USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1132 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 940 SER OG : rot 180:sc= 0.0357 USER MOD Set 1.2: A1021 MET CE :methyl -174:sc= -5.09! (180deg=-5.56!) USER MOD Set 2.1: A 944 GLN : amide:sc= 0.695 K(o=-1.1,f=-2.7) USER MOD Set 2.2: A1014 GLN : amide:sc= -1.75 K(o=-1.1,f=-7!) USER MOD Single : A 915 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 917 ASN : amide:sc= 0.0826 K(o=0.083,f=-1.2) USER MOD Single : A 921 SER OG : rot 180:sc= 0 USER MOD Single : A 922 ASN : amide:sc= -4.11! C(o=-4.1!,f=-5.8!) USER MOD Single : A 924 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 926 TYR OH : rot -151:sc= 0.0247 USER MOD Single : A 928 ASN : amide:sc= -3.1 K(o=-3.1,f=-5.8!) USER MOD Single : A 930 THR OG1 : rot -102:sc= -0.0738 USER MOD Single : A 934 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 939 MET CE :methyl 156:sc= -0.865 (180deg=-3!) USER MOD Single : A 941 SER OG : rot 180:sc= 0 USER MOD Single : A 942 LYS NZ :NH3+ 155:sc= 0.267 (180deg=-0.298) USER MOD Single : A 951 TYR OH : rot 130:sc= -0.435 USER MOD Single : A 954 MET CE :methyl -131:sc= -3.27 (180deg=-10.2!) USER MOD Single : A 956 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 964 THR OG1 : rot 91:sc= 0.444 USER MOD Single : A 968 THR OG1 : rot 180:sc= 0 USER MOD Single : A 972 SER OG : rot 41:sc= -1.88! USER MOD Single : A 979 SER OG : rot 180:sc= -1.42 USER MOD Single : A 980 THR OG1 : rot -74:sc= -3.7! USER MOD Single : A 981 HIS :FLIP no HD1:sc= -2.1! C(o=-2.6!,f=-2.1!) USER MOD Single : A 986 MET CE :methyl -118:sc= -1.79! (180deg=-3.68!) USER MOD Single : A 988 GLN :FLIP amide:sc= -6.69! C(o=-7.3!,f=-6.7!) USER MOD Single : A 989 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 992 ASN : amide:sc= -0.465 K(o=-0.46,f=-1) USER MOD Single : A 993 SER OG : rot 180:sc= 0 USER MOD Single : A1000 ASN : amide:sc= -0.0612 K(o=-0.061,f=-0.95) USER MOD Single : A1001 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0117) USER MOD Single : A1002 MET CE :methyl -139:sc= -1.44 (180deg=-3.97!) USER MOD Single : A1003 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1006 GLN :FLIP amide:sc= -5.36! C(o=-6.3!,f=-5.4!) USER MOD Single : A1007 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1008 TYR OH : rot 180:sc= 0 USER MOD Single : A1010 MET CE :methyl -109:sc= -1.19 (180deg=-4.15!) USER MOD Single : A1011 THR OG1 : rot 180:sc= -0.431 USER MOD Single : A1012 SER OG : rot 180:sc= 0 USER MOD Single : A1015 GLN : amide:sc=-0.00946 X(o=-0.0095,f=-0.0061) USER MOD Single : A1017 TYR OH : rot 64:sc= 1.41 USER MOD Single : A1018 LYS NZ :NH3+ -133:sc= -0.695 (180deg=-3.16!) USER MOD Single : A1019 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1020 GLN : amide:sc= -0.0589 X(o=-0.059,f=-0.4) USER MOD Single : A1023 THR OG1 : rot 89:sc= 0.305 USER MOD Single : A1026 HIS : no HD1:sc= -0.0368 X(o=-0.037,f=-0.17) USER MOD Single : A1033 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1034 ASN : amide:sc= -9.64! C(o=-9.6!,f=-14!) USER MOD Single : A1041 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1045 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1046 MET CE :methyl 158:sc= -0.56 (180deg=-1.86!) USER MOD Single : A1048 SER OG : rot 180:sc= 0 USER MOD Single : A1049 GLN : amide:sc= -0.01 X(o=-0.01,f=0.28) USER MOD Single : A1050 SER OG : rot 180:sc= 0 USER MOD Single : A1053 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 915 11.956 -21.470 -0.345 1.00 0.00 N ATOM 2 CA MET A 915 12.057 -21.058 1.045 1.00 0.00 C ATOM 3 C MET A 915 11.488 -19.652 1.243 1.00 0.00 C ATOM 4 O MET A 915 10.560 -19.458 2.027 1.00 0.00 O ATOM 5 CB MET A 915 13.523 -21.082 1.480 1.00 0.00 C ATOM 6 CG MET A 915 14.003 -22.517 1.712 1.00 0.00 C ATOM 7 SD MET A 915 15.710 -22.513 2.233 1.00 0.00 S ATOM 8 CE MET A 915 16.111 -24.236 1.996 1.00 0.00 C ATOM 0 HA MET A 915 11.478 -21.753 1.653 1.00 0.00 H new ATOM 0 HB2 MET A 915 14.140 -20.607 0.717 1.00 0.00 H new ATOM 0 HB3 MET A 915 13.644 -20.502 2.395 1.00 0.00 H new ATOM 0 HG2 MET A 915 13.384 -22.998 2.469 1.00 0.00 H new ATOM 0 HG3 MET A 915 13.895 -23.098 0.796 1.00 0.00 H new ATOM 0 HE1 MET A 915 17.150 -24.410 2.276 1.00 0.00 H new ATOM 0 HE2 MET A 915 15.460 -24.850 2.618 1.00 0.00 H new ATOM 0 HE3 MET A 915 15.969 -24.502 0.949 1.00 0.00 H new ATOM 18 N ALA A 916 12.069 -18.706 0.519 1.00 0.00 N ATOM 19 CA ALA A 916 11.632 -17.323 0.606 1.00 0.00 C ATOM 20 C ALA A 916 10.804 -16.976 -0.633 1.00 0.00 C ATOM 21 O ALA A 916 11.355 -16.610 -1.670 1.00 0.00 O ATOM 22 CB ALA A 916 12.850 -16.412 0.766 1.00 0.00 C ATOM 0 H ALA A 916 12.838 -18.870 -0.130 1.00 0.00 H new ATOM 0 HA ALA A 916 10.997 -17.175 1.480 1.00 0.00 H new ATOM 0 HB1 ALA A 916 12.522 -15.374 0.831 1.00 0.00 H new ATOM 0 HB2 ALA A 916 13.388 -16.680 1.675 1.00 0.00 H new ATOM 0 HB3 ALA A 916 13.509 -16.531 -0.094 1.00 0.00 H new ATOM 28 N ASN A 917 9.494 -17.104 -0.485 1.00 0.00 N ATOM 29 CA ASN A 917 8.584 -16.809 -1.579 1.00 0.00 C ATOM 30 C ASN A 917 8.607 -15.306 -1.864 1.00 0.00 C ATOM 31 O ASN A 917 7.634 -14.604 -1.594 1.00 0.00 O ATOM 32 CB ASN A 917 7.149 -17.200 -1.223 1.00 0.00 C ATOM 33 CG ASN A 917 7.096 -18.609 -0.628 1.00 0.00 C ATOM 34 OD1 ASN A 917 7.389 -18.830 0.536 1.00 0.00 O ATOM 35 ND2 ASN A 917 6.707 -19.545 -1.488 1.00 0.00 N ATOM 0 H ASN A 917 9.040 -17.408 0.376 1.00 0.00 H new ATOM 0 HA ASN A 917 8.908 -17.379 -2.450 1.00 0.00 H new ATOM 0 HB2 ASN A 917 6.740 -16.485 -0.510 1.00 0.00 H new ATOM 0 HB3 ASN A 917 6.524 -17.154 -2.115 1.00 0.00 H new ATOM 0 HD21 ASN A 917 6.639 -20.517 -1.187 1.00 0.00 H new ATOM 0 HD22 ASN A 917 6.476 -19.291 -2.449 1.00 0.00 H new ATOM 42 N LEU A 918 9.729 -14.856 -2.406 1.00 0.00 N ATOM 43 CA LEU A 918 9.892 -13.449 -2.731 1.00 0.00 C ATOM 44 C LEU A 918 10.270 -13.311 -4.207 1.00 0.00 C ATOM 45 O LEU A 918 11.291 -12.711 -4.537 1.00 0.00 O ATOM 46 CB LEU A 918 10.891 -12.791 -1.777 1.00 0.00 C ATOM 47 CG LEU A 918 10.356 -12.432 -0.389 1.00 0.00 C ATOM 48 CD1 LEU A 918 10.632 -13.555 0.612 1.00 0.00 C ATOM 49 CD2 LEU A 918 10.919 -11.090 0.085 1.00 0.00 C ATOM 0 H LEU A 918 10.534 -15.441 -2.628 1.00 0.00 H new ATOM 0 HA LEU A 918 8.952 -12.915 -2.591 1.00 0.00 H new ATOM 0 HB2 LEU A 918 11.742 -13.461 -1.655 1.00 0.00 H new ATOM 0 HB3 LEU A 918 11.267 -11.882 -2.246 1.00 0.00 H new ATOM 0 HG LEU A 918 9.274 -12.321 -0.458 1.00 0.00 H new ATOM 0 HD11 LEU A 918 10.242 -13.274 1.590 1.00 0.00 H new ATOM 0 HD12 LEU A 918 10.145 -14.470 0.276 1.00 0.00 H new ATOM 0 HD13 LEU A 918 11.707 -13.722 0.684 1.00 0.00 H new ATOM 0 HD21 LEU A 918 10.523 -10.858 1.074 1.00 0.00 H new ATOM 0 HD22 LEU A 918 12.006 -11.148 0.134 1.00 0.00 H new ATOM 0 HD23 LEU A 918 10.629 -10.306 -0.615 1.00 0.00 H new ATOM 61 N ASP A 919 9.425 -13.877 -5.057 1.00 0.00 N ATOM 62 CA ASP A 919 9.657 -13.825 -6.490 1.00 0.00 C ATOM 63 C ASP A 919 9.629 -12.367 -6.954 1.00 0.00 C ATOM 64 O ASP A 919 9.606 -11.451 -6.133 1.00 0.00 O ATOM 65 CB ASP A 919 8.569 -14.585 -7.252 1.00 0.00 C ATOM 66 CG ASP A 919 9.024 -15.899 -7.889 1.00 0.00 C ATOM 67 OD1 ASP A 919 9.689 -16.677 -7.171 1.00 0.00 O ATOM 68 OD2 ASP A 919 8.695 -16.097 -9.078 1.00 0.00 O ATOM 0 H ASP A 919 8.578 -14.374 -4.780 1.00 0.00 H new ATOM 0 HA ASP A 919 10.625 -14.283 -6.692 1.00 0.00 H new ATOM 0 HB2 ASP A 919 7.747 -14.796 -6.568 1.00 0.00 H new ATOM 0 HB3 ASP A 919 8.174 -13.937 -8.034 1.00 0.00 H new ATOM 73 N ARG A 920 9.631 -12.198 -8.268 1.00 0.00 N ATOM 74 CA ARG A 920 9.607 -10.867 -8.851 1.00 0.00 C ATOM 75 C ARG A 920 8.171 -10.343 -8.916 1.00 0.00 C ATOM 76 O ARG A 920 7.913 -9.302 -9.519 1.00 0.00 O ATOM 77 CB ARG A 920 10.205 -10.872 -10.259 1.00 0.00 C ATOM 78 CG ARG A 920 11.695 -11.217 -10.221 1.00 0.00 C ATOM 79 CD ARG A 920 12.047 -12.244 -11.299 1.00 0.00 C ATOM 80 NE ARG A 920 13.497 -12.190 -11.595 1.00 0.00 N ATOM 81 CZ ARG A 920 14.046 -12.590 -12.761 1.00 0.00 C ATOM 82 NH1 ARG A 920 13.271 -13.079 -13.752 1.00 0.00 N ATOM 83 NH2 ARG A 920 15.354 -12.497 -12.917 1.00 0.00 N ATOM 0 H ARG A 920 9.649 -12.960 -8.945 1.00 0.00 H new ATOM 0 HA ARG A 920 10.207 -10.215 -8.216 1.00 0.00 H new ATOM 0 HB2 ARG A 920 9.676 -11.595 -10.880 1.00 0.00 H new ATOM 0 HB3 ARG A 920 10.066 -9.894 -10.720 1.00 0.00 H new ATOM 0 HG2 ARG A 920 12.285 -10.313 -10.369 1.00 0.00 H new ATOM 0 HG3 ARG A 920 11.956 -11.611 -9.239 1.00 0.00 H new ATOM 0 HD2 ARG A 920 11.773 -13.244 -10.964 1.00 0.00 H new ATOM 0 HD3 ARG A 920 11.475 -12.044 -12.205 1.00 0.00 H new ATOM 0 HE ARG A 920 14.119 -11.828 -10.873 1.00 0.00 H new ATOM 0 HH11 ARG A 920 12.262 -13.149 -13.623 1.00 0.00 H new ATOM 0 HH12 ARG A 920 13.695 -13.379 -14.630 1.00 0.00 H new ATOM 0 HH21 ARG A 920 15.933 -12.127 -12.163 1.00 0.00 H new ATOM 0 HH22 ARG A 920 15.786 -12.795 -13.792 1.00 0.00 H new ATOM 96 N SER A 921 7.274 -11.087 -8.286 1.00 0.00 N ATOM 97 CA SER A 921 5.871 -10.710 -8.264 1.00 0.00 C ATOM 98 C SER A 921 5.600 -9.767 -7.090 1.00 0.00 C ATOM 99 O SER A 921 5.233 -8.610 -7.290 1.00 0.00 O ATOM 100 CB SER A 921 4.970 -11.943 -8.172 1.00 0.00 C ATOM 101 OG SER A 921 5.177 -12.837 -9.263 1.00 0.00 O ATOM 0 H SER A 921 7.492 -11.949 -7.787 1.00 0.00 H new ATOM 0 HA SER A 921 5.642 -10.194 -9.197 1.00 0.00 H new ATOM 0 HB2 SER A 921 5.163 -12.464 -7.234 1.00 0.00 H new ATOM 0 HB3 SER A 921 3.926 -11.629 -8.153 1.00 0.00 H new ATOM 0 HG SER A 921 4.585 -13.612 -9.168 1.00 0.00 H new ATOM 107 N ASN A 922 5.793 -10.296 -5.891 1.00 0.00 N ATOM 108 CA ASN A 922 5.574 -9.516 -4.685 1.00 0.00 C ATOM 109 C ASN A 922 6.684 -8.472 -4.549 1.00 0.00 C ATOM 110 O ASN A 922 6.627 -7.610 -3.674 1.00 0.00 O ATOM 111 CB ASN A 922 5.607 -10.405 -3.440 1.00 0.00 C ATOM 112 CG ASN A 922 7.028 -10.891 -3.151 1.00 0.00 C ATOM 113 OD1 ASN A 922 7.682 -11.506 -3.977 1.00 0.00 O ATOM 114 ND2 ASN A 922 7.468 -10.582 -1.934 1.00 0.00 N ATOM 0 H ASN A 922 6.099 -11.255 -5.729 1.00 0.00 H new ATOM 0 HA ASN A 922 4.596 -9.042 -4.764 1.00 0.00 H new ATOM 0 HB2 ASN A 922 5.227 -9.850 -2.582 1.00 0.00 H new ATOM 0 HB3 ASN A 922 4.948 -11.261 -3.583 1.00 0.00 H new ATOM 0 HD21 ASN A 922 8.405 -10.862 -1.644 1.00 0.00 H new ATOM 0 HD22 ASN A 922 6.868 -10.065 -1.291 1.00 0.00 H new ATOM 121 N ASP A 923 7.669 -8.585 -5.429 1.00 0.00 N ATOM 122 CA ASP A 923 8.791 -7.661 -5.419 1.00 0.00 C ATOM 123 C ASP A 923 8.355 -6.329 -6.033 1.00 0.00 C ATOM 124 O ASP A 923 8.893 -5.278 -5.689 1.00 0.00 O ATOM 125 CB ASP A 923 9.958 -8.204 -6.245 1.00 0.00 C ATOM 126 CG ASP A 923 11.309 -7.542 -5.968 1.00 0.00 C ATOM 127 OD1 ASP A 923 11.768 -7.651 -4.810 1.00 0.00 O ATOM 128 OD2 ASP A 923 11.853 -6.942 -6.920 1.00 0.00 O ATOM 0 H ASP A 923 7.713 -9.302 -6.153 1.00 0.00 H new ATOM 0 HA ASP A 923 9.111 -7.530 -4.385 1.00 0.00 H new ATOM 0 HB2 ASP A 923 10.049 -9.274 -6.058 1.00 0.00 H new ATOM 0 HB3 ASP A 923 9.722 -8.085 -7.302 1.00 0.00 H new ATOM 133 N LYS A 924 7.385 -6.417 -6.930 1.00 0.00 N ATOM 134 CA LYS A 924 6.871 -5.232 -7.595 1.00 0.00 C ATOM 135 C LYS A 924 5.807 -4.578 -6.712 1.00 0.00 C ATOM 136 O LYS A 924 5.843 -3.370 -6.481 1.00 0.00 O ATOM 137 CB LYS A 924 6.375 -5.579 -9.001 1.00 0.00 C ATOM 138 CG LYS A 924 6.147 -4.313 -9.829 1.00 0.00 C ATOM 139 CD LYS A 924 5.190 -4.584 -10.992 1.00 0.00 C ATOM 140 CE LYS A 924 5.420 -3.591 -12.134 1.00 0.00 C ATOM 141 NZ LYS A 924 4.881 -4.128 -13.404 1.00 0.00 N ATOM 0 H LYS A 924 6.941 -7.291 -7.212 1.00 0.00 H new ATOM 0 HA LYS A 924 7.665 -4.499 -7.734 1.00 0.00 H new ATOM 0 HB2 LYS A 924 7.103 -6.218 -9.500 1.00 0.00 H new ATOM 0 HB3 LYS A 924 5.447 -6.146 -8.934 1.00 0.00 H new ATOM 0 HG2 LYS A 924 5.739 -3.527 -9.193 1.00 0.00 H new ATOM 0 HG3 LYS A 924 7.100 -3.950 -10.214 1.00 0.00 H new ATOM 0 HD2 LYS A 924 5.333 -5.602 -11.356 1.00 0.00 H new ATOM 0 HD3 LYS A 924 4.160 -4.512 -10.644 1.00 0.00 H new ATOM 0 HE2 LYS A 924 4.939 -2.641 -11.900 1.00 0.00 H new ATOM 0 HE3 LYS A 924 6.486 -3.390 -12.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 5.045 -3.442 -14.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 5.359 -5.023 -13.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 3.860 -4.297 -13.304 1.00 0.00 H new ATOM 155 N VAL A 925 4.884 -5.404 -6.241 1.00 0.00 N ATOM 156 CA VAL A 925 3.812 -4.921 -5.388 1.00 0.00 C ATOM 157 C VAL A 925 4.413 -4.217 -4.170 1.00 0.00 C ATOM 158 O VAL A 925 3.973 -3.130 -3.797 1.00 0.00 O ATOM 159 CB VAL A 925 2.882 -6.076 -5.012 1.00 0.00 C ATOM 160 CG1 VAL A 925 1.750 -5.594 -4.102 1.00 0.00 C ATOM 161 CG2 VAL A 925 2.327 -6.762 -6.261 1.00 0.00 C ATOM 0 H VAL A 925 4.857 -6.405 -6.434 1.00 0.00 H new ATOM 0 HA VAL A 925 3.202 -4.189 -5.918 1.00 0.00 H new ATOM 0 HB VAL A 925 3.467 -6.811 -4.459 1.00 0.00 H new ATOM 0 HG11 VAL A 925 1.103 -6.434 -3.849 1.00 0.00 H new ATOM 0 HG12 VAL A 925 2.171 -5.173 -3.189 1.00 0.00 H new ATOM 0 HG13 VAL A 925 1.168 -4.831 -4.618 1.00 0.00 H new ATOM 0 HG21 VAL A 925 1.669 -7.579 -5.965 1.00 0.00 H new ATOM 0 HG22 VAL A 925 1.765 -6.040 -6.853 1.00 0.00 H new ATOM 0 HG23 VAL A 925 3.151 -7.157 -6.856 1.00 0.00 H new ATOM 171 N TYR A 926 5.410 -4.864 -3.584 1.00 0.00 N ATOM 172 CA TYR A 926 6.076 -4.313 -2.416 1.00 0.00 C ATOM 173 C TYR A 926 6.848 -3.041 -2.774 1.00 0.00 C ATOM 174 O TYR A 926 6.934 -2.116 -1.968 1.00 0.00 O ATOM 175 CB TYR A 926 7.066 -5.383 -1.951 1.00 0.00 C ATOM 176 CG TYR A 926 6.429 -6.507 -1.132 1.00 0.00 C ATOM 177 CD1 TYR A 926 5.272 -7.113 -1.576 1.00 0.00 C ATOM 178 CD2 TYR A 926 7.012 -6.914 0.051 1.00 0.00 C ATOM 179 CE1 TYR A 926 4.672 -8.171 -0.804 1.00 0.00 C ATOM 180 CE2 TYR A 926 6.412 -7.972 0.822 1.00 0.00 C ATOM 181 CZ TYR A 926 5.272 -8.548 0.356 1.00 0.00 C ATOM 182 OH TYR A 926 4.705 -9.548 1.085 1.00 0.00 O ATOM 0 H TYR A 926 5.773 -5.765 -3.896 1.00 0.00 H new ATOM 0 HA TYR A 926 5.349 -4.054 -1.646 1.00 0.00 H new ATOM 0 HB2 TYR A 926 7.554 -5.816 -2.824 1.00 0.00 H new ATOM 0 HB3 TYR A 926 7.844 -4.908 -1.353 1.00 0.00 H new ATOM 0 HD1 TYR A 926 4.816 -6.794 -2.502 1.00 0.00 H new ATOM 0 HD2 TYR A 926 7.918 -6.439 0.398 1.00 0.00 H new ATOM 0 HE1 TYR A 926 3.766 -8.654 -1.139 1.00 0.00 H new ATOM 0 HE2 TYR A 926 6.857 -8.300 1.749 1.00 0.00 H new ATOM 0 HH TYR A 926 4.914 -9.420 2.034 1.00 0.00 H new ATOM 192 N GLU A 927 7.389 -3.037 -3.983 1.00 0.00 N ATOM 193 CA GLU A 927 8.151 -1.894 -4.457 1.00 0.00 C ATOM 194 C GLU A 927 7.233 -0.684 -4.642 1.00 0.00 C ATOM 195 O GLU A 927 7.354 0.308 -3.924 1.00 0.00 O ATOM 196 CB GLU A 927 8.887 -2.227 -5.756 1.00 0.00 C ATOM 197 CG GLU A 927 10.272 -2.809 -5.467 1.00 0.00 C ATOM 198 CD GLU A 927 11.350 -1.726 -5.548 1.00 0.00 C ATOM 199 OE1 GLU A 927 11.242 -0.758 -4.765 1.00 0.00 O ATOM 200 OE2 GLU A 927 12.258 -1.891 -6.391 1.00 0.00 O ATOM 0 H GLU A 927 7.315 -3.806 -4.648 1.00 0.00 H new ATOM 0 HA GLU A 927 8.901 -1.645 -3.706 1.00 0.00 H new ATOM 0 HB2 GLU A 927 8.303 -2.941 -6.337 1.00 0.00 H new ATOM 0 HB3 GLU A 927 8.986 -1.327 -6.363 1.00 0.00 H new ATOM 0 HG2 GLU A 927 10.280 -3.262 -4.476 1.00 0.00 H new ATOM 0 HG3 GLU A 927 10.494 -3.602 -6.182 1.00 0.00 H new ATOM 207 N ASN A 928 6.335 -0.805 -5.609 1.00 0.00 N ATOM 208 CA ASN A 928 5.397 0.267 -5.897 1.00 0.00 C ATOM 209 C ASN A 928 4.816 0.797 -4.585 1.00 0.00 C ATOM 210 O ASN A 928 4.655 2.005 -4.416 1.00 0.00 O ATOM 211 CB ASN A 928 4.237 -0.234 -6.760 1.00 0.00 C ATOM 212 CG ASN A 928 4.736 -0.717 -8.123 1.00 0.00 C ATOM 213 OD1 ASN A 928 5.614 -1.557 -8.229 1.00 0.00 O ATOM 214 ND2 ASN A 928 4.128 -0.141 -9.156 1.00 0.00 N ATOM 0 H ASN A 928 6.237 -1.629 -6.203 1.00 0.00 H new ATOM 0 HA ASN A 928 5.934 1.050 -6.433 1.00 0.00 H new ATOM 0 HB2 ASN A 928 3.723 -1.047 -6.248 1.00 0.00 H new ATOM 0 HB3 ASN A 928 3.510 0.566 -6.898 1.00 0.00 H new ATOM 0 HD21 ASN A 928 4.389 -0.396 -10.108 1.00 0.00 H new ATOM 0 HD22 ASN A 928 3.400 0.556 -8.996 1.00 0.00 H new ATOM 221 N VAL A 929 4.517 -0.132 -3.689 1.00 0.00 N ATOM 222 CA VAL A 929 3.957 0.227 -2.397 1.00 0.00 C ATOM 223 C VAL A 929 4.889 1.221 -1.701 1.00 0.00 C ATOM 224 O VAL A 929 4.506 2.362 -1.447 1.00 0.00 O ATOM 225 CB VAL A 929 3.703 -1.034 -1.568 