USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 888 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 53 ASN : amide:sc= -0.841 X(o=0.3,f=-0.0019) USER MOD Set 1.2: A 58 THR OG1 : rot 76:sc= 1.15 USER MOD Set 2.1: A 34 SER OG : rot -66:sc= -0.0179 USER MOD Set 2.2: A 39 THR OG1 : rot 180:sc= 0.629 USER MOD Single : A 1 ALA N :NH3+ -129:sc= 0.087 (180deg=0) USER MOD Single : A 2 THR OG1 : rot -45:sc= 0.776 USER MOD Single : A 3 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0176) USER MOD Single : A 6 CYS SG : rot 180:sc= -0.0862 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=-0.068) USER MOD Single : A 19 ASN : amide:sc= -0.0744 X(o=-0.074,f=-0.35) USER MOD Single : A 22 GLN : amide:sc= -0.721 K(o=-0.72,f=-1.4) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 122:sc= 1.06 USER MOD Single : A 26 ASN : amide:sc= -0.118 X(o=-0.12,f=0) USER MOD Single : A 30 LYS NZ :NH3+ -173:sc= 0.352 (180deg=0.322) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -0.276 X(o=-0.28,f=-0.003) USER MOD Single : A 46 HIS : no HE2:sc= -0.471 X(o=-0.47,f=-0.87) USER MOD Single : A 48 HIS : no HD1:sc=-0.00255 K(o=-0.0026,f=-1.1) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 CYS SG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 140:sc= -0.837 USER MOD Single : A 63 HIS : no HD1:sc= -0.0742 X(o=-0.074,f=-0.031) USER MOD Single : A 65 ASN : amide:sc= -1.11 X(o=-1.1,f=-1.4) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : no HD1:sc= -0.744 X(o=-0.74,f=-0.79) USER MOD Single : A 86 ASN : amide:sc= -0.0053 X(o=-0.0053,f=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= -0.812 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= -0.018 USER MOD Single : A 102 SER OG : rot -130:sc= -2.11! USER MOD Single : A 105 SER OG : rot -25:sc= -0.622 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 111 CYS SG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 66:sc= 0.722 USER MOD Single : A 120 HIS : no HD1:sc= -0.975 X(o=-0.97,f=-1.4) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -14.864 5.587 4.732 1.00 0.00 N ATOM 2 CA ALA A 1 -14.590 4.794 3.537 1.00 0.00 C ATOM 3 C ALA A 1 -13.098 4.514 3.395 1.00 0.00 C ATOM 4 O ALA A 1 -12.329 4.681 4.343 1.00 0.00 O ATOM 5 CB ALA A 1 -15.115 5.507 2.299 1.00 0.00 C ATOM 0 H1 ALA A 1 -15.613 5.128 5.289 1.00 0.00 H new ATOM 0 H2 ALA A 1 -14.000 5.659 5.306 1.00 0.00 H new ATOM 0 H3 ALA A 1 -15.174 6.540 4.453 1.00 0.00 H new ATOM 0 HA ALA A 1 -15.105 3.839 3.639 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -14.904 4.905 1.415 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -16.191 5.651 2.391 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -14.626 6.476 2.203 1.00 0.00 H new ATOM 11 N THR A 2 -12.691 4.087 2.203 1.00 0.00 N ATOM 12 CA THR A 2 -11.291 3.782 1.938 1.00 0.00 C ATOM 13 C THR A 2 -11.007 3.766 0.439 1.00 0.00 C ATOM 14 O THR A 2 -10.068 3.114 -0.017 1.00 0.00 O ATOM 15 CB THR A 2 -10.889 2.423 2.539 1.00 0.00 C ATOM 16 OG1 THR A 2 -9.470 2.245 2.441 1.00 0.00 O ATOM 17 CG2 THR A 2 -11.598 1.283 1.827 1.00 0.00 C ATOM 0 H THR A 2 -13.312 3.945 1.406 1.00 0.00 H new ATOM 0 HA THR A 2 -10.701 4.568 2.409 1.00 0.00 H new ATOM 0 HB THR A 2 -11.186 2.413 3.588 1.00 0.00 H new ATOM 0 HG1 THR A 2 -9.169 2.501 1.544 1.00 0.00 H new ATOM 0 HG21 THR A 2 -11.297 0.334 2.270 1.00 0.00 H new ATOM 0 HG22 THR A 2 -12.676 1.405 1.929 1.00 0.00 H new ATOM 0 HG23 THR A 2 -11.330 1.291 0.770 1.00 0.00 H new ATOM 25 N LYS A 3 -11.825 4.485 -0.320 1.00 0.00 N ATOM 26 CA LYS A 3 -11.661 4.555 -1.769 1.00 0.00 C ATOM 27 C LYS A 3 -10.754 5.718 -2.158 1.00 0.00 C ATOM 28 O LYS A 3 -9.864 5.571 -2.993 1.00 0.00 O ATOM 29 CB LYS A 3 -13.023 4.706 -2.450 1.00 0.00 C ATOM 30 CG LYS A 3 -14.080 3.757 -1.913 1.00 0.00 C ATOM 31 CD LYS A 3 -15.193 4.507 -1.199 1.00 0.00 C ATOM 32 CE LYS A 3 -16.335 3.579 -0.814 1.00 0.00 C ATOM 33 NZ LYS A 3 -17.163 3.201 -1.994 1.00 0.00 N1+ ATOM 0 H LYS A 3 -12.609 5.028 0.042 1.00 0.00 H new ATOM 0 HA LYS A 3 -11.196 3.627 -2.103 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -13.370 5.732 -2.325 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -12.905 4.537 -3.520 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -14.500 3.177 -2.734 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -13.618 3.048 -1.225 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -14.795 4.985 -0.304 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -15.570 5.301 -1.844 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -15.931 2.679 -0.350 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -16.964 4.067 -0.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -17.997 2.667 -1.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -17.471 4.061 -2.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -16.599 2.611 -2.639 1.00 0.00 H new ATOM 47 N ALA A 4 -10.988 6.874 -1.547 1.00 0.00 N ATOM 48 CA ALA A 4 -10.191 8.062 -1.827 1.00 0.00 C ATOM 49 C ALA A 4 -8.733 7.850 -1.430 1.00 0.00 C ATOM 50 O ALA A 4 -7.856 8.620 -1.821 1.00 0.00 O ATOM 51 CB ALA A 4 -10.768 9.269 -1.100 1.00 0.00 C ATOM 0 H ALA A 4 -11.724 7.013 -0.854 1.00 0.00 H new ATOM 0 HA ALA A 4 -10.225 8.248 -2.900 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -10.163 10.149 -1.318 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -11.791 9.440 -1.434 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -10.764 9.083 -0.026 1.00 0.00 H new ATOM 57 N VAL A 5 -8.482 6.803 -0.654 1.00 0.00 N ATOM 58 CA VAL A 5 -7.132 6.489 -0.205 1.00 0.00 C ATOM 59 C VAL A 5 -6.395 5.637 -1.234 1.00 0.00 C ATOM 60 O VAL A 5 -5.253 5.924 -1.589 1.00 0.00 O ATOM 61 CB VAL A 5 -7.145 5.747 1.146 1.00 0.00 C ATOM 62 CG1 VAL A 5 -5.789 5.847 1.824 1.00 0.00 C ATOM 63 CG2 VAL A 5 -8.240 6.301 2.044 1.00 0.00 C ATOM 0 H VAL A 5 -9.197 6.156 -0.322 1.00 0.00 H new ATOM 0 HA VAL A 5 -6.611 7.439 -0.083 1.00 0.00 H new ATOM 0 HB VAL A 5 -7.354 4.693 0.961 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -5.818 5.317 2.776 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -5.028 5.401 1.184 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -5.546 6.895 1.999 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -8.236 5.767 2.994 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -8.062 7.361 2.223 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -9.208 6.173 1.559 1.00 0.00 H new ATOM 73 N CYS A 6 -7.057 4.585 -1.704 1.00 0.00 N ATOM 74 CA CYS A 6 -6.464 3.689 -2.691 1.00 0.00 C ATOM 75 C CYS A 6 -7.458 2.611 -3.113 1.00 0.00 C ATOM 76 O CYS A 6 -7.346 1.456 -2.707 1.00 0.00 O ATOM 77 CB CYS A 6 -5.199 3.041 -2.126 1.00 0.00 C ATOM 78 SG CYS A 6 -5.400 2.349 -0.469 1.00 0.00 S ATOM 0 H CYS A 6 -8.003 4.332 -1.418 1.00 0.00 H new ATOM 0 HA CYS A 6 -6.200 4.278 -3.569 1.00 0.00 H new ATOM 0 HB2 CYS A 6 -4.877 2.249 -2.802 1.00 0.00 H new ATOM 0 HB3 CYS A 6 -4.402 3.784 -2.103 1.00 0.00 H new ATOM 0 HG CYS A 6 -4.277 1.822 -0.080 1.00 0.00 H new ATOM 84 N VAL A 7 -8.432 3.000 -3.931 1.00 0.00 N ATOM 85 CA VAL A 7 -9.448 2.069 -4.408 1.00 0.00 C ATOM 86 C VAL A 7 -10.414 2.754 -5.368 1.00 0.00 C ATOM 87 O VAL A 7 -10.894 2.142 -6.322 1.00 0.00 O ATOM 88 CB VAL A 7 -10.247 1.462 -3.238 1.00 0.00 C ATOM 89 CG1 VAL A 7 -11.740 1.528 -3.522 1.00 0.00 C ATOM 90 CG2 VAL A 7 -9.806 0.029 -2.981 1.00 0.00 C ATOM 0 H VAL A 7 -8.538 3.954 -4.277 1.00 0.00 H new ATOM 0 HA VAL A 7 -8.924 1.270 -4.933 1.00 0.00 H new ATOM 0 HB VAL A 7 -10.047 2.046 -2.340 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -12.289 1.095 -2.686 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -12.040 2.568 -3.654 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -11.963 0.968 -4.431 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -10.380 -0.385 -2.152 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -9.977 -0.570 -3.875 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -8.745 0.014 -2.731 1.00 0.00 H new ATOM 100 N LEU A 8 -10.694 4.026 -5.109 1.00 0.00 N ATOM 101 CA LEU A 8 -11.603 4.796 -5.952 1.00 0.00 C ATOM 102 C LEU A 8 -11.088 4.865 -7.386 1.00 0.00 C ATOM 103 O LEU A 8 -11.850 5.118 -8.320 1.00 0.00 O ATOM 104 CB LEU A 8 -11.778 6.207 -5.391 1.00 0.00 C ATOM 105 CG LEU A 8 -12.940 7.020 -5.965 1.00 0.00 C ATOM 106 CD1 LEU A 8 -14.268 6.472 -5.471 1.00 0.00 C ATOM 107 CD2 LEU A 8 -12.796 8.488 -5.598 1.00 0.00 C ATOM 0 H LEU A 8 -10.305 4.546 -4.323 1.00 0.00 H new ATOM 0 HA LEU A 8 -12.570 4.292 -5.957 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -11.911 6.133 -4.312 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -10.855 6.761 -5.561 1.00 0.00 H new ATOM 0 HG LEU A 8 -12.917 6.935 -7.051 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -15.083 7.062 -5.889 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -14.373 5.434 -5.786 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -14.302 6.526 -4.383 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -13.631 9.051 -6.015 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -12.793 8.593 -4.513 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -11.860 8.874 -6.003 1.00 0.00 H new ATOM 119 N LYS A 9 -9.790 4.639 -7.555 1.00 0.00 N ATOM 120 CA LYS A 9 -9.173 4.673 -8.876 1.00 0.00 C ATOM 121 C LYS A 9 -9.118 3.275 -9.486 1.00 0.00 C ATOM 122 O LYS A 9 -8.661 3.099 -10.616 1.00 0.00 O ATOM 123 CB LYS A 9 -7.762 5.257 -8.787 1.00 0.00 C ATOM 124 CG LYS A 9 -7.676 6.514 -7.936 1.00 0.00 C ATOM 125 CD LYS A 9 -6.600 7.457 -8.441 1.00 0.00 C ATOM 126 CE LYS A 9 -6.659 8.802 -7.734 1.00 0.00 C ATOM 127 NZ LYS A 9 -5.571 8.946 -6.724 1.00 0.00 N1+ ATOM 0 H LYS A 9 -9.144 4.430 -6.793 1.00 0.00 H new ATOM 0 HA LYS A 9 -9.783 5.308 -9.519 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -7.091 4.503 -8.375 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -7.408 5.484 -9.792 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.639 7.024 -7.941 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -7.465 6.241 -6.902 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -5.619 7.007 -8.287 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -6.718 7.604 -9.515 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -6.580 9.603 -8.469 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.626 8.913 -7.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -5.645 9.876 -6.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -5.661 8.197 -6.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -4.647 8.866 -7.195 1.00 0.00 H new ATOM 141 N GLY A 10 -9.591 2.286 -8.733 1.00 0.00 N ATOM 142 CA GLY A 10 -9.586 0.919 -9.219 1.00 0.00 C ATOM 143 C GLY A 10 -10.853 0.171 -8.854 1.00 0.00 C ATOM 144 O GLY A 10 -10.797 -0.961 -8.372 1.00 0.00 O ATOM 0 H GLY A 10 -9.977 2.407 -7.797 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -9.469 0.922 -10.303 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -8.725 0.393 -8.807 1.00 0.00 H new ATOM 148 N ASP A 11 -11.999 0.804 -9.083 1.00 0.00 N ATOM 149 CA ASP A 11 -13.285 0.192 -8.774 1.00 0.00 C ATOM 150 C ASP A 11 -14.049 -0.142 -10.051 1.00 0.00 C ATOM 151 O ASP A 11 -14.976 -0.952 -10.040 1.00 0.00 O ATOM 152 CB ASP A 11 -14.121 1.125 -7.897 1.00 0.00 C ATOM 153 CG ASP A 11 -14.331 0.571 -6.500 1.00 0.00 C ATOM 154 OD1 ASP A 11 -13.428 -0.130 -5.997 1.00 0.00 O ATOM 155 OD2 ASP A 11 -15.398 0.841 -5.909 1.00 0.00 O1- ATOM 0 H ASP A 11 -12.063 1.741 -9.482 1.00 0.00 H new ATOM 0 HA ASP A 11 -13.096 -0.734 -8.231 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -13.628 2.095 -7.830 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -15.090 1.291 -8.368 1.00 0.00 H new ATOM 160 N GLY A 12 -13.652 0.488 -11.154 1.00 0.00 N ATOM 161 CA GLY A 12 -14.311 0.245 -12.424 1.00 0.00 C ATOM 162 C GLY A 12 -14.797 1.521 -13.080 1.00 0.00 C ATOM 163 O GLY A 12 -14.587 1.753 -14.271 1.00 0.00 O ATOM 0 H GLY A 12 -12.887 1.161 -11.190 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -13.621 -0.265 -13.096 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -15.157 -0.424 -12.268 1.00 0.00 H new ATOM 167 N PRO A 13 -15.465 2.378 -12.290 1.00 0.00 N ATOM 168 CA PRO A 13 -15.998 3.652 -12.780 1.00 0.00 C ATOM 169 C PRO A 13 -14.896 4.656 -13.102 1.00 0.00 C ATOM 170 O PRO A 13 -15.157 5.723 -13.660 1.00 0.00 O ATOM 171 CB PRO A 13 -16.852 4.152 -11.612 1.00 0.00 C ATOM 172 CG PRO A 13 -16.260 3.507 -10.407 1.00 0.00 C ATOM 173 CD PRO A 13 -15.752 2.165 -10.863 1.00 0.00 C ATOM 0 HA PRO A 13 -16.553 3.531 -13.710 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -16.820 5.239 -11.535 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -17.898 3.872 -11.738 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -15.451 4.112 -9.998 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -17.004 3.395 -9.619 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -14.860 1.865 -10.314 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -16.496 1.382 -10.715 1.00 0.00 H new ATOM 181 N VAL A 14 -13.662 4.308 -12.747 1.00 0.00 N ATOM 182 CA VAL A 14 -12.520 5.178 -13.000 1.00 0.00 C ATOM 183 C VAL A 14 -12.117 5.143 -14.469 1.00 0.00 C ATOM 184 O VAL A 14 -11.366 5.998 -14.937 1.00 0.00 O ATOM 185 CB VAL A 14 -11.309 4.778 -12.136 1.00 0.00 C ATOM 186 CG1 VAL A 14 -10.852 3.368 -12.477 1.00 0.00 C ATOM 187 CG2 VAL A 14 -10.174 5.775 -12.316 1.00 0.00 C ATOM 0 H VAL A 14 -13.429 3.430 -12.284 1.00 0.00 H new ATOM 0 HA VAL A 14 -12.827 6.190 -12.736 1.00 0.00 H new ATOM 0 HB VAL A 14 -11.611 4.792 -11.089 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -9.996 3.103 -11.857 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -11.666 2.667 -12.291 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -10.567 3.322 -13.528 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.327 