USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=30 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 939 MET CE :methyl -168:sc= -1.73! (180deg=-1.66) USER MOD Set 1.2: A 940 SER OG : rot 180:sc= 0 USER MOD Set 1.3: A1021 MET CE :methyl -152:sc= -0.628 (180deg=-2.59!) USER MOD Set 2.1: A 922 ASN : amide:sc= -0.236 K(o=-0.24,f=-1.9!) USER MOD Set 2.2: A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 915 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 917 ASN : amide:sc= 0 X(o=0,f=-0.058) USER MOD Single : A 921 SER OG : rot 180:sc= 0 USER MOD Single : A 924 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 928 ASN : amide:sc= -0.0713 X(o=-0.071,f=-0.39) USER MOD Single : A 930 THR OG1 : rot -49:sc= 0.239 USER MOD Single : A 934 LYS NZ :NH3+ -134:sc= 0.201 (180deg=0) USER MOD Single : A 941 SER OG : rot 180:sc= 0 USER MOD Single : A 942 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.191) USER MOD Single : A 944 GLN : amide:sc= -0.0363 K(o=-0.036,f=-0.72) USER MOD Single : A 951 TYR OH : rot 180:sc= -0.171 USER MOD Single : A 954 MET CE :methyl -121:sc= -2.81! (180deg=-7.66!) 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 968 THR OG1 : rot 97:sc= 1.03 USER MOD Single : A 972 SER OG : rot -170:sc= -0.508 USER MOD Single : A 979 SER OG : rot 180:sc= 0 USER MOD Single : A 980 THR OG1 : rot 112:sc= -4.49! USER MOD Single : A 981 HIS : no HD1:sc= -1.79 K(o=-1.8,f=-8.9!) USER MOD Single : A 986 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 988 GLN :FLIP amide:sc= -1.9 F(o=-3.9!,f=-1.9) USER MOD Single : A 989 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 992 ASN : amide:sc= -0.0115 K(o=-0.011,f=-1.2) USER MOD Single : A 993 SER OG : rot 180:sc= 0 USER MOD Single : A1000 ASN : amide:sc= -0.0566 K(o=-0.057,f=-0.71) USER MOD Single : A1001 LYS NZ :NH3+ 166:sc= -0.506 (180deg=-0.65) USER MOD Single : A1002 MET CE :methyl -120:sc= -2.42 (180deg=-6.85!) USER MOD Single : A1003 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1006 GLN : amide:sc= -2.78! C(o=-2.8!,f=-5!) USER MOD Single : A1007 GLN : amide:sc= -0.0136 X(o=-0.014,f=0) USER MOD Single : A1008 TYR OH : rot 180:sc= 0 USER MOD Single : A1010 MET CE :methyl -126:sc= -4.01! (180deg=-9.45!) USER MOD Single : A1011 THR OG1 : rot 180:sc= -0.0289 USER MOD Single : A1012 SER OG : rot 180:sc= 0 USER MOD Single : A1014 GLN : amide:sc= -0.36 K(o=-0.36,f=-4!) USER MOD Single : A1015 GLN : amide:sc= -0.0818 K(o=-0.082,f=-1.4!) USER MOD Single : A1017 TYR OH : rot 95:sc= -0.739 USER MOD Single : A1018 LYS NZ :NH3+ 152:sc= 0 (180deg=-0.607) USER MOD Single : A1019 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1020 GLN : amide:sc= -0.287 X(o=-0.29,f=-0.28) USER MOD Single : A1023 THR OG1 : rot -160:sc= -0.0141 USER MOD Single : A1026 HIS : no HD1:sc= 0 X(o=0,f=-0.062) USER MOD Single : A1033 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1034 