USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=29 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 944 GLN : amide:sc= 1.09 K(o=0.76,f=-2.2) USER MOD Set 1.2: A1014 GLN : amide:sc= -0.327 K(o=0.76,f=-2.2!) USER MOD Set 2.1: A1001 LYS NZ :NH3+ -160:sc= 0.0367 (180deg=0) USER MOD Set 2.2: A1020 GLN : amide:sc= 0.0188 K(o=0.056,f=-0.83) USER MOD Set 3.1: A 928 ASN : amide:sc= -2.73 K(o=-1.9,f=-4.7!) USER MOD Set 3.2: A 968 THR OG1 : rot 80:sc= 0.814 USER MOD Single : A 915 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 917 ASN : amide:sc= -1.43 K(o=-1.4,f=-5.7!) USER MOD Single : A 921 SER OG : rot 180:sc= 0 USER MOD Single : A 922 ASN : amide:sc= -2.01 K(o=-2,f=-4.1!) USER MOD Single : A 924 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 930 THR OG1 : rot -107:sc= 0.851 USER MOD Single : A 934 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 939 MET CE :methyl 148:sc= -0.129 (180deg=-1.02) USER MOD Single : A 940 SER OG : rot -112:sc= -0.979 USER MOD Single : A 941 SER OG : rot 180:sc= 0 USER MOD Single : A 942 LYS NZ :NH3+ 177:sc= 1.24 (180deg=1.13) USER MOD Single : A 951 TYR OH : rot 48:sc= -0.7 USER MOD Single : A 954 MET CE :methyl -132:sc= -3.41 (180deg=-7.4!) USER MOD Single : A 956 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 964 THR OG1 : rot 180:sc= 0 USER MOD Single : A 972 SER OG : rot -140:sc= -0.34 USER MOD Single : A 979 SER OG : rot 180:sc= 0 USER MOD Single : A 980 THR OG1 : rot 4:sc= -3.24! USER MOD Single : A 981 HIS : no HD1:sc= -3.2 K(o=-3.2,f=-6.7!) USER MOD Single : A 986 MET CE :methyl 139:sc= -0.34 (180deg=-1.42) USER MOD Single : A 988 GLN : amide:sc= -0.955 K(o=-0.96,f=-2.8!) USER MOD Single : A 989 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 992 ASN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 993 SER OG : rot 180:sc= 0 USER MOD Single : A1000 ASN : amide:sc= -0.181 K(o=-0.18,f=-2.3!) USER MOD Single : A1002 MET CE :methyl -121:sc= -0.296 (180deg=-1.41) USER MOD Single : A1003 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1006 GLN : amide:sc= -8.33! C(o=-8.3!,f=-18!) 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 -121:sc= -7.62! (180deg=-11.8!) USER MOD Single : A1011 THR OG1 : rot -160:sc= 0 USER MOD Single : A1012 SER OG : rot 180:sc= 0 USER MOD Single : A1015 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A1017 TYR OH : rot 129:sc= 0.0266! USER MOD Single : A1018 LYS NZ :NH3+ -142:sc= -3.11 (180deg=-6.99!) USER MOD Single : A1019 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1021 MET CE :methyl -120:sc= -0.542 (180deg=-4.22!) USER MOD Single : A1023 THR OG1 : rot 180:sc= 0.0455 USER MOD Single : A1026 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1033 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1034 ASN : amide:sc= -0.122 K(o=-0.12,f=-1.8!) USER MOD Single : A1041 GLN : amide:sc=-0.00372 X(o=-0.0037,f=-0.32) USER MOD Single : A1045 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1046 MET CE :methyl -147:sc= -0.121 (180deg=-1.08) USER MOD Single : A1048 SER OG : rot 180:sc= 0 USER MOD Single : A1049 GLN : amide:sc= -0.0279 K(o=-0.028,f=-1.5!) USER MOD Single : A1050 SER OG : rot 180:sc= 0 USER MOD Single : A1053 HIS : no HD1:sc= -0.366 X(o=-0.37,f=-0.5) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 915 17.285 -13.221 -9.329 1.00 0.00 N ATOM 2 CA MET A 915 16.285 -14.265 -9.186 1.00 0.00 C ATOM 3 C MET A 915 15.575 -14.529 -10.515 1.00 0.00 C ATOM 4 O MET A 915 16.013 -14.055 -11.562 1.00 0.00 O ATOM 5 CB MET A 915 15.258 -13.848 -8.132 1.00 0.00 C ATOM 6 CG MET A 915 14.489 -12.602 -8.578 1.00 0.00 C ATOM 7 SD MET A 915 15.113 -11.162 -7.727 1.00 0.00 S ATOM 8 CE MET A 915 15.427 -10.091 -9.120 1.00 0.00 C ATOM 0 HA MET A 915 16.786 -15.182 -8.875 1.00 0.00 H new ATOM 0 HB2 MET A 915 14.560 -14.666 -7.955 1.00 0.00 H new ATOM 0 HB3 MET A 915 15.762 -13.649 -7.186 1.00 0.00 H new ATOM 0 HG2 MET A 915 14.589 -12.469 -9.655 1.00 0.00 H new ATOM 0 HG3 MET A 915 13.426 -12.726 -8.369 1.00 0.00 H new ATOM 0 HE1 MET A 915 15.824 -9.140 -8.765 1.00 0.00 H new ATOM 0 HE2 MET A 915 16.152 -10.561 -9.785 1.00 0.00 H new ATOM 0 HE3 MET A 915 14.497 -9.917 -9.662 1.00 0.00 H new ATOM 18 N ALA A 916 14.490 -15.285 -10.430 1.00 0.00 N ATOM 19 CA ALA A 916 13.714 -15.617 -11.613 1.00 0.00 C ATOM 20 C ALA A 916 12.956 -14.375 -12.086 1.00 0.00 C ATOM 21 O ALA A 916 12.556 -13.541 -11.275 1.00 0.00 O ATOM 22 CB ALA A 916 12.779 -16.787 -11.298 1.00 0.00 C ATOM 0 H ALA A 916 14.130 -15.677 -9.560 1.00 0.00 H new ATOM 0 HA ALA A 916 14.368 -15.932 -12.426 1.00 0.00 H new ATOM 0 HB1 ALA A 916 12.197 -17.036 -12.185 1.00 0.00 H new ATOM 0 HB2 ALA A 916 13.368 -17.653 -10.996 1.00 0.00 H new ATOM 0 HB3 ALA A 916 12.105 -16.506 -10.489 1.00 0.00 H new ATOM 28 N ASN A 917 12.781 -14.292 -13.397 1.00 0.00 N ATOM 29 CA ASN A 917 12.078 -13.166 -13.988 1.00 0.00 C ATOM 30 C ASN A 917 10.797 -12.897 -13.195 1.00 0.00 C ATOM 31 O ASN A 917 10.476 -11.747 -12.900 1.00 0.00 O ATOM 32 CB ASN A 917 11.684 -13.462 -15.436 1.00 0.00 C ATOM 33 CG ASN A 917 10.966 -14.809 -15.545 1.00 0.00 C ATOM 34 OD1 ASN A 917 11.418 -15.825 -15.044 1.00 0.00 O ATOM 35 ND2 ASN A 917 9.825 -14.760 -16.227 1.00 0.00 N ATOM 0 H ASN A 917 13.114 -14.986 -14.066 1.00 0.00 H new ATOM 0 HA ASN A 917 12.743 -12.303 -13.964 1.00 0.00 H new ATOM 0 HB2 ASN A 917 11.036 -12.669 -15.810 1.00 0.00 H new ATOM 0 HB3 ASN A 917 12.574 -13.469 -16.065 1.00 0.00 H new ATOM 0 HD21 ASN A 917 9.271 -15.607 -16.356 1.00 0.00 H new ATOM 0 HD22 ASN A 917 9.504 -13.876 -16.621 1.00 0.00 H new ATOM 42 N LEU A 918 10.101 -13.977 -12.873 1.00 0.00 N ATOM 43 CA LEU A 918 8.863 -13.872 -12.120 1.00 0.00 C ATOM 44 C LEU A 918 9.016 -14.611 -10.789 1.00 0.00 C ATOM 45 O LEU A 918 8.224 -15.498 -10.472 1.00 0.00 O ATOM 46 CB LEU A 918 7.681 -14.359 -12.961 1.00 0.00 C ATOM 47 CG LEU A 918 6.804 -13.269 -13.580 1.00 0.00 C ATOM 48 CD1 LEU A 918 7.562 -12.509 -14.670 1.00 0.00 C ATOM 49 CD2 LEU A 918 5.488 -13.852 -14.097 1.00 0.00 C ATOM 0 H LEU A 918 10.371 -14.929 -13.120 1.00 0.00 H new ATOM 0 HA LEU A 918 8.649 -12.830 -11.884 1.00 0.00 H new ATOM 0 HB2 LEU A 918 8.066 -14.987 -13.764 1.00 0.00 H new ATOM 0 HB3 LEU A 918 7.052 -14.992 -12.335 1.00 0.00 H new ATOM 0 HG LEU A 918 6.553 -12.549 -12.801 1.00 0.00 H new ATOM 0 HD11 LEU A 918 6.916 -11.740 -15.094 1.00 0.00 H new ATOM 0 HD12 LEU A 918 8.448 -12.042 -14.239 1.00 0.00 H new ATOM 0 HD13 LEU A 918 7.863 -13.203 -15.455 1.00 0.00 H new ATOM 0 HD21 LEU A 918 4.883 -13.056 -14.532 1.00 0.00 H new ATOM 0 HD22 LEU A 918 5.697 -14.605 -14.857 1.00 0.00 H new ATOM 0 HD23 LEU A 918 4.944 -14.311 -13.271 1.00 0.00 H new ATOM 61 N ASP A 919 10.040 -14.218 -10.045 1.00 0.00 N ATOM 62 CA ASP A 919 10.307 -14.832 -8.755 1.00 0.00 C ATOM 63 C ASP A 919 9.994 -13.829 -7.643 1.00 0.00 C ATOM 64 O ASP A 919 9.185 -14.109 -6.760 1.00 0.00 O ATOM 65 CB ASP A 919 11.778 -15.233 -8.630 1.00 0.00 C ATOM 66 CG ASP A 919 12.020 -16.639 -8.078 1.00 0.00 C ATOM 67 OD1 ASP A 919 11.119 -17.485 -8.264 1.00 0.00 O ATOM 68 OD2 ASP A 919 13.101 -16.836 -7.482 1.00 0.00 O ATOM 0 H ASP A 919 10.694 -13.482 -10.311 1.00 0.00 H new ATOM 0 HA ASP A 919 9.682 -15.721 -8.669 1.00 0.00 H new ATOM 0 HB2 ASP A 919 12.244 -15.160 -9.613 1.00 0.00 H new ATOM 0 HB3 ASP A 919 12.282 -14.514 -7.984 1.00 0.00 H new ATOM 73 N ARG A 920 10.652 -12.682 -7.722 1.00 0.00 N ATOM 74 CA ARG A 920 10.454 -11.636 -6.733 1.00 0.00 C ATOM 75 C ARG A 920 9.290 -10.731 -7.143 1.00 0.00 C ATOM 76 O ARG A 920 9.492 -9.561 -7.463 1.00 0.00 O ATOM 77 CB ARG A 920 11.717 -10.788 -6.569 1.00 0.00 C ATOM 78 CG ARG A 920 11.936 -10.410 -5.102 1.00 0.00 C ATOM 79 CD ARG A 920 13.124 -11.170 -4.511 1.00 0.00 C ATOM 80 NE ARG A 920 12.920 -12.628 -4.665 1.00 0.00 N ATOM 81 CZ ARG A 920 13.809 -13.563 -4.268 1.00 0.00 C ATOM 82 NH1 ARG A 920 14.973 -13.200 -3.689 1.00 0.00 N ATOM 83 NH2 ARG A 920 13.523 -14.838 -4.455 1.00 0.00 N ATOM 0 H ARG A 920 11.323 -12.454 -8.456 1.00 0.00 H new ATOM 0 HA ARG A 920 10.227 -12.117 -5.782 1.00 0.00 H new ATOM 0 HB2 ARG A 920 12.581 -11.340 -6.939 1.00 0.00 H new ATOM 0 HB3 ARG A 920 11.634 -9.884 -7.173 1.00 0.00 H new ATOM 0 HG2 ARG A 920 12.110 -9.337 -5.021 1.00 0.00 H new ATOM 0 HG3 ARG A 920 11.036 -10.631 -4.528 1.00 0.00 H new ATOM 0 HD2 ARG A 920 14.044 -10.868 -5.011 1.00 0.00 H new ATOM 0 HD3 ARG A 920 13.238 -10.920 -3.456 1.00 0.00 H new ATOM 0 HE ARG A 920 12.053 -12.946 -5.098 1.00 0.00 H new ATOM 0 HH11 ARG A 920 15.187 -12.213 -3.548 1.00 0.00 H new ATOM 0 HH12 ARG A 920 15.639 -13.913 -3.392 1.00 0.00 H new ATOM 0 HH21 ARG A 920 12.641 -15.104 -4.894 1.00 0.00 H new ATOM 0 HH22 ARG A 920 14.184 -15.557 -4.161 1.00 0.00 H new ATOM 96 N SER A 921 8.098 -11.308 -7.120 1.00 0.00 N ATOM 97 CA SER A 921 6.902 -10.568 -7.485 1.00 0.00 C ATOM 98 C SER A 921 6.335 -9.851 -6.259 1.00 0.00 C ATOM 99 O SER A 921 5.809 -8.744 -6.370 1.00 0.00 O ATOM 100 CB SER A 921 5.846 -11.493 -8.094 1.00 0.00 C ATOM 101 OG SER A 921 5.597 -11.191 -9.464 1.00 0.00 O ATOM 0 H SER A 921 7.935 -12.279 -6.854 1.00 0.00 H new ATOM 0 HA SER A 921 7.175 -9.828 -8.237 1.00 0.00 H new ATOM 0 HB2 SER A 921 6.176 -12.528 -8.005 1.00 0.00 H new ATOM 0 HB3 SER A 921 4.918 -11.405 -7.529 1.00 0.00 H new ATOM 0 HG SER A 921 4.919 -11.804 -9.816 1.00 0.00 H new ATOM 107 N ASN A 922 6.461 -10.510 -5.116 1.00 0.00 N ATOM 108 CA ASN A 922 5.968 -9.950 -3.870 1.00 0.00 C ATOM 109 C ASN A 922 6.700 -8.637 -3.581 1.00 0.00 C ATOM 110 O ASN A 922 6.185 -7.779 -2.866 1.00 0.00 O ATOM 111 CB ASN A 922 6.223 -10.901 -2.699 1.00 0.00 C ATOM 112 CG ASN A 922 4.915 -11.511 -2.193 1.00 0.00 C ATOM 113 OD1 ASN A 922 4.689 -12.708 -2.267 1.00 0.00 O ATOM 114 ND2 ASN A 922 4.068 -10.625 -1.677 1.00 0.00 N ATOM 0 H ASN A 922 6.898 -11.427 -5.027 1.00 0.00 H new ATOM 0 HA ASN A 922 4.895 -9.787 -3.975 1.00 0.00 H new ATOM 0 HB2 ASN A 922 6.901 -11.695 -3.012 1.00 0.00 H new ATOM 0 HB3 ASN A 922 6.714 -10.362 -1.889 1.00 0.00 H new ATOM 0 HD21 ASN A 922 3.167 -10.933 -1.313 1.00 0.00 H new ATOM 0 HD22 ASN A 922 4.320 -9.637 -1.646 1.00 0.00 H new ATOM 121 N ASP A 923 7.890 -8.522 -4.153 1.00 0.00 N ATOM 122 CA ASP A 923 8.697 -7.329 -3.966 1.00 0.00 C ATOM 123 C ASP A 923 8.125 -6.192 -4.815 1.00 0.00 C ATOM 124 O ASP A 923 8.208 -5.026 -4.434 1.00 0.00 O ATOM 125 CB ASP A 923 10.143 -7.567 -4.408 1.00 0.00 C ATOM 126 CG ASP A 923 10.512 -6.962 -5.763 1.00 0.00 C ATOM 127 OD1 ASP A 923 9.815 -7.298 -6.744 1.00 0.00 O ATOM 128 OD2 ASP A 923 11.484 -6.176 -5.788 1.00 0.00 O ATOM 0 H ASP A 923 8.314 -9.235 -4.746 1.00 0.00 H new ATOM 0 HA ASP A 923 8.680 -7.074 -2.906 1.00 0.00 H new ATOM 0 HB2 ASP A 923 10.811 -7.158 -3.650 1.00 0.00 H new ATOM 0 HB3 ASP A 923 10.324 -8.641 -4.445 1.00 0.00 H new ATOM 133 N LYS A 924 7.556 -6.573 -5.949 1.00 0.00 N ATOM 134 CA LYS A 924 6.969 -5.600 -6.855 1.00 0.00 C ATOM 135 C LYS A 924 5.841 -4.856 -6.137 1.00 0.00 C ATOM 136 O LYS A 924 5.874 -3.632 -6.023 1.00 0.00 O ATOM 137 CB LYS A 924 6.530 -6.276 -8.156 1.00 0.00 C ATOM 138 CG LYS A 924 5.767 -5.298 -9.051 1.00 0.00 C ATOM 139 CD LYS A 924 5.835 -5.729 -10.518 1.00 0.00 C ATOM 140 CE LYS A 924 7.205 -5.410 -11.120 1.00 0.00 C ATOM 141 NZ LYS A 924 7.651 -6.509 -12.005 1.00 0.00 N ATOM 0 H LYS A 924 7.489 -7.542 -6.261 1.00 0.00 H new ATOM 0 HA LYS A 924 7.709 -4.854 -7.145 1.00 0.00 H new ATOM 0 HB2 LYS A 924 7.404 -6.654 -8.686 1.00 0.00 H new ATOM 0 HB3 LYS A 924 5.899 -7.135 -7.929 1.00 0.00 H new ATOM 0 HG2 LYS A 924 4.726 -5.244 -8.732 1.00 0.00 H new ATOM 0 HG3 LYS A 924 6.186 -4.298 -8.942 1.00 0.00 H new ATOM 0 HD2 LYS A 924 5.640 -6.799 -10.596 1.00 0.00 H new ATOM 0 HD3 LYS A 924 5.057 -5.220 -11.087 1.00 0.00 H new ATOM 0 HE2 LYS A 924 7.153 -4.479 -11.685 1.00 0.00 H new ATOM 0 HE3 LYS A 924 7.933 -5.259 -10.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 8.582 -6.276 -12.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 7.720 -7.390 -11.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 6.964 -6.634 -12.776 1.00 0.00 H new ATOM 155 N VAL A 925 4.869 -5.628 -5.673 1.00 0.00 N ATOM 156 CA VAL A 925 3.733 -5.057 -4.969 1.00 0.00 C ATOM 157 C VAL A 925 4.231 -4.288 -3.744 1.00 0.00 C ATOM 158 O VAL A 925 3.734 -3.204 -3.442 1.00 0.00 O ATOM 159 CB VAL A 925 2.729 -6.157 -4.618 1.00 0.00 C ATOM 160 CG1 VAL A 925 1.554 -5.591 -3.818 1.00 0.00 C ATOM 161 CG2 VAL A 925 2.240 -6.876 -5.877 1.00 0.00 C ATOM 0 H VAL A 925 4.845 -6.643 -5.771 1.00 0.00 H new ATOM 0 HA VAL A 925 3.207 -4.346 -5.606 1.00 0.00 H new ATOM 0 HB VAL A 925 3.239 -6.889 -3.992 1.00 0.00 H new ATOM 0 HG11 VAL A 925 0.855 -6.393 -3.581 1.00 0.00 H new ATOM 0 HG12 VAL A 925 1.923 -5.147 -2.894 1.00 0.00 H new ATOM 0 HG13 VAL A 925 1.045 -4.829 -4.408 1.00 0.00 H new ATOM 0 HG21 VAL A 925 1.528 -7.653 -5.599 1.00 0.00 H new ATOM 0 HG22 VAL A 925 1.755 -6.160 -6.540 1.00 0.00 H new ATOM 0 HG23 VAL A 925 3.088 -7.329 -6.390 1.00 0.00 H new ATOM 171 N TYR A 926 5.207 -4.880 -3.070 1.00 0.00 N ATOM 172 CA TYR A 926 5.777 -4.264 -1.884 1.00 0.00 C ATOM 173 C TYR A 926 6.560 -3.000 -2.245 1.00 0.00 C ATOM 174 O TYR A 926 6.805 -2.151 -1.389 1.00 0.00 O ATOM 175 CB TYR A 926 6.742 -5.296 -1.296 1.00 0.00 C ATOM 176 CG TYR A 926 6.060 -6.370 -0.446 1.00 0.00 C ATOM 177 CD1 TYR A 926 4.840 -6.886 -0.833 1.00 0.00 C ATOM 178 CD2 TYR A 926 6.666 -6.824 0.708 1.00 0.00 C ATOM 179 CE1 TYR A 926 4.199 -7.897 -0.033 1.00 0.00 C ATOM 180 CE2 TYR A 926 6.025 -7.835 1.508 1.00 0.00 C ATOM 181 CZ TYR A 926 4.823 -8.322 1.098 1.00 0.00 C ATOM 182 OH TYR A 926 4.218 -9.277 1.854 1.00 0.00 O ATOM 0 H TYR A 926 5.617 -5.779 -3.323 1.00 0.00 H new ATOM 0 HA TYR A 926 4.991 -3.979 -1.184 1.00 0.00 H new ATOM 0 HB2 TYR A 926 7.281 -5.780 -2.110 1.00 0.00 H new ATOM 0 HB3 TYR A 926 7.483 -4.780 -0.685 1.00 0.00 H new ATOM 0 HD1 TYR A 926 4.366 -6.531 -1.736 1.00 0.00 H new ATOM 0 HD2 TYR A 926 7.621 -6.421 1.011 1.00 0.00 H new ATOM 0 HE1 TYR A 926 3.244 -8.309 -0.325 1.00 0.00 H new ATOM 0 HE2 TYR A 926 6.488 -8.199 2.413 1.00 0.00 H new ATOM 0 HH TYR A 926 4.779 -9.483 2.631 1.00 0.00 H new ATOM 192 N GLU A 927 6.931 -2.914 -3.515 1.00 0.00 N ATOM 193 CA GLU A 927 7.681 -1.768 -3.999 1.00 0.00 C ATOM 194 C GLU A 927 6.756 -0.560 -4.164 1.00 0.00 C ATOM 195 O GLU A 927 6.871 0.419 -3.429 1.00 0.00 O ATOM 196 CB GLU A 927 8.395 -2.096 -5.312 1.00 0.00 C ATOM 197 CG GLU A 927 9.895 -1.815 -5.206 1.00 0.00 C ATOM 198 CD GLU A 927 10.549 -2.717 -4.158 1.00 0.00 C ATOM 199 OE1 GLU A 927 10.501 -2.333 -2.969 1.00 0.00 O ATOM 200 OE2 GLU A 927 11.081 -3.771 -4.569 1.00 0.00 O ATOM 0 H GLU A 927 6.726 -3.619 -4.223 1.00 0.00 H new ATOM 0 HA GLU A 927 8.444 -1.519 -3.261 1.00 0.00 H new ATOM 0 HB2 GLU A 927 8.235 -3.144 -5.565 1.00 0.00 H new ATOM 0 HB3 GLU A 927 7.967 -1.504 -6.121 1.00 0.00 H new ATOM 0 HG2 GLU A 927 10.368 -1.975 -6.175 1.00 0.00 H new ATOM 0 HG3 GLU A 927 10.055 -0.770 -4.942 1.00 0.00 H new ATOM 207 N ASN A 928 5.861 -0.669 -5.135 1.00 0.00 N ATOM 208 CA ASN A 928 4.917 0.402 -5.405 1.00 0.00 C ATOM 209 C ASN A 928 4.349 0.922 -4.083 1.00 0.00 C ATOM 210 O ASN A 928 4.142 2.124 -3.922 1.00 0.00 O ATOM 211 CB ASN A 928 3.749 -0.095 -6.259 1.00 0.00 C ATOM 212 CG ASN A 928 4.253 -0.836 -7.499 1.00 0.00 C ATOM 213 OD1 ASN A 928 4.825 -1.911 -7.422 1.00 0.00 O ATOM 214 ND2 ASN A 928 4.008 -0.204 -8.643 1.00 0.00 N ATOM 0 H ASN A 928 5.770 -1.482 -5.744 1.00 0.00 H new ATOM 0 HA ASN A 928 5.446 1.190 -5.941 1.00 0.00 H new ATOM 0 HB2 ASN A 928 3.117 -0.757 -5.667 1.00 0.00 H new ATOM 0 HB3 ASN A 928 3.130 0.750 -6.562 1.00 0.00 H new ATOM 0 HD21 ASN A 928 4.304 -0.617 -9.527 1.00 0.00 H new ATOM 0 HD22 ASN A 928 3.524 0.694 -8.636 1.00 0.00 H new ATOM 221 N VAL A 929 4.112 -0.009 -3.171 1.00 0.00 N ATOM 222 CA VAL A 929 3.571 0.339 -1.868 1.00 0.00 C ATOM 223 C VAL A 929 4.509 1.334 -1.181 1.00 0.00 C ATOM 224 O VAL A 929 4.083 2.411 -0.767 1.00 0.00 O ATOM 225 CB VAL A 929 3.335 -0.927 -1.043 1.00 0.00 C ATOM 226 CG1 VAL A 929 2.898 -0.580 0.381 1.00 0.00 C ATOM 227 CG2 VAL A 