5.477 -11.698 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -9.871 5.796 -13.363 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -10.510 6.767 -12.016 1.00 0.00 H new ATOM 197 N GLN A 15 -12.622 4.148 -15.192 1.00 0.00 N ATOM 198 CA GLN A 15 -12.313 4.001 -16.609 1.00 0.00 C ATOM 199 C GLN A 15 -13.415 4.604 -17.472 1.00 0.00 C ATOM 200 O GLN A 15 -13.149 5.195 -18.519 1.00 0.00 O ATOM 201 CB GLN A 15 -12.122 2.526 -16.963 1.00 0.00 C ATOM 202 CG GLN A 15 -11.549 2.300 -18.351 1.00 0.00 C ATOM 203 CD GLN A 15 -10.164 1.687 -18.319 1.00 0.00 C ATOM 204 OE1 GLN A 15 -9.955 0.630 -17.721 1.00 0.00 O ATOM 205 NE2 GLN A 15 -9.208 2.348 -18.961 1.00 0.00 N ATOM 0 H GLN A 15 -13.246 3.432 -14.820 1.00 0.00 H new ATOM 0 HA GLN A 15 -11.385 4.537 -16.809 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -11.461 2.068 -16.228 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -13.083 2.016 -16.889 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -12.217 1.648 -18.914 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -11.509 3.251 -18.882 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -9.426 3.220 -19.443 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -8.255 1.984 -18.972 1.00 0.00 H new ATOM 214 N GLY A 16 -14.661 4.453 -17.024 1.00 0.00 N ATOM 215 CA GLY A 16 -15.785 4.988 -17.769 1.00 0.00 C ATOM 216 C GLY A 16 -16.031 6.454 -17.473 1.00 0.00 C ATOM 217 O GLY A 16 -16.537 7.188 -18.322 1.00 0.00 O ATOM 0 H GLY A 16 -14.909 3.971 -16.160 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -15.603 4.861 -18.836 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -16.681 4.416 -17.529 1.00 0.00 H new ATOM 221 N ILE A 17 -15.675 6.881 -16.267 1.00 0.00 N ATOM 222 CA ILE A 17 -15.861 8.269 -15.862 1.00 0.00 C ATOM 223 C ILE A 17 -14.692 9.136 -16.320 1.00 0.00 C ATOM 224 O ILE A 17 -14.858 10.325 -16.593 1.00 0.00 O ATOM 225 CB ILE A 17 -16.013 8.396 -14.335 1.00 0.00 C ATOM 226 CG1 ILE A 17 -17.256 7.640 -13.860 1.00 0.00 C ATOM 227 CG2 ILE A 17 -16.089 9.859 -13.928 1.00 0.00 C ATOM 228 CD1 ILE A 17 -17.412 7.620 -12.355 1.00 0.00 C ATOM 0 H ILE A 17 -15.256 6.286 -15.553 1.00 0.00 H new ATOM 0 HA ILE A 17 -16.777 8.616 -16.339 1.00 0.00 H new ATOM 0 HB ILE A 17 -15.137 7.953 -13.860 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -18.141 8.097 -14.303 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -17.210 6.614 -14.226 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -16.196 9.930 -12.846 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -15.177 10.370 -14.237 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -16.948 10.326 -14.409 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -18.314 7.068 -12.090 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -16.545 7.136 -11.906 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -17.490 8.642 -11.984 1.00 0.00 H new ATOM 240 N ILE A 18 -13.511 8.533 -16.399 1.00 0.00 N ATOM 241 CA ILE A 18 -12.315 9.249 -16.825 1.00 0.00 C ATOM 242 C ILE A 18 -12.442 9.722 -18.269 1.00 0.00 C ATOM 243 O ILE A 18 -11.935 10.779 -18.634 1.00 0.00 O ATOM 244 CB ILE A 18 -11.056 8.371 -16.694 1.00 0.00 C ATOM 245 CG1 ILE A 18 -10.381 8.611 -15.341 1.00 0.00 C ATOM 246 CG2 ILE A 18 -10.089 8.657 -17.833 1.00 0.00 C ATOM 247 CD1 ILE A 18 -9.813 10.003 -15.188 1.00 0.00 C ATOM 0 H ILE A 18 -13.357 7.550 -16.174 1.00 0.00 H new ATOM 0 HA ILE A 18 -12.215 10.114 -16.169 1.00 0.00 H new ATOM 0 HB ILE A 18 -11.353 7.324 -16.751 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -11.105 8.434 -14.546 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -9.580 7.884 -15.210 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -9.205 8.029 -17.726 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -10.574 8.442 -18.785 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -9.794 9.706 -17.805 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -9.350 10.101 -14.206 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -9.064 10.177 -15.961 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -10.614 10.736 -15.287 1.00 0.00 H new ATOM 259 N ASN A 19 -13.127 8.928 -19.088 1.00 0.00 N ATOM 260 CA ASN A 19 -13.323 9.264 -20.494 1.00 0.00 C ATOM 261 C ASN A 19 -14.641 10.007 -20.696 1.00 0.00 C ATOM 262 O ASN A 19 -14.811 10.736 -21.673 1.00 0.00 O ATOM 263 CB ASN A 19 -13.301 7.997 -21.351 1.00 0.00 C ATOM 264 CG ASN A 19 -12.018 7.862 -22.146 1.00 0.00 C ATOM 265 OD1 ASN A 19 -11.546 8.824 -22.754 1.00 0.00 O ATOM 266 ND2 ASN A 19 -11.447 6.663 -22.147 1.00 0.00 N ATOM 0 H ASN A 19 -13.555 8.048 -18.801 1.00 0.00 H new ATOM 0 HA ASN A 19 -12.507 9.917 -20.804 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -13.421 7.125 -20.709 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -14.150 8.009 -22.035 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -10.582 6.510 -22.666 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -11.873 5.895 -21.629 1.00 0.00 H new ATOM 273 N PHE A 20 -15.572 9.816 -19.765 1.00 0.00 N ATOM 274 CA PHE A 20 -16.874 10.466 -19.841 1.00 0.00 C ATOM 275 C PHE A 20 -16.806 11.886 -19.288 1.00 0.00 C ATOM 276 O PHE A 20 -17.486 12.787 -19.780 1.00 0.00 O ATOM 277 CB PHE A 20 -17.917 9.655 -19.069 1.00 0.00 C ATOM 278 CG PHE A 20 -18.565 8.576 -19.888 1.00 0.00 C ATOM 279 CD1 PHE A 20 -17.828 7.851 -20.809 1.00 0.00 C ATOM 280 CD2 PHE A 20 -19.913 8.289 -19.740 1.00 0.00 C ATOM 281 CE1 PHE A 20 -18.420 6.856 -21.566 1.00 0.00 C ATOM 282 CE2 PHE A 20 -20.511 7.296 -20.492 1.00 0.00 C ATOM 283 CZ PHE A 20 -19.763 6.579 -21.408 1.00 0.00 C ATOM 0 H PHE A 20 -15.447 9.216 -18.950 1.00 0.00 H new ATOM 0 HA PHE A 20 -17.167 10.518 -20.890 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -17.442 9.203 -18.198 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -18.688 10.330 -18.697 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -16.777 8.065 -20.938 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -20.503 8.848 -19.029 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -17.833 6.297 -22.279 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -21.561 7.080 -20.365 1.00 0.00 H new ATOM 0 HZ PHE A 20 -20.229 5.804 -21.999 1.00 0.00 H new ATOM 293 N GLU A 21 -15.981 12.076 -18.264 1.00 0.00 N ATOM 294 CA GLU A 21 -15.823 13.387 -17.644 1.00 0.00 C ATOM 295 C GLU A 21 -14.789 14.224 -18.390 1.00 0.00 C ATOM 296 O GLU A 21 -14.675 15.429 -18.171 1.00 0.00 O ATOM 297 CB GLU A 21 -15.413 13.237 -16.176 1.00 0.00 C ATOM 298 CG GLU A 21 -15.251 14.563 -15.451 1.00 0.00 C ATOM 299 CD GLU A 21 -15.928 14.570 -14.095 1.00 0.00 C ATOM 300 OE1 GLU A 21 -15.614 13.689 -13.268 1.00 0.00 O ATOM 301 OE2 GLU A 21 -16.773 15.459 -13.861 1.00 0.00 O1- ATOM 0 H GLU A 21 -15.412 11.340 -17.846 1.00 0.00 H new ATOM 0 HA GLU A 21 -16.783 13.901 -17.695 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -16.162 12.638 -15.658 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -14.473 12.687 -16.124 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -14.190 14.777 -15.325 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -15.666 15.362 -16.065 1.00 0.00 H new ATOM 308 N GLN A 22 -14.037 13.574 -19.272 1.00 0.00 N ATOM 309 CA GLN A 22 -13.010 14.256 -20.050 1.00 0.00 C ATOM 310 C GLN A 22 -13.521 14.594 -21.447 1.00 0.00 C ATOM 311 O GLN A 22 -13.247 15.672 -21.976 1.00 0.00 O ATOM 312 CB GLN A 22 -11.754 13.387 -20.150 1.00 0.00 C ATOM 313 CG GLN A 22 -10.867 13.459 -18.918 1.00 0.00 C ATOM 314 CD GLN A 22 -9.684 12.514 -18.998 1.00 0.00 C ATOM 315 OE1 GLN A 22 -9.305 12.064 -20.078 1.00 0.00 O ATOM 316 NE2 GLN A 22 -9.093 12.208 -17.848 1.00 0.00 N ATOM 0 H GLN A 22 -14.120 12.576 -19.466 1.00 0.00 H new ATOM 0 HA GLN A 22 -12.760 15.186 -19.539 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -12.051 12.351 -20.314 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -11.177 13.695 -21.022 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -10.505 14.480 -18.794 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -11.459 13.221 -18.034 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -9.440 12.604 -16.975 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -8.292 11.577 -17.838 1.00 0.00 H new ATOM 325 N LYS A 23 -14.264 13.667 -22.041 1.00 0.00 N ATOM 326 CA LYS A 23 -14.815 13.867 -23.376 1.00 0.00 C ATOM 327 C LYS A 23 -15.929 14.911 -23.356 1.00 0.00 C ATOM 328 O LYS A 23 -16.050 15.717 -24.275 1.00 0.00 O ATOM 329 CB LYS A 23 -15.350 12.544 -23.932 1.00 0.00 C ATOM 330 CG LYS A 23 -14.258 11.588 -24.379 1.00 0.00 C ATOM 331 CD LYS A 23 -13.483 12.140 -25.563 1.00 0.00 C ATOM 332 CE LYS A 23 -12.008 12.308 -25.232 1.00 0.00 C ATOM 333 NZ LYS A 23 -11.295 13.109 -26.267 1.00 0.00 N1+ ATOM 0 H LYS A 23 -14.499 12.769 -21.619 1.00 0.00 H new ATOM 0 HA LYS A 23 -14.015 14.229 -24.022 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -15.957 12.058 -23.169 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -16.007 12.753 -24.776 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -13.574 11.402 -23.551 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -14.701 10.629 -24.648 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -13.592 11.469 -26.415 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -13.903 13.102 -25.858 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -11.907 12.795 -24.262 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -11.541 11.327 -25.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -10.293 13.201 -26.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -11.370 12.632 -27.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -11.724 14.054 -26.331 1.00 0.00 H new ATOM 347 N GLU A 24 -16.736 14.885 -22.300 1.00 0.00 N ATOM 348 CA GLU A 24 -17.838 15.829 -22.161 1.00 0.00 C ATOM 349 C GLU A 24 -17.368 17.123 -21.502 1.00 0.00 C ATOM 350 O GLU A 24 -18.173 17.995 -21.177 1.00 0.00 O ATOM 351 CB GLU A 24 -18.971 15.209 -21.340 1.00 0.00 C ATOM 352 CG GLU A 24 -20.311 15.200 -22.058 1.00 0.00 C ATOM 353 CD GLU A 24 -21.171 14.014 -21.673 1.00 0.00 C ATOM 354 OE1 GLU A 24 -21.598 13.944 -20.501 1.00 0.00 O ATOM 355 OE2 GLU A 24 -21.421 13.154 -22.543 1.00 0.00 O1- ATOM 0 H GLU A 24 -16.647 14.222 -21.530 1.00 0.00 H new ATOM 0 HA GLU A 24 -18.208 16.063 -23.159 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -18.701 14.185 -21.080 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -19.073 15.759 -20.405 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -20.847 16.122 -21.831 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -20.142 15.187 -23.135 1.00 0.00 H new ATOM 362 N SER A 25 -16.058 17.237 -21.307 1.00 0.00 N ATOM 363 CA SER A 25 -15.479 18.421 -20.684 1.00 0.00 C ATOM 364 C SER A 25 -14.541 19.141 -21.648 1.00 0.00 C ATOM 365 O SER A 25 -13.754 19.997 -21.245 1.00 0.00 O ATOM 366 CB SER A 25 -14.722 18.035 -19.412 1.00 0.00 C ATOM 367 OG SER A 25 -15.604 17.923 -18.308 1.00 0.00 O ATOM 0 H SER A 25 -15.378 16.524 -21.571 1.00 0.00 H new ATOM 0 HA SER A 25 -16.293 19.098 -20.424 1.00 0.00 H new ATOM 0 HB2 SER A 25 -14.205 17.088 -19.566 1.00 0.00 H new ATOM 0 HB3 SER A 25 -13.959 18.783 -19.198 1.00 0.00 H new ATOM 0 HG SER A 25 -15.545 17.020 -17.932 1.00 0.00 H new ATOM 373 N ASN A 26 -14.630 18.785 -22.927 1.00 0.00 N ATOM 374 CA ASN A 26 -13.790 19.396 -23.949 1.00 0.00 C ATOM 375 C ASN A 26 -14.211 18.938 -25.342 1.00 0.00 C ATOM 376 O ASN A 26 -14.201 19.719 -26.294 1.00 0.00 O ATOM 377 CB ASN A 26 -12.321 19.045 -23.708 1.00 0.00 C ATOM 378 CG ASN A 26 -11.490 20.261 -23.345 1.00 0.00 C ATOM 379 OD1 ASN A 26 -11.236 21.127 -24.181 1.00 0.00 O ATOM 380 ND2 ASN A 26 -11.062 20.331 -22.088 1.00 0.00 N ATOM 0 H ASN A 26 -15.275 18.077 -23.278 1.00 0.00 H new ATOM 0 HA ASN A 26 -13.913 20.477 -23.887 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -12.252 18.309 -22.907 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -11.909 18.581 -24.604 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -10.499 21.126 -21.784 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -11.296 19.590 -21.427 1.00 0.00 H new ATOM 387 N GLY A 27 -14.579 17.664 -25.456 1.00 0.00 N ATOM 388 CA GLY A 27 -14.997 17.123 -26.737 1.00 0.00 C ATOM 389 C GLY A 27 -16.291 17.742 -27.231 1.00 0.00 C ATOM 390 O GLY A 27 -16.399 18.957 -27.396 1.00 0.00 O ATOM 0 H GLY A 27 -14.595 16.998 -24.684 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -14.212 17.292 -27.474 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -15.124 16.044 -26.649 1.00 0.00 H new ATOM 394 N PRO A 28 -17.299 16.894 -27.478 1.00 0.00 N ATOM 395 CA PRO A 28 -18.609 17.340 -27.963 1.00 0.00 C ATOM 396 C PRO A 28 -19.387 18.112 -26.901 1.00 0.00 C ATOM 397 O PRO A 28 -20.548 17.808 -26.626 1.00 0.00 O ATOM 398 CB PRO A 28 -19.326 16.033 -28.306 1.00 0.00 C ATOM 399 CG PRO A 28 -18.674 15.007 -27.444 1.00 0.00 C ATOM 400 CD PRO A 28 -17.239 15.433 -27.303 1.00 0.00 C ATOM 0 HA PRO A 28 -18.520 18.026 -28.806 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -20.394 16.102 -28.101 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -19.219 15.788 -29.363 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -19.161 14.949 -26.471 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -18.744 14.017 -27.895 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -16.833 15.161 -26.329 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -16.605 14.964 -28.055 1.00 0.00 H new ATOM 408 N VAL A 29 -18.739 19.110 -26.309 1.00 0.00 N ATOM 409 CA VAL A 29 -19.373 19.925 -25.279 1.00 0.00 C ATOM 410 C VAL A 29 -18.838 21.353 -25.305 1.00 0.00 C ATOM 411 O VAL A 29 -19.602 22.316 -25.230 1.00 0.00 O ATOM 412 CB VAL A 29 -19.151 19.330 -23.876 1.00 0.00 C ATOM 413 CG1 VAL A 29 -19.666 20.280 -22.805 1.00 0.00 C ATOM 414 CG2 VAL A 29 -19.823 17.970 -23.763 1.00 0.00 C ATOM 0 H VAL A 29 -17.777 19.373 -26.524 1.00 0.00 H new ATOM 0 HA VAL A 29 -20.441 19.935 -25.495 1.00 0.00 H new ATOM 0 HB VAL A 29 -18.080 19.195 -23.722 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -19.501 19.842 -21.820 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -19.134 21.229 -22.874 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -20.733 20.450 -22.952 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -19.656 17.564 -22.765 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -20.894 18.078 -23.937 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -19.401 17.293 -24.506 1.00 0.00 H new ATOM 424 N LYS A 30 -17.519 21.483 -25.408 1.00 0.00 N ATOM 425 CA LYS A 30 -16.879 22.795 -25.443 1.00 0.00 C ATOM 426 C LYS A 30 -16.366 23.110 -26.844 1.00 0.00 C ATOM 427 O LYS A 30 -16.311 24.273 -27.248 1.00 0.00 O ATOM 428 CB LYS A 30 -15.724 22.848 -24.440 1.00 0.00 C ATOM 429 CG LYS A 30 -16.165 23.150 -23.019 1.00 0.00 C ATOM 430 CD LYS A 30 -15.415 22.299 -22.010 1.00 0.00 C ATOM 431 CE LYS A 30 -16.325 21.829 -20.886 1.00 0.00 C ATOM 432 NZ LYS A 30 -15.585 21.656 -19.606 1.00 0.00 N1+ ATOM 0 H LYS A 30 -16.872 20.697 -25.469 1.00 0.00 H new ATOM 0 HA LYS A 30 -17.623 23.544 -25.170 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -15.199 21.893 -24.453 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -15.011 23.608 -24.759 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -15.998 24.205 -22.802 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -17.236 22.970 -22.923 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -14.982 21.435 -22.513 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -14.588 22.873 -21.593 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -17.130 22.551 -20.745 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -16.790 20.884 -21.