1.00 0.00 C ATOM 226 CG1 VAL A 929 3.873 -0.752 -0.074 1.00 0.00 C ATOM 227 CG2 VAL A 929 2.318 -1.614 -1.863 1.00 0.00 C ATOM 0 H VAL A 929 4.652 -1.133 -3.832 1.00 0.00 H new ATOM 0 HA VAL A 929 2.992 0.718 -2.522 1.00 0.00 H new ATOM 0 HB VAL A 929 4.446 -1.778 -1.854 1.00 0.00 H new ATOM 0 HG11 VAL A 929 3.687 -1.665 0.492 1.00 0.00 H new ATOM 0 HG12 VAL A 929 4.889 -0.407 0.118 1.00 0.00 H new ATOM 0 HG13 VAL A 929 3.164 0.017 0.234 1.00 0.00 H new ATOM 0 HG21 VAL A 929 2.163 -2.509 -1.261 1.00 0.00 H new ATOM 0 HG22 VAL A 929 1.555 -0.875 -1.618 1.00 0.00 H new ATOM 0 HG23 VAL A 929 2.249 -1.871 -2.920 1.00 0.00 H new ATOM 237 N THR A 930 6.094 0.752 -1.412 1.00 0.00 N ATOM 238 CA THR A 930 7.083 1.586 -0.751 1.00 0.00 C ATOM 239 C THR A 930 7.304 2.878 -1.539 1.00 0.00 C ATOM 240 O THR A 930 6.994 3.966 -1.056 1.00 0.00 O ATOM 241 CB THR A 930 8.356 0.758 -0.572 1.00 0.00 C ATOM 242 OG1 THR A 930 8.473 0.031 -1.792 1.00 0.00 O ATOM 243 CG2 THR A 930 8.203 -0.328 0.495 1.00 0.00 C ATOM 0 H THR A 930 6.408 -0.195 -1.624 1.00 0.00 H new ATOM 0 HA THR A 930 6.741 1.899 0.235 1.00 0.00 H new ATOM 0 HB THR A 930 9.182 1.417 -0.304 1.00 0.00 H new ATOM 0 HG1 THR A 930 8.171 -0.891 -1.654 1.00 0.00 H new ATOM 0 HG21 THR A 930 9.135 -0.886 0.582 1.00 0.00 H new ATOM 0 HG22 THR A 930 7.966 0.134 1.453 1.00 0.00 H new ATOM 0 HG23 THR A 930 7.399 -1.007 0.211 1.00 0.00 H new ATOM 251 N GLY A 931 7.840 2.716 -2.740 1.00 0.00 N ATOM 252 CA GLY A 931 8.107 3.856 -3.601 1.00 0.00 C ATOM 253 C GLY A 931 7.025 4.927 -3.445 1.00 0.00 C ATOM 254 O GLY A 931 7.317 6.121 -3.486 1.00 0.00 O ATOM 0 H GLY A 931 8.097 1.812 -3.137 1.00 0.00 H new ATOM 0 HA2 GLY A 931 9.081 4.280 -3.357 1.00 0.00 H new ATOM 0 HA3 GLY A 931 8.153 3.529 -4.640 1.00 0.00 H new ATOM 258 N LEU A 932 5.797 4.460 -3.268 1.00 0.00 N ATOM 259 CA LEU A 932 4.670 5.362 -3.105 1.00 0.00 C ATOM 260 C LEU A 932 4.790 6.084 -1.761 1.00 0.00 C ATOM 261 O LEU A 932 5.088 7.277 -1.718 1.00 0.00 O ATOM 262 CB LEU A 932 3.350 4.608 -3.282 1.00 0.00 C ATOM 263 CG LEU A 932 2.157 5.152 -2.494 1.00 0.00 C ATOM 264 CD1 LEU A 932 0.958 5.394 -3.413 1.00 0.00 C ATOM 265 CD2 LEU A 932 1.805 4.230 -1.325 1.00 0.00 C ATOM 0 H LEU A 932 5.559 3.469 -3.234 1.00 0.00 H new ATOM 0 HA LEU A 932 4.680 6.128 -3.881 1.00 0.00 H new ATOM 0 HB2 LEU A 932 3.092 4.610 -4.341 1.00 0.00 H new ATOM 0 HB3 LEU A 932 3.507 3.568 -2.994 1.00 0.00 H new ATOM 0 HG LEU A 932 2.439 6.116 -2.070 1.00 0.00 H new ATOM 0 HD11 LEU A 932 0.123 5.781 -2.828 1.00 0.00 H new ATOM 0 HD12 LEU A 932 1.229 6.118 -4.181 1.00 0.00 H new ATOM 0 HD13 LEU A 932 0.666 4.456 -3.885 1.00 0.00 H new ATOM 0 HD21 LEU A 932 0.954 4.640 -0.782 1.00 0.00 H new ATOM 0 HD22 LEU A 932 1.550 3.241 -1.706 1.00 0.00 H new ATOM 0 HD23 LEU A 932 2.660 4.151 -0.654 1.00 0.00 H new ATOM 277 N VAL A 933 4.553 5.331 -0.697 1.00 0.00 N ATOM 278 CA VAL A 933 4.631 5.884 0.644 1.00 0.00 C ATOM 279 C VAL A 933 5.934 6.672 0.791 1.00 0.00 C ATOM 280 O VAL A 933 5.995 7.643 1.543 1.00 0.00 O ATOM 281 CB VAL A 933 4.487 4.768 1.680 1.00 0.00 C ATOM 282 CG1 VAL A 933 3.042 4.270 1.752 1.00 0.00 C ATOM 283 CG2 VAL A 933 5.449 3.616 1.382 1.00 0.00 C ATOM 0 H VAL A 933 4.307 4.342 -0.737 1.00 0.00 H new ATOM 0 HA VAL A 933 3.809 6.579 0.819 1.00 0.00 H new ATOM 0 HB VAL A 933 4.749 5.180 2.655 1.00 0.00 H new ATOM 0 HG11 VAL A 933 2.967 3.477 2.496 1.00 0.00 H new ATOM 0 HG12 VAL A 933 2.387 5.094 2.033 1.00 0.00 H new ATOM 0 HG13 VAL A 933 2.741 3.883 0.778 1.00 0.00 H new ATOM 0 HG21 VAL A 933 5.326 2.836 2.133 1.00 0.00 H new ATOM 0 HG22 VAL A 933 5.232 3.207 0.395 1.00 0.00 H new ATOM 0 HG23 VAL A 933 6.475 3.984 1.405 1.00 0.00 H new ATOM 293 N LYS A 934 6.945 6.224 0.061 1.00 0.00 N ATOM 294 CA LYS A 934 8.243 6.875 0.100 1.00 0.00 C ATOM 295 C LYS A 934 8.099 8.321 -0.378 1.00 0.00 C ATOM 296 O LYS A 934 8.736 9.224 0.162 1.00 0.00 O ATOM 297 CB LYS A 934 9.273 6.065 -0.690 1.00 0.00 C ATOM 298 CG LYS A 934 9.693 4.811 0.080 1.00 0.00 C ATOM 299 CD LYS A 934 11.212 4.756 0.250 1.00 0.00 C ATOM 300 CE LYS A 934 11.590 4.325 1.669 1.00 0.00 C ATOM 301 NZ LYS A 934 13.040 4.509 1.898 1.00 0.00 N ATOM 0 H LYS A 934 6.891 5.418 -0.561 1.00 0.00 H new ATOM 0 HA LYS A 934 8.619 6.914 1.122 1.00 0.00 H new ATOM 0 HB2 LYS A 934 8.854 5.780 -1.655 1.00 0.00 H new ATOM 0 HB3 LYS A 934 10.148 6.682 -0.892 1.00 0.00 H new ATOM 0 HG2 LYS A 934 9.213 4.803 1.059 1.00 0.00 H new ATOM 0 HG3 LYS A 934 9.350 3.922 -0.450 1.00 0.00 H new ATOM 0 HD2 LYS A 934 11.637 4.058 -0.471 1.00 0.00 H new ATOM 0 HD3 LYS A 934 11.641 5.735 0.037 1.00 0.00 H new ATOM 0 HE2 LYS A 934 11.024 4.909 2.395 1.00 0.00 H new ATOM 0 HE3 LYS A 934 11.322 3.280 1.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 13.279 4.212 2.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 13.575 3.933 1.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 13.287 5.512 1.773 1.00 0.00 H new ATOM 315 N ALA A 935 7.257 8.496 -1.386 1.00 0.00 N ATOM 316 CA ALA A 935 7.021 9.817 -1.943 1.00 0.00 C ATOM 317 C ALA A 935 6.041 10.576 -1.047 1.00 0.00 C ATOM 318 O ALA A 935 6.293 11.721 -0.676 1.00 0.00 O ATOM 319 CB ALA A 935 6.513 9.681 -3.380 1.00 0.00 C ATOM 0 H ALA A 935 6.730 7.745 -1.831 1.00 0.00 H new ATOM 0 HA ALA A 935 7.947 10.391 -1.977 1.00 0.00 H new ATOM 0 HB1 ALA A 935 6.336 10.672 -3.799 1.00 0.00 H new ATOM 0 HB2 ALA A 935 7.258 9.161 -3.982 1.00 0.00 H new ATOM 0 HB3 ALA A 935 5.583 9.113 -3.385 1.00 0.00 H new ATOM 325 N VAL A 936 4.943 9.907 -0.726 1.00 0.00 N ATOM 326 CA VAL A 936 3.924 10.504 0.120 1.00 0.00 C ATOM 327 C VAL A 936 4.596 11.361 1.195 1.00 0.00 C ATOM 328 O VAL A 936 4.112 12.442 1.525 1.00 0.00 O ATOM 329 CB VAL A 936 3.022 9.414 0.702 1.00 0.00 C ATOM 330 CG1 VAL A 936 2.341 9.893 1.986 1.00 0.00 C ATOM 331 CG2 VAL A 936 1.988 8.951 -0.327 1.00 0.00 C ATOM 0 H VAL A 936 4.737 8.958 -1.037 1.00 0.00 H new ATOM 0 HA VAL A 936 3.281 11.162 -0.464 1.00 0.00 H new ATOM 0 HB VAL A 936 3.650 8.559 0.955 1.00 0.00 H new ATOM 0 HG11 VAL A 936 1.706 9.099 2.379 1.00 0.00 H new ATOM 0 HG12 VAL A 936 3.099 10.151 2.726 1.00 0.00 H new ATOM 0 HG13 VAL A 936 1.732 10.771 1.769 1.00 0.00 H new ATOM 0 HG21 VAL A 936 1.360 8.176 0.112 1.00 0.00 H new ATOM 0 HG22 VAL A 936 1.367 9.796 -0.625 1.00 0.00 H new ATOM 0 HG23 VAL A 936 2.500 8.551 -1.202 1.00 0.00 H new ATOM 341 N ILE A 937 5.702 10.844 1.712 1.00 0.00 N ATOM 342 CA ILE A 937 6.446 11.548 2.743 1.00 0.00 C ATOM 343 C ILE A 937 7.399 12.548 2.085 1.00 0.00 C ATOM 344 O ILE A 937 7.210 13.758 2.199 1.00 0.00 O ATOM 345 CB ILE A 937 7.144 10.554 3.673 1.00 0.00 C ATOM 346 CG1 ILE A 937 6.125 9.778 4.510 1.00 0.00 C ATOM 347 CG2 ILE A 937 8.185 11.257 4.545 1.00 0.00 C ATOM 348 CD1 ILE A 937 6.588 8.338 4.742 1.00 0.00 C ATOM 0 H ILE A 937 6.100 9.946 1.436 1.00 0.00 H new ATOM 0 HA ILE A 937 5.770 12.121 3.377 1.00 0.00 H new ATOM 0 HB ILE A 937 7.676 9.828 3.059 1.00 0.00 H new ATOM 0 HG12 ILE A 937 5.982 10.276 5.469 1.00 0.00 H new ATOM 0 HG13 ILE A 937 5.160 9.776 4.004 1.00 0.00 H new ATOM 0 HG21 ILE A 937 8.666 10.528 5.197 1.00 0.00 H new ATOM 0 HG22 ILE A 937 8.936 11.726 3.909 1.00 0.00 H new ATOM 0 HG23 ILE A 937 7.696 12.019 5.152 1.00 0.00 H new ATOM 0 HD11 ILE A 937 5.846 7.809 5.339 1.00 0.00 H new ATOM 0 HD12 ILE A 937 6.707 7.835 3.782 1.00 0.00 H new ATOM 0 HD13 ILE A 937 7.542 8.343 5.270 1.00 0.00 H new ATOM 360 N GLU A 938 8.402 12.005 1.411 1.00 0.00 N ATOM 361 CA GLU A 938 9.385 12.835 0.735 1.00 0.00 C ATOM 362 C GLU A 938 8.734 14.124 0.230 1.00 0.00 C ATOM 363 O GLU A 938 9.256 15.216 0.451 1.00 0.00 O ATOM 364 CB GLU A 938 10.051 12.072 -0.411 1.00 0.00 C ATOM 365 CG GLU A 938 11.551 11.903 -0.159 1.00 0.00 C ATOM 366 CD GLU A 938 11.875 10.475 0.285 1.00 0.00 C ATOM 367 OE1 GLU A 938 11.641 9.560 -0.534 1.00 0.00 O ATOM 368 OE2 GLU A 938 12.349 10.331 1.432 1.00 0.00 O ATOM 0 H GLU A 938 8.555 11.001 1.318 1.00 0.00 H new ATOM 0 HA GLU A 938 10.162 13.100 1.452 1.00 0.00 H new ATOM 0 HB2 GLU A 938 9.584 11.093 -0.520 1.00 0.00 H new ATOM 0 HB3 GLU A 938 9.894 12.606 -1.348 1.00 0.00 H new ATOM 0 HG2 GLU A 938 12.105 12.140 -1.067 1.00 0.00 H new ATOM 0 HG3 GLU A 938 11.877 12.608 0.606 1.00 0.00 H new ATOM 375 N MET A 939 7.602 13.956 -0.439 1.00 0.00 N ATOM 376 CA MET A 939 6.875 15.092 -0.977 1.00 0.00 C ATOM 377 C MET A 939 6.733 16.199 0.070 1.00 0.00 C ATOM 378 O MET A 939 7.300 17.280 -0.083 1.00 0.00 O ATOM 379 CB MET A 939 5.486 14.640 -1.433 1.00 0.00 C ATOM 380 CG MET A 939 4.559 15.840 -1.640 1.00 0.00 C ATOM 381 SD MET A 939 3.555 15.591 -3.094 1.00 0.00 S ATOM 382 CE MET A 939 3.258 13.835 -2.970 1.00 0.00 C ATOM 0 H MET A 939 7.171 13.049 -0.620 1.00 0.00 H new ATOM 0 HA MET A 939 7.435 15.489 -1.824 1.00 0.00 H new ATOM 0 HB2 MET A 939 5.570 14.076 -2.362 1.00 0.00 H new ATOM 0 HB3 MET A 939 5.056 13.968 -0.690 1.00 0.00 H new ATOM 0 HG2 MET A 939 3.921 15.973 -0.766 1.00 0.00 H new ATOM 0 HG3 MET A 939 5.148 16.751 -1.746 1.00 0.00 H new ATOM 0 HE1 MET A 939 2.345 13.582 -3.508 1.00 0.00 H new ATOM 0 HE2 MET A 939 4.097 13.292 -3.405 1.00 0.00 H new ATOM 0 HE3 MET A 939 3.150 13.557 -1.921 1.00 0.00 H new ATOM 392 N SER A 940 5.975 15.890 1.112 1.00 0.00 N ATOM 393 CA SER A 940 5.752 16.845 2.184 1.00 0.00 C ATOM 394 C SER A 940 7.035 17.630 2.461 1.00 0.00 C ATOM 395 O SER A 940 6.986 18.825 2.749 1.00 0.00 O ATOM 396 CB SER A 940 5.275 16.142 3.457 1.00 0.00 C ATOM 397 OG SER A 940 4.371 15.078 3.173 1.00 0.00 O ATOM 0 H SER A 940 5.508 14.992 1.237 1.00 0.00 H new ATOM 0 HA SER A 940 4.971 17.537 1.868 1.00 0.00 H new ATOM 0 HB2 SER A 940 6.136 15.751 3.999 1.00 0.00 H new ATOM 0 HB3 SER A 940 4.789 16.866 4.110 1.00 0.00 H new ATOM 0 HG SER A 940 4.091 14.654 4.011 1.00 0.00 H new ATOM 403 N SER A 941 8.154 16.928 2.362 1.00 0.00 N ATOM 404 CA SER A 941 9.448 17.544 2.598 1.00 0.00 C ATOM 405 C SER A 941 9.711 18.627 1.549 1.00 0.00 C ATOM 406 O SER A 941 10.039 19.762 1.892 1.00 0.00 O ATOM 407 CB SER A 941 10.568 16.502 2.577 1.00 0.00 C ATOM 408 OG SER A 941 11.739 16.962 3.245 1.00 0.00 O ATOM 0 H SER A 941 8.191 15.938 2.121 1.00 0.00 H new ATOM 0 HA SER A 941 9.433 18.001 3.588 1.00 0.00 H new ATOM 0 HB2 SER A 941 10.218 15.584 3.050 1.00 0.00 H new ATOM 0 HB3 SER A 941 10.814 16.255 1.544 1.00 0.00 H new ATOM 0 HG SER A 941 12.429 16.267 3.211 1.00 0.00 H new ATOM 414 N LYS A 942 9.557 18.237 0.292 1.00 0.00 N ATOM 415 CA LYS A 942 9.774 19.160 -0.809 1.00 0.00 C ATOM 416 C LYS A 942 8.426 19.705 -1.285 1.00 0.00 C ATOM 417 O LYS A 942 8.289 20.115 -2.436 1.00 0.00 O ATOM 418 CB LYS A 942 10.592 18.491 -1.916 1.00 0.00 C ATOM 419 CG LYS A 942 9.984 17.142 -2.307 1.00 0.00 C ATOM 420 CD LYS A 942 9.920 16.990 -3.828 1.00 0.00 C ATOM 421 CE LYS A 942 8.820 17.874 -4.421 1.00 0.00 C ATOM 422 NZ LYS A 942 9.412 18.996 -5.184 1.00 0.00 N ATOM 0 H LYS A 942 9.285 17.295 0.012 1.00 0.00 H new ATOM 0 HA LYS A 942 10.365 20.014 -0.479 1.00 0.00 H new ATOM 0 HB2 LYS A 942 10.632 19.143 -2.789 1.00 0.00 H new ATOM 0 HB3 LYS A 942 11.618 18.347 -1.579 1.00 0.00 H new ATOM 0 HG2 LYS A 942 10.579 16.334 -1.882 1.00 0.00 H new ATOM 0 HG3 LYS A 942 8.982 17.055 -1.887 1.00 0.00 H new ATOM 0 HD2 LYS A 942 10.882 17.258 -4.265 1.00 0.00 H new ATOM 0 HD3 LYS A 942 9.732 15.948 -4.085 1.00 0.00 H new ATOM 0 HE2 LYS A 942 8.180 17.280 -5.074 1.00 0.00 H new ATOM 0 HE3 LYS A 942 8.188 18.263 -3.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 8.735 19.323 -5.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 9.633 19.778 -4.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 10.284 18.676 -5.651 1.00 0.00 H new ATOM 436 N ILE A 943 7.464 19.694 -0.373 1.00 0.00 N ATOM 437 CA ILE A 943 6.132 20.182 -0.685 1.00 0.00 C ATOM 438 C ILE A 943 6.024 21.652 -0.275 1.00 0.00 C ATOM 439 O ILE A 943 5.582 22.488 -1.062 1.00 0.00 O ATOM 440 CB ILE A 943 5.069 19.286 -0.046 1.00 0.00 C ATOM 441 CG1 ILE A 943 3.937 18.989 -1.031 1.00 0.00 C ATOM 442 CG2 ILE A 943 4.550 19.895 1.258 1.00 0.00 C ATOM 443 CD1 ILE A 943 2.772 19.960 -0.836 1.00 0.00 C ATOM 0 H ILE A 943 7.581 19.355 0.582 1.00 0.00 H new ATOM 0 HA ILE A 943 5.951 20.135 -1.759 1.00 0.00 H new ATOM 0 HB ILE A 943 5.533 18.333 0.207 1.00 0.00 H new ATOM 0 HG12 ILE A 943 4.310 19.064 -2.052 1.00 0.00 H new ATOM 0 HG13 ILE A 943 3.589 17.965 -0.893 1.00 0.00 H new ATOM 0 HG21 ILE A 943 3.796 19.238 1.691 1.00 0.00 H new ATOM 0 HG22 ILE A 943 5.376 20.011 1.959 1.00 0.00 H new ATOM 0 HG23 ILE A 943 4.108 20.870 1.053 1.00 0.00 H new ATOM 0 HD11 ILE A 943 1.981 19.727 -1.549 1.00 0.00 H new ATOM 0 HD12 ILE A 943 2.386 19.866 0.179 1.00 0.00 H new ATOM 0 HD13 ILE A 943 3.118 20.981 -0.999 1.00 0.00 H new ATOM 455 N GLN A 944 6.435 21.923 0.955 1.00 0.00 N ATOM 456 CA GLN A 944 6.389 23.277 1.478 1.00 0.00 C ATOM 457 C GLN A 944 6.928 24.265 0.441 1.00 0.00 C ATOM 458 O GLN A 944 6.261 25.243 0.106 1.00 0.00 O ATOM 459 CB GLN A 944 7.166 23.384 2.792 1.00 0.00 C ATOM 460 CG GLN A 944 6.321 24.056 3.876 1.00 0.00 C ATOM 461 CD GLN A 944 7.054 25.256 4.477 1.00 0.00 C ATOM 462 OE1 GLN A 944 8.254 25.237 4.696 1.00 0.00 O ATOM 463 NE2 GLN A 944 6.268 26.299 4.731 1.00 0.00 N ATOM 0 H GLN A 944 6.802 21.227 1.605 1.00 0.00 H new ATOM 0 HA GLN A 944 5.349 23.530 1.687 1.00 0.00 H new ATOM 0 HB2 GLN A 944 7.465 22.390 3.124 1.00 0.00 H new ATOM 0 HB3 GLN A 944 8.080 23.955 2.632 1.00 0.00 H new ATOM 0 HG2 GLN A 944 5.371 24.381 3.452 1.00 0.00 H new ATOM 0 HG3 GLN A 944 6.090 23.336 4.661 1.00 0.00 H new ATOM 0 HE21 GLN A 944 5.271 26.249 4.523 1.00 0.00 H new ATOM 0 HE22 GLN A 944 6.663 27.149 5.133 1.00 0.00 H new ATOM 472 N PRO A 945 8.160 23.968 -0.050 1.00 0.00 N ATOM 473 CA PRO A 945 8.796 24.818 -1.042 1.00 0.00 C ATOM 474 C PRO A 945 8.161 24.622 -2.420 1.00 0.00 C ATOM 475 O PRO A 945 7.784 25.591 -3.077 1.00 0.00 O ATOM 476 CB PRO A 945 10.266 24.435 -1.005 1.00 0.00 C ATOM 477 CG PRO A 945 10.325 23.071 -0.335 1.00 0.00 C ATOM 478 CD PRO A 945 8.979 22.818 0.324 1.00 0.00 C ATOM 0 HA PRO A 945 8.670 25.880 -0.829 1.00 0.00 H new ATOM 0 HB2 PRO A 945 10.684 24.395 -2.011 1.00 0.00 H new ATOM 0 HB3 PRO A 945 10.847 25.170 -0.447 1.00 0.00 H new ATOM 0 HG2 PRO A 945 10.543 22.295 -1.068 1.00 0.00 H new ATOM 0 HG3 PRO A 945 11.124 23.044 0.406 1.00 0.00 H new ATOM 0 HD2 PRO A 945 8.536 21.886 -0.026 1.00 0.00 H new ATOM 0 HD3 PRO A 945 9.077 22.737 1.407 1.00 0.00 H new ATOM 486 N ALA A 946 8.063 23.362 -2.817 1.00 0.00 N ATOM 487 CA ALA A 946 7.480 23.027 -4.105 1.00 0.00 C ATOM 488 C ALA A 946 6.367 24.024 -4.432 1.00 0.00 C ATOM 489 O ALA A 946 5.422 24.180 -3.659 1.00 0.00 O ATOM 490 CB ALA A 946 6.979 21.581 -4.078 1.00 0.00 C ATOM 0 H ALA A 946 8.377 22.561 -2.270 1.00 0.00 H new ATOM 0 HA ALA A 946 8.228 23.098 -4.895 1.00 0.00 H new ATOM 0 HB1 ALA A 946 6.542 21.329 -5.044 1.00 0.00 H new ATOM 0 HB2 ALA A 946 7.813 20.911 -3.872 1.00 0.00 H new ATOM 0 HB3 ALA A 946 6.225 21.472 -3.299 1.00 0.00 H new ATOM 496 N PRO A 947 6.518 24.690 -5.608 1.00 0.00 N ATOM 497 CA PRO A 947 5.537 25.668 -6.046 1.00 0.00 C ATOM 498 C PRO A 947 4.270 24.981 -6.559 1.00 0.00 C ATOM 499 O PRO A 947 4.197 23.753 -6.598 1.00 0.00 O ATOM 500 CB PRO A 947 6.245 26.484 -7.115 1.00 0.00 C ATOM 501 CG PRO A 947 7.429 25.644 -7.565 1.00 0.00 C ATOM 502 CD PRO A 947 7.624 24.531 -6.548 1.00 0.00 C ATOM 0 HA PRO A 947 5.193 26.311 -5.236 1.00 0.00 H new ATOM 0 HB2 PRO A 947 5.577 26.697 -7.950 1.00 0.00 H new ATOM 0 HB3 PRO A 947 6.576 27.444 -6.718 1.00 0.00 H new ATOM 0 HG2 PRO A 947 7.247 25.228 -8.556 1.00 0.00 H new ATOM 0 HG3 PRO A 947 8.327 26.257 -7.637 1.00 0.00 H new ATOM 0 HD2 PRO A 947 7.601 23.551 -7.024 1.00 0.00 H new ATOM 0 HD3 PRO A 947 8.587 24.618 -6.045 1.00 0.00 H new ATOM 510 N PRO A 948 3.277 25.824 -6.949 1.00 0.00 N ATOM 511 CA PRO A 948 2.016 25.310 -7.458 1.00 0.00 C ATOM 512 C PRO A 948 2.175 24.782 -8.885 1.00 0.00 C ATOM 513 O PRO A 948 1.311 24.063 -9.385 1.00 0.00 O ATOM 514 CB PRO A 948 1.048 26.478 -7.362 1.00 0.00 C ATOM 515 CG PRO A 948 1.910 27.725 -7.242 1.00 0.00 C ATOM 516 CD PRO A 948 