929 2.315 -1.842 -1.723 1.00 0.00 C ATOM 0 H VAL A 929 4.285 -1.005 -3.309 1.00 0.00 H new ATOM 0 HA VAL A 929 2.602 0.826 -1.975 1.00 0.00 H new ATOM 0 HB VAL A 929 4.280 -1.467 -0.980 1.00 0.00 H new ATOM 0 HG11 VAL A 929 2.737 -1.498 0.946 1.00 0.00 H new ATOM 0 HG12 VAL A 929 3.674 0.013 0.865 1.00 0.00 H new ATOM 0 HG13 VAL A 929 1.971 -0.007 0.348 1.00 0.00 H new ATOM 0 HG21 VAL A 929 2.165 -2.735 -1.116 1.00 0.00 H new ATOM 0 HG22 VAL A 929 1.368 -1.314 -1.831 1.00 0.00 H new ATOM 0 HG23 VAL A 929 2.684 -2.130 -2.707 1.00 0.00 H new ATOM 237 N THR A 930 5.770 0.938 -1.082 1.00 0.00 N ATOM 238 CA THR A 930 6.772 1.781 -0.453 1.00 0.00 C ATOM 239 C THR A 930 7.136 2.951 -1.369 1.00 0.00 C ATOM 240 O THR A 930 6.969 4.111 -0.996 1.00 0.00 O ATOM 241 CB THR A 930 7.968 0.901 -0.087 1.00 0.00 C ATOM 242 OG1 THR A 930 8.127 0.044 -1.214 1.00 0.00 O ATOM 243 CG2 THR A 930 7.660 -0.055 1.067 1.00 0.00 C ATOM 0 H THR A 930 6.120 0.044 -1.427 1.00 0.00 H new ATOM 0 HA THR A 930 6.390 2.233 0.463 1.00 0.00 H new ATOM 0 HB THR A 930 8.815 1.533 0.181 1.00 0.00 H new ATOM 0 HG1 THR A 930 7.836 -0.862 -0.980 1.00 0.00 H new ATOM 0 HG21 THR A 930 8.542 -0.656 1.287 1.00 0.00 H new ATOM 0 HG22 THR A 930 7.383 0.519 1.951 1.00 0.00 H new ATOM 0 HG23 THR A 930 6.835 -0.710 0.787 1.00 0.00 H new ATOM 251 N GLY A 931 7.627 2.606 -2.550 1.00 0.00 N ATOM 252 CA GLY A 931 8.017 3.613 -3.523 1.00 0.00 C ATOM 253 C GLY A 931 7.079 4.821 -3.466 1.00 0.00 C ATOM 254 O GLY A 931 7.534 5.962 -3.406 1.00 0.00 O ATOM 0 H GLY A 931 7.764 1.643 -2.856 1.00 0.00 H new ATOM 0 HA2 GLY A 931 9.041 3.933 -3.330 1.00 0.00 H new ATOM 0 HA3 GLY A 931 8.001 3.182 -4.524 1.00 0.00 H new ATOM 258 N LEU A 932 5.787 4.528 -3.487 1.00 0.00 N ATOM 259 CA LEU A 932 4.782 5.576 -3.439 1.00 0.00 C ATOM 260 C LEU A 932 4.756 6.188 -2.037 1.00 0.00 C ATOM 261 O LEU A 932 4.812 7.407 -1.887 1.00 0.00 O ATOM 262 CB LEU A 932 3.426 5.040 -3.902 1.00 0.00 C ATOM 263 CG LEU A 932 2.437 4.670 -2.794 1.00 0.00 C ATOM 264 CD1 LEU A 932 2.001 5.911 -2.012 1.00 0.00 C ATOM 265 CD2 LEU A 932 1.243 3.900 -3.359 1.00 0.00 C ATOM 0 H LEU A 932 5.413 3.580 -3.537 1.00 0.00 H new ATOM 0 HA LEU A 932 5.035 6.378 -4.132 1.00 0.00 H new ATOM 0 HB2 LEU A 932 2.960 5.790 -4.542 1.00 0.00 H new ATOM 0 HB3 LEU A 932 3.598 4.157 -4.518 1.00 0.00 H new ATOM 0 HG LEU A 932 2.943 4.008 -2.092 1.00 0.00 H new ATOM 0 HD11 LEU A 932 1.299 5.621 -1.231 1.00 0.00 H new ATOM 0 HD12 LEU A 932 2.874 6.381 -1.559 1.00 0.00 H new ATOM 0 HD13 LEU A 932 1.520 6.617 -2.689 1.00 0.00 H new ATOM 0 HD21 LEU A 932 0.556 3.650 -2.551 1.00 0.00 H new ATOM 0 HD22 LEU A 932 0.728 4.517 -4.095 1.00 0.00 H new ATOM 0 HD23 LEU A 932 1.593 2.984 -3.835 1.00 0.00 H new ATOM 277 N VAL A 933 4.669 5.313 -1.046 1.00 0.00 N ATOM 278 CA VAL A 933 4.635 5.751 0.339 1.00 0.00 C ATOM 279 C VAL A 933 5.816 6.687 0.602 1.00 0.00 C ATOM 280 O VAL A 933 5.694 7.648 1.362 1.00 0.00 O ATOM 281 CB VAL A 933 4.613 4.538 1.271 1.00 0.00 C ATOM 282 CG1 VAL A 933 5.475 4.785 2.512 1.00 0.00 C ATOM 283 CG2 VAL A 933 3.180 4.173 1.663 1.00 0.00 C ATOM 0 H VAL A 933 4.621 4.302 -1.175 1.00 0.00 H new ATOM 0 HA VAL A 933 3.724 6.314 0.540 1.00 0.00 H new ATOM 0 HB VAL A 933 5.038 3.692 0.730 1.00 0.00 H new ATOM 0 HG11 VAL A 933 5.442 3.908 3.158 1.00 0.00 H new ATOM 0 HG12 VAL A 933 6.505 4.974 2.208 1.00 0.00 H new ATOM 0 HG13 VAL A 933 5.093 5.650 3.054 1.00 0.00 H new ATOM 0 HG21 VAL A 933 3.193 3.308 2.326 1.00 0.00 H new ATOM 0 HG22 VAL A 933 2.717 5.016 2.176 1.00 0.00 H new ATOM 0 HG23 VAL A 933 2.607 3.935 0.767 1.00 0.00 H new ATOM 293 N LYS A 934 6.932 6.375 -0.039 1.00 0.00 N ATOM 294 CA LYS A 934 8.134 7.176 0.116 1.00 0.00 C ATOM 295 C LYS A 934 7.860 8.599 -0.375 1.00 0.00 C ATOM 296 O LYS A 934 8.189 9.569 0.307 1.00 0.00 O ATOM 297 CB LYS A 934 9.320 6.503 -0.578 1.00 0.00 C ATOM 298 CG LYS A 934 9.572 5.108 -0.004 1.00 0.00 C ATOM 299 CD LYS A 934 11.037 4.938 0.402 1.00 0.00 C ATOM 300 CE LYS A 934 11.159 4.598 1.888 1.00 0.00 C ATOM 301 NZ LYS A 934 12.576 4.384 2.257 1.00 0.00 N ATOM 0 H LYS A 934 7.029 5.578 -0.668 1.00 0.00 H new ATOM 0 HA LYS A 934 8.410 7.249 1.168 1.00 0.00 H new ATOM 0 HB2 LYS A 934 9.126 6.430 -1.648 1.00 0.00 H new ATOM 0 HB3 LYS A 934 10.213 7.117 -0.457 1.00 0.00 H new ATOM 0 HG2 LYS A 934 8.930 4.946 0.862 1.00 0.00 H new ATOM 0 HG3 LYS A 934 9.306 4.353 -0.744 1.00 0.00 H new ATOM 0 HD2 LYS A 934 11.494 4.148 -0.194 1.00 0.00 H new ATOM 0 HD3 LYS A 934 11.586 5.855 0.189 1.00 0.00 H new ATOM 0 HE2 LYS A 934 10.739 5.406 2.487 1.00 0.00 H new ATOM 0 HE3 LYS A 934 10.580 3.702 2.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 12.640 4.154 3.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 12.965 3.598 1.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 13.120 5.249 2.063 1.00 0.00 H new ATOM 315 N ALA A 935 7.261 8.679 -1.554 1.00 0.00 N ATOM 316 CA ALA A 935 6.940 9.967 -2.144 1.00 0.00 C ATOM 317 C ALA A 935 5.901 10.677 -1.274 1.00 0.00 C ATOM 318 O ALA A 935 6.027 11.869 -0.998 1.00 0.00 O ATOM 319 CB ALA A 935 6.455 9.764 -3.581 1.00 0.00 C ATOM 0 H ALA A 935 6.990 7.873 -2.117 1.00 0.00 H new ATOM 0 HA ALA A 935 7.825 10.601 -2.185 1.00 0.00 H new ATOM 0 HB1 ALA A 935 6.214 10.730 -4.024 1.00 0.00 H new ATOM 0 HB2 ALA A 935 7.239 9.283 -4.165 1.00 0.00 H new ATOM 0 HB3 ALA A 935 5.566 9.134 -3.579 1.00 0.00 H new ATOM 325 N VAL A 936 4.898 9.915 -0.865 1.00 0.00 N ATOM 326 CA VAL A 936 3.838 10.456 -0.031 1.00 0.00 C ATOM 327 C VAL A 936 4.443 11.410 1.001 1.00 0.00 C ATOM 328 O VAL A 936 3.928 12.506 1.215 1.00 0.00 O ATOM 329 CB VAL A 936 3.039 9.316 0.605 1.00 0.00 C ATOM 330 CG1 VAL A 936 2.239 9.814 1.811 1.00 0.00 C ATOM 331 CG2 VAL A 936 2.123 8.649 -0.423 1.00 0.00 C ATOM 0 H VAL A 936 4.797 8.927 -1.096 1.00 0.00 H new ATOM 0 HA VAL A 936 3.135 11.032 -0.633 1.00 0.00 H new ATOM 0 HB VAL A 936 3.747 8.567 0.959 1.00 0.00 H new ATOM 0 HG11 VAL A 936 1.680 8.985 2.245 1.00 0.00 H new ATOM 0 HG12 VAL A 936 2.921 10.221 2.557 1.00 0.00 H new ATOM 0 HG13 VAL A 936 1.545 10.591 1.491 1.00 0.00 H new ATOM 0 HG21 VAL A 936 1.567 7.842 0.055 1.00 0.00 H new ATOM 0 HG22 VAL A 936 1.425 9.386 -0.820 1.00 0.00 H new ATOM 0 HG23 VAL A 936 2.724 8.243 -1.237 1.00 0.00 H new ATOM 341 N ILE A 937 5.528 10.958 1.613 1.00 0.00 N ATOM 342 CA ILE A 937 6.209 11.757 2.617 1.00 0.00 C ATOM 343 C ILE A 937 7.174 12.723 1.925 1.00 0.00 C ATOM 344 O ILE A 937 7.015 13.939 2.020 1.00 0.00 O ATOM 345 CB ILE A 937 6.880 10.856 3.655 1.00 0.00 C ATOM 346 CG1 ILE A 937 5.844 10.240 4.598 1.00 0.00 C ATOM 347 CG2 ILE A 937 7.969 11.613 4.417 1.00 0.00 C ATOM 348 CD1 ILE A 937 5.733 8.730 4.379 1.00 0.00 C ATOM 0 H ILE A 937 5.952 10.048 1.433 1.00 0.00 H new ATOM 0 HA ILE A 937 5.493 12.363 3.171 1.00 0.00 H new ATOM 0 HB ILE A 937 7.367 10.034 3.130 1.00 0.00 H new ATOM 0 HG12 ILE A 937 6.123 10.442 5.632 1.00 0.00 H new ATOM 0 HG13 ILE A 937 4.873 10.707 4.433 1.00 0.00 H new ATOM 0 HG21 ILE A 937 8.430 10.949 5.149 1.00 0.00 H new ATOM 0 HG22 ILE A 937 8.727 11.963 3.716 1.00 0.00 H new ATOM 0 HG23 ILE A 937 7.527 12.467 4.930 1.00 0.00 H new ATOM 0 HD11 ILE A 937 4.990 8.317 5.061 1.00 0.00 H new ATOM 0 HD12 ILE A 937 5.430 8.533 3.351 1.00 0.00 H new ATOM 0 HD13 ILE A 937 6.699 8.263 4.569 1.00 0.00 H new ATOM 360 N GLU A 938 8.153 12.144 1.246 1.00 0.00 N ATOM 361 CA GLU A 938 9.144 12.938 0.539 1.00 0.00 C ATOM 362 C GLU A 938 8.516 14.234 0.022 1.00 0.00 C ATOM 363 O GLU A 938 9.108 15.305 0.141 1.00 0.00 O ATOM 364 CB GLU A 938 9.772 12.139 -0.605 1.00 0.00 C ATOM 365 CG GLU A 938 11.296 12.099 -0.475 1.00 0.00 C ATOM 366 CD GLU A 938 11.770 10.719 -0.014 1.00 0.00 C ATOM 367 OE1 GLU A 938 11.750 10.493 1.215 1.00 0.00 O ATOM 368 OE2 GLU A 938 12.142 9.922 -0.902 1.00 0.00 O ATOM 0 H GLU A 938 8.281 11.135 1.170 1.00 0.00 H new ATOM 0 HA GLU A 938 9.940 13.196 1.238 1.00 0.00 H new ATOM 0 HB2 GLU A 938 9.377 11.123 -0.603 1.00 0.00 H new ATOM 0 HB3 GLU A 938 9.497 12.587 -1.560 1.00 0.00 H new ATOM 0 HG2 GLU A 938 11.753 12.343 -1.434 1.00 0.00 H new ATOM 0 HG3 GLU A 938 11.624 12.857 0.236 1.00 0.00 H new ATOM 375 N MET A 939 7.324 14.093 -0.540 1.00 0.00 N ATOM 376 CA MET A 939 6.609 15.240 -1.074 1.00 0.00 C ATOM 377 C MET A 939 6.575 16.386 -0.062 1.00 0.00 C ATOM 378 O MET A 939 7.243 17.403 -0.247 1.00 0.00 O ATOM 379 CB MET A 939 5.178 14.829 -1.429 1.00 0.00 C ATOM 380 CG MET A 939 4.328 16.052 -1.779 1.00 0.00 C ATOM 381 SD MET A 939 3.701 15.903 -3.444 1.00 0.00 S ATOM 382 CE MET A 939 2.784 14.379 -3.294 1.00 0.00 C ATOM 0 H MET A 939 6.836 13.203 -0.637 1.00 0.00 H new ATOM 0 HA MET A 939 7.130 15.585 -1.967 1.00 0.00 H new ATOM 0 HB2 MET A 939 5.193 14.138 -2.272 1.00 0.00 H new ATOM 0 HB3 MET A 939 4.729 14.298 -0.590 1.00 0.00 H new ATOM 0 HG2 MET A 939 3.500 16.143 -1.076 1.00 0.00 H new ATOM 0 HG3 MET A 939 4.925 16.959 -1.686 1.00 0.00 H new ATOM 0 HE1 MET A 939 1.921 14.407 -3.959 1.00 0.00 H new ATOM 0 HE2 MET A 939 3.425 13.540 -3.566 1.00 0.00 H new ATOM 0 HE3 MET A 939 2.445 14.258 -2.265 1.00 0.00 H new ATOM 392 N SER A 940 5.792 16.184 0.987 1.00 0.00 N ATOM 393 CA SER A 940 5.662 17.188 2.030 1.00 0.00 C ATOM 394 C SER A 940 7.025 17.821 2.318 1.00 0.00 C ATOM 395 O SER A 940 7.105 18.997 2.672 1.00 0.00 O ATOM 396 CB SER A 940 5.077 16.584 3.307 1.00 0.00 C ATOM 397 OG SER A 940 5.180 17.474 4.415 1.00 0.00 O ATOM 0 H SER A 940 5.241 15.339 1.138 1.00 0.00 H new ATOM 0 HA SER A 940 4.976 17.959 1.679 1.00 0.00 H new ATOM 0 HB2 SER A 940 4.030 16.331 3.142 1.00 0.00 H new ATOM 0 HB3 SER A 940 5.597 15.654 3.539 1.00 0.00 H new ATOM 0 HG SER A 940 5.815 17.112 5.067 1.00 0.00 H new ATOM 403 N SER A 941 8.063 17.014 2.157 1.00 0.00 N ATOM 404 CA SER A 941 9.418 17.480 2.396 1.00 0.00 C ATOM 405 C SER A 941 9.790 18.554 1.372 1.00 0.00 C ATOM 406 O SER A 941 10.296 19.615 1.735 1.00 0.00 O ATOM 407 CB SER A 941 10.417 16.323 2.337 1.00 0.00 C ATOM 408 OG SER A 941 11.250 16.278 3.493 1.00 0.00 O ATOM 0 H SER A 941 7.993 16.040 1.864 1.00 0.00 H new ATOM 0 HA SER A 941 9.460 17.910 3.397 1.00 0.00 H new ATOM 0 HB2 SER A 941 9.876 15.381 2.243 1.00 0.00 H new ATOM 0 HB3 SER A 941 11.037 16.425 1.447 1.00 0.00 H new ATOM 0 HG SER A 941 11.873 15.525 3.418 1.00 0.00 H new ATOM 414 N LYS A 942 9.525 18.243 0.112 1.00 0.00 N ATOM 415 CA LYS A 942 9.825 19.168 -0.967 1.00 0.00 C ATOM 416 C LYS A 942 8.527 19.818 -1.452 1.00 0.00 C ATOM 417 O LYS A 942 8.449 20.284 -2.588 1.00 0.00 O ATOM 418 CB LYS A 942 10.611 18.464 -2.075 1.00 0.00 C ATOM 419 CG LYS A 942 9.814 17.292 -2.652 1.00 0.00 C ATOM 420 CD LYS A 942 9.958 17.229 -4.174 1.00 0.00 C ATOM 421 CE LYS A 942 8.775 17.909 -4.866 1.00 0.00 C ATOM 422 NZ LYS A 942 9.237 18.685 -6.039 1.00 0.00 N ATOM 0 H LYS A 942 9.105 17.362 -0.186 1.00 0.00 H new ATOM 0 HA LYS A 942 10.471 19.971 -0.611 1.00 0.00 H new ATOM 0 HB2 LYS A 942 10.845 19.175 -2.868 1.00 0.00 H new ATOM 0 HB3 LYS A 942 11.561 18.103 -1.680 1.00 0.00 H new ATOM 0 HG2 LYS A 942 10.163 16.358 -2.211 1.00 0.00 H new ATOM 0 HG3 LYS A 942 8.762 17.397 -2.386 1.00 0.00 H new ATOM 0 HD2 LYS A 942 10.887 17.713 -4.475 1.00 0.00 H new ATOM 0 HD3 LYS A 942 10.022 16.189 -4.494 1.00 0.00 H new ATOM 0 HE2 LYS A 942 8.050 17.159 -5.182 1.00 0.00 H new ATOM 0 HE3 LYS A 942 8.265 18.569 -4.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 8.417 19.098 -6.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 9.872 19.446 -5.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 9.747 18.057 -6.692 1.00 0.00 H new ATOM 436 N ILE A 943 7.542 19.828 -0.567 1.00 0.00 N ATOM 437 CA ILE A 943 6.251 20.413 -0.891 1.00 0.00 C ATOM 438 C ILE A 943 6.228 21.872 -0.432 1.00 0.00 C ATOM 439 O ILE A 943 5.891 22.766 -1.207 1.00 0.00 O ATOM 440 CB ILE A 943 5.118 19.567 -0.308 1.00 0.00 C ATOM 441 CG1 ILE A 943 3.977 19.410 -1.315 1.00 0.00 C ATOM 442 CG2 ILE A 943 4.633 20.143 1.024 1.00 0.00 C ATOM 443 CD1 ILE A 943 3.152 20.695 -1.413 1.00 0.00 C ATOM 0 H ILE A 943 7.611 19.441 0.374 1.00 0.00 H new ATOM 0 HA ILE A 943 6.093 20.415 -1.970 1.00 0.00 H new ATOM 0 HB ILE A 943 5.507 18.569 -0.104 1.00 0.00 H new ATOM 0 HG12 ILE A 943 4.384 19.159 -2.295 1.00 0.00 H new ATOM 0 HG13 ILE A 943 3.334 18.583 -1.015 1.00 0.00 H new ATOM 0 HG21 ILE A 943 3.827 19.523 1.417 1.00 0.00 H new ATOM 0 HG22 ILE A 943 5.459 20.159 1.736 1.00 0.00 H new ATOM 0 HG23 ILE A 943 4.267 21.158 0.870 1.00 0.00 H new ATOM 0 HD11 ILE A 943 2.348 20.557 -2.135 1.00 0.00 H new ATOM 0 HD12 ILE A 943 2.727 20.930 -0.437 1.00 0.00 H new ATOM 0 HD13 ILE A 943 3.793 21.515 -1.736 1.00 0.00 H new ATOM 455 N GLN A 944 6.590 22.069 0.828 1.00 0.00 N ATOM 456 CA GLN A 944 6.615 23.404 1.399 1.00 0.00 C ATOM 457 C GLN A 944 7.193 24.402 0.393 1.00 0.00 C ATOM 458 O GLN A 944 6.562 25.410 0.081 1.00 0.00 O ATOM 459 CB GLN A 944 7.406 23.426 2.709 1.00 0.00 C ATOM 460 CG GLN A 944 6.571 24.019 3.845 1.00 0.00 C ATOM 461 CD GLN A 944 7.299 25.190 4.507 1.00 0.00 C ATOM 462 OE1 GLN A 944 8.357 25.044 5.095 1.00 0.00 O ATOM 463 NE2 GLN A 944 6.674 26.357 4.379 1.00 0.00 N ATOM 0 H GLN A 944 6.868 21.326 1.469 1.00 0.00 H new ATOM 0 HA GLN A 944 5.591 23.699 1.626 1.00 0.00 H new ATOM 0 HB2 GLN A 944 7.713 22.413 2.969 1.00 0.00 H new ATOM 0 HB3 GLN A 944 8.316 24.011 2.578 1.00 0.00 H new ATOM 0 HG2 GLN A 944 5.610 24.356 3.457 1.00 0.00 H new ATOM 0 HG3 GLN A 944 6.362 23.249 4.588 1.00 0.00 H new ATOM 0 HE21 GLN A 944 5.790 26.409 3.873 1.00 0.00 H new ATOM 0 HE22 GLN A 944 7.079 27.200 4.786 1.00 0.00 H new ATOM 472 N PRO A 945 8.419 24.077 -0.099 1.00 0.00 N ATOM 473 CA PRO A 945 9.089 24.933 -1.063 1.00 0.00 C ATOM 474 C PRO A 945 8.457 24.796 -2.450 1.00 0.00 C ATOM 475 O PRO A 945 8.105 25.794 -3.077 1.00 0.00 O ATOM 476 CB PRO A 945 10.545 24.499 -1.028 1.00 0.00 C ATOM 477 CG PRO A 945 10.554 23.117 -0.396 1.00 0.00 C ATOM 478 CD PRO A 945 9.196 22.891 0.248 1.00 0.00 C ATOM 0 HA PRO A 945 8.997 25.992 -0.822 1.00 0.00 H new ATOM 0 HB2 PRO A 945 10.968 24.472 -2.032 1.00 0.00 H new ATOM 0 HB3 PRO A 945 11.147 25.198 -0.447 1.00 0.00 H new ATOM 0 HG2 PRO A 945 10.751 22.354 -1.149 1.00 0.00 H new ATOM 0 HG3 PRO A 945 11.347 23.043 0.348 1.00 0.00 H new ATOM 0 HD2 PRO A 945 8.724 21.984 -0.130 1.00 0.00 H new ATOM 0 HD3 PRO A 945 9.284 22.778 1.328 1.00 0.00 H new ATOM 486 N ALA A 946 8.333 23.552 -2.888 1.00 0.00 N ATOM 487 CA ALA A 946 7.750 23.271 -4.189 1.00 0.00 C ATOM 488 C ALA A 946 6.674 24.315 -4.497 1.00 0.00 C ATOM 489 O ALA A 946 5.777 24.544 -3.687 1.00 0.00 O ATOM 490 CB ALA A 946 7.199 21.844 -4.205 1.00 0.00 C ATOM 0 H ALA A 946 8.626 22.727 -2.365 1.00 0.00 H new ATOM 0 HA ALA A 946 8.507 23.337 -4.971 1.00 0.00 H new ATOM 0 HB1 ALA A 946 6.762 21.634 -5.181 1.00 0.00 H new ATOM 0 HB2 ALA A 946 8.008 21.140 -4.010 1.00 0.00 H new ATOM 0 HB3 ALA A 946 6.434 21.741 -3.435 1.00 0.00 H new ATOM 496 N PRO A 947 6.803 24.936 -5.700 1.00 0.00 N ATOM 497 CA PRO A 947 5.853 25.949 -6.124 1.00 0.00 C ATOM 498 C PRO A 947 4.529 25.314 -6.555 1.00 0.00 C ATOM 499 O PRO A 947 4.397 24.091 -6.563 1.00 0.00 O ATOM 500 CB PRO A 947 6.549 26.694 -7.252 1.00 0.00 C ATOM 501 CG PRO A 947 7.666 25.779 -7.728 1.00 0.00 C ATOM 502 CD PRO A 947 7.853 24.690 -6.684 1.00 0.00 C ATOM 0 HA PRO A 947 5.582 26.633 -5.320 1.00 0.00 H new ATOM 0 HB2 PRO A 947 5.854 26.915 -8.062 1.00 0.00 H new ATOM 0 HB3 PRO A 947 6.947 27.647 -6.904 1.00 0.00 H new ATOM 0 HG2 PRO A 947 7.416 25.342 -8.695 1.00 0.00 H new ATOM 0 HG3 PRO A 947 8.590 26.342 -7.862 1.00 0.00 H new ATOM 0 HD2 PRO A 947 7.758 23.698 -7.125 1.00 0.00 H new ATOM 0 HD3 PRO A 947 8.842 24.743 -6.229 1.00 0.00 H new ATOM 510 N PRO A 948 3.557 26.196 -6.912 1.00 0.00 N ATOM 511 CA PRO A 948 2.249 25.735 -7.343 1.00 0.00 C ATOM 512 C PRO A 948 2.307 25.171 -8.764 1.00 0.00 C ATOM 513 O PRO A 948 1.429 24.411 -9.171 1.00 0.00 O ATOM 514 CB PRO A 948 1.344 26.950 -7.222 1.00 0.00 C ATOM 515 CG PRO A 948 2.268 28.155 -7.175 1.00 0.00 C ATOM 516 CD PRO A 948 3.678 27.651 -6.915 1.00 0.00 C ATOM 0 HA PRO A 948 1.872 24.912 -6.736 