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -16.212 21.223 -18.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -14.762 21.040 -19.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -15.264 22.584 -19.263 1.00 0.00 H new ATOM 446 N VAL A 31 -15.995 22.070 -27.582 1.00 0.00 N ATOM 447 CA VAL A 31 -15.487 22.237 -28.939 1.00 0.00 C ATOM 448 C VAL A 31 -16.469 23.028 -29.796 1.00 0.00 C ATOM 449 O VAL A 31 -16.106 23.553 -30.849 1.00 0.00 O ATOM 450 CB VAL A 31 -15.218 20.877 -29.609 1.00 0.00 C ATOM 451 CG1 VAL A 31 -16.525 20.198 -29.987 1.00 0.00 C ATOM 452 CG2 VAL A 31 -14.325 21.053 -30.830 1.00 0.00 C ATOM 0 H VAL A 31 -16.036 21.102 -27.264 1.00 0.00 H new ATOM 0 HA VAL A 31 -14.549 22.787 -28.862 1.00 0.00 H new ATOM 0 HB VAL A 31 -14.699 20.237 -28.896 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -16.313 19.239 -30.459 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -17.124 20.037 -29.091 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -17.076 20.831 -30.683 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -14.145 20.082 -31.292 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -14.815 21.711 -31.548 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -13.375 21.492 -30.526 1.00 0.00 H new ATOM 462 N TRP A 32 -17.714 23.108 -29.341 1.00 0.00 N ATOM 463 CA TRP A 32 -18.748 23.836 -30.069 1.00 0.00 C ATOM 464 C TRP A 32 -18.297 25.257 -30.379 1.00 0.00 C ATOM 465 O TRP A 32 -18.277 25.675 -31.537 1.00 0.00 O ATOM 466 CB TRP A 32 -20.046 23.866 -29.257 1.00 0.00 C ATOM 467 CG TRP A 32 -21.132 24.671 -29.903 1.00 0.00 C ATOM 468 CD1 TRP A 32 -21.748 25.774 -29.387 1.00 0.00 C ATOM 469 CD2 TRP A 32 -21.729 24.435 -31.183 1.00 0.00 C ATOM 470 NE1 TRP A 32 -22.693 26.239 -30.269 1.00 0.00 N ATOM 471 CE2 TRP A 32 -22.702 25.436 -31.380 1.00 0.00 C ATOM 472 CE3 TRP A 32 -21.535 23.479 -32.183 1.00 0.00 C ATOM 473 CZ2 TRP A 32 -23.477 25.503 -32.534 1.00 0.00 C ATOM 474 CZ3 TRP A 32 -22.308 23.547 -33.326 1.00 0.00 C ATOM 475 CH2 TRP A 32 -23.266 24.554 -33.496 1.00 0.00 C ATOM 0 H TRP A 32 -18.032 22.678 -28.472 1.00 0.00 H new ATOM 0 HA TRP A 32 -18.927 23.318 -31.011 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -20.398 22.845 -29.111 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -19.838 24.276 -28.269 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -21.525 26.216 -28.427 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -23.292 27.051 -30.121 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -20.795 22.702 -32.065 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -24.219 26.277 -32.665 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -22.171 22.810 -34.103 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -23.850 24.582 -34.404 1.00 0.00 H new ATOM 486 N GLY A 33 -17.935 26.000 -29.337 1.00 0.00 N ATOM 487 CA GLY A 33 -17.488 27.369 -29.522 1.00 0.00 C ATOM 488 C GLY A 33 -16.634 27.861 -28.368 1.00 0.00 C ATOM 489 O GLY A 33 -16.461 29.066 -28.186 1.00 0.00 O ATOM 0 H GLY A 33 -17.943 25.679 -28.369 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.918 27.440 -30.448 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -18.356 28.020 -29.631 1.00 0.00 H new ATOM 493 N SER A 34 -16.103 26.926 -27.587 1.00 0.00 N ATOM 494 CA SER A 34 -15.269 27.271 -26.442 1.00 0.00 C ATOM 495 C SER A 34 -13.832 27.540 -26.879 1.00 0.00 C ATOM 496 O SER A 34 -13.315 28.643 -26.703 1.00 0.00 O ATOM 497 CB SER A 34 -15.297 26.147 -25.407 1.00 0.00 C ATOM 498 OG SER A 34 -14.588 26.513 -24.237 1.00 0.00 O ATOM 0 H SER A 34 -16.235 25.924 -27.726 1.00 0.00 H new ATOM 0 HA SER A 34 -15.670 28.179 -25.992 1.00 0.00 H new ATOM 0 HB2 SER A 34 -16.330 25.910 -25.151 1.00 0.00 H new ATOM 0 HB3 SER A 34 -14.859 25.245 -25.834 1.00 0.00 H new ATOM 0 HG SER A 34 -13.636 26.613 -24.449 1.00 0.00 H new ATOM 504 N ILE A 35 -13.193 26.524 -27.448 1.00 0.00 N ATOM 505 CA ILE A 35 -11.817 26.651 -27.911 1.00 0.00 C ATOM 506 C ILE A 35 -11.680 27.779 -28.929 1.00 0.00 C ATOM 507 O ILE A 35 -10.574 28.233 -29.222 1.00 0.00 O ATOM 508 CB ILE A 35 -11.313 25.341 -28.546 1.00 0.00 C ATOM 509 CG1 ILE A 35 -11.871 24.133 -27.786 1.00 0.00 C ATOM 510 CG2 ILE A 35 -9.792 25.308 -28.556 1.00 0.00 C ATOM 511 CD1 ILE A 35 -11.046 22.878 -27.957 1.00 0.00 C ATOM 0 H ILE A 35 -13.606 25.604 -27.600 1.00 0.00 H new ATOM 0 HA ILE A 35 -11.210 26.879 -27.035 1.00 0.00 H new ATOM 0 HB ILE A 35 -11.666 25.295 -29.576 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -11.930 24.377 -26.725 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -12.888 23.938 -28.126 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -9.451 24.376 -29.008 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -9.414 26.151 -29.134 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -9.420 25.373 -27.534 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -11.500 22.064 -27.392 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -11.007 22.609 -29.013 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -10.035 23.055 -27.590 1.00 0.00 H new ATOM 523 N LYS A 36 -12.812 28.227 -29.461 1.00 0.00 N ATOM 524 CA LYS A 36 -12.821 29.304 -30.443 1.00 0.00 C ATOM 525 C LYS A 36 -13.644 30.489 -29.945 1.00 0.00 C ATOM 526 O LYS A 36 -13.966 31.398 -30.708 1.00 0.00 O ATOM 527 CB LYS A 36 -13.381 28.804 -31.776 1.00 0.00 C ATOM 528 CG LYS A 36 -14.643 27.970 -31.630 1.00 0.00 C ATOM 529 CD LYS A 36 -15.718 28.411 -32.610 1.00 0.00 C ATOM 530 CE LYS A 36 -15.312 28.121 -34.047 1.00 0.00 C ATOM 531 NZ LYS A 36 -15.498 29.308 -34.926 1.00 0.00 N1+ ATOM 0 H LYS A 36 -13.735 27.861 -29.228 1.00 0.00 H new ATOM 0 HA LYS A 36 -11.793 29.635 -30.590 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -13.593 29.661 -32.416 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -12.619 28.210 -32.281 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -14.407 26.919 -31.796 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -15.021 28.055 -30.611 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -16.652 27.897 -32.383 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -15.905 29.478 -32.491 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -14.268 27.810 -34.074 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -15.903 27.289 -34.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -15.210 29.070 -35.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -16.499 29.590 -34.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -14.915 30.094 -34.575 1.00 0.00 H new ATOM 545 N GLY A 37 -13.983 30.469 -28.660 1.00 0.00 N ATOM 546 CA GLY A 37 -14.765 31.547 -28.081 1.00 0.00 C ATOM 547 C GLY A 37 -14.467 31.755 -26.610 1.00 0.00 C ATOM 548 O GLY A 37 -13.993 32.817 -26.210 1.00 0.00 O ATOM 0 H GLY A 37 -13.730 29.726 -28.009 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -14.562 32.470 -28.624 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -15.826 31.330 -28.206 1.00 0.00 H new ATOM 552 N LEU A 38 -14.747 30.739 -25.802 1.00 0.00 N ATOM 553 CA LEU A 38 -14.509 30.816 -24.365 1.00 0.00 C ATOM 554 C LEU A 38 -13.017 30.716 -24.055 1.00 0.00 C ATOM 555 O LEU A 38 -12.444 31.602 -23.420 1.00 0.00 O ATOM 556 CB LEU A 38 -15.267 29.700 -23.641 1.00 0.00 C ATOM 557 CG LEU A 38 -16.785 29.869 -23.555 1.00 0.00 C ATOM 558 CD1 LEU A 38 -17.469 28.511 -23.533 1.00 0.00 C ATOM 559 CD2 LEU A 38 -17.162 30.679 -22.324 1.00 0.00 C ATOM 0 H LEU A 38 -15.139 29.852 -26.117 1.00 0.00 H new ATOM 0 HA LEU A 38 -14.872 31.781 -24.013 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -15.054 28.757 -24.144 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -14.872 29.617 -22.628 1.00 0.00 H new ATOM 0 HG LEU A 38 -17.124 30.411 -24.438 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -18.549 28.648 -23.472 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -17.224 27.965 -24.444 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -17.126 27.945 -22.667 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -18.245 30.789 -22.279 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -16.812 30.165 -21.429 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -16.699 31.664 -22.381 1.00 0.00 H new ATOM 571 N THR A 39 -12.396 29.633 -24.509 1.00 0.00 N ATOM 572 CA THR A 39 -10.972 29.418 -24.281 1.00 0.00 C ATOM 573 C THR A 39 -10.130 30.229 -25.259 1.00 0.00 C ATOM 574 O THR A 39 -8.940 30.448 -25.034 1.00 0.00 O ATOM 575 CB THR A 39 -10.601 27.929 -24.413 1.00 0.00 C ATOM 576 OG1 THR A 39 -11.779 27.148 -24.636 1.00 0.00 O ATOM 577 CG2 THR A 39 -9.888 27.435 -23.163 1.00 0.00 C ATOM 0 H THR A 39 -12.856 28.891 -25.037 1.00 0.00 H new ATOM 0 HA THR A 39 -10.761 29.749 -23.264 1.00 0.00 H new ATOM 0 HB THR A 39 -9.927 27.820 -25.263 1.00 0.00 H new ATOM 0 HG1 THR A 39 -11.534 26.203 -24.720 1.00 0.00 H new ATOM 0 HG21 THR A 39 -9.636 26.381 -23.280 1.00 0.00 H new ATOM 0 HG22 THR A 39 -8.975 28.012 -23.013 1.00 0.00 H new ATOM 0 HG23 THR A 39 -10.541 27.558 -22.299 1.00 0.00 H new ATOM 585 N GLU A 40 -10.756 30.672 -26.344 1.00 0.00 N ATOM 586 CA GLU A 40 -10.063 31.461 -27.356 1.00 0.00 C ATOM 587 C GLU A 40 -10.245 32.955 -27.104 1.00 0.00 C ATOM 588 O GLU A 40 -9.395 33.765 -27.466 1.00 0.00 O ATOM 589 CB GLU A 40 -10.575 31.104 -28.754 1.00 0.00 C ATOM 590 CG GLU A 40 -10.562 32.271 -29.725 1.00 0.00 C ATOM 591 CD GLU A 40 -9.162 32.780 -30.007 1.00 0.00 C ATOM 592 OE1 GLU A 40 -8.212 31.973 -29.936 1.00 0.00 O ATOM 593 OE2 GLU A 40 -9.017 33.985 -30.299 1.00 0.00 O1- ATOM 0 H GLU A 40 -11.741 30.498 -26.545 1.00 0.00 H new ATOM 0 HA GLU A 40 -9.000 31.227 -27.294 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -9.964 30.298 -29.160 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -11.593 30.722 -28.672 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -11.029 31.965 -30.661 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -11.165 33.083 -29.319 1.00 0.00 H new ATOM 600 N GLY A 41 -11.364 33.310 -26.477 1.00 0.00 N ATOM 601 CA GLY A 41 -11.639 34.705 -26.187 1.00 0.00 C ATOM 602 C GLY A 41 -11.324 35.070 -24.751 1.00 0.00 C ATOM 603 O GLY A 41 -10.781 36.143 -24.480 1.00 0.00 O ATOM 0 H GLY A 41 -12.083 32.657 -26.166 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -11.052 35.335 -26.856 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -12.689 34.915 -26.390 1.00 0.00 H new ATOM 607 N LEU A 42 -11.667 34.181 -23.827 1.00 0.00 N ATOM 608 CA LEU A 42 -11.418 34.415 -22.408 1.00 0.00 C ATOM 609 C LEU A 42 -10.061 33.856 -21.993 1.00 0.00 C ATOM 610 O LEU A 42 -9.454 34.322 -21.027 1.00 0.00 O ATOM 611 CB LEU A 42 -12.524 33.782 -21.565 1.00 0.00 C ATOM 612 CG LEU A 42 -13.916 33.751 -22.195 1.00 0.00 C ATOM 613 CD1 LEU A 42 -14.841 32.838 -21.406 1.00 0.00 C ATOM 614 CD2 LEU A 42 -14.495 35.156 -22.281 1.00 0.00 C ATOM 0 H LEU A 42 -12.119 33.290 -24.034 1.00 0.00 H new ATOM 0 HA LEU A 42 -11.413 35.492 -22.238 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -12.232 32.759 -21.328 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -12.587 34.322 -20.620 1.00 0.00 H new ATOM 0 HG LEU A 42 -13.826 33.355 -23.206 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -15.827 32.830 -21.871 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -14.435 31.827 -21.399 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -14.925 33.202 -20.382 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -15.486 35.114 -22.732 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -14.570 35.581 -21.280 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -13.844 35.781 -22.893 1.00 0.00 H new ATOM 626 N HIS A 43 -9.589 32.855 -22.730 1.00 0.00 N ATOM 627 CA HIS A 43 -8.303 32.232 -22.440 1.00 0.00 C ATOM 628 C HIS A 43 -7.370 32.327 -23.642 1.00 0.00 C ATOM 629 O HIS A 43 -6.202 31.946 -23.566 1.00 