3.327 27.282 -6.916 1.00 0.00 C ATOM 0 HA PRO A 948 1.649 24.457 -6.888 1.00 0.00 H new ATOM 0 HB2 PRO A 948 0.408 26.529 -8.243 1.00 0.00 H new ATOM 0 HB3 PRO A 948 0.392 26.372 -6.498 1.00 0.00 H new ATOM 0 HG2 PRO A 948 1.892 28.293 -8.172 1.00 0.00 H new ATOM 0 HG3 PRO A 948 1.526 28.381 -6.461 1.00 0.00 H new ATOM 0 HD2 PRO A 948 4.040 27.670 -7.643 1.00 0.00 H new ATOM 0 HD3 PRO A 948 3.640 27.645 -5.937 1.00 0.00 H new ATOM 524 N GLU A 949 3.286 25.159 -9.501 1.00 0.00 N ATOM 525 CA GLU A 949 3.570 24.732 -10.860 1.00 0.00 C ATOM 526 C GLU A 949 4.323 23.400 -10.852 1.00 0.00 C ATOM 527 O GLU A 949 4.247 22.634 -11.812 1.00 0.00 O ATOM 528 CB GLU A 949 4.357 25.802 -11.618 1.00 0.00 C ATOM 529 CG GLU A 949 3.521 26.397 -12.754 1.00 0.00 C ATOM 530 CD GLU A 949 3.863 25.736 -14.090 1.00 0.00 C ATOM 531 OE1 GLU A 949 5.036 25.331 -14.240 1.00 0.00 O ATOM 532 OE2 GLU A 949 2.943 25.649 -14.932 1.00 0.00 O ATOM 0 H GLU A 949 4.000 25.756 -9.083 1.00 0.00 H new ATOM 0 HA GLU A 949 2.623 24.588 -11.380 1.00 0.00 H new ATOM 0 HB2 GLU A 949 4.658 26.593 -10.930 1.00 0.00 H new ATOM 0 HB3 GLU A 949 5.271 25.367 -12.023 1.00 0.00 H new ATOM 0 HG2 GLU A 949 2.461 26.263 -12.539 1.00 0.00 H new ATOM 0 HG3 GLU A 949 3.700 27.470 -12.819 1.00 0.00 H new ATOM 539 N GLU A 950 5.034 23.165 -9.759 1.00 0.00 N ATOM 540 CA GLU A 950 5.800 21.939 -9.613 1.00 0.00 C ATOM 541 C GLU A 950 5.062 20.957 -8.702 1.00 0.00 C ATOM 542 O GLU A 950 5.418 19.781 -8.633 1.00 0.00 O ATOM 543 CB GLU A 950 7.205 22.231 -9.081 1.00 0.00 C ATOM 544 CG GLU A 950 8.274 21.635 -10.000 1.00 0.00 C ATOM 545 CD GLU A 950 8.727 22.655 -11.047 1.00 0.00 C ATOM 546 OE1 GLU A 950 9.635 23.445 -10.713 1.00 0.00 O ATOM 547 OE2 GLU A 950 8.154 22.620 -12.157 1.00 0.00 O ATOM 0 H GLU A 950 5.096 23.803 -8.966 1.00 0.00 H new ATOM 0 HA GLU A 950 5.907 21.481 -10.596 1.00 0.00 H new ATOM 0 HB2 GLU A 950 7.350 23.308 -8.999 1.00 0.00 H new ATOM 0 HB3 GLU A 950 7.311 21.818 -8.078 1.00 0.00 H new ATOM 0 HG2 GLU A 950 9.130 21.313 -9.407 1.00 0.00 H new ATOM 0 HG3 GLU A 950 7.879 20.749 -10.497 1.00 0.00 H new ATOM 554 N TYR A 951 4.047 21.474 -8.026 1.00 0.00 N ATOM 555 CA TYR A 951 3.255 20.657 -7.122 1.00 0.00 C ATOM 556 C TYR A 951 2.075 20.015 -7.855 1.00 0.00 C ATOM 557 O TYR A 951 1.645 18.918 -7.503 1.00 0.00 O ATOM 558 CB TYR A 951 2.718 21.610 -6.053 1.00 0.00 C ATOM 559 CG TYR A 951 1.731 20.962 -5.080 1.00 0.00 C ATOM 560 CD1 TYR A 951 2.029 19.744 -4.504 1.00 0.00 C ATOM 561 CD2 TYR A 951 0.542 21.595 -4.780 1.00 0.00 C ATOM 562 CE1 TYR A 951 1.100 19.134 -3.588 1.00 0.00 C ATOM 563 CE2 TYR A 951 -0.387 20.984 -3.864 1.00 0.00 C ATOM 564 CZ TYR A 951 -0.062 19.784 -3.314 1.00 0.00 C ATOM 565 OH TYR A 951 -0.940 19.208 -2.449 1.00 0.00 O ATOM 0 H TYR A 951 3.754 22.449 -8.086 1.00 0.00 H new ATOM 0 HA TYR A 951 3.860 19.854 -6.700 1.00 0.00 H new ATOM 0 HB2 TYR A 951 3.557 22.015 -5.487 1.00 0.00 H new ATOM 0 HB3 TYR A 951 2.229 22.451 -6.544 1.00 0.00 H new ATOM 0 HD1 TYR A 951 2.959 19.248 -4.740 1.00 0.00 H new ATOM 0 HD2 TYR A 951 0.308 22.548 -5.232 1.00 0.00 H new ATOM 0 HE1 TYR A 951 1.322 18.182 -3.129 1.00 0.00 H new ATOM 0 HE2 TYR A 951 -1.321 21.468 -3.620 1.00 0.00 H new ATOM 0 HH TYR A 951 -1.206 19.862 -1.769 1.00 0.00 H new ATOM 575 N VAL A 952 1.587 20.726 -8.860 1.00 0.00 N ATOM 576 CA VAL A 952 0.465 20.239 -9.645 1.00 0.00 C ATOM 577 C VAL A 952 0.753 18.808 -10.105 1.00 0.00 C ATOM 578 O VAL A 952 -0.103 17.932 -9.994 1.00 0.00 O ATOM 579 CB VAL A 952 0.185 21.195 -10.806 1.00 0.00 C ATOM 580 CG1 VAL A 952 -0.276 20.430 -12.048 1.00 0.00 C ATOM 581 CG2 VAL A 952 -0.840 22.258 -10.406 1.00 0.00 C ATOM 0 H VAL A 952 1.947 21.635 -9.149 1.00 0.00 H new ATOM 0 HA VAL A 952 -0.441 20.210 -9.040 1.00 0.00 H new ATOM 0 HB VAL A 952 1.117 21.704 -11.053 1.00 0.00 H new ATOM 0 HG11 VAL A 952 -0.468 21.133 -12.858 1.00 0.00 H new ATOM 0 HG12 VAL A 952 0.501 19.729 -12.353 1.00 0.00 H new ATOM 0 HG13 VAL A 952 -1.190 19.882 -11.819 1.00 0.00 H new ATOM 0 HG21 VAL A 952 -1.021 22.925 -11.249 1.00 0.00 H new ATOM 0 HG22 VAL A 952 -1.774 21.774 -10.119 1.00 0.00 H new ATOM 0 HG23 VAL A 952 -0.457 22.834 -9.564 1.00 0.00 H new ATOM 591 N PRO A 953 1.994 18.611 -10.626 1.00 0.00 N ATOM 592 CA PRO A 953 2.405 17.302 -11.104 1.00 0.00 C ATOM 593 C PRO A 953 2.709 16.363 -9.935 1.00 0.00 C ATOM 594 O PRO A 953 2.179 15.254 -9.870 1.00 0.00 O ATOM 595 CB PRO A 953 3.617 17.567 -11.983 1.00 0.00 C ATOM 596 CG PRO A 953 4.119 18.948 -11.596 1.00 0.00 C ATOM 597 CD PRO A 953 3.034 19.625 -10.774 1.00 0.00 C ATOM 0 HA PRO A 953 1.623 16.796 -11.669 1.00 0.00 H new ATOM 0 HB2 PRO A 953 4.387 16.813 -11.824 1.00 0.00 H new ATOM 0 HB3 PRO A 953 3.349 17.531 -13.039 1.00 0.00 H new ATOM 0 HG2 PRO A 953 5.042 18.871 -11.021 1.00 0.00 H new ATOM 0 HG3 PRO A 953 4.346 19.535 -12.486 1.00 0.00 H new ATOM 0 HD2 PRO A 953 3.414 19.947 -9.804 1.00 0.00 H new ATOM 0 HD3 PRO A 953 2.652 20.513 -11.277 1.00 0.00 H new ATOM 605 N MET A 954 3.561 16.840 -9.039 1.00 0.00 N ATOM 606 CA MET A 954 3.942 16.056 -7.876 1.00 0.00 C ATOM 607 C MET A 954 2.795 15.147 -7.429 1.00 0.00 C ATOM 608 O MET A 954 2.914 13.924 -7.476 1.00 0.00 O ATOM 609 CB MET A 954 4.325 16.996 -6.731 1.00 0.00 C ATOM 610 CG MET A 954 5.845 17.095 -6.589 1.00 0.00 C ATOM 611 SD MET A 954 6.314 18.774 -6.205 1.00 0.00 S ATOM 612 CE MET A 954 5.493 18.973 -4.632 1.00 0.00 C ATOM 0 H MET A 954 3.998 17.760 -9.095 1.00 0.00 H new ATOM 0 HA MET A 954 4.793 15.430 -8.145 1.00 0.00 H new ATOM 0 HB2 MET A 954 3.908 17.986 -6.914 1.00 0.00 H new ATOM 0 HB3 MET A 954 3.892 16.635 -5.798 1.00 0.00 H new ATOM 0 HG2 MET A 954 6.190 16.424 -5.803 1.00 0.00 H new ATOM 0 HG3 MET A 954 6.326 16.777 -7.514 1.00 0.00 H new ATOM 0 HE1 MET A 954 4.926 19.904 -4.632 1.00 0.00 H new ATOM 0 HE2 MET A 954 4.815 18.136 -4.467 1.00 0.00 H new ATOM 0 HE3 MET A 954 6.236 19.001 -3.835 1.00 0.00 H new ATOM 622 N VAL A 955 1.711 15.780 -7.005 1.00 0.00 N ATOM 623 CA VAL A 955 0.545 15.043 -6.550 1.00 0.00 C ATOM 624 C VAL A 955 0.078 14.099 -7.659 1.00 0.00 C ATOM 625 O VAL A 955 -0.112 12.907 -7.426 1.00 0.00 O ATOM 626 CB VAL A 955 -0.545 16.017 -6.096 1.00 0.00 C ATOM 627 CG1 VAL A 955 -1.898 15.313 -5.985 1.00 0.00 C ATOM 628 CG2 VAL A 955 -0.165 16.686 -4.773 1.00 0.00 C ATOM 0 H VAL A 955 1.616 16.795 -6.967 1.00 0.00 H new ATOM 0 HA VAL A 955 0.795 14.429 -5.685 1.00 0.00 H new ATOM 0 HB VAL A 955 -0.634 16.796 -6.853 1.00 0.00 H new ATOM 0 HG11 VAL A 955 -2.654 16.028 -5.661 1.00 0.00 H new ATOM 0 HG12 VAL A 955 -2.177 14.905 -6.957 1.00 0.00 H new ATOM 0 HG13 VAL A 955 -1.828 14.504 -5.258 1.00 0.00 H new ATOM 0 HG21 VAL A 955 -0.956 17.373 -4.472 1.00 0.00 H new ATOM 0 HG22 VAL A 955 -0.035 15.924 -4.004 1.00 0.00 H new ATOM 0 HG23 VAL A 955 0.767 17.238 -4.899 1.00 0.00 H new ATOM 638 N LYS A 956 -0.094 14.668 -8.844 1.00 0.00 N ATOM 639 CA LYS A 956 -0.535 13.892 -9.990 1.00 0.00 C ATOM 640 C LYS A 956 0.299 12.612 -10.085 1.00 0.00 C ATOM 641 O LYS A 956 -0.210 11.564 -10.478 1.00 0.00 O ATOM 642 CB LYS A 956 -0.499 14.745 -11.260 1.00 0.00 C ATOM 643 CG LYS A 956 -1.574 15.832 -11.220 1.00 0.00 C ATOM 644 CD LYS A 956 -2.839 15.380 -11.953 1.00 0.00 C ATOM 645 CE LYS A 956 -2.657 15.471 -13.469 1.00 0.00 C ATOM 646 NZ LYS A 956 -3.011 16.824 -13.953 1.00 0.00 N ATOM 0 H LYS A 956 0.064 15.657 -9.034 1.00 0.00 H new ATOM 0 HA LYS A 956 -1.574 13.588 -9.867 1.00 0.00 H new ATOM 0 HB2 LYS A 956 0.484 15.204 -11.366 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -0.651 14.110 -12.133 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -1.816 16.072 -10.184 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -1.191 16.744 -11.677 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -3.079 14.354 -11.673 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -3.682 15.999 -11.647 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -1.624 15.243 -13.732 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -3.283 14.727 -13.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -2.882 16.869 -14.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -4.004 17.028 -13.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -2.396 17.528 -13.496 1.00 0.00 H new ATOM 660 N GLU A 957 1.565 12.740 -9.718 1.00 0.00 N ATOM 661 CA GLU A 957 2.474 11.607 -9.757 1.00 0.00 C ATOM 662 C GLU A 957 1.986 10.503 -8.816 1.00 0.00 C ATOM 663 O GLU A 957 2.071 9.321 -9.145 1.00 0.00 O ATOM 664 CB GLU A 957 3.900 12.036 -9.407 1.00 0.00 C ATOM 665 CG GLU A 957 4.920 11.326 -10.300 1.00 0.00 C ATOM 666 CD GLU A 957 5.523 10.114 -9.587 1.00 0.00 C ATOM 667 OE1 GLU A 957 6.493 10.326 -8.828 1.00 0.00 O ATOM 668 OE2 GLU A 957 5.000 9.002 -9.817 1.00 0.00 O ATOM 0 H GLU A 957 1.983 13.611 -9.392 1.00 0.00 H new ATOM 0 HA GLU A 957 2.488 11.212 -10.773 1.00 0.00 H new ATOM 0 HB2 GLU A 957 3.998 13.115 -9.524 1.00 0.00 H new ATOM 0 HB3 GLU A 957 4.106 11.808 -8.361 1.00 0.00 H new ATOM 0 HG2 GLU A 957 4.439 11.006 -11.225 1.00 0.00 H new ATOM 0 HG3 GLU A 957 5.713 12.021 -10.577 1.00 0.00 H new ATOM 675 N VAL A 958 1.487 10.929 -7.666 1.00 0.00 N ATOM 676 CA VAL A 958 0.986 9.991 -6.675 1.00 0.00 C ATOM 677 C VAL A 958 -0.104 9.122 -7.307 1.00 0.00 C ATOM 678 O VAL A 958 -0.149 7.914 -7.079 1.00 0.00 O ATOM 679 CB VAL A 958 0.503 10.748 -5.436 1.00 0.00 C ATOM 680 CG1 VAL A 958 -1.009 10.975 -5.486 1.00 0.00 C ATOM 681 CG2 VAL A 958 0.904 10.014 -4.155 1.00 0.00 C ATOM 0 H VAL A 958 1.419 11.911 -7.398 1.00 0.00 H new ATOM 0 HA VAL A 958 1.782 9.324 -6.343 1.00 0.00 H new ATOM 0 HB VAL A 958 0.988 11.724 -5.430 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -1.326 11.515 -4.594 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -1.260 11.559 -6.372 1.00 0.00 H new ATOM 0 HG13 VAL A 958 -1.520 10.013 -5.529 1.00 0.00 H new ATOM 0 HG21 VAL A 958 0.549 10.573 -3.289 1.00 0.00 H new ATOM 0 HG22 VAL A 958 0.460 9.019 -4.152 1.00 0.00 H new ATOM 0 HG23 VAL A 958 1.990 9.927 -4.110 1.00 0.00 H new ATOM 691 N GLY A 959 -0.955 9.771 -8.088 1.00 0.00 N ATOM 692 CA GLY A 959 -2.041 9.073 -8.754 1.00 0.00 C ATOM 693 C GLY A 959 -1.506 7.950 -9.646 1.00 0.00 C ATOM 694 O GLY A 959 -2.094 6.872 -9.713 1.00 0.00 O ATOM 0 H GLY A 959 -0.914 10.773 -8.274 1.00 0.00 H new ATOM 0 HA2 GLY A 959 -2.722 8.659 -8.010 1.00 0.00 H new ATOM 0 HA3 GLY A 959 -2.616 9.777 -9.355 1.00 0.00 H new ATOM 698 N LEU A 960 -0.396 8.243 -10.308 1.00 0.00 N ATOM 699 CA LEU A 960 0.225 7.272 -11.193 1.00 0.00 C ATOM 700 C LEU A 960 0.761 6.103 -10.364 1.00 0.00 C ATOM 701 O LEU A 960 0.630 4.945 -10.760 1.00 0.00 O ATOM 702 CB LEU A 960 1.287 7.945 -12.066 1.00 0.00 C ATOM 703 CG LEU A 960 1.161 7.712 -13.573 1.00 0.00 C ATOM 704 CD1 LEU A 960 2.284 8.422 -14.332 1.00 0.00 C ATOM 705 CD2 LEU A 960 1.107 6.218 -13.895 1.00 0.00 C ATOM 0 H LEU A 960 0.089 9.138 -10.249 1.00 0.00 H new ATOM 0 HA LEU A 960 -0.510 6.862 -11.885 1.00 0.00 H new ATOM 0 HB2 LEU A 960 1.255 9.019 -11.880 1.00 0.00 H new ATOM 0 HB3 LEU A 960 2.268 7.595 -11.745 1.00 0.00 H new ATOM 0 HG LEU A 960 0.219 8.147 -13.909 1.00 0.00 H new ATOM 0 HD11 LEU A 960 2.172 8.241 -15.401 1.00 0.00 H new ATOM 0 HD12 LEU A 960 2.233 9.493 -14.138 1.00 0.00 H new ATOM 0 HD13 LEU A 960 3.248 8.038 -13.998 1.00 0.00 H new ATOM 0 HD21 LEU A 960 1.017 6.081 -14.973 1.00 0.00 H new ATOM 0 HD22 LEU A 960 2.019 5.737 -13.543 1.00 0.00 H new ATOM 0 HD23 LEU A 960 0.246 5.770 -13.400 1.00 0.00 H new ATOM 717 N ALA A 961 1.353 6.445 -9.229 1.00 0.00 N ATOM 718 CA ALA A 961 1.909 5.438 -8.342 1.00 0.00 C ATOM 719 C ALA A 961 0.769 4.698 -7.640 1.00 0.00 C ATOM 720 O ALA A 961 0.813 3.477 -7.495 1.00 0.00 O ATOM 721 CB ALA A 961 2.868 6.103 -7.353 1.00 0.00 C ATOM 0 H ALA A 961 1.460 7.406 -8.903 1.00 0.00 H new ATOM 0 HA ALA A 961 2.481 4.702 -8.907 1.00 0.00 H new ATOM 0 HB1 ALA A 961 3.285 5.348 -6.687 1.00 0.00 H new ATOM 0 HB2 ALA A 961 3.675 6.590 -7.900 1.00 0.00 H new ATOM 0 HB3 ALA A 961 2.328 6.846 -6.766 1.00 0.00 H new ATOM 727 N LEU A 962 -0.226 5.468 -7.222 1.00 0.00 N ATOM 728 CA LEU A 962 -1.376 4.900 -6.539 1.00 0.00 C ATOM 729 C LEU A 962 -2.180 4.050 -7.524 1.00 0.00 C ATOM 730 O LEU A 962 -2.676 2.982 -7.167 1.00 0.00 O ATOM 731 CB LEU A 962 -2.196 6.002 -5.865 1.00 0.00 C ATOM 732 CG LEU A 962 -3.716 5.866 -5.970 1.00 0.00 C ATOM 733 CD1 LEU A 962 -4.213 6.320 -7.344 1.00 0.00 C ATOM 734 CD2 LEU A 962 -4.163 4.440 -5.642 1.00 0.00 C ATOM 0 H LEU A 962 -0.259 6.480 -7.343 1.00 0.00 H new ATOM 0 HA LEU A 962 -1.054 4.238 -5.736 1.00 0.00 H new ATOM 0 HB2 LEU A 962 -1.926 6.034 -4.809 1.00 0.00 H new ATOM 0 HB3 LEU A 962 -1.906 6.959 -6.298 1.00 0.00 H new ATOM 0 HG LEU A 962 -4.170 6.524 -5.229 1.00 0.00 H new ATOM 0 HD11 LEU A 962 -5.297 6.213 -7.392 1.00 0.00 H new ATOM 0 HD12 LEU A 962 -3.944 7.364 -7.501 1.00 0.00 H new ATOM 0 HD13 LEU A 962 -3.753 5.706 -8.118 1.00 0.00 H new ATOM 0 HD21 LEU A 962 -5.248 4.371 -5.724 1.00 0.00 H new ATOM 0 HD22 LEU A 962 -3.701 3.744 -6.342 1.00 0.00 H new ATOM 0 HD23 LEU A 962 -3.859 4.188 -4.626 1.00 0.00 H new ATOM 746 N ARG A 963 -2.285 4.555 -8.744 1.00 0.00 N ATOM 747 CA ARG A 963 -3.021 3.855 -9.784 1.00 0.00 C ATOM 748 C ARG A 963 -2.364 2.506 -10.082 1.00 0.00 C ATOM 749 O ARG A 963 -3.032 1.473 -10.087 1.00 0.00 O ATOM 750 CB ARG A 963 -3.079 4.682 -11.069 1.00 0.00 C ATOM 751 CG ARG A 963 -3.935 3.986 -12.130 1.00 0.00 C ATOM 752 CD ARG A 963 -5.288 4.683 -12.286 1.00 0.00 C ATOM 753 NE ARG A 963 -5.272 5.559 -13.479 1.00 0.00 N ATOM 754 CZ ARG A 963 -6.148 6.550 -13.696 1.00 0.00 C ATOM 755 NH1 ARG A 963 -7.115 6.796 -12.802 1.00 0.00 N ATOM 756 NH2 ARG A 963 -6.056 7.294 -14.807 1.00 0.00 N ATOM 0 H ARG A 963 -1.873 5.441 -9.036 1.00 0.00 H new ATOM 0 HA ARG A 963 -4.037 3.696 -9.422 1.00 0.00 H new ATOM 0 HB2 ARG A 963 -3.491 5.668 -10.853 1.00 0.00 H new ATOM 0 HB3 ARG A 963 -2.071 4.835 -11.453 1.00 0.00 H new ATOM 0 HG2 ARG A 963 -3.409 3.987 -13.085 1.00 0.00 H new ATOM 0 HG3 ARG A 963 -4.089 2.943 -11.852 1.00 0.00 H new ATOM 0 HD2 ARG A 963 -6.080 3.940 -12.381 1.00 0.00 H new ATOM 0 HD3 ARG A 963 -5.508 5.272 -11.395 1.00 0.00 H new ATOM 0 HE ARG A 963 -4.549 5.398 -14.180 1.00 0.00 H new ATOM 0 HH11 ARG A 963 -7.184 6.229 -11.957 1.00 0.00 H new ATOM 0 HH12 ARG A 963 -7.782 7.550 -12.967 1.00 0.00 H new ATOM 0 HH21 ARG A 963 -5.319 7.106 -15.487 1.00 0.00 H new ATOM 0 HH22 ARG A 963 -6.723 8.048 -14.972 1.00 0.00 H new ATOM 770 N THR A 964 -1.062 2.558 -10.324 1.00 0.00 N ATOM 771 CA THR A 964 -0.307 1.353 -10.623 1.00 0.00 C ATOM 772 C THR A 964 -0.415 0.356 -9.468 1.00 0.00 C ATOM 773 O THR A 964 -0.317 -0.852 -9.675 1.00 0.00 O ATOM 774 CB THR A 964 1.132 1.764 -10.940 1.00 0.00 C ATOM 775 OG1 THR A 964 1.034 2.435 -12.193 1.00 0.00 O ATOM 776 CG2 THR A 964 2.033 0.562 -11.231 1.00 0.00 C ATOM 0 H THR A 964 -0.511 3.416 -10.319 1.00 0.00 H new ATOM 0 HA THR A 964 -0.712 0.837 -11.494 1.00 0.00 H new ATOM 0 HB THR A 964 1.540 2.330 -10.103 1.00 0.00 H new ATOM 0 HG1 THR A 964 0.897 3.393 -12.041 1.00 0.00 H new ATOM 0 HG21 THR A 964 3.043 0.909 -11.450 1.00 0.00 H new ATOM 0 HG22 THR A 964 2.055 -0.095 -10.361 1.00 0.00 H new ATOM 0 HG23 THR A 964 1.643 0.015 -12.089 1.00 0.00 H new ATOM 784 N LEU A 965 -0.614 0.900 -8.276 1.00 0.00 N ATOM 785 CA LEU A 965 -0.735 0.073 -7.087 1.00 0.00 C ATOM 786 C LEU A 965 -1.869 -0.935 -7.286 1.00 0.00 C ATOM 787 O LEU A 965 -1.654 -2.143 -7.188 1.00 0.00 O ATOM 788 CB LEU A 965 -0.901 0.947 -5.842 1.00 0.00 C ATOM 789 CG LEU A 965 -0.087 0.528 -4.616 1.00 0.00 C ATOM 790 CD1 LEU A 965 0.191 1.727 -3.708 1.00 0.00 C ATOM 791 CD2 LEU A 965 -0.775 -0.613 -3.864 1.00 0.00 C ATOM 0 H LEU A 965 -0.694 1.903 -8.108 1.00 0.00 H new ATOM 0 HA LEU A 965 0.178 -0.501 -6.927 1.00 0.00 H new ATOM 0 HB2 LEU A 965 -0.629 1.970 -6.102 1.00 0.00 H new ATOM 0 HB3 LEU A 965 -1.956 0.957 -5.567 1.00 0.00 H new ATOM 0 HG LEU A 965 0.877 0.152 -4.958 1.00 0.00 H new ATOM 0 HD11 LEU A 965 0.771 1.402 -2.844 1.00 0.00 H new ATOM 0 HD12 LEU A 965 0.754 2.479 -4.261 1.00 0.00 H new ATOM 0 HD13 LEU A 965 -0.753 2.155 -3.371 1.00 0.00 H new ATOM 0 HD21 LEU A 965 -0.175 -0.891 -2.997 1.00 0.00 H new ATOM 0 HD22 LEU A 965 -1.762 -0.288 -3.534 1.00 0.00 H new ATOM 0 HD23 LEU A 965 -0.879 -1.474 -4.525 1.00 0.00 H new ATOM 803 N LEU A 966 -3.050 -0.403 -7.563 1.00 0.00 N ATOM 804 CA LEU A 966 -4.217 -1.242 -7.777 1.00 0.00 C ATOM 805 C LEU A 966 -3.850 -2.387 -8.722 1.00 0.00 C ATOM 806 O LEU A 966 -4.085 -3.554 -8.410 1.00 0.00 O ATOM 807 CB LEU A 966 -5.400 -0.400 -8.260 1.00 0.00 C ATOM 808 CG LEU A 966 -6.093 0.456 -7.198 1.00 0.00 C ATOM 809 CD1 LEU A 966 -5.411 1.819 -7.063 1.00 0.00 C ATOM 810 CD2 LEU A 966 -7.588 0.590 -7.491 1.00 0.00 C ATOM 0 H LEU A 966 -3.224 0.599 -7.644 1.00 0.00 H new ATOM 0 HA LEU A 966 -4.539 -1.694 -6.839 1.00 0.00 H new ATOM 0 HB2 LEU A 966 -5.051 0.257 -9.057 1.00 0.00 H new ATOM 0 HB3 LEU A 966 -6.141 -1.068 -8.699 1.00 0.00 H new ATOM 0 HG LEU A 966 -5.998 -0.049 -6.237 1.00 0.00 H new ATOM 0 HD11 LEU A 966 -5.923 2.408 -6.302 1.00 0.00 H new ATOM 0 HD12 LEU A 966 -4.370 1.678 -6.773 1.00 0.00 H new ATOM 0 HD13 LEU A 966 -5.454 2.344 -8.018 1.00 0.00 H new ATOM 0 HD21 LEU A 966 -8.056 1.203 -6.721 1.00 0.00 H new ATOM 0 HD22 LEU A 966 -7.727 1.061 -8.464 1.00 0.00 H new ATOM 0 HD23 LEU A 966 -8.048 -0.398 -7.497 1.00 0.00 H new ATOM 822 N ALA A 967 -3.280 -2.015 -9.859 1.00 0.00 N ATOM 823 CA ALA A 967 -2.879 -2.997 -10.851 1.00 0.00 C ATOM 824 C ALA A 967 -1.880 -3.972 -10.223 1.00 0.00 C ATOM 825 O ALA A 967 -2.091 -5.183 -10.248 1.00 0.00 O ATOM 826 CB ALA A 967 -2.303 -2.280 -12.075 1.00 0.00 C ATOM 0 H ALA A 967 -3.087 -1.047 -10.115 1.00 0.00 H new ATOM 0 HA ALA A 967 -3.739 -3.577 -11.187 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -2.002 -3.017 -12.820 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -3.060 -1.622 -12.501 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -1.436 -1.690 -11.777 1.00 0.00 H new ATOM 832 N THR A 968 -0.814 -3.406 -9.676 1.00 0.00 N ATOM 833 CA THR A 968 0.217 -4.210 -9.043 1.00 0.00 C ATOM 834 C THR A 968 -0.401 -5.153 -8.009 1.00 0.00 C ATOM 835 O THR A 968 0.052 -6.285 -7.846 1.00 0.00 O ATOM 836 CB THR A 968 1.261 -3.260 -8.451 1.00 0.00 C ATOM 837 OG1 THR A 968 2.508 -3.862 -8.787 1.00 0.00 O ATOM 838 CG2 THR A 968 1.249 -3.256 -6.921 1.00 0.00 C ATOM 0 H THR A 968 -0.642 -2.401 -9.658 1.00 0.00 H new ATOM 0 HA THR A 968 0.716 -4.854 -9.767 1.00 0.00 H new ATOM 0 HB THR A 968 1.081 -2.249 -8.818 1.00 0.00 H new ATOM 0 HG1 THR A 968 3.241 -3.310 -8.443 1.00 0.00 H new ATOM 0 HG21 THR A 968 2.008 -2.566 -6.553 1.00 0.00 H new ATOM 0 HG22 THR A 968 0.268 -2.940 -6.566 1.00 0.00 H new ATOM 0 HG23 THR A 968 1.462 -4.260 -6.553 1.00 0.00 H new ATOM 846 N VAL A 969 -1.427 -4.651 -7.336 1.00 0.00 N ATOM 847 CA VAL A 969 -2.112 -5.435 -6.322 1.00 0.00 C ATOM 848 C VAL A 969 -2.782 -6.641 -6.982 1.00 0.00 C ATOM 849 O VAL A 969 -2.766 -7.742 -6.434 1.00 0.00 O ATOM 850 CB VAL A 969 -3.096 -4.550 -5.553 1.00 0.00 C ATOM 851 CG1 VAL A 969 -3.795 -5.342 -4.447 1.00 0.00 C ATOM 852 CG2 VAL A 969 -2.394 -3.315 -4.985 1.00 0.00 C ATOM 0 H VAL A 969 -1.800 -3.712 -7.473 1.00 0.00 H new ATOM 0 HA VAL A 969 -1.401 -5.819 -5.591 1.00 0.00 H new ATOM 0 HB VAL A 969 -3.858 -4.208 -6.253 1.00 0.00 H new ATOM 0 HG11 VAL A 969 -4.489 -4.690 -3.916 1.00 0.00 H new ATOM 0 HG12 VAL A 969 -4.344 -6.175 -4.887 1.00 0.00 H new ATOM 0 HG13 VAL A 969 -3.051 -5.726 -3.749 1.00 0.00 H new ATOM 0 HG21 VAL A 969 -3.115 -2.703 -4.443 1.00 0.00 H new ATOM 0 HG22 VAL A 969 -1.601 -3.628 -4.306 1.00 0.00 H new ATOM 0 HG23 VAL A 969 -1.965 -2.733 -5.801 1.00 0.00 H new ATOM 862 N ASP A 970 -3.356 -6.393 -8.151 1.00 0.00 N ATOM 863 CA ASP A 970 -4.031 -7.444 -8.892 1.00 0.00 C ATOM 864 C ASP A 970 -3.103 -8.655 -9.009 1.00 0.00 C ATOM 865 O ASP A 970 -3.549 -9.796 -8.898 1.00 0.00 O ATOM 866 CB ASP A 970 -4.386 -6.981 -10.306 1.00 0.00 C ATOM 867 CG ASP A 970 -5.393 -7.867 -11.043 1.00 0.00 C ATOM 868 OD1 ASP A 970 -4.934 -8.844 -11.673 1.00 0.00 O ATOM 869 OD2 ASP A 970 -6.598 -7.546 -10.959 1.00 0.00 O ATOM 0 H ASP A 970 -3.367 -5.479 -8.603 1.00 0.00 H new ATOM 0 HA ASP A 970 -4.946 -7.700 -8.357 1.00 0.00 H new ATOM 0 HB2 ASP A 970 -4.787 -5.969 -10.251 1.00 0.00 H new ATOM 0 HB3 ASP A 970 -3.471 -6.929 -10.896 1.00 0.00 H new ATOM 874 N GLU A 971 -1.830 -8.365 -9.233 1.00 0.00 N ATOM 875 CA GLU A 971 -0.836 -9.416 -9.368 1.00 0.00 C ATOM 876 C GLU A 971 -0.605 -10.104 -8.020 1.00 0.00 C ATOM 877 O GLU A 971 -0.155 -11.248 -7.972 1.00 0.00 O ATOM 878 CB GLU A 971 0.474 -8.863 -9.932 1.00 0.00 C ATOM 879 CG GLU A 971 0.385 -8.682 -11.449 1.00 0.00 C ATOM 880 CD GLU A 971 1.748 -8.905 -12.108 1.00 0.00 C ATOM 881 OE1 GLU A 971 2.523 -7.925 -12.154 1.00 0.00 O ATOM 882 OE2 GLU A 971 1.983 -10.049 -12.552 1.00 0.00 O ATOM 0 H GLU A 971 -1.464 -7.417 -9.324 1.00 0.00 H new ATOM 0 HA GLU A 971 -1.213 -10.157 -10.073 1.00 0.00 H new ATOM 0 HB2 GLU A 971 0.702 -7.907 -9.461 1.00 0.00 H new ATOM 0 HB3 GLU A 971 1.293 -9.541 -9.690 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -0.341 -9.383 -11.861 1.00 0.00 H new ATOM 0 HG3 GLU A 971 0.026 -7.679 -11.679 1.00 0.00 H new ATOM 889 N SER A 972 -0.924 -9.378 -6.959 1.00 0.00 N ATOM 890 CA SER A 972 -0.758 -9.904 -5.615 1.00 0.00 C ATOM 891 C SER A 972 -1.973 -10.750 -5.230 1.00 0.00 C ATOM 892 O SER A 972 -1.847 -11.720 -4.484 1.00 0.00 O ATOM 893 CB SER A 972 -0.555 -8.774 -4.603 1.00 0.00 C ATOM 894 OG SER A 972 0.679 -8.900 -3.902 1.00 0.00 O ATOM 0 H SER A 972 -1.297 -8.430 -7.003 1.00 0.00 H new ATOM 0 HA SER A 972 0.133 -10.532 -5.601 1.00 0.00 H new ATOM 0 HB2 SER A 972 -0.582 -7.815 -5.120 1.00 0.00 H new ATOM 0 HB3 SER A 972 -1.379 -8.774 -3.889 1.00 0.00 H new ATOM 0 HG SER A 972 1.382 -9.179 -4.525 1.00 0.00 H new ATOM 900 N LEU A 973 -3.122 -10.351 -5.755 1.00 0.00 N ATOM 901 CA LEU A 973 -4.359 -11.061 -5.475 1.00 0.00 C ATOM 902 C LEU A 973 -4.072 -12.562 -5.390 1.00 0.00 C ATOM 903 O LEU A 973 -4.426 -13.209 -4.406 1.00 0.00 O ATOM 904 CB LEU A 973 -5.430 -10.697 -6.505 1.00 0.00 C ATOM 905 CG LEU A 973 -6.706 -10.062 -5.950 1.00 0.00 C ATOM 906 CD1 LEU A 973 -7.921 -10.440 -6.800 1.00 0.00 C ATOM 907 CD2 LEU A 973 -6.902 -10.424 -4.476 1.00 0.00 C ATOM 0 H LEU A 973 -3.223 -9.545 -6.373 1.00 0.00 H new ATOM 0 HA LEU A 973 -4.763 -10.758 -4.509 1.00 0.00 H new ATOM 0 HB2 LEU A 973 -4.991 -10.010 -7.229 1.00 0.00 H new ATOM 0 HB3 LEU A 973 -5.705 -11.601 -7.049 1.00 0.00 H new ATOM 0 HG LEU A 973 -6.600 -8.979 -6.004 1.00 0.00 H new ATOM 0 HD11 LEU A 973 -8.815 -9.976 -6.384 1.00 0.00 H new ATOM 0 HD12 LEU A 973 -7.773 -10.091 -7.822 1.00 0.00 H new ATOM 0 HD13 LEU A 973 -8.042 -11.523 -6.801 1.00 0.00 H new ATOM 0 HD21 LEU A 973 -7.816 -9.960 -4.106 1.00 0.00 H new ATOM 0 HD22 LEU A 973 -6.978 -11.507 -4.374 1.00 0.00 H new ATOM 0 HD23 LEU A 973 -6.052 -10.064 -3.897 1.00 0.00 H new ATOM 919 N PRO A 974 -3.418 -13.084 -6.462 1.00 0.00 N ATOM 920 CA PRO A 974 -3.080 -14.496 -6.517 1.00 0.00 C ATOM 921 C PRO A 974 -1.899 -14.814 -5.597 1.00 0.00 C ATOM 922 O PRO A 974 -1.889 -15.846 -4.928 1.00 0.00 O ATOM 923 CB PRO A 974 -2.784 -14.773 -7.982 1.00 0.00 C ATOM 924 CG PRO A 974 -2.513 -13.418 -8.615 1.00 0.00 C ATOM 925 CD PRO A 974 -2.984 -12.347 -7.645 1.00 0.00 C ATOM 0 HA PRO A 974 -3.887 -15.136 -6.160 1.00 0.00 H new ATOM 0 HB2 PRO A 974 -1.923 -15.433 -8.089 1.00 0.00 H new ATOM 0 HB3 PRO A 974 -3.627 -15.268 -8.464 1.00 0.00 H new ATOM 0 HG2 PRO A 974 -1.450 -13.301 -8.826 1.00 0.00 H new ATOM 0 HG3 PRO A 974 -3.038 -13.329 -9.566 1.00 0.00 H new ATOM 0 HD2 PRO A 974 -2.181 -11.650 -7.405 1.00 0.00 H new ATOM 0 HD3 PRO A 974 -3.800 -11.761 -8.068 1.00 0.00 H new ATOM 933 N VAL A 975 -0.933 -13.908 -5.594 1.00 0.00 N ATOM 934 CA VAL A 975 0.250 -14.079 -4.768 1.00 0.00 C ATOM 935 C VAL A 975 -0.177 -14.363 -3.326 1.00 0.00 C ATOM 936 O VAL A 975 0.483 -15.122 -2.618 1.00 0.00 O ATOM 937 CB VAL A 975 1.157 -12.852 -4.892 1.00 0.00 C ATOM 938 CG1 VAL A 975 2.407 -13.005 -4.024 1.00 0.00 C ATOM 939 CG2 VAL A 975 1.531 -12.593 -6.353 1.00 0.00 C ATOM 0 H VAL A 975 -0.945 -13.053 -6.150 1.00 0.00 H new ATOM 0 HA VAL A 975 0.834 -14.934 -5.109 1.00 0.00 H new ATOM 0 HB VAL A 975 0.602 -11.986 -4.530 1.00 0.00 H new ATOM 0 HG11 VAL A 975 3.034 -12.120 -4.130 1.00 0.00 H new ATOM 0 HG12 VAL A 975 2.114 -13.119 -2.980 1.00 0.00 H new ATOM 0 HG13 VAL A 975 2.965 -13.886 -4.342 1.00 0.00 H new ATOM 0 HG21 VAL A 975 2.176 -11.716 -6.414 1.00 0.00 H new ATOM 0 HG22 VAL A 975 2.058 -13.459 -6.753 1.00 0.00 H new ATOM 0 HG23 VAL A 975 0.626 -12.419 -6.935 1.00 0.00 H new ATOM 949 N LEU A 976 -1.277 -13.738 -2.935 1.00 0.00 N ATOM 950 CA LEU A 976 -1.800 -13.915 -1.591 1.00 0.00 C ATOM 951 C LEU A 976 -3.083 -14.747 -1.652 1.00 0.00 C ATOM 952 O LEU A 976 -3.721 -14.833 -2.700 1.00 0.00 O ATOM 953 CB LEU A 976 -1.978 -12.560 -0.903 1.00 0.00 C ATOM 954 CG LEU A 976 -0.829 -11.564 -1.074 1.00 0.00 C ATOM 955 CD1 LEU A 976 0.512 -12.291 -1.196 1.00 0.00 C ATOM 956 CD2 LEU A 976 -1.084 -10.631 -2.259 1.00 0.00 C ATOM 0 H LEU A 976 -1.821 -13.108 -3.525 1.00 0.00 H new ATOM 0 HA LEU A 976 -1.090 -14.468 -0.976 1.00 0.00 H new ATOM 0 HB2 LEU A 976 -2.891 -12.100 -1.282 1.00 0.00 H new ATOM 0 HB3 LEU A 976 -2.127 -12.733 0.163 1.00 0.00 H new ATOM 0 HG LEU A 976 -0.779 -10.943 -0.180 1.00 0.00 H new ATOM 0 HD11 LEU A 976 1.312 -11.561 -1.317 1.00 0.00 H new ATOM 0 HD12 LEU A 976 0.690 -12.879 -0.296 1.00 0.00 H new ATOM 0 HD13 LEU A 976 0.490 -12.952 -2.063 1.00 0.00 H new ATOM 0 HD21 LEU A 976 -0.252 -9.933 -2.358 1.00 0.00 H new ATOM 0 HD22 LEU A 976 -1.175 -11.219 -3.172 1.00 0.00 H new ATOM 0 HD23 LEU A 976 -2.006 -10.075 -2.092 1.00 0.00 H new ATOM 968 N PRO A 977 -3.431 -15.353 -0.485 1.00 0.00 N ATOM 969 CA PRO A 977 -4.626 -16.175 -0.396 1.00 0.00 C ATOM 970 C PRO A 977 -5.886 -15.308 -0.362 1.00 0.00 C ATOM 971 O PRO A 977 -5.800 -14.081 -0.334 1.00 0.00 O ATOM 972 CB PRO A 977 -4.440 -17.003 0.864 1.00 0.00 C ATOM 973 CG PRO A 977 -3.376 -16.288 1.681 1.00 0.00 C ATOM 974 CD PRO A 977 -2.699 -15.272 0.775 1.00 0.00 C ATOM 0 HA PRO A 977 -4.759 -16.820 -1.264 1.00 0.00 H new ATOM 0 HB2 PRO A 977 -5.373 -17.081 1.421 1.00 0.00 H new ATOM 0 HB3 PRO A 977 -4.128 -18.019 0.621 1.00 0.00 H new ATOM 0 HG2 PRO A 977 -3.824 -15.793 2.542 1.00 0.00 H new ATOM 0 HG3 PRO A 977 -2.647 -17.001 2.067 1.00 0.00 H new ATOM 0 HD2 PRO A 977 -2.749 -14.269 1.198 1.00 0.00 H new ATOM 0 HD3 PRO A 977 -1.644 -15.507 0.636 1.00 0.00 H new ATOM 982 N ALA A 978 -7.028 -15.980 -0.365 1.00 0.00 N ATOM 983 CA ALA A 978 -8.304 -15.286 -0.335 1.00 0.00 C ATOM 984 C ALA A 978 -8.423 -14.503 0.974 1.00 0.00 C ATOM 985 O ALA A 978 -9.302 -13.654 1.116 1.00 0.00 O ATOM 986 CB ALA A 978 -9.439 -16.297 -0.515 1.00 0.00 C ATOM 0 H ALA A 978 -7.096 -16.997 -0.388 1.00 0.00 H new ATOM 0 HA ALA A 978 -8.371 -14.570 -1.154 1.00 0.00 H new ATOM 0 HB1 ALA A 978 -10.397 -15.777 -0.493 1.00 0.00 H new ATOM 0 HB2 ALA A 978 -9.325 -16.806 -1.472 1.00 0.00 H new ATOM 0 HB3 ALA A 978 -9.405 -17.030 0.291 1.00 0.00 H new ATOM 992 N SER A 979 -7.526 -14.816 1.897 1.00 0.00 N ATOM 993 CA SER A 979 -7.519 -14.152 3.190 1.00 0.00 C ATOM 994 C SER A 979 -7.316 -12.647 3.004 1.00 0.00 C ATOM 995 O SER A 979 -7.618 -11.861 3.900 1.00 0.00 O ATOM 996 CB SER A 979 -6.431 -14.726 4.098 1.00 0.00 C ATOM 997 OG SER A 979 -5.128 -14.307 3.701 1.00 0.00 O ATOM 0 H SER A 979 -6.799 -15.521 1.776 1.00 0.00 H new ATOM 0 HA SER A 979 -8.483 -14.326 3.669 1.00 0.00 H new ATOM 0 HB2 SER A 979 -6.615 -14.414 5.126 1.00 0.00 H new ATOM 0 HB3 SER A 979 -6.482 -15.815 4.082 1.00 0.00 H new ATOM 0 HG SER A 979 -4.461 -14.693 4.307 1.00 0.00 H new ATOM 1003 N THR A 980 -6.806 -12.291 1.834 1.00 0.00 N ATOM 1004 CA THR A 980 -6.559 -10.894 1.519 1.00 0.00 C ATOM 1005 C THR A 980 -7.602 -10.379 0.524 1.00 0.00 C ATOM 1006 O THR A 980 -7.271 -9.633 -0.396 1.00 0.00 O ATOM 1007 CB THR A 980 -5.122 -10.771 1.010 1.00 0.00 C ATOM 1008 OG1 THR A 980 -5.245 -10.862 -0.406 1.00 0.00 O ATOM 1009 CG2 THR A 980 -4.262 -11.979 1.387 1.00 0.00 C ATOM 0 H THR A 980 -6.557 -12.946 1.093 1.00 0.00 H new ATOM 0 HA THR A 980 -6.661 -10.265 2.404 1.00 0.00 H new ATOM 0 HB THR A 980 -4.671 -9.864 1.413 1.00 0.00 H new ATOM 0 HG1 THR A 980 -5.425 -11.791 -0.660 1.00 0.00 H new ATOM 0 HG21 THR A 980 -3.252 -11.841 1.002 1.00 0.00 H new ATOM 0 HG22 THR A 980 -4.226 -12.076 2.472 1.00 0.00 H new ATOM 0 HG23 THR A 980 -4.694 -12.882 0.956 1.00 0.00 H new ATOM 1017 N HIS A 981 -8.840 -10.798 0.743 1.00 0.00 N ATOM 1018 CA HIS A 981 -9.932 -10.389 -0.122 1.00 0.00 C ATOM 1019 C HIS A 981 -10.472 -9.034 0.339 1.00 0.00 C ATOM 1020 O HIS A 981 -9.936 -7.990 -0.030 1.00 0.00 O ATOM 1021 CB HIS A 981 -11.014 -11.469 -0.180 1.00 0.00 C ATOM 1022 CG HIS A 981 -10.817 -12.478 -1.286 1.00 0.00 C ATOM 1023 ND1 HIS A 981 -10.064 -12.419 -2.422 1.00 0.00 N flip ATOM 1024 CD2 HIS A 981 -11.436 -13.716 -1.291 1.00 0.00 C flip ATOM 1025 CE1 HIS A 981 -10.215 -13.559 -3.085 1.00 0.00 C flip ATOM 1026 NE2 HIS A 981 -11.065 -14.364 -2.386 1.00 0.00 N flip ATOM 0 H HIS A 981 -9.110 -11.417 1.507 1.00 0.00 H new ATOM 0 HA HIS A 981 -9.566 -10.268 -1.142 1.00 0.00 H new ATOM 0 HB2 HIS A 981 -11.041 -11.993 0.775 1.00 0.00 H new ATOM 0 HB3 HIS A 981 -11.985 -10.990 -0.308 1.00 0.00 H new ATOM 0 HD2 HIS A 981 -12.107 -14.090 -0.532 1.00 0.00 H new ATOM 0 HE1 HIS A 981 -9.742 -13.808 -4.024 1.00 0.00 H new ATOM 0 HE2 HIS A 981 -11.363 -15.301 -2.658 1.00 0.00 H new ATOM 1034 N ARG A 982 -11.527 -9.094 1.138 1.00 0.00 N ATOM 1035 CA ARG A 982 -12.145 -7.884 1.653 1.00 0.00 C ATOM 1036 C ARG A 982 -11.102 -7.011 2.353 1.00 0.00 C ATOM 1037 O ARG A 982 -11.068 -5.797 2.154 1.00 0.00 O ATOM 1038 CB ARG A 982 -13.267 -8.215 2.639 1.00 0.00 C ATOM 1039 CG ARG A 982 -14.551 -8.598 1.901 1.00 0.00 C ATOM 1040 CD ARG A 982 -15.689 -8.875 2.886 1.00 0.00 C ATOM 1041 NE ARG A 982 -16.849 -9.452 2.171 1.00 0.00 N ATOM 1042 CZ ARG A 982 -18.074 -9.571 2.700 1.00 0.00 C ATOM 1043 NH1 ARG A 982 -18.306 -9.156 3.953 1.00 0.00 N ATOM 1044 NH2 ARG A 982 -19.067 -10.107 1.977 1.00 0.00 N ATOM 0 H ARG A 982 -11.970 -9.961 1.441 1.00 0.00 H new ATOM 0 HA ARG A 982 -12.568 -7.343 0.807 1.00 0.00 H new ATOM 0 HB2 ARG A 982 -12.957 -9.036 3.286 1.00 0.00 H new ATOM 0 HB3 ARG A 982 -13.456 -7.356 3.282 1.00 0.00 H new ATOM 0 HG2 ARG A 982 -14.839 -7.794 1.224 1.00 0.00 H new ATOM 0 HG3 ARG A 982 -14.373 -9.482 1.288 1.00 0.00 H new ATOM 0 HD2 ARG A 982 -15.351 -9.563 3.661 1.00 0.00 H new ATOM 0 HD3 ARG A 982 -15.982 -7.951 3.385 1.00 0.00 H new ATOM 0 HE ARG A 982 -16.707 -9.780 1.216 1.00 0.00 H new ATOM 0 HH11 ARG A 982 -17.550 -8.750 4.504 1.00 0.00 H new ATOM 0 HH12 ARG A 982 -19.239 -9.247 4.356 1.00 0.00 H new ATOM 0 HH21 ARG A 982 -18.890 -10.424 1.024 1.00 0.00 H new ATOM 0 HH22 ARG A 982 -20.000 -10.198 2.380 1.00 0.00 H new ATOM 1058 N GLU A 983 -10.275 -7.663 3.157 1.00 0.00 N ATOM 1059 CA GLU A 983 -9.233 -6.961 3.888 1.00 0.00 C ATOM 1060 C GLU A 983 -8.430 -6.068 2.940 1.00 0.00 C ATOM 1061 O GLU A 983 -8.170 -4.906 3.247 1.00 0.00 O ATOM 1062 CB GLU A 983 -8.319 -7.945 4.620 1.00 0.00 C ATOM 1063 CG GLU A 983 -9.061 -8.633 5.767 1.00 0.00 C ATOM 1064 CD GLU A 983 -8.638 -10.098 5.894 1.00 0.00 C ATOM 1065 OE1 GLU A 983 -7.411 -10.337 5.887 1.00 0.00 O ATOM 1066 OE2 GLU A 983 -9.551 -10.946 5.994 1.00 0.00 O ATOM 0 H GLU A 983 -10.305 -8.670 3.318 1.00 0.00 H new ATOM 0 HA GLU A 983 -9.706 -6.328 4.639 1.00 0.00 H new ATOM 0 HB2 GLU A 983 -7.950 -8.694 3.920 1.00 0.00 H new ATOM 0 HB3 GLU A 983 -7.449 -7.417 5.010 1.00 0.00 H new ATOM 0 HG2 GLU A 983 -8.858 -8.110 6.702 1.00 0.00 H new ATOM 0 HG3 GLU A 983 -10.136 -8.575 5.596 1.00 0.00 H new ATOM 1073 N ILE A 984 -8.059 -6.645 1.806 1.00 0.00 N ATOM 1074 CA ILE A 984 -7.291 -5.916 0.811 1.00 0.00 C ATOM 1075 C ILE A 984 -8.166 -4.819 0.201 1.00 0.00 C ATOM 1076 O ILE A 984 -7.676 -3.738 -0.124 1.00 0.00 O ATOM 1077 CB ILE A 984 -6.702 -6.878 -0.222 1.00 0.00 C ATOM 1078 CG1 ILE A 984 -5.601 -7.742 0.399 1.00 0.00 C ATOM 1079 CG2 ILE A 984 -6.209 -6.122 -1.457 1.00 0.00 C ATOM 