1.00 0.00 H new ATOM 0 HB2 PRO A 948 0.661 27.014 -8.069 1.00 0.00 H new ATOM 0 HB3 PRO A 948 0.731 26.892 -6.322 1.00 0.00 H new ATOM 0 HG2 PRO A 948 2.226 28.705 -8.115 1.00 0.00 H new ATOM 0 HG3 PRO A 948 1.958 28.844 -6.389 1.00 0.00 H new ATOM 0 HD2 PRO A 948 4.368 27.989 -7.688 1.00 0.00 H new ATOM 0 HD3 PRO A 948 4.061 28.018 -5.963 1.00 0.00 H new ATOM 524 N GLU A 949 3.350 25.564 -9.480 1.00 0.00 N ATOM 525 CA GLU A 949 3.534 25.107 -10.847 1.00 0.00 C ATOM 526 C GLU A 949 4.218 23.739 -10.862 1.00 0.00 C ATOM 527 O GLU A 949 4.177 23.032 -11.868 1.00 0.00 O ATOM 528 CB GLU A 949 4.330 26.127 -11.663 1.00 0.00 C ATOM 529 CG GLU A 949 3.617 26.456 -12.976 1.00 0.00 C ATOM 530 CD GLU A 949 4.570 27.132 -13.964 1.00 0.00 C ATOM 531 OE1 GLU A 949 4.996 28.266 -13.656 1.00 0.00 O ATOM 532 OE2 GLU A 949 4.851 26.500 -15.005 1.00 0.00 O ATOM 0 H GLU A 949 4.076 26.194 -9.139 1.00 0.00 H new ATOM 0 HA GLU A 949 2.553 25.006 -11.311 1.00 0.00 H new ATOM 0 HB2 GLU A 949 4.465 27.038 -11.080 1.00 0.00 H new ATOM 0 HB3 GLU A 949 5.324 25.733 -11.874 1.00 0.00 H new ATOM 0 HG2 GLU A 949 3.219 25.542 -13.417 1.00 0.00 H new ATOM 0 HG3 GLU A 949 2.768 27.110 -12.779 1.00 0.00 H new ATOM 539 N GLU A 950 4.830 23.407 -9.735 1.00 0.00 N ATOM 540 CA GLU A 950 5.522 22.135 -9.606 1.00 0.00 C ATOM 541 C GLU A 950 4.762 21.212 -8.651 1.00 0.00 C ATOM 542 O GLU A 950 5.156 20.065 -8.446 1.00 0.00 O ATOM 543 CB GLU A 950 6.964 22.341 -9.138 1.00 0.00 C ATOM 544 CG GLU A 950 7.951 21.655 -10.085 1.00 0.00 C ATOM 545 CD GLU A 950 8.833 22.683 -10.797 1.00 0.00 C ATOM 546 OE1 GLU A 950 9.753 23.201 -10.128 1.00 0.00 O ATOM 547 OE2 GLU A 950 8.567 22.927 -11.993 1.00 0.00 O ATOM 0 H GLU A 950 4.861 23.996 -8.903 1.00 0.00 H new ATOM 0 HA GLU A 950 5.557 21.661 -10.587 1.00 0.00 H new ATOM 0 HB2 GLU A 950 7.185 23.407 -9.087 1.00 0.00 H new ATOM 0 HB3 GLU A 950 7.084 21.942 -8.131 1.00 0.00 H new ATOM 0 HG2 GLU A 950 8.576 20.961 -9.524 1.00 0.00 H new ATOM 0 HG3 GLU A 950 7.404 21.067 -10.822 1.00 0.00 H new ATOM 554 N TYR A 951 3.687 21.747 -8.092 1.00 0.00 N ATOM 555 CA TYR A 951 2.868 20.986 -7.163 1.00 0.00 C ATOM 556 C TYR A 951 1.727 20.277 -7.894 1.00 0.00 C ATOM 557 O TYR A 951 1.355 19.160 -7.536 1.00 0.00 O ATOM 558 CB TYR A 951 2.278 22.006 -6.187 1.00 0.00 C ATOM 559 CG TYR A 951 1.519 21.379 -5.016 1.00 0.00 C ATOM 560 CD1 TYR A 951 1.927 20.166 -4.499 1.00 0.00 C ATOM 561 CD2 TYR A 951 0.426 22.026 -4.477 1.00 0.00 C ATOM 562 CE1 TYR A 951 1.213 19.576 -3.397 1.00 0.00 C ATOM 563 CE2 TYR A 951 -0.289 21.436 -3.375 1.00 0.00 C ATOM 564 CZ TYR A 951 0.140 20.240 -2.889 1.00 0.00 C ATOM 565 OH TYR A 951 -0.535 19.683 -1.848 1.00 0.00 O ATOM 0 H TYR A 951 3.364 22.699 -8.264 1.00 0.00 H new ATOM 0 HA TYR A 951 3.464 20.224 -6.660 1.00 0.00 H new ATOM 0 HB2 TYR A 951 3.084 22.626 -5.794 1.00 0.00 H new ATOM 0 HB3 TYR A 951 1.604 22.667 -6.732 1.00 0.00 H new ATOM 0 HD1 TYR A 951 2.782 19.659 -4.921 1.00 0.00 H new ATOM 0 HD2 TYR A 951 0.107 22.975 -4.882 1.00 0.00 H new ATOM 0 HE1 TYR A 951 1.522 18.628 -2.983 1.00 0.00 H new ATOM 0 HE2 TYR A 951 -1.146 21.932 -2.944 1.00 0.00 H new ATOM 0 HH TYR A 951 0.102 19.400 -1.159 1.00 0.00 H new ATOM 575 N VAL A 952 1.202 20.954 -8.904 1.00 0.00 N ATOM 576 CA VAL A 952 0.110 20.403 -9.688 1.00 0.00 C ATOM 577 C VAL A 952 0.494 19.005 -10.179 1.00 0.00 C ATOM 578 O VAL A 952 -0.290 18.065 -10.062 1.00 0.00 O ATOM 579 CB VAL A 952 -0.251 21.358 -10.827 1.00 0.00 C ATOM 580 CG1 VAL A 952 -0.604 20.585 -12.100 1.00 0.00 C ATOM 581 CG2 VAL A 952 -1.392 22.292 -10.419 1.00 0.00 C ATOM 0 H VAL A 952 1.513 21.880 -9.198 1.00 0.00 H new ATOM 0 HA VAL A 952 -0.785 20.298 -9.074 1.00 0.00 H new ATOM 0 HB VAL A 952 0.625 21.972 -11.039 1.00 0.00 H new ATOM 0 HG11 VAL A 952 -0.857 21.288 -12.894 1.00 0.00 H new ATOM 0 HG12 VAL A 952 0.250 19.981 -12.408 1.00 0.00 H new ATOM 0 HG13 VAL A 952 -1.457 19.935 -11.906 1.00 0.00 H new ATOM 0 HG21 VAL A 952 -1.629 22.960 -11.247 1.00 0.00 H new ATOM 0 HG22 VAL A 952 -2.273 21.702 -10.166 1.00 0.00 H new ATOM 0 HG23 VAL A 952 -1.089 22.880 -9.553 1.00 0.00 H new ATOM 591 N PRO A 953 1.734 18.911 -10.731 1.00 0.00 N ATOM 592 CA PRO A 953 2.232 17.645 -11.239 1.00 0.00 C ATOM 593 C PRO A 953 2.634 16.714 -10.094 1.00 0.00 C ATOM 594 O PRO A 953 2.177 15.574 -10.026 1.00 0.00 O ATOM 595 CB PRO A 953 3.398 18.014 -12.141 1.00 0.00 C ATOM 596 CG PRO A 953 3.803 19.424 -11.743 1.00 0.00 C ATOM 597 CD PRO A 953 2.689 20.004 -10.885 1.00 0.00 C ATOM 0 HA PRO A 953 1.477 17.089 -11.794 1.00 0.00 H new ATOM 0 HB2 PRO A 953 4.227 17.318 -12.012 1.00 0.00 H new ATOM 0 HB3 PRO A 953 3.108 17.973 -13.191 1.00 0.00 H new ATOM 0 HG2 PRO A 953 4.742 19.410 -11.190 1.00 0.00 H new ATOM 0 HG3 PRO A 953 3.963 20.040 -12.628 1.00 0.00 H new ATOM 0 HD2 PRO A 953 3.067 20.339 -9.919 1.00 0.00 H new ATOM 0 HD3 PRO A 953 2.229 20.868 -11.364 1.00 0.00 H new ATOM 605 N MET A 954 3.485 17.234 -9.222 1.00 0.00 N ATOM 606 CA MET A 954 3.954 16.464 -8.082 1.00 0.00 C ATOM 607 C MET A 954 2.889 15.468 -7.619 1.00 0.00 C ATOM 608 O MET A 954 3.160 14.274 -7.501 1.00 0.00 O ATOM 609 CB MET A 954 4.301 17.412 -6.933 1.00 0.00 C ATOM 610 CG MET A 954 5.810 17.437 -6.679 1.00 0.00 C ATOM 611 SD MET A 954 6.306 19.052 -6.105 1.00 0.00 S ATOM 612 CE MET A 954 5.218 19.229 -4.701 1.00 0.00 C ATOM 0 H MET A 954 3.862 18.180 -9.282 1.00 0.00 H new ATOM 0 HA MET A 954 4.840 15.906 -8.384 1.00 0.00 H new ATOM 0 HB2 MET A 954 3.952 18.417 -7.168 1.00 0.00 H new ATOM 0 HB3 MET A 954 3.781 17.098 -6.028 1.00 0.00 H new ATOM 0 HG2 MET A 954 6.075 16.682 -5.939 1.00 0.00 H new ATOM 0 HG3 MET A 954 6.345 17.187 -7.595 1.00 0.00 H new ATOM 0 HE1 MET A 954 4.737 20.206 -4.735 1.00 0.00 H new ATOM 0 HE2 MET A 954 4.457 18.449 -4.730 1.00 0.00 H new ATOM 0 HE3 MET A 954 5.795 19.140 -3.780 1.00 0.00 H new ATOM 622 N VAL A 955 1.700 15.995 -7.368 1.00 0.00 N ATOM 623 CA VAL A 955 0.593 15.167 -6.920 1.00 0.00 C ATOM 624 C VAL A 955 0.203 14.197 -8.037 1.00 0.00 C ATOM 625 O VAL A 955 0.127 12.989 -7.816 1.00 0.00 O ATOM 626 CB VAL A 955 -0.569 16.050 -6.462 1.00 0.00 C ATOM 627 CG1 VAL A 955 -1.837 15.221 -6.249 1.00 0.00 C ATOM 628 CG2 VAL A 955 -0.202 16.826 -5.196 1.00 0.00 C ATOM 0 H VAL A 955 1.479 16.986 -7.466 1.00 0.00 H new ATOM 0 HA VAL A 955 0.888 14.569 -6.058 1.00 0.00 H new ATOM 0 HB VAL A 955 -0.771 16.774 -7.252 1.00 0.00 H new ATOM 0 HG11 VAL A 955 -2.648 15.873 -5.924 1.00 0.00 H new ATOM 0 HG12 VAL A 955 -2.115 14.735 -7.184 1.00 0.00 H new ATOM 0 HG13 VAL A 955 -1.653 14.464 -5.487 1.00 0.00 H new ATOM 0 HG21 VAL A 955 -1.045 17.446 -4.892 1.00 0.00 H new ATOM 0 HG22 VAL A 955 0.040 16.125 -4.397 1.00 0.00 H new ATOM 0 HG23 VAL A 955 0.661 17.461 -5.396 1.00 0.00 H new ATOM 638 N LYS A 956 -0.034 14.762 -9.212 1.00 0.00 N ATOM 639 CA LYS A 956 -0.415 13.962 -10.363 1.00 0.00 C ATOM 640 C LYS A 956 0.406 12.670 -10.376 1.00 0.00 C ATOM 641 O LYS A 956 -0.104 11.610 -10.736 1.00 0.00 O ATOM 642 CB LYS A 956 -0.291 14.781 -11.650 1.00 0.00 C ATOM 643 CG LYS A 956 -1.510 15.685 -11.843 1.00 0.00 C ATOM 644 CD LYS A 956 -2.741 14.868 -12.238 1.00 0.00 C ATOM 645 CE LYS A 956 -3.339 15.377 -13.552 1.00 0.00 C ATOM 646 NZ LYS A 956 -3.474 14.269 -14.524 1.00 0.00 N ATOM 0 H LYS A 956 0.031 15.764 -9.391 1.00 0.00 H new ATOM 0 HA LYS A 956 -1.464 13.674 -10.295 1.00 0.00 H new ATOM 0 HB2 LYS A 956 0.614 15.387 -11.614 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -0.192 14.111 -12.504 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -1.712 16.231 -10.921 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -1.299 16.427 -12.613 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -2.467 13.818 -12.342 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -3.489 14.926 -11.447 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -4.315 15.825 -13.365 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -2.704 16.159 -13.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -3.881 14.632 -15.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -2.538 13.859 -14.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -4.098 13.536 -14.131 1.00 0.00 H new ATOM 660 N GLU A 957 1.662 12.802 -9.977 1.00 0.00 N ATOM 661 CA GLU A 957 2.558 11.658 -9.937 1.00 0.00 C ATOM 662 C GLU A 957 2.067 10.634 -8.912 1.00 0.00 C ATOM 663 O GLU A 957 1.778 9.491 -9.262 1.00 0.00 O ATOM 664 CB GLU A 957 3.992 12.096 -9.631 1.00 0.00 C ATOM 665 CG GLU A 957 4.829 12.164 -10.910 1.00 0.00 C ATOM 666 CD GLU A 957 4.980 13.610 -11.389 1.00 0.00 C ATOM 667 OE1 GLU A 957 3.962 14.160 -11.860 1.00 0.00 O ATOM 668 OE2 GLU A 957 6.111 14.131 -11.274 1.00 0.00 O ATOM 0 H GLU A 957 2.081 13.683 -9.679 1.00 0.00 H new ATOM 0 HA GLU A 957 2.558 11.187 -10.920 1.00 0.00 H new ATOM 0 HB2 GLU A 957 3.982 13.072 -9.146 1.00 0.00 H new ATOM 0 HB3 GLU A 957 4.448 11.397 -8.930 1.00 0.00 H new ATOM 0 HG2 GLU A 957 5.813 11.732 -10.728 1.00 0.00 H new ATOM 0 HG3 GLU A 957 4.358 11.566 -11.690 1.00 0.00 H new ATOM 675 N VAL A 958 1.987 11.081 -7.668 1.00 0.00 N ATOM 676 CA VAL A 958 1.535 10.218 -6.590 1.00 0.00 C ATOM 677 C VAL A 958 0.291 9.451 -7.043 1.00 0.00 C ATOM 678 O VAL A 958 0.161 8.258 -6.776 1.00 0.00 O ATOM 679 CB VAL A 958 1.300 11.042 -5.322 1.00 0.00 C ATOM 680 CG1 VAL A 958 -0.180 11.394 -5.163 1.00 0.00 C ATOM 681 CG2 VAL A 958 1.825 10.309 -4.087 1.00 0.00 C ATOM 0 H VAL A 958 2.228 12.030 -7.382 1.00 0.00 H new ATOM 0 HA VAL A 958 2.300 9.481 -6.346 1.00 0.00 H new ATOM 0 HB VAL A 958 1.857 11.974 -5.420 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -0.319 11.980 -4.254 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -0.510 11.976 -6.024 1.00 0.00 H new ATOM 0 HG13 VAL A 958 -0.767 10.478 -5.098 1.00 0.00 H new ATOM 0 HG21 VAL A 958 1.646 10.916 -3.200 1.00 0.00 H new ATOM 0 HG22 VAL A 958 1.309 9.354 -3.984 1.00 0.00 H new ATOM 0 HG23 VAL A 958 2.895 10.133 -4.196 1.00 0.00 H new ATOM 691 N GLY A 959 -0.593 10.169 -7.722 1.00 0.00 N ATOM 692 CA GLY A 959 -1.822 9.572 -8.215 1.00 0.00 C ATOM 693 C GLY A 959 -1.525 8.367 -9.111 1.00 0.00 C ATOM 694 O GLY A 959 -2.122 7.304 -8.945 1.00 0.00 O ATOM 0 H GLY A 959 -0.482 11.159 -7.942 1.00 0.00 H new ATOM 0 HA2 GLY A 959 -2.442 9.261 -7.374 1.00 0.00 H new ATOM 0 HA3 GLY A 959 -2.392 10.314 -8.774 1.00 0.00 H new ATOM 698 N LEU A 960 -0.604 8.574 -10.040 1.00 0.00 N ATOM 699 CA LEU A 960 -0.221 7.518 -10.962 1.00 0.00 C ATOM 700 C LEU A 960 0.215 6.286 -10.167 1.00 0.00 C ATOM 701 O LEU A 960 -0.163 5.163 -10.498 1.00 0.00 O ATOM 702 CB LEU A 960 0.838 8.023 -11.944 1.00 0.00 C ATOM 703 CG LEU A 960 0.581 7.721 -13.422 1.00 0.00 C ATOM 704 CD1 LEU A 960 1.639 8.379 -14.309 1.00 0.00 C ATOM 705 CD2 LEU A 960 0.487 6.213 -13.665 1.00 0.00 C ATOM 0 H LEU A 960 -0.112 9.457 -10.174 1.00 0.00 H new ATOM 0 HA LEU A 960 -1.072 7.218 -11.573 1.00 0.00 H new ATOM 0 HB2 LEU A 960 0.930 9.103 -11.825 1.00 0.00 H new ATOM 0 HB3 LEU A 960 1.799 7.589 -11.667 1.00 0.00 H new ATOM 0 HG LEU A 960 -0.382 8.153 -13.696 1.00 0.00 H new ATOM 0 HD11 LEU A 960 1.432 8.148 -15.354 1.00 0.00 H new ATOM 0 HD12 LEU A 960 1.615 9.459 -14.164 1.00 0.00 H new ATOM 0 HD13 LEU A 960 2.625 7.999 -14.042 1.00 0.00 H new ATOM 0 HD21 LEU A 960 0.304 6.026 -14.723 1.00 0.00 H new ATOM 0 HD22 LEU A 960 1.422 5.738 -13.369 1.00 0.00 H new ATOM 0 HD23 LEU A 960 -0.332 5.800 -13.076 1.00 0.00 H new ATOM 717 N ALA A 961 1.005 6.537 -9.133 1.00 0.00 N ATOM 718 CA ALA A 961 1.496 5.462 -8.288 1.00 0.00 C ATOM 719 C ALA A 961 0.309 4.678 -7.725 1.00 0.00 C ATOM 720 O ALA A 961 0.324 3.449 -7.708 1.00 0.00 O ATOM 721 CB ALA A 961 2.385 6.044 -7.187 1.00 0.00 C ATOM 0 H ALA A 961 1.317 7.469 -8.861 1.00 0.00 H new ATOM 0 HA ALA A 961 2.105 4.767 -8.866 1.00 0.00 H new ATOM 0 HB1 ALA A 961 2.754 5.238 -6.553 1.00 0.00 H new ATOM 0 HB2 ALA A 961 3.229 6.565 -7.638 1.00 0.00 H new ATOM 0 HB3 ALA A 961 1.806 6.744 -6.584 1.00 0.00 H new ATOM 727 N LEU A 962 -0.692 5.423 -7.278 1.00 0.00 N ATOM 728 CA LEU A 962 -1.885 4.813 -6.715 1.00 0.00 C ATOM 729 C LEU A 962 -2.553 3.936 -7.777 1.00 0.00 C ATOM 730 O LEU A 962 -2.896 2.786 -7.510 1.00 0.00 O ATOM 731 CB LEU A 962 -2.809 5.883 -6.131 1.00 0.00 C ATOM 732 CG LEU A 962 -2.320 6.567 -4.853 1.00 0.00 C ATOM 733 CD1 LEU A 962 -2.469 8.087 -4.953 1.00 0.00 C ATOM 734 CD2 LEU A 962 -3.029 6.001 -3.622 1.00 0.00 C ATOM 0 H LEU A 962 -0.701 6.443 -7.294 1.00 0.00 H new ATOM 0 HA LEU A 962 -1.623 4.162 -5.881 1.00 0.00 H new ATOM 0 HB2 LEU A 962 -2.971 6.648 -6.890 1.00 0.00 H new ATOM 0 HB3 LEU A 962 -3.778 5.426 -5.927 1.00 0.00 H new ATOM 0 HG LEU A 962 -1.257 6.355 -4.737 1.00 0.00 H new ATOM 0 HD11 LEU A 962 -2.114 8.549 -4.032 1.00 0.00 H new ATOM 0 HD12 LEU A 962 -1.881 8.456 -5.793 1.00 0.00 H new ATOM 0 HD13 LEU A 962 -3.518 8.341 -5.105 1.00 0.00 H new ATOM 0 HD21 LEU A 962 -2.663 6.505 -2.727 1.00 0.00 H new ATOM 0 HD22 LEU A 962 -4.103 6.162 -3.715 1.00 0.00 H new ATOM 0 HD23 LEU A 962 -2.827 4.933 -3.545 1.00 0.00 H new ATOM 746 N ARG A 963 -2.717 4.514 -8.958 1.00 0.00 N ATOM 747 CA ARG A 963 -3.338 3.799 -10.060 1.00 0.00 C ATOM 748 C ARG A 963 -2.619 2.471 -10.303 1.00 0.00 C ATOM 749 O ARG A 963 -3.243 1.411 -10.289 1.00 0.00 O ATOM 750 CB ARG A 963 -3.305 4.631 -11.344 1.00 0.00 C ATOM 751 CG ARG A 963 -4.131 5.910 -11.189 1.00 0.00 C ATOM 752 CD ARG A 963 -5.253 5.966 -12.228 1.00 0.00 C ATOM 753 NE ARG A 963 -5.411 7.350 -12.728 1.00 0.00 N ATOM 754 CZ ARG A 963 -6.521 7.814 -13.318 1.00 0.00 C ATOM 755 NH1 ARG A 963 -7.578 7.007 -13.486 1.00 0.00 N ATOM 756 NH2 ARG A 963 -6.575 9.084 -13.740 1.00 0.00 N ATOM 0 H ARG A 963 -2.431 5.469 -9.176 1.00 0.00 H new ATOM 0 HA ARG A 963 -4.377 3.610 -9.789 1.00 0.00 H new ATOM 0 HB2 ARG A 963 -2.274 4.887 -11.590 1.00 0.00 H new ATOM 0 HB3 ARG A 963 -3.694 4.041 -12.174 1.00 0.00 H new ATOM 0 HG2 ARG A 963 -4.556 5.954 -10.186 1.00 0.00 H new ATOM 0 HG3 ARG A 963 -3.484 6.781 -11.299 1.00 0.00 H new ATOM 0 HD2 ARG A 963 -5.026 5.295 -13.056 1.00 0.00 H new ATOM 0 HD3 ARG A 963 -6.188 5.622 -11.785 1.00 0.00 H new ATOM 0 HE ARG A 963 -4.625 7.991 -12.616 1.00 0.00 H new ATOM 0 HH11 ARG A 963 -7.537 6.040 -13.165 1.00 0.00 H new ATOM 0 HH12 ARG A 963 -8.423 7.360 -13.935 1.00 0.00 H new ATOM 0 HH21 ARG A 963 -5.771 9.698 -13.612 1.00 0.00 H new ATOM 0 HH22 ARG A 963 -7.420 9.437 -14.189 1.00 0.00 H new ATOM 770 N THR A 964 -1.316 2.571 -10.522 1.00 0.00 N ATOM 771 CA THR A 964 -0.505 1.390 -10.768 1.00 0.00 C ATOM 772 C THR A 964 -0.602 0.421 -9.588 1.00 0.00 C ATOM 773 O THR A 964 -0.595 -0.794 -9.776 1.00 0.00 O ATOM 774 CB THR A 964 0.924 1.850 -11.061 1.00 0.00 C ATOM 775 OG1 THR A 964 0.851 2.397 -12.375 1.00 0.00 O ATOM 776 CG2 THR A 964 1.900 0.680 -11.198 1.00 0.00 C ATOM 0 H THR A 964 -0.802 3.452 -10.534 1.00 0.00 H new ATOM 0 HA THR A 964 -0.867 0.835 -11.634 1.00 0.00 H new ATOM 0 HB THR A 964 1.262 2.513 -10.264 1.00 0.00 H new ATOM 0 HG1 THR A 964 1.736 2.721 -12.644 1.00 0.00 H new ATOM 0 HG21 THR A 964 2.899 1.062 -11.406 1.00 0.00 H new ATOM 0 HG22 THR A 964 1.916 0.109 -10.270 1.00 0.00 H new ATOM 0 HG23 THR A 964 1.581 0.034 -12.016 1.00 0.00 H new ATOM 784 N LEU A 965 -0.691 0.996 -8.398 1.00 0.00 N ATOM 785 CA LEU A 965 -0.789 0.199 -7.187 1.00 0.00 C ATOM 786 C LEU A 965 -1.951 -0.787 -7.323 1.00 0.00 C ATOM 787 O LEU A 965 -1.773 -1.991 -7.148 1.00 0.00 O ATOM 788 CB LEU A 965 -0.890 1.103 -5.957 1.00 0.00 C ATOM 789 CG LEU A 965 -0.769 0.405 -4.600 1.00 0.00 C ATOM 790 CD1 LEU A 965 -2.118 -0.163 -4.154 1.00 0.00 C ATOM 791 CD2 LEU A 965 0.323 -0.666 -4.630 1.00 0.00 C ATOM 0 H LEU A 965 -0.697 2.005 -8.246 1.00 0.00 H new ATOM 0 HA LEU A 965 0.116 -0.392 -7.046 1.00 0.00 H new ATOM 0 HB2 LEU A 965 -0.111 1.862 -6.024 1.00 0.00 H new ATOM 0 HB3 LEU A 965 -1.847 1.624 -5.991 1.00 0.00 H new ATOM 0 HG LEU A 965 -0.471 1.147 -3.859 1.00 0.00 H new ATOM 0 HD11 LEU A 965 -2.005 -0.654 -3.187 1.00 0.00 H new ATOM 0 HD12 LEU A 965 -2.843 0.646 -4.067 1.00 0.00 H new ATOM 0 HD13 LEU A 965 -2.469 -0.887 -4.889 1.00 0.00 H new ATOM 0 HD21 LEU A 