0.00 O ATOM 630 CB HIS A 43 -8.497 30.769 -22.042 1.00 0.00 C ATOM 631 CG HIS A 43 -7.762 30.384 -20.797 1.00 0.00 C ATOM 632 ND1 HIS A 43 -6.384 30.331 -20.723 1.00 0.00 N ATOM 633 CD2 HIS A 43 -8.217 30.029 -19.574 1.00 0.00 C ATOM 634 CE1 HIS A 43 -6.026 29.960 -19.506 1.00 0.00 C ATOM 635 NE2 HIS A 43 -7.119 29.772 -18.787 1.00 0.00 N ATOM 0 H HIS A 43 -10.078 32.458 -23.532 1.00 0.00 H new ATOM 0 HA HIS A 43 -7.848 32.768 -21.607 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -9.561 30.578 -21.900 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -8.165 30.131 -22.861 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -9.251 29.960 -19.271 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -5.012 29.832 -19.158 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -7.144 29.484 -17.809 1.00 0.00 H new ATOM 643 N GLY A 44 -7.894 32.835 -24.753 1.00 0.00 N ATOM 644 CA GLY A 44 -7.094 32.967 -25.957 1.00 0.00 C ATOM 645 C GLY A 44 -6.858 34.416 -26.338 1.00 0.00 C ATOM 646 O GLY A 44 -5.891 34.733 -27.030 1.00 0.00 O ATOM 0 H GLY A 44 -8.858 33.157 -24.841 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -6.134 32.472 -25.808 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -7.593 32.454 -26.780 1.00 0.00 H new ATOM 650 N PHE A 45 -7.744 35.298 -25.887 1.00 0.00 N ATOM 651 CA PHE A 45 -7.628 36.720 -26.186 1.00 0.00 C ATOM 652 C PHE A 45 -7.555 37.542 -24.904 1.00 0.00 C ATOM 653 O PHE A 45 -7.090 38.683 -24.909 1.00 0.00 O ATOM 654 CB PHE A 45 -8.814 37.182 -27.037 1.00 0.00 C ATOM 655 CG PHE A 45 -9.000 38.673 -27.045 1.00 0.00 C ATOM 656 CD1 PHE A 45 -9.739 39.296 -26.053 1.00 0.00 C ATOM 657 CD2 PHE A 45 -8.438 39.448 -28.045 1.00 0.00 C ATOM 658 CE1 PHE A 45 -9.913 40.667 -26.060 1.00 0.00 C ATOM 659 CE2 PHE A 45 -8.607 40.821 -28.057 1.00 0.00 C ATOM 660 CZ PHE A 45 -9.347 41.431 -27.061 1.00 0.00 C ATOM 0 H PHE A 45 -8.551 35.052 -25.313 1.00 0.00 H new ATOM 0 HA PHE A 45 -6.706 36.874 -26.747 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -8.673 36.836 -28.061 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -9.724 36.712 -26.664 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -10.184 38.705 -25.266 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -7.860 38.975 -28.825 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -10.492 41.141 -25.282 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -8.162 41.415 -28.842 1.00 0.00 H new ATOM 0 HZ PHE A 45 -9.482 42.503 -27.066 1.00 0.00 H new ATOM 670 N HIS A 46 -8.021 36.956 -23.807 1.00 0.00 N ATOM 671 CA HIS A 46 -8.010 37.634 -22.514 1.00 0.00 C ATOM 672 C HIS A 46 -6.823 37.177 -21.671 1.00 0.00 C ATOM 673 O HIS A 46 -6.191 37.981 -20.985 1.00 0.00 O ATOM 674 CB HIS A 46 -9.316 37.367 -21.764 1.00 0.00 C ATOM 675 CG HIS A 46 -9.207 37.568 -20.283 1.00 0.00 C ATOM 676 ND1 HIS A 46 -9.689 36.660 -19.364 1.00 0.00 N ATOM 677 CD2 HIS A 46 -8.667 38.579 -19.564 1.00 0.00 C ATOM 678 CE1 HIS A 46 -9.449 37.104 -18.143 1.00 0.00 C ATOM 679 NE2 HIS A 46 -8.831 38.266 -18.237 1.00 0.00 N ATOM 0 H HIS A 46 -8.411 36.014 -23.786 1.00 0.00 H new ATOM 0 HA HIS A 46 -7.915 38.705 -22.693 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -10.092 38.025 -22.156 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -9.636 36.344 -21.961 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -10.157 35.783 -19.591 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -8.195 39.466 -19.960 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -9.714 36.601 -17.224 1.00 0.00 H new ATOM 687 N VAL A 47 -6.527 35.884 -21.728 1.00 0.00 N ATOM 688 CA VAL A 47 -5.413 35.322 -20.970 1.00 0.00 C ATOM 689 C VAL A 47 -4.170 35.185 -21.839 1.00 0.00 C ATOM 690 O VAL A 47 -3.045 35.346 -21.363 1.00 0.00 O ATOM 691 CB VAL A 47 -5.775 33.940 -20.389 1.00 0.00 C ATOM 692 CG1 VAL A 47 -4.596 33.361 -19.620 1.00 0.00 C ATOM 693 CG2 VAL A 47 -7.005 34.041 -19.498 1.00 0.00 C ATOM 0 H VAL A 47 -7.041 35.205 -22.290 1.00 0.00 H new ATOM 0 HA VAL A 47 -5.205 36.012 -20.152 1.00 0.00 H new ATOM 0 HB VAL A 47 -6.008 33.267 -21.214 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -4.868 32.386 -19.217 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -3.743 33.251 -20.290 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -4.331 34.031 -18.802 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -7.246 33.056 -19.097 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -6.804 34.728 -18.676 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -7.848 34.411 -20.082 1.00 0.00 H new ATOM 703 N HIS A 48 -4.375 34.890 -23.118 1.00 0.00 N ATOM 704 CA HIS A 48 -3.270 34.733 -24.056 1.00 0.00 C ATOM 705 C HIS A 48 -3.138 35.964 -24.949 1.00 0.00 C ATOM 706 O HIS A 48 -2.046 36.289 -25.413 1.00 0.00 O ATOM 707 CB HIS A 48 -3.474 33.486 -24.914 1.00 0.00 C ATOM 708 CG HIS A 48 -3.124 32.211 -24.209 1.00 0.00 C ATOM 709 ND1 HIS A 48 -3.111 32.090 -22.837 1.00 0.00 N ATOM 710 CD2 HIS A 48 -2.775 30.998 -24.697 1.00 0.00 C ATOM 711 CE1 HIS A 48 -2.768 30.856 -22.510 1.00 0.00 C ATOM 712 NE2 HIS A 48 -2.558 30.174 -23.621 1.00 0.00 N ATOM 0 H HIS A 48 -5.298 34.755 -23.529 1.00 0.00 H new ATOM 0 HA HIS A 48 -2.351 34.621 -23.481 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -4.515 33.441 -25.234 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -2.867 33.572 -25.815 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -2.684 30.729 -25.739 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -2.675 30.471 -21.505 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -2.280 29.194 -23.671 1.00 0.00 H new ATOM 720 N GLU A 49 -4.256 36.642 -25.185 1.00 0.00 N ATOM 721 CA GLU A 49 -4.265 37.835 -26.023 1.00 0.00 C ATOM 722 C GLU A 49 -3.644 37.544 -27.387 1.00 0.00 C ATOM 723 O GLU A 49 -3.047 38.424 -28.010 1.00 0.00 O ATOM 724 CB GLU A 49 -3.506 38.973 -25.336 1.00 0.00 C ATOM 725 CG GLU A 49 -4.176 40.329 -25.486 1.00 0.00 C ATOM 726 CD GLU A 49 -5.154 40.622 -24.367 1.00 0.00 C ATOM 727 OE1 GLU A 49 -4.935 40.126 -23.243 1.00 0.00 O ATOM 728 OE2 GLU A 49 -6.139 41.348 -24.614 1.00 0.00 O1- ATOM 0 H GLU A 49 -5.168 36.385 -24.807 1.00 0.00 H new ATOM 0 HA GLU A 49 -5.302 38.138 -26.171 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -3.405 38.743 -24.275 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -2.498 39.027 -25.748 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -3.413 41.107 -25.509 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -4.700 40.368 -26.441 1.00 0.00 H new ATOM 735 N PHE A 50 -3.787 36.306 -27.845 1.00 0.00 N ATOM 736 CA PHE A 50 -3.240 35.898 -29.133 1.00 0.00 C ATOM 737 C PHE A 50 -1.718 35.993 -29.133 1.00 0.00 C ATOM 738 O PHE A 50 -1.084 35.966 -30.185 1.00 0.00 O ATOM 739 CB PHE A 50 -3.817 36.768 -30.254 1.00 0.00 C ATOM 740 CG PHE A 50 -4.422 35.975 -31.377 1.00 0.00 C ATOM 741 CD1 PHE A 50 -5.426 35.052 -31.130 1.00 0.00 C ATOM 742 CD2 PHE A 50 -3.986 36.153 -32.681 1.00 0.00 C ATOM 743 CE1 PHE A 50 -5.982 34.321 -32.162 1.00 0.00 C ATOM 744 CE2 PHE A 50 -4.539 35.423 -33.717 1.00 0.00 C ATOM 745 CZ PHE A 50 -5.539 34.506 -33.458 1.00 0.00 C ATOM 0 H PHE A 50 -4.278 35.566 -27.343 1.00 0.00 H new ATOM 0 HA PHE A 50 -3.521 34.859 -29.306 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -4.577 37.429 -29.836 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -3.027 37.404 -30.653 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -5.778 34.903 -30.120 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -3.206 36.870 -32.890 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -6.763 33.604 -31.956 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -4.189 35.570 -34.728 1.00 0.00 H new ATOM 0 HZ PHE A 50 -5.973 33.935 -34.266 1.00 0.00 H new ATOM 755 N GLY A 51 -1.140 36.106 -27.941 1.00 0.00 N ATOM 756 CA GLY A 51 0.304 36.204 -27.825 1.00 0.00 C ATOM 757 C GLY A 51 0.738 37.365 -26.951 1.00 0.00 C ATOM 758 O GLY A 51 1.738 37.275 -26.239 1.00 0.00 O ATOM 0 H GLY A 51 -1.645 36.131 -27.055 1.00 0.00 H new ATOM 0 HA2 GLY A 51 0.696 35.275 -27.411 1.00 0.00 H new ATOM 0 HA3 GLY A 51 0.738 36.319 -28.818 1.00 0.00 H new ATOM 762 N ASP A 52 -0.015 38.457 -27.006 1.00 0.00 N ATOM 763 CA ASP A 52 0.296 39.642 -26.212 1.00 0.00 C ATOM 764 C ASP A 52 0.126 39.359 -24.723 1.00 0.00 C ATOM 765 O ASP A 52 0.678 40.063 -23.881 1.00 0.00 O ATOM 766 CB ASP A 52 -0.599 40.810 -26.628 1.00 0.00 C ATOM 767 CG ASP A 52 -0.846 40.846 -28.123 1.00 0.00 C ATOM 768 OD1 ASP A 52 0.084 40.516 -28.888 1.00 0.00 O ATOM 769 OD2 ASP A 52 -1.972 41.205 -28.530 1.00 0.00 O1- ATOM 0 H ASP A 52 -0.845 38.548 -27.592 1.00 0.00 H new ATOM 0 HA ASP A 52 1.337 39.909 -26.395 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -1.553 40.736 -26.107 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -0.137 41.747 -26.316 1.00 0.00 H new ATOM 774 N ASN A 53 -0.642 38.321 -24.407 1.00 0.00 N ATOM 775 CA ASN A 53 -0.886 37.945 -23.019 1.00 0.00 C ATOM 776 C ASN A 53 -1.868 38.908 -22.359 1.00 0.00 C ATOM 777 O ASN A 53 -2.914 38.500 -21.854 1.00 0.00 O ATOM 778 CB ASN A 53 0.428 37.923 -22.235 1.00 0.00 C ATOM 779 CG ASN A 53 1.581 37.382 -23.058 1.00 0.00 C ATOM 780 OD1 ASN A 53 2.569 38.079 -23.296 1.00 0.00 O ATOM 781 ND2 ASN A 53 1.461 36.135 -23.494 1.00 0.00 N ATOM 0 H ASN A 53 -1.106 37.726 -25.093 1.00 0.00 H new ATOM 0 HA ASN A 53 -1.322 36.946 -23.011 1.00 0.00 H new ATOM 0 HB2 ASN A 53 0.666 38.933 -21.901 1.00 0.00 H new ATOM 0 HB3 ASN A 53 0.305 37.312 -21.341 1.00 0.00 H new ATOM 0 HD21 ASN A 53 2.205 35.716 -24.051 1.00 0.00 H new ATOM 0 HD22 ASN A 53 0.624 35.595 -23.272 1.00 0.00 H new ATOM 788 N THR A 54 -1.525 40.192 -22.368 1.00 0.00 N ATOM 789 CA THR A 54 -2.376 41.216 -21.772 1.00 0.00 C ATOM 790 C THR A 54 -2.411 42.473 -22.633 1.00 0.00 C ATOM 791 O THR A 54 -2.925 43.509 -22.215 1.00 0.00 O ATOM 792 CB THR A 54 -1.893 41.591 -20.357 1.00 0.00 C ATOM 793 OG1 THR A 54 -0.473 41.435 -20.265 1.00 0.00 O ATOM 794 CG2 THR A 54 -2.572 40.723 -19.307 1.00 0.00 C ATOM 0 H THR A 54 -0.663 40.548 -22.782 1.00 0.00 H new ATOM 0 HA THR A 54 -3.380 40.795 -21.708 1.00 0.00 H new ATOM 0 HB THR A 54 -2.156 42.633 -20.172 1.00 0.00 H new ATOM 0 HG1 THR A 54 -0.175 41.677 -19.363 1.00 0.00 H new ATOM 0 HG21 THR A 54 -2.216 41.005 -18.316 1.00 0.00 H new ATOM 0 HG22 THR A 54 -3.651 40.866 -19.359 1.00 0.00 H new ATOM 0 HG23 THR A 54 -2.336 39.675 -19.493 1.00 0.00 H new ATOM 802 N ALA A 55 -1.860 42.374 -23.839 1.00 0.00 N ATOM 803 CA ALA A 55 -1.832 43.503 -24.762 1.00 0.00 C ATOM 804 C ALA A 55 -1.231 44.737 -24.100 1.00 0.00 C ATOM 805 O ALA A 55 -1.494 45.866 -24.512 1.00 0.00 O ATOM 806 CB ALA A 55 -3.236 43.805 -25.268 1.00 0.00 C ATOM 0 H ALA A 55 -1.427 41.524 -24.200 1.00 0.00 H new ATOM 0 HA ALA A 55 -1.202 43.233 -25.609 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -3.201 44.650 -25.956 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -3.632 42.931 -25.786 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -3.882 44.050 -24.425 1.00 0.00 H new ATOM 812 N GLY A 56 -0.421 44.514 -23.069 1.00 0.00 N ATOM 813 CA GLY A 56 0.206 45.617 -22.367 1.00 0.00 C ATOM 814 C GLY A 56 1.707 45.445 -22.232 1.00 0.00 C ATOM 815 O GLY A 56 2.450 46.425 -22.190 1.00 0.00 O ATOM 0 H GLY A 56 -0.188 43.589 -22.708 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -0.003 46.546 -22.897 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -0.236 45.710 -21.375 1.00 0.00 H new ATOM 819 N CYS A 57 2.151 44.194 -22.165 1.00 0.00 N ATOM 820 CA CYS A 57 3.573 43.896 -22.033 1.00 0.00 C ATOM 821 C CYS A 57 4.129 43.314 -23.329 1.00 0.00 C ATOM 822 O CYS A 57 5.267 42.849 -23.376 1.00 0.00 O ATOM 823 CB CYS A 57 3.804 42.917 -20.880 1.00 0.00 C ATOM 824 SG CYS A 57 4.263 43.708 -19.320 1.00 0.00 S ATOM 0 H CYS A 57 1.548 43.372 -22.200 1.00 0.00 H new ATOM 0 HA CYS A 57 4.097 44.828 -21.820 1.00 0.00 H new ATOM 0 HB2 CYS A 57 2.896 42.333 -20.726 1.00 0.00 H new ATOM 0 HB3 CYS A 57 4.589 42.216 -21.164 1.00 0.00 H new ATOM 0 HG CYS A 57 4.434 42.799 -18.407 1.00 0.00 H new ATOM 830 N THR A 58 3.316 43.346 -24.381 1.00 0.00 N ATOM 831 CA THR A 58 3.727 42.820 -25.678 1.00 0.00 C ATOM 832 C THR A 58 2.879 43.406 -26.800 1.00 0.00 C ATOM 833 O THR A 58 2.810 42.847 -27.895 1.00 0.00 O ATOM 834 CB THR A 58 3.623 41.285 -25.719 1.00 0.00 C ATOM 835 OG1 THR A 58 3.083 40.796 -24.486 1.00 0.00 O ATOM 836 CG2 THR A 58 4.987 40.656 -25.965 1.00 0.00 C ATOM 0 H THR A 58 2.371 43.730 -24.361 1.00 0.00 H new ATOM 0 HA THR A 58 4.768 43.110 -25.823 1.00 0.00 H new ATOM 0 HB THR A 58 2.960 41.011 -26.540 1.00 0.00 H new ATOM 0 HG1 THR A 58 2.116 40.954 -24.467 1.00 0.00 H new ATOM 0 HG21 THR A 58 4.888 39.571 -25.990 1.00 0.00 H new ATOM 0 HG22 THR A 58 5.383 41.006 -26.918 1.00 0.00 H new ATOM 0 HG23 THR A 58 5.669 40.940 -25.163 1.00 0.00 H new ATOM 844 N SER A 59 2.236 44.536 -26.522 1.00 0.00 N ATOM 845 CA SER A 59 1.389 45.194 -27.509 1.00 0.00 C ATOM 846 C SER A 59 1.203 46.671 -27.166 1.00 0.00 C ATOM 847 O SER A 59 1.176 47.526 -28.051 1.00 0.00 O ATOM 848 CB SER A 59 0.027 44.504 -27.590 1.00 0.00 C ATOM 849 OG SER A 59 -0.983 45.294 -26.988 1.00 0.00 O ATOM 0 H SER A 59 2.286 45.014 -25.622 1.00 0.00 H new ATOM 0 HA SER A 59 1.882 45.121 -28.478 1.00 0.00 H new ATOM 0 HB2 SER A 59 -0.227 44.317 -28.633 1.00 0.00 H new ATOM 0 HB3 SER A 59 0.077 43.534 -27.095 1.00 0.00 H new ATOM 0 HG SER A 59 -1.800 45.247 -27.527 1.00 0.00 H new ATOM 855 N ALA A 60 1.074 46.959 -25.875 1.00 0.00 N ATOM 856 CA ALA A 60 0.893 48.328 -25.413 1.00 0.00 C ATOM 857 C ALA A 60 1.859 48.661 -24.280 1.00 0.00 C ATOM 858 O ALA A 60 1.491 49.318 -23.309 1.00 0.00 O ATOM 859 CB ALA A 60 -0.546 48.547 -24.963 1.00 0.00 C ATOM 0 H ALA A 60 1.092 46.262 -25.131 1.00 0.00 H new ATOM 0 HA ALA A 60 1.109 48.996 -26.246 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -0.668 49.574 -24.620 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -1.221 48.361 -25.799 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -0.781 47.862 -24.148 1.00 0.00 H new ATOM 865 N GLY A 61 3.099 48.199 -24.415 1.00 0.00 N ATOM 866 CA GLY A 61 4.099 48.455 -23.396 1.00 0.00 C ATOM 867 C GLY A 61 4.732 49.825 -23.536 1.00 0.00 C ATOM 868 O GLY A 61 4.253 50.681 -24.281 1.00 0.00 O ATOM 0 H GLY A 61 3.428 47.653 -25.211 1.00 0.00 H new ATOM 0 HA2 GLY A 61 3.640 48.369 -22.411 1.00 0.00 H new ATOM 0 HA3 GLY A 61 4.875 47.692 -23.453 1.00 0.00 H new ATOM 872 N PRO A 62 5.835 50.050 -22.806 1.00 0.00 N ATOM 873 CA PRO A 62 6.557 51.326 -22.834 1.00 0.00 C ATOM 874 C PRO A 62 7.270 51.557 -24.162 1.00 0.00 C ATOM 875 O PRO A 62 8.481 51.364 -24.269 1.00 0.00 O ATOM 876 CB PRO A 62 7.573 51.183 -21.699 1.00 0.00 C ATOM 877 CG PRO A 62 7.780 49.714 -21.557 1.00 0.00 C ATOM 878 CD PRO A 62 6.460 49.076 -21.896 1.00 0.00 C ATOM 0 HA PRO A 62 5.887 52.178 -22.719 1.00 0.00 H new ATOM 0 HB2 PRO A 62 8.506 51.693 -21.937 1.00 0.00 H new ATOM 0 HB3 PRO A 62 7.197 51.621 -20.774 1.00 0.00 H new ATOM 0 HG2 PRO A 62 8.566 49.364 -22.226 1.00 0.00 H new ATOM 0 HG3 PRO A 62 8.088 49.459 -20.543 1.00 0.00 H new ATOM 0 HD2 PRO A 62 6.594 48.106 -22.375 1.00 0.00 H new ATOM 0 HD3 PRO A 62 5.853 48.911 -21.006 1.00 0.00 H new ATOM 886 N HIS A 63 6.513 51.976 -25.170 1.00 0.00 N ATOM 887 CA HIS A 63 7.073 52.233 -26.492 1.00 0.00 C ATOM 888 C HIS A 63 6.296 53.338 -27.204 1.00 0.00 C ATOM 889 O HIS A 63 5.452 54.004 -26.604 1.00 0.00 O ATOM 890 CB HIS A 63 7.058 50.959 -27.335 1.00 0.00 C ATOM 891 CG HIS A 63 8.327 50.733 -28.100 1.00 0.00 C ATOM 892 ND1 HIS A 63 8.361 50.560 -29.467 1.00 0.00 N ATOM 893 CD2 HIS A 63 9.611 50.654 -27.680 1.00 0.00 C ATOM 894 CE1 HIS A 63 9.611 50.383 -29.856 1.00 0.00 C ATOM 895 NE2 HIS A 63 10.389 50.435 -28.791 1.00 0.00 N ATOM 0 H HIS A 63 5.510 52.145 -25.097 1.00 0.00 H new ATOM 0 HA HIS A 63 8.105 52.560 -26.364 1.00 0.00 H new ATOM 0 HB2 HIS A 63 6.879 50.104 -26.683 1.00 0.00 H new ATOM 0 HB3 HIS A 63 6.224 51.006 -28.036 1.00 0.00 H new ATOM 0 HD2 HIS A 63 9.959 50.746 -26.662 1.00 0.00 H new ATOM 0 HE1 HIS A 63 9.940 50.223 -30.872 1.00 0.00 H new ATOM 0 HE2 HIS A 63 11.404 50.330 -28.793 1.00 0.00 H new ATOM 903 N PHE A 64 6.587 53.527 -28.487 1.00 0.00 N ATOM 904 CA PHE A 64 5.917 54.550 -29.280 1.00 0.00 C ATOM 905 C PHE A 64 4.401 54.378 -29.224 1.00 0.00 C ATOM 906 O PHE A 64 3.839 53.516 -29.897 1.00 0.00 O ATOM 907 CB PHE A 64 6.394 54.492 -30.733 1.00 0.00 C ATOM 908 CG PHE A 64 7.774 55.047 -30.933 1.00 0.00 C ATOM 909 CD1 PHE A 64 8.020 56.403 -30.788 1.00 0.00 C ATOM 910 CD2 PHE A 64 8.829 54.212 -31.269 1.00 0.00 C ATOM 911 CE1 PHE A 64 9.289 56.917 -30.970 1.00 0.00 C ATOM 912 CE2 PHE A 64 10.101 54.721 -31.453 1.00 0.00 C ATOM 913 CZ PHE A 64 10.332 56.074 -31.304 1.00 0.00 C ATOM 0 H PHE A 64 7.283 52.985 -28.999 1.00 0.00 H new ATOM 0 HA PHE A 64 6.170 55.523 -28.859 1.00 0.00 H new ATOM 0 HB2 PHE A 64 6.375 53.456 -31.072 1.00 0.00 H new ATOM 0 HB3 PHE A 64 5.694 55.045 -31.359 1.00 0.00 H new ATOM 0 HD1 PHE A 64 7.208 57.067 -30.529 1.00 0.00 H new ATOM 0 HD2 PHE A 64 8.655 53.153 -31.388 1.00 0.00 H new ATOM 0 HE1 PHE A 64 9.466 57.976 -30.852 1.00 0.00 H new ATOM 0 HE2 PHE A 64 10.914 54.060 -31.713 1.00 0.00 H new ATOM 0 HZ PHE A 64 11.325 56.473 -31.448 1.00 0.00 H new ATOM 923 N ASN A 65 3.749 55.203 -28.414 1.00 0.00 N ATOM 924 CA ASN A 65 2.299 55.144 -28.268 1.00 0.00 C ATOM 925 C ASN A 65 1.754 56.451 -27.699 1.00 0.00 C ATOM 926 O ASN A 65 2.471 57.233 -27.075 1.00 0.00 O ATOM 927 CB ASN A 65 1.905 53.977 -27.358 1.00 0.00 C ATOM 928 CG ASN A 65 1.868 52.654 -28.102 1.00 0.00 C ATOM 929 OD1 ASN A 65 0.962 52.402 -28.896 1.00 0.00 O ATOM 930 ND2 ASN A 65 2.854 51.803 -27.842 1.00 0.00 N ATOM 0 H ASN A 65 4.201 55.921 -27.848 1.00 0.00 H new ATOM 0 HA ASN A 65 1.866 54.990 -29.256 1.00 0.00 H new ATOM 0 HB2 ASN A 65 2.613 53.908 -26.533 1.00 0.00 H new ATOM 0 HB3 ASN A 65 0.926 54.174 -26.922 1.00 0.00 H new ATOM 0 HD21 ASN A 65 2.882 50.896 -28.309 1.00 0.00 H new ATOM 0 HD22 ASN A 65 3.584 52.056 -27.176 1.00 0.00 H new ATOM 937 N PRO A 66 0.454 56.694 -27.918 1.00 0.00 N ATOM 938 CA PRO A 66 -0.218 57.905 -27.434 1.00 0.00 C ATOM 939 C PRO A 66 -0.369 57.917 -25.917 1.00 0.00 C ATOM 940 O PRO A 66 -1.455 58.169 -25.395 1.00 0.00 O ATOM 941 CB PRO A 66 -1.591 57.843 -28.110 1.00 0.00 C ATOM 942 CG PRO A 66 -1.819 56.395 -28.371 1.00 0.00 C ATOM 943 CD PRO A 66 -0.463 55.806 -28.652 1.00 0.00 C ATOM 0 HA PRO A 66 0.347 58.807 -27.669 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -2.368 58.257 -27.467 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -1.603 58.419 -29.035 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -2.284 55.912 -27.511 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -2.490 56.252 -29.218 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -0.392 54.776 -28.301 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -0.243 55.795 -29.720 1.00 0.00 H new ATOM 951 N LEU A 67 0.726 57.644 -25.217 1.00 0.00 N ATOM 952 CA LEU A 67 0.714 57.626 -23.757 1.00 0.00 C ATOM 953 C LEU A 67 2.087 57.257 -23.207 1.00 0.00 C ATOM 954 O LEU A 67 2.204 56.726 -22.102 1.00 0.00 O ATOM 955 CB LEU A 67 -0.334 56.634 -23.249 1.00 0.00 C ATOM 956 CG LEU A 67 -0.353 55.267 -23.932 1.00 0.00 C ATOM 957 CD1 LEU A 67 -0.228 54.154 -22.904 1.00 0.00 C ATOM 958 CD2 LEU A 67 -1.625 55.098 -24.753 1.00 0.00 C ATOM 0 H LEU A 67 1.632 57.432 -25.635 1.00 0.00 H new ATOM 0 HA LEU A 67 0.459 58.626 -23.407 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -0.173 56.482 -22.182 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -1.319 57.088 -23.362 1.00 0.00 H new ATOM 0 HG LEU A 67 0.501 55.208 -24.606 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.243 53.188 -23.409 1.00 0.00 H new ATOM 0 HD12 LEU A 67 0.711 54.264 -22.361 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -1.061 54.210 -22.204 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.621 54.119 -25.232 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -2.493 55.179 -24.099 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -1.672 55.875 -25.516 1.00 0.00 H new ATOM 970 N SER A 68 3.128 57.543 -23.984 1.00 0.00 N ATOM 971 CA SER A 68 4.494 57.239 -23.576 1.00 0.00 C ATOM 972 C SER A 68 5.501 57.907 -24.508 1.00 0.00 C ATOM 973 O SER A 68 6.620 57.425 -24.677 1.00 0.00 O ATOM 974 CB SER A 68 4.722 55.727 -23.561 1.00 0.00 C ATOM 975 OG SER A 68 5.692 55.367 -22.595 1.00 0.00 O ATOM 0 H SER A 68 3.050 57.985 -24.900 1.00 0.00 H new ATOM 0 HA SER A 68 4.640 57.630 -22.569 1.00 0.00 H new ATOM 0 HB2 SER A 68 3.783 55.217 -23.346 1.00 0.00 H new ATOM 0 HB3 SER A 68 5.046 55.395 -24.547 1.00 0.00 H new ATOM 0 HG SER A 68 5.818 54.395 -22.605 1.00 0.00 H new ATOM 981 N ARG A 69 5.092 59.018 -25.110 1.00 0.00 N ATOM 982 CA ARG A 69 5.956 59.753 -26.028 1.00 0.00 C ATOM 983 C ARG A 69 5.657 61.247 -25.980 1.00 0.00 C ATOM 984 O ARG A 69 6.072 62.005 -26.856 1.00 0.00 O ATOM 985 CB ARG A 69 5.780 59.232 -27.456 1.00 0.00 C ATOM 986 CG ARG A 69 4.364 59.381 -27.987 1.00 0.00 C ATOM 987 CD ARG A 69 4.142 60.751 -28.608 1.00 0.00 C ATOM 988 NE ARG A 69 2.958 60.780 -29.463 1.00 0.00 N ATOM 989 CZ ARG A 69 2.726 61.725 -30.365 1.00 0.00 C ATOM 990 NH1 ARG A 69 3.593 62.717 -30.530 1.00 0.00 N1+ ATOM 991 NH2 ARG A 69 1.626 61.684 -31.103 1.00 0.00 N ATOM 0 H ARG A 69 4.168 59.430 -24.979 1.00 0.00 H new ATOM 0 HA ARG A 69 6.989 59.598 -25.716 1.00 0.00 H new ATOM 0 HB2 ARG A 69 6.465 59.765 -28.116 1.00 0.00 H new ATOM 0 HB3 ARG A 69 6.062 58.180 -27.487 1.00 0.00 H new ATOM 0 HG2 ARG A 69 4.170 58.608 -28.730 1.00 0.00 H new ATOM 0 HG3 ARG A 69 3.652 59.229 -27.176 1.00 0.00 H new ATOM 0 HD2 ARG A 69 4.037 61.494 -27.818 1.00 0.00 H new ATOM 0 HD3 ARG A 69 5.018 61.030 -29.193 1.00 0.00 H new ATOM 0 HE ARG A 69 2.272 60.032 -29.361 1.00 0.00 H new ATOM 0 HH11 ARG A 69 4.440 62.754 -29.963 1.00 0.00 H new ATOM 0 HH12 ARG A 69 3.412 63.442 -31.224 1.00 0.00 H new ATOM 0 HH21 ARG A 69 0.956 60.925 -30.978 1.00 0.00 H new ATOM 0 HH22 ARG A 69 1.449 62.411 -31.796 1.00 0.00 H new ATOM 1005 N LYS A 70 4.933 61.667 -24.946 1.00 0.00 N ATOM 1006 CA LYS A 70 4.577 63.072 -24.781 1.00 0.00 C ATOM 1007 C LYS A 70 5.086 63.608 -23.448 1.00 0.00 C ATOM 1008 O LYS A 70 6.104 64.299 -23.394 1.00 0.00 O ATOM 1009 CB LYS A 70 3.059 63.248 -24.867 1.00 0.00 C ATOM 1010 CG LYS A 70 2.501 63.032 -26.263 1.00 0.00 C ATOM 1011 CD LYS A 70 1.855 61.664 -26.401 1.00 0.00 C ATOM 1012 CE LYS A 70 0.490 61.620 -25.730 1.00 0.00 C ATOM 1013 NZ LYS A 70 -0.613 61.845 -26.703 1.00 0.00 N1+ ATOM 0 H LYS A 70 4.582 61.054 -24.210 1.00 0.00 H new ATOM 0 HA LYS A 70 5.048 63.638 -25.585 1.00 0.00 H new ATOM 0 HB2 LYS A 70 2.581 62.549 -24.181 1.00 0.00 H new ATOM 0 HB3 LYS A 70 2.798 64.252 -24.532 1.00 0.00 H new ATOM 0 HG2 LYS A 70 1.767 63.806 -26.486 1.00 0.00 H new ATOM 0 HG3 LYS A 70 3.302 63.132 -26.995 1.00 0.00 H new ATOM 0 HD2 LYS A 70 1.750 61.415 -27.457 1.00 0.00 H new ATOM 0 HD3 LYS A 70 2.504 60.908 -25.958 1.00 0.00 H new ATOM 0 HE2 LYS A 70 0.355 60.653 -25.245 1.00 0.00 H new ATOM 0 HE3 LYS A 70 0.445 62.378 -24.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -1.526 61.807 -26.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -0.499 62.778 -27.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -0.586 61.107 -27.435 1.00 0.00 H new ATOM 1027 N HIS A 71 4.373 63.285 -22.374 1.00 0.00 N ATOM 1028 CA HIS A 71 4.755 63.734 -21.039 1.00 0.00 C ATOM 1029 C HIS A 71 5.886 62.876 -20.480 1.00 0.00 C ATOM 1030 O HIS A 71 6.523 63.234 -19.491 1.00 0.00 O ATOM 1031 CB HIS A 71 3.552 63.686 -20.099 1.00 0.00 C ATOM 1032 CG HIS A 71 2.866 65.008 -19.938 1.00 0.00 C ATOM 1033 ND1 HIS A 71 1.674 65.320 -20.559 1.00 0.00 N ATOM 1034 CD2 HIS A 71 3.208 66.102 -19.216 1.00 0.00 C ATOM 1035 CE1 HIS A 71 1.316 66.547 -20.232 1.00 0.00 C ATOM 1036 NE2 HIS A 71 2.230 67.044 -19.416 1.00 0.00 N ATOM 0 H HIS A 71 3.528 62.714 -22.401 1.00 0.00 H new ATOM 0 HA HIS A 71 5.107 64.763 -21.115 1.00 0.00 H new ATOM 0 HB2 HIS A 71 2.835 62.957 -20.477 1.00 0.00 H new ATOM 0 HB3 HIS A 71 3.879 63.334 -19.121 1.00 0.00 H new ATOM 0 HD2 HIS A 71 4.087 66.212 -18.598 1.00 0.00 H new ATOM 0 HE1 HIS A 71 0.428 67.058 -20.573 1.00 0.00 H new ATOM 0 HE2 HIS A 71 2.211 67.976 -19.002 1.00 0.00 H new ATOM 1044 N GLY A 72 6.132 61.738 -21.122 1.00 0.00 N ATOM 1045 CA GLY A 72 7.186 60.846 -20.674 1.00 0.00 C ATOM 1046 C GLY A 72 8.175 60.517 -21.775 1.00 0.00 C ATOM 1047 O GLY A 72 9.218 59.918 -21.524 1.00 0.00 O ATOM 0 H GLY A 72 5.620 61.418 -21.944 1.00 0.00 H new ATOM 0 HA2 GLY A 72 7.716 61.305 -19.839 1.00 0.00 H new ATOM 0 HA3 GLY A 72 6.742 59.923 -20.301 1.00 0.00 H new ATOM 1051 N GLY A 73 7.844 60.909 -23.003 1.00 0.00 N ATOM 1052 CA GLY A 73 8.719 60.641 -24.128 1.00 0.00 C ATOM 1053 C GLY A 73 10.154 61.046 -23.854 1.00 0.00 C ATOM 1054 O GLY A 73 11.039 60.204 -23.692 1.00 0.00 O ATOM 0 H GLY A 73 6.985 61.407 -23.237 1.00 0.00 H new ATOM 0 HA2 GLY A 73 8.684 59.578 -24.367 1.00 0.00 H new ATOM 0 HA3 GLY A 73 8.354 61.177 -25.004 1.00 0.00 H new ATOM 1058 N PRO A 74 10.403 62.362 -23.802 1.00 0.00 N ATOM 1059 CA PRO A 74 11.741 62.908 -23.547 1.00 0.00 C ATOM 1060 C PRO A 74 12.202 62.664 -22.114 1.00 0.00 C ATOM 1061 O PRO A 74 11.559 61.935 -21.359 1.00 0.00 O ATOM 1062 CB PRO A 74 11.569 64.404 -23.807 1.00 0.00 C ATOM 1063 CG PRO A 74 10.124 64.669 -23.562 1.00 0.00 C ATOM 1064 CD PRO A 74 9.397 63.421 -23.986 1.00 0.00 C ATOM 0 HA PRO A 74 12.500 62.438 -24.173 1.00 0.00 H new ATOM 0 HB2 PRO A 74 12.198 64.996 -23.142 1.00 0.00 H new ATOM 0 HB3 PRO A 74 11.851 64.663 -24.827 1.00 0.00 H new ATOM 0 HG2 PRO A 74 9.940 64.890 -22.510 1.00 0.00 H new ATOM 0 HG3 PRO A 74 9.783 65.533 -24.133 1.00 0.00 H new ATOM 0 HD2 PRO A 74 8.511 63.245 -23.375 1.00 0.00 H new ATOM 0 HD3 PRO A 74 9.063 63.483 -25.022 1.00 0.00 H new ATOM 1072 N LYS A 75 13.323 63.276 -21.747 1.00 0.00 N ATOM 1073 CA LYS A 75 13.870 63.126 -20.403 1.00 0.00 C ATOM 1074 C LYS A 75 14.328 61.693 -20.158 1.00 0.00 C ATOM 1075 O LYS A 75 13.771 60.749 -20.720 1.00 0.00 O ATOM 1076 CB LYS A 75 12.828 63.527 -19.357 1.00 0.00 C ATOM 1077 CG LYS A 75 13.262 64.686 -18.476 1.00 0.00 C ATOM 1078 CD LYS A 75 14.528 64.354 -17.704 1.00 0.00 C ATOM 1079 CE LYS A 75 14.578 65.090 -16.374 1.00 0.00 C ATOM 1080 NZ LYS A 75 14.420 64.160 -15.222 1.00 0.00 N1+ ATOM 0 H LYS A 75 13.870 63.880 -22.360 1.00 0.00 H new ATOM 0 HA LYS A 75 14.734 63.784 -20.315 1.00 0.00 H new ATOM 0 HB2 LYS A 75 11.901 63.795 -19.864 1.00 0.00 H new ATOM 0 HB3 LYS A 75 12.609 62.665 -18.727 1.00 0.00 H new ATOM 0 HG2 LYS A 75 13.431 65.569 -19.092 1.00 0.00 H new ATOM 0 HG3 LYS A 75 12.463 64.933 -17.777 1.00 0.00 H new ATOM 0 HD2 LYS A 75 14.577 63.279 -17.529 1.00 0.00 H new ATOM 0 HD3 LYS A 75 15.400 64.620 -18.301 1.00 0.00 H new ATOM 0 HE2 LYS A 75 15.527 65.619 -16.287 1.00 0.00 H new ATOM 0 HE3 LYS A 75 13.790 65.842 -16.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 14.459 64.699 -14.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 13.503 63.674 -15.