1080 CD1 ILE A 984 -4.688 -8.326 -0.681 1.00 0.00 C ATOM 0 H ILE A 984 -8.276 -7.609 1.554 1.00 0.00 H new ATOM 0 HA ILE A 984 -6.437 -5.422 1.276 1.00 0.00 H new ATOM 0 HB ILE A 984 -7.493 -7.552 -0.552 1.00 0.00 H new ATOM 0 HG12 ILE A 984 -5.012 -7.143 1.093 1.00 0.00 H new ATOM 0 HG13 ILE A 984 -6.050 -8.550 0.977 1.00 0.00 H new ATOM 0 HG21 ILE A 984 -5.795 -6.829 -2.175 1.00 0.00 H new ATOM 0 HG22 ILE A 984 -7.042 -5.587 -1.913 1.00 0.00 H new ATOM 0 HG23 ILE A 984 -5.438 -5.410 -1.164 1.00 0.00 H new ATOM 0 HD11 ILE A 984 -3.915 -8.935 -0.213 1.00 0.00 H new ATOM 0 HD12 ILE A 984 -5.276 -8.944 -1.359 1.00 0.00 H new ATOM 0 HD13 ILE A 984 -4.222 -7.515 -1.241 1.00 0.00 H new ATOM 1092 N GLU A 985 -9.445 -5.135 0.064 1.00 0.00 N ATOM 1093 CA GLU A 985 -10.393 -4.189 -0.501 1.00 0.00 C ATOM 1094 C GLU A 985 -10.510 -2.955 0.395 1.00 0.00 C ATOM 1095 O GLU A 985 -10.570 -1.829 -0.098 1.00 0.00 O ATOM 1096 CB GLU A 985 -11.759 -4.844 -0.714 1.00 0.00 C ATOM 1097 CG GLU A 985 -11.868 -5.441 -2.119 1.00 0.00 C ATOM 1098 CD GLU A 985 -13.164 -5.002 -2.803 1.00 0.00 C ATOM 1099 OE1 GLU A 985 -14.202 -5.633 -2.510 1.00 0.00 O ATOM 1100 OE2 GLU A 985 -13.087 -4.044 -3.603 1.00 0.00 O ATOM 0 H GLU A 985 -9.847 -6.032 0.334 1.00 0.00 H new ATOM 0 HA GLU A 985 -10.023 -3.871 -1.476 1.00 0.00 H new ATOM 0 HB2 GLU A 985 -11.911 -5.626 0.030 1.00 0.00 H new ATOM 0 HB3 GLU A 985 -12.547 -4.106 -0.567 1.00 0.00 H new ATOM 0 HG2 GLU A 985 -11.013 -5.128 -2.718 1.00 0.00 H new ATOM 0 HG3 GLU A 985 -11.835 -6.529 -2.059 1.00 0.00 H new ATOM 1107 N MET A 986 -10.538 -3.207 1.695 1.00 0.00 N ATOM 1108 CA MET A 986 -10.647 -2.130 2.664 1.00 0.00 C ATOM 1109 C MET A 986 -9.361 -1.302 2.710 1.00 0.00 C ATOM 1110 O MET A 986 -9.407 -0.087 2.892 1.00 0.00 O ATOM 1111 CB MET A 986 -10.926 -2.716 4.050 1.00 0.00 C ATOM 1112 CG MET A 986 -12.395 -2.532 4.437 1.00 0.00 C ATOM 1113 SD MET A 986 -12.912 -3.855 5.517 1.00 0.00 S ATOM 1114 CE MET A 986 -13.362 -5.087 4.306 1.00 0.00 C ATOM 0 H MET A 986 -10.487 -4.142 2.100 1.00 0.00 H new ATOM 0 HA MET A 986 -11.467 -1.478 2.363 1.00 0.00 H new ATOM 0 HB2 MET A 986 -10.674 -3.776 4.058 1.00 0.00 H new ATOM 0 HB3 MET A 986 -10.288 -2.231 4.789 1.00 0.00 H new ATOM 0 HG2 MET A 986 -12.531 -1.572 4.934 1.00 0.00 H new ATOM 0 HG3 MET A 986 -13.017 -2.518 3.542 1.00 0.00 H new ATOM 0 HE1 MET A 986 -14.422 -5.321 4.401 1.00 0.00 H new ATOM 0 HE2 MET A 986 -13.164 -4.703 3.305 1.00 0.00 H new ATOM 0 HE3 MET A 986 -12.775 -5.991 4.471 1.00 0.00 H new ATOM 1124 N ALA A 987 -8.243 -1.994 2.542 1.00 0.00 N ATOM 1125 CA ALA A 987 -6.947 -1.337 2.562 1.00 0.00 C ATOM 1126 C ALA A 987 -6.765 -0.538 1.270 1.00 0.00 C ATOM 1127 O ALA A 987 -6.067 0.475 1.256 1.00 0.00 O ATOM 1128 CB ALA A 987 -5.848 -2.383 2.761 1.00 0.00 C ATOM 0 H ALA A 987 -8.208 -3.002 2.392 1.00 0.00 H new ATOM 0 HA ALA A 987 -6.884 -0.636 3.394 1.00 0.00 H new ATOM 0 HB1 ALA A 987 -4.876 -1.891 2.776 1.00 0.00 H new ATOM 0 HB2 ALA A 987 -6.007 -2.902 3.706 1.00 0.00 H new ATOM 0 HB3 ALA A 987 -5.878 -3.102 1.943 1.00 0.00 H new ATOM 1134 N GLN A 988 -7.405 -1.024 0.217 1.00 0.00 N ATOM 1135 CA GLN A 988 -7.322 -0.367 -1.077 1.00 0.00 C ATOM 1136 C GLN A 988 -8.331 0.780 -1.156 1.00 0.00 C ATOM 1137 O GLN A 988 -8.009 1.862 -1.645 1.00 0.00 O ATOM 1138 CB GLN A 988 -7.540 -1.368 -2.214 1.00 0.00 C ATOM 1139 CG GLN A 988 -6.538 -2.520 -2.131 1.00 0.00 C ATOM 1140 CD GLN A 988 -5.462 -2.391 -3.211 1.00 0.00 C ATOM 1141 OE1 GLN A 988 -4.449 -1.599 -2.874 1.00 0.00 O flip ATOM 1142 NE2 GLN A 988 -5.548 -2.973 -4.281 1.00 0.00 N flip ATOM 0 H GLN A 988 -7.983 -1.864 0.233 1.00 0.00 H new ATOM 0 HA GLN A 988 -6.320 0.048 -1.188 1.00 0.00 H new ATOM 0 HB2 GLN A 988 -8.556 -1.761 -2.167 1.00 0.00 H new ATOM 0 HB3 GLN A 988 -7.438 -0.861 -3.174 1.00 0.00 H new ATOM 0 HG2 GLN A 988 -6.070 -2.530 -1.146 1.00 0.00 H new ATOM 0 HG3 GLN A 988 -7.060 -3.470 -2.245 1.00 0.00 H new ATOM 0 HE21 GLN A 988 -6.354 -3.567 -4.475 1.00 0.00 H new ATOM 0 HE22 GLN A 988 -4.814 -2.865 -4.981 1.00 0.00 H new ATOM 1151 N LYS A 989 -9.531 0.506 -0.665 1.00 0.00 N ATOM 1152 CA LYS A 989 -10.588 1.502 -0.674 1.00 0.00 C ATOM 1153 C LYS A 989 -10.154 2.708 0.161 1.00 0.00 C ATOM 1154 O LYS A 989 -10.624 3.823 -0.061 1.00 0.00 O ATOM 1155 CB LYS A 989 -11.911 0.883 -0.218 1.00 0.00 C ATOM 1156 CG LYS A 989 -12.046 0.939 1.305 1.00 0.00 C ATOM 1157 CD LYS A 989 -12.863 2.158 1.739 1.00 0.00 C ATOM 1158 CE LYS A 989 -13.153 2.118 3.240 1.00 0.00 C ATOM 1159 NZ LYS A 989 -13.775 3.386 3.682 1.00 0.00 N ATOM 0 H LYS A 989 -9.794 -0.392 -0.258 1.00 0.00 H new ATOM 0 HA LYS A 989 -10.763 1.862 -1.688 1.00 0.00 H new ATOM 0 HB2 LYS A 989 -12.743 1.414 -0.680 1.00 0.00 H new ATOM 0 HB3 LYS A 989 -11.967 -0.152 -0.554 1.00 0.00 H new ATOM 0 HG2 LYS A 989 -12.525 0.029 1.665 1.00 0.00 H new ATOM 0 HG3 LYS A 989 -11.056 0.979 1.760 1.00 0.00 H new ATOM 0 HD2 LYS A 989 -12.319 3.070 1.494 1.00 0.00 H new ATOM 0 HD3 LYS A 989 -13.801 2.188 1.185 1.00 0.00 H new ATOM 0 HE2 LYS A 989 -13.816 1.283 3.466 1.00 0.00 H new ATOM 0 HE3 LYS A 989 -12.228 1.949 3.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 -13.965 3.342 4.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 -13.129 4.177 3.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 -14.668 3.532 3.170 1.00 0.00 H new ATOM 1173 N LEU A 990 -9.261 2.444 1.104 1.00 0.00 N ATOM 1174 CA LEU A 990 -8.758 3.494 1.973 1.00 0.00 C ATOM 1175 C LEU A 990 -7.797 4.386 1.184 1.00 0.00 C ATOM 1176 O LEU A 990 -8.003 5.595 1.090 1.00 0.00 O ATOM 1177 CB LEU A 990 -8.141 2.893 3.238 1.00 0.00 C ATOM 1178 CG LEU A 990 -8.822 3.261 4.557 1.00 0.00 C ATOM 1179 CD1 LEU A 990 -8.320 2.377 5.700 1.00 0.00 C ATOM 1180 CD2 LEU A 990 -8.651 4.750 4.866 1.00 0.00 C ATOM 0 H LEU A 990 -8.873 1.518 1.285 1.00 0.00 H new ATOM 0 HA LEU A 990 -9.575 4.129 2.316 1.00 0.00 H new ATOM 0 HB2 LEU A 990 -8.146 1.807 3.140 1.00 0.00 H new ATOM 0 HB3 LEU A 990 -7.098 3.203 3.292 1.00 0.00 H new ATOM 0 HG LEU A 990 -9.891 3.074 4.452 1.00 0.00 H new ATOM 0 HD11 LEU A 990 -8.821 2.660 6.626 1.00 0.00 H new ATOM 0 HD12 LEU A 990 -8.537 1.333 5.475 1.00 0.00 H new ATOM 0 HD13 LEU A 990 -7.244 2.507 5.815 1.00 0.00 H new ATOM 0 HD21 LEU A 990 -9.145 4.985 5.809 1.00 0.00 H new ATOM 0 HD22 LEU A 990 -7.590 4.986 4.943 1.00 0.00 H new ATOM 0 HD23 LEU A 990 -9.097 5.341 4.066 1.00 0.00 H new ATOM 1192 N LEU A 991 -6.768 3.755 0.638 1.00 0.00 N ATOM 1193 CA LEU A 991 -5.775 4.477 -0.139 1.00 0.00 C ATOM 1194 C LEU A 991 -6.483 5.374 -1.156 1.00 0.00 C ATOM 1195 O LEU A 991 -6.166 6.557 -1.273 1.00 0.00 O ATOM 1196 CB LEU A 991 -4.776 3.503 -0.768 1.00 0.00 C ATOM 1197 CG LEU A 991 -3.599 4.137 -1.513 1.00 0.00 C ATOM 1198 CD1 LEU A 991 -2.717 4.944 -0.558 1.00 0.00 C ATOM 1199 CD2 LEU A 991 -2.799 3.080 -2.276 1.00 0.00 C ATOM 0 H LEU A 991 -6.600 2.752 0.718 1.00 0.00 H new ATOM 0 HA LEU A 991 -5.186 5.129 0.506 1.00 0.00 H new ATOM 0 HB2 LEU A 991 -4.379 2.862 0.019 1.00 0.00 H new ATOM 0 HB3 LEU A 991 -5.315 2.859 -1.462 1.00 0.00 H new ATOM 0 HG LEU A 991 -3.997 4.834 -2.251 1.00 0.00 H new ATOM 0 HD11 LEU A 991 -1.888 5.384 -1.112 1.00 0.00 H new ATOM 0 HD12 LEU A 991 -3.308 5.737 -0.099 1.00 0.00 H new ATOM 0 HD13 LEU A 991 -2.326 4.287 0.219 1.00 0.00 H new ATOM 0 HD21 LEU A 991 -1.969 3.558 -2.796 1.00 0.00 H new ATOM 0 HD22 LEU A 991 -2.411 2.341 -1.575 1.00 0.00 H new ATOM 0 HD23 LEU A 991 -3.446 2.587 -3.001 1.00 0.00 H new ATOM 1211 N ASN A 992 -7.428 4.777 -1.867 1.00 0.00 N ATOM 1212 CA ASN A 992 -8.184 5.507 -2.871 1.00 0.00 C ATOM 1213 C ASN A 992 -8.865 6.710 -2.215 1.00 0.00 C ATOM 1214 O ASN A 992 -8.532 7.856 -2.514 1.00 0.00 O ATOM 1215 CB ASN A 992 -9.272 4.627 -3.490 1.00 0.00 C ATOM 1216 CG ASN A 992 -9.670 5.141 -4.874 1.00 0.00 C ATOM 1217 OD1 ASN A 992 -8.967 4.968 -5.856 1.00 0.00 O ATOM 1218 ND2 ASN A 992 -10.836 5.781 -4.899 1.00 0.00 N ATOM 0 H ASN A 992 -7.688 3.796 -1.768 1.00 0.00 H new ATOM 0 HA ASN A 992 -7.491 5.824 -3.650 1.00 0.00 H new ATOM 0 HB2 ASN A 992 -8.914 3.601 -3.568 1.00 0.00 H new ATOM 0 HB3 ASN A 992 -10.146 4.611 -2.839 1.00 0.00 H new ATOM 0 HD21 ASN A 992 -11.190 6.161 -5.777 1.00 0.00 H new ATOM 0 HD22 ASN A 992 -11.376 5.891 -4.041 1.00 0.00 H new ATOM 1225 N SER A 993 -9.806 6.408 -1.333 1.00 0.00 N ATOM 1226 CA SER A 993 -10.537 7.450 -0.632 1.00 0.00 C ATOM 1227 C SER A 993 -9.595 8.601 -0.276 1.00 0.00 C ATOM 1228 O SER A 993 -9.843 9.748 -0.643 1.00 0.00 O ATOM 1229 CB SER A 993 -11.205 6.901 0.630 1.00 0.00 C ATOM 1230 OG SER A 993 -12.509 7.442 0.823 1.00 0.00 O ATOM 0 H SER A 993 -10.079 5.456 -1.088 1.00 0.00 H new ATOM 0 HA SER A 993 -11.320 7.821 -1.293 1.00 0.00 H new ATOM 0 HB2 SER A 993 -11.270 5.815 0.563 1.00 0.00 H new ATOM 0 HB3 SER A 993 -10.586 7.130 1.497 1.00 0.00 H new ATOM 0 HG SER A 993 -12.902 7.065 1.638 1.00 0.00 H new ATOM 1236 N ASP A 994 -8.532 8.255 0.436 1.00 0.00 N ATOM 1237 CA ASP A 994 -7.551 9.245 0.846 1.00 0.00 C ATOM 1238 C ASP A 994 -6.917 9.873 -0.396 1.00 0.00 C ATOM 1239 O ASP A 994 -6.711 11.085 -0.447 1.00 0.00 O ATOM 1240 CB ASP A 994 -6.435 8.605 1.674 1.00 0.00 C ATOM 1241 CG ASP A 994 -6.889 7.971 2.990 1.00 0.00 C ATOM 1242 OD1 ASP A 994 -7.320 8.743 3.873 1.00 0.00 O ATOM 1243 OD2 ASP A 994 -6.794 6.728 3.084 1.00 0.00 O ATOM 0 H ASP A 994 -8.329 7.303 0.739 1.00 0.00 H new ATOM 0 HA ASP A 994 -8.062 9.996 1.449 1.00 0.00 H new ATOM 0 HB2 ASP A 994 -5.947 7.841 1.069 1.00 0.00 H new ATOM 0 HB3 ASP A 994 -5.685 9.365 1.894 1.00 0.00 H new ATOM 1248 N LEU A 995 -6.625 9.021 -1.368 1.00 0.00 N ATOM 1249 CA LEU A 995 -6.019 9.478 -2.607 1.00 0.00 C ATOM 1250 C LEU A 995 -6.788 10.693 -3.129 1.00 0.00 C ATOM 1251 O LEU A 995 -6.192 11.721 -3.446 1.00 0.00 O ATOM 1252 CB LEU A 995 -5.927 8.329 -3.613 1.00 0.00 C ATOM 1253 CG LEU A 995 -6.426 8.635 -5.027 1.00 0.00 C ATOM 1254 CD1 LEU A 995 -5.403 9.468 -5.802 1.00 0.00 C ATOM 1255 CD2 LEU A 995 -6.796 7.348 -5.768 1.00 0.00 C ATOM 0 H LEU A 995 -6.797 8.017 -1.322 1.00 0.00 H new ATOM 0 HA LEU A 995 -4.993 9.802 -2.433 1.00 0.00 H new ATOM 0 HB2 LEU A 995 -4.886 8.011 -3.677 1.00 0.00 H new ATOM 0 HB3 LEU A 995 -6.495 7.484 -3.223 1.00 0.00 H new ATOM 0 HG LEU A 995 -7.334 9.233 -4.947 1.00 0.00 H new ATOM 0 HD11 LEU A 995 -5.783 9.671 -6.803 1.00 0.00 H new ATOM 0 HD12 LEU A 995 -5.231 10.410 -5.281 1.00 0.00 H new ATOM 0 HD13 LEU A 995 -4.465 8.917 -5.874 1.00 0.00 H new ATOM 0 HD21 LEU A 995 -7.148 7.593 -6.770 1.00 0.00 H new ATOM 0 HD22 LEU A 995 -5.919 6.704 -5.838 1.00 0.00 H new ATOM 0 HD23 LEU A 995 -7.585 6.829 -5.224 1.00 0.00 H new ATOM 1267 N ALA A 996 -8.102 10.535 -3.202 1.00 0.00 N ATOM 1268 CA ALA A 996 -8.959 11.606 -3.680 1.00 0.00 C ATOM 1269 C ALA A 996 -8.716 12.861 -2.840 1.00 0.00 C ATOM 1270 O ALA A 996 -8.458 13.935 -3.382 1.00 0.00 O ATOM 1271 CB ALA A 996 -10.419 11.150 -3.637 1.00 0.00 C ATOM 0 H ALA A 996 -8.594 9.681 -2.938 1.00 0.00 H new ATOM 0 HA ALA A 996 -8.724 11.852 -4.716 1.00 0.00 H new ATOM 0 HB1 ALA A 996 -11.062 11.954 -3.996 1.00 0.00 H new ATOM 0 HB2 ALA A 996 -10.545 10.273 -4.272 1.00 0.00 H new ATOM 0 HB3 ALA A 996 -10.691 10.898 -2.612 1.00 0.00 H new ATOM 1277 N GLU A 997 -8.806 12.685 -1.530 1.00 0.00 N ATOM 1278 CA GLU A 997 -8.599 13.791 -0.610 1.00 0.00 C ATOM 1279 C GLU A 997 -7.224 14.421 -0.838 1.00 0.00 C ATOM 1280 O GLU A 997 -7.032 15.609 -0.587 1.00 0.00 O ATOM 1281 CB GLU A 997 -8.758 13.333 0.841 1.00 0.00 C ATOM 1282 CG GLU A 997 -8.811 14.532 1.791 1.00 0.00 C ATOM 1283 CD GLU A 997 -10.179 15.215 1.737 1.00 0.00 C ATOM 1284 OE1 GLU A 997 -10.450 15.861 0.701 1.00 0.00 O ATOM 1285 OE2 GLU A 997 -10.923 15.075 2.731 1.00 0.00 O ATOM 0 H GLU A 997 -9.019 11.793 -1.084 1.00 0.00 H new ATOM 0 HA GLU A 997 -9.360 14.547 -0.804 1.00 0.00 H new ATOM 0 HB2 GLU A 997 -9.669 12.743 0.942 1.00 0.00 H new ATOM 0 HB3 GLU A 997 -7.926 12.684 1.115 1.00 0.00 H new ATOM 0 HG2 GLU A 997 -8.605 14.203 2.809 1.00 0.00 H new ATOM 0 HG3 GLU A 997 -8.033 15.247 1.524 1.00 0.00 H new ATOM 1292 N LEU A 998 -6.301 13.596 -1.312 1.00 0.00 N ATOM 1293 CA LEU A 998 -4.949 14.057 -1.577 1.00 0.00 C ATOM 1294 C LEU A 998 -4.932 14.843 -2.890 1.00 0.00 C ATOM 1295 O LEU A 998 -4.390 15.946 -2.950 1.00 0.00 O ATOM 1296 CB LEU A 998 -3.968 12.884 -1.550 1.00 0.00 C ATOM 1297 CG LEU A 998 -2.695 13.094 -0.727 1.00 0.00 C ATOM 1298 CD1 LEU A 998 -2.908 12.672 0.729 1.00 0.00 C ATOM 1299 CD2 LEU A 998 -1.505 12.373 -1.364 1.00 0.00 C ATOM 0 H LEU A 998 -6.464 12.611 -1.519 1.00 0.00 H new ATOM 0 HA LEU A 998 -4.617 14.737 -0.793 1.00 0.00 H new ATOM 0 HB2 LEU A 998 -4.489 12.009 -1.160 1.00 0.00 H new ATOM 0 HB3 LEU A 998 -3.680 12.653 -2.576 1.00 0.00 H new ATOM 0 HG LEU A 998 -2.462 14.159 -0.723 1.00 0.00 H new ATOM 0 HD11 LEU A 998 -1.988 12.831 1.292 1.00 0.00 H new ATOM 0 HD12 LEU A 998 -3.709 13.267 1.167 1.00 0.00 H new ATOM 0 HD13 LEU A 998 -3.178 11.617 0.766 1.00 0.00 H new ATOM 0 HD21 LEU A 998 -0.613 12.538 -0.759 1.00 0.00 H new ATOM 0 HD22 LEU A 998 -1.714 11.305 -1.418 1.00 0.00 H new ATOM 0 HD23 LEU A 998 -1.339 12.762 -2.369 1.00 0.00 H new ATOM 1311 N ILE A 999 -5.531 14.244 -3.909 1.00 0.00 N ATOM 1312 CA ILE A 999 -5.591 14.875 -5.217 1.00 0.00 C ATOM 1313 C ILE A 999 -6.314 16.218 -5.099 1.00 0.00 C ATOM 1314 O ILE A 999 -5.786 17.249 -5.511 1.00 0.00 O ATOM 1315 CB ILE A 999 -6.218 13.926 -6.241 1.00 0.00 C ATOM 1316 CG1 ILE A 999 -5.476 12.589 -6.276 1.00 0.00 C ATOM 1317 CG2 ILE A 999 -6.289 14.579 -7.622 1.00 0.00 C ATOM 1318 CD1 ILE A 999 -4.303 12.638 -7.257 1.00 0.00 C ATOM 0 H ILE A 999 -5.979 13.329 -3.856 1.00 0.00 H new ATOM 0 HA ILE A 999 -4.587 15.086 -5.585 1.00 0.00 H new ATOM 0 HB ILE A 999 -7.242 13.717 -5.931 1.00 0.00 H new ATOM 0 HG12 ILE A 999 -5.110 12.346 -5.278 1.00 0.00 H new ATOM 0 HG13 ILE A 999 -6.164 11.795 -6.566 1.00 0.00 H new ATOM 0 HG21 ILE A 999 -6.738 13.883 -8.331 1.00 0.00 H new ATOM 0 HG22 ILE A 999 -6.896 15.483 -7.566 1.00 0.00 H new ATOM 0 HG23 ILE A 999 -5.284 14.837 -7.955 1.00 0.00 H new ATOM 0 HD11 ILE A 999 -3.793 11.675 -7.262 1.00 0.00 H new ATOM 0 HD12 ILE A 999 -4.675 12.857 -8.258 1.00 0.00 H new ATOM 0 HD13 ILE A 999 -3.605 13.417 -6.951 1.00 0.00 H new ATOM 1330 N ASN A1000 -7.511 16.161 -4.533 1.00 0.00 N ATOM 1331 CA ASN A1000 -8.312 17.360 -4.356 1.00 0.00 C ATOM 1332 C ASN A1000 -7.527 18.373 -3.519 1.00 0.00 C ATOM 1333 O ASN A1000 -7.377 19.527 -3.917 1.00 0.00 O ATOM 1334 CB ASN A1000 -9.616 17.047 -3.619 1.00 0.00 C ATOM 1335 CG ASN A1000 -10.767 17.899 -4.156 1.00 0.00 C ATOM 1336 OD1 ASN A1000 -10.573 18.940 -4.763 1.00 0.00 O ATOM 1337 ND2 ASN A1000 -11.974 17.401 -3.900 1.00 0.00 N ATOM 0 H ASN A1000 -7.945 15.304 -4.191 1.00 0.00 H new ATOM 0 HA ASN A1000 -8.543 17.761 -5.343 1.00 0.00 H new ATOM 0 HB2 ASN A1000 -9.857 15.990 -3.732 1.00 0.00 H new ATOM 0 HB3 ASN A1000 -9.489 17.232 -2.552 1.00 0.00 H new ATOM 0 HD21 ASN A1000 -12.808 17.896 -4.217 1.00 0.00 H new ATOM 0 HD22 ASN A1000 -12.066 16.524 -3.387 1.00 0.00 H new ATOM 1344 N LYS A1001 -7.048 17.904 -2.376 1.00 0.00 N ATOM 1345 CA LYS A1001 -6.283 18.755 -1.481 1.00 0.00 C ATOM 1346 C LYS A1001 -5.306 19.601 -2.299 1.00 0.00 C ATOM 1347 O LYS A1001 -5.211 20.811 -2.100 1.00 0.00 O ATOM 1348 CB LYS A1001 -5.609 17.917 -0.392 1.00 0.00 C ATOM 1349 CG LYS A1001 -4.598 18.753 0.396 1.00 0.00 C ATOM 1350 CD LYS A1001 -5.038 18.916 1.852 1.00 0.00 C ATOM 1351 CE LYS A1001 -5.336 17.557 2.490 1.00 0.00 C ATOM 1352 NZ LYS A1001 -6.738 17.503 2.963 1.00 0.00 N ATOM 0 H LYS A1001 -7.175 16.946 -2.049 1.00 0.00 H new ATOM 0 HA LYS A1001 -6.942 19.447 -0.957 1.00 0.00 H new ATOM 0 HB2 LYS A1001 -6.364 17.519 0.286 1.00 0.00 H new ATOM 0 HB3 LYS A1001 -5.106 17.063 -0.845 1.00 0.00 H new ATOM 0 HG2 LYS A1001 -3.619 18.275 0.360 1.00 0.00 H new ATOM 0 HG3 LYS A1001 -4.492 19.734 -0.068 1.00 0.00 H new ATOM 0 HD2 LYS A1001 -4.256 19.424 2.417 1.00 0.00 H new ATOM 0 HD3 LYS A1001 -5.926 19.546 1.899 1.00 0.00 H new ATOM 0 HE2 LYS A1001 -5.159 16.762 1.766 1.00 0.00 H new ATOM 0 HE3 LYS A1001 -4.657 17.384 3.325 