965 0.388 -1.146 -3.654 1.00 0.00 H new ATOM 0 HD22 LEU A 965 0.080 -1.412 -5.386 1.00 0.00 H new ATOM 0 HD23 LEU A 965 1.280 -0.203 -4.871 1.00 0.00 H new ATOM 803 N LEU A 966 -3.117 -0.238 -7.636 1.00 0.00 N ATOM 804 CA LEU A 966 -4.308 -1.054 -7.798 1.00 0.00 C ATOM 805 C LEU A 966 -3.976 -2.268 -8.668 1.00 0.00 C ATOM 806 O LEU A 966 -4.191 -3.408 -8.259 1.00 0.00 O ATOM 807 CB LEU A 966 -5.466 -0.211 -8.335 1.00 0.00 C ATOM 808 CG LEU A 966 -6.213 0.637 -7.303 1.00 0.00 C ATOM 809 CD1 LEU A 966 -5.387 1.858 -6.894 1.00 0.00 C ATOM 810 CD2 LEU A 966 -7.600 1.030 -7.818 1.00 0.00 C ATOM 0 H LEU A 966 -3.261 0.761 -7.781 1.00 0.00 H new ATOM 0 HA LEU A 966 -4.642 -1.435 -6.833 1.00 0.00 H new ATOM 0 HB2 LEU A 966 -5.079 0.452 -9.109 1.00 0.00 H new ATOM 0 HB3 LEU A 966 -6.182 -0.877 -8.815 1.00 0.00 H new ATOM 0 HG LEU A 966 -6.360 0.034 -6.407 1.00 0.00 H new ATOM 0 HD11 LEU A 966 -5.941 2.443 -6.160 1.00 0.00 H new ATOM 0 HD12 LEU A 966 -4.443 1.530 -6.458 1.00 0.00 H new ATOM 0 HD13 LEU A 966 -5.187 2.473 -7.772 1.00 0.00 H new ATOM 0 HD21 LEU A 966 -8.110 1.632 -7.066 1.00 0.00 H new ATOM 0 HD22 LEU A 966 -7.497 1.608 -8.737 1.00 0.00 H new ATOM 0 HD23 LEU A 966 -8.182 0.130 -8.019 1.00 0.00 H new ATOM 822 N ALA A 967 -3.456 -1.982 -9.853 1.00 0.00 N ATOM 823 CA ALA A 967 -3.092 -3.035 -10.784 1.00 0.00 C ATOM 824 C ALA A 967 -2.046 -3.944 -10.136 1.00 0.00 C ATOM 825 O ALA A 967 -2.164 -5.168 -10.188 1.00 0.00 O ATOM 826 CB ALA A 967 -2.594 -2.413 -12.090 1.00 0.00 C ATOM 0 H ALA A 967 -3.278 -1.035 -10.189 1.00 0.00 H new ATOM 0 HA ALA A 967 -3.959 -3.650 -11.025 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -2.321 -3.204 -12.789 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -3.384 -1.801 -12.526 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -1.722 -1.791 -11.887 1.00 0.00 H new ATOM 832 N THR A 968 -1.046 -3.311 -9.540 1.00 0.00 N ATOM 833 CA THR A 968 0.020 -4.048 -8.882 1.00 0.00 C ATOM 834 C THR A 968 -0.562 -5.060 -7.893 1.00 0.00 C ATOM 835 O THR A 968 -0.157 -6.221 -7.877 1.00 0.00 O ATOM 836 CB THR A 968 0.962 -3.034 -8.230 1.00 0.00 C ATOM 837 OG1 THR A 968 1.383 -2.206 -9.310 1.00 0.00 O ATOM 838 CG2 THR A 968 2.257 -3.677 -7.727 1.00 0.00 C ATOM 0 H THR A 968 -0.951 -2.296 -9.499 1.00 0.00 H new ATOM 0 HA THR A 968 0.595 -4.635 -9.598 1.00 0.00 H new ATOM 0 HB THR A 968 0.452 -2.547 -7.399 1.00 0.00 H new ATOM 0 HG1 THR A 968 0.688 -1.542 -9.503 1.00 0.00 H new ATOM 0 HG21 THR A 968 2.890 -2.914 -7.273 1.00 0.00 H new ATOM 0 HG22 THR A 968 2.020 -4.440 -6.986 1.00 0.00 H new ATOM 0 HG23 THR A 968 2.784 -4.135 -8.564 1.00 0.00 H new ATOM 846 N VAL A 969 -1.504 -4.582 -7.093 1.00 0.00 N ATOM 847 CA VAL A 969 -2.146 -5.430 -6.103 1.00 0.00 C ATOM 848 C VAL A 969 -2.837 -6.598 -6.810 1.00 0.00 C ATOM 849 O VAL A 969 -2.820 -7.725 -6.317 1.00 0.00 O ATOM 850 CB VAL A 969 -3.103 -4.601 -5.245 1.00 0.00 C ATOM 851 CG1 VAL A 969 -3.835 -5.483 -4.231 1.00 0.00 C ATOM 852 CG2 VAL A 969 -2.363 -3.459 -4.545 1.00 0.00 C ATOM 0 H VAL A 969 -1.838 -3.618 -7.110 1.00 0.00 H new ATOM 0 HA VAL A 969 -1.405 -5.852 -5.424 1.00 0.00 H new ATOM 0 HB VAL A 969 -3.849 -4.161 -5.906 1.00 0.00 H new ATOM 0 HG11 VAL A 969 -4.509 -4.869 -3.634 1.00 0.00 H new ATOM 0 HG12 VAL A 969 -4.410 -6.244 -4.759 1.00 0.00 H new ATOM 0 HG13 VAL A 969 -3.109 -5.965 -3.577 1.00 0.00 H new ATOM 0 HG21 VAL A 969 -3.067 -2.885 -3.942 1.00 0.00 H new ATOM 0 HG22 VAL A 969 -1.585 -3.870 -3.902 1.00 0.00 H new ATOM 0 HG23 VAL A 969 -1.910 -2.807 -5.292 1.00 0.00 H new ATOM 862 N ASP A 970 -3.428 -6.289 -7.955 1.00 0.00 N ATOM 863 CA ASP A 970 -4.123 -7.299 -8.735 1.00 0.00 C ATOM 864 C ASP A 970 -3.212 -8.514 -8.916 1.00 0.00 C ATOM 865 O ASP A 970 -3.677 -9.652 -8.892 1.00 0.00 O ATOM 866 CB ASP A 970 -4.486 -6.769 -10.123 1.00 0.00 C ATOM 867 CG ASP A 970 -5.641 -7.499 -10.813 1.00 0.00 C ATOM 868 OD1 ASP A 970 -6.769 -7.404 -10.284 1.00 0.00 O ATOM 869 OD2 ASP A 970 -5.368 -8.137 -11.853 1.00 0.00 O ATOM 0 H ASP A 970 -3.440 -5.353 -8.361 1.00 0.00 H new ATOM 0 HA ASP A 970 -5.035 -7.568 -8.202 1.00 0.00 H new ATOM 0 HB2 ASP A 970 -4.743 -5.713 -10.036 1.00 0.00 H new ATOM 0 HB3 ASP A 970 -3.604 -6.831 -10.761 1.00 0.00 H new ATOM 874 N GLU A 971 -1.929 -8.231 -9.093 1.00 0.00 N ATOM 875 CA GLU A 971 -0.948 -9.287 -9.278 1.00 0.00 C ATOM 876 C GLU A 971 -0.617 -9.944 -7.937 1.00 0.00 C ATOM 877 O GLU A 971 -0.167 -11.088 -7.897 1.00 0.00 O ATOM 878 CB GLU A 971 0.315 -8.749 -9.953 1.00 0.00 C ATOM 879 CG GLU A 971 0.045 -8.388 -11.415 1.00 0.00 C ATOM 880 CD GLU A 971 1.337 -8.414 -12.234 1.00 0.00 C ATOM 881 OE1 GLU A 971 2.070 -9.418 -12.105 1.00 0.00 O ATOM 882 OE2 GLU A 971 1.563 -7.429 -12.970 1.00 0.00 O ATOM 0 H GLU A 971 -1.547 -7.286 -9.112 1.00 0.00 H new ATOM 0 HA GLU A 971 -1.376 -10.044 -9.935 1.00 0.00 H new ATOM 0 HB2 GLU A 971 0.671 -7.869 -9.417 1.00 0.00 H new ATOM 0 HB3 GLU A 971 1.107 -9.496 -9.900 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -0.673 -9.089 -11.840 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -0.406 -7.397 -11.471 1.00 0.00 H new ATOM 889 N SER A 972 -0.851 -9.192 -6.872 1.00 0.00 N ATOM 890 CA SER A 972 -0.583 -9.688 -5.533 1.00 0.00 C ATOM 891 C SER A 972 -1.786 -10.479 -5.017 1.00 0.00 C ATOM 892 O SER A 972 -1.632 -11.390 -4.204 1.00 0.00 O ATOM 893 CB SER A 972 -0.253 -8.540 -4.576 1.00 0.00 C ATOM 894 OG SER A 972 0.867 -8.840 -3.748 1.00 0.00 O ATOM 0 H SER A 972 -1.223 -8.243 -6.909 1.00 0.00 H new ATOM 0 HA SER A 972 0.284 -10.347 -5.580 1.00 0.00 H new ATOM 0 HB2 SER A 972 -0.047 -7.637 -5.151 1.00 0.00 H new ATOM 0 HB3 SER A 972 -1.120 -8.329 -3.950 1.00 0.00 H new ATOM 0 HG SER A 972 0.701 -8.509 -2.841 1.00 0.00 H new ATOM 900 N LEU A 973 -2.957 -10.104 -5.510 1.00 0.00 N ATOM 901 CA LEU A 973 -4.186 -10.767 -5.109 1.00 0.00 C ATOM 902 C LEU A 973 -3.949 -12.278 -5.052 1.00 0.00 C ATOM 903 O LEU A 973 -4.265 -12.922 -4.053 1.00 0.00 O ATOM 904 CB LEU A 973 -5.339 -10.360 -6.028 1.00 0.00 C ATOM 905 CG LEU A 973 -6.592 -9.821 -5.334 1.00 0.00 C ATOM 906 CD1 LEU A 973 -7.859 -10.277 -6.059 1.00 0.00 C ATOM 907 CD2 LEU A 973 -6.607 -10.208 -3.854 1.00 0.00 C ATOM 0 H LEU A 973 -3.081 -9.349 -6.184 1.00 0.00 H new ATOM 0 HA LEU A 973 -4.480 -10.451 -4.108 1.00 0.00 H new ATOM 0 HB2 LEU A 973 -4.975 -9.600 -6.719 1.00 0.00 H new ATOM 0 HB3 LEU A 973 -5.623 -11.225 -6.627 1.00 0.00 H new ATOM 0 HG LEU A 973 -6.568 -8.732 -5.382 1.00 0.00 H new ATOM 0 HD11 LEU A 973 -8.735 -9.880 -5.545 1.00 0.00 H new ATOM 0 HD12 LEU A 973 -7.843 -9.910 -7.085 1.00 0.00 H new ATOM 0 HD13 LEU A 973 -7.904 -11.366 -6.064 1.00 0.00 H new ATOM 0 HD21 LEU A 973 -7.508 -9.813 -3.384 1.00 0.00 H new ATOM 0 HD22 LEU A 973 -6.596 -11.294 -3.762 1.00 0.00 H new ATOM 0 HD23 LEU A 973 -5.728 -9.793 -3.361 1.00 0.00 H new ATOM 919 N PRO A 974 -3.381 -12.813 -6.165 1.00 0.00 N ATOM 920 CA PRO A 974 -3.098 -14.236 -6.251 1.00 0.00 C ATOM 921 C PRO A 974 -1.876 -14.604 -5.407 1.00 0.00 C ATOM 922 O PRO A 974 -1.832 -15.676 -4.806 1.00 0.00 O ATOM 923 CB PRO A 974 -2.901 -14.509 -7.733 1.00 0.00 C ATOM 924 CG PRO A 974 -2.620 -13.159 -8.372 1.00 0.00 C ATOM 925 CD PRO A 974 -2.993 -12.081 -7.367 1.00 0.00 C ATOM 0 HA PRO A 974 -3.904 -14.850 -5.850 1.00 0.00 H new ATOM 0 HB2 PRO A 974 -2.073 -15.198 -7.896 1.00 0.00 H new ATOM 0 HB3 PRO A 974 -3.789 -14.969 -8.167 1.00 0.00 H new ATOM 0 HG2 PRO A 974 -1.568 -13.078 -8.646 1.00 0.00 H new ATOM 0 HG3 PRO A 974 -3.198 -13.043 -9.289 1.00 0.00 H new ATOM 0 HD2 PRO A 974 -2.153 -11.415 -7.171 1.00 0.00 H new ATOM 0 HD3 PRO A 974 -3.811 -11.462 -7.735 1.00 0.00 H new ATOM 933 N VAL A 975 -0.913 -13.694 -5.390 1.00 0.00 N ATOM 934 CA VAL A 975 0.307 -13.910 -4.631 1.00 0.00 C ATOM 935 C VAL A 975 -0.052 -14.399 -3.226 1.00 0.00 C ATOM 936 O VAL A 975 0.704 -15.153 -2.616 1.00 0.00 O ATOM 937 CB VAL A 975 1.151 -12.633 -4.622 1.00 0.00 C ATOM 938 CG1 VAL A 975 2.184 -12.666 -3.494 1.00 0.00 C ATOM 939 CG2 VAL A 975 1.825 -12.413 -5.978 1.00 0.00 C ATOM 0 H VAL A 975 -0.953 -12.806 -5.890 1.00 0.00 H new ATOM 0 HA VAL A 975 0.916 -14.683 -5.099 1.00 0.00 H new ATOM 0 HB VAL A 975 0.484 -11.791 -4.439 1.00 0.00 H new ATOM 0 HG11 VAL A 975 2.770 -11.747 -3.510 1.00 0.00 H new ATOM 0 HG12 VAL A 975 1.673 -12.754 -2.535 1.00 0.00 H new ATOM 0 HG13 VAL A 975 2.846 -13.521 -3.632 1.00 0.00 H new ATOM 0 HG21 VAL A 975 2.419 -11.499 -5.945 1.00 0.00 H new ATOM 0 HG22 VAL A 975 2.474 -13.259 -6.203 1.00 0.00 H new ATOM 0 HG23 VAL A 975 1.063 -12.323 -6.753 1.00 0.00 H new ATOM 949 N LEU A 976 -1.205 -13.949 -2.755 1.00 0.00 N ATOM 950 CA LEU A 976 -1.674 -14.332 -1.433 1.00 0.00 C ATOM 951 C LEU A 976 -2.865 -15.280 -1.574 1.00 0.00 C ATOM 952 O LEU A 976 -3.511 -15.321 -2.620 1.00 0.00 O ATOM 953 CB LEU A 976 -1.972 -13.090 -0.591 1.00 0.00 C ATOM 954 CG LEU A 976 -0.844 -12.062 -0.487 1.00 0.00 C ATOM 955 CD1 LEU A 976 0.477 -12.735 -0.108 1.00 0.00 C ATOM 956 CD2 LEU A 976 -0.723 -11.248 -1.777 1.00 0.00 C ATOM 0 H LEU A 976 -1.829 -13.323 -3.264 1.00 0.00 H new ATOM 0 HA LEU A 976 -0.897 -14.875 -0.895 1.00 0.00 H new ATOM 0 HB2 LEU A 976 -2.850 -12.596 -1.007 1.00 0.00 H new ATOM 0 HB3 LEU A 976 -2.236 -13.413 0.416 1.00 0.00 H new ATOM 0 HG LEU A 976 -1.091 -11.363 0.312 1.00 0.00 H new ATOM 0 HD11 LEU A 976 1.263 -11.982 -0.041 1.00 0.00 H new ATOM 0 HD12 LEU A 976 0.368 -13.233 0.855 1.00 0.00 H new ATOM 0 HD13 LEU A 976 0.742 -13.469 -0.868 1.00 0.00 H new ATOM 0 HD21 LEU A 976 0.086 -10.525 -1.676 1.00 0.00 H new ATOM 0 HD22 LEU A 976 -0.510 -11.917 -2.611 1.00 0.00 H new ATOM 0 HD23 LEU A 976 -1.659 -10.722 -1.964 1.00 0.00 H new ATOM 968 N PRO A 977 -3.128 -16.040 -0.477 1.00 0.00 N ATOM 969 CA PRO A 977 -4.231 -16.986 -0.468 1.00 0.00 C ATOM 970 C PRO A 977 -5.572 -16.263 -0.331 1.00 0.00 C ATOM 971 O PRO A 977 -5.627 -15.137 0.161 1.00 0.00 O ATOM 972 CB PRO A 977 -3.939 -17.920 0.695 1.00 0.00 C ATOM 973 CG PRO A 977 -2.938 -17.189 1.575 1.00 0.00 C ATOM 974 CD PRO A 977 -2.385 -16.019 0.780 1.00 0.00 C ATOM 0 HA PRO A 977 -4.313 -17.545 -1.400 1.00 0.00 H new ATOM 0 HB2 PRO A 977 -4.849 -18.152 1.248 1.00 0.00 H new ATOM 0 HB3 PRO A 977 -3.531 -18.867 0.342 1.00 0.00 H new ATOM 0 HG2 PRO A 977 -3.418 -16.837 2.488 1.00 0.00 H new ATOM 0 HG3 PRO A 977 -2.133 -17.860 1.876 1.00 0.00 H new ATOM 0 HD2 PRO A 977 -2.529 -15.077 1.309 1.00 0.00 H new ATOM 0 HD3 PRO A 977 -1.314 -16.128 0.609 1.00 0.00 H new ATOM 982 N ALA A 978 -6.621 -16.940 -0.776 1.00 0.00 N ATOM 983 CA ALA A 978 -7.959 -16.376 -0.709 1.00 0.00 C ATOM 984 C ALA A 978 -8.374 -16.231 0.756 1.00 0.00 C ATOM 985 O ALA A 978 -9.207 -16.992 1.247 1.00 0.00 O ATOM 986 CB ALA A 978 -8.924 -17.257 -1.504 1.00 0.00 C ATOM 0 H ALA A 978 -6.571 -17.873 -1.184 1.00 0.00 H new ATOM 0 HA ALA A 978 -7.980 -15.383 -1.157 1.00 0.00 H new ATOM 0 HB1 ALA A 978 -9.928 -16.835 -1.454 1.00 0.00 H new ATOM 0 HB2 ALA A 978 -8.601 -17.304 -2.544 1.00 0.00 H new ATOM 0 HB3 ALA A 978 -8.932 -18.262 -1.081 1.00 0.00 H new ATOM 992 N SER A 979 -7.775 -15.250 1.414 1.00 0.00 N ATOM 993 CA SER A 979 -8.072 -14.995 2.813 1.00 0.00 C ATOM 994 C SER A 979 -7.952 -13.499 3.111 1.00 0.00 C ATOM 995 O SER A 979 -8.796 -12.931 3.802 1.00 0.00 O ATOM 996 CB SER A 979 -7.141 -15.794 3.728 1.00 0.00 C ATOM 997 OG SER A 979 -7.251 -15.386 5.089 1.00 0.00 O ATOM 0 H SER A 979 -7.084 -14.621 1.004 1.00 0.00 H new ATOM 0 HA SER A 979 -9.095 -15.317 3.009 1.00 0.00 H new ATOM 0 HB2 SER A 979 -7.377 -16.855 3.647 1.00 0.00 H new ATOM 0 HB3 SER A 979 -6.111 -15.670 3.394 1.00 0.00 H new ATOM 0 HG SER A 979 -6.643 -15.920 5.641 1.00 0.00 H new ATOM 1003 N THR A 980 -6.897 -12.904 2.573 1.00 0.00 N ATOM 1004 CA THR A 980 -6.656 -11.485 2.772 1.00 0.00 C ATOM 1005 C THR A 980 -7.306 -10.672 1.651 1.00 0.00 C ATOM 1006 O THR A 980 -7.332 -9.443 1.706 1.00 0.00 O ATOM 1007 CB THR A 980 -5.145 -11.273 2.880 1.00 0.00 C ATOM 1008 OG1 THR A 980 -4.983 -9.862 2.762 1.00 0.00 O ATOM 1009 CG2 THR A 980 -4.387 -11.837 1.677 1.00 0.00 C ATOM 0 H THR A 980 -6.200 -13.379 2.000 1.00 0.00 H new ATOM 0 HA THR A 980 -7.115 -11.131 3.695 1.00 0.00 H new ATOM 0 HB THR A 980 -4.777 -11.742 3.793 1.00 0.00 H new ATOM 0 HG1 THR A 980 -5.863 -9.435 2.708 1.00 0.00 H new ATOM 0 HG21 THR A 980 -3.319 -11.660 1.804 1.00 0.00 H new ATOM 0 HG22 THR A 980 -4.571 -12.909 1.601 1.00 0.00 H new ATOM 0 HG23 THR A 980 -4.730 -11.345 0.767 1.00 0.00 H new ATOM 1017 N HIS A 981 -7.813 -11.390 0.660 1.00 0.00 N ATOM 1018 CA HIS A 981 -8.461 -10.750 -0.472 1.00 0.00 C ATOM 1019 C HIS A 981 -9.561 -9.813 0.028 1.00 0.00 C ATOM 1020 O HIS A 981 -9.541 -8.617 -0.260 1.00 0.00 O ATOM 1021 CB HIS A 981 -8.977 -11.795 -1.464 1.00 0.00 C ATOM 1022 CG HIS A 981 -7.902 -12.697 -2.021 1.00 0.00 C ATOM 1023 ND1 HIS A 981 -8.029 -13.355 -3.233 1.00 0.00 N ATOM 1024 CD2 HIS A 981 -6.681 -13.043 -1.521 1.00 0.00 C ATOM 1025 CE1 HIS A 981 -6.929 -14.062 -3.441 1.00 0.00 C ATOM 1026 NE2 HIS A 981 -6.095 -13.868 -2.379 1.00 0.00 N ATOM 0 H HIS A 981 -7.788 -12.409 0.617 1.00 0.00 H new ATOM 0 HA HIS A 981 -7.736 -10.144 -1.016 1.00 0.00 H new ATOM 0 HB2 HIS A 981 -9.731 -12.408 -0.971 1.00 0.00 H new ATOM 0 HB3 HIS A 981 -9.472 -11.284 -2.290 1.00 0.00 H new ATOM 0 HD2 HIS A 981 -6.262 -12.703 -0.585 1.00 0.00 H new ATOM 0 HE1 HIS A 981 -6.727 -14.683 -4.301 1.00 0.00 H new ATOM 0 HE2 HIS A 981 -5.173 -14.288 -2.264 1.00 0.00 H new ATOM 1034 N ARG A 982 -10.495 -10.391 0.769 1.00 0.00 N ATOM 1035 CA ARG A 982 -11.602 -9.621 1.312 1.00 0.00 C ATOM 1036 C ARG A 982 -11.099 -8.288 1.868 1.00 0.00 C ATOM 1037 O ARG A 982 -11.429 -7.227 1.340 1.00 0.00 O ATOM 1038 CB ARG A 982 -12.316 -10.393 2.423 1.00 0.00 C ATOM 1039 CG ARG A 982 -13.827 -10.160 2.369 1.00 0.00 C ATOM 1040 CD ARG A 982 -14.331 -9.526 3.668 1.00 0.00 C ATOM 1041 NE ARG A 982 -15.756 -9.153 3.529 1.00 0.00 N ATOM 1042 CZ ARG A 982 -16.371 -8.241 4.294 1.00 0.00 C ATOM 1043 NH1 ARG A 982 -15.691 -7.605 5.257 1.00 0.00 N ATOM 1044 NH2 ARG A 982 -17.668 -7.966 4.097 1.00 0.00 N ATOM 0 H ARG A 982 -10.508 -11.383 1.006 1.00 0.00 H new ATOM 0 HA ARG A 982 -12.307 -9.437 0.502 1.00 0.00 H new ATOM 0 HB2 ARG A 982 -12.105 -11.458 2.324 1.00 0.00 H new ATOM 0 HB3 ARG A 982 -11.931 -10.080 3.393 1.00 0.00 H new ATOM 0 HG2 ARG A 982 -14.069 -9.512 1.526 1.00 0.00 H new ATOM 0 HG3 ARG A 982 -14.339 -11.107 2.200 1.00 0.00 H new ATOM 0 HD2 ARG A 982 -14.209 -10.225 4.495 1.00 0.00 H new ATOM 0 HD3 ARG A 982 -13.737 -8.644 3.906 1.00 0.00 H new ATOM 0 HE ARG A 982 -16.304 -9.619 2.806 1.00 0.00 H new ATOM 0 HH11 ARG A 982 -14.704 -7.815 5.408 1.00 0.00 H new ATOM 0 HH12 ARG A 982 -16.160 -6.911 5.839 1.00 0.00 H new ATOM 0 HH21 ARG A 982 -18.187 -8.451 3.365 1.00 0.00 H new ATOM 0 HH22 ARG A 982 -18.136 -7.272 4.679 1.00 0.00 H new ATOM 1058 N GLU A 983 -10.308 -8.385 2.927 1.00 0.00 N ATOM 1059 CA GLU A 983 -9.757 -7.200 3.560 1.00 0.00 C ATOM 1060 C GLU A 983 -8.954 -6.381 2.547 1.00 0.00 C ATOM 1061 O GLU A 983 -9.021 -5.153 2.543 1.00 0.00 O ATOM 1062 CB GLU A 983 -8.895 -7.574 4.768 1.00 0.00 C ATOM 1063 CG GLU A 983 -9.759 -8.098 5.916 1.00 0.00 C ATOM 1064 CD GLU A 983 -9.207 -9.416 6.461 1.00 0.00 C ATOM 1065 OE1 GLU A 983 -9.627 -10.469 5.933 1.00 0.00 O ATOM 1066 OE2 GLU A 983 -8.377 -9.342 7.393 1.00 0.00 O ATOM 0 H GLU A 983 -10.036 -9.267 3.362 1.00 0.00 H new ATOM 0 HA GLU A 983 -10.584 -6.587 3.920 1.00 0.00 H new ATOM 0 HB2 GLU A 983 -8.168 -8.333 4.479 1.00 0.00 H new ATOM 0 HB3 GLU A 983 -8.331 -6.703 5.101 1.00 0.00 H new ATOM 0 HG2 GLU A 983 -9.796 -7.357 6.715 1.00 0.00 H new ATOM 0 HG3 GLU A 983 -10.782 -8.244 5.569 1.00 0.00 H new ATOM 1073 N ILE A 984 -8.213 -7.095 1.712 1.00 0.00 N ATOM 1074 CA ILE A 984 -7.399 -6.450 0.696 1.00 0.00 C ATOM 1075 C ILE A 984 -8.283 -5.540 -0.159 1.00 0.00 C ATOM 1076 O ILE A 984 -7.949 -4.379 -0.387 1.00 0.00 O ATOM 1077 CB ILE A 984 -6.626 -7.493 -0.113 1.00 0.00 C ATOM 1078 CG1 ILE A 984 -5.345 -7.911 0.612 1.00 0.00 C ATOM 1079 CG2 ILE A 984 -6.343 -6.990 -1.530 1.00 0.00 C ATOM 1080 CD1 ILE A 984 -4.785 -9.211 0.032 1.00 0.00 C ATOM 