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 15.187 63.457 -15.235 1.00 0.00 H new ATOM 1094 N ASP A 76 15.343 61.537 -19.316 1.00 0.00 N ATOM 1095 CA ASP A 76 15.874 60.217 -18.994 1.00 0.00 C ATOM 1096 C ASP A 76 16.274 59.468 -20.263 1.00 0.00 C ATOM 1097 O ASP A 76 16.156 58.247 -20.334 1.00 0.00 O ATOM 1098 CB ASP A 76 14.839 59.404 -18.213 1.00 0.00 C ATOM 1099 CG ASP A 76 14.592 59.965 -16.824 1.00 0.00 C ATOM 1100 OD1 ASP A 76 15.567 60.406 -16.181 1.00 0.00 O ATOM 1101 OD2 ASP A 76 13.425 59.957 -16.381 1.00 0.00 O1- ATOM 0 H ASP A 76 15.815 62.308 -18.844 1.00 0.00 H new ATOM 0 HA ASP A 76 16.762 60.350 -18.376 1.00 0.00 H new ATOM 0 HB2 ASP A 76 13.901 59.387 -18.767 1.00 0.00 H new ATOM 0 HB3 ASP A 76 15.179 58.372 -18.130 1.00 0.00 H new ATOM 1106 N GLU A 77 16.747 60.211 -21.256 1.00 0.00 N ATOM 1107 CA GLU A 77 17.162 59.618 -22.521 1.00 0.00 C ATOM 1108 C GLU A 77 17.819 60.660 -23.422 1.00 0.00 C ATOM 1109 O GLU A 77 18.816 60.380 -24.088 1.00 0.00 O ATOM 1110 CB GLU A 77 15.963 58.995 -23.237 1.00 0.00 C ATOM 1111 CG GLU A 77 14.929 60.010 -23.693 1.00 0.00 C ATOM 1112 CD GLU A 77 13.667 59.362 -24.223 1.00 0.00 C ATOM 1113 OE1 GLU A 77 13.046 58.571 -23.479 1.00 0.00 O ATOM 1114 OE2 GLU A 77 13.297 59.642 -25.383 1.00 0.00 O1- ATOM 0 H GLU A 77 16.853 61.224 -21.210 1.00 0.00 H new ATOM 0 HA GLU A 77 17.892 58.838 -22.303 1.00 0.00 H new ATOM 0 HB2 GLU A 77 16.318 58.437 -24.103 1.00 0.00 H new ATOM 0 HB3 GLU A 77 15.485 58.278 -22.570 1.00 0.00 H new ATOM 0 HG2 GLU A 77 14.674 60.663 -22.858 1.00 0.00 H new ATOM 0 HG3 GLU A 77 15.363 60.640 -24.470 1.00 0.00 H new ATOM 1121 N GLU A 78 17.254 61.864 -23.435 1.00 0.00 N ATOM 1122 CA GLU A 78 17.784 62.947 -24.255 1.00 0.00 C ATOM 1123 C GLU A 78 18.579 63.933 -23.406 1.00 0.00 C ATOM 1124 O GLU A 78 19.758 64.181 -23.662 1.00 0.00 O ATOM 1125 CB GLU A 78 16.647 63.676 -24.972 1.00 0.00 C ATOM 1126 CG GLU A 78 15.807 62.773 -25.859 1.00 0.00 C ATOM 1127 CD GLU A 78 15.262 63.493 -27.077 1.00 0.00 C ATOM 1128 OE1 GLU A 78 15.247 64.741 -27.071 1.00 0.00 O ATOM 1129 OE2 GLU A 78 14.851 62.807 -28.036 1.00 0.00 O1- ATOM 0 H GLU A 78 16.430 62.113 -22.887 1.00 0.00 H new ATOM 0 HA GLU A 78 18.453 62.512 -24.998 1.00 0.00 H new ATOM 0 HB2 GLU A 78 16.001 64.143 -24.229 1.00 0.00 H new ATOM 0 HB3 GLU A 78 17.067 64.478 -25.579 1.00 0.00 H new ATOM 0 HG2 GLU A 78 16.411 61.925 -26.183 1.00 0.00 H new ATOM 0 HG3 GLU A 78 14.977 62.370 -25.278 1.00 0.00 H new ATOM 1136 N ARG A 79 17.927 64.492 -22.392 1.00 0.00 N ATOM 1137 CA ARG A 79 18.573 65.452 -21.503 1.00 0.00 C ATOM 1138 C ARG A 79 19.285 64.740 -20.359 1.00 0.00 C ATOM 1139 O ARG A 79 19.824 65.380 -19.455 1.00 0.00 O ATOM 1140 CB ARG A 79 17.541 66.435 -20.945 1.00 0.00 C ATOM 1141 CG ARG A 79 18.070 67.851 -20.791 1.00 0.00 C ATOM 1142 CD ARG A 79 18.197 68.246 -19.328 1.00 0.00 C ATOM 1143 NE ARG A 79 19.356 69.100 -19.090 1.00 0.00 N ATOM 1144 CZ ARG A 79 19.527 69.813 -17.982 1.00 0.00 C ATOM 1145 NH1 ARG A 79 18.621 69.772 -17.016 1.00 0.00 N1+ ATOM 1146 NH2 ARG A 79 20.610 70.568 -17.839 1.00 0.00 N ATOM 0 H ARG A 79 16.952 64.297 -22.165 1.00 0.00 H new ATOM 0 HA ARG A 79 19.315 66.003 -22.081 1.00 0.00 H new ATOM 0 HB2 ARG A 79 16.673 66.450 -21.604 1.00 0.00 H new ATOM 0 HB3 ARG A 79 17.198 66.077 -19.974 1.00 0.00 H new ATOM 0 HG2 ARG A 79 19.043 67.931 -21.276 1.00 0.00 H new ATOM 0 HG3 ARG A 79 17.402 68.547 -21.299 1.00 0.00 H new ATOM 0 HD2 ARG A 79 17.293 68.767 -19.013 1.00 0.00 H new ATOM 0 HD3 ARG A 79 18.277 67.348 -18.716 1.00 0.00 H new ATOM 0 HE ARG A 79 20.073 69.152 -19.813 1.00 0.00 H new ATOM 0 HH11 ARG A 79 17.789 69.192 -17.122 1.00 0.00 H new ATOM 0 HH12 ARG A 79 18.756 70.321 -16.167 1.00 0.00 H new ATOM 0 HH21 ARG A 79 21.310 70.601 -18.580 1.00 0.00 H new ATOM 0 HH22 ARG A 79 20.741 71.115 -16.988 1.00 0.00 H new ATOM 1160 N HIS A 80 19.284 63.412 -20.403 1.00 0.00 N ATOM 1161 CA HIS A 80 19.932 62.612 -19.368 1.00 0.00 C ATOM 1162 C HIS A 80 21.349 62.230 -19.785 1.00 0.00 C ATOM 1163 O HIS A 80 22.174 61.855 -18.950 1.00 0.00 O ATOM 1164 CB HIS A 80 19.116 61.351 -19.083 1.00 0.00 C ATOM 1165 CG HIS A 80 19.172 60.913 -17.652 1.00 0.00 C ATOM 1166 ND1 HIS A 80 18.640 61.652 -16.617 1.00 0.00 N ATOM 1167 CD2 HIS A 80 19.699 59.801 -17.086 1.00 0.00 C ATOM 1168 CE1 HIS A 80 18.840 61.018 -15.477 1.00 0.00 C ATOM 1169 NE2 HIS A 80 19.479 59.891 -15.732 1.00 0.00 N ATOM 0 H HIS A 80 18.842 62.867 -21.143 1.00 0.00 H new ATOM 0 HA HIS A 80 19.988 63.213 -18.460 1.00 0.00 H new ATOM 0 HB2 HIS A 80 18.077 61.530 -19.359 1.00 0.00 H new ATOM 0 HB3 HIS A 80 19.479 60.542 -19.717 1.00 0.00 H new ATOM 0 HD2 HIS A 80 20.199 58.994 -17.602 1.00 0.00 H new ATOM 0 HE1 HIS A 80 18.533 61.363 -14.501 1.00 0.00 H new ATOM 0 HE2 HIS A 80 19.763 59.200 -15.038 1.00 0.00 H new ATOM 1177 N VAL A 81 21.628 62.328 -21.080 1.00 0.00 N ATOM 1178 CA VAL A 81 22.946 61.995 -21.608 1.00 0.00 C ATOM 1179 C VAL A 81 23.376 62.986 -22.681 1.00 0.00 C ATOM 1180 O VAL A 81 24.561 63.293 -22.819 1.00 0.00 O ATOM 1181 CB VAL A 81 22.968 60.572 -22.200 1.00 0.00 C ATOM 1182 CG1 VAL A 81 24.387 60.176 -22.581 1.00 0.00 C ATOM 1183 CG2 VAL A 81 22.374 59.576 -21.216 1.00 0.00 C ATOM 0 H VAL A 81 20.958 62.636 -21.785 1.00 0.00 H new ATOM 0 HA VAL A 81 23.644 62.046 -20.772 1.00 0.00 H new ATOM 0 HB VAL A 81 22.358 60.563 -23.103 1.00 0.00 H new ATOM 0 HG11 VAL A 81 24.384 59.169 -22.997 1.00 0.00 H new ATOM 0 HG12 VAL A 81 24.773 60.874 -23.324 1.00 0.00 H new ATOM 0 HG13 VAL A 81 25.022 60.201 -21.695 1.00 0.00 H new ATOM 0 HG21 VAL A 81 22.398 58.577 -21.651 1.00 0.00 H new ATOM 0 HG22 VAL A 81 22.955 59.585 -20.294 1.00 0.00 H new ATOM 0 HG23 VAL A 81 21.343 59.852 -20.997 1.00 0.00 H new ATOM 1193 N GLY A 82 22.406 63.490 -23.439 1.00 0.00 N ATOM 1194 CA GLY A 82 22.706 64.443 -24.491 1.00 0.00 C ATOM 1195 C GLY A 82 22.939 63.775 -25.830 1.00 0.00 C ATOM 1196 O GLY A 82 22.783 64.400 -26.879 1.00 0.00 O ATOM 0 H GLY A 82 21.418 63.255 -23.343 1.00 0.00 H new ATOM 0 HA2 GLY A 82 21.883 65.151 -24.581 1.00 0.00 H new ATOM 0 HA3 GLY A 82 23.591 65.016 -24.216 1.00 0.00 H new ATOM 1200 N ASP A 83 23.317 62.501 -25.797 1.00 0.00 N ATOM 1201 CA ASP A 83 23.574 61.747 -27.018 1.00 0.00 C ATOM 1202 C ASP A 83 22.272 61.228 -27.620 1.00 0.00 C ATOM 1203 O ASP A 83 22.221 60.117 -28.151 1.00 0.00 O ATOM 1204 CB ASP A 83 24.519 60.581 -26.734 1.00 0.00 C ATOM 1205 CG ASP A 83 25.669 60.977 -25.827 1.00 0.00 C ATOM 1206 OD1 ASP A 83 26.046 62.167 -25.831 1.00 0.00 O ATOM 1207 OD2 ASP A 83 26.194 60.095 -25.113 1.00 0.00 O1- ATOM 0 H ASP A 83 23.452 61.969 -24.937 1.00 0.00 H new ATOM 0 HA ASP A 83 24.044 62.418 -27.737 1.00 0.00 H new ATOM 0 HB2 ASP A 83 23.959 59.767 -26.273 1.00 0.00 H new ATOM 0 HB3 ASP A 83 24.916 60.201 -27.675 1.00 0.00 H new ATOM 1212 N LEU A 84 21.221 62.035 -27.530 1.00 0.00 N ATOM 1213 CA LEU A 84 19.917 61.657 -28.065 1.00 0.00 C ATOM 1214 C LEU A 84 18.998 62.869 -28.168 1.00 0.00 C ATOM 1215 O LEU A 84 17.780 62.748 -28.049 1.00 0.00 O ATOM 1216 CB LEU A 84 19.274 60.586 -27.183 1.00 0.00 C ATOM 1217 CG LEU A 84 18.071 59.855 -27.783 1.00 0.00 C ATOM 1218 CD1 LEU A 84 18.522 58.613 -28.535 1.00 0.00 C ATOM 1219 CD2 LEU A 84 17.072 59.487 -26.695 1.00 0.00 C ATOM 0 H LEU A 84 21.246 62.956 -27.092 1.00 0.00 H new ATOM 0 HA LEU A 84 20.065 61.253 -29.066 1.00 0.00 H new ATOM 0 HB2 LEU A 84 20.034 59.847 -26.931 1.00 0.00 H new ATOM 0 HB3 LEU A 84 18.961 61.053 -26.249 1.00 0.00 H new ATOM 0 HG LEU A 84 17.579 60.525 -28.489 1.00 0.00 H new ATOM 0 HD11 LEU A 84 17.653 58.106 -28.955 1.00 0.00 H new ATOM 0 HD12 LEU A 84 19.198 58.901 -29.340 1.00 0.00 H new ATOM 0 HD13 LEU A 84 19.039 57.941 -27.850 1.00 0.00 H new ATOM 0 HD21 LEU A 84 16.223 58.968 -27.141 1.00 0.00 H new ATOM 0 HD22 LEU A 84 17.553 58.836 -25.965 1.00 0.00 H new ATOM 0 HD23 LEU A 84 16.724 60.393 -26.199 1.00 0.00 H new ATOM 1231 N GLY A 85 19.590 64.038 -28.392 1.00 0.00 N ATOM 1232 CA GLY A 85 18.809 65.256 -28.508 1.00 0.00 C ATOM 1233 C GLY A 85 19.619 66.496 -28.191 1.00 0.00 C ATOM 1234 O GLY A 85 19.157 67.618 -28.401 1.00 0.00 O ATOM 0 H GLY A 85 20.597 64.164 -28.495 1.00 0.00 H new ATOM 0 HA2 GLY A 85 18.412 65.334 -29.520 1.00 0.00 H new ATOM 0 HA3 GLY A 85 17.955 65.202 -27.833 1.00 0.00 H new ATOM 1238 N ASN A 86 20.829 66.297 -27.682 1.00 0.00 N ATOM 1239 CA ASN A 86 21.705 67.410 -27.333 1.00 0.00 C ATOM 1240 C ASN A 86 22.912 67.467 -28.266 1.00 0.00 C ATOM 1241 O ASN A 86 23.400 68.547 -28.601 1.00 0.00 O ATOM 1242 CB ASN A 86 22.173 67.282 -25.882 1.00 0.00 C ATOM 1243 CG ASN A 86 22.560 68.618 -25.279 1.00 0.00 C ATOM 1244 OD1 ASN A 86 23.736 68.879 -25.026 1.00 0.00 O ATOM 1245 ND2 ASN A 86 21.570 69.471 -25.046 1.00 0.00 N ATOM 0 H ASN A 86 21.226 65.375 -27.502 1.00 0.00 H new ATOM 0 HA ASN A 86 21.138 68.334 -27.445 1.00 0.00 H new ATOM 0 HB2 ASN A 86 21.379 66.834 -25.285 1.00 0.00 H new ATOM 0 HB3 ASN A 86 23.026 66.605 -25.837 1.00 0.00 H new ATOM 0 HD21 ASN A 86 21.770 70.386 -24.641 1.00 0.00 H new ATOM 0 HD22 ASN A 86 20.610 69.212 -25.272 1.00 0.00 H new ATOM 1252 N VAL A 87 23.386 66.297 -28.681 1.00 0.00 N ATOM 1253 CA VAL A 87 24.534 66.213 -29.576 1.00 0.00 C ATOM 1254 C VAL A 87 24.116 65.739 -30.964 1.00 0.00 C ATOM 1255 O VAL A 87 24.952 65.345 -31.776 1.00 0.00 O ATOM 1256 CB VAL A 87 25.610 65.259 -29.022 1.00 0.00 C ATOM 1257 CG1 VAL A 87 25.285 63.819 -29.389 1.00 0.00 C ATOM 1258 CG2 VAL A 87 26.986 65.652 -29.539 1.00 0.00 C ATOM 0 H VAL A 87 22.993 65.395 -28.412 1.00 0.00 H new ATOM 0 HA VAL A 87 24.952 67.217 -29.649 1.00 0.00 H new ATOM 0 HB VAL A 87 25.619 65.339 -27.935 1.00 0.00 H new ATOM 0 HG11 VAL A 87 26.055 63.159 -28.990 1.00 0.00 H new ATOM 0 HG12 VAL A 87 24.318 63.545 -28.967 1.00 0.00 H new ATOM 0 HG13 VAL A 87 25.248 63.719 -30.474 1.00 0.00 H new ATOM 0 HG21 VAL A 87 27.734 64.968 -29.138 1.00 0.00 H new ATOM 0 HG22 VAL A 87 26.994 65.601 -30.628 1.00 0.00 H new ATOM 0 HG23 VAL A 87 27.217 66.669 -29.222 1.00 0.00 H new ATOM 1268 N THR A 88 22.814 65.780 -31.230 1.00 0.00 N ATOM 1269 CA THR A 88 22.283 65.355 -32.518 1.00 0.00 C ATOM 1270 C THR A 88 21.169 66.284 -32.989 1.00 0.00 C ATOM 1271 O THR A 88 21.135 66.691 -34.147 1.00 0.00 O ATOM 1272 CB THR A 88 21.742 63.914 -32.455 1.00 0.00 C ATOM 1273 OG1 THR A 88 20.747 63.720 -33.466 1.00 0.00 O ATOM 1274 CG2 THR A 88 21.146 63.620 -31.086 1.00 0.00 C ATOM 0 H THR A 88 22.108 66.104 -30.569 1.00 0.00 H new ATOM 0 HA THR A 88 23.109 65.395 -33.228 1.00 0.00 H new ATOM 0 HB THR A 88 22.572 63.229 -32.627 1.00 0.00 H new ATOM 0 HG1 THR A 88 20.409 62.801 -33.420 1.00 0.00 H new ATOM 0 HG21 THR A 88 20.770 62.597 -31.065 1.00 0.00 H new ATOM 0 HG22 THR A 88 21.914 63.741 -30.322 1.00 0.00 H new ATOM 0 HG23 THR A 88 20.327 64.312 -30.890 1.00 0.00 H new ATOM 1282 N ALA A 89 20.258 66.618 -32.078 1.00 0.00 N ATOM 1283 CA ALA A 89 19.146 67.501 -32.398 1.00 0.00 C ATOM 1284 C ALA A 89 19.630 68.757 -33.114 1.00 0.00 C ATOM 1285 O ALA A 89 18.923 69.320 -33.950 1.00 0.00 O ATOM 1286 CB ALA A 89 18.384 67.871 -31.134 1.00 0.00 C ATOM 0 H ALA A 89 20.271 66.289 -31.113 1.00 0.00 H new ATOM 0 HA ALA A 89 18.474 66.968 -33.071 1.00 0.00 H new ATOM 0 HB1 ALA A 89 17.555 68.532 -31.389 1.00 0.00 H new ATOM 0 HB2 ALA A 89 17.996 66.967 -30.665 1.00 0.00 H new ATOM 0 HB3 ALA A 89 19.054 68.380 -30.441 1.00 0.00 H new ATOM 1292 N ASP A 90 20.842 69.193 -32.780 1.00 0.00 N ATOM 1293 CA ASP A 90 21.419 70.384 -33.390 1.00 0.00 C ATOM 1294 C ASP A 90 22.788 70.075 -33.990 1.00 0.00 C ATOM 1295 O ASP A 90 23.623 70.967 -34.149 1.00 0.00 O ATOM 1296 CB ASP A 90 21.542 71.505 -32.358 1.00 0.00 C ATOM 1297 CG ASP A 90 20.225 72.215 -32.114 1.00 0.00 C ATOM 1298 OD1 ASP A 90 19.436 71.728 -31.278 1.00 0.00 O ATOM 1299 OD2 ASP A 90 19.984 73.256 -32.759 1.00 0.00 O1- ATOM 0 H ASP A 90 21.442 68.739 -32.091 1.00 0.00 H new ATOM 0 HA ASP A 90 20.755 70.711 -34.190 1.00 0.00 H new ATOM 0 HB2 ASP A 90 21.908 71.091 -31.418 1.00 0.00 H new ATOM 0 HB3 ASP A 90 22.284 72.228 -32.698 1.00 0.00 H new ATOM 1304 N LYS A 91 23.013 68.808 -34.318 1.00 0.00 N ATOM 1305 CA LYS A 91 24.280 68.380 -34.899 1.00 0.00 C ATOM 1306 C LYS A 91 24.050 67.384 -36.033 1.00 0.00 C ATOM 1307 O LYS A 91 24.511 67.590 -37.155 1.00 0.00 O ATOM 1308 CB LYS A 91 25.170 67.751 -33.826 1.00 0.00 C ATOM 1309 CG LYS A 91 26.402 67.059 -34.387 1.00 0.00 C ATOM 1310 CD LYS A 91 27.333 68.047 -35.071 1.00 0.00 C ATOM 1311 CE LYS A 91 28.203 67.360 -36.114 1.00 0.00 C ATOM 1312 NZ LYS A 91 29.633 67.754 -35.987 1.00 0.00 N1+ ATOM 0 H LYS A 91 22.333 68.058 -34.191 1.00 0.00 H new ATOM 0 HA LYS A 91 24.779 69.259 -35.307 1.00 0.00 H new ATOM 0 HB2 LYS A 91 25.485 68.526 -33.127 1.00 0.00 H new ATOM 0 HB3 LYS A 91 24.584 67.028 -33.258 1.00 0.00 H new ATOM 0 HG2 LYS A 91 26.935 66.553 -33.582 1.00 0.00 H new ATOM 0 HG3 LYS A 91 26.097 66.292 -35.099 1.00 0.00 H new ATOM 0 HD2 LYS A 91 26.746 68.834 -35.545 1.00 0.00 H new ATOM 0 HD3 LYS A 91 27.967 68.528 -34.326 1.00 0.00 H new ATOM 0 HE2 LYS A 91 28.113 66.279 -36.008 1.00 0.00 H new ATOM 0 HE3 LYS A 91 27.843 67.613 -37.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 30.194 67.266 -36.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 29.722 68.782 -36.