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 -6.954 16.543 3.300 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 -6.868 18.181 3.741 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 -7.378 17.747 2.180 1.00 0.00 H new ATOM 1366 N MET A1002 -4.605 18.931 -3.202 1.00 0.00 N ATOM 1367 CA MET A1002 -3.639 19.607 -4.051 1.00 0.00 C ATOM 1368 C MET A1002 -4.315 20.685 -4.900 1.00 0.00 C ATOM 1369 O MET A1002 -3.860 21.828 -4.936 1.00 0.00 O ATOM 1370 CB MET A1002 -2.961 18.586 -4.967 1.00 0.00 C ATOM 1371 CG MET A1002 -2.131 19.283 -6.046 1.00 0.00 C ATOM 1372 SD MET A1002 -3.157 19.660 -7.457 1.00 0.00 S ATOM 1373 CE MET A1002 -2.598 18.400 -8.592 1.00 0.00 C ATOM 0 H MET A1002 -4.687 17.927 -3.364 1.00 0.00 H new ATOM 0 HA MET A1002 -2.896 20.086 -3.414 1.00 0.00 H new ATOM 0 HB2 MET A1002 -2.320 17.932 -4.376 1.00 0.00 H new ATOM 0 HB3 MET A1002 -3.716 17.955 -5.435 1.00 0.00 H new ATOM 0 HG2 MET A1002 -1.696 20.199 -5.647 1.00 0.00 H new ATOM 0 HG3 MET A1002 -1.302 18.643 -6.349 1.00 0.00 H new ATOM 0 HE1 MET A1002 -2.506 18.825 -9.591 1.00 0.00 H new ATOM 0 HE2 MET A1002 -1.628 18.022 -8.267 1.00 0.00 H new ATOM 0 HE3 MET A1002 -3.318 17.582 -8.611 1.00 0.00 H new ATOM 1383 N LYS A1003 -5.389 20.284 -5.563 1.00 0.00 N ATOM 1384 CA LYS A1003 -6.132 21.202 -6.410 1.00 0.00 C ATOM 1385 C LYS A1003 -6.454 22.471 -5.619 1.00 0.00 C ATOM 1386 O LYS A1003 -6.583 23.550 -6.196 1.00 0.00 O ATOM 1387 CB LYS A1003 -7.367 20.512 -6.994 1.00 0.00 C ATOM 1388 CG LYS A1003 -7.190 20.246 -8.490 1.00 0.00 C ATOM 1389 CD LYS A1003 -8.530 19.922 -9.152 1.00 0.00 C ATOM 1390 CE LYS A1003 -9.343 21.195 -9.396 1.00 0.00 C ATOM 1391 NZ LYS A1003 -10.506 20.910 -10.266 1.00 0.00 N ATOM 0 H LYS A1003 -5.763 19.336 -5.531 1.00 0.00 H new ATOM 0 HA LYS A1003 -5.529 21.503 -7.266 1.00 0.00 H new ATOM 0 HB2 LYS A1003 -7.543 19.571 -6.472 1.00 0.00 H new ATOM 0 HB3 LYS A1003 -8.246 21.136 -6.833 1.00 0.00 H new ATOM 0 HG2 LYS A1003 -6.746 21.119 -8.968 1.00 0.00 H new ATOM 0 HG3 LYS A1003 -6.498 19.416 -8.636 1.00 0.00 H new ATOM 0 HD2 LYS A1003 -8.358 19.409 -10.098 1.00 0.00 H new ATOM 0 HD3 LYS A1003 -9.097 19.240 -8.519 1.00 0.00 H new ATOM 0 HE2 LYS A1003 -9.685 21.603 -8.445 1.00 0.00 H new ATOM 0 HE3 LYS A1003 -8.712 21.953 -9.860 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 -11.046 21.785 -10.421 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 -10.174 20.542 -11.180 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 -11.116 20.203 -9.809 1.00 0.00 H new ATOM 1405 N LEU A1004 -6.575 22.301 -4.311 1.00 0.00 N ATOM 1406 CA LEU A1004 -6.880 23.420 -3.435 1.00 0.00 C ATOM 1407 C LEU A1004 -5.578 24.114 -3.030 1.00 0.00 C ATOM 1408 O LEU A1004 -5.452 25.330 -3.160 1.00 0.00 O ATOM 1409 CB LEU A1004 -7.724 22.956 -2.247 1.00 0.00 C ATOM 1410 CG LEU A1004 -8.918 22.058 -2.582 1.00 0.00 C ATOM 1411 CD1 LEU A1004 -9.525 21.457 -1.313 1.00 0.00 C ATOM 1412 CD2 LEU A1004 -9.957 22.815 -3.412 1.00 0.00 C ATOM 0 H LEU A1004 -6.467 21.405 -3.836 1.00 0.00 H new ATOM 0 HA LEU A1004 -7.487 24.159 -3.958 1.00 0.00 H new ATOM 0 HB2 LEU A1004 -7.076 22.421 -1.553 1.00 0.00 H new ATOM 0 HB3 LEU A1004 -8.093 23.837 -1.723 1.00 0.00 H new ATOM 0 HG LEU A1004 -8.561 21.228 -3.192 1.00 0.00 H new ATOM 0 HD11 LEU A1004 -10.371 20.824 -1.579 1.00 0.00 H new ATOM 0 HD12 LEU A1004 -8.773 20.860 -0.797 1.00 0.00 H new ATOM 0 HD13 LEU A1004 -9.864 22.259 -0.657 1.00 0.00 H new ATOM 0 HD21 LEU A1004 -10.795 22.155 -3.636 1.00 0.00 H new ATOM 0 HD22 LEU A1004 -10.315 23.677 -2.849 1.00 0.00 H new ATOM 0 HD23 LEU A1004 -9.502 23.154 -4.343 1.00 0.00 H new ATOM 1424 N ALA A1005 -4.641 23.310 -2.548 1.00 0.00 N ATOM 1425 CA ALA A1005 -3.353 23.832 -2.123 1.00 0.00 C ATOM 1426 C ALA A1005 -2.808 24.771 -3.201 1.00 0.00 C ATOM 1427 O ALA A1005 -2.204 25.796 -2.888 1.00 0.00 O ATOM 1428 CB ALA A1005 -2.404 22.669 -1.828 1.00 0.00 C ATOM 0 H ALA A1005 -4.748 22.301 -2.442 1.00 0.00 H new ATOM 0 HA ALA A1005 -3.456 24.410 -1.204 1.00 0.00 H new ATOM 0 HB1 ALA A1005 -1.438 23.060 -1.509 1.00 0.00 H new ATOM 0 HB2 ALA A1005 -2.824 22.049 -1.036 1.00 0.00 H new ATOM 0 HB3 ALA A1005 -2.273 22.069 -2.728 1.00 0.00 H new ATOM 1434 N GLN A1006 -3.041 24.388 -4.447 1.00 0.00 N ATOM 1435 CA GLN A1006 -2.580 25.183 -5.573 1.00 0.00 C ATOM 1436 C GLN A1006 -3.018 26.640 -5.408 1.00 0.00 C ATOM 1437 O GLN A1006 -2.277 27.557 -5.757 1.00 0.00 O ATOM 1438 CB GLN A1006 -3.086 24.605 -6.896 1.00 0.00 C ATOM 1439 CG GLN A1006 -1.920 24.171 -7.787 1.00 0.00 C ATOM 1440 CD GLN A1006 -2.231 24.429 -9.262 1.00 0.00 C ATOM 1441 OE1 GLN A1006 -1.231 24.991 -9.936 1.00 0.00 O flip ATOM 1442 NE2 GLN A1006 -3.308 24.138 -9.756 1.00 0.00 N flip ATOM 0 H GLN A1006 -3.543 23.538 -4.702 1.00 0.00 H new ATOM 0 HA GLN A1006 -1.491 25.151 -5.594 1.00 0.00 H new ATOM 0 HB2 GLN A1006 -3.735 23.752 -6.699 1.00 0.00 H new ATOM 0 HB3 GLN A1006 -3.688 25.350 -7.416 1.00 0.00 H new ATOM 0 HG2 GLN A1006 -1.018 24.713 -7.502 1.00 0.00 H new ATOM 0 HG3 GLN A1006 -1.716 23.111 -7.635 1.00 0.00 H new ATOM 0 HE21 GLN A1006 -4.033 23.708 -9.182 1.00 0.00 H new ATOM 0 HE22 GLN A1006 -3.483 24.324 -10.743 1.00 0.00 H new ATOM 1451 N GLN A1007 -4.220 26.806 -4.876 1.00 0.00 N ATOM 1452 CA GLN A1007 -4.765 28.136 -4.661 1.00 0.00 C ATOM 1453 C GLN A1007 -4.581 28.555 -3.201 1.00 0.00 C ATOM 1454 O GLN A1007 -4.469 29.743 -2.902 1.00 0.00 O ATOM 1455 CB GLN A1007 -6.238 28.197 -5.068 1.00 0.00 C ATOM 1456 CG GLN A1007 -6.592 29.570 -5.643 1.00 0.00 C ATOM 1457 CD GLN A1007 -8.045 29.937 -5.331 1.00 0.00 C ATOM 1458 OE1 GLN A1007 -8.972 29.547 -6.020 1.00 0.00 O ATOM 1459 NE2 GLN A1007 -8.189 30.708 -4.257 1.00 0.00 N ATOM 0 H GLN A1007 -4.832 26.042 -4.588 1.00 0.00 H new ATOM 0 HA GLN A1007 -4.219 28.838 -5.291 1.00 0.00 H new ATOM 0 HB2 GLN A1007 -6.447 27.424 -5.808 1.00 0.00 H new ATOM 0 HB3 GLN A1007 -6.867 27.988 -4.203 1.00 0.00 H new ATOM 0 HG2 GLN A1007 -5.925 30.325 -5.227 1.00 0.00 H new ATOM 0 HG3 GLN A1007 -6.437 29.567 -6.722 1.00 0.00 H new ATOM 0 HE21 GLN A1007 -7.369 30.999 -3.724 1.00 0.00 H new ATOM 0 HE22 GLN A1007 -9.119 31.008 -3.966 1.00 0.00 H new ATOM 1468 N TYR A1008 -4.556 27.556 -2.331 1.00 0.00 N ATOM 1469 CA TYR A1008 -4.388 27.806 -0.910 1.00 0.00 C ATOM 1470 C TYR A1008 -2.907 27.799 -0.523 1.00 0.00 C ATOM 1471 O TYR A1008 -2.556 27.429 0.597 1.00 0.00 O ATOM 1472 CB TYR A1008 -5.095 26.655 -0.192 1.00 0.00 C ATOM 1473 CG TYR A1008 -6.598 26.870 -0.003 1.00 0.00 C ATOM 1474 CD1 TYR A1008 -7.056 27.694 1.005 1.00 0.00 C ATOM 1475 CD2 TYR A1008 -7.497 26.240 -0.840 1.00 0.00 C ATOM 1476 CE1 TYR A1008 -8.470 27.897 1.184 1.00 0.00 C ATOM 1477 CE2 TYR A1008 -8.911 26.443 -0.662 1.00 0.00 C ATOM 1478 CZ TYR A1008 -9.328 27.261 0.342 1.00 0.00 C ATOM 1479 OH TYR A1008 -10.664 27.452 0.510 1.00 0.00 O ATOM 0 H TYR A1008 -4.649 26.572 -2.583 1.00 0.00 H new ATOM 0 HA TYR A1008 -4.797 28.780 -0.641 1.00 0.00 H new ATOM 0 HB2 TYR A1008 -4.938 25.736 -0.757 1.00 0.00 H new ATOM 0 HB3 TYR A1008 -4.633 26.511 0.785 1.00 0.00 H new ATOM 0 HD1 TYR A1008 -6.353 28.187 1.660 1.00 0.00 H new ATOM 0 HD2 TYR A1008 -7.139 25.595 -1.629 1.00 0.00 H new ATOM 0 HE1 TYR A1008 -8.841 28.540 1.969 1.00 0.00 H new ATOM 0 HE2 TYR A1008 -9.625 25.957 -1.311 1.00 0.00 H new ATOM 0 HH TYR A1008 -11.155 26.937 -0.163 1.00 0.00 H new ATOM 1489 N VAL A1009 -2.079 28.212 -1.471 1.00 0.00 N ATOM 1490 CA VAL A1009 -0.644 28.257 -1.244 1.00 0.00 C ATOM 1491 C VAL A1009 -0.159 29.704 -1.361 1.00 0.00 C ATOM 1492 O VAL A1009 0.546 30.199 -0.484 1.00 0.00 O ATOM 1493 CB VAL A1009 0.069 27.307 -2.208 1.00 0.00 C ATOM 1494 CG1 VAL A1009 -0.291 27.629 -3.660 1.00 0.00 C ATOM 1495 CG2 VAL A1009 1.583 27.346 -1.996 1.00 0.00 C ATOM 0 H VAL A1009 -2.374 28.519 -2.398 1.00 0.00 H new ATOM 0 HA VAL A1009 -0.406 27.915 -0.237 1.00 0.00 H new ATOM 0 HB VAL A1009 -0.272 26.294 -1.995 1.00 0.00 H new ATOM 0 HG11 VAL A1009 0.229 26.940 -4.325 1.00 0.00 H new ATOM 0 HG12 VAL A1009 -1.367 27.526 -3.799 1.00 0.00 H new ATOM 0 HG13 VAL A1009 0.009 28.651 -3.891 1.00 0.00 H new ATOM 0 HG21 VAL A1009 2.066 26.662 -2.694 1.00 0.00 H new ATOM 0 HG22 VAL A1009 1.949 28.358 -2.169 1.00 0.00 H new ATOM 0 HG23 VAL A1009 1.815 27.046 -0.974 1.00 0.00 H new ATOM 1505 N MET A1010 -0.557 30.340 -2.453 1.00 0.00 N ATOM 1506 CA MET A1010 -0.172 31.720 -2.697 1.00 0.00 C ATOM 1507 C MET A1010 -0.269 32.551 -1.415 1.00 0.00 C ATOM 1508 O MET A1010 0.436 33.547 -1.263 1.00 0.00 O ATOM 1509 CB MET A1010 -1.084 32.323 -3.767 1.00 0.00 C ATOM 1510 CG MET A1010 -2.511 31.789 -3.636 1.00 0.00 C ATOM 1511 SD MET A1010 -3.674 33.143 -3.655 1.00 0.00 S ATOM 1512 CE MET A1010 -4.672 32.714 -2.238 1.00 0.00 C ATOM 0 H MET A1010 -1.142 29.925 -3.179 1.00 0.00 H new ATOM 0 HA MET A1010 0.863 31.734 -3.039 1.00 0.00 H new ATOM 0 HB2 MET A1010 -1.089 33.409 -3.676 1.00 0.00 H new ATOM 0 HB3 MET A1010 -0.694 32.088 -4.757 1.00 0.00 H new ATOM 0 HG2 MET A1010 -2.727 31.102 -4.454 1.00 0.00 H new ATOM 0 HG3 MET A1010 -2.613 31.224 -2.709 1.00 0.00 H new ATOM 0 HE1 MET A1010 -5.655 32.382 -2.572 1.00 0.00 H new ATOM 0 HE2 MET A1010 -4.188 31.911 -1.682 1.00 0.00 H new ATOM 0 HE3 MET A1010 -4.783 33.586 -1.594 1.00 0.00 H new ATOM 1522 N THR A1011 -1.148 32.110 -0.527 1.00 0.00 N ATOM 1523 CA THR A1011 -1.346 32.801 0.735 1.00 0.00 C ATOM 1524 C THR A1011 -0.715 32.008 1.882 1.00 0.00 C ATOM 1525 O THR A1011 -0.302 30.864 1.696 1.00 0.00 O ATOM 1526 CB THR A1011 -2.847 33.037 0.914 1.00 0.00 C ATOM 1527 OG1 THR A1011 -2.957 33.594 2.222 1.00 0.00 O ATOM 1528 CG2 THR A1011 -3.640 31.731 0.997 1.00 0.00 C ATOM 0 H THR A1011 -1.731 31.283 -0.657 1.00 0.00 H new ATOM 0 HA THR A1011 -0.847 33.770 0.738 1.00 0.00 H new ATOM 0 HB THR A1011 -3.222 33.636 0.084 1.00 0.00 H new ATOM 0 HG1 THR A1011 -3.899 33.780 2.420 1.00 0.00 H new ATOM 0 HG21 THR A1011 -4.699 31.956 1.124 1.00 0.00 H new ATOM 0 HG22 THR A1011 -3.498 31.160 0.080 1.00 0.00 H new ATOM 0 HG23 THR A1011 -3.289 31.146 1.847 1.00 0.00 H new ATOM 1536 N SER A1012 -0.661 32.646 3.041 1.00 0.00 N ATOM 1537 CA SER A1012 -0.088 32.015 4.217 1.00 0.00 C ATOM 1538 C SER A1012 -0.801 30.691 4.501 1.00 0.00 C ATOM 1539 O SER A1012 -0.259 29.824 5.184 1.00 0.00 O ATOM 1540 CB SER A1012 -0.175 32.937 5.435 1.00 0.00 C ATOM 1541 OG SER A1012 0.804 33.971 5.393 1.00 0.00 O ATOM 0 H SER A1012 -1.005 33.594 3.191 1.00 0.00 H new ATOM 0 HA SER A1012 0.966 31.818 4.020 1.00 0.00 H new ATOM 0 HB2 SER A1012 -1.169 33.381 5.483 1.00 0.00 H new ATOM 0 HB3 SER A1012 -0.044 32.350 6.344 1.00 0.00 H new ATOM 0 HG SER A1012 0.714 34.539 6.187 1.00 0.00 H new ATOM 1547 N LEU A1013 -2.006 30.578 3.962 1.00 0.00 N ATOM 1548 CA LEU A1013 -2.799 29.375 4.149 1.00 0.00 C ATOM 1549 C LEU A1013 -1.954 28.151 3.790 1.00 0.00 C ATOM 1550 O LEU A1013 -2.239 27.042 4.238 1.00 0.00 O ATOM 1551 CB LEU A1013 -4.109 29.469 3.364 1.00 0.00 C ATOM 1552 CG LEU A1013 -5.376 29.071 4.123 1.00 0.00 C ATOM 1553 CD1 LEU A1013 -5.380 27.573 4.435 1.00 0.00 C ATOM 1554 CD2 LEU A1013 -5.549 29.919 5.384 1.00 0.00 C ATOM 0 H LEU A1013 -2.452 31.300 3.396 1.00 0.00 H new ATOM 0 HA LEU A1013 -3.088 29.268 5.195 1.00 0.00 H new ATOM 0 HB2 LEU A1013 -4.226 30.494 3.013 1.00 0.00 H new ATOM 0 HB3 LEU A1013 -4.026 28.837 2.480 1.00 0.00 H new ATOM 0 HG LEU A1013 -6.235 29.269 3.482 1.00 0.00 H new ATOM 0 HD11 LEU A1013 -6.291 27.316 4.975 1.00 0.00 H new ATOM 0 HD12 LEU A1013 -5.338 27.007 3.504 1.00 0.00 H new ATOM 0 HD13 LEU A1013 -4.513 27.327 5.048 1.00 0.00 H new ATOM 0 HD21 LEU A1013 -6.457 29.616 5.905 1.00 0.00 H new ATOM 0 HD22 LEU A1013 -4.690 29.776 6.039 1.00 0.00 H new ATOM 0 HD23 LEU A1013 -5.623 30.971 5.108 1.00 0.00 H new ATOM 1566 N GLN A1014 -0.931 28.394 2.984 1.00 0.00 N ATOM 1567 CA GLN A1014 -0.042 27.326 2.559 1.00 0.00 C ATOM 1568 C GLN A1014 0.272 26.398 3.734 1.00 0.00 C ATOM 1569 O GLN A1014 -0.283 25.305 3.832 1.00 0.00 O ATOM 1570 CB GLN A1014 1.242 27.891 1.949 1.00 0.00 C ATOM 1571 CG GLN A1014 2.260 26.779 1.686 1.00 0.00 C ATOM 1572 CD GLN A1014 3.478 26.924 2.599 1.00 0.00 C ATOM 1573 OE1 GLN A1014 3.537 26.380 3.690 1.00 0.00 O ATOM 1574 NE2 GLN A1014 4.445 27.686 2.095 1.00 0.00 N ATOM 0 H GLN A1014 -0.698 29.315 2.614 1.00 0.00 H new ATOM 0 HA GLN A1014 -0.547 26.745 1.787 1.00 0.00 H new ATOM 0 HB2 GLN A1014 1.010 28.405 1.016 1.00 0.00 H new ATOM 0 HB3 GLN A1014 1.673 28.632 2.622 1.00 0.00 H new ATOM 0 HG2 GLN A1014 1.793 25.808 1.848 1.00 0.00 H new ATOM 0 HG3 GLN A1014 2.577 26.810 0.643 1.00 0.00 H new ATOM 0 HE21 GLN A1014 4.332 28.112 1.175 1.00 0.00 H new ATOM 0 HE22 GLN A1014 5.300 27.844 2.628 1.00 0.00 H new ATOM 1583 N GLN A1015 1.161 26.868 4.597 1.00 0.00 N ATOM 1584 CA GLN A1015 1.555 26.094 5.762 1.00 0.00 C ATOM 1585 C GLN A1015 0.340 25.389 6.367 1.00 0.00 C ATOM 1586 O GLN A1015 0.471 24.323 6.967 1.00 0.00 O ATOM 1587 CB GLN A1015 2.248 26.979 6.800 1.00 0.00 C ATOM 1588 CG GLN A1015 1.308 28.080 7.297 1.00 0.00 C ATOM 1589 CD GLN A1015 1.857 28.738 8.565 1.00 0.00 C ATOM 1590 OE1 GLN A1015 3.019 29.097 8.656 1.00 0.00 O ATOM 1591 NE2 GLN A1015 0.958 28.875 9.535 1.00 0.00 N ATOM 0 H GLN A1015 1.620 27.775 4.513 1.00 0.00 H new ATOM 0 HA GLN A1015 2.270 25.335 5.444 1.00 0.00 H new ATOM 0 HB2 GLN A1015 2.577 26.369 7.642 1.00 0.00 H new ATOM 0 HB3 GLN A1015 3.140 27.427 6.363 1.00 0.00 H new ATOM 0 HG2 GLN A1015 1.180 28.832 6.519 1.00 0.00 H new ATOM 0 HG3 GLN A1015 0.323 27.659 7.499 1.00 0.00 H new ATOM 0 HE21 GLN A1015 0.001 28.552 9.393 1.00 0.00 H new ATOM 0 HE22 GLN A1015 1.225 29.303 10.422 1.00 0.00 H new ATOM 1600 N GLU A1016 -0.816 26.012 6.188 1.00 0.00 N ATOM 1601 CA GLU A1016 -2.054 25.457 6.709 1.00 0.00 C ATOM 1602 C GLU A1016 -2.413 24.170 5.964 1.00 0.00 C ATOM 1603 O GLU A1016 -2.499 23.102 6.569 1.00 0.00 O ATOM 1604 CB GLU A1016 -3.191 26.477 6.622 1.00 0.00 C ATOM 1605 CG GLU A1016 -3.988 26.522 7.927 1.00 0.00 C ATOM 1606 CD GLU A1016 -4.771 27.831 8.046 1.00 0.00 C ATOM 1607 OE1 GLU A1016 -4.107 28.874 8.234 1.00 0.00 O ATOM 1608 OE2 GLU A1016 -6.015 27.760 7.948 1.00 0.00 O ATOM 0 H GLU A1016 -0.921 26.896 5.690 1.00 0.00 H new ATOM 0 HA GLU A1016 -1.907 25.215 7.762 1.00 0.00 H new ATOM 0 HB2 GLU A1016 -2.783 27.464 6.407 1.00 0.00 H new ATOM 0 HB3 GLU A1016 -3.853 26.219 5.796 1.00 0.00 H new ATOM 0 HG2 GLU A1016 -4.676 25.678 7.966 1.00 0.00 H new ATOM 0 HG3 GLU A1016 -3.310 26.421 8.775 1.00 0.00 H new ATOM 1615 N TYR A1017 -2.614 24.314 4.662 1.00 0.00 N ATOM 1616 CA TYR A1017 -2.962 23.176 3.829 1.00 0.00 C ATOM 1617 C TYR A1017 -1.812 22.169 3.767 1.00 0.00 C ATOM 1618 O TYR A1017 -2.006 21.023 3.366 1.00 0.00 O ATOM 1619 CB TYR A1017 -3.207 23.739 2.427 1.00 0.00 C ATOM 1620 CG TYR A1017 -4.679 23.750 2.010 1.00 0.00 C ATOM 1621 CD1 TYR A1017 -5.475 24.836 2.315 1.00 0.00 C ATOM 1622 CD2 TYR A1017 -5.211 22.675 1.328 1.00 0.00 C ATOM 1623 CE1 TYR A1017 -6.860 24.846 1.923 1.00 0.00 C ATOM 1624 CE2 TYR A1017 -6.597 22.686 0.935 1.00 0.00 C ATOM 1625 CZ TYR A1017 -7.353 23.771 1.252 1.00 0.00 C ATOM 1626 OH TYR A1017 -8.661 23.781 0.880 1.00 0.00 O ATOM 0 H TYR A1017 -2.542 25.201 4.164 1.00 0.00 H new ATOM 0 HA TYR A1017 -3.834 22.659 4.231 1.00 0.00 H new ATOM 0 HB2 TYR A1017 -2.820 24.757 2.382 1.00 0.00 H new ATOM 0 HB3 TYR A1017 -2.640 23.150 1.706 1.00 0.00 H new ATOM 0 HD1 TYR A1017 -5.059 25.678 2.848 1.00 0.00 H new ATOM 0 HD2 TYR A1017 -4.589 21.825 1.089 1.00 0.00 H new ATOM 0 HE1 TYR A1017 -7.494 25.689 2.157 1.00 0.00 H new ATOM 0 HE2 TYR A1017 -7.026 21.851 0.401 1.00 0.00 H new ATOM 0 HH TYR A1017 -8.813 24.505 0.237 1.00 0.00 H new ATOM 1636 N LYS A1018 -0.639 22.634 4.170 1.00 0.00 N ATOM 1637 CA LYS A1018 0.543 21.788 4.166 1.00 0.00 C ATOM 1638 C LYS A1018 0.426 20.749 5.283 1.00 0.00 C ATOM 1639 O LYS A1018 0.781 19.587 5.094 1.00 0.00 O ATOM 1640 CB LYS A1018 1.811 22.640 4.249 1.00 0.00 C ATOM 1641 CG LYS A1018 2.790 22.277 3.130 1.00 0.00 C ATOM 1642 CD LYS A1018 2.748 23.315 2.007 1.00 0.00 C ATOM 1643 CE LYS A1018 1.338 23.437 1.425 1.00 0.00 C ATOM 1644 NZ LYS A1018 1.368 24.186 0.149 1.00 0.00 N ATOM 0 H LYS A1018 -0.481 