77.287 1.209 -3.832 1.00 0.00 C ATOM 2899 CD2 LEU B 79 76.355 -1.130 -3.752 1.00 0.00 C ATOM 0 H LEU B 79 74.720 0.974 0.253 1.00 0.00 H new ATOM 0 HA LEU B 79 74.345 -0.825 -1.973 1.00 0.00 H new ATOM 0 HB2 LEU B 79 75.812 1.454 -1.489 1.00 0.00 H new ATOM 0 HB3 LEU B 79 77.072 0.242 -1.361 1.00 0.00 H new ATOM 0 HG LEU B 79 75.193 0.680 -3.727 1.00 0.00 H new ATOM 0 HD11 LEU B 79 77.333 1.141 -4.919 1.00 0.00 H new ATOM 0 HD12 LEU B 79 77.116 2.245 -3.540 1.00 0.00 H new ATOM 0 HD13 LEU B 79 78.229 0.863 -3.407 1.00 0.00 H new ATOM 0 HD21 LEU B 79 76.391 -1.182 -4.840 1.00 0.00 H new ATOM 0 HD22 LEU B 79 77.294 -1.500 -3.340 1.00 0.00 H new ATOM 0 HD23 LEU B 79 75.532 -1.744 -3.387 1.00 0.00 H new ATOM 2911 N SER B 80 76.356 -1.769 0.443 1.00 0.00 N ATOM 2912 CA SER B 80 77.078 -2.949 0.995 1.00 0.00 C ATOM 2913 C SER B 80 76.063 -4.048 1.254 1.00 0.00 C ATOM 2914 O SER B 80 76.295 -5.209 0.980 1.00 0.00 O ATOM 2915 CB SER B 80 77.765 -2.563 2.306 1.00 0.00 C ATOM 2916 OG SER B 80 76.776 -2.231 3.272 1.00 0.00 O ATOM 0 H SER B 80 76.362 -0.943 1.041 1.00 0.00 H new ATOM 0 HA SER B 80 77.834 -3.293 0.289 1.00 0.00 H new ATOM 0 HB2 SER B 80 78.379 -3.389 2.666 1.00 0.00 H new ATOM 0 HB3 SER B 80 78.432 -1.716 2.145 1.00 0.00 H new ATOM 0 HG SER B 80 76.018 -1.796 2.828 1.00 0.00 H new ATOM 2922 N CYS B 81 74.918 -3.682 1.751 1.00 0.00 N ATOM 2923 CA CYS B 81 73.868 -4.693 1.990 1.00 0.00 C ATOM 2924 C CYS B 81 73.543 -5.328 0.650 1.00 0.00 C ATOM 2925 O CYS B 81 73.297 -6.514 0.548 1.00 0.00 O ATOM 2926 CB CYS B 81 72.614 -4.025 2.554 1.00 0.00 C ATOM 2927 SG CYS B 81 71.356 -5.289 2.863 1.00 0.00 S ATOM 0 H CYS B 81 74.668 -2.725 2.001 1.00 0.00 H new ATOM 0 HA CYS B 81 74.211 -5.439 2.707 1.00 0.00 H new ATOM 0 HB2 CYS B 81 72.852 -3.498 3.478 1.00 0.00 H new ATOM 0 HB3 CYS B 81 72.236 -3.282 1.852 1.00 0.00 H new ATOM 0 HG CYS B 81 70.593 -4.911 3.845 1.00 0.00 H new ATOM 2933 N ILE B 82 73.555 -4.537 -0.390 1.00 0.00 N ATOM 2934 CA ILE B 82 73.260 -5.103 -1.737 1.00 0.00 C ATOM 2935 C ILE B 82 74.412 -6.013 -2.153 1.00 0.00 C ATOM 2936 O ILE B 82 74.212 -7.068 -2.721 1.00 0.00 O ATOM 2937 CB ILE B 82 73.075 -3.979 -2.764 1.00 0.00 C ATOM 2938 CG1 ILE B 82 71.763 -3.244 -2.465 1.00 0.00 C ATOM 2939 CG2 ILE B 82 73.029 -4.571 -4.179 1.00 0.00 C ATOM 2940 CD1 ILE B 82 71.658 -1.976 -3.319 1.00 0.00 C ATOM 0 H ILE B 82 73.754 -3.537 -0.366 1.00 0.00 H new ATOM 0 HA ILE B 82 72.334 -5.677 -1.694 1.00 0.00 H new ATOM 0 HB ILE B 82 73.910 -3.281 -2.701 1.00 0.00 H new ATOM 0 HG12 ILE B 82 70.916 -3.899 -2.669 1.00 0.00 H new ATOM 0 HG13 ILE B 82 