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 29.984 67.490 -35.044 1.00 0.00 H new ATOM 1326 N ASP A 92 23.333 66.308 -35.731 1.00 0.00 N ATOM 1327 CA ASP A 92 23.039 65.281 -36.724 1.00 0.00 C ATOM 1328 C ASP A 92 21.910 65.727 -37.650 1.00 0.00 C ATOM 1329 O ASP A 92 22.045 65.690 -38.872 1.00 0.00 O ATOM 1330 CB ASP A 92 22.664 63.967 -36.037 1.00 0.00 C ATOM 1331 CG ASP A 92 23.762 63.459 -35.124 1.00 0.00 C ATOM 1332 OD1 ASP A 92 24.814 64.126 -35.030 1.00 0.00 O ATOM 1333 OD2 ASP A 92 23.570 62.393 -34.505 1.00 0.00 O1- ATOM 0 H ASP A 92 22.944 66.124 -34.806 1.00 0.00 H new ATOM 0 HA ASP A 92 23.936 65.124 -37.323 1.00 0.00 H new ATOM 0 HB2 ASP A 92 21.751 64.110 -35.459 1.00 0.00 H new ATOM 0 HB3 ASP A 92 22.447 63.213 -36.794 1.00 0.00 H new ATOM 1338 N GLY A 93 20.798 66.147 -37.055 1.00 0.00 N ATOM 1339 CA GLY A 93 19.662 66.593 -37.840 1.00 0.00 C ATOM 1340 C GLY A 93 19.667 68.091 -38.072 1.00 0.00 C ATOM 1341 O GLY A 93 18.631 68.685 -38.368 1.00 0.00 O ATOM 0 H GLY A 93 20.664 66.186 -36.045 1.00 0.00 H new ATOM 0 HA2 GLY A 93 19.666 66.080 -38.802 1.00 0.00 H new ATOM 0 HA3 GLY A 93 18.740 66.311 -37.331 1.00 0.00 H new ATOM 1345 N VAL A 94 20.839 68.705 -37.933 1.00 0.00 N ATOM 1346 CA VAL A 94 20.976 70.143 -38.129 1.00 0.00 C ATOM 1347 C VAL A 94 22.341 70.492 -38.709 1.00 0.00 C ATOM 1348 O VAL A 94 22.460 71.385 -39.548 1.00 0.00 O ATOM 1349 CB VAL A 94 20.780 70.909 -36.807 1.00 0.00 C ATOM 1350 CG1 VAL A 94 21.215 72.360 -36.961 1.00 0.00 C ATOM 1351 CG2 VAL A 94 19.334 70.822 -36.348 1.00 0.00 C ATOM 0 H VAL A 94 21.706 68.228 -37.686 1.00 0.00 H new ATOM 0 HA VAL A 94 20.200 70.442 -38.833 1.00 0.00 H new ATOM 0 HB VAL A 94 21.406 70.446 -36.044 1.00 0.00 H new ATOM 0 HG11 VAL A 94 21.069 72.886 -36.017 1.00 0.00 H new ATOM 0 HG12 VAL A 94 22.269 72.397 -37.238 1.00 0.00 H new ATOM 0 HG13 VAL A 94 20.619 72.838 -37.738 1.00 0.00 H new ATOM 0 HG21 VAL A 94 19.216 71.369 -35.413 1.00 0.00 H new ATOM 0 HG22 VAL A 94 18.684 71.257 -37.108 1.00 0.00 H new ATOM 0 HG23 VAL A 94 19.063 69.777 -36.194 1.00 0.00 H new ATOM 1361 N ALA A 95 23.369 69.780 -38.259 1.00 0.00 N ATOM 1362 CA ALA A 95 24.727 70.013 -38.736 1.00 0.00 C ATOM 1363 C ALA A 95 25.272 68.786 -39.461 1.00 0.00 C ATOM 1364 O ALA A 95 26.479 68.551 -39.480 1.00 0.00 O ATOM 1365 CB ALA A 95 25.636 70.390 -37.575 1.00 0.00 C ATOM 0 H ALA A 95 23.287 69.037 -37.565 1.00 0.00 H new ATOM 0 HA ALA A 95 24.700 70.840 -39.446 1.00 0.00 H new ATOM 0 HB1 ALA A 95 26.647 70.561 -37.945 1.00 0.00 H new ATOM 0 HB2 ALA A 95 25.264 71.299 -37.102 1.00 0.00 H new ATOM 0 HB3 ALA A 95 25.649 69.580 -36.845 1.00 0.00 H new ATOM 1371 N ASP A 96 24.371 68.007 -40.055 1.00 0.00 N ATOM 1372 CA ASP A 96 24.763 66.806 -40.779 1.00 0.00 C ATOM 1373 C ASP A 96 23.680 66.394 -41.773 1.00 0.00 C ATOM 1374 O ASP A 96 23.976 65.888 -42.856 1.00 0.00 O ATOM 1375 CB ASP A 96 25.038 65.662 -39.804 1.00 0.00 C ATOM 1376 CG ASP A 96 26.462 65.146 -39.902 1.00 0.00 C ATOM 1377 OD1 ASP A 96 27.013 65.139 -41.022 1.00 0.00 O ATOM 1378 OD2 ASP A 96 27.021 64.749 -38.859 1.00 0.00 O1- ATOM 0 H ASP A 96 23.367 68.188 -40.048 1.00 0.00 H new ATOM 0 HA ASP A 96 25.676 67.027 -41.332 1.00 0.00 H new ATOM 0 HB2 ASP A 96 24.847 66.002 -38.786 1.00 0.00 H new ATOM 0 HB3 ASP A 96 24.344 64.845 -40.002 1.00 0.00 H new ATOM 1383 N VAL A 97 22.426 66.616 -41.398 1.00 0.00 N ATOM 1384 CA VAL A 97 21.298 66.269 -42.254 1.00 0.00 C ATOM 1385 C VAL A 97 20.369 67.462 -42.449 1.00 0.00 C ATOM 1386 O VAL A 97 19.230 67.308 -42.892 1.00 0.00 O ATOM 1387 CB VAL A 97 20.490 65.091 -41.673 1.00 0.00 C ATOM 1388 CG1 VAL A 97 19.511 64.554 -42.704 1.00 0.00 C ATOM 1389 CG2 VAL A 97 21.426 63.993 -41.190 1.00 0.00 C ATOM 0 H VAL A 97 22.164 67.035 -40.506 1.00 0.00 H new ATOM 0 HA VAL A 97 21.713 65.973 -43.218 1.00 0.00 H new ATOM 0 HB VAL A 97 19.917 65.451 -40.819 1.00 0.00 H new ATOM 0 HG11 VAL A 97 18.950 63.723 -42.275 1.00 0.00 H new ATOM 0 HG12 VAL A 97 18.821 65.345 -42.997 1.00 0.00 H new ATOM 0 HG13 VAL A 97 20.059 64.208 -43.580 1.00 0.00 H new ATOM 0 HG21 VAL A 97 20.840 63.169 -40.783 1.00 0.00 H new ATOM 0 HG22 VAL A 97 22.027 63.633 -42.025 1.00 0.00 H new ATOM 0 HG23 VAL A 97 22.082 64.389 -40.415 1.00 0.00 H new ATOM 1399 N SER A 98 20.860 68.650 -42.114 1.00 0.00 N ATOM 1400 CA SER A 98 20.071 69.869 -42.250 1.00 0.00 C ATOM 1401 C SER A 98 20.964 71.104 -42.165 1.00 0.00 C ATOM 1402 O SER A 98 20.508 72.188 -41.794 1.00 0.00 O ATOM 1403 CB SER A 98 18.995 69.928 -41.164 1.00 0.00 C ATOM 1404 OG SER A 98 17.708 70.091 -41.733 1.00 0.00 O ATOM 0 H SER A 98 21.800 68.795 -41.746 1.00 0.00 H new ATOM 0 HA SER A 98 19.590 69.856 -43.228 1.00 0.00 H new ATOM 0 HB2 SER A 98 19.021 69.014 -40.571 1.00 0.00 H new ATOM 0 HB3 SER A 98 19.204 70.755 -40.485 1.00 0.00 H new ATOM 0 HG SER A 98 17.037 70.124 -41.020 1.00 0.00 H new ATOM 1410 N ILE A 99 22.235 70.933 -42.510 1.00 0.00 N ATOM 1411 CA ILE A 99 23.190 72.033 -42.474 1.00 0.00 C ATOM 1412 C ILE A 99 22.725 73.195 -43.346 1.00 0.00 C ATOM 1413 O ILE A 99 22.859 74.359 -42.969 1.00 0.00 O ATOM 1414 CB ILE A 99 24.588 71.582 -42.942 1.00 0.00 C ATOM 1415 CG1 ILE A 99 24.995 70.292 -42.227 1.00 0.00 C ATOM 1416 CG2 ILE A 99 25.610 72.680 -42.691 1.00 0.00 C ATOM 1417 CD1 ILE A 99 25.051 69.088 -43.140 1.00 0.00 C ATOM 0 H ILE A 99 22.627 70.043 -42.818 1.00 0.00 H new ATOM 0 HA ILE A 99 23.252 72.362 -41.437 1.00 0.00 H new ATOM 0 HB ILE A 99 24.552 71.386 -44.014 1.00 0.00 H new ATOM 0 HG12 ILE A 99 25.972 70.434 -41.766 1.00 0.00 H new ATOM 0 HG13 ILE A 99 24.288 70.094 -41.421 1.00 0.00 H new ATOM 0 HG21 ILE A 99 26.592 72.347 -43.027 1.00 0.00 H new ATOM 0 HG22 ILE A 99 25.324 73.576 -43.241 1.00 0.00 H new ATOM 0 HG23 ILE A 99 25.648 72.905 -41.625 1.00 0.00 H new ATOM 0 HD11 ILE A 99 25.346 68.210 -42.566 1.00 0.00 H new ATOM 0 HD12 ILE A 99 24.069 68.920 -43.581 1.00 0.00 H new ATOM 0 HD13 ILE A 99 25.779 69.265 -43.932 1.00 0.00 H new ATOM 1429 N GLU A 100 22.178 72.868 -44.512 1.00 0.00 N ATOM 1430 CA GLU A 100 21.691 73.886 -45.438 1.00 0.00 C ATOM 1431 C GLU A 100 20.424 74.546 -44.903 1.00 0.00 C ATOM 1432 O GLU A 100 20.240 75.757 -45.035 1.00 0.00 O ATOM 1433 CB GLU A 100 21.417 73.269 -46.811 1.00 0.00 C ATOM 1434 CG GLU A 100 22.423 72.202 -47.211 1.00 0.00 C ATOM 1435 CD GLU A 100 21.941 70.797 -46.899 1.00 0.00 C ATOM 1436 OE1 GLU A 100 20.772 70.487 -47.210 1.00 0.00 O ATOM 1437 OE2 GLU A 100 22.733 70.009 -46.343 1.00 0.00 O1- ATOM 0 H GLU A 100 22.061 71.909 -44.838 1.00 0.00 H new ATOM 0 HA GLU A 100 22.463 74.649 -45.538 1.00 0.00 H new ATOM 0 HB2 GLU A 100 20.418 72.833 -46.811 1.00 0.00 H new ATOM 0 HB3 GLU A 100 21.420 74.059 -47.562 1.00 0.00 H new ATOM 0 HG2 GLU A 100 22.627 72.283 -48.279 1.00 0.00 H new ATOM 0 HG3 GLU A 100 23.364 72.383 -46.692 1.00 0.00 H new ATOM 1444 N ASP A 101 19.555 73.743 -44.302 1.00 0.00 N ATOM 1445 CA ASP A 101 18.305 74.249 -43.746 1.00 0.00 C ATOM 1446 C ASP A 101 18.557 75.028 -42.459 1.00 0.00 C ATOM 1447 O ASP A 101 17.698 75.778 -41.995 1.00 0.00 O ATOM 1448 CB ASP A 101 17.337 73.095 -43.477 1.00 0.00 C ATOM 1449 CG ASP A 101 16.153 73.516 -42.629 1.00 0.00 C ATOM 1450 OD1 ASP A 101 15.289 74.258 -43.143 1.00 0.00 O ATOM 1451 OD2 ASP A 101 16.092 73.108 -41.451 1.00 0.00 O1- ATOM 0 H ASP A 101 19.692 72.739 -44.187 1.00 0.00 H new ATOM 0 HA ASP A 101 17.859 74.924 -44.476 1.00 0.00 H new ATOM 0 HB2 ASP A 101 16.977 72.698 -44.426 1.00 0.00 H new ATOM 0 HB3 ASP A 101 17.870 72.287 -42.975 1.00 0.00 H new ATOM 1456 N SER A 102 19.741 74.843 -41.885 1.00 0.00 N ATOM 1457 CA SER A 102 20.106 75.524 -40.648 1.00 0.00 C ATOM 1458 C SER A 102 20.942 76.767 -40.939 1.00 0.00 C ATOM 1459 O SER A 102 20.746 77.819 -40.327 1.00 0.00 O ATOM 1460 CB SER A 102 20.882 74.579 -39.729 1.00 0.00 C ATOM 1461 OG SER A 102 20.553 74.802 -38.370 1.00 0.00 O ATOM 0 H SER A 102 20.464 74.227 -42.257 1.00 0.00 H new ATOM 0 HA SER A 102 19.188 75.832 -40.148 1.00 0.00 H new ATOM 0 HB2 SER A 102 20.660 73.545 -39.995 1.00 0.00 H new ATOM 0 HB3 SER A 102 21.953 74.723 -39.875 1.00 0.00 H new ATOM 0 HG SER A 102 21.375 74.898 -37.846 1.00 0.00 H new ATOM 1467 N VAL A 103 21.874 76.640 -41.878 1.00 0.00 N ATOM 1468 CA VAL A 103 22.738 77.752 -42.253 1.00 0.00 C ATOM 1469 C VAL A 103 21.933 78.896 -42.861 1.00 0.00 C ATOM 1470 O VAL A 103 22.361 80.050 -42.839 1.00 0.00 O ATOM 1471 CB VAL A 103 23.820 77.310 -43.255 1.00 0.00 C ATOM 1472 CG1 VAL A 103 23.215 77.094 -44.633 1.00 0.00 C ATOM 1473 CG2 VAL A 103 24.943 78.335 -43.313 1.00 0.00 C ATOM 0 H VAL A 103 22.050 75.777 -42.393 1.00 0.00 H new ATOM 0 HA VAL A 103 23.220 78.098 -41.339 1.00 0.00 H new ATOM 0 HB VAL A 103 24.240 76.363 -42.915 1.00 0.00 H new ATOM 0 HG11 VAL A 103 23.995 76.782 -45.328 1.00 0.00 H new ATOM 0 HG12 VAL A 103 22.449 76.321 -44.577 1.00 0.00 H new ATOM 0 HG13 VAL A 103 22.767 78.024 -44.984 1.00 0.00 H new ATOM 0 HG21 VAL A 103 25.699 78.006 -44.026 1.00 0.00 H new ATOM 0 HG22 VAL A 103 24.541 79.298 -43.628 1.00 0.00 H new ATOM 0 HG23 VAL A 103 25.395 78.436 -42.326 1.00 0.00 H new ATOM 1483 N ILE A 104 20.766 78.565 -43.402 1.00 0.00 N ATOM 1484 CA ILE A 104 19.899 79.564 -44.016 1.00 0.00 C ATOM 1485 C ILE A 104 18.842 80.052 -43.033 1.00 0.00 C ATOM 1486 O ILE A 104 18.407 81.204 -43.094 1.00 0.00 O ATOM 1487 CB ILE A 104 19.199 79.007 -45.271 1.00 0.00 C ATOM 1488 CG1 ILE A 104 20.235 78.534 -46.292 1.00 0.00 C ATOM 1489 CG2 ILE A 104 18.290 80.063 -45.883 1.00 0.00 C ATOM 1490 CD1 ILE A 104 19.654 77.659 -47.381 1.00 0.00 C ATOM 0 H ILE A 104 20.399 77.614 -43.428 1.00 0.00 H new ATOM 0 HA ILE A 104 20.536 80.400 -44.306 1.00 0.00 H new ATOM 0 HB ILE A 104 18.588 78.153 -44.979 1.00 0.00 H new ATOM 0 HG12 ILE A 104 20.706 79.404 -46.749 1.00 0.00 H new ATOM 0 HG13 ILE A 104 21.019 77.982 -45.773 1.00 0.00 H new ATOM 0 HG21 ILE A 104 17.803 79.655 -46.768 1.00 0.00 H new ATOM 0 HG22 ILE A 104 17.533 80.358 -45.156 1.00 0.00 H new ATOM 0 HG23 ILE A 104 18.882 80.934 -46.164 1.00 0.00 H new ATOM 0 HD11 ILE A 104 20.445 77.361 -48.069 1.00 0.00 H new ATOM 0 HD12 ILE A 104 19.207 76.771 -46.934 1.00 0.00 H new ATOM 0 HD13 ILE A 104 18.890 78.214 -47.925 1.00 0.00 H new ATOM 1502 N SER A 105 18.433 79.173 -42.125 1.00 0.00 N ATOM 1503 CA SER A 105 17.425 79.514 -41.128 1.00 0.00 C ATOM 1504 C SER A 105 18.038 80.326 -39.992 1.00 0.00 C ATOM 1505 O SER A 105 17.361 81.139 -39.358 1.00 0.00 O ATOM 1506 CB SER A 105 16.777 78.246 -40.572 1.00 0.00 C ATOM 1507 OG SER A 105 17.688 77.520 -39.763 1.00 0.00 O ATOM 0 H SER A 105 18.784 78.218 -42.059 1.00 0.00 H new ATOM 0 HA SER A 105 16.660 80.120 -41.613 1.00 0.00 H new ATOM 0 HB2 SER A 105 15.897 78.511 -39.986 1.00 0.00 H new ATOM 0 HB3 SER A 105 16.436 77.618 -41.395 1.00 0.00 H new ATOM 0 HG SER A 105 18.606 77.733 -40.032 1.00 0.00 H new ATOM 1513 N LEU A 106 19.323 80.102 -39.739 1.00 0.00 N ATOM 1514 CA LEU A 106 20.030 80.812 -38.678 1.00 0.00 C ATOM 1515 C LEU A 106 20.094 82.308 -38.974 1.00 0.00 C ATOM 1516 O LEU A 106 19.874 83.136 -38.090 1.00 0.00 O ATOM 1517 CB LEU A 106 21.444 80.251 -38.515 1.00 0.00 C ATOM 1518 CG LEU A 106 22.268 80.832 -37.367 1.00 0.00 C ATOM 1519 CD1 LEU A 106 21.919 80.143 -36.057 1.00 0.00 C ATOM 1520 CD2 LEU A 106 23.756 80.703 -37.659 1.00 0.00 C ATOM 0 H LEU A 106 19.897 79.434 -40.254 1.00 0.00 H new ATOM 0 HA LEU A 106 19.480 80.667 -37.748 1.00 0.00 H new ATOM 0 HB2 LEU A 106 21.371 79.173 -38.374 1.00 0.00 H new ATOM 0 HB3 LEU A 106 21.988 80.415 -39.445 1.00 0.00 H new ATOM 0 HG LEU A 106 22.027 81.891 -37.273 1.00 0.00 H new ATOM 0 HD11 LEU A 106 22.516 80.570 -35.251 1.00 0.00 H new ATOM 0 HD12 LEU A 106 20.861 80.288 -35.841 1.00 0.00 H new ATOM 0 HD13 LEU A 106 22.130 79.077 -36.139 1.00 0.00 H new ATOM 0 HD21 LEU A 106 24.327 81.122 -36.831 1.00 0.00 H new ATOM 0 HD22 LEU A 106 24.013 79.651 -37.781 1.00 0.00 H new ATOM 0 HD23 LEU A 106 23.995 81.244 -38.575 1.00 0.00 H new ATOM 1532 N SER A 107 20.395 82.646 -40.223 1.00 0.00 N ATOM 1533 CA SER A 107 20.490 84.042 -40.636 1.00 0.00 C ATOM 1534 C SER A 107 19.219 84.484 -41.353 1.00 0.00 C ATOM 1535 O SER A 107 19.027 85.668 -41.623 1.00 0.00 O ATOM 1536 CB SER A 107 21.701 84.245 -41.548 1.00 0.00 C ATOM 1537 OG SER A 107 21.480 83.671 -42.825 1.00 0.00 O ATOM 0 H SER A 107 20.577 81.973 -40.967 1.00 0.00 H new ATOM 0 HA SER A 107 20.612 84.652 -39.741 1.00 0.00 H new ATOM 0 HB2 SER A 107 21.905 85.310 -41.655 1.00 0.00 H new ATOM 0 HB3 SER A 107 22.583 83.796 -41.092 1.00 0.00 H new ATOM 0 HG SER A 107 22.268 83.816 -43.390 1.00 0.00 H new ATOM 1543 N GLY A 108 18.353 83.522 -41.657 1.00 0.00 N ATOM 1544 CA GLY A 108 17.111 83.830 -42.342 1.00 0.00 C ATOM 1545 C GLY A 108 15.914 83.805 -41.411 1.00 0.00 C ATOM 1546 O GLY A 108 14.791 84.091 -41.823 1.00 0.00 O ATOM 0 H GLY A 108 18.489 82.535 -41.441 1.00 0.00 H new ATOM 0 HA2 GLY A 108 17.188 84.815 -42.803 1.00 0.00 H new ATOM 0 HA3 GLY A 108 16.956 83.112 -43.147 1.00 0.00 H new ATOM 1550 N ASP A 109 16.156 83.461 -40.148 1.00 0.00 N ATOM 1551 CA ASP A 109 15.089 83.396 -39.157 1.00 0.00 C ATOM 1552 C ASP A 109 15.525 84.049 -37.849 1.00 0.00 C ATOM 1553 O ASP A 109 14.873 83.891 -36.816 1.00 0.00 O ATOM 1554 CB ASP A 109 14.684 81.943 -38.906 1.00 0.00 C ATOM 1555 CG ASP A 109 13.178 81.755 -38.902 1.00 0.00 C ATOM 1556 OD1 ASP A 109 12.519 82.266 -37.972 1.00 0.00 O ATOM 1557 OD2 ASP A 109 12.662 81.096 -39.829 1.00 0.00 O1- ATOM 0 H ASP A 109 17.081 83.224 -39.789 1.00 0.00 H new ATOM 0 HA ASP A 109 14.229 83.941 -39.547 1.00 0.00 H new ATOM 0 HB2 ASP A 109 15.125 81.308 -39.674 1.00 0.00 H new ATOM 0 HB3 ASP A 109 15.091 81.615 -37.949 1.00 0.00 H new ATOM 1562 N HIS A 110 16.633 84.782 -37.900 1.00 0.00 N ATOM 1563 CA HIS A 110 17.157 85.458 -36.719 1.00 0.00 C ATOM 1564 C HIS A 110 17.487 86.916 -37.029 1.00 0.00 C ATOM 1565 O HIS A 110 17.787 87.700 -36.127 1.00 0.00 O ATOM 1566 CB HIS A 110 18.403 84.740 -36.203 1.00 0.00 C ATOM 1567 CG HIS A 110 18.659 84.956 -34.744 1.00 0.00 C ATOM 1568 ND1 HIS A 110 18.086 84.185 -33.755 1.00 0.00 N ATOM 1569 CD2 HIS A 110 19.436 85.865 -34.106 1.00 0.00 C ATOM 1570 CE1 HIS A 110 18.497 84.608 -32.574 1.00 0.00 C ATOM 1571 NE2 HIS A 110 19.316 85.628 -32.760 1.00 0.00 N ATOM 0 H HIS A 110 17.185 84.923 -38.746 1.00 0.00 H new ATOM 0 HA HIS A 110 16.388 85.433 -35.947 1.00 0.00 H new ATOM 0 HB2 HIS A 110 18.300 83.671 -36.391 1.00 0.00 H new ATOM 0 HB3 HIS A 110 19.269 85.081 -36.770 1.00 0.00 H new ATOM 0 HD2 HIS A 110 20.037 86.633 -34.570 1.00 