23.586 4.502 1.00 0.00 H new ATOM 0 HA LYS A1018 0.616 21.239 3.227 1.00 0.00 H new ATOM 0 HB2 LYS A1018 1.549 23.696 4.180 1.00 0.00 H new ATOM 0 HB3 LYS A1018 2.289 22.493 5.217 1.00 0.00 H new ATOM 0 HG2 LYS A1018 3.801 22.213 3.533 1.00 0.00 H new ATOM 0 HG3 LYS A1018 2.543 21.293 2.730 1.00 0.00 H new ATOM 0 HD2 LYS A1018 3.072 24.283 2.389 1.00 0.00 H new ATOM 0 HD3 LYS A1018 3.447 23.033 1.220 1.00 0.00 H new ATOM 0 HE2 LYS A1018 0.918 22.444 1.261 1.00 0.00 H new ATOM 0 HE3 LYS A1018 0.687 23.945 2.137 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 0.618 24.906 0.152 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 2.293 24.650 0.040 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 1.215 23.529 -0.643 1.00 0.00 H new ATOM 1658 N LYS A1019 -0.075 21.205 6.422 1.00 0.00 N ATOM 1659 CA LYS A1019 -0.244 20.330 7.569 1.00 0.00 C ATOM 1660 C LYS A1019 -1.376 19.340 7.287 1.00 0.00 C ATOM 1661 O LYS A1019 -1.355 18.212 7.777 1.00 0.00 O ATOM 1662 CB LYS A1019 -0.447 21.151 8.844 1.00 0.00 C ATOM 1663 CG LYS A1019 0.788 21.999 9.153 1.00 0.00 C ATOM 1664 CD LYS A1019 2.018 21.116 9.376 1.00 0.00 C ATOM 1665 CE LYS A1019 2.957 21.171 8.170 1.00 0.00 C ATOM 1666 NZ LYS A1019 4.352 21.397 8.609 1.00 0.00 N ATOM 0 H LYS A1019 -0.369 22.170 6.575 1.00 0.00 H new ATOM 0 HA LYS A1019 0.659 19.743 7.737 1.00 0.00 H new ATOM 0 HB2 LYS A1019 -1.317 21.798 8.730 1.00 0.00 H new ATOM 0 HB3 LYS A1019 -0.653 20.484 9.681 1.00 0.00 H new ATOM 0 HG2 LYS A1019 0.975 22.688 8.330 1.00 0.00 H new ATOM 0 HG3 LYS A1019 0.605 22.605 10.041 1.00 0.00 H new ATOM 0 HD2 LYS A1019 2.549 21.444 10.270 1.00 0.00 H new ATOM 0 HD3 LYS A1019 1.705 20.087 9.551 1.00 0.00 H new ATOM 0 HE2 LYS A1019 2.893 20.239 7.609 1.00 0.00 H new ATOM 0 HE3 LYS A1019 2.647 21.970 7.497 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 4.976 21.432 7.778 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 4.412 22.298 9.125 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 4.650 20.620 9.233 1.00 0.00 H new ATOM 1680 N GLN A1020 -2.337 19.799 6.500 1.00 0.00 N ATOM 1681 CA GLN A1020 -3.476 18.968 6.147 1.00 0.00 C ATOM 1682 C GLN A1020 -3.019 17.765 5.319 1.00 0.00 C ATOM 1683 O GLN A1020 -3.132 16.623 5.763 1.00 0.00 O ATOM 1684 CB GLN A1020 -4.535 19.778 5.398 1.00 0.00 C ATOM 1685 CG GLN A1020 -4.958 21.007 6.206 1.00 0.00 C ATOM 1686 CD GLN A1020 -5.719 20.597 7.469 1.00 0.00 C ATOM 1687 OE1 GLN A1020 -6.561 19.714 7.459 1.00 0.00 O ATOM 1688 NE2 GLN A1020 -5.377 21.286 8.554 1.00 0.00 N ATOM 0 H GLN A1020 -2.351 20.736 6.096 1.00 0.00 H new ATOM 0 HA GLN A1020 -3.931 18.600 7.067 1.00 0.00 H new ATOM 0 HB2 GLN A1020 -4.142 20.092 4.431 1.00 0.00 H new ATOM 0 HB3 GLN A1020 -5.405 19.151 5.200 1.00 0.00 H new ATOM 0 HG2 GLN A1020 -4.077 21.587 6.480 1.00 0.00 H new ATOM 0 HG3 GLN A1020 -5.586 21.652 5.592 1.00 0.00 H new ATOM 0 HE21 GLN A1020 -4.664 22.013 8.493 1.00 0.00 H new ATOM 0 HE22 GLN A1020 -5.828 21.088 9.447 1.00 0.00 H new ATOM 1697 N MET A1021 -2.513 18.062 4.131 1.00 0.00 N ATOM 1698 CA MET A1021 -2.039 17.019 3.238 1.00 0.00 C ATOM 1699 C MET A1021 -1.076 16.075 3.959 1.00 0.00 C ATOM 1700 O MET A1021 -0.932 14.915 3.574 1.00 0.00 O ATOM 1701 CB MET A1021 -1.329 17.656 2.041 1.00 0.00 C ATOM 1702 CG MET A1021 -0.036 18.350 2.477 1.00 0.00 C ATOM 1703 SD MET A1021 1.352 17.669 1.586 1.00 0.00 S ATOM 1704 CE MET A1021 1.251 15.965 2.109 1.00 0.00 C ATOM 0 H MET A1021 -2.421 19.010 3.766 1.00 0.00 H new ATOM 0 HA MET A1021 -2.898 16.440 2.898 1.00 0.00 H new ATOM 0 HB2 MET A1021 -1.103 16.891 1.298 1.00 0.00 H new ATOM 0 HB3 MET A1021 -1.991 18.378 1.563 1.00 0.00 H new ATOM 0 HG2 MET A1021 -0.108 19.422 2.291 1.00 0.00 H new ATOM 0 HG3 MET A1021 0.111 18.222 3.549 1.00 0.00 H new ATOM 0 HE1 MET A1021 2.112 15.416 1.728 1.00 0.00 H new ATOM 0 HE2 MET A1021 1.244 15.918 3.198 1.00 0.00 H new ATOM 0 HE3 MET A1021 0.335 15.519 1.721 1.00 0.00 H new ATOM 1714 N LEU A1022 -0.442 16.605 4.995 1.00 0.00 N ATOM 1715 CA LEU A1022 0.503 15.824 5.774 1.00 0.00 C ATOM 1716 C LEU A1022 -0.263 14.840 6.660 1.00 0.00 C ATOM 1717 O LEU A1022 -0.006 13.637 6.625 1.00 0.00 O ATOM 1718 CB LEU A1022 1.447 16.744 6.551 1.00 0.00 C ATOM 1719 CG LEU A1022 2.907 16.292 6.634 1.00 0.00 C ATOM 1720 CD1 LEU A1022 3.855 17.430 6.253 1.00 0.00 C ATOM 1721 CD2 LEU A1022 3.225 15.718 8.016 1.00 0.00 C ATOM 0 H LEU A1022 -0.565 17.566 5.313 1.00 0.00 H new ATOM 0 HA LEU A1022 1.141 15.233 5.117 1.00 0.00 H new ATOM 0 HB2 LEU A1022 1.419 17.732 6.092 1.00 0.00 H new ATOM 0 HB3 LEU A1022 1.063 16.853 7.565 1.00 0.00 H new ATOM 0 HG LEU A1022 3.059 15.491 5.911 1.00 0.00 H new ATOM 0 HD11 LEU A1022 4.886 17.083 6.320 1.00 0.00 H new ATOM 0 HD12 LEU A1022 3.646 17.751 5.233 1.00 0.00 H new ATOM 0 HD13 LEU A1022 3.709 18.268 6.934 1.00 0.00 H new ATOM 0 HD21 LEU A1022 4.268 15.404 8.048 1.00 0.00 H new ATOM 0 HD22 LEU A1022 3.052 16.480 8.775 1.00 0.00 H new ATOM 0 HD23 LEU A1022 2.582 14.860 8.210 1.00 0.00 H new ATOM 1733 N THR A1023 -1.190 15.387 7.432 1.00 0.00 N ATOM 1734 CA THR A1023 -1.996 14.572 8.326 1.00 0.00 C ATOM 1735 C THR A1023 -2.350 13.241 7.660 1.00 0.00 C ATOM 1736 O THR A1023 -2.249 12.185 8.283 1.00 0.00 O ATOM 1737 CB THR A1023 -3.222 15.391 8.736 1.00 0.00 C ATOM 1738 OG1 THR A1023 -2.695 16.683 9.024 1.00 0.00 O ATOM 1739 CG2 THR A1023 -3.818 14.926 10.066 1.00 0.00 C ATOM 0 H THR A1023 -1.401 16.385 7.457 1.00 0.00 H new ATOM 0 HA THR A1023 -1.444 14.311 9.229 1.00 0.00 H new ATOM 0 HB THR A1023 -3.981 15.325 7.956 1.00 0.00 H new ATOM 0 HG1 THR A1023 -2.690 17.224 8.207 1.00 0.00 H new ATOM 0 HG21 THR A1023 -4.685 15.540 10.311 1.00 0.00 H new ATOM 0 HG22 THR A1023 -4.124 13.883 9.983 1.00 0.00 H new ATOM 0 HG23 THR A1023 -3.071 15.023 10.853 1.00 0.00 H new ATOM 1747 N ALA A1024 -2.757 13.334 6.403 1.00 0.00 N ATOM 1748 CA ALA A1024 -3.126 12.150 5.645 1.00 0.00 C ATOM 1749 C ALA A1024 -1.859 11.421 5.197 1.00 0.00 C ATOM 1750 O ALA A1024 -1.654 10.257 5.539 1.00 0.00 O ATOM 1751 CB ALA A1024 -4.014 12.554 4.467 1.00 0.00 C ATOM 0 H ALA A1024 -2.840 14.212 5.890 1.00 0.00 H new ATOM 0 HA ALA A1024 -3.700 11.461 6.265 1.00 0.00 H new ATOM 0 HB1 ALA A1024 -4.291 11.666 3.899 1.00 0.00 H new ATOM 0 HB2 ALA A1024 -4.915 13.041 4.841 1.00 0.00 H new ATOM 0 HB3 ALA A1024 -3.470 13.243 3.821 1.00 0.00 H new ATOM 1757 N ALA A1025 -1.040 12.135 4.439 1.00 0.00 N ATOM 1758 CA ALA A1025 0.202 11.570 3.940 1.00 0.00 C ATOM 1759 C ALA A1025 0.906 10.818 5.072 1.00 0.00 C ATOM 1760 O ALA A1025 1.685 9.900 4.821 1.00 0.00 O ATOM 1761 CB ALA A1025 1.071 12.685 3.353 1.00 0.00 C ATOM 0 H ALA A1025 -1.212 13.100 4.158 1.00 0.00 H new ATOM 0 HA ALA A1025 0.005 10.855 3.141 1.00 0.00 H new ATOM 0 HB1 ALA A1025 2.003 12.261 2.979 1.00 0.00 H new ATOM 0 HB2 ALA A1025 0.538 13.169 2.535 1.00 0.00 H new ATOM 0 HB3 ALA A1025 1.292 13.420 4.127 1.00 0.00 H new ATOM 1767 N HIS A1026 0.605 11.234 6.293 1.00 0.00 N ATOM 1768 CA HIS A1026 1.198 10.611 7.463 1.00 0.00 C ATOM 1769 C HIS A1026 0.527 9.261 7.722 1.00 0.00 C ATOM 1770 O HIS A1026 1.181 8.220 7.678 1.00 0.00 O ATOM 1771 CB HIS A1026 1.130 11.548 8.671 1.00 0.00 C ATOM 1772 CG HIS A1026 1.970 11.101 9.843 1.00 0.00 C ATOM 1773 ND1 HIS A1026 3.273 10.653 9.705 1.00 0.00 N ATOM 1774 CD2 HIS A1026 1.681 11.039 11.175 1.00 0.00 C ATOM 1775 CE1 HIS A1026 3.736 10.337 10.905 1.00 0.00 C ATOM 1776 NE2 HIS A1026 2.748 10.576 11.815 1.00 0.00 N ATOM 0 H HIS A1026 -0.042 11.995 6.497 1.00 0.00 H new ATOM 0 HA HIS A1026 2.256 10.423 7.281 1.00 0.00 H new ATOM 0 HB2 HIS A1026 1.453 12.543 8.365 1.00 0.00 H new ATOM 0 HB3 HIS A1026 0.092 11.634 8.993 1.00 0.00 H new ATOM 0 HD2 HIS A1026 0.743 11.319 11.631 1.00 0.00 H new ATOM 0 HE1 HIS A1026 4.723 9.957 11.125 1.00 0.00 H new ATOM 0 HE2 HIS A1026 2.818 10.424 12.821 1.00 0.00 H new ATOM 1784 N ALA A1027 -0.770 9.322 7.987 1.00 0.00 N ATOM 1785 CA ALA A1027 -1.537 8.117 8.253 1.00 0.00 C ATOM 1786 C ALA A1027 -1.553 7.241 6.999 1.00 0.00 C ATOM 1787 O ALA A1027 -1.440 6.019 7.089 1.00 0.00 O ATOM 1788 CB ALA A1027 -2.945 8.500 8.714 1.00 0.00 C ATOM 0 H ALA A1027 -1.309 10.187 8.023 1.00 0.00 H new ATOM 0 HA ALA A1027 -1.077 7.538 9.054 1.00 0.00 H new ATOM 0 HB1 ALA A1027 -3.521 7.596 8.914 1.00 0.00 H new ATOM 0 HB2 ALA A1027 -2.880 9.097 9.623 1.00 0.00 H new ATOM 0 HB3 ALA A1027 -3.438 9.080 7.934 1.00 0.00 H new ATOM 1794 N LEU A1028 -1.694 7.899 5.857 1.00 0.00 N ATOM 1795 CA LEU A1028 -1.726 7.195 4.587 1.00 0.00 C ATOM 1796 C LEU A1028 -0.553 6.215 4.522 1.00 0.00 C ATOM 1797 O LEU A1028 -0.753 5.002 4.490 1.00 0.00 O ATOM 1798 CB LEU A1028 -1.762 8.189 3.424 1.00 0.00 C ATOM 1799 CG LEU A1028 -3.153 8.617 2.951 1.00 0.00 C ATOM 1800 CD1 LEU A1028 -3.765 7.564 2.025 1.00 0.00 C ATOM 1801 CD2 LEU A1028 -4.062 8.935 4.139 1.00 0.00 C ATOM 0 H LEU A1028 -1.787 8.912 5.785 1.00 0.00 H new ATOM 0 HA LEU A1028 -2.639 6.606 4.501 1.00 0.00 H new ATOM 0 HB2 LEU A1028 -1.209 9.081 3.717 1.00 0.00 H new ATOM 0 HB3 LEU A1028 -1.232 7.749 2.579 1.00 0.00 H new ATOM 0 HG LEU A1028 -3.050 9.534 2.371 1.00 0.00 H new ATOM 0 HD11 LEU A1028 -4.753 7.893 1.703 1.00 0.00 H new ATOM 0 HD12 LEU A1028 -3.125 7.431 1.153 1.00 0.00 H new ATOM 0 HD13 LEU A1028 -3.853 6.618 2.558 1.00 0.00 H new ATOM 0 HD21 LEU A1028 -5.044 9.236 3.775 1.00 0.00 H new ATOM 0 HD22 LEU A1028 -4.164 8.050 4.767 1.00 0.00 H new ATOM 0 HD23 LEU A1028 -3.627 9.746 4.723 1.00 0.00 H new ATOM 1813 N ALA A1029 0.647 6.778 4.504 1.00 0.00 N ATOM 1814 CA ALA A1029 1.852 5.969 4.443 1.00 0.00 C ATOM 1815 C ALA A1029 1.677 4.734 5.329 1.00 0.00 C ATOM 1816 O ALA A1029 1.889 3.608 4.880 1.00 0.00 O ATOM 1817 CB ALA A1029 3.057 6.816 4.856 1.00 0.00 C ATOM 0 H ALA A1029 0.810 7.785 4.531 1.00 0.00 H new ATOM 0 HA ALA A1029 2.030 5.622 3.425 1.00 0.00 H new ATOM 0 HB1 ALA A1029 3.961 6.209 4.810 1.00 0.00 H new ATOM 0 HB2 ALA A1029 3.155 7.664 4.179 1.00 0.00 H new ATOM 0 HB3 ALA A1029 2.915 7.179 5.874 1.00 0.00 H new ATOM 1823 N VAL A1030 1.293 4.986 6.572 1.00 0.00 N ATOM 1824 CA VAL A1030 1.088 3.908 7.524 1.00 0.00 C ATOM 1825 C VAL A1030 -0.030 2.993 7.020 1.00 0.00 C ATOM 1826 O VAL A1030 0.092 1.770 7.076 1.00 0.00 O ATOM 1827 CB VAL A1030 0.807 4.484 8.914 1.00 0.00 C ATOM 1828 CG1 VAL A1030 0.038 3.482 9.778 1.00 0.00 C ATOM 1829 CG2 VAL A1030 2.103 4.919 9.600 1.00 0.00 C ATOM 0 H VAL A1030 1.119 5.921 6.941 1.00 0.00 H new ATOM 0 HA VAL A1030 1.989 3.301 7.613 1.00 0.00 H new ATOM 0 HB VAL A1030 0.181 5.368 8.790 1.00 0.00 H new ATOM 0 HG11 VAL A1030 -0.149 3.916 10.760 1.00 0.00 H new ATOM 0 HG12 VAL A1030 -0.912 3.244 9.300 1.00 0.00 H new ATOM 0 HG13 VAL A1030 0.626 2.571 9.890 1.00 0.00 H new ATOM 0 HG21 VAL A1030 1.875 5.324 10.586 1.00 0.00 H new ATOM 0 HG22 VAL A1030 2.765 4.060 9.706 1.00 0.00 H new ATOM 0 HG23 VAL A1030 2.594 5.684 8.998 1.00 0.00 H new ATOM 1839 N ASP A1031 -1.093 3.620 6.538 1.00 0.00 N ATOM 1840 CA ASP A1031 -2.231 2.878 6.023 1.00 0.00 C ATOM 1841 C ASP A1031 -1.753 1.904 4.944 1.00 0.00 C ATOM 1842 O ASP A1031 -2.113 0.728 4.961 1.00 0.00 O ATOM 1843 CB ASP A1031 -3.261 3.816 5.391 1.00 0.00 C ATOM 1844 CG ASP A1031 -3.837 4.873 6.335 1.00 0.00 C ATOM 1845 OD1 ASP A1031 -3.802 4.621 7.559 1.00 0.00 O ATOM 1846 OD2 ASP A1031 -4.300 5.910 5.812 1.00 0.00 O ATOM 0 H ASP A1031 -1.190 4.634 6.493 1.00 0.00 H new ATOM 0 HA ASP A1031 -2.692 2.347 6.856 1.00 0.00 H new ATOM 0 HB2 ASP A1031 -2.798 4.321 4.543 1.00 0.00 H new ATOM 0 HB3 ASP A1031 -4.082 3.217 4.996 1.00 0.00 H new ATOM 1851 N ALA A1032 -0.950 2.430 4.031 1.00 0.00 N ATOM 1852 CA ALA A1032 -0.419 1.622 2.946 1.00 0.00 C ATOM 1853 C ALA A1032 0.378 0.454 3.529 1.00 0.00 C ATOM 1854 O ALA A1032 0.569 -0.564 2.866 1.00 0.00 O ATOM 1855 CB ALA A1032 0.425 2.501 2.021 1.00 0.00 C ATOM 0 H ALA A1032 -0.654 3.406 4.020 1.00 0.00 H new ATOM 0 HA ALA A1032 -1.228 1.202 2.348 1.00 0.00 H new ATOM 0 HB1 ALA A1032 0.823 1.895 1.207 1.00 0.00 H new ATOM 0 HB2 ALA A1032 -0.195 3.298 1.610 1.00 0.00 H new ATOM 0 HB3 ALA A1032 1.249 2.937 2.586 1.00 0.00 H new ATOM 1861 N LYS A1033 0.823 0.640 4.763 1.00 0.00 N ATOM 1862 CA LYS A1033 1.596 -0.386 5.443 1.00 0.00 C ATOM 1863 C LYS A1033 0.667 -1.531 5.851 1.00 0.00 C ATOM 1864 O LYS A1033 0.981 -2.699 5.629 1.00 0.00 O ATOM 1865 CB LYS A1033 2.377 0.218 6.611 1.00 0.00 C ATOM 1866 CG LYS A1033 3.682 -0.545 6.851 1.00 0.00 C ATOM 1867 CD LYS A1033 4.862 0.163 6.184 1.00 0.00 C ATOM 1868 CE LYS A1033 5.766 -0.838 5.462 1.00 0.00 C ATOM 1869 NZ LYS A1033 5.980 -0.424 4.057 1.00 0.00 N ATOM 0 H LYS A1033 0.663 1.486 5.310 1.00 0.00 H new ATOM 0 HA LYS A1033 2.345 -0.806 4.772 1.00 0.00 H new ATOM 0 HB2 LYS A1033 2.597 1.265 6.403 1.00 0.00 H new ATOM 0 HB3 LYS A1033 1.766 0.193 7.513 1.00 0.00 H new ATOM 0 HG2 LYS A1033 3.864 -0.633 7.922 1.00 0.00 H new ATOM 0 HG3 LYS A1033 3.592 -1.558 6.459 1.00 0.00 H new ATOM 0 HD2 LYS A1033 4.492 0.903 5.474 1.00 0.00 H new ATOM 0 HD3 LYS A1033 5.438 0.703 6.935 1.00 0.00 H new ATOM 0 HE2 LYS A1033 6.724 -0.908 5.977 1.00 0.00 H new ATOM 0 HE3 LYS A1033 5.315 -1.830 5.490 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 6.596 -1.114 3.582 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 5.065 -0.380 3.565 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 6.430 0.513 4.036 1.00 0.00 H new ATOM 1883 N ASN A1034 -0.458 -1.156 6.442 1.00 0.00 N ATOM 1884 CA ASN A1034 -1.435 -2.138 6.883 1.00 0.00 C ATOM 1885 C ASN A1034 -1.933 -2.934 5.675 1.00 0.00 C ATOM 1886 O ASN A1034 -2.427 -4.051 5.824 1.00 0.00 O ATOM 1887 CB ASN A1034 -2.642 -1.460 7.533 1.00 0.00 C ATOM 1888 CG ASN A1034 -3.525 -0.786 6.481 1.00 0.00 C ATOM 1889 OD1 ASN A1034 -3.851 -1.353 5.451 1.00 0.00 O ATOM 1890 ND2 ASN A1034 -3.893 0.453 6.796 1.00 0.00 N ATOM 0 H ASN A1034 -0.715 -0.186 6.626 1.00 0.00 H new ATOM 0 HA ASN A1034 -0.953 -2.790 7.611 1.00 0.00 H new ATOM 0 HB2 ASN A1034 -3.225 -2.198 8.084 1.00 0.00 H new ATOM 0 HB3 ASN A1034 -2.302 -0.719 8.256 1.00 0.00 H new ATOM 0 HD21 ASN A1034 -4.483 0.987 6.159 1.00 0.00 H new ATOM 0 HD22 ASN A1034 -3.585 0.869 7.675 1.00 0.00 H new ATOM 1897 N LEU A1035 -1.787 -2.328 4.506 1.00 0.00 N ATOM 1898 CA LEU A1035 -2.216 -2.966 3.273 1.00 0.00 C ATOM 1899 C LEU A1035 -1.357 -4.207 3.021 1.00 0.00 C ATOM 1900 O LEU A1035 -1.869 -5.325 2.991 1.00 0.00 O ATOM 1901 CB LEU A1035 -2.202 -1.964 2.118 1.00 0.00 C ATOM 1902 CG LEU A1035 -2.066 -2.559 0.715 1.00 0.00 C ATOM 1903 CD1 LEU A1035 -3.005 -1.860 -0.271 1.00 0.00 C ATOM 1904 CD2 LEU A1035 -0.611 -2.525 0.243 1.00 0.00 C ATOM 0 H LEU A1035 -1.377 -1.402 4.387 1.00 0.00 H new ATOM 0 HA LEU A1035 -3.249 -3.304 3.358 1.00 0.00 H new ATOM 0 HB2 LEU A1035 -3.123 -1.382 2.157 1.00 0.00 H new ATOM 0 HB3 LEU A1035 -1.379 -1.268 2.277 1.00 0.00 H new ATOM 0 HG LEU A1035 -2.366 -3.606 0.758 1.00 0.00 H new ATOM 0 HD11 LEU A1035 -2.888 -2.302 -1.260 1.00 0.00 H new ATOM 0 HD12 LEU A1035 -4.036 -1.980 0.061 1.00 0.00 H new ATOM 0 HD13 LEU A1035 -2.760 -0.799 -0.317 1.00 0.00 H new ATOM 0 HD21 LEU A1035 -0.543 -2.954 -0.757 1.00 0.00 H new ATOM 0 HD22 LEU A1035 -0.260 -1.493 0.220 1.00 0.00 H new ATOM 0 HD23 LEU A1035 0.008 -3.104 0.929 1.00 0.00 H new ATOM 1916 N LEU A1036 -0.066 -3.969 2.845 1.00 0.00 N ATOM 1917 CA LEU A1036 0.869 -5.053 2.596 1.00 0.00 C ATOM 1918 C LEU A1036 1.009 -5.900 3.863 1.00 0.00 C ATOM 1919 O LEU A1036 1.085 -7.126 3.789 1.00 0.00 O ATOM 1920 CB LEU A1036 2.198 -4.506 2.073 1.00 0.00 C ATOM 1921 CG LEU A1036 2.900 -5.353 1.009 1.00 0.00 C ATOM 1922 CD1 LEU A1036 2.829 -4.679 -0.363 1.00 0.00 C ATOM 1923 CD2 LEU A1036 4.340 -5.666 1.420 1.00 0.00 C ATOM 0 H LEU A1036 0.355 -3.040 2.870 1.00 0.00 H new ATOM 0 HA LEU A1036 0.491 -5.709 1.812 1.00 0.00 H new ATOM 0 HB2 LEU A1036 2.022 -3.513 1.660 1.00 0.00 H new ATOM 0 HB3 LEU A1036 2.876 -4.385 2.918 1.00 0.00 H new ATOM 0 HG LEU A1036 2.374 -6.304 0.928 1.00 0.00 H new ATOM 0 HD11 LEU A1036 3.335 -5.301 -1.101 1.00 0.00 H new ATOM 0 HD12 LEU A1036 1.786 -4.550 -0.651 1.00 0.00 H new ATOM 0 HD13 LEU A1036 3.315 -3.705 -0.315 1.00 0.00 H new ATOM 0 HD21 LEU A1036 4.816 -6.269 0.647 