71.717 -2.983 -1.408 1.00 0.00 H new ATOM 0 HG21 ILE B 82 72.897 -3.769 -4.905 1.00 0.00 H new ATOM 0 HG22 ILE B 82 73.962 -5.097 -4.384 1.00 0.00 H new ATOM 0 HG23 ILE B 82 72.195 -5.269 -4.254 1.00 0.00 H new ATOM 0 HD11 ILE B 82 70.722 -1.464 -3.097 1.00 0.00 H new ATOM 0 HD12 ILE B 82 72.495 -1.315 -3.094 1.00 0.00 H new ATOM 0 HD13 ILE B 82 71.682 -2.245 -4.375 1.00 0.00 H new ATOM 2952 N ALA B 83 75.619 -5.616 -1.870 1.00 0.00 N ATOM 2953 CA ALA B 83 76.777 -6.463 -2.248 1.00 0.00 C ATOM 2954 C ALA B 83 76.653 -7.821 -1.558 1.00 0.00 C ATOM 2955 O ALA B 83 76.799 -8.846 -2.177 1.00 0.00 O ATOM 2956 CB ALA B 83 78.070 -5.786 -1.809 1.00 0.00 C ATOM 0 H ALA B 83 75.852 -4.744 -1.395 1.00 0.00 H new ATOM 0 HA ALA B 83 76.791 -6.601 -3.329 1.00 0.00 H new ATOM 0 HB1 ALA B 83 78.920 -6.409 -2.087 1.00 0.00 H new ATOM 0 HB2 ALA B 83 78.157 -4.815 -2.297 1.00 0.00 H new ATOM 0 HB3 ALA B 83 78.060 -5.648 -0.728 1.00 0.00 H new ATOM 2962 N MET B 84 76.370 -7.842 -0.287 1.00 0.00 N ATOM 2963 CA MET B 84 76.227 -9.156 0.402 1.00 0.00 C ATOM 2964 C MET B 84 74.997 -9.856 -0.147 1.00 0.00 C ATOM 2965 O MET B 84 74.960 -11.064 -0.273 1.00 0.00 O ATOM 2966 CB MET B 84 76.093 -8.949 1.910 1.00 0.00 C ATOM 2967 CG MET B 84 77.431 -8.469 2.474 1.00 0.00 C ATOM 2968 SD MET B 84 77.281 -8.222 4.261 1.00 0.00 S ATOM 2969 CE MET B 84 76.205 -6.764 4.211 1.00 0.00 C ATOM 0 H MET B 84 76.233 -7.019 0.300 1.00 0.00 H new ATOM 0 HA MET B 84 77.111 -9.768 0.222 1.00 0.00 H new ATOM 0 HB2 MET B 84 75.313 -8.217 2.121 1.00 0.00 H new ATOM 0 HB3 MET B 84 75.795 -9.880 2.392 1.00 0.00 H new ATOM 0 HG2 MET B 84 78.210 -9.201 2.262 1.00 0.00 H new ATOM 0 HG3 MET B 84 77.728 -7.538 1.991 1.00 0.00 H new ATOM 0 HE1 MET B 84 76.570 -6.018 4.917 1.00 0.00 H new ATOM 0 HE2 MET B 84 76.208 -6.344 3.205 1.00 0.00 H new ATOM 0 HE3 MET B 84 75.189 -7.052 4.481 1.00 0.00 H new ATOM 2979 N MET B 85 73.998 -9.107 -0.510 1.00 0.00 N ATOM 2980 CA MET B 85 72.791 -9.737 -1.086 1.00 0.00 C ATOM 2981 C MET B 85 73.244 -10.485 -2.334 1.00 0.00 C ATOM 2982 O MET B 85 72.670 -11.482 -2.726 1.00 0.00 O ATOM 2983 CB MET B 85 71.769 -8.661 -1.461 1.00 0.00 C ATOM 2984 CG MET B 85 70.445 -9.326 -1.850 1.00 0.00 C ATOM 2985 SD MET B 85 69.673 -10.060 -0.382 1.00 0.00 S ATOM 2986 CE MET B 85 69.361 -8.528 0.530 1.00 0.00 C ATOM 0 H MET B 85 73.968 -8.090 -0.432 1.00 0.00 H new ATOM 0 HA MET B 85 72.319 -10.412 -0.372 1.00 0.00 H new ATOM 0 HB2 MET B 85 71.615 -7.983 -0.622 1.00 0.00 H new ATOM 0 HB3 MET B 85 72.144 -8.061 -2.290 1.00 0.00 H new ATOM 0 HG2 MET B 85 69.775 -8.591 -2.295 1.00 0.00 H new