0 H ILE A 984 -8.159 -8.114 1.718 1.00 0.00 H new ATOM 0 HA ILE A 984 -6.643 -5.816 1.160 1.00 0.00 H new ATOM 0 HB ILE A 984 -7.249 -8.382 -0.205 1.00 0.00 H new ATOM 0 HG12 ILE A 984 -4.600 -7.120 0.526 1.00 0.00 H new ATOM 0 HG13 ILE A 984 -5.550 -8.042 1.674 1.00 0.00 H new ATOM 0 HG21 ILE A 984 -5.792 -7.751 -2.083 1.00 0.00 H new ATOM 0 HG22 ILE A 984 -7.285 -6.783 -2.038 1.00 0.00 H new ATOM 0 HG23 ILE A 984 -5.749 -6.077 -1.480 1.00 0.00 H new ATOM 0 HD11 ILE A 984 -3.875 -9.485 0.565 1.00 0.00 H new ATOM 0 HD12 ILE A 984 -5.523 -10.006 0.141 1.00 0.00 H new ATOM 0 HD13 ILE A 984 -4.558 -9.070 -1.025 1.00 0.00 H new ATOM 1092 N GLU A 985 -9.395 -6.103 -0.610 1.00 0.00 N ATOM 1093 CA GLU A 985 -10.330 -5.358 -1.435 1.00 0.00 C ATOM 1094 C GLU A 985 -10.720 -4.049 -0.745 1.00 0.00 C ATOM 1095 O GLU A 985 -10.720 -2.989 -1.370 1.00 0.00 O ATOM 1096 CB GLU A 985 -11.567 -6.198 -1.758 1.00 0.00 C ATOM 1097 CG GLU A 985 -12.051 -5.936 -3.186 1.00 0.00 C ATOM 1098 CD GLU A 985 -13.173 -4.897 -3.203 1.00 0.00 C ATOM 1099 OE1 GLU A 985 -14.237 -5.201 -2.623 1.00 0.00 O ATOM 1100 OE2 GLU A 985 -12.941 -3.821 -3.796 1.00 0.00 O ATOM 0 H GLU A 985 -9.669 -7.067 -0.419 1.00 0.00 H new ATOM 0 HA GLU A 985 -9.840 -5.117 -2.378 1.00 0.00 H new ATOM 0 HB2 GLU A 985 -11.334 -7.256 -1.638 1.00 0.00 H new ATOM 0 HB3 GLU A 985 -12.364 -5.965 -1.052 1.00 0.00 H new ATOM 0 HG2 GLU A 985 -11.219 -5.588 -3.798 1.00 0.00 H new ATOM 0 HG3 GLU A 985 -12.405 -6.866 -3.630 1.00 0.00 H new ATOM 1107 N MET A 986 -11.043 -4.165 0.534 1.00 0.00 N ATOM 1108 CA MET A 986 -11.434 -3.005 1.316 1.00 0.00 C ATOM 1109 C MET A 986 -10.229 -2.108 1.607 1.00 0.00 C ATOM 1110 O MET A 986 -10.386 -0.916 1.868 1.00 0.00 O ATOM 1111 CB MET A 986 -12.059 -3.464 2.635 1.00 0.00 C ATOM 1112 CG MET A 986 -13.562 -3.702 2.475 1.00 0.00 C ATOM 1113 SD MET A 986 -13.951 -5.408 2.826 1.00 0.00 S ATOM 1114 CE MET A 986 -14.293 -5.994 1.175 1.00 0.00 C ATOM 0 H MET A 986 -11.042 -5.045 1.049 1.00 0.00 H new ATOM 0 HA MET A 986 -12.160 -2.431 0.740 1.00 0.00 H new ATOM 0 HB2 MET A 986 -11.576 -4.381 2.971 1.00 0.00 H new ATOM 0 HB3 MET A 986 -11.886 -2.712 3.405 1.00 0.00 H new ATOM 0 HG2 MET A 986 -14.116 -3.048 3.149 1.00 0.00 H new ATOM 0 HG3 MET A 986 -13.872 -3.451 1.461 1.00 0.00 H new ATOM 0 HE1 MET A 986 -13.859 -6.985 1.043 1.00 0.00 H new ATOM 0 HE2 MET A 986 -15.371 -6.047 1.024 1.00 0.00 H new ATOM 0 HE3 MET A 986 -13.858 -5.308 0.448 1.00 0.00 H new ATOM 1124 N ALA A 987 -9.053 -2.716 1.552 1.00 0.00 N ATOM 1125 CA ALA A 987 -7.822 -1.987 1.807 1.00 0.00 C ATOM 1126 C ALA A 987 -7.533 -1.055 0.628 1.00 0.00 C ATOM 1127 O ALA A 987 -7.073 0.070 0.821 1.00 0.00 O ATOM 1128 CB ALA A 987 -6.684 -2.979 2.057 1.00 0.00 C ATOM 0 H ALA A 987 -8.927 -3.705 1.335 1.00 0.00 H new ATOM 0 HA ALA A 987 -7.919 -1.370 2.700 1.00 0.00 H new ATOM 0 HB1 ALA A 987 -5.760 -2.433 2.248 1.00 0.00 H new ATOM 0 HB2 ALA A 987 -6.925 -3.599 2.921 1.00 0.00 H new ATOM 0 HB3 ALA A 987 -6.555 -3.613 1.180 1.00 0.00 H new ATOM 1134 N GLN A 988 -7.815 -1.556 -0.565 1.00 0.00 N ATOM 1135 CA GLN A 988 -7.592 -0.782 -1.774 1.00 0.00 C ATOM 1136 C GLN A 988 -8.459 0.478 -1.765 1.00 0.00 C ATOM 1137 O GLN A 988 -7.949 1.588 -1.915 1.00 0.00 O ATOM 1138 CB GLN A 988 -7.861 -1.625 -3.022 1.00 0.00 C ATOM 1139 CG GLN A 988 -6.787 -2.700 -3.201 1.00 0.00 C ATOM 1140 CD GLN A 988 -5.904 -2.396 -4.413 1.00 0.00 C ATOM 1141 OE1 GLN A 988 -5.078 -1.498 -4.402 1.00 0.00 O ATOM 1142 NE2 GLN A 988 -6.124 -3.192 -5.456 1.00 0.00 N ATOM 0 H GLN A 988 -8.196 -2.489 -0.721 1.00 0.00 H new ATOM 0 HA GLN A 988 -6.545 -0.478 -1.800 1.00 0.00 H new ATOM 0 HB2 GLN A 988 -8.841 -2.095 -2.943 1.00 0.00 H new ATOM 0 HB3 GLN A 988 -7.886 -0.981 -3.901 1.00 0.00 H new ATOM 0 HG2 GLN A 988 -6.171 -2.757 -2.303 1.00 0.00 H new ATOM 0 HG3 GLN A 988 -7.260 -3.674 -3.326 1.00 0.00 H new ATOM 0 HE21 GLN A 988 -6.831 -3.925 -5.398 1.00 0.00 H new ATOM 0 HE22 GLN A 988 -5.585 -3.070 -6.314 1.00 0.00 H new ATOM 1151 N LYS A 989 -9.754 0.265 -1.588 1.00 0.00 N ATOM 1152 CA LYS A 989 -10.697 1.371 -1.558 1.00 0.00 C ATOM 1153 C LYS A 989 -10.295 2.348 -0.451 1.00 0.00 C ATOM 1154 O LYS A 989 -10.600 3.537 -0.528 1.00 0.00 O ATOM 1155 CB LYS A 989 -12.130 0.849 -1.427 1.00 0.00 C ATOM 1156 CG LYS A 989 -13.144 1.936 -1.792 1.00 0.00 C ATOM 1157 CD LYS A 989 -14.333 1.921 -0.829 1.00 0.00 C ATOM 1158 CE LYS A 989 -15.588 1.381 -1.516 1.00 0.00 C ATOM 1159 NZ LYS A 989 -16.687 1.222 -0.538 1.00 0.00 N ATOM 0 H LYS A 989 -10.173 -0.657 -1.464 1.00 0.00 H new ATOM 0 HA LYS A 989 -10.667 1.923 -2.497 1.00 0.00 H new ATOM 0 HB2 LYS A 989 -12.267 -0.015 -2.077 1.00 0.00 H new ATOM 0 HB3 LYS A 989 -12.306 0.510 -0.406 1.00 0.00 H new ATOM 0 HG2 LYS A 989 -12.661 2.913 -1.765 1.00 0.00 H new ATOM 0 HG3 LYS A 989 -13.496 1.783 -2.812 1.00 0.00 H new ATOM 0 HD2 LYS A 989 -14.095 1.305 0.038 1.00 0.00 H new ATOM 0 HD3 LYS A 989 -14.521 2.930 -0.462 1.00 0.00 H new ATOM 0 HE2 LYS A 989 -15.896 2.061 -2.310 1.00 0.00 H new ATOM 0 HE3 LYS A 989 -15.369 0.422 -1.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 -17.531 0.854 -1.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 -16.396 0.556 0.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 -16.907 2.144 -0.110 1.00 0.00 H new ATOM 1173 N LEU A 990 -9.618 1.810 0.552 1.00 0.00 N ATOM 1174 CA LEU A 990 -9.171 2.619 1.673 1.00 0.00 C ATOM 1175 C LEU A 990 -8.123 3.622 1.187 1.00 0.00 C ATOM 1176 O LEU A 990 -8.258 4.824 1.409 1.00 0.00 O ATOM 1177 CB LEU A 990 -8.685 1.728 2.818 1.00 0.00 C ATOM 1178 CG LEU A 990 -9.118 2.147 4.224 1.00 0.00 C ATOM 1179 CD1 LEU A 990 -8.713 1.096 5.259 1.00 0.00 C ATOM 1180 CD2 LEU A 990 -8.576 3.534 4.574 1.00 0.00 C ATOM 0 H LEU A 990 -9.368 0.823 0.612 1.00 0.00 H new ATOM 0 HA LEU A 990 -10.001 3.196 2.080 1.00 0.00 H new ATOM 0 HB2 LEU A 990 -9.039 0.713 2.638 1.00 0.00 H new ATOM 0 HB3 LEU A 990 -7.596 1.695 2.789 1.00 0.00 H new ATOM 0 HG LEU A 990 -10.206 2.212 4.241 1.00 0.00 H new ATOM 0 HD11 LEU A 990 -9.033 1.419 6.250 1.00 0.00 H new ATOM 0 HD12 LEU A 990 -9.187 0.145 5.017 1.00 0.00 H new ATOM 0 HD13 LEU A 990 -7.630 0.974 5.249 1.00 0.00 H new ATOM 0 HD21 LEU A 990 -8.898 3.808 5.579 1.00 0.00 H new ATOM 0 HD22 LEU A 990 -7.487 3.520 4.534 1.00 0.00 H new ATOM 0 HD23 LEU A 990 -8.956 4.264 3.859 1.00 0.00 H new ATOM 1192 N LEU A 991 -7.101 3.090 0.532 1.00 0.00 N ATOM 1193 CA LEU A 991 -6.030 3.924 0.012 1.00 0.00 C ATOM 1194 C LEU A 991 -6.619 4.971 -0.935 1.00 0.00 C ATOM 1195 O LEU A 991 -6.339 6.162 -0.800 1.00 0.00 O ATOM 1196 CB LEU A 991 -4.941 3.060 -0.627 1.00 0.00 C ATOM 1197 CG LEU A 991 -3.782 3.816 -1.281 1.00 0.00 C ATOM 1198 CD1 LEU A 991 -3.298 4.957 -0.385 1.00 0.00 C ATOM 1199 CD2 LEU A 991 -2.648 2.861 -1.657 1.00 0.00 C ATOM 0 H LEU A 991 -6.992 2.092 0.350 1.00 0.00 H new ATOM 0 HA LEU A 991 -5.541 4.465 0.822 1.00 0.00 H new ATOM 0 HB2 LEU A 991 -4.532 2.400 0.139 1.00 0.00 H new ATOM 0 HB3 LEU A 991 -5.405 2.424 -1.381 1.00 0.00 H new ATOM 0 HG LEU A 991 -4.144 4.265 -2.206 1.00 0.00 H new ATOM 0 HD11 LEU A 991 -2.474 5.478 -0.873 1.00 0.00 H new ATOM 0 HD12 LEU A 991 -4.117 5.655 -0.211 1.00 0.00 H new ATOM 0 HD13 LEU A 991 -2.958 4.552 0.568 1.00 0.00 H new ATOM 0 HD21 LEU A 991 -1.837 3.423 -2.120 1.00 0.00 H new ATOM 0 HD22 LEU A 991 -2.279 2.364 -0.760 1.00 0.00 H new ATOM 0 HD23 LEU A 991 -3.019 2.115 -2.359 1.00 0.00 H new ATOM 1211 N ASN A 992 -7.423 4.491 -1.871 1.00 0.00 N ATOM 1212 CA ASN A 992 -8.054 5.371 -2.840 1.00 0.00 C ATOM 1213 C ASN A 992 -8.708 6.544 -2.107 1.00 0.00 C ATOM 1214 O ASN A 992 -8.366 7.701 -2.349 1.00 0.00 O ATOM 1215 CB ASN A 992 -9.143 4.637 -3.624 1.00 0.00 C ATOM 1216 CG ASN A 992 -8.946 4.813 -5.131 1.00 0.00 C ATOM 1217 OD1 ASN A 992 -8.147 4.140 -5.762 1.00 0.00 O ATOM 1218 ND2 ASN A 992 -9.718 5.751 -5.672 1.00 0.00 N ATOM 0 H ASN A 992 -7.653 3.503 -1.980 1.00 0.00 H new ATOM 0 HA ASN A 992 -7.285 5.719 -3.530 1.00 0.00 H new ATOM 0 HB2 ASN A 992 -9.125 3.577 -3.373 1.00 0.00 H new ATOM 0 HB3 ASN A 992 -10.123 5.017 -3.335 1.00 0.00 H new ATOM 0 HD21 ASN A 992 -9.662 5.943 -6.672 1.00 0.00 H new ATOM 0 HD22 ASN A 992 -10.366 6.278 -5.087 1.00 0.00 H new ATOM 1225 N SER A 993 -9.637 6.205 -1.225 1.00 0.00 N ATOM 1226 CA SER A 993 -10.342 7.216 -0.456 1.00 0.00 C ATOM 1227 C SER A 993 -9.378 8.333 -0.051 1.00 0.00 C ATOM 1228 O SER A 993 -9.485 9.457 -0.539 1.00 0.00 O ATOM 1229 CB SER A 993 -10.998 6.605 0.785 1.00 0.00 C ATOM 1230 OG SER A 993 -11.667 7.586 1.572 1.00 0.00 O ATOM 0 H SER A 993 -9.918 5.245 -1.026 1.00 0.00 H new ATOM 0 HA SER A 993 -11.130 7.635 -1.082 1.00 0.00 H new ATOM 0 HB2 SER A 993 -11.710 5.839 0.479 1.00 0.00 H new ATOM 0 HB3 SER A 993 -10.238 6.111 1.391 1.00 0.00 H new ATOM 0 HG SER A 993 -12.074 7.157 2.353 1.00 0.00 H new ATOM 1236 N ASP A 994 -8.459 7.984 0.837 1.00 0.00 N ATOM 1237 CA ASP A 994 -7.476 8.943 1.313 1.00 0.00 C ATOM 1238 C ASP A 994 -6.763 9.573 0.115 1.00 0.00 C ATOM 1239 O ASP A 994 -6.503 10.775 0.105 1.00 0.00 O ATOM 1240 CB ASP A 994 -6.421 8.263 2.187 1.00 0.00 C ATOM 1241 CG ASP A 994 -5.563 9.214 3.024 1.00 0.00 C ATOM 1242 OD1 ASP A 994 -5.052 10.188 2.431 1.00 0.00 O ATOM 1243 OD2 ASP A 994 -5.438 8.946 4.239 1.00 0.00 O ATOM 0 H ASP A 994 -8.374 7.051 1.240 1.00 0.00 H new ATOM 0 HA ASP A 994 -7.999 9.698 1.901 1.00 0.00 H new ATOM 0 HB2 ASP A 994 -6.922 7.565 2.857 1.00 0.00 H new ATOM 0 HB3 ASP A 994 -5.764 7.675 1.546 1.00 0.00 H new ATOM 1248 N LEU A 995 -6.467 8.733 -0.865 1.00 0.00 N ATOM 1249 CA LEU A 995 -5.789 9.193 -2.066 1.00 0.00 C ATOM 1250 C LEU A 995 -6.514 10.423 -2.616 1.00 0.00 C ATOM 1251 O LEU A 995 -5.907 11.478 -2.792 1.00 0.00 O ATOM 1252 CB LEU A 995 -5.657 8.052 -3.077 1.00 0.00 C ATOM 1253 CG LEU A 995 -6.058 8.383 -4.516 1.00 0.00 C ATOM 1254 CD1 LEU A 995 -5.335 9.636 -5.013 1.00 0.00 C ATOM 1255 CD2 LEU A 995 -5.828 7.184 -5.438 1.00 0.00 C ATOM 0 H LEU A 995 -6.684 7.736 -0.853 1.00 0.00 H new ATOM 0 HA LEU A 995 -4.769 9.501 -1.834 1.00 0.00 H new ATOM 0 HB2 LEU A 995 -4.621 7.712 -3.078 1.00 0.00 H new ATOM 0 HB3 LEU A 995 -6.267 7.216 -2.734 1.00 0.00 H new ATOM 0 HG LEU A 995 -7.126 8.601 -4.532 1.00 0.00 H new ATOM 0 HD11 LEU A 995 -5.638 9.849 -6.038 1.00 0.00 H new ATOM 0 HD12 LEU A 995 -5.593 10.482 -4.376 1.00 0.00 H new ATOM 0 HD13 LEU A 995 -4.258 9.472 -4.980 1.00 0.00 H new ATOM 0 HD21 LEU A 995 -6.121 7.445 -6.455 1.00 0.00 H new ATOM 0 HD22 LEU A 995 -4.773 6.911 -5.423 1.00 0.00 H new ATOM 0 HD23 LEU A 995 -6.426 6.340 -5.094 1.00 0.00 H new ATOM 1267 N ALA A 996 -7.801 10.245 -2.873 1.00 0.00 N ATOM 1268 CA ALA A 996 -8.615 11.327 -3.400 1.00 0.00 C ATOM 1269 C ALA A 996 -8.501 12.542 -2.477 1.00 0.00 C ATOM 1270 O ALA A 996 -8.408 13.676 -2.945 1.00 0.00 O ATOM 1271 CB ALA A 996 -10.060 10.849 -3.559 1.00 0.00 C ATOM 0 H ALA A 996 -8.300 9.368 -2.726 1.00 0.00 H new ATOM 0 HA ALA A 996 -8.261 11.628 -4.386 1.00 0.00 H new ATOM 0 HB1 ALA A 996 -10.670 11.661 -3.954 1.00 0.00 H new ATOM 0 HB2 ALA A 996 -10.090 10.004 -4.247 1.00 0.00 H new ATOM 0 HB3 ALA A 996 -10.450 10.541 -2.589 1.00 0.00 H new ATOM 1277 N GLU A 997 -8.513 12.263 -1.181 1.00 0.00 N ATOM 1278 CA GLU A 997 -8.412 13.319 -0.188 1.00 0.00 C ATOM 1279 C GLU A 997 -7.073 14.047 -0.321 1.00 0.00 C ATOM 1280 O GLU A 997 -7.013 15.270 -0.202 1.00 0.00 O ATOM 1281 CB GLU A 997 -8.595 12.762 1.225 1.00 0.00 C ATOM 1282 CG GLU A 997 -9.471 13.688 2.071 1.00 0.00 C ATOM 1283 CD GLU A 997 -10.949 13.521 1.715 1.00 0.00 C ATOM 1284 OE1 GLU A 997 -11.468 12.409 1.954 1.00 0.00 O ATOM 1285 OE2 GLU A 997 -11.527 14.509 1.211 1.00 0.00 O ATOM 0 H GLU A 997 -8.591 11.322 -0.796 1.00 0.00 H new ATOM 0 HA GLU A 997 -9.213 14.037 -0.367 1.00 0.00 H new ATOM 0 HB2 GLU A 997 -9.050 11.773 1.174 1.00 0.00 H new ATOM 0 HB3 GLU A 997 -7.622 12.641 1.701 1.00 0.00 H new ATOM 0 HG2 GLU A 997 -9.321 13.470 3.128 1.00 0.00 H new ATOM 0 HG3 GLU A 997 -9.170 14.724 1.913 1.00 0.00 H new ATOM 1292 N LEU A 998 -6.033 13.265 -0.567 1.00 0.00 N ATOM 1293 CA LEU A 998 -4.698 13.821 -0.718 1.00 0.00 C ATOM 1294 C LEU A 998 -4.632 14.633 -2.013 1.00 0.00 C ATOM 1295 O LEU A 998 -3.961 15.662 -2.071 1.00 0.00 O ATOM 1296 CB LEU A 998 -3.645 12.714 -0.632 1.00 0.00 C ATOM 1297 CG LEU A 998 -2.210 13.128 -0.964 1.00 0.00 C ATOM 1298 CD1 LEU A 998 -1.220 12.522 0.033 1.00 0.00 C ATOM 1299 CD2 LEU A 998 -1.857 12.772 -2.410 1.00 0.00 C ATOM 0 H LEU A 998 -6.087 12.251 -0.666 1.00 0.00 H new ATOM 0 HA LEU A 998 -4.475 14.506 0.100 1.00 0.00 H new ATOM 0 HB2 LEU A 998 -3.660 12.303 0.378 1.00 0.00 H new ATOM 0 HB3 LEU A 998 -3.936 11.910 -1.308 1.00 0.00 H new ATOM 0 HG LEU A 998 -2.137 14.212 -0.872 1.00 0.00 H new ATOM 0 HD11 LEU A 998 -0.207 12.832 -0.226 1.00 0.00 H new ATOM 0 HD12 LEU A 998 -1.459 12.867 1.039 1.00 0.00 H new ATOM 0 HD13 LEU A 998 -1.287 11.435 -0.003 1.00 0.00 H new ATOM 0 HD21 LEU A 998 -0.832 13.077 -2.620 1.00 0.00 H new ATOM 0 HD22 LEU A 998 -1.952 11.696 -2.553 1.00 0.00 H new ATOM 0 HD23 LEU A 998 -2.536 13.290 -3.088 1.00 0.00 H new ATOM 1311 N ILE A 999 -5.338 14.140 -3.020 1.00 0.00 N ATOM 1312 CA ILE A 999 -5.368 14.807 -4.311 1.00 0.00 C ATOM 1313 C ILE A 999 -6.058 16.165 -4.162 1.00 0.00 C ATOM 1314 O ILE A 999 -5.596 17.163 -4.711 1.00 0.00 O ATOM 1315 CB ILE A 999 -6.008 13.904 -5.366 1.00 0.00 C ATOM 1316 CG1 ILE A 999 -5.134 12.679 -5.643 1.00 0.00 C ATOM 1317 CG2 ILE A 999 -6.318 14.687 -6.643 1.00 0.00 C ATOM 1318 CD1 ILE A 999 -3.789 13.090 -6.244 1.00 0.00 C ATOM 0 H ILE A 999 -5.894 13.286 -2.968 1.00 0.00 H new ATOM 0 HA ILE A 999 -4.355 15.001 -4.664 1.00 0.00 H new ATOM 0 HB ILE A 999 -6.957 13.540 -4.973 1.00 0.00 H new ATOM 0 HG12 ILE A 999 -4.969 12.128 -4.717 1.00 0.00 H new ATOM 0 HG13 ILE A 999 -5.651 12.006 -6.327 1.00 0.00 H new ATOM 0 HG21 ILE A 999 -6.772 14.021 -7.377 1.00 0.00 H new ATOM 0 HG22 ILE A 999 -7.008 15.499 -6.413 1.00 0.00 H new ATOM 0 HG23 ILE A 999 -5.395 15.099 -7.050 1.00 0.00 H new ATOM 0 HD11 ILE A 999 -3.187 12.201 -6.431 1.00 0.00 H new ATOM 0 HD12 ILE A 999 -3.956 13.619 -7.182 1.00 0.00 H new ATOM 0 HD13 ILE A 999 -3.264 13.744 -5.547 1.00 0.00 H new ATOM 1330 N ASN A1000 -7.154 16.157 -3.416 1.00 0.00 N ATOM 1331 CA ASN A1000 -7.912 17.375 -3.189 1.00 0.00 C ATOM 1332 C ASN A1000 -7.087 18.331 -2.324 1.00 0.00 C ATOM 1333 O ASN A1000 -6.986 19.518 -2.628 1.00 0.00 O ATOM 1334 CB ASN A1000 -9.220 17.080 -2.451 1.00 0.00 C ATOM 1335 CG ASN A1000 -10.277 18.141 -2.764 1.00 0.00 C ATOM 1336 OD1 ASN A1000 -10.220 18.836 -3.765 1.00 0.00 O ATOM 1337 ND2 ASN A1000 -11.243 18.226 -1.854 1.00 0.00 N ATOM 0 H ASN A1000 -7.534 15.327 -2.962 1.00 0.00 H new ATOM 0 HA ASN A1000 -8.137 17.818 -4.159 1.00 0.00 H new ATOM 0 HB2 ASN A1000 -9.590 16.096 -2.739 1.00 0.00 H new ATOM 0 HB3 ASN A1000 -9.037 17.050 -1.377 1.00 0.00 H new ATOM 0 HD21 ASN A1000 -11.996 18.904 -1.972 1.00 0.00 H new ATOM 0 HD22 ASN A1000 -11.231 17.614 -1.038 1.00 0.00 H new ATOM 1344 N LYS A1001 -6.518 17.776 -1.264 1.00 0.00 N ATOM 1345 CA LYS A1001 -5.705 18.565 -0.353 1.00 0.00 C ATOM 1346 C LYS A1001 -4.719 19.412 -1.160 1.00 0.00 C ATOM 1347 O LYS A1001 -4.410 20.540 -0.781 1.00 0.00 O ATOM 1348 CB LYS A1001 -5.035 17.662 0.684 1.00 0.00 C ATOM 1349 CG LYS A1001 -5.564 17.955 2.090 1.00 0.00 C ATOM 1350 CD LYS A1001 -6.822 17.136 2.384 1.00 0.00 C ATOM 1351 CE LYS A1001 -7.918 18.014 2.991 1.00 0.00 C ATOM 1352 NZ LYS A1001 -8.011 17.790 4.451 1.00 0.00 N ATOM 0 H LYS A1001 -6.604 16.790 -1.015 1.00 0.00 H new ATOM 0 HA LYS A1001 -6.329 19.256 0.215 1.00 0.00 H new ATOM 0 HB2 LYS A1001 -5.217 16.617 0.433 1.00 0.00 H new ATOM 0 HB3 LYS A1001 -3.956 17.812 0.659 1.00 0.00 H new ATOM 0 HG2 LYS A1001 -4.795 17.724 2.827 1.00 0.00 H new ATOM 0 HG3 LYS A1001 -5.787 19.018 2.184 1.00 0.00 H new ATOM 0 HD2 LYS A1001 -7.186 16.678 1.464 1.00 0.00 H new ATOM 0 HD3 LYS A1001 -6.580 16.324 3.070 1.00 0.00 H new ATOM 0 HE2 LYS A1001 -7.704 19.064 2.791 1.00 0.00 H new ATOM 0 HE3 LYS A1001 -8.875 17.789 2.521 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 -8.940 18.110 4.793 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 -7.897 16.777 4.655 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 -7.261 18.326 4.933 1.00 0.00 H new ATOM 1366 N MET A1002 -4.252 18.834 -2.258 1.00 0.00 N ATOM 1367 CA MET A1002 -3.307 19.522 -3.121 1.00 0.00 C ATOM 1368 C MET A1002 -4.028 20.494 -4.058 1.00 0.00 C ATOM 1369 O MET A1002 -3.443 21.479 -4.506 1.00 0.00 O ATOM 1370 CB MET A1002 -2.531 18.496 -3.948 1.00 0.00 C ATOM 1371 CG MET A1002 -3.037 18.459 -5.392 1.00 0.00 C ATOM 1372 SD MET A1002 -2.260 19.752 -6.345 1.00 0.00 S ATOM 1373 CE MET A1002 -3.361 19.807 -7.749 1.00 0.00 C ATOM 0 H MET A1002 -4.511 17.898 -2.569 1.00 0.00 H new ATOM 0 HA MET A1002 -2.620 20.092 -2.496 1.00 0.00 H new ATOM 0 HB2 MET A1002 -1.469 18.743 -3.937 1.00 0.00 H new ATOM 0 HB3 MET A1002 -2.633 17.509 -3.498 1.00 0.00 H new ATOM 0 HG2 MET A1002 -2.820 17.488 -5.837 1.00 0.00 H new ATOM 0 HG3 MET A1002 -4.120 18.583 -5.410 1.00 0.00 H new ATOM 0 HE1 MET A1002 -2.799 19.604 -8.660 1.00 0.00 H new ATOM 0 HE2 MET A1002 -4.142 19.056 -7.629 1.00 0.00 H new ATOM 0 HE3 MET A1002 -3.816 20.795 -7.816 1.00 0.00 H new ATOM 1383 N LYS A1003 -5.287 20.182 -4.327 1.00 0.00 N ATOM 1384 CA LYS A1003 -6.094 21.016 -5.202 1.00 0.00 C ATOM 1385 C LYS A1003 -6.280 22.392 -4.561 1.00 0.00 C ATOM 1386 O LYS A1003 -6.052 23.416 -5.203 1.00 0.00 O ATOM 1387 CB LYS A1003 -7.409 20.315 -5.546 1.00 0.00 C ATOM 1388 CG LYS A1003 -7.187 19.205 -6.576 1.00 0.00 C ATOM 1389 CD LYS A1003 -8.419 19.026 -7.465 1.00 0.00 C ATOM 1390 CE LYS A1003 -9.207 17.777 -7.065 1.00 0.00 C ATOM 1391 NZ LYS A1003 -9.718 17.080 -8.266 1.00 0.00 N ATOM 0 H LYS A1003 -5.768 19.363 -3.955 1.00 0.00 H new ATOM 0 HA LYS A1003 -5.585 21.174 -6.153 1.00 0.00 H new ATOM 0 HB2 LYS A1003 -7.848 19.894 -4.642 1.00 0.00 H new ATOM 0 HB3 LYS A1003 -8.121 21.042 -5.937 1.00 0.00 H new ATOM 0 HG2 LYS A1003 -6.321 19.445 -7.193 1.00 0.00 H new ATOM 0 HG3 LYS A1003 -6.964 18.269 -6.064 1.00 0.00 H new ATOM 0 HD2 LYS A1003 -9.059 19.905 -7.387 1.00 0.00 H new ATOM 0 HD3 LYS A1003 -8.111 18.948 -8.508 1.00 0.00 H new ATOM 0 HE2 LYS A1003 -8.568 17.105 -6.492 1.00 0.00 H new ATOM 0 HE3 LYS A1003 -10.039 18.056 -6.418 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 -10.250 16.235 -7.977 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 -10.344 17.718 -8.798 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 -8.919 16.797 -8.869 1.00 0.00 H new ATOM 1405 N LEU A1004 -6.692 22.372 -3.302 1.00 0.00 N ATOM 1406 CA LEU A1004 -6.911 23.605 -2.566 1.00 0.00 C ATOM 1407 C LEU A1004 -5.574 24.323 -2.372 1.00 0.00 C ATOM 1408 O LEU A1004 -5.424 25.481 -2.760 1.00 0.00 O ATOM 1409 CB LEU A1004 -7.654 23.325 -1.258 1.00 0.00 C ATOM 1410 CG LEU A1004 -7.345 21.985 -0.586 1.00 0.00 C ATOM 1411 CD1 LEU A1004 -7.229 22.147 0.931 1.00 0.00 C ATOM 1412 CD2 LEU A1004 -8.380 20.927 -0.971 1.00 0.00 C ATOM 0 H LEU A1004 -6.880 21.521 -2.773 1.00 0.00 H new ATOM 0 HA LEU A1004 -7.555 24.277 -3.133 1.00 0.00 H new ATOM 0 HB2 LEU A1004 -7.423 24.124 -0.554 1.00 0.00 H new ATOM 0 HB3 LEU A1004 -8.725 23.372 -1.454 1.00 0.00 H new ATOM 0 HG LEU A1004 -6.378 21.636 -0.948 1.00 0.00 H new ATOM 0 HD11 LEU A1004 -7.009 21.180 1.384 1.00 0.00 H new ATOM 0 HD12 LEU A1004 -6.426 22.847 1.162 1.00 0.00 H new ATOM 0 HD13 LEU A1004 -8.169 22.529 1.329 1.00 0.00 H new ATOM 0 HD21 LEU A1004 -8.137 19.985 -0.480 1.00 0.00 H new ATOM 0 HD22 LEU A1004 -9.370 21.255 -0.656 1.00 0.00 H new ATOM 0 HD23 LEU A1004 -8.371 20.786 -2.052 1.00 0.00 H new ATOM 1424 N ALA A1005 -4.636 23.606 -1.772 1.00 0.00 N ATOM 1425 CA ALA A1005 -3.316 24.159 -1.521 1.00 0.00 C ATOM 1426 C ALA A1005 -2.856 24.946 -2.750 1.00 0.00 C ATOM 1427 O ALA A1005 -2.356 26.063 -2.626 1.00 0.00 O ATOM 1428 CB ALA A1005 -2.349 23.031 -1.157 1.00 0.00 C ATOM 0 H ALA A1005 -4.764 22.646 -1.452 1.00 0.00 H new ATOM 0 HA ALA A1005 -3.344 24.849 -0.678 1.00 0.00 H new ATOM 0 HB1 ALA A1005 -1.359 23.447 -0.969 1.00 0.00 H new ATOM 0 HB2 ALA A1005 -2.705 22.522 -0.261 1.00 0.00 H new ATOM 0 HB3 ALA A1005 -2.293 22.320 -1.981 1.00 0.00 H new ATOM 1434 N GLN A1006 -3.041 24.332 -3.910 1.00 0.00 N ATOM 1435 CA GLN A1006 -2.652 24.961 -5.160 1.00 0.00 C ATOM 1436 C GLN A1006 -3.009 26.449 -5.140 1.00 0.00 C ATOM 1437 O GLN A1006 -2.210 27.288 -5.554 1.00 0.00 O ATOM 1438 CB GLN A1006 -3.302 24.258 -6.354 1.00 0.00 C ATOM 1439 CG GLN A1006 -2.246 23.588 -7.237 1.00 0.00 C ATOM 1440 CD GLN A1006 -1.364 24.632 -7.924 1.00 0.00 C ATOM 1441 OE1 GLN A1006 -0.260 24.928 -7.497 1.00 0.00 O ATOM 1442 NE2 GLN A1006 -1.911 25.171 -9.010 1.00 0.00 N ATOM 0 H GLN A1006 -3.455 23.405 -4.010 1.00 0.00 H new ATOM 0 HA GLN A1006 -1.572 24.868 -5.269 1.00 0.00 H new ATOM 0 HB2 GLN A1006 -4.011 23.511 -5.999 1.00 0.00 H new ATOM 0 HB3 GLN A1006 -3.868 24.980 -6.942 1.00 0.00 H new ATOM 0 HG2 GLN A1006 -1.627 22.926 -6.631 1.00 0.00 H new ATOM 0 HG3 GLN A1006 -2.735 22.968 -7.989 1.00 0.00 H new ATOM 0 HE21 GLN A1006 -2.840 24.877 -9.312 1.00 0.00 H new ATOM 0 HE22 GLN A1006 -1.402 25.878 -9.540 1.00 0.00 H new ATOM 1451 N GLN A1007 -4.208 26.730 -4.654 1.00 0.00 N ATOM 1452 CA GLN A1007 -4.681 28.102 -4.574 1.00 0.00 C ATOM 1453 C GLN A1007 -4.453 28.661 -3.168 1.00 0.00 C ATOM 1454 O GLN A1007 -4.263 29.864 -2.998 1.00 0.00 O ATOM 1455 CB GLN A1007 -6.155 28.198 -4.970 1.00 0.00 C ATOM 1456 CG GLN A1007 -6.451 29.529 -5.664 1.00 0.00 C ATOM 1457 CD GLN A1007 -7.958 29.735 -5.836 1.00 0.00 C ATOM 1458 OE1 GLN A1007 -8.519 29.542 -6.902 1.00 0.00 O ATOM 1459 NE2 GLN A1007 -8.578 30.137 -4.730 1.00 0.00 N ATOM 0 H GLN A1007 -4.867 26.031 -4.311 1.00 0.00 H new ATOM 0 HA GLN A1007 -4.110 28.704 -5.280 1.00 0.00 H new ATOM 0 HB2 GLN A1007 -6.411 27.373 -5.634 1.00 0.00 H new ATOM 0 HB3 GLN A1007 -6.781 28.099 -4.083 1.00 0.00 H new ATOM 0 HG2 GLN A1007 -6.033 30.349 -5.080 1.00 0.00 H new ATOM 0 HG3 GLN A1007 -5.964 29.551 -6.639 1.00 0.00 H new ATOM 0 HE21 GLN A1007 -8.047 30.279 -3.871 1.00 0.00 H new ATOM 0 HE22 GLN A1007 -9.584 30.303 -4.741 1.00 0.00 H new ATOM 1468 N TYR A1008 -4.480 27.760 -2.196 1.00 0.00 N ATOM 1469 CA TYR A1008 -4.279 28.148 -0.811 1.00 0.00 C ATOM 1470 C TYR A1008 -2.796 28.102 -0.438 1.00 0.00 C ATOM 1471 O TYR A1008 -2.451 27.921 0.728 1.00 0.00 O ATOM 1472 CB TYR A1008 -5.036 27.118 0.030 1.00 0.00 C ATOM 1473 CG TYR A1008 -6.537 27.392 0.147 1.00 0.00 C ATOM 1474 CD1 TYR A1008 -6.996 28.351 1.027 1.00 0.00 C ATOM 1475 CD2 TYR A1008 -7.431 26.680 -0.626 1.00 0.00 C ATOM 1476 CE1 TYR A1008 -8.409 28.609 1.137 1.00 0.00 C ATOM 1477 CE2 TYR A1008 -8.843 26.938 -0.516 1.00 0.00 C ATOM 1478 CZ TYR A1008 -9.262 27.890 0.361 1.00 0.00 C ATOM 1479 OH TYR A1008 -10.596 28.134 0.465 1.00 0.00 O ATOM 0 H TYR A1008 -4.638 26.763 -2.341 1.00 0.00 H new ATOM 0 HA TYR A1008 -4.632 29.166 -0.643 1.00 0.00 H new ATOM 0 HB2 TYR A1008 -4.890 26.130 -0.407 1.00 0.00 H new ATOM 0 HB3 TYR A1008 -4.603 27.092 1.030 1.00 0.00 H new ATOM 0 HD1 TYR A1008 -6.296 28.908 1.633 1.00 0.00 H new ATOM 0 HD2 TYR A1008 -7.071 25.929 -1.314 1.00 0.00 H new ATOM 0 HE1 TYR A1008 -8.782 29.357 1.821 1.00 0.00 H new ATOM 0 HE2 TYR A1008 -9.553 26.388 -1.116 1.00 0.00 H new ATOM 0 HH TYR A1008 -11.085 27.547 -0.149 1.00 0.00 H new ATOM 1489 N VAL A1009 -1.959 28.270 -1.451 1.00 0.00 N ATOM 1490 CA VAL A1009 -0.521 28.250 -1.245 1.00 0.00 C ATOM 1491 C VAL A1009 0.067 29.604 -1.647 1.00 0.00 C ATOM 1492 O VAL A1009 0.808 30.216 -0.879 1.00 0.00 O ATOM 1493 CB VAL A1009 0.101 27.078 -2.007 1.00 0.00 C ATOM 1494 CG1 VAL A1009 -0.116 27.228 -3.514 1.00 0.00 C ATOM 1495 CG2 VAL A1009 1.589 26.938 -1.679 1.00 0.00 C ATOM 0 H VAL A1009 -2.249 28.421 -2.417 1.00 0.00 H new ATOM 0 HA VAL A1009 -0.289 28.095 -0.191 1.00 0.00 H new ATOM 0 HB VAL A1009 -0.400 26.165 -1.685 1.00 0.00 H new ATOM 0 HG11 VAL A1009 0.336 26.382 -4.033 1.00 0.00 H new ATOM 0 HG12 VAL A1009 -1.185 27.256 -3.727 1.00 0.00 H new ATOM 0 HG13 VAL A1009 0.346 28.153 -3.858 1.00 0.00 H new ATOM 0 HG21 VAL A1009 2.006 26.098 -2.234 1.00 0.00 H new ATOM 0 HG22 VAL A1009 2.111 27.853 -1.959 1.00 0.00 H new ATOM 0 HG23 VAL A1009 1.711 26.763 -0.610 1.00 0.00 H new ATOM 1505 N MET A1010 -0.285 30.032 -2.850 1.00 0.00 N ATOM 1506 CA MET A1010 0.198 31.303 -3.363 1.00 0.00 C ATOM 1507 C MET A1010 -0.508 32.475 -2.679 1.00 0.00 C ATOM 1508 O MET A1010 -1.051 33.353 -3.348 1.00 0.00 O ATOM 1509 CB MET A1010 -0.046 31.370 -4.872 1.00 0.00 C ATOM 1510 CG MET A1010 -1.519 31.117 -5.201 1.00 0.00 C ATOM 1511 SD MET A1010 -2.291 32.631 -5.748 1.00 0.00 S ATOM 1512 CE MET A1010 -3.492 32.854 -4.446 1.00 0.00 C ATOM 0 H MET A1010 -0.899 29.521 -3.485 1.00 0.00 H new ATOM 0 HA MET A1010 1.265 31.375 -3.155 1.00 0.00 H new ATOM 0 HB2 MET A1010 0.252 32.348 -5.249 1.00 0.00 H new ATOM 0 HB3 MET A1010 0.575 30.631 -5.378 1.00 0.00 H new ATOM 0 HG2 MET A1010 -1.601 30.356 -5.977 1.00 0.00 H new ATOM 0 HG3 MET A1010 -2.036 30.733 -4.322 1.00 0.00 H new ATOM 0 HE1 MET A1010 -4.494 32.877 -4.875 1.00 0.00 H new ATOM 0 HE2 MET A1010 -3.419 32.028 -3.738 1.00 0.00 H new ATOM 0 HE3 MET A1010 -3.297 33.793 -3.928 1.00 0.00 H new ATOM 1522 N THR A1011 -0.479 32.450 -1.355 1.00 0.00 N ATOM 1523 CA THR A1011 -1.109 33.500 -0.573 1.00 0.00 C ATOM 1524 C THR A1011 -0.300 33.779 0.696 1.00 0.00 C ATOM 1525 O THR A1011 0.334 34.826 0.813 1.00 0.00 O ATOM 1526 CB THR A1011 -2.553 33.078 -0.292 1.00 0.00 C ATOM 1527 OG1 THR A1011 -2.498 31.655 -0.257 1.00 0.00 O ATOM 1528 CG2 THR A1011 -3.491 33.386 -1.461 1.00 0.00 C ATOM 0 H THR A1011 -0.029 31.719 -0.804 1.00 0.00 H new ATOM 0 HA THR A1011 -1.131 34.442 -1.121 1.00 0.00 H new ATOM 0 HB THR A1011 -2.911 33.585 0.604 1.00 0.00 H new ATOM 0 HG1 THR A1011 -3.396 31.289 -0.399 1.00 0.00 H new ATOM 0 HG21 THR A1011 -4.502 33.067 -1.210 1.00 0.00 H new ATOM 0 HG22 THR A1011 -3.487 34.458 -1.658 1.00 0.00 H new ATOM 0 HG23 THR A1011 -3.153 32.853 -2.349 1.00 0.00 H new ATOM 1536 N SER A1012 -0.350 32.824 1.613 1.00 0.00 N ATOM 1537 CA SER A1012 0.370 32.954 2.868 1.00 0.00 C ATOM 1538 C SER A1012 0.033 31.780 3.789 1.00 0.00 C ATOM 1539 O SER A1012 0.878 31.330 4.562 1.00 0.00 O ATOM 1540 CB SER A1012 0.042 34.280 3.557 1.00 0.00 C ATOM 1541 OG SER A1012 1.212 35.051 3.817 1.00 0.00 O ATOM 0 H SER A1012 -0.878 31.957 1.512 1.00 0.00 H new ATOM 0 HA SER A1012 1.438 32.943 2.652 1.00 0.00 H new ATOM 0 HB2 SER A1012 -0.639 34.855 2.930 1.00 0.00 H new ATOM 0 HB3 SER A1012 -0.478 34.082 4.495 1.00 0.00 H new ATOM 0 HG SER A1012 0.960 35.890 4.256 1.00 0.00 H new ATOM 1547 N LEU A1013 -1.203 31.317 3.676 1.00 0.00 N ATOM 1548 CA LEU A1013 -1.662 30.203 4.489 1.00 0.00 C ATOM 1549 C LEU A1013 -1.185 28.891 3.865 1.00 0.00 C ATOM 1550 O LEU A1013 -1.977 27.973 3.657 1.00 0.00 O ATOM 1551 CB LEU A1013 -3.178 30.274 4.687 1.00 0.00 C ATOM 1552 CG LEU A1013 -4.002 30.610 3.443 1.00 0.00 C ATOM 1553 CD1 LEU A1013 -3.527 29.800 2.235 1.00 0.00 C ATOM 1554 CD2 LEU A1013 -5.497 30.421 3.708 1.00 0.00 C ATOM 0 H LEU A1013 -1.901 31.693 3.034 1.00 0.00 H new ATOM 0 HA LEU A1013 -1.230 30.257 5.488 1.00 0.00 H new ATOM 0 HB2 LEU A1013 -3.519 29.315 5.076 1.00 0.00 H new ATOM 0 HB3 LEU A1013 -3.390 31.021 5.452 1.00 0.00 H new ATOM 0 HG LEU A1013 -3.848 31.663 3.205 1.00 0.00 H new ATOM 0 HD11 LEU A1013 -4.130 30.058 1.364 1.00 0.00 H new ATOM 0 HD12 LEU A1013 -2.481 30.028 2.033 1.00 0.00 H new ATOM 0 HD13 LEU A1013 -3.632 28.736 2.446 1.00 0.00 H new ATOM 0 HD21 LEU A1013 -6.060 30.667 2.808 1.00 0.00 H new ATOM 0 HD22 LEU A1013 -5.689 29.384 3.985 1.00 0.00 H new ATOM 0 HD23 LEU A1013 -5.808 31.077 4.521 1.00 0.00 H new ATOM 1566 N GLN A1014 0.109 28.843 3.583 1.00 0.00 N ATOM 1567 CA GLN A1014 0.702 27.657 2.987 1.00 0.00 C ATOM 1568 C GLN A1014 1.075 26.647 4.074 1.00 0.00 C ATOM 1569 O GLN A1014 0.444 25.598 4.194 1.00 0.00 O ATOM 1570 CB GLN A1014 1.920 28.022 2.136 1.00 0.00 C ATOM 1571 CG GLN A1014 2.636 26.766 1.637 1.00 0.00 C ATOM 1572 CD GLN A1014 4.144 26.862 1.880 1.00 0.00 C ATOM 1573 OE1 GLN A1014 4.700 26.217 2.754 1.00 0.00 O ATOM 1574 NE2 GLN A1014 4.772 27.701 1.060 1.00 0.00 N ATOM 0 H GLN A1014 0.763 29.606 3.756 1.00 0.00 H new ATOM 0 HA GLN A1014 -0.035 27.197 2.329 1.00 0.00 H new ATOM 0 HB2 GLN A1014 1.606 28.628 1.286 1.00 0.00 H new ATOM 0 HB3 GLN A1014 2.609 28.629 2.723 1.00 0.00 H new ATOM 0 HG2 GLN A1014 2.237 25.889 2.146 1.00 0.00 H new ATOM 0 HG3 GLN A1014 2.443 26.632 0.573 1.00 0.00 H new ATOM 0 HE21 GLN A1014 4.246 28.210 0.350 1.00 0.00 H new ATOM 0 HE22 GLN A1014 5.780 27.835 1.142 1.00 0.00 H new ATOM 1583 N GLN A1015 2.100 26.998 4.837 1.00 0.00 N ATOM 1584 CA GLN A1015 2.564 26.135 5.910 1.00 0.00 C ATOM 1585 C GLN A1015 1.379 25.448 6.590 1.00 0.00 C ATOM 1586 O GLN A1015 1.498 24.318 7.061 1.00 0.00 O ATOM 1587 CB GLN A1015 3.398 26.921 6.924 1.00 0.00 C ATOM 1588 CG GLN A1015 2.919 28.372 7.020 1.00 0.00 C ATOM 1589 CD GLN A1015 3.335 28.999 8.352 1.00 0.00 C ATOM 1590 OE1 GLN A1015 4.239 28.537 9.030 1.00 0.00 O ATOM 1591 NE2 GLN A1015 2.628 30.074 8.688 1.00 0.00 N ATOM 0 H GLN A1015 2.622 27.868 4.733 1.00 0.00 H new ATOM 0 HA GLN A1015 3.205 25.366 5.479 1.00 0.00 H new ATOM 0 HB2 GLN A1015 3.330 26.446 7.903 1.00 0.00 H new ATOM 0 HB3 GLN A1015 4.448 26.899 6.632 1.00 0.00 H new ATOM 0 HG2 GLN A1015 3.335 28.951 6.196 1.00 0.00 H new ATOM 0 HG3 GLN A1015 1.834 28.408 6.920 1.00 0.00 H new ATOM 0 HE21 GLN A1015 1.885 30.408 8.074 1.00 0.00 H new ATOM 0 HE22 GLN A1015 2.829 30.565 9.559 1.00 0.00 H new ATOM 1600 N GLU A1016 0.261 26.159 6.619 1.00 0.00 N ATOM 1601 CA GLU A1016 -0.946 25.631 7.234 1.00 0.00 C ATOM 1602 C GLU A1016 -1.547 24.528 6.360 1.00 0.00 C ATOM 1603 O GLU A1016 -1.579 23.365 6.758 1.00 0.00 O ATOM 1604 CB GLU A1016 -1.963 26.745 7.489 1.00 0.00 C ATOM 1605 CG GLU A1016 -3.149 26.227 8.305 1.00 0.00 C ATOM 1606 CD GLU A1016 -2.886 26.367 9.805 1.00 0.00 C ATOM 1607 OE1 GLU A1016 -2.753 27.527 10.252 1.00 0.00 O ATOM 1608 OE2 GLU A1016 -2.822 25.312 10.471 1.00 0.00 O ATOM 0 H GLU A1016 0.165 27.096 6.227 1.00 0.00 H new ATOM 0 HA GLU A1016 -0.681 25.199 8.199 1.00 0.00 H new ATOM 0 HB2 GLU A1016 -1.482 27.567 8.020 1.00 0.00 H new ATOM 0 HB3 GLU A1016 -2.317 27.144 6.538 1.00 0.00 H new ATOM 0 HG2 GLU A1016 -4.049 26.781 8.037 1.00 0.00 H new ATOM 0 HG3 GLU A1016 -3.334 25.181 8.061 1.00 0.00 H new ATOM 1615 N TYR A1017 -2.009 24.933 5.186 1.00 0.00 N ATOM 1616 CA TYR A1017 -2.608 23.994 4.254 1.00 0.00 C ATOM 1617 C TYR A1017 -1.618 22.891 3.874 1.00 0.00 C ATOM 1618 O TYR A1017 -2.020 21.815 3.434 1.00 0.00 O ATOM 1619 CB TYR A1017 -2.954 24.804 3.003 1.00 0.00 C ATOM 1620 CG TYR A1017 -4.391 25.329 2.980 1.00 0.00 C ATOM 1621 CD1 TYR A1017 -4.806 26.247 3.924 1.00 0.00 C ATOM 1622 CD2 TYR A1017 -5.273 24.885 2.016 1.00 0.00 C ATOM 1623 CE1 TYR A1017 -6.158 26.742 3.902 1.00 0.00 C ATOM 1624 CE2 TYR A1017 -6.625 25.379 1.994 1.00 0.00 C ATOM 1625 CZ TYR A1017 -7.001 26.283 2.938 1.00 0.00 C ATOM 1626 OH TYR A1017 -8.278 26.750 2.918 1.00 0.00 O ATOM 0 H TYR A1017 -1.980 25.899 4.859 1.00 0.00 H new ATOM 0 HA TYR A1017 -3.481 23.517 4.699 1.00 0.00 H new ATOM 0 HB2 TYR A1017 -2.268 25.648 2.928 1.00 0.00 H new ATOM 0 HB3 TYR A1017 -2.791 24.182 2.123 1.00 0.00 H new ATOM 0 HD1 TYR A1017 -4.116 26.594 4.679 1.00 0.00 H new ATOM 0 HD2 TYR A1017 -4.949 24.167 1.278 1.00 0.00 H new ATOM 0 HE1 TYR A1017 -6.495 27.461 4.634 1.00 0.00 H new ATOM 0 HE2 TYR A1017 -7.325 25.039 1.245 1.00 0.00 H new ATOM 0 HH TYR A1017 -8.496 27.067 2.017 1.00 0.00 H new ATOM 1636 N LYS A1018 -0.342 23.197 4.059 1.00 0.00 N ATOM 1637 CA LYS A1018 0.709 22.245 3.741 1.00 0.00 C ATOM 1638 C LYS A1018 0.696 21.114 4.772 1.00 0.00 C ATOM 1639 O LYS A1018 0.864 19.947 4.421 1.00 0.00 O ATOM 1640 CB LYS A1018 2.059 22.956 3.626 1.00 0.00 C ATOM 1641 CG LYS A1018 2.899 22.358 2.495 1.00 0.00 C ATOM 1642 CD LYS A1018 2.566 23.019 1.156 1.00 0.00 C ATOM 1643 CE LYS A1018 1.286 22.432 0.558 1.00 0.00 C ATOM 1644 NZ LYS A1018 0.111 23.239 0.955 1.00 0.00 N ATOM 0 H LYS A1018 -0.012 24.090 4.425 1.00 0.00 H new ATOM 0 HA LYS A1018 0.529 21.791 