1.00 0.00 H new ATOM 0 HD22 LEU A1036 4.893 -4.735 1.546 1.00 0.00 H new ATOM 0 HD23 LEU A1036 4.338 -6.217 2.360 1.00 0.00 H new ATOM 1935 N ASP A1037 1.038 -5.214 4.996 1.00 0.00 N ATOM 1936 CA ASP A1037 1.167 -5.888 6.276 1.00 0.00 C ATOM 1937 C ASP A1037 0.151 -7.029 6.352 1.00 0.00 C ATOM 1938 O ASP A1037 0.464 -8.112 6.844 1.00 0.00 O ATOM 1939 CB ASP A1037 0.888 -4.928 7.435 1.00 0.00 C ATOM 1940 CG ASP A1037 1.111 -5.516 8.829 1.00 0.00 C ATOM 1941 OD1 ASP A1037 2.264 -5.915 9.099 1.00 0.00 O ATOM 1942 OD2 ASP A1037 0.123 -5.553 9.594 1.00 0.00 O ATOM 0 H ASP A1037 0.974 -4.198 5.054 1.00 0.00 H new ATOM 0 HA ASP A1037 2.187 -6.265 6.357 1.00 0.00 H new ATOM 0 HB2 ASP A1037 1.524 -4.050 7.321 1.00 0.00 H new ATOM 0 HB3 ASP A1037 -0.144 -4.585 7.363 1.00 0.00 H new ATOM 1947 N VAL A1038 -1.045 -6.747 5.857 1.00 0.00 N ATOM 1948 CA VAL A1038 -2.109 -7.737 5.863 1.00 0.00 C ATOM 1949 C VAL A1038 -1.801 -8.817 4.823 1.00 0.00 C ATOM 1950 O VAL A1038 -2.241 -9.957 4.959 1.00 0.00 O ATOM 1951 CB VAL A1038 -3.459 -7.055 5.634 1.00 0.00 C ATOM 1952 CG1 VAL A1038 -3.745 -6.891 4.140 1.00 0.00 C ATOM 1953 CG2 VAL A1038 -4.586 -7.823 6.326 1.00 0.00 C ATOM 0 H VAL A1038 -1.301 -5.848 5.449 1.00 0.00 H new ATOM 0 HA VAL A1038 -2.168 -8.228 6.834 1.00 0.00 H new ATOM 0 HB VAL A1038 -3.410 -6.060 6.077 1.00 0.00 H new ATOM 0 HG11 VAL A1038 -4.711 -6.404 4.006 1.00 0.00 H new ATOM 0 HG12 VAL A1038 -2.964 -6.281 3.685 1.00 0.00 H new ATOM 0 HG13 VAL A1038 -3.764 -7.871 3.663 1.00 0.00 H new ATOM 0 HG21 VAL A1038 -5.535 -7.317 6.147 1.00 0.00 H new ATOM 0 HG22 VAL A1038 -4.635 -8.836 5.927 1.00 0.00 H new ATOM 0 HG23 VAL A1038 -4.393 -7.864 7.398 1.00 0.00 H new ATOM 1963 N ILE A1039 -1.048 -8.418 3.809 1.00 0.00 N ATOM 1964 CA ILE A1039 -0.676 -9.338 2.747 1.00 0.00 C ATOM 1965 C ILE A1039 0.379 -10.314 3.270 1.00 0.00 C ATOM 1966 O ILE A1039 0.222 -11.528 3.148 1.00 0.00 O ATOM 1967 CB ILE A1039 -0.237 -8.567 1.500 1.00 0.00 C ATOM 1968 CG1 ILE A1039 -1.444 -8.163 0.651 1.00 0.00 C ATOM 1969 CG2 ILE A1039 0.789 -9.366 0.694 1.00 0.00 C ATOM 1970 CD1 ILE A1039 -1.034 -7.198 -0.462 1.00 0.00 C ATOM 0 H ILE A1039 -0.685 -7.471 3.700 1.00 0.00 H new ATOM 0 HA ILE A1039 -1.536 -9.933 2.439 1.00 0.00 H new ATOM 0 HB ILE A1039 0.252 -7.648 1.822 1.00 0.00 H new ATOM 0 HG12 ILE A1039 -1.901 -9.052 0.216 1.00 0.00 H new ATOM 0 HG13 ILE A1039 -2.198 -7.694 1.284 1.00 0.00 H new ATOM 0 HG21 ILE A1039 1.084 -8.795 -0.187 1.00 0.00 H new ATOM 0 HG22 ILE A1039 1.666 -9.560 1.312 1.00 0.00 H new ATOM 0 HG23 ILE A1039 0.349 -10.313 0.382 1.00 0.00 H new ATOM 0 HD11 ILE A1039 -1.911 -6.927 -1.050 1.00 0.00 H new ATOM 0 HD12 ILE A1039 -0.600 -6.300 -0.023 1.00 0.00 H new ATOM 0 HD13 ILE A1039 -0.299 -7.678 -1.107 1.00 0.00 H new ATOM 1982 N ASP A1040 1.432 -9.747 3.841 1.00 0.00 N ATOM 1983 CA ASP A1040 2.513 -10.553 4.383 1.00 0.00 C ATOM 1984 C ASP A1040 1.938 -11.583 5.356 1.00 0.00 C ATOM 1985 O ASP A1040 2.208 -12.777 5.234 1.00 0.00 O ATOM 1986 CB ASP A1040 3.515 -9.686 5.149 1.00 0.00 C ATOM 1987 CG ASP A1040 4.978 -9.882 4.749 1.00 0.00 C ATOM 1988 OD1 ASP A1040 5.491 -10.995 4.998 1.00 0.00 O ATOM 1989 OD2 ASP A1040 5.552 -8.915 4.203 1.00 0.00 O ATOM 0 H ASP A1040 1.559 -8.740 3.940 1.00 0.00 H new ATOM 0 HA ASP A1040 3.020 -11.041 3.550 1.00 0.00 H new ATOM 0 HB2 ASP A1040 3.252 -8.638 5.004 1.00 0.00 H new ATOM 0 HB3 ASP A1040 3.414 -9.895 6.214 1.00 0.00 H new ATOM 1994 N GLN A1041 1.154 -11.084 6.301 1.00 0.00 N ATOM 1995 CA GLN A1041 0.538 -11.946 7.295 1.00 0.00 C ATOM 1996 C GLN A1041 -0.432 -12.921 6.624 1.00 0.00 C ATOM 1997 O GLN A1041 -0.692 -14.003 7.148 1.00 0.00 O ATOM 1998 CB GLN A1041 -0.170 -11.123 8.372 1.00 0.00 C ATOM 1999 CG GLN A1041 0.825 -10.614 9.417 1.00 0.00 C ATOM 2000 CD GLN A1041 0.118 -10.278 10.731 1.00 0.00 C ATOM 2001 OE1 GLN A1041 0.250 -10.965 11.731 1.00 0.00 O ATOM 2002 NE2 GLN A1041 -0.639 -9.186 10.674 1.00 0.00 N ATOM 0 H GLN A1041 0.931 -10.093 6.399 1.00 0.00 H new ATOM 0 HA GLN A1041 1.323 -12.523 7.783 1.00 0.00 H new ATOM 0 HB2 GLN A1041 -0.682 -10.279 7.911 1.00 0.00 H new ATOM 0 HB3 GLN A1041 -0.933 -11.732 8.857 1.00 0.00 H new ATOM 0 HG2 GLN A1041 1.590 -11.370 9.595 1.00 0.00 H new ATOM 0 HG3 GLN A1041 1.335 -9.728 9.038 1.00 0.00 H new ATOM 0 HE21 GLN A1041 -0.706 -8.656 9.805 1.00 0.00 H new ATOM 0 HE22 GLN A1041 -1.153 -8.878 11.500 1.00 0.00 H new ATOM 2011 N ALA A1042 -0.940 -12.503 5.474 1.00 0.00 N ATOM 2012 CA ALA A1042 -1.876 -13.325 4.726 1.00 0.00 C ATOM 2013 C ALA A1042 -1.125 -14.502 4.100 1.00 0.00 C ATOM 2014 O ALA A1042 -1.463 -15.659 4.345 1.00 0.00 O ATOM 2015 CB ALA A1042 -2.589 -12.465 3.680 1.00 0.00 C ATOM 0 H ALA A1042 -0.721 -11.605 5.042 1.00 0.00 H new ATOM 0 HA ALA A1042 -2.641 -13.735 5.386 1.00 0.00 H new ATOM 0 HB1 ALA A1042 -3.291 -13.082 3.119 1.00 0.00 H new ATOM 0 HB2 ALA A1042 -3.130 -11.661 4.178 1.00 0.00 H new ATOM 0 HB3 ALA A1042 -1.854 -12.039 2.997 1.00 0.00 H new ATOM 2021 N ARG A1043 -0.122 -14.166 3.303 1.00 0.00 N ATOM 2022 CA ARG A1043 0.679 -15.181 2.640 1.00 0.00 C ATOM 2023 C ARG A1043 0.916 -16.367 3.577 1.00 0.00 C ATOM 2024 O ARG A1043 0.474 -17.481 3.298 1.00 0.00 O ATOM 2025 CB ARG A1043 2.029 -14.614 2.195 1.00 0.00 C ATOM 2026 CG ARG A1043 2.618 -15.436 1.048 1.00 0.00 C ATOM 2027 CD ARG A1043 4.127 -15.212 0.930 1.00 0.00 C ATOM 2028 NE ARG A1043 4.401 -14.076 0.022 1.00 0.00 N ATOM 2029 CZ ARG A1043 5.568 -13.419 -0.029 1.00 0.00 C ATOM 2030 NH1 ARG A1043 6.576 -13.780 0.777 1.00 0.00 N ATOM 2031 NH2 ARG A1043 5.726 -12.400 -0.885 1.00 0.00 N ATOM 0 H ARG A1043 0.155 -13.205 3.101 1.00 0.00 H new ATOM 0 HA ARG A1043 0.129 -15.514 1.760 1.00 0.00 H new ATOM 0 HB2 ARG A1043 1.906 -13.578 1.879 1.00 0.00 H new ATOM 0 HB3 ARG A1043 2.721 -14.610 3.037 1.00 0.00 H new ATOM 0 HG2 ARG A1043 2.416 -16.494 1.213 1.00 0.00 H new ATOM 0 HG3 ARG A1043 2.132 -15.161 0.112 1.00 0.00 H new ATOM 0 HD2 ARG A1043 4.551 -15.012 1.914 1.00 0.00 H new ATOM 0 HD3 ARG A1043 4.608 -16.114 0.553 1.00 0.00 H new ATOM 0 HE ARG A1043 3.655 -13.774 -0.604 1.00 0.00 H new ATOM 0 HH11 ARG A1043 6.455 -14.555 1.429 1.00 0.00 H new ATOM 0 HH12 ARG A1043 7.464 -13.280 0.738 1.00 0.00 H new ATOM 0 HH21 ARG A1043 4.958 -12.125 -1.497 1.00 0.00 H new ATOM 0 HH22 ARG A1043 6.614 -11.900 -0.924 1.00 0.00 H new ATOM 2045 N LEU A1044 1.613 -16.088 4.669 1.00 0.00 N ATOM 2046 CA LEU A1044 1.913 -17.118 5.648 1.00 0.00 C ATOM 2047 C LEU A1044 0.638 -17.903 5.964 1.00 0.00 C ATOM 2048 O LEU A1044 0.667 -19.129 6.057 1.00 0.00 O ATOM 2049 CB LEU A1044 2.580 -16.506 6.882 1.00 0.00 C ATOM 2050 CG LEU A1044 1.891 -15.275 7.476 1.00 0.00 C ATOM 2051 CD1 LEU A1044 0.861 -15.680 8.532 1.00 0.00 C ATOM 2052 CD2 LEU A1044 2.918 -14.284 8.027 1.00 0.00 C ATOM 0 H LEU A1044 1.978 -15.163 4.897 1.00 0.00 H new ATOM 0 HA LEU A1044 2.633 -17.829 5.244 1.00 0.00 H new ATOM 0 HB2 LEU A1044 2.641 -17.272 7.655 1.00 0.00 H new ATOM 0 HB3 LEU A1044 3.603 -16.235 6.621 1.00 0.00 H new ATOM 0 HG LEU A1044 1.351 -14.767 6.677 1.00 0.00 H new ATOM 0 HD11 LEU A1044 0.386 -14.787 8.938 1.00 0.00 H new ATOM 0 HD12 LEU A1044 0.104 -16.318 8.076 1.00 0.00 H new ATOM 0 HD13 LEU A1044 1.358 -16.224 9.335 1.00 0.00 H new ATOM 0 HD21 LEU A1044 2.402 -13.419 8.443 1.00 0.00 H new ATOM 0 HD22 LEU A1044 3.506 -14.766 8.808 1.00 0.00 H new ATOM 0 HD23 LEU A1044 3.579 -13.960 7.223 1.00 0.00 H new ATOM 2064 N LYS A1045 -0.450 -17.163 6.121 1.00 0.00 N ATOM 2065 CA LYS A1045 -1.733 -17.775 6.425 1.00 0.00 C ATOM 2066 C LYS A1045 -1.927 -19.008 5.540 1.00 0.00 C ATOM 2067 O LYS A1045 -2.521 -19.996 5.968 1.00 0.00 O ATOM 2068 CB LYS A1045 -2.859 -16.746 6.302 1.00 0.00 C ATOM 2069 CG LYS A1045 -4.004 -17.069 7.265 1.00 0.00 C ATOM 2070 CD LYS A1045 -4.603 -15.790 7.852 1.00 0.00 C ATOM 2071 CE LYS A1045 -5.917 -16.084 8.578 1.00 0.00 C ATOM 2072 NZ LYS A1045 -5.658 -16.464 9.985 1.00 0.00 N ATOM 0 H LYS A1045 -0.470 -16.146 6.044 1.00 0.00 H new ATOM 0 HA LYS A1045 -1.757 -18.118 7.459 1.00 0.00 H new ATOM 0 HB2 LYS A1045 -2.471 -15.750 6.514 1.00 0.00 H new ATOM 0 HB3 LYS A1045 -3.233 -16.731 5.278 1.00 0.00 H new ATOM 0 HG2 LYS A1045 -4.778 -17.630 6.741 1.00 0.00 H new ATOM 0 HG3 LYS A1045 -3.638 -17.706 8.070 1.00 0.00 H new ATOM 0 HD2 LYS A1045 -3.894 -15.337 8.545 1.00 0.00 H new ATOM 0 HD3 LYS A1045 -4.777 -15.067 7.055 1.00 0.00 H new ATOM 0 HE2 LYS A1045 -6.562 -15.206 8.545 1.00 0.00 H new ATOM 0 HE3 LYS A1045 -6.448 -16.889 8.070 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 -6.560 -16.660 10.463 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 -5.060 -17.315 10.010 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 -5.171 -15.684 10.471 1.00 0.00 H new ATOM 2086 N MET A1046 -1.416 -18.909 4.322 1.00 0.00 N ATOM 2087 CA MET A1046 -1.526 -20.004 3.373 1.00 0.00 C ATOM 2088 C MET A1046 -0.416 -21.035 3.594 1.00 0.00 C ATOM 2089 O MET A1046 -0.684 -22.232 3.677 1.00 0.00 O ATOM 2090 CB MET A1046 -1.436 -19.456 1.947 1.00 0.00 C ATOM 2091 CG MET A1046 -1.184 -20.581 0.942 1.00 0.00 C ATOM 2092 SD MET A1046 -1.187 -19.928 -0.719 1.00 0.00 S ATOM 2093 CE MET A1046 -0.147 -18.496 -0.491 1.00 0.00 C ATOM 0 H MET A1046 -0.925 -18.087 3.970 1.00 0.00 H new ATOM 0 HA MET A1046 -2.488 -20.494 3.523 1.00 0.00 H new ATOM 0 HB2 MET A1046 -2.361 -18.938 1.694 1.00 0.00 H new ATOM 0 HB3 MET A1046 -0.632 -18.722 1.886 1.00 0.00 H new ATOM 0 HG2 MET A1046 -0.227 -21.060 1.152 1.00 0.00 H new ATOM 0 HG3 MET A1046 -1.952 -21.348 1.042 1.00 0.00 H new ATOM 0 HE1 MET A1046 0.276 -18.197 -1.450 1.00 0.00 H new ATOM 0 HE2 MET A1046 -0.740 -17.677 -0.084 1.00 0.00 H new ATOM 0 HE3 MET A1046 0.659 -18.738 0.201 1.00 0.00 H new ATOM 2103 N ILE A1047 0.806 -20.531 3.683 1.00 0.00 N ATOM 2104 CA ILE A1047 1.957 -21.393 3.893 1.00 0.00 C ATOM 2105 C ILE A1047 1.642 -22.396 5.005 1.00 0.00 C ATOM 2106 O ILE A1047 1.711 -23.606 4.792 1.00 0.00 O ATOM 2107 CB ILE A1047 3.211 -20.557 4.156 1.00 0.00 C ATOM 2108 CG1 ILE A1047 3.703 -19.887 2.872 1.00 0.00 C ATOM 2109 CG2 ILE A1047 4.303 -21.401 4.817 1.00 0.00 C ATOM 2110 CD1 ILE A1047 3.671 -18.363 3.002 1.00 0.00 C ATOM 0 H ILE A1047 1.024 -19.537 3.614 1.00 0.00 H new ATOM 0 HA ILE A1047 2.170 -21.971 2.993 1.00 0.00 H new ATOM 0 HB ILE A1047 2.951 -19.762 4.854 1.00 0.00 H new ATOM 0 HG12 ILE A1047 4.719 -20.216 2.652 1.00 0.00 H new ATOM 0 HG13 ILE A1047 3.079 -20.197 2.034 1.00 0.00 H new ATOM 0 HG21 ILE A1047 5.184 -20.783 4.993 1.00 0.00 H new ATOM 0 HG22 ILE A1047 3.937 -21.790 5.767 1.00 0.00 H new ATOM 0 HG23 ILE A1047 4.567 -22.231 4.162 1.00 0.00 H new ATOM 0 HD11 ILE A1047 4.026 -17.911 2.076 1.00 0.00 H new ATOM 0 HD12 ILE A1047 2.650 -18.036 3.198 1.00 0.00 H new ATOM 0 HD13 ILE A1047 4.315 -18.055 3.826 1.00 0.00 H new ATOM 2122 N SER A1048 1.302 -21.856 6.166 1.00 0.00 N ATOM 2123 CA SER A1048 0.976 -22.689 7.311 1.00 0.00 C ATOM 2124 C SER A1048 -0.480 -23.151 7.225 1.00 0.00 C ATOM 2125 O SER A1048 -1.272 -22.894 8.131 1.00 0.00 O ATOM 2126 CB SER A1048 1.218 -21.940 8.623 1.00 0.00 C ATOM 2127 OG SER A1048 1.830 -22.770 9.607 1.00 0.00 O ATOM 0 H SER A1048 1.245 -20.852 6.338 1.00 0.00 H new ATOM 0 HA SER A1048 1.629 -23.562 7.296 1.00 0.00 H new ATOM 0 HB2 SER A1048 1.852 -21.074 8.434 1.00 0.00 H new ATOM 0 HB3 SER A1048 0.269 -21.563 9.006 1.00 0.00 H new ATOM 0 HG SER A1048 1.969 -22.255 10.429 1.00 0.00 H new ATOM 2133 N GLN A1049 -0.790 -23.824 6.126 1.00 0.00 N ATOM 2134 CA GLN A1049 -2.136 -24.325 5.910 1.00 0.00 C ATOM 2135 C GLN A1049 -2.157 -25.298 4.730 1.00 0.00 C ATOM 2136 O GLN A1049 -3.145 -25.373 4.000 1.00 0.00 O ATOM 2137 CB GLN A1049 -3.120 -23.174 5.689 1.00 0.00 C ATOM 2138 CG GLN A1049 -4.190 -23.149 6.782 1.00 0.00 C ATOM 2139 CD GLN A1049 -5.437 -22.397 6.312 1.00 0.00 C ATOM 2140 OE1 GLN A1049 -5.381 -21.256 5.885 1.00 0.00 O ATOM 2141 NE2 GLN A1049 -6.562 -23.099 6.414 1.00 0.00 N ATOM 0 H GLN A1049 -0.131 -24.034 5.376 1.00 0.00 H new ATOM 0 HA GLN A1049 -2.451 -24.862 6.804 1.00 0.00 H new ATOM 0 HB2 GLN A1049 -2.581 -22.227 5.681 1.00 0.00 H new ATOM 0 HB3 GLN A1049 -3.594 -23.279 4.713 1.00 0.00 H new ATOM 0 HG2 GLN A1049 -4.458 -24.169 7.057 1.00 0.00 H new ATOM 0 HG3 GLN A1049 -3.790 -22.673 7.677 1.00 0.00 H new ATOM 0 HE21 GLN A1049 -6.538 -24.051 6.781 1.00 0.00 H new ATOM 0 HE22 GLN A1049 -7.449 -22.686 6.126 1.00 0.00 H new ATOM 2150 N SER A1050 -1.056 -26.020 4.579 1.00 0.00 N ATOM 2151 CA SER A1050 -0.936 -26.985 3.500 1.00 0.00 C ATOM 2152 C SER A1050 0.239 -27.928 3.770 1.00 0.00 C ATOM 2153 O SER A1050 1.327 -27.740 3.229 1.00 0.00 O ATOM 2154 CB SER A1050 -0.755 -26.285 2.152 1.00 0.00 C ATOM 2155 OG SER A1050 -0.999 -27.164 1.057 1.00 0.00 O ATOM 0 H SER A1050 -0.239 -25.956 5.186 1.00 0.00 H new ATOM 0 HA SER A1050 -1.858 -27.565 3.456 1.00 0.00 H new ATOM 0 HB2 SER A1050 -1.433 -25.434 2.092 1.00 0.00 H new ATOM 0 HB3 SER A1050 0.259 -25.891 2.081 1.00 0.00 H new ATOM 0 HG SER A1050 -0.875 -26.679 0.214 1.00 0.00 H new ATOM 2161 N ARG A1051 -0.022 -28.921 4.608 1.00 0.00 N ATOM 2162 CA ARG A1051 1.000 -29.894 4.956 1.00 0.00 C ATOM 2163 C ARG A1051 1.613 -30.496 3.690 1.00 0.00 C ATOM 2164 O ARG A1051 0.904 -31.070 2.865 1.00 0.00 O ATOM 2165 CB ARG A1051 0.421 -31.017 5.818 1.00 0.00 C ATOM 2166 CG ARG A1051 1.505 -32.023 6.209 1.00 0.00 C ATOM 2167 CD ARG A1051 1.112 -33.442 5.795 1.00 0.00 C ATOM 2168 NE ARG A1051 1.311 -34.374 6.927 1.00 0.00 N ATOM 2169 CZ ARG A1051 1.100 -35.695 6.859 1.00 0.00 C ATOM 2170 NH1 ARG A1051 0.683 -36.249 5.712 1.00 0.00 N ATOM 2171 NH2 ARG A1051 1.307 -36.464 7.937 1.00 0.00 N ATOM 0 H ARG A1051 -0.926 -29.073 5.056 1.00 0.00 H new ATOM 0 HA ARG A1051 1.771 -29.375 5.526 1.00 0.00 H new ATOM 0 HB2 ARG A1051 -0.030 -30.595 6.716 1.00 0.00 H new ATOM 0 HB3 ARG A1051 -0.373 -31.527 5.272 1.00 0.00 H new ATOM 0 HG2 ARG A1051 2.448 -31.750 5.734 1.00 0.00 H new ATOM 0 HG3 ARG A1051 1.668 -31.987 7.286 1.00 0.00 H new ATOM 0 HD2 ARG A1051 0.070 -33.461 5.477 1.00 0.00 H new ATOM 0 HD3 ARG A1051 1.712 -33.760 4.942 1.00 0.00 H new ATOM 0 HE ARG A1051 1.629 -33.986 7.815 1.00 0.00 H new ATOM 0 HH11 ARG A1051 0.526 -35.665 4.891 1.00 0.00 H new ATOM 0 HH12 ARG A1051 0.522 -37.255 5.660 1.00 0.00 H new ATOM 0 HH21 ARG A1051 1.625 -36.043 8.810 1.00 0.00 H new ATOM 0 HH22 ARG A1051 1.146 -37.470 7.884 1.00 0.00 H new ATOM 2185 N PRO A1052 2.959 -30.341 3.573 1.00 0.00 N ATOM 2186 CA PRO A1052 3.676 -30.863 2.422 1.00 0.00 C ATOM 2187 C PRO A1052 3.824 -32.383 2.512 1.00 0.00 C ATOM 2188 O PRO A1052 3.581 -32.973 3.563 1.00 0.00 O ATOM 2189 CB PRO A1052 5.010 -30.134 2.425 1.00 0.00 C ATOM 2190 CG PRO A1052 5.178 -29.579 3.830 1.00 0.00 C ATOM 2191 CD PRO A1052 3.832 -29.667 4.530 1.00 0.00 C ATOM 0 HA PRO A1052 3.147 -30.693 1.484 1.00 0.00 H new ATOM 0 HB2 PRO A1052 5.826 -30.811 2.172 1.00 0.00 H new ATOM 0 HB3 PRO A1052 5.019 -29.334 1.685 1.00 0.00 H new ATOM 0 HG2 PRO A1052 5.931 -30.147 4.377 1.00 0.00 H new ATOM 0 HG3 PRO A1052 5.522 -28.545 3.794 1.00 0.00 H new ATOM 0 HD2 PRO A1052 3.906 -30.228 5.462 1.00 0.00 H new ATOM 0 HD3 PRO A1052 3.452 -28.677 4.783 1.00 0.00 H new ATOM 2199 N HIS A1053 4.223 -32.973 1.394 1.00 0.00 N ATOM 2200 CA HIS A1053 4.407 -34.413 1.334 1.00 0.00 C ATOM 2201 C HIS A1053 5.873 -34.756 1.607 1.00 0.00 C ATOM 2202 O HIS A1053 6.170 -35.764 2.246 1.00 0.00 O ATOM 2203 CB HIS A1053 3.907 -34.969 -0.001 1.00 0.00 C ATOM 2204 CG HIS A1053 4.540 -36.282 -0.396 1.00 0.00 C ATOM 2205 ND1 HIS A1053 4.122 -37.499 0.114 1.00 0.00 N ATOM 2206 CD2 HIS A1053 5.563 -36.555 -1.256 1.00 0.00 C ATOM 2207 CE1 HIS A1053 4.868 -38.455 -0.421 1.00 0.00 C ATOM 2208 NE2 HIS A1053 5.761 -37.868 -1.269 1.00 0.00 N ATOM 0 H HIS A1053 4.424 -32.480 0.524 1.00 0.00 H new ATOM 0 HA HIS A1053 3.808 -34.892 2.109 1.00 0.00 H new ATOM 0 HB2 HIS A1053 2.826 -35.101 0.054 1.00 0.00 H new ATOM 0 HB3 HIS A1053 4.099 -34.235 -0.783 1.00 0.00 H new ATOM 0 HD2 HIS A1053 6.118 -35.827 -1.829 1.00 0.00 H new ATOM 0 HE1 HIS A1053 4.784 -39.513 -0.221 1.00 0.00 H new ATOM 0 HE2 HIS A1053 6.465 -38.357 -1.822 1.00 0.00 H new TER 2216 HIS A1053