ATOM 0 HG3 MET B 85 70.621 -10.095 -2.603 1.00 0.00 H new ATOM 0 HE1 MET B 85 68.476 -8.650 1.155 1.00 0.00 H new ATOM 0 HE2 MET B 85 70.221 -8.298 1.159 1.00 0.00 H new ATOM 0 HE3 MET B 85 69.198 -7.712 -0.174 1.00 0.00 H new ATOM 2996 N CYS B 86 74.301 -10.012 -2.947 1.00 0.00 N ATOM 2997 CA CYS B 86 74.831 -10.694 -4.155 1.00 0.00 C ATOM 2998 C CYS B 86 76.275 -10.255 -4.375 1.00 0.00 C ATOM 2999 O CYS B 86 76.582 -9.507 -5.281 1.00 0.00 O ATOM 3000 CB CYS B 86 73.979 -10.335 -5.374 1.00 0.00 C ATOM 3001 SG CYS B 86 74.583 -11.238 -6.821 1.00 0.00 S ATOM 0 H CYS B 86 74.817 -9.181 -2.658 1.00 0.00 H new ATOM 0 HA CYS B 86 74.795 -11.774 -4.015 1.00 0.00 H new ATOM 0 HB2 CYS B 86 72.934 -10.584 -5.187 1.00 0.00 H new ATOM 0 HB3 CYS B 86 74.023 -9.262 -5.558 1.00 0.00 H new ATOM 0 HG CYS B 86 74.372 -12.510 -6.658 1.00 0.00 H new ATOM 3007 N ASN B 87 77.160 -10.704 -3.532 1.00 0.00 N ATOM 3008 CA ASN B 87 78.585 -10.303 -3.661 1.00 0.00 C ATOM 3009 C ASN B 87 79.178 -10.889 -4.941 1.00 0.00 C ATOM 3010 O ASN B 87 79.728 -10.178 -5.759 1.00 0.00 O ATOM 3011 CB ASN B 87 79.365 -10.825 -2.455 1.00 0.00 C ATOM 3012 CG ASN B 87 80.728 -10.136 -2.387 1.00 0.00 C ATOM 3013 OD1 ASN B 87 81.162 -9.525 -3.343 1.00 0.00 O ATOM 3014 ND2 ASN B 87 81.426 -10.207 -1.288 1.00 0.00 N ATOM 0 H ASN B 87 76.956 -11.334 -2.756 1.00 0.00 H new ATOM 0 HA ASN B 87 78.651 -9.216 -3.703 1.00 0.00 H new ATOM 0 HB2 ASN B 87 78.805 -10.637 -1.539 1.00 0.00 H new ATOM 0 HB3 ASN B 87 79.496 -11.904 -2.533 1.00 0.00 H new ATOM 0 HD21 ASN B 87 82.336 -9.750 -1.231 1.00 0.00 H new ATOM 0 HD22 ASN B 87 81.062 -10.720 -0.485 1.00 0.00 H new ATOM 3021 N GLU B 88 79.069 -12.179 -5.128 1.00 0.00 N ATOM 3022 CA GLU B 88 79.633 -12.795 -6.361 1.00 0.00 C ATOM 3023 C GLU B 88 79.225 -14.274 -6.436 1.00 0.00 C ATOM 3024 O GLU B 88 78.089 -14.632 -6.201 1.00 0.00 O ATOM 3025 CB GLU B 88 81.168 -12.685 -6.326 1.00 0.00 C ATOM 3026 CG GLU B 88 81.736 -12.771 -7.747 1.00 0.00 C ATOM 3027 CD GLU B 88 83.257 -12.914 -7.673 1.00 0.00 C ATOM 3028 OE1 GLU B 88 83.769 -13.016 -6.570 1.00 0.00 O ATOM 3029 OE2 GLU B 88 83.885 -12.913 -8.718 1.00 0.00 O ATOM 0 H GLU B 88 78.616 -12.827 -4.483 1.00 0.00 H new ATOM 0 HA GLU B 88 79.248 -12.273 -7.237 1.00 0.00 H new ATOM 0 HB2 GLU B 88 81.462 -11.742 -5.865 1.00 0.00 H new ATOM 0 HB3 GLU B 88 81.583 -13.483 -5.711 1.00 0.00 H new ATOM 0 HG2 GLU B 88 81.304 -13.622 -8.273 1.00 0.00 H new ATOM 0 HG3 GLU B 88 81.470 -11.878 -8.313 1.00 0.00 H new ATOM 3036 N PHE B 89 80.155 -15.127 -6.770 1.00 0.00 N ATOM 3037 CA PHE B 89 79.856 -16.586 -6.876 1.00 0.00 