2.766 1.00 0.00 H new ATOM 0 HB2 LYS A1018 1.900 24.019 3.443 1.00 0.00 H new ATOM 0 HB3 LYS A1018 2.600 22.872 4.569 1.00 0.00 H new ATOM 0 HG2 LYS A1018 3.958 22.489 2.716 1.00 0.00 H new ATOM 0 HG3 LYS A1018 2.717 21.285 2.430 1.00 0.00 H new ATOM 0 HD2 LYS A1018 2.447 24.093 1.296 1.00 0.00 H new ATOM 0 HD3 LYS A1018 3.394 22.878 0.461 1.00 0.00 H new ATOM 0 HE2 LYS A1018 1.365 22.404 -0.529 1.00 0.00 H new ATOM 0 HE3 LYS A1018 1.159 21.403 0.895 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 -0.696 22.610 1.139 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 0.334 23.776 1.817 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 -0.132 23.899 0.189 1.00 0.00 H new ATOM 1658 N LYS A1019 0.494 21.500 6.023 1.00 0.00 N ATOM 1659 CA LYS A1019 0.457 20.533 7.107 1.00 0.00 C ATOM 1660 C LYS A1019 -0.730 19.589 6.902 1.00 0.00 C ATOM 1661 O LYS A1019 -0.673 18.422 7.287 1.00 0.00 O ATOM 1662 CB LYS A1019 0.448 21.246 8.461 1.00 0.00 C ATOM 1663 CG LYS A1019 1.786 21.069 9.183 1.00 0.00 C ATOM 1664 CD LYS A1019 2.748 22.209 8.843 1.00 0.00 C ATOM 1665 CE LYS A1019 3.469 21.942 7.520 1.00 0.00 C ATOM 1666 NZ LYS A1019 4.868 21.527 7.767 1.00 0.00 N ATOM 0 H LYS A1019 0.354 22.469 6.310 1.00 0.00 H new ATOM 0 HA LYS A1019 1.358 19.920 7.101 1.00 0.00 H new ATOM 0 HB2 LYS A1019 0.247 22.307 8.316 1.00 0.00 H new ATOM 0 HB3 LYS A1019 -0.358 20.850 9.079 1.00 0.00 H new ATOM 0 HG2 LYS A1019 1.621 21.037 10.260 1.00 0.00 H new ATOM 0 HG3 LYS A1019 2.232 20.115 8.901 1.00 0.00 H new ATOM 0 HD2 LYS A1019 2.197 23.147 8.778 1.00 0.00 H new ATOM 0 HD3 LYS A1019 3.479 22.323 9.643 1.00 0.00 H new ATOM 0 HE2 LYS A1019 2.945 21.164 6.964 1.00 0.00 H new ATOM 0 HE3 LYS A1019 3.453 22.840 6.903 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 5.343 21.350 6.859 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 5.369 22.282 8.278 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 4.877 20.658 8.338 1.00 0.00 H new ATOM 1680 N GLN A1020 -1.777 20.129 6.296 1.00 0.00 N ATOM 1681 CA GLN A1020 -2.975 19.350 6.035 1.00 0.00 C ATOM 1682 C GLN A1020 -2.645 18.152 5.142 1.00 0.00 C ATOM 1683 O GLN A1020 -2.844 17.004 5.538 1.00 0.00 O ATOM 1684 CB GLN A1020 -4.067 20.217 5.407 1.00 0.00 C ATOM 1685 CG GLN A1020 -4.808 21.024 6.475 1.00 0.00 C ATOM 1686 CD GLN A1020 -6.053 20.279 6.961 1.00 0.00 C ATOM 1687 OE1 GLN A1020 -6.183 19.075 6.815 1.00 0.00 O ATOM 1688 NE2 GLN A1020 -6.957 21.059 7.545 1.00 0.00 N ATOM 0 H GLN A1020 -1.820 21.097 5.978 1.00 0.00 H new ATOM 0 HA GLN A1020 -3.356 18.976 6.985 1.00 0.00 H new ATOM 0 HB2 GLN A1020 -3.624 20.894 4.677 1.00 0.00 H new ATOM 0 HB3 GLN A1020 -4.773 19.585 4.868 1.00 0.00 H new ATOM 0 HG2 GLN A1020 -4.143 21.216 7.317 1.00 0.00 H new ATOM 0 HG3 GLN A1020 -5.096 21.994 6.069 1.00 0.00 H new ATOM 0 HE21 GLN A1020 -6.785 22.060 7.635 1.00 0.00 H new ATOM 0 HE22 GLN A1020 -7.823 20.656 7.903 1.00 0.00 H new ATOM 1697 N MET A1021 -2.146 18.460 3.954 1.00 0.00 N ATOM 1698 CA MET A1021 -1.786 17.423 3.002 1.00 0.00 C ATOM 1699 C MET A1021 -0.828 16.409 3.631 1.00 0.00 C ATOM 1700 O MET A1021 -0.750 15.265 3.186 1.00 0.00 O ATOM 1701 CB MET A1021 -1.124 18.060 1.778 1.00 0.00 C ATOM 1702 CG MET A1021 0.207 18.714 2.153 1.00 0.00 C ATOM 1703 SD MET A1021 1.367 18.552 0.806 1.00 0.00 S ATOM 1704 CE MET A1021 1.660 16.792 0.859 1.00 0.00 C ATOM 0 H MET A1021 -1.982 19.413 3.629 1.00 0.00 H new ATOM 0 HA MET A1021 -2.694 16.900 2.704 1.00 0.00 H new ATOM 0 HB2 MET A1021 -0.958 17.301 1.014 1.00 0.00 H new ATOM 0 HB3 MET A1021 -1.791 18.806 1.346 1.00 0.00 H new ATOM 0 HG2 MET A1021 0.051 19.768 2.385 1.00 0.00 H new ATOM 0 HG3 MET A1021 0.612 18.246 3.051 1.00 0.00 H new ATOM 0 HE1 MET A1021 2.719 16.605 1.039 1.00 0.00 H new ATOM 0 HE2 MET A1021 1.071 16.349 1.662 1.00 0.00 H new ATOM 0 HE3 MET A1021 1.369 16.346 -0.092 1.00 0.00 H new ATOM 1714 N LEU A1022 -0.123 16.866 4.655 1.00 0.00 N ATOM 1715 CA LEU A1022 0.827 16.014 5.349 1.00 0.00 C ATOM 1716 C LEU A1022 0.065 15.007 6.213 1.00 0.00 C ATOM 1717 O LEU A1022 0.335 13.808 6.159 1.00 0.00 O ATOM 1718 CB LEU A1022 1.833 16.859 6.133 1.00 0.00 C ATOM 1719 CG LEU A1022 2.830 16.085 6.998 1.00 0.00 C ATOM 1720 CD1 LEU A1022 2.111 15.314 8.106 1.00 0.00 C ATOM 1721 CD2 LEU A1022 3.706 15.171 6.139 1.00 0.00 C ATOM 0 H LEU A1022 -0.191 17.816 5.021 1.00 0.00 H new ATOM 0 HA LEU A1022 1.417 15.441 4.634 1.00 0.00 H new ATOM 0 HB2 LEU A1022 2.394 17.470 5.425 1.00 0.00 H new ATOM 0 HB3 LEU A1022 1.279 17.543 6.776 1.00 0.00 H new ATOM 0 HG LEU A1022 3.492 16.803 7.483 1.00 0.00 H new ATOM 0 HD11 LEU A1022 2.842 14.773 8.706 1.00 0.00 H new ATOM 0 HD12 LEU A1022 1.566 16.013 8.741 1.00 0.00 H new ATOM 0 HD13 LEU A1022 1.411 14.606 7.662 1.00 0.00 H new ATOM 0 HD21 LEU A1022 4.406 14.632 6.778 1.00 0.00 H new ATOM 0 HD22 LEU A1022 3.076 14.457 5.608 1.00 0.00 H new ATOM 0 HD23 LEU A1022 4.261 15.771 5.418 1.00 0.00 H new ATOM 1733 N THR A1023 -0.872 15.531 6.989 1.00 0.00 N ATOM 1734 CA THR A1023 -1.675 14.693 7.864 1.00 0.00 C ATOM 1735 C THR A1023 -2.105 13.419 7.133 1.00 0.00 C ATOM 1736 O THR A1023 -1.911 12.314 7.638 1.00 0.00 O ATOM 1737 CB THR A1023 -2.851 15.529 8.371 1.00 0.00 C ATOM 1738 OG1 THR A1023 -2.249 16.746 8.806 1.00 0.00 O ATOM 1739 CG2 THR A1023 -3.478 14.949 9.640 1.00 0.00 C ATOM 0 H THR A1023 -1.093 16.526 7.030 1.00 0.00 H new ATOM 0 HA THR A1023 -1.101 14.357 8.728 1.00 0.00 H new ATOM 0 HB THR A1023 -3.609 15.599 7.591 1.00 0.00 H new ATOM 0 HG1 THR A1023 -2.941 17.349 9.149 1.00 0.00 H new ATOM 0 HG21 THR A1023 -4.308 15.581 9.957 1.00 0.00 H new ATOM 0 HG22 THR A1023 -3.845 13.943 9.437 1.00 0.00 H new ATOM 0 HG23 THR A1023 -2.729 14.910 10.431 1.00 0.00 H new ATOM 1747 N ALA A1024 -2.682 13.616 5.957 1.00 0.00 N ATOM 1748 CA ALA A1024 -3.142 12.497 5.152 1.00 0.00 C ATOM 1749 C ALA A1024 -1.952 11.601 4.805 1.00 0.00 C ATOM 1750 O ALA A1024 -2.055 10.377 4.857 1.00 0.00 O ATOM 1751 CB ALA A1024 -3.859 13.024 3.907 1.00 0.00 C ATOM 0 H ALA A1024 -2.842 14.534 5.542 1.00 0.00 H new ATOM 0 HA ALA A1024 -3.858 11.892 5.708 1.00 0.00 H new ATOM 0 HB1 ALA A1024 -4.204 12.185 3.303 1.00 0.00 H new ATOM 0 HB2 ALA A1024 -4.714 13.630 4.208 1.00 0.00 H new ATOM 0 HB3 ALA A1024 -3.171 13.634 3.321 1.00 0.00 H new ATOM 1757 N ALA A1025 -0.848 12.247 4.457 1.00 0.00 N ATOM 1758 CA ALA A1025 0.361 11.524 4.101 1.00 0.00 C ATOM 1759 C ALA A1025 0.700 10.527 5.211 1.00 0.00 C ATOM 1760 O ALA A1025 1.179 9.427 4.937 1.00 0.00 O ATOM 1761 CB ALA A1025 1.495 12.519 3.846 1.00 0.00 C ATOM 0 H ALA A1025 -0.766 13.263 4.414 1.00 0.00 H new ATOM 0 HA ALA A1025 0.212 10.957 3.182 1.00 0.00 H new ATOM 0 HB1 ALA A1025 2.402 11.976 3.579 1.00 0.00 H new ATOM 0 HB2 ALA A1025 1.217 13.186 3.030 1.00 0.00 H new ATOM 0 HB3 ALA A1025 1.675 13.105 4.748 1.00 0.00 H new ATOM 1767 N HIS A1026 0.437 10.946 6.440 1.00 0.00 N ATOM 1768 CA HIS A1026 0.708 10.104 7.592 1.00 0.00 C ATOM 1769 C HIS A1026 -0.185 8.863 7.541 1.00 0.00 C ATOM 1770 O HIS A1026 0.308 7.736 7.578 1.00 0.00 O ATOM 1771 CB HIS A1026 0.551 10.894 8.892 1.00 0.00 C ATOM 1772 CG HIS A1026 1.791 10.913 9.753 1.00 0.00 C ATOM 1773 ND1 HIS A1026 2.936 11.609 9.405 1.00 0.00 N ATOM 1774 CD2 HIS A1026 2.054 10.315 10.951 1.00 0.00 C ATOM 1775 CE1 HIS A1026 3.840 11.431 10.356 1.00 0.00 C ATOM 1776 NE2 HIS A1026 3.292 10.628 11.313 1.00 0.00 N ATOM 0 H HIS A1026 0.039 11.858 6.663 1.00 0.00 H new ATOM 0 HA HIS A1026 1.744 9.766 7.564 1.00 0.00 H new ATOM 0 HB2 HIS A1026 0.273 11.920 8.650 1.00 0.00 H new ATOM 0 HB3 HIS A1026 -0.271 10.468 9.467 1.00 0.00 H new ATOM 0 HD2 HIS A1026 1.371 9.693 11.510 1.00 0.00 H new ATOM 0 HE1 HIS A1026 4.836 11.848 10.371 1.00 0.00 H new ATOM 0 HE2 HIS A1026 3.757 10.319 12.166 1.00 0.00 H new ATOM 1784 N ALA A1027 -1.484 9.110 7.458 1.00 0.00 N ATOM 1785 CA ALA A1027 -2.451 8.027 7.402 1.00 0.00 C ATOM 1786 C ALA A1027 -2.240 7.227 6.115 1.00 0.00 C ATOM 1787 O ALA A1027 -2.450 6.016 6.091 1.00 0.00 O ATOM 1788 CB ALA A1027 -3.866 8.599 7.508 1.00 0.00 C ATOM 0 H ALA A1027 -1.890 10.045 7.428 1.00 0.00 H new ATOM 0 HA ALA A1027 -2.312 7.345 8.241 1.00 0.00 H new ATOM 0 HB1 ALA A1027 -4.591 7.786 7.466 1.00 0.00 H new ATOM 0 HB2 ALA A1027 -3.973 9.132 8.453 1.00 0.00 H new ATOM 0 HB3 ALA A1027 -4.043 9.287 6.681 1.00 0.00 H new ATOM 1794 N LEU A1028 -1.827 7.938 5.076 1.00 0.00 N ATOM 1795 CA LEU A1028 -1.586 7.310 3.788 1.00 0.00 C ATOM 1796 C LEU A1028 -0.528 6.216 3.949 1.00 0.00 C ATOM 1797 O LEU A1028 -0.822 5.033 3.779 1.00 0.00 O ATOM 1798 CB LEU A1028 -1.227 8.362 2.737 1.00 0.00 C ATOM 1799 CG LEU A1028 -2.401 8.966 1.965 1.00 0.00 C ATOM 1800 CD1 LEU A1028 -1.907 9.817 0.793 1.00 0.00 C ATOM 1801 CD2 LEU A1028 -3.377 7.879 1.512 1.00 0.00 C ATOM 0 H LEU A1028 -1.653 8.943 5.100 1.00 0.00 H new ATOM 0 HA LEU A1028 -2.493 6.827 3.425 1.00 0.00 H new ATOM 0 HB2 LEU A1028 -0.688 9.171 3.230 1.00 0.00 H new ATOM 0 HB3 LEU A1028 -0.540 7.912 2.021 1.00 0.00 H new ATOM 0 HG LEU A1028 -2.946 9.629 2.637 1.00 0.00 H new ATOM 0 HD11 LEU A1028 -2.762 10.235 0.261 1.00 0.00 H new ATOM 0 HD12 LEU A1028 -1.283 10.627 1.169 1.00 0.00 H new ATOM 0 HD13 LEU A1028 -1.324 9.196 0.113 1.00 0.00 H new ATOM 0 HD21 LEU A1028 -4.202 8.336 0.966 1.00 0.00 H new ATOM 0 HD22 LEU A1028 -2.859 7.172 0.863 1.00 0.00 H new ATOM 0 HD23 LEU A1028 -3.766 7.353 2.384 1.00 0.00 H new ATOM 1813 N ALA A1029 0.680 6.649 4.276 1.00 0.00 N ATOM 1814 CA ALA A1029 1.783 5.722 4.463 1.00 0.00 C ATOM 1815 C ALA A1029 1.277 4.472 5.186 1.00 0.00 C ATOM 1816 O ALA A1029 1.673 3.356 4.856 1.00 0.00 O ATOM 1817 CB ALA A1029 2.913 6.418 5.224 1.00 0.00 C ATOM 0 H ALA A1029 0.920 7.630 4.416 1.00 0.00 H new ATOM 0 HA ALA A1029 2.185 5.406 3.500 1.00 0.00 H new ATOM 0 HB1 ALA A1029 3.740 5.722 5.364 1.00 0.00 H new ATOM 0 HB2 ALA A1029 3.258 7.281 4.654 1.00 0.00 H new ATOM 0 HB3 ALA A1029 2.548 6.747 6.197 1.00 0.00 H new ATOM 1823 N VAL A1030 0.408 4.703 6.159 1.00 0.00 N ATOM 1824 CA VAL A1030 -0.158 3.609 6.932 1.00 0.00 C ATOM 1825 C VAL A1030 -1.184 2.863 6.077 1.00 0.00 C ATOM 1826 O VAL A1030 -1.139 1.638 5.975 1.00 0.00 O ATOM 1827 CB VAL A1030 -0.744 4.142 8.241 1.00 0.00 C ATOM 1828 CG1 VAL A1030 -1.770 3.166 8.820 1.00 0.00 C ATOM 1829 CG2 VAL A1030 0.362 4.441 9.255 1.00 0.00 C ATOM 0 H VAL A1030 0.082 5.631 6.430 1.00 0.00 H new ATOM 0 HA VAL A1030 0.617 2.894 7.206 1.00 0.00 H new ATOM 0 HB VAL A1030 -1.259 5.077 8.021 1.00 0.00 H new ATOM 0 HG11 VAL A1030 -2.171 3.569 9.750 1.00 0.00 H new ATOM 0 HG12 VAL A1030 -2.581 3.025 8.106 1.00 0.00 H new ATOM 0 HG13 VAL A1030 -1.290 2.208 9.017 1.00 0.00 H new ATOM 0 HG21 VAL A1030 -0.081 4.818 10.176 1.00 0.00 H new ATOM 0 HG22 VAL A1030 0.918 3.528 9.467 1.00 0.00 H new ATOM 0 HG23 VAL A1030 1.039 5.190 8.845 1.00 0.00 H new ATOM 1839 N ASP A1031 -2.085 3.634 5.484 1.00 0.00 N ATOM 1840 CA ASP A1031 -3.120 3.061 4.641 1.00 0.00 C ATOM 1841 C ASP A1031 -2.502 1.998 3.731 1.00 0.00 C ATOM 1842 O ASP A1031 -2.901 0.836 3.767 1.00 0.00 O ATOM 1843 CB ASP A1031 -3.761 4.129 3.753 1.00 0.00 C ATOM 1844 CG ASP A1031 -4.938 4.875 4.385 1.00 0.00 C ATOM 1845 OD1 ASP A1031 -4.797 5.260 5.567 1.00 0.00 O ATOM 1846 OD2 ASP A1031 -5.951 5.045 3.673 1.00 0.00 O ATOM 0 H ASP A1031 -2.119 4.650 5.571 1.00 0.00 H new ATOM 0 HA ASP A1031 -3.881 2.627 5.290 1.00 0.00 H new ATOM 0 HB2 ASP A1031 -2.997 4.855 3.475 1.00 0.00 H new ATOM 0 HB3 ASP A1031 -4.102 3.657 2.832 1.00 0.00 H new ATOM 1851 N ALA A1032 -1.536 2.436 2.936 1.00 0.00 N ATOM 1852 CA ALA A1032 -0.858 1.536 2.017 1.00 0.00 C ATOM 1853 C ALA A1032 -0.266 0.364 2.802 1.00 0.00 C ATOM 1854 O ALA A1032 -0.205 -0.757 2.299 1.00 0.00 O ATOM 1855 CB ALA A1032 0.205 2.311 1.236 1.00 0.00 C ATOM 0 H ALA A1032 -1.207 3.401 2.909 1.00 0.00 H new ATOM 0 HA ALA A1032 -1.561 1.126 1.292 1.00 0.00 H new ATOM 0 HB1 ALA A1032 0.714 1.637 0.547 1.00 0.00 H new ATOM 0 HB2 ALA A1032 -0.270 3.114 0.673 1.00 0.00 H new ATOM 0 HB3 ALA A1032 0.930 2.735 1.931 1.00 0.00 H new ATOM 1861 N LYS A1033 0.155 0.663 4.022 1.00 0.00 N ATOM 1862 CA LYS A1033 0.740 -0.352 4.882 1.00 0.00 C ATOM 1863 C LYS A1033 -0.324 -1.396 5.228 1.00 0.00 C ATOM 1864 O LYS A1033 -0.186 -2.567 4.880 1.00 0.00 O ATOM 1865 CB LYS A1033 1.391 0.293 6.107 1.00 0.00 C ATOM 1866 CG LYS A1033 2.837 -0.180 6.272 1.00 0.00 C ATOM 1867 CD LYS A1033 3.779 0.605 5.357 1.00 0.00 C ATOM 1868 CE LYS A1033 4.573 -0.336 4.450 1.00 0.00 C ATOM 1869 NZ LYS A1033 5.812 -0.783 5.124 1.00 0.00 N ATOM 0 H LYS A1033 0.103 1.594 4.436 1.00 0.00 H new ATOM 0 HA LYS A1033 1.543 -0.875 4.362 1.00 0.00 H new ATOM 0 HB2 LYS A1033 1.369 1.378 6.006 1.00 0.00 H new ATOM 0 HB3 LYS A1033 0.819 0.044 7.001 1.00 0.00 H new ATOM 0 HG2 LYS A1033 3.147 -0.058 7.310 1.00 0.00 H new ATOM 0 HG3 LYS A1033 2.904 -1.243 6.042 1.00 0.00 H new ATOM 0 HD2 LYS A1033 3.203 1.302 4.748 1.00 0.00 H new ATOM 0 HD3 LYS A1033 4.465 1.200 5.960 1.00 0.00 H new ATOM 0 HE2 LYS A1033 3.962 -1.200 4.189 1.00 0.00 H new ATOM 0 HE3 LYS A1033 4.822 0.172 3.518 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 6.339 -1.421 4.494 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 6.401 0.043 5.351 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 5.568 -1.286 6.001 1.00 0.00 H new ATOM 1883 N ASN A1034 -1.361 -0.933 5.911 1.00 0.00 N ATOM 1884 CA ASN A1034 -2.447 -1.811 6.309 1.00 0.00 C ATOM 1885 C ASN A1034 -2.761 -2.778 5.165 1.00 0.00 C ATOM 1886 O ASN A1034 -3.024 -3.956 5.398 1.00 0.00 O ATOM 1887 CB ASN A1034 -3.717 -1.013 6.615 1.00 0.00 C ATOM 1888 CG ASN A1034 -4.564 -1.717 7.677 1.00 0.00 C ATOM 1889 OD1 ASN A1034 -4.232 -2.786 8.165 1.00 0.00 O ATOM 1890 ND2 ASN A1034 -5.672 -1.061 8.007 1.00 0.00 N ATOM 0 H ASN A1034 -1.472 0.039 6.199 1.00 0.00 H new ATOM 0 HA ASN A1034 -2.134 -2.349 7.204 1.00 0.00 H new ATOM 0 HB2 ASN A1034 -3.449 -0.015 6.961 1.00 0.00 H new ATOM 0 HB3 ASN A1034 -4.301 -0.888 5.703 1.00 0.00 H new ATOM 0 HD21 ASN A1034 -6.304 -1.448 8.708 1.00 0.00 H new ATOM 0 HD22 ASN A1034 -5.890 -0.171 7.560 1.00 0.00 H new ATOM 1897 N LEU A1035 -2.723 -2.242 3.953 1.00 0.00 N ATOM 1898 CA LEU A1035 -3.000 -3.043 2.772 1.00 0.00 C ATOM 1899 C LEU A1035 -2.125 -4.297 2.795 1.00 0.00 C ATOM 1900 O LEU A1035 -2.631 -5.409 2.936 1.00 0.00 O ATOM 1901 CB LEU A1035 -2.836 -2.202 1.505 1.00 0.00 C ATOM 1902 CG LEU A1035 -3.360 -2.829 0.211 1.00 0.00 C ATOM 1903 CD1 LEU A1035 -3.719 -1.752 -0.814 1.00 0.00 C ATOM 1904 CD2 LEU A1035 -2.362 -3.844 -0.349 1.00 0.00 C ATOM 0 H LEU A1035 -2.505 -1.264 3.764 1.00 0.00 H new ATOM 0 HA LEU A1035 -4.037 -3.378 2.773 1.00 0.00 H new ATOM 0 HB2 LEU A1035 -3.345 -1.250 1.656 1.00 0.00 H new ATOM 0 HB3 LEU A1035 -1.777 -1.980 1.375 1.00 0.00 H new ATOM 0 HG LEU A1035 -4.277 -3.372 0.441 1.00 0.00 H new ATOM 0 HD11 LEU A1035 -4.089 -2.225 -1.724 1.00 0.00 H new ATOM 0 HD12 LEU A1035 -4.491 -1.102 -0.403 1.00 0.00 H new ATOM 0 HD13 LEU A1035 -2.833 -1.161 -1.046 1.00 0.00 H new ATOM 0 HD21 LEU A1035 -2.758 -4.275 -1.268 1.00 0.00 H new ATOM 0 HD22 LEU A1035 -1.416 -3.346 -0.560 1.00 0.00 H new ATOM 0 HD23 LEU A1035 -2.199 -4.636 0.382 1.00 0.00 H new ATOM 1916 N LEU A1036 -0.826 -4.077 2.655 1.00 0.00 N ATOM 1917 CA LEU A1036 0.125 -5.176 2.658 1.00 0.00 C ATOM 1918 C LEU A1036 0.108 -5.855 4.029 1.00 0.00 C ATOM 1919 O LEU A1036 0.139 -7.081 4.118 1.00 0.00 O ATOM 1920 CB LEU A1036 1.510 -4.687 2.230 1.00 0.00 C ATOM 1921 CG LEU A1036 2.345 -5.672 1.409 1.00 0.00 C ATOM 1922 CD1 LEU A1036 2.483 -5.200 -0.039 1.00 0.00 C ATOM 1923 CD2 LEU A1036 3.706 -5.917 2.064 1.00 0.00 C ATOM 0 H LEU A1036 -0.409 -3.153 2.539 1.00 0.00 H new ATOM 0 HA LEU A1036 -0.161 -5.930 1.925 1.00 0.00 H new ATOM 0 HB2 LEU A1036 1.387 -3.773 1.649 1.00 0.00 H new ATOM 0 HB3 LEU A1036 2.073 -4.422 3.125 1.00 0.00 H new ATOM 0 HG LEU A1036 1.821 -6.628 1.388 1.00 0.00 H new ATOM 0 HD11 LEU A1036 3.081 -5.918 -0.600 1.00 0.00 H new ATOM 0 HD12 LEU A1036 1.494 -5.119 -0.491 1.00 0.00 H new ATOM 0 HD13 LEU A1036 2.972 -4.226 -0.059 1.00 0.00 H new ATOM 0 HD21 LEU A1036 4.279 -6.621 1.460 1.00 0.00 H new ATOM 0 HD22 LEU A1036 