0.00 H new ATOM 0 HE1 HIS A 110 18.212 84.192 -31.619 1.00 0.00 H new ATOM 0 HE2 HIS A 110 19.784 86.154 -32.022 1.00 0.00 H new ATOM 1579 N CYS A 111 17.430 87.271 -38.307 1.00 0.00 N ATOM 1580 CA CYS A 111 17.724 88.634 -38.736 1.00 0.00 C ATOM 1581 C CYS A 111 16.492 89.287 -39.352 1.00 0.00 C ATOM 1582 O CYS A 111 16.292 90.496 -39.228 1.00 0.00 O ATOM 1583 CB CYS A 111 18.875 88.636 -39.743 1.00 0.00 C ATOM 1584 SG CYS A 111 20.488 88.250 -39.022 1.00 0.00 S ATOM 0 H CYS A 111 17.183 86.634 -39.065 1.00 0.00 H new ATOM 0 HA CYS A 111 18.018 89.210 -37.859 1.00 0.00 H new ATOM 0 HB2 CYS A 111 18.658 87.912 -40.528 1.00 0.00 H new ATOM 0 HB3 CYS A 111 18.926 89.616 -40.218 1.00 0.00 H new ATOM 0 HG CYS A 111 21.396 88.274 -39.952 1.00 0.00 H new ATOM 1590 N ILE A 112 15.670 88.481 -40.017 1.00 0.00 N ATOM 1591 CA ILE A 112 14.459 88.984 -40.654 1.00 0.00 C ATOM 1592 C ILE A 112 13.222 88.629 -39.835 1.00 0.00 C ATOM 1593 O ILE A 112 12.314 89.447 -39.676 1.00 0.00 O ATOM 1594 CB ILE A 112 14.298 88.422 -42.078 1.00 0.00 C ATOM 1595 CG1 ILE A 112 13.029 88.979 -42.729 1.00 0.00 C ATOM 1596 CG2 ILE A 112 14.256 86.901 -42.046 1.00 0.00 C ATOM 1597 CD1 ILE A 112 13.107 89.053 -44.238 1.00 0.00 C ATOM 0 H ILE A 112 15.821 87.478 -40.128 1.00 0.00 H new ATOM 0 HA ILE A 112 14.557 90.068 -40.710 1.00 0.00 H new ATOM 0 HB ILE A 112 15.157 88.731 -42.673 1.00 0.00 H new ATOM 0 HG12 ILE A 112 12.181 88.354 -42.447 1.00 0.00 H new ATOM 0 HG13 ILE A 112 12.835 89.976 -42.334 1.00 0.00 H new ATOM 0 HG21 ILE A 112 14.142 86.519 -43.060 1.00 0.00 H new ATOM 0 HG22 ILE A 112 15.183 86.520 -41.617 1.00 0.00 H new ATOM 0 HG23 ILE A 112 13.413 86.573 -41.438 1.00 0.00 H new ATOM 0 HD11 ILE A 112 12.174 89.457 -44.631 1.00 0.00 H new ATOM 0 HD12 ILE A 112 13.934 89.701 -44.528 1.00 0.00 H new ATOM 0 HD13 ILE A 112 13.270 88.054 -44.643 1.00 0.00 H new ATOM 1609 N ILE A 113 13.192 87.406 -39.317 1.00 0.00 N ATOM 1610 CA ILE A 113 12.068 86.944 -38.514 1.00 0.00 C ATOM 1611 C ILE A 113 12.382 87.041 -37.024 1.00 0.00 C ATOM 1612 O ILE A 113 11.691 87.734 -36.276 1.00 0.00 O ATOM 1613 CB ILE A 113 11.692 85.489 -38.853 1.00 0.00 C ATOM 1614 CG1 ILE A 113 11.243 85.384 -40.310 1.00 0.00 C ATOM 1615 CG2 ILE A 113 10.598 84.993 -37.919 1.00 0.00 C ATOM 1616 CD1 ILE A 113 11.891 84.243 -41.063 1.00 0.00 C ATOM 0 H ILE A 113 13.934 86.717 -39.439 1.00 0.00 H new ATOM 0 HA ILE A 113 11.224 87.592 -38.750 1.00 0.00 H new ATOM 0 HB ILE A 113 12.572 84.860 -38.716 1.00 0.00 H new ATOM 0 HG12 ILE A 113 10.161 85.259 -40.340 1.00 0.00 H new ATOM 0 HG13 ILE A 113 11.470 86.320 -40.820 1.00 0.00 H new ATOM 0 HG21 ILE A 113 10.343 83.964 -38.171 1.00 0.00 H new ATOM 0 HG22 ILE A 113 10.951 85.037 -36.889 1.00 0.00 H new ATOM 0 HG23 ILE A 113 9.715 85.622 -38.027 1.00 0.00 H new ATOM 0 HD11 ILE A 113 11.525 84.230 -42.090 1.00 0.00 H new ATOM 0 HD12 ILE A 113 12.973 84.376 -41.065 1.00 0.00 H new ATOM 0 HD13 ILE A 113 11.643 83.299 -40.578 1.00 0.00 H new ATOM 1628 N GLY A 114 13.429 86.343 -36.598 1.00 0.00 N ATOM 1629 CA GLY A 114 13.817 86.364 -35.200 1.00 0.00 C ATOM 1630 C GLY A 114 14.178 87.755 -34.720 1.00 0.00 C ATOM 1631 O GLY A 114 14.100 88.047 -33.527 1.00 0.00 O ATOM 0 H GLY A 114 14.016 85.762 -37.197 1.00 0.00 H new ATOM 0 HA2 GLY A 114 13.000 85.974 -34.593 1.00 0.00 H new ATOM 0 HA3 GLY A 114 14.668 85.700 -35.052 1.00 0.00 H new ATOM 1635 N ARG A 115 14.580 88.614 -35.651 1.00 0.00 N ATOM 1636 CA ARG A 115 14.960 89.983 -35.316 1.00 0.00 C ATOM 1637 C ARG A 115 13.727 90.828 -35.013 1.00 0.00 C ATOM 1638 O ARG A 115 13.834 91.932 -34.475 1.00 0.00 O ATOM 1639 CB ARG A 115 15.751 90.610 -36.464 1.00 0.00 C ATOM 1640 CG ARG A 115 16.410 91.929 -36.099 1.00 0.00 C ATOM 1641 CD ARG A 115 15.684 93.108 -36.729 1.00 0.00 C ATOM 1642 NE ARG A 115 16.333 94.380 -36.422 1.00 0.00 N ATOM 1643 CZ ARG A 115 15.761 95.562 -36.617 1.00 0.00 C ATOM 1644 NH1 ARG A 115 14.534 95.636 -37.111 1.00 0.00 N1+ ATOM 1645 NH2 ARG A 115 16.417 96.676 -36.312 1.00 0.00 N ATOM 0 H ARG A 115 14.651 88.387 -36.643 1.00 0.00 H new ATOM 0 HA ARG A 115 15.588 89.953 -34.426 1.00 0.00 H new ATOM 0 HB2 ARG A 115 16.518 89.908 -36.791 1.00 0.00 H new ATOM 0 HB3 ARG A 115 15.083 90.769 -37.310 1.00 0.00 H new ATOM 0 HG2 ARG A 115 16.421 92.044 -35.015 1.00 0.00 H new ATOM 0 HG3 ARG A 115 17.449 91.922 -36.429 1.00 0.00 H new ATOM 0 HD2 ARG A 115 15.644 92.973 -37.810 1.00 0.00 H new ATOM 0 HD3 ARG A 115 14.654 93.132 -36.373 1.00 0.00 H new ATOM 0 HE ARG A 115 17.277 94.359 -36.037 1.00 0.00 H new ATOM 0 HH11 ARG A 115 14.025 94.783 -37.343 1.00 0.00 H new ATOM 0 HH12 ARG A 115 14.098 96.546 -37.259 1.00 0.00 H new ATOM 0 HH21 ARG A 115 17.360 96.623 -35.928 1.00 0.00 H new ATOM 0 HH22 ARG A 115 15.977 97.584 -36.462 1.00 0.00 H new ATOM 1659 N THR A 116 12.555 90.305 -35.358 1.00 0.00 N ATOM 1660 CA THR A 116 11.301 91.012 -35.125 1.00 0.00 C ATOM 1661 C THR A 116 10.566 90.442 -33.919 1.00 0.00 C ATOM 1662 O THR A 116 9.888 91.169 -33.191 1.00 0.00 O ATOM 1663 CB THR A 116 10.379 90.940 -36.355 1.00 0.00 C ATOM 1664 OG1 THR A 116 11.030 90.233 -37.417 1.00 0.00 O ATOM 1665 CG2 THR A 116 9.998 92.335 -36.828 1.00 0.00 C ATOM 0 H THR A 116 12.448 89.392 -35.801 1.00 0.00 H new ATOM 0 HA THR A 116 11.556 92.054 -34.933 1.00 0.00 H new ATOM 0 HB THR A 116 9.471 90.409 -36.069 1.00 0.00 H new ATOM 0 HG1 THR A 116 11.154 89.296 -37.158 1.00 0.00 H new ATOM 0 HG21 THR A 116 9.346 92.259 -37.698 1.00 0.00 H new ATOM 0 HG22 THR A 116 9.476 92.860 -36.028 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.899 92.887 -37.097 1.00 0.00 H new ATOM 1673 N LEU A 117 10.704 89.137 -33.708 1.00 0.00 N ATOM 1674 CA LEU A 117 10.052 88.468 -32.588 1.00 0.00 C ATOM 1675 C LEU A 117 10.938 88.501 -31.345 1.00 0.00 C ATOM 1676 O LEU A 117 10.443 88.496 -30.217 1.00 0.00 O ATOM 1677 CB LEU A 117 9.720 87.021 -32.954 1.00 0.00 C ATOM 1678 CG LEU A 117 8.377 86.493 -32.448 1.00 0.00 C ATOM 1679 CD1 LEU A 117 8.342 86.493 -30.927 1.00 0.00 C ATOM 1680 CD2 LEU A 117 7.232 87.322 -33.009 1.00 0.00 C ATOM 0 H LEU A 117 11.262 88.521 -34.299 1.00 0.00 H new ATOM 0 HA LEU A 117 9.127 89.000 -32.367 1.00 0.00 H new ATOM 0 HB2 LEU A 117 9.739 86.928 -34.040 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.510 86.378 -32.566 1.00 0.00 H new ATOM 0 HG LEU A 117 8.259 85.466 -32.794 1.00 0.00 H new ATOM 0 HD11 LEU A 117 7.379 86.114 -30.585 1.00 0.00 H new ATOM 0 HD12 LEU A 117 9.139 85.855 -30.545 1.00 0.00 H new ATOM 0 HD13 LEU A 117 8.483 87.510 -30.560 1.00 0.00 H new ATOM 0 HD21 LEU A 117 6.284 86.932 -32.638 1.00 0.00 H new ATOM 0 HD22 LEU A 117 7.345 88.359 -32.694 1.00 0.00 H new ATOM 0 HD23 LEU A 117 7.245 87.270 -34.098 1.00 0.00 H new ATOM 1692 N VAL A 118 12.249 88.533 -31.562 1.00 0.00 N ATOM 1693 CA VAL A 118 13.204 88.570 -30.459 1.00 0.00 C ATOM 1694 C VAL A 118 13.766 89.973 -30.265 1.00 0.00 C ATOM 1695 O VAL A 118 13.547 90.604 -29.232 1.00 0.00 O ATOM 1696 CB VAL A 118 14.368 87.590 -30.694 1.00 0.00 C ATOM 1697 CG1 VAL A 118 15.176 87.405 -29.418 1.00 0.00 C ATOM 1698 CG2 VAL A 118 13.845 86.252 -31.200 1.00 0.00 C ATOM 0 H VAL A 118 12.674 88.534 -32.489 1.00 0.00 H new ATOM 0 HA VAL A 118 12.663 88.272 -29.561 1.00 0.00 H new ATOM 0 HB VAL A 118 15.025 88.010 -31.456 1.00 0.00 H new ATOM 0 HG11 VAL A 118 15.994 86.709 -29.603 1.00 0.00 H new ATOM 0 HG12 VAL A 118 15.581 88.366 -29.102 1.00 0.00 H new ATOM 0 HG13 VAL A 118 14.532 87.007 -28.634 1.00 0.00 H new ATOM 0 HG21 VAL A 118 14.681 85.572 -31.361 1.00 0.00 H new ATOM 0 HG22 VAL A 118 13.166 85.824 -30.462 1.00 0.00 H new ATOM 0 HG23 VAL A 118 13.313 86.401 -32.140 1.00 0.00 H new ATOM 1708 N VAL A 119 14.494 90.456 -31.268 1.00 0.00 N ATOM 1709 CA VAL A 119 15.089 91.787 -31.208 1.00 0.00 C ATOM 1710 C VAL A 119 14.014 92.867 -31.156 1.00 0.00 C ATOM 1711 O VAL A 119 14.211 93.926 -30.561 1.00 0.00 O ATOM 1712 CB VAL A 119 16.004 92.046 -32.420 1.00 0.00 C ATOM 1713 CG1 VAL A 119 16.046 93.531 -32.747 1.00 0.00 C ATOM 1714 CG2 VAL A 119 17.402 91.510 -32.155 1.00 0.00 C ATOM 0 H VAL A 119 14.686 89.946 -32.131 1.00 0.00 H new ATOM 0 HA VAL A 119 15.685 91.828 -30.296 1.00 0.00 H new ATOM 0 HB VAL A 119 15.596 91.519 -33.283 1.00 0.00 H new ATOM 0 HG11 VAL A 119 16.697 93.696 -33.606 1.00 0.00 H new ATOM 0 HG12 VAL A 119 15.041 93.881 -32.981 1.00 0.00 H new ATOM 0 HG13 VAL A 119 16.431 94.082 -31.889 1.00 0.00 H new ATOM 0 HG21 VAL A 119 18.035 91.701 -33.021 1.00 0.00 H new ATOM 0 HG22 VAL A 119 17.823 92.007 -31.281 1.00 0.00 H new ATOM 0 HG23 VAL A 119 17.352 90.437 -31.972 1.00 0.00 H new ATOM 1724 N HIS A 120 12.874 92.590 -31.783 1.00 0.00 N ATOM 1725 CA HIS A 120 11.764 93.540 -31.807 1.00 0.00 C ATOM 1726 C HIS A 120 10.517 92.931 -31.173 1.00 0.00 C ATOM 1727 O HIS A 120 9.402 93.159 -31.640 1.00 0.00 O ATOM 1728 CB HIS A 120 11.465 93.967 -33.243 1.00 0.00 C ATOM 1729 CG HIS A 120 11.124 95.419 -33.377 1.00 0.00 C ATOM 1730 ND1 HIS A 120 11.924 96.326 -34.037 1.00 0.00 N ATOM 1731 CD2 HIS A 120 10.054 96.122 -32.928 1.00 0.00 C ATOM 1732 CE1 HIS A 120 11.367 97.521 -33.990 1.00 0.00 C ATOM 1733 NE2 HIS A 120 10.229 97.425 -33.322 1.00 0.00 N ATOM 0 H HIS A 120 12.694 91.718 -32.280 1.00 0.00 H new ATOM 0 HA HIS A 120 12.053 94.417 -31.228 1.00 0.00 H new ATOM 0 HB2 HIS A 120 12.331 93.747 -33.867 1.00 0.00 H new ATOM 0 HB3 HIS A 120 10.637 93.371 -33.626 1.00 0.00 H new ATOM 0 HD2 HIS A 120 9.220 95.729 -32.365 1.00 0.00 H new ATOM 0 HE1 HIS A 120 11.771 98.424 -34.423 1.00 0.00 H new ATOM 0 HE2 HIS A 120 9.587 98.194 -33.131 1.00 0.00 H new ATOM 1741 N GLU A 121 10.716 92.160 -30.110 1.00 0.00 N ATOM 1742 CA GLU A 121 9.604 91.520 -29.415 1.00 0.00 C ATOM 1743 C GLU A 121 8.661 92.562 -28.820 1.00 0.00 C ATOM 1744 O GLU A 121 7.523 92.257 -28.467 1.00 0.00 O ATOM 1745 CB GLU A 121 10.129 90.601 -28.307 1.00 0.00 C ATOM 1746 CG GLU A 121 9.095 89.610 -27.800 1.00 0.00 C ATOM 1747 CD GLU A 121 9.667 88.638 -26.787 1.00 0.00 C ATOM 1748 OE1 GLU A 121 10.857 88.278 -26.918 1.00 0.00 O ATOM 1749 OE2 GLU A 121 8.927 88.235 -25.866 1.00 0.00 O1- ATOM 0 H GLU A 121 11.634 91.963 -29.711 1.00 0.00 H new ATOM 0 HA GLU A 121 9.049 90.925 -30.141 1.00 0.00 H new ATOM 0 HB2 GLU A 121 10.994 90.052 -28.680 1.00 0.00 H new ATOM 0 HB3 GLU A 121 10.475 91.212 -27.473 1.00 0.00 H new ATOM 0 HG2 GLU A 121 8.266 90.155 -27.348 1.00 0.00 H new ATOM 0 HG3 GLU A 121 8.687 89.052 -28.643 1.00 0.00 H new ATOM 1756 N LYS A 122 9.142 93.796 -28.714 1.00 0.00 N ATOM 1757 CA LYS A 122 8.344 94.886 -28.165 1.00 0.00 C ATOM 1758 C LYS A 122 8.535 96.162 -28.978 1.00 0.00 C ATOM 1759 O LYS A 122 7.587 96.682 -29.566 1.00 0.00 O ATOM 1760 CB LYS A 122 8.724 95.136 -26.704 1.00 0.00 C ATOM 1761 CG LYS A 122 8.307 96.505 -26.194 1.00 0.00 C ATOM 1762 CD LYS A 122 8.484 96.617 -24.688 1.00 0.00 C ATOM 1763 CE LYS A 122 8.683 98.061 -24.257 1.00 0.00 C ATOM 1764 NZ LYS A 122 9.330 98.153 -22.918 1.00 0.00 N1+ ATOM 0 H LYS A 122 10.082 94.067 -29.002 1.00 0.00 H new ATOM 0 HA LYS A 122 7.294 94.598 -28.217 1.00 0.00 H new ATOM 0 HB2 LYS A 122 8.263 94.369 -26.081 1.00 0.00 H new ATOM 0 HB3 LYS A 122 9.803 95.030 -26.594 1.00 0.00 H new ATOM 0 HG2 LYS A 122 8.899 97.275 -26.689 1.00 0.00 H new ATOM 0 HG3 LYS A 122 7.264 96.689 -26.453 1.00 0.00 H new ATOM 0 HD2 LYS A 122 7.609 96.203 -24.186 1.00 0.00 H new ATOM 0 HD3 LYS A 122 9.342 96.021 -24.376 1.00 0.00 H new ATOM 0 HE2 LYS A 122 9.297 98.579 -24.994 1.00 0.00 H new ATOM 0 HE3 LYS A 122 7.719 98.569 -24.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 9.449 99.153 -22.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 8.732 97.680 -22.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 10.261 97.690 -22.950 1.00 0.00 H new ATOM 1778 N ALA A 123 9.765 96.662 -29.007 1.00 0.00 N ATOM 1779 CA ALA A 123 10.079 97.877 -29.749 1.00 0.00 C ATOM 1780 C ALA A 123 11.550 98.247 -29.601 1.00 0.00 C ATOM 1781 O ALA A 123 11.991 98.661 -28.527 1.00 0.00 O ATOM 1782 CB ALA A 123 9.195 99.025 -29.284 1.00 0.00 C ATOM 0 H ALA A 123 10.561 96.245 -28.525 1.00 0.00 H new ATOM 0 HA ALA A 123 9.883 97.687 -30.804 1.00 0.00 H new ATOM 0 HB1 ALA A 123 9.441 99.925 -29.847 1.00 0.00 H new ATOM 0 HB2 ALA A 123 8.149 98.768 -29.449 1.00 0.00 H new ATOM 0 HB3 ALA A 123 9.361 99.205 -28.222 1.00 0.00 H new ATOM 1788 N ASP A 124 12.306 98.093 -30.682 1.00 0.00 N ATOM 1789 CA ASP A 124 13.731 98.411 -30.671 1.00 0.00 C ATOM 1790 C ASP A 124 14.434 97.721 -29.507 1.00 0.00 C ATOM 1791 O ASP A 124 15.420 98.229 -28.973 1.00 0.00 O ATOM 1792 CB ASP A 124 13.936 99.925 -30.581 1.00 0.00 C ATOM 1793 CG ASP A 124 15.168 100.387 -31.334 1.00 0.00 C ATOM 1794 OD1 ASP A 124 16.112 99.582 -31.478 1.00 0.00 O ATOM 1795 OD2 ASP A 124 15.189 101.555 -31.776 1.00 0.00 O1- ATOM 0 H ASP A 124 11.957 97.750 -31.577 1.00 0.00 H new ATOM 0 HA ASP A 124 14.166 98.047 -31.602 1.00 0.00 H new ATOM 0 HB2 ASP A 124 13.058 100.432 -30.981 1.00 0.00 H new ATOM 0 HB3 ASP A 124 14.023 100.216 -29.534 1.00 0.00 H new ATOM 1800 N ASP A 125 13.917 96.561 -29.115 1.00 0.00 N ATOM 1801 CA ASP A 125 14.495 95.800 -28.013 1.00 0.00 C ATOM 1802 C ASP A 125 13.789 94.458 -27.851 1.00 0.00 C ATOM 1803 O ASP A 125 14.415 93.454 -27.505 1.00 0.00 O ATOM 1804 CB ASP A 125 14.406 96.599 -26.712 1.00 0.00 C ATOM 1805 CG ASP A 125 15.681 96.523 -25.897 1.00 0.00 C ATOM 1806 OD1 ASP A 125 15.859 95.527 -25.165 1.00 0.00 O ATOM 1807 OD2 ASP A 125 16.502 97.460 -25.991 1.00 0.00 O1- ATOM 0 H ASP A 125 13.099 96.128 -29.544 1.00 0.00 H new ATOM 0 HA ASP A 125 15.544 95.612 -28.243 1.00 0.00 H new ATOM 0 HB2 ASP A 125 14.188 97.642 -26.944 1.00 0.00 H new ATOM 0 HB3 ASP A 125 13.574 96.225 -26.115 1.00 0.00 H new TER 1812 ASP A 125