C ATOM 3038 C PHE B 89 79.465 -17.152 -5.510 1.00 0.00 C ATOM 3039 O PHE B 89 78.589 -17.987 -5.400 1.00 0.00 O ATOM 3040 CB PHE B 89 81.089 -17.325 -7.399 1.00 0.00 C ATOM 3041 CG PHE B 89 80.782 -18.800 -7.509 1.00 0.00 C ATOM 3042 CD1 PHE B 89 80.241 -19.308 -8.696 1.00 0.00 C ATOM 3043 CD2 PHE B 89 81.030 -19.657 -6.429 1.00 0.00 C ATOM 3044 CE1 PHE B 89 79.947 -20.672 -8.805 1.00 0.00 C ATOM 3045 CE2 PHE B 89 80.736 -21.022 -6.539 1.00 0.00 C ATOM 3046 CZ PHE B 89 80.195 -21.529 -7.728 1.00 0.00 C ATOM 0 H PHE B 89 81.121 -14.873 -6.977 1.00 0.00 H new ATOM 0 HA PHE B 89 79.024 -16.724 -7.566 1.00 0.00 H new ATOM 0 HB2 PHE B 89 81.378 -16.929 -8.373 1.00 0.00 H new ATOM 0 HB3 PHE B 89 81.933 -17.167 -6.727 1.00 0.00 H new ATOM 0 HD1 PHE B 89 80.050 -18.647 -9.528 1.00 0.00 H new ATOM 0 HD2 PHE B 89 81.447 -19.266 -5.513 1.00 0.00 H new ATOM 0 HE1 PHE B 89 79.529 -21.063 -9.721 1.00 0.00 H new ATOM 0 HE2 PHE B 89 80.926 -21.684 -5.707 1.00 0.00 H new ATOM 0 HZ PHE B 89 79.969 -22.582 -7.813 1.00 0.00 H new ATOM 3056 N PHE B 90 80.127 -16.724 -4.473 1.00 0.00 N ATOM 3057 CA PHE B 90 79.820 -17.253 -3.114 1.00 0.00 C ATOM 3058 C PHE B 90 78.592 -16.540 -2.552 1.00 0.00 C ATOM 3059 O PHE B 90 78.434 -16.391 -1.356 1.00 0.00 O ATOM 3060 CB PHE B 90 81.026 -17.030 -2.199 1.00 0.00 C ATOM 3061 CG PHE B 90 81.476 -15.591 -2.283 1.00 0.00 C ATOM 3062 CD1 PHE B 90 82.417 -15.207 -3.247 1.00 0.00 C ATOM 3063 CD2 PHE B 90 80.960 -14.644 -1.392 1.00 0.00 C ATOM 3064 CE1 PHE B 90 82.843 -13.875 -3.318 1.00 0.00 C ATOM 3065 CE2 PHE B 90 81.384 -13.312 -1.465 1.00 0.00 C ATOM 3066 CZ PHE B 90 82.325 -12.927 -2.427 1.00 0.00 C ATOM 0 H PHE B 90 80.871 -16.027 -4.507 1.00 0.00 H new ATOM 0 HA PHE B 90 79.610 -18.321 -3.174 1.00 0.00 H new ATOM 0 HB2 PHE B 90 80.764 -17.279 -1.171 1.00 0.00 H new ATOM 0 HB3 PHE B 90 81.841 -17.693 -2.489 1.00 0.00 H new ATOM 0 HD1 PHE B 90 82.814 -15.938 -3.935 1.00 0.00 H new ATOM 0 HD2 PHE B 90 80.235 -14.940 -0.648 1.00 0.00 H new ATOM 0 HE1 PHE B 90 83.570 -13.579 -4.059 1.00 0.00 H new ATOM 0 HE2 PHE B 90 80.985 -12.580 -0.778 1.00 0.00 H new ATOM 0 HZ PHE B 90 82.651 -11.899 -2.482 1.00 0.00 H new ATOM 3076 N GLU B 91 77.716 -16.115 -3.416 1.00 0.00 N ATOM 3077 CA GLU B 91 76.476 -15.426 -2.958 1.00 0.00 C ATOM 3078 C GLU B 91 75.783 -16.281 -1.895 1.00 0.00 C ATOM 3079 O GLU B 91 74.978 -15.798 -1.124 1.00 0.00 O ATOM 3080 CB GLU B 91 75.538 -15.221 -4.151 1.00 0.00 C ATOM 3081 CG GLU B 91 74.202 -14.651 -3.668 1.00 0.00 C ATOM 3082 CD GLU B 91 73.368 -14.217 -4.876 1.00 0.00 C ATOM 3083 OE1 GLU B 91 73.848 -14.372 -5.987 