4.249 -4.975 2.137 1.00 0.00 H new ATOM 0 HD23 LEU A1036 3.560 -6.330 3.062 1.00 0.00 H new ATOM 1935 N ASP A1037 0.060 -5.028 5.063 1.00 0.00 N ATOM 1936 CA ASP A1037 0.039 -5.534 6.425 1.00 0.00 C ATOM 1937 C ASP A1037 -0.856 -6.773 6.491 1.00 0.00 C ATOM 1938 O ASP A1037 -0.435 -7.822 6.976 1.00 0.00 O ATOM 1939 CB ASP A1037 -0.527 -4.491 7.391 1.00 0.00 C ATOM 1940 CG ASP A1037 -0.034 -4.612 8.834 1.00 0.00 C ATOM 1941 OD1 ASP A1037 1.097 -4.146 9.089 1.00 0.00 O ATOM 1942 OD2 ASP A1037 -0.801 -5.168 9.651 1.00 0.00 O ATOM 0 H ASP A1037 0.035 -4.011 4.985 1.00 0.00 H new ATOM 0 HA ASP A1037 1.063 -5.774 6.711 1.00 0.00 H new ATOM 0 HB2 ASP A1037 -0.275 -3.498 7.019 1.00 0.00 H new ATOM 0 HB3 ASP A1037 -1.614 -4.566 7.387 1.00 0.00 H new ATOM 1947 N VAL A1038 -2.074 -6.612 5.994 1.00 0.00 N ATOM 1948 CA VAL A1038 -3.032 -7.704 5.991 1.00 0.00 C ATOM 1949 C VAL A1038 -2.476 -8.861 5.157 1.00 0.00 C ATOM 1950 O VAL A1038 -2.596 -10.022 5.543 1.00 0.00 O ATOM 1951 CB VAL A1038 -4.390 -7.207 5.493 1.00 0.00 C ATOM 1952 CG1 VAL A1038 -5.416 -8.343 5.475 1.00 0.00 C ATOM 1953 CG2 VAL A1038 -4.888 -6.033 6.338 1.00 0.00 C ATOM 0 H VAL A1038 -2.419 -5.741 5.590 1.00 0.00 H new ATOM 0 HA VAL A1038 -3.189 -8.078 7.003 1.00 0.00 H new ATOM 0 HB VAL A1038 -4.263 -6.853 4.470 1.00 0.00 H new ATOM 0 HG11 VAL A1038 -6.373 -7.963 5.117 1.00 0.00 H new ATOM 0 HG12 VAL A1038 -5.069 -9.136 4.812 1.00 0.00 H new ATOM 0 HG13 VAL A1038 -5.537 -8.740 6.483 1.00 0.00 H new ATOM 0 HG21 VAL A1038 -5.855 -5.699 5.963 1.00 0.00 H new ATOM 0 HG22 VAL A1038 -4.991 -6.350 7.376 1.00 0.00 H new ATOM 0 HG23 VAL A1038 -4.173 -5.213 6.278 1.00 0.00 H new ATOM 1963 N ILE A1039 -1.880 -8.502 4.030 1.00 0.00 N ATOM 1964 CA ILE A1039 -1.305 -9.495 3.138 1.00 0.00 C ATOM 1965 C ILE A1039 -0.245 -10.300 3.893 1.00 0.00 C ATOM 1966 O ILE A1039 -0.181 -11.522 3.767 1.00 0.00 O ATOM 1967 CB ILE A1039 -0.781 -8.832 1.863 1.00 0.00 C ATOM 1968 CG1 ILE A1039 -1.900 -8.660 0.834 1.00 0.00 C ATOM 1969 CG2 ILE A1039 0.409 -9.606 1.292 1.00 0.00 C ATOM 1970 CD1 ILE A1039 -1.483 -7.690 -0.273 1.00 0.00 C ATOM 0 H ILE A1039 -1.783 -7.537 3.714 1.00 0.00 H new ATOM 0 HA ILE A1039 -2.069 -10.200 2.811 1.00 0.00 H new ATOM 0 HB ILE A1039 -0.424 -7.835 2.119 1.00 0.00 H new ATOM 0 HG12 ILE A1039 -2.151 -9.628 0.399 1.00 0.00 H new ATOM 0 HG13 ILE A1039 -2.799 -8.290 1.327 1.00 0.00 H new ATOM 0 HG21 ILE A1039 0.762 -9.114 0.386 1.00 0.00 H new ATOM 0 HG22 ILE A1039 1.213 -9.632 2.028 1.00 0.00 H new ATOM 0 HG23 ILE A1039 0.101 -10.624 1.055 1.00 0.00 H new ATOM 0 HD11 ILE A1039 -2.296 -7.586 -0.991 1.00 0.00 H new ATOM 0 HD12 ILE A1039 -1.256 -6.717 0.162 1.00 0.00 H new ATOM 0 HD13 ILE A1039 -0.599 -8.075 -0.780 1.00 0.00 H new ATOM 1982 N ASP A1040 0.560 -9.582 4.662 1.00 0.00 N ATOM 1983 CA ASP A1040 1.614 -10.214 5.438 1.00 0.00 C ATOM 1984 C ASP A1040 1.012 -11.330 6.294 1.00 0.00 C ATOM 1985 O ASP A1040 1.622 -12.384 6.464 1.00 0.00 O ATOM 1986 CB ASP A1040 2.286 -9.209 6.375 1.00 0.00 C ATOM 1987 CG ASP A1040 3.811 -9.147 6.271 1.00 0.00 C ATOM 1988 OD1 ASP A1040 4.289 -8.484 5.326 1.00 0.00 O ATOM 1989 OD2 ASP A1040 4.465 -9.764 7.140 1.00 0.00 O ATOM 0 H ASP A1040 0.504 -8.569 4.765 1.00 0.00 H new ATOM 0 HA ASP A1040 2.354 -10.609 4.742 1.00 0.00 H new ATOM 0 HB2 ASP A1040 1.882 -8.218 6.170 1.00 0.00 H new ATOM 0 HB3 ASP A1040 2.017 -9.456 7.402 1.00 0.00 H new ATOM 1994 N GLN A1041 -0.177 -11.059 6.811 1.00 0.00 N ATOM 1995 CA GLN A1041 -0.868 -12.027 7.645 1.00 0.00 C ATOM 1996 C GLN A1041 -1.416 -13.171 6.789 1.00 0.00 C ATOM 1997 O GLN A1041 -1.701 -14.253 7.301 1.00 0.00 O ATOM 1998 CB GLN A1041 -1.987 -11.360 8.448 1.00 0.00 C ATOM 1999 CG GLN A1041 -1.465 -10.845 9.791 1.00 0.00 C ATOM 2000 CD GLN A1041 -1.371 -9.318 9.793 1.00 0.00 C ATOM 2001 OE1 GLN A1041 -0.317 -8.735 9.596 1.00 0.00 O ATOM 2002 NE2 GLN A1041 -2.528 -8.705 10.026 1.00 0.00 N ATOM 0 H GLN A1041 -0.679 -10.183 6.668 1.00 0.00 H new ATOM 0 HA GLN A1041 -0.152 -12.441 8.355 1.00 0.00 H new ATOM 0 HB2 GLN A1041 -2.407 -10.533 7.876 1.00 0.00 H new ATOM 0 HB3 GLN A1041 -2.794 -12.073 8.617 1.00 0.00 H new ATOM 0 HG2 GLN A1041 -2.127 -11.173 10.593 1.00 0.00 H new ATOM 0 HG3 GLN A1041 -0.483 -11.274 9.992 1.00 0.00 H new ATOM 0 HE21 GLN A1041 -3.373 -9.254 10.183 1.00 0.00 H new ATOM 0 HE22 GLN A1041 -2.570 -7.686 10.048 1.00 0.00 H new ATOM 2011 N ALA A1042 -1.546 -12.893 5.500 1.00 0.00 N ATOM 2012 CA ALA A1042 -2.054 -13.885 4.568 1.00 0.00 C ATOM 2013 C ALA A1042 -0.884 -14.691 3.999 1.00 0.00 C ATOM 2014 O ALA A1042 -0.991 -15.902 3.816 1.00 0.00 O ATOM 2015 CB ALA A1042 -2.869 -13.190 3.476 1.00 0.00 C ATOM 0 H ALA A1042 -1.308 -11.995 5.079 1.00 0.00 H new ATOM 0 HA ALA A1042 -2.719 -14.583 5.076 1.00 0.00 H new ATOM 0 HB1 ALA A1042 -3.250 -13.934 2.777 1.00 0.00 H new ATOM 0 HB2 ALA A1042 -3.705 -12.657 3.929 1.00 0.00 H new ATOM 0 HB3 ALA A1042 -2.234 -12.483 2.942 1.00 0.00 H new ATOM 2021 N ARG A1043 0.206 -13.985 3.737 1.00 0.00 N ATOM 2022 CA ARG A1043 1.395 -14.620 3.193 1.00 0.00 C ATOM 2023 C ARG A1043 1.784 -15.833 4.039 1.00 0.00 C ATOM 2024 O ARG A1043 1.912 -16.941 3.521 1.00 0.00 O ATOM 2025 CB ARG A1043 2.570 -13.640 3.147 1.00 0.00 C ATOM 2026 CG ARG A1043 3.673 -14.151 2.217 1.00 0.00 C ATOM 2027 CD ARG A1043 4.749 -13.084 2.007 1.00 0.00 C ATOM 2028 NE ARG A1043 6.092 -13.703 2.061 1.00 0.00 N ATOM 2029 CZ ARG A1043 7.239 -13.010 2.077 1.00 0.00 C ATOM 2030 NH1 ARG A1043 7.213 -11.671 2.045 1.00 0.00 N ATOM 2031 NH2 ARG A1043 8.412 -13.657 2.127 1.00 0.00 N ATOM 0 H ARG A1043 0.291 -12.980 3.891 1.00 0.00 H new ATOM 0 HA ARG A1043 1.164 -14.941 2.177 1.00 0.00 H new ATOM 0 HB2 ARG A1043 2.222 -12.666 2.804 1.00 0.00 H new ATOM 0 HB3 ARG A1043 2.971 -13.500 4.151 1.00 0.00 H new ATOM 0 HG2 ARG A1043 4.124 -15.049 2.640 1.00 0.00 H new ATOM 0 HG3 ARG A1043 3.242 -14.433 1.256 1.00 0.00 H new ATOM 0 HD2 ARG A1043 4.604 -12.594 1.044 1.00 0.00 H new ATOM 0 HD3 ARG A1043 4.663 -12.314 2.773 1.00 0.00 H new ATOM 0 HE ARG A1043 6.148 -14.721 2.088 1.00 0.00 H new ATOM 0 HH11 ARG A1043 6.320 -11.179 2.008 1.00 0.00 H new ATOM 0 HH12 ARG A1043 8.086 -11.144 2.057 1.00 0.00 H new ATOM 0 HH21 ARG A1043 8.431 -14.676 2.153 1.00 0.00 H new ATOM 0 HH22 ARG A1043 9.285 -13.130 2.139 1.00 0.00 H new ATOM 2045 N LEU A1044 1.961 -15.583 5.328 1.00 0.00 N ATOM 2046 CA LEU A1044 2.332 -16.641 6.252 1.00 0.00 C ATOM 2047 C LEU A1044 1.179 -17.639 6.368 1.00 0.00 C ATOM 2048 O LEU A1044 1.404 -18.838 6.530 1.00 0.00 O ATOM 2049 CB LEU A1044 2.773 -16.051 7.594 1.00 0.00 C ATOM 2050 CG LEU A1044 1.686 -15.935 8.664 1.00 0.00 C ATOM 2051 CD1 LEU A1044 0.488 -15.137 8.145 1.00 0.00 C ATOM 2052 CD2 LEU A1044 1.275 -17.315 9.181 1.00 0.00 C ATOM 0 H LEU A1044 1.854 -14.663 5.754 1.00 0.00 H new ATOM 0 HA LEU A1044 3.193 -17.192 5.874 1.00 0.00 H new ATOM 0 HB2 LEU A1044 3.581 -16.665 7.990 1.00 0.00 H new ATOM 0 HB3 LEU A1044 3.186 -15.058 7.414 1.00 0.00 H new ATOM 0 HG LEU A1044 2.098 -15.384 9.510 1.00 0.00 H new ATOM 0 HD11 LEU A1044 -0.270 -15.070 8.925 1.00 0.00 H new ATOM 0 HD12 LEU A1044 0.812 -14.134 7.866 1.00 0.00 H new ATOM 0 HD13 LEU A1044 0.067 -15.638 7.273 1.00 0.00 H new ATOM 0 HD21 LEU A1044 0.501 -17.203 9.940 1.00 0.00 H new ATOM 0 HD22 LEU A1044 0.889 -17.913 8.355 1.00 0.00 H new ATOM 0 HD23 LEU A1044 2.141 -17.813 9.616 1.00 0.00 H new ATOM 2064 N LYS A1045 -0.032 -17.108 6.281 1.00 0.00 N ATOM 2065 CA LYS A1045 -1.221 -17.938 6.374 1.00 0.00 C ATOM 2066 C LYS A1045 -1.074 -19.140 5.440 1.00 0.00 C ATOM 2067 O LYS A1045 -1.660 -20.194 5.681 1.00 0.00 O ATOM 2068 CB LYS A1045 -2.477 -17.105 6.111 1.00 0.00 C ATOM 2069 CG LYS A1045 -3.740 -17.886 6.481 1.00 0.00 C ATOM 2070 CD LYS A1045 -4.383 -18.509 5.240 1.00 0.00 C ATOM 2071 CE LYS A1045 -5.787 -19.030 5.553 1.00 0.00 C ATOM 2072 NZ LYS A1045 -5.714 -20.357 6.204 1.00 0.00 N ATOM 0 H LYS A1045 -0.215 -16.114 6.147 1.00 0.00 H new ATOM 0 HA LYS A1045 -1.333 -18.331 7.384 1.00 0.00 H new ATOM 0 HB2 LYS A1045 -2.433 -16.182 6.689 1.00 0.00 H new ATOM 0 HB3 LYS A1045 -2.516 -16.821 5.059 1.00 0.00 H new ATOM 0 HG2 LYS A1045 -3.491 -18.669 7.198 1.00 0.00 H new ATOM 0 HG3 LYS A1045 -4.453 -17.222 6.969 1.00 0.00 H new ATOM 0 HD2 LYS A1045 -4.436 -17.768 4.442 1.00 0.00 H new ATOM 0 HD3 LYS A1045 -3.761 -19.326 4.875 1.00 0.00 H new ATOM 0 HE2 LYS A1045 -6.305 -18.327 6.205 1.00 0.00 H new ATOM 0 HE3 LYS A1045 -6.368 -19.101 4.634 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 -6.675 -20.696 6.410 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 -5.238 -21.029 5.569 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 -5.177 -20.279 7.091 1.00 0.00 H new ATOM 2086 N MET A1046 -0.287 -18.942 4.393 1.00 0.00 N ATOM 2087 CA MET A1046 -0.054 -19.997 3.421 1.00 0.00 C ATOM 2088 C MET A1046 1.025 -20.965 3.910 1.00 0.00 C ATOM 2089 O MET A1046 1.025 -22.139 3.541 1.00 0.00 O ATOM 2090 CB MET A1046 0.378 -19.379 2.090 1.00 0.00 C ATOM 2091 CG MET A1046 0.286 -20.401 0.955 1.00 0.00 C ATOM 2092 SD MET A1046 1.831 -20.466 0.064 1.00 0.00 S ATOM 2093 CE MET A1046 1.998 -18.749 -0.392 1.00 0.00 C ATOM 0 H MET A1046 0.198 -18.066 4.196 1.00 0.00 H new ATOM 0 HA MET A1046 -0.981 -20.554 3.288 1.00 0.00 H new ATOM 0 HB2 MET A1046 -0.253 -18.520 1.862 1.00 0.00 H new ATOM 0 HB3 MET A1046 1.401 -19.011 2.171 1.00 0.00 H new ATOM 0 HG2 MET A1046 0.048 -21.385 1.359 1.00 0.00 H new ATOM 0 HG3 MET A1046 -0.523 -20.131 0.277 1.00 0.00 H new ATOM 0 HE1 MET A1046 2.497 -18.676 -1.358 1.00 0.00 H new ATOM 0 HE2 MET A1046 1.010 -18.292 -0.458 1.00 0.00 H new ATOM 0 HE3 MET A1046 2.589 -18.228 0.362 1.00 0.00 H new ATOM 2103 N ILE A1047 1.920 -20.437 4.732 1.00 0.00 N ATOM 2104 CA ILE A1047 3.003 -21.239 5.275 1.00 0.00 C ATOM 2105 C ILE A1047 2.417 -22.410 6.067 1.00 0.00 C ATOM 2106 O ILE A1047 2.635 -23.570 5.721 1.00 0.00 O ATOM 2107 CB ILE A1047 3.962 -20.366 6.086 1.00 0.00 C ATOM 2108 CG1 ILE A1047 4.486 -19.200 5.245 1.00 0.00 C ATOM 2109 CG2 ILE A1047 5.098 -21.203 6.677 1.00 0.00 C ATOM 2110 CD1 ILE A1047 5.626 -19.652 4.330 1.00 0.00 C ATOM 0 H ILE A1047 1.917 -19.463 5.035 1.00 0.00 H new ATOM 0 HA ILE A1047 3.602 -21.666 4.470 1.00 0.00 H new ATOM 0 HB ILE A1047 3.410 -19.937 6.922 1.00 0.00 H new ATOM 0 HG12 ILE A1047 3.675 -18.787 4.645 1.00 0.00 H new ATOM 0 HG13 ILE A1047 4.836 -18.402 5.901 1.00 0.00 H new ATOM 0 HG21 ILE A1047 5.766 -20.558 7.249 1.00 0.00 H new ATOM 0 HG22 ILE A1047 4.683 -21.968 7.333 1.00 0.00 H new ATOM 0 HG23 ILE A1047 5.656 -21.680 5.871 1.00 0.00 H new ATOM 0 HD11 ILE A1047 5.980 -18.804 3.744 1.00 0.00 H new ATOM 0 HD12 ILE A1047 6.445 -20.042 4.934 1.00 0.00 H new ATOM 0 HD13 ILE A1047 5.267 -20.432 3.659 1.00 0.00 H new ATOM 2122 N SER A1048 1.684 -22.065 7.115 1.00 0.00 N ATOM 2123 CA SER A1048 1.065 -23.072 7.960 1.00 0.00 C ATOM 2124 C SER A1048 -0.220 -23.585 7.306 1.00 0.00 C ATOM 2125 O SER A1048 -1.319 -23.213 7.714 1.00 0.00 O ATOM 2126 CB SER A1048 0.765 -22.515 9.353 1.00 0.00 C ATOM 2127 OG SER A1048 1.553 -23.144 10.360 1.00 0.00 O ATOM 0 H SER A1048 1.505 -21.102 7.398 1.00 0.00 H new ATOM 0 HA SER A1048 1.765 -23.900 8.073 1.00 0.00 H new ATOM 0 HB2 SER A1048 0.954 -21.442 9.363 1.00 0.00 H new ATOM 0 HB3 SER A1048 -0.292 -22.655 9.580 1.00 0.00 H new ATOM 0 HG SER A1048 1.334 -22.760 11.234 1.00 0.00 H new ATOM 2133 N GLN A1049 -0.039 -24.432 6.304 1.00 0.00 N ATOM 2134 CA GLN A1049 -1.169 -25.000 5.590 1.00 0.00 C ATOM 2135 C GLN A1049 -0.684 -25.982 4.522 1.00 0.00 C ATOM 2136 O GLN A1049 -0.879 -27.190 4.650 1.00 0.00 O ATOM 2137 CB GLN A1049 -2.035 -23.901 4.971 1.00 0.00 C ATOM 2138 CG GLN A1049 -3.158 -24.501 4.122 1.00 0.00 C ATOM 2139 CD GLN A1049 -4.291 -25.028 5.005 1.00 0.00 C ATOM 2140 OE1 GLN A1049 -4.320 -24.829 6.208 1.00 0.00 O ATOM 2141 NE2 GLN A1049 -5.221 -25.710 4.342 1.00 0.00 N ATOM 0 H GLN A1049 0.874 -24.739 5.969 1.00 0.00 H new ATOM 0 HA GLN A1049 -1.787 -25.546 6.303 1.00 0.00 H new ATOM 0 HB2 GLN A1049 -2.462 -23.282 5.760 1.00 0.00 H new ATOM 0 HB3 GLN A1049 -1.416 -23.250 4.354 1.00 0.00 H new ATOM 0 HG2 GLN A1049 -3.546 -23.745 3.439 1.00 0.00 H new ATOM 0 HG3 GLN A1049 -2.763 -25.311 3.510 1.00 0.00 H new ATOM 0 HE21 GLN A1049 -5.136 -25.840 3.334 1.00 0.00 H new ATOM 0 HE22 GLN A1049 -6.019 -26.103 4.842 1.00 0.00 H new ATOM 2150 N SER A1050 -0.061 -25.428 3.493 1.00 0.00 N ATOM 2151 CA SER A1050 0.454 -26.239 2.404 1.00 0.00 C ATOM 2152 C SER A1050 1.347 -25.391 1.495 1.00 0.00 C ATOM 2153 O SER A1050 0.853 -24.564 0.731 1.00 0.00 O ATOM 2154 CB SER A1050 -0.686 -26.863 1.595 1.00 0.00 C ATOM 2155 OG SER A1050 -0.209 -27.809 0.643 1.00 0.00 O ATOM 0 H SER A1050 0.099 -24.426 3.390 1.00 0.00 H new ATOM 0 HA SER A1050 1.046 -27.048 2.832 1.00 0.00 H new ATOM 0 HB2 SER A1050 -1.386 -27.352 2.273 1.00 0.00 H new ATOM 0 HB3 SER A1050 -1.238 -26.077 1.080 1.00 0.00 H new ATOM 0 HG SER A1050 -0.967 -28.186 0.148 1.00 0.00 H new ATOM 2161 N ARG A1051 2.646 -25.627 1.609 1.00 0.00 N ATOM 2162 CA ARG A1051 3.612 -24.895 0.808 1.00 0.00 C ATOM 2163 C ARG A1051 3.234 -24.965 -0.674 1.00 0.00 C ATOM 2164 O ARG A1051 2.661 -25.955 -1.126 1.00 0.00 O ATOM 2165 CB ARG A1051 5.022 -25.459 0.995 1.00 0.00 C ATOM 2166 CG ARG A1051 5.069 -26.946 0.640 1.00 0.00 C ATOM 2167 CD ARG A1051 5.732 -27.165 -0.722 1.00 0.00 C ATOM 2168 NE ARG A1051 6.762 -28.222 -0.620 1.00 0.00 N ATOM 2169 CZ ARG A1051 7.282 -28.869 -1.672 1.00 0.00 C ATOM 2170 NH1 ARG A1051 6.871 -28.569 -2.912 1.00 0.00 N ATOM 2171 NH2 ARG A1051 8.212 -29.815 -1.485 1.00 0.00 N ATOM 0 H ARG A1051 3.052 -26.315 2.244 1.00 0.00 H new ATOM 0 HA ARG A1051 3.601 -23.857 1.141 1.00 0.00 H new ATOM 0 HB2 ARG A1051 5.724 -24.909 0.368 1.00 0.00 H new ATOM 0 HB3 ARG A1051 5.340 -25.318 2.028 1.00 0.00 H new ATOM 0 HG2 ARG A1051 5.620 -27.489 1.408 1.00 0.00 H new ATOM 0 HG3 ARG A1051 4.058 -27.352 0.625 1.00 0.00 H new ATOM 0 HD2 ARG A1051 4.981 -27.448 -1.460 1.00 0.00 H new ATOM 0 HD3 ARG A1051 6.185 -26.236 -1.068 1.00 0.00 H new ATOM 0 HE ARG A1051 7.097 -28.474 0.310 1.00 0.00 H new ATOM 0 HH11 ARG A1051 6.163 -27.849 -3.054 1.00 0.00 H new ATOM 0 HH12 ARG A1051 7.266 -29.061 -3.713 1.00 0.00 H new ATOM 0 HH21 ARG A1051 8.525 -30.043 -0.541 1.00 0.00 H new ATOM 0 HH22 ARG A1051 8.607 -30.307 -2.286 1.00 0.00 H new ATOM 2185 N PRO A1052 3.580 -23.873 -1.407 1.00 0.00 N ATOM 2186 CA PRO A1052 3.284 -23.801 -2.827 1.00 0.00 C ATOM 2187 C PRO A1052 4.238 -24.686 -3.632 1.00 0.00 C ATOM 2188 O PRO A1052 3.817 -25.674 -4.232 1.00 0.00 O ATOM 2189 CB PRO A1052 3.401 -22.327 -3.180 1.00 0.00 C ATOM 2190 CG PRO A1052 4.208 -21.694 -2.058 1.00 0.00 C ATOM 2191 CD PRO A1052 4.259 -22.682 -0.905 1.00 0.00 C ATOM 0 HA PRO A1052 2.290 -24.177 -3.068 1.00 0.00 H new ATOM 0 HB2 PRO A1052 3.897 -22.194 -4.141 1.00 0.00 H new ATOM 0 HB3 PRO A1052 2.417 -21.865 -3.262 1.00 0.00 H new ATOM 0 HG2 PRO A1052 5.215 -21.455 -2.400 1.00 0.00 H new ATOM 0 HG3 PRO A1052 3.749 -20.758 -1.739 1.00 0.00 H new ATOM 0 HD2 PRO A1052 5.287 -22.903 -0.619 1.00 0.00 H new ATOM 0 HD3 PRO A1052 3.760 -22.285 -0.021 1.00 0.00 H new ATOM 2199 N HIS A1053 5.505 -24.300 -3.619 1.00 0.00 N ATOM 2200 CA HIS A1053 6.522 -25.046 -4.340 1.00 0.00 C ATOM 2201 C HIS A1053 7.458 -25.733 -3.343 1.00 0.00 C ATOM 2202 O HIS A1053 8.331 -25.091 -2.761 1.00 0.00 O ATOM 2203 CB HIS A1053 7.266 -24.139 -5.323 1.00 0.00 C ATOM 2204 CG HIS A1053 7.374 -24.706 -6.719 1.00 0.00 C ATOM 2205 ND1 HIS A1053 6.381 -25.480 -7.292 1.00 0.00 N ATOM 2206 CD2 HIS A1053 8.367 -24.601 -7.648 1.00 0.00 C ATOM 2207 CE1 HIS A1053 6.769 -25.822 -8.512 1.00 0.00 C ATOM 2208 NE2 HIS A1053 8.000 -25.276 -8.731 1.00 0.00 N ATOM 0 H HIS A1053 5.851 -23.480 -3.120 1.00 0.00 H new ATOM 0 HA HIS A1053 6.051 -25.825 -4.939 1.00 0.00 H new ATOM 0 HB2 HIS A1053 6.756 -23.177 -5.371 1.00 0.00 H new ATOM 0 HB3 HIS A1053 8.269 -23.950 -4.940 1.00 0.00 H new ATOM 0 HD2 HIS A1053 9.294 -24.061 -7.524 1.00 0.00 H new ATOM 0 HE1 HIS A1053 6.209 -26.427 -9.210 1.00 0.00 H new ATOM 0 HE2 HIS A1053 8.548 -25.371 -9.586 1.00 0.00 H new TER 2216 HIS A1053