1.00 0.00 O ATOM 3084 OE2 GLU B 91 72.266 -13.737 -4.668 1.00 0.00 O ATOM 0 H GLU B 91 77.805 -16.215 -4.427 1.00 0.00 H new ATOM 0 HA GLU B 91 76.731 -14.457 -2.530 1.00 0.00 H new ATOM 0 HB2 GLU B 91 75.994 -14.542 -4.872 1.00 0.00 H new ATOM 0 HB3 GLU B 91 75.375 -16.169 -4.664 1.00 0.00 H new ATOM 0 HG2 GLU B 91 73.662 -15.401 -3.090 1.00 0.00 H new ATOM 0 HG3 GLU B 91 74.374 -13.802 -3.007 1.00 0.00 H new ATOM 3091 N GLY B 92 76.089 -17.550 -1.846 1.00 0.00 N ATOM 3092 CA GLY B 92 75.449 -18.433 -0.829 1.00 0.00 C ATOM 3093 C GLY B 92 75.894 -18.013 0.576 1.00 0.00 C ATOM 3094 O GLY B 92 75.677 -18.717 1.541 1.00 0.00 O ATOM 0 H GLY B 92 76.754 -18.013 -2.466 1.00 0.00 H new ATOM 0 HA2 GLY B 92 74.364 -18.370 -0.911 1.00 0.00 H new ATOM 0 HA3 GLY B 92 75.723 -19.472 -1.012 1.00 0.00 H new ATOM 3098 N PHE B 93 76.512 -16.869 0.697 1.00 0.00 N ATOM 3099 CA PHE B 93 76.968 -16.400 2.034 1.00 0.00 C ATOM 3100 C PHE B 93 75.723 -16.062 2.884 1.00 0.00 C ATOM 3101 O PHE B 93 74.786 -15.482 2.371 1.00 0.00 O ATOM 3102 CB PHE B 93 77.817 -15.138 1.841 1.00 0.00 C ATOM 3103 CG PHE B 93 78.572 -14.819 3.108 1.00 0.00 C ATOM 3104 CD1 PHE B 93 79.834 -15.384 3.330 1.00 0.00 C ATOM 3105 CD2 PHE B 93 78.013 -13.959 4.059 1.00 0.00 C ATOM 3106 CE1 PHE B 93 80.536 -15.088 4.504 1.00 0.00 C ATOM 3107 CE2 PHE B 93 78.714 -13.664 5.234 1.00 0.00 C ATOM 3108 CZ PHE B 93 79.977 -14.228 5.457 1.00 0.00 C ATOM 0 H PHE B 93 76.721 -16.238 -0.077 1.00 0.00 H new ATOM 0 HA PHE B 93 77.558 -17.168 2.535 1.00 0.00 H new ATOM 0 HB2 PHE B 93 78.517 -15.284 1.019 1.00 0.00 H new ATOM 0 HB3 PHE B 93 77.177 -14.298 1.569 1.00 0.00 H new ATOM 0 HD1 PHE B 93 80.265 -16.048 2.595 1.00 0.00 H new ATOM 0 HD2 PHE B 93 77.040 -13.523 3.887 1.00 0.00 H new ATOM 0 HE1 PHE B 93 81.510 -15.523 4.675 1.00 0.00 H new ATOM 0 HE2 PHE B 93 78.281 -13.001 5.969 1.00 0.00 H new ATOM 0 HZ PHE B 93 80.519 -14.000 6.363 1.00 0.00 H new ATOM 3118 N PRO B 94 75.680 -16.412 4.161 1.00 0.00 N ATOM 3119 CA PRO B 94 74.481 -16.098 4.992 1.00 0.00 C ATOM 3120 C PRO B 94 73.957 -14.670 4.759 1.00 0.00 C ATOM 3121 O PRO B 94 74.573 -13.879 4.076 1.00 0.00 O ATOM 3122 CB PRO B 94 75.022 -16.287 6.418 1.00 0.00 C ATOM 3123 CG PRO B 94 76.291 -17.154 6.327 1.00 0.00 C ATOM 3124 CD PRO B 94 76.786 -17.128 4.867 1.00 0.00 C ATOM 0 HA PRO B 94 73.621 -16.726 4.760 1.00 0.00 H new ATOM 0 HB2 PRO B 94 75.250 -15.322 6.871 1.00 0.00 H new ATOM 0 HB3 PRO B 94 74.275 -16.768 7.050 1.00 0.00 H new ATOM 0 HG2 PRO B 94 77.061 -16.772 6.997 1.00 0.00 H new ATOM 0 HG3 PRO B 94 76.076 -18.176 6.638 1.00 0.00 H new ATOM 0 HD2 PRO B 94 77.736 -16.602 4.770 1.00 0.00 H new ATOM 0 HD3 PRO B 94 76.936 -18.133 4.472 1.00 0.00 H new ATOM 3132 N ASP B 95 72.816 -14.350 5.316 1.00 0.00 N ATOM 3133 CA ASP B 95 72.235 -12.988 5.125 1.00 0.00 C ATOM 3134 C ASP B 95 73.214 -11.917 5.623 1.00 0.00 C ATOM 3135 O ASP B 95 74.361 -11.872 5.226 1.00 0.00 O ATOM 3136 CB ASP B 95 70.928 -12.883 5.916 1.00 0.00 C ATOM 3137 CG ASP B 95 70.219 -11.575 5.563 1.00 0.00 C ATOM 3138 OD1 ASP B 95 70.826 -10.757 4.892 1.00 0.00 O ATOM 3139 OD2 ASP B 95 69.082 -11.409 5.976 1.00 0.00 O ATOM 0 H ASP B 95 72.260 -14.977 5.897 1.00 0.00 H new ATOM 0 HA ASP B 95 72.045 -12.829 4.064 1.00 0.00 H new ATOM 0 HB2 ASP B 95 70.283 -13.731 5.687 1.00 0.00 H new ATOM 0 HB3 ASP B 95 71.134 -12.919 6.986 1.00 0.00 H new ATOM 3144 N LYS B 96 72.769 -11.046 6.490 1.00 0.00 N ATOM 3145 CA LYS B 96 73.672 -9.978 7.007 1.00 0.00 C ATOM 3146 C LYS B 96 74.387 -10.478 8.263 1.00 0.00 C ATOM 3147 O LYS B 96 75.531 -10.887 8.215 1.00 0.00 O ATOM 3148 CB LYS B 96 72.851 -8.734 7.350 1.00 0.00 C ATOM 3149 CG LYS B 96 73.799 -7.585 7.699 1.00 0.00 C ATOM 3150 CD LYS B 96 72.986 -6.337 8.044 1.00 0.00 C ATOM 3151 CE LYS B 96 73.940 -5.191 8.386 1.00 0.00 C ATOM 3152 NZ LYS B 96 73.156 -3.950 8.637 1.00 0.00 N ATOM 0 H LYS B 96 71.819 -11.029 6.862 1.00 0.00 H new ATOM 0 HA LYS B 96 74.409 -9.727 6.244 1.00 0.00 H new ATOM 0 HB2 LYS B 96 72.220 -8.456 6.506 1.00 0.00 H new ATOM 0 HB3 LYS B 96 72.188 -8.942 8.190 1.00 0.00 H new ATOM 0 HG2 LYS B 96 74.431 -7.865 8.542 1.00 0.00 H new ATOM 0 HG3 LYS B 96 74.462 -7.379 6.859 1.00 0.00 H new ATOM 0 HD2 LYS B 96 72.351 -6.058 7.203 1.00 0.00 H new ATOM 0 HD3 LYS B 96 72.326 -6.540 8.888 1.00 0.00 H new ATOM 0 HE2 LYS B 96 74.530 -5.445 9.266 1.00 0.00 H new ATOM 0 HE3 LYS B 96 74.642 -5.031 7.567 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 73.804 -3.171 8.870 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 72.612 -3.705 7.785 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 72.504 -4.106 9.432 1.00 0.00 H new ATOM 3166 N GLN B 97 73.728 -10.447 9.391 1.00 0.00 N ATOM 3167 CA GLN B 97 74.375 -10.920 10.648 1.00 0.00 C ATOM 3168 C GLN B 97 74.263 -12.458 10.728 1.00 0.00 C ATOM 3169 O GLN B 97 73.244 -13.009 10.358 1.00 0.00 O ATOM 3170 CB GLN B 97 73.655 -10.300 11.847 1.00 0.00 C ATOM 3171 CG GLN B 97 73.740 -8.774 11.767 1.00 0.00 C ATOM 3172 CD GLN B 97 75.187 -8.330 11.987 1.00 0.00 C ATOM 3173 OE1 GLN B 97 75.717 -8.460 13.073 1.00 0.00 O ATOM 3174 NE2 GLN B 97 75.854 -7.806 10.996 1.00 0.00 N ATOM 0 H GLN B 97 72.769 -10.114 9.495 1.00 0.00 H new ATOM 0 HA GLN B 97 75.425 -10.626 10.656 1.00 0.00 H new ATOM 0 HB2 GLN B 97 72.612 -10.616 11.860 1.00 0.00 H new ATOM 0 HB3 GLN B 97 74.106 -10.651 12.775 1.00 0.00 H new ATOM 0 HG2 GLN B 97 73.387 -8.430 10.795 1.00 0.00 H new ATOM 0 HG3 GLN B 97 73.092 -8.323 12.519 1.00 0.00 H new ATOM 0 HE21 GLN B 97 75.410 -7.696 10.084 1.00 0.00 H new ATOM 0 HE22 GLN B 97 76.819 -7.506 11.133 1.00 0.00 H new ATOM 3183 N PRO B 98 75.274 -13.163 11.208 1.00 0.00 N ATOM 3184 CA PRO B 98 75.186 -14.652 11.308 1.00 0.00 C ATOM 3185 C PRO B 98 74.224 -15.095 12.421 1.00 0.00 C ATOM 3186 O PRO B 98 74.588 -15.144 13.578 1.00 0.00 O ATOM 3187 CB PRO B 98 76.636 -15.031 11.654 1.00 0.00 C ATOM 3188 CG PRO B 98 77.311 -13.778 12.227 1.00 0.00 C ATOM 3189 CD PRO B 98 76.557 -12.557 11.679 1.00 0.00 C ATOM 0 HA PRO B 98 74.801 -15.124 10.404 1.00 0.00 H new ATOM 0 HB2 PRO B 98 76.658 -15.845 12.379 1.00 0.00 H new ATOM 0 HB3 PRO B 98 77.164 -15.380 10.767 1.00 0.00 H new ATOM 0 HG2 PRO B 98 77.281 -13.790 13.317 1.00 0.00 H new ATOM 0 HG3 PRO B 98 78.361 -13.742 11.938 1.00 0.00 H new ATOM 0 HD2 PRO B 98 76.392 -11.802 12.447 1.00 0.00 H new ATOM 0 HD3 PRO B 98 77.101 -12.073 10.868 1.00 0.00 H new ATOM 3197 N ARG B 99 73.006 -15.416 12.084 1.00 0.00 N ATOM 3198 CA ARG B 99 72.042 -15.847 13.136 1.00 0.00 C ATOM 3199 C ARG B 99 72.468 -17.205 13.696 1.00 0.00 C ATOM 3200 O ARG B 99 72.393 -17.447 14.885 1.00 0.00 O ATOM 3201 CB ARG B 99 70.636 -15.946 12.538 1.00 0.00 C ATOM 3202 CG ARG B 99 70.132 -14.537 12.201 1.00 0.00 C ATOM 3203 CD ARG B 99 68.654 -14.585 11.769 1.00 0.00 C ATOM 3204 NE ARG B 99 68.397 -13.536 10.730 1.00 0.00 N ATOM 3205 CZ ARG B 99 68.807 -12.302 10.886 1.00 0.00 C ATOM 3206 NH1 ARG B 99 69.305 -11.903 12.024 1.00 0.00 N ATOM 3207 NH2 ARG B 99 68.666 -11.447 9.910 1.00 0.00 N ATOM 0 H ARG B 99 72.638 -15.399 11.133 1.00 0.00 H new ATOM 0 HA ARG B 99 72.034 -15.114 13.943 1.00 0.00 H new ATOM 0 HB2 ARG B 99 70.652 -16.564 11.640 1.00 0.00 H new ATOM 0 HB3 ARG B 99 69.960 -16.428 13.245 1.00 0.00 H new ATOM 0 HG2 ARG B 99 70.243 -13.887 13.069 1.00 0.00 H new ATOM 0 HG3 ARG B 99 70.737 -14.109 11.402 1.00 0.00 H new ATOM 0 HD2 ARG B 99 68.413 -15.571 11.371 1.00 0.00 H new ATOM 0 HD3 ARG B 99 68.008 -14.422 12.631 1.00 0.00 H new ATOM 0 HE ARG B 99 67.891 -13.789 9.881 1.00 0.00 H new ATOM 0 HH11 ARG B 99 69.379 -12.555 12.805 1.00 0.00 H new ATOM 0 HH12 ARG B 99 69.621 -10.939 12.133 1.00 0.00 H new ATOM 0 HH21 ARG B 99 68.238 -11.741 9.032 1.00 0.00 H new ATOM 0 HH22 ARG B 99 68.983 -10.484 10.025 1.00 0.00 H new ATOM 3221 N LYS B 100 72.920 -18.091 12.854 1.00 0.00 N ATOM 3222 CA LYS B 100 73.358 -19.427 13.350 1.00 0.00 C ATOM 3223 C LYS B 100 74.641 -19.269 14.168 1.00 0.00 C ATOM 3224 O LYS B 100 75.486 -18.451 13.862 1.00 0.00 O ATOM 3225 CB LYS B 100 73.609 -20.362 12.164 1.00 0.00 C ATOM 3226 CG LYS B 100 72.310 -20.538 11.374 1.00 0.00 C ATOM 3227 CD LYS B 100 72.552 -21.471 10.185 1.00 0.00 C ATOM 3228 CE LYS B 100 71.249 -21.642 9.401 1.00 0.00 C ATOM 3229 NZ LYS B 100 70.781 -20.311 8.920 1.00 0.00 N ATOM 0 H LYS B 100 73.005 -17.950 11.847 1.00 0.00 H new ATOM 0 HA LYS B 100 72.578 -19.855 13.980 1.00 0.00 H new ATOM 0 HB2 LYS B 100 74.387 -19.951 11.520 1.00 0.00 H new ATOM 0 HB3 LYS B 100 73.967 -21.329 12.518 1.00 0.00 H new ATOM 0 HG2 LYS B 100 71.534 -20.949 12.019 1.00 0.00 H new ATOM 0 HG3 LYS B 100 71.953 -19.570 11.022 1.00 0.00 H new ATOM 0 HD2 LYS B 100 73.327 -21.061 9.538 1.00 0.00 H new ATOM 0 HD3 LYS B 100 72.909 -22.440 10.535 1.00 0.00 H new ATOM 0 HE2 LYS B 100 71.406 -22.312 8.555 1.00 0.00 H new ATOM 0 HE3 LYS B 100 70.489 -22.100 10.034 1.00 0.00 H new ATOM 0 HZ1 LYS B 100 70.131 -20.440 8.119 1.00 0.00 H new ATOM 0 HZ2 LYS B 100 70.287 -19.818 9.691 1.00 0.00 H new ATOM 0 HZ3 LYS B 100 71.598 -19.745 8.615 1.00 0.00 H new ATOM 3243 N LYS B 101 74.790 -20.039 15.212 1.00 0.00 N ATOM 3244 CA LYS B 101 76.016 -19.926 16.053 1.00 0.00 C ATOM 3245 C LYS B 101 77.151 -20.730 15.415 1.00 0.00 C ATOM 3246 O LYS B 101 77.338 -21.869 15.810 1.00 0.00 O ATOM 3247 CB LYS B 101 75.730 -20.475 17.452 1.00 0.00 C ATOM 3248 CG LYS B 101 74.689 -19.594 18.146 1.00 0.00 C ATOM 3249 CD LYS B 101 74.405 -20.146 19.546 1.00 0.00 C ATOM 3250 CE LYS B 101 73.364 -19.269 20.249 1.00 0.00 C ATOM 3251 NZ LYS B 101 72.004 -19.625 19.757 1.00 0.00 N ATOM 3252 OXT LYS B 101 77.813 -20.191 14.544 1.00 0.00 O ATOM 0 H LYS B 101 74.116 -20.741 15.519 1.00 0.00 H new ATOM 0 HA LYS B 101 76.308 -18.878 16.126 1.00 0.00 H new ATOM 0 HB2 LYS B 101 75.366 -21.500 17.384 1.00 0.00 H new ATOM 0 HB3 LYS B 101 76.648 -20.501 18.038 1.00 0.00 H new ATOM 0 HG2 LYS B 101 75.052 -18.569 18.215 1.00 0.00 H new ATOM 0 HG3 LYS B 101 73.770 -19.568 17.560 1.00 0.00 H new ATOM 0 HD2 LYS B 101 74.042 -21.171 19.476 1.00 0.00 H new ATOM 0 HD3 LYS B 101 75.325 -20.173 20.130 1.00 0.00 H new ATOM 0 HE2 LYS B 101 73.421 -19.412 21.328 1.00 0.00 H new ATOM 0 HE3 LYS B 101 73.569 -18.216 20.055 1.00 0.00 H new ATOM 0 HZ1 LYS B 101 71.296 -19.031 20.233 1.00 0.00 H new ATOM 0 HZ2 LYS B 101 71.954 -19.468 18.730 1.00 0.00 H new ATOM 0 HZ3 LYS B 101 71.811 -20.626 19.964 1.00 0.00 H new TER 3266 LYS B 101