ASN : amide:sc= -0.0928 K(o=-0.093,f=-1.9!) USER MOD Single : A1041 GLN : amide:sc= -0.109 K(o=-0.11,f=-1.9!) USER MOD Single : A1045 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1046 MET CE :methyl 160:sc= -1.09 (180deg=-2.79!) USER MOD Single : A1048 SER OG : rot 55:sc= 0.828 USER MOD Single : A1049 GLN : amide:sc= -0.0371 K(o=-0.037,f=-1.8!) USER MOD Single : A1050 SER OG : rot -78:sc= 0.238 USER MOD Single : A1053 HIS : no HD1:sc= -0.0799 X(o=-0.08,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 915 14.686 -21.108 -0.803 1.00 0.00 N ATOM 2 CA MET A 915 14.754 -21.043 -2.253 1.00 0.00 C ATOM 3 C MET A 915 13.370 -21.234 -2.876 1.00 0.00 C ATOM 4 O MET A 915 13.062 -22.304 -3.398 1.00 0.00 O ATOM 5 CB MET A 915 15.701 -22.129 -2.769 1.00 0.00 C ATOM 6 CG MET A 915 17.083 -21.551 -3.077 1.00 0.00 C ATOM 7 SD MET A 915 17.730 -22.278 -4.573 1.00 0.00 S ATOM 8 CE MET A 915 19.445 -22.459 -4.113 1.00 0.00 C ATOM 0 HA MET A 915 15.127 -20.059 -2.537 1.00 0.00 H new ATOM 0 HB2 MET A 915 15.792 -22.921 -2.025 1.00 0.00 H new ATOM 0 HB3 MET A 915 15.284 -22.583 -3.668 1.00 0.00 H new ATOM 0 HG2 MET A 915 17.017 -20.469 -3.188 1.00 0.00 H new ATOM 0 HG3 MET A 915 17.761 -21.745 -2.246 1.00 0.00 H new ATOM 0 HE1 MET A 915 19.999 -22.903 -4.940 1.00 0.00 H new ATOM 0 HE2 MET A 915 19.864 -21.480 -3.879 1.00 0.00 H new ATOM 0 HE3 MET A 915 19.521 -23.105 -3.238 1.00 0.00 H new ATOM 18 N ALA A 916 12.572 -20.178 -2.802 1.00 0.00 N ATOM 19 CA ALA A 916 11.228 -20.216 -3.352 1.00 0.00 C ATOM 20 C ALA A 916 11.207 -19.468 -4.687 1.00 0.00 C ATOM 21 O ALA A 916 11.867 -18.441 -4.838 1.00 0.00 O ATOM 22 CB ALA A 916 10.245 -19.627 -2.339 1.00 0.00 C ATOM 0 H ALA A 916 12.831 -19.291 -2.369 1.00 0.00 H new ATOM 0 HA ALA A 916 10.921 -21.244 -3.545 1.00 0.00 H new ATOM 0 HB1 ALA A 916 9.237 -19.655 -2.752 1.00 0.00 H new ATOM 0 HB2 ALA A 916 10.277 -20.211 -1.419 1.00 0.00 H new ATOM 0 HB3 ALA A 916 10.520 -18.594 -2.123 1.00 0.00 H new ATOM 28 N ASN A 917 10.442 -20.013 -5.622 1.00 0.00 N ATOM 29 CA ASN A 917 10.326 -19.410 -6.939 1.00 0.00 C ATOM 30 C ASN A 917 9.209 -18.364 -6.920 1.00 0.00 C ATOM 31 O ASN A 917 8.048 -18.686 -7.165 1.00 0.00 O ATOM 32 CB ASN A 917 9.973 -20.459 -7.995 1.00 0.00 C ATOM 33 CG ASN A 917 11.215 -20.889 -8.778 1.00 0.00 C ATOM 34 OD1 ASN A 917 12.279 -21.119 -8.227 1.00 0.00 O ATOM 35 ND2 ASN A 917 11.022 -20.983 -10.090 1.00 0.00 N ATOM 0 H ASN A 917 9.897 -20.865 -5.494 1.00 0.00 H new ATOM 0 HA ASN A 917 11.285 -18.956 -7.188 1.00 0.00 H new ATOM 0 HB2 ASN A 917 9.524 -21.328 -7.514 1.00 0.00 H new ATOM 0 HB3 ASN A 917 9.229 -20.054 -8.681 1.00 0.00 H new ATOM 0 HD21 ASN A 917 11.791 -21.262 -10.700 1.00 0.00 H new ATOM 0 HD22 ASN A 917 10.105 -20.776 -10.487 1.00 0.00 H new ATOM 42 N LEU A 918 9.601 -17.133 -6.627 1.00 0.00 N ATOM 43 CA LEU A 918 8.648 -16.037 -6.573 1.00 0.00 C ATOM 44 C LEU A 918 9.110 -14.918 -7.508 1.00 0.00 C ATOM 45 O LEU A 918 10.086 -14.226 -7.218 1.00 0.00 O ATOM 46 CB LEU A 918 8.435 -15.583 -5.128 1.00 0.00 C ATOM 47 CG LEU A 918 7.045 -15.840 -4.542 1.00 0.00 C ATOM 48 CD1 LEU A 918 7.111 -16.853 -3.397 1.00 0.00 C ATOM 49 CD2 LEU A 918 6.381 -14.530 -4.111 1.00 0.00 C ATOM 0 H LEU A 918 10.565 -16.870 -6.424 1.00 0.00 H new ATOM 0 HA LEU A 918 7.670 -16.365 -6.927 1.00 0.00 H new ATOM 0 HB2 LEU A 918 9.171 -16.083 -4.499 1.00 0.00 H new ATOM 0 HB3 LEU A 918 8.640 -14.514 -5.070 1.00 0.00 H new ATOM 0 HG LEU A 918 6.421 -16.276 -5.322 1.00 0.00 H new ATOM 0 HD11 LEU A 918 6.110 -17.017 -2.999 1.00 0.00 H new ATOM 0 HD12 LEU A 918 7.513 -17.796 -3.768 1.00 0.00 H new ATOM 0 HD13 LEU A 918 7.757 -16.468 -2.608 1.00 0.00 H new ATOM 0 HD21 LEU A 918 5.394 -14.741 -3.698 1.00 0.00 H new ATOM 0 HD22 LEU A 918 6.995 -14.043 -3.353 1.00 0.00 H new ATOM 0 HD23 LEU A 918 6.280 -13.872 -4.974 1.00 0.00 H new ATOM 61 N ASP A 919 8.389 -14.774 -8.610 1.00 0.00 N ATOM 62 CA ASP A 919 8.714 -13.751 -9.589 1.00 0.00 C ATOM 63 C ASP A 919 8.742 -12.384 -8.901 1.00 0.00 C ATOM 64 O ASP A 919 8.662 -12.300 -7.676 1.00 0.00 O ATOM 65 CB ASP A 919 7.663 -13.699 -10.700 1.00 0.00 C ATOM 66 CG ASP A 919 7.171 -15.062 -11.189 1.00 0.00 C ATOM 67 OD1 ASP A 919 6.725 -15.848 -10.324 1.00 0.00 O ATOM 68 OD2 ASP A 919 7.251 -15.288 -12.415 1.00 0.00 O ATOM 0 H ASP A 919 7.580 -15.349 -8.847 1.00 0.00 H new ATOM 0 HA ASP A 919 9.685 -13.994 -10.021 1.00 0.00 H new ATOM 0 HB2 ASP A 919 6.807 -13.127 -10.343 1.00 0.00 H new ATOM 0 HB3 ASP A 919 8.079 -13.154 -11.548 1.00 0.00 H new ATOM 73 N ARG A 920 8.857 -11.348 -9.719 1.00 0.00 N ATOM 74 CA ARG A 920 8.897 -9.990 -9.204 1.00 0.00 C ATOM 75 C ARG A 920 7.480 -9.427 -9.082 1.00 0.00 C ATOM 76 O ARG A 920 7.252 -8.247 -9.346 1.00 0.00 O ATOM 77 CB ARG A 920 9.723 -9.080 -10.116 1.00 0.00 C ATOM 78 CG ARG A 920 9.083 -8.965 -11.501 1.00 0.00 C ATOM 79 CD ARG A 920 10.048 -9.433 -12.592 1.00 0.00 C ATOM 80 NE ARG A 920 9.290 -9.863 -13.787 1.00 0.00 N ATOM 81 CZ ARG A 920 8.628 -9.020 -14.608 1.00 0.00 C ATOM 82 NH1 ARG A 920 8.624 -7.692 -14.367 1.00 0.00 N ATOM 83 NH2 ARG A 920 7.983 -9.514 -15.648 1.00 0.00 N ATOM 0 H ARG A 920 8.924 -11.422 -10.734 1.00 0.00 H new ATOM 0 HA ARG A 920 9.365 -10.022 -8.220 1.00 0.00 H new ATOM 0 HB2 ARG A 920 9.808 -8.090 -9.667 1.00 0.00 H new ATOM 0 HB3 ARG A 920 10.734 -9.475 -10.211 1.00 0.00 H new ATOM 0 HG2 ARG A 920 8.172 -9.563 -11.535 1.00 0.00 H new ATOM 0 HG3 ARG A 920 8.793 -7.931 -11.687 1.00 0.00 H new ATOM 0 HD2 ARG A 920 10.731 -8.626 -12.856 1.00 0.00 H new ATOM 0 HD3 ARG A 920 10.657 -10.258 -12.221 1.00 0.00 H new ATOM 0 HE ARG A 920 9.266 -10.859 -14.005 1.00 0.00 H new ATOM 0 HH11 ARG A 920 9.124 -7.319 -13.560 1.00 0.00 H new ATOM 0 HH12 ARG A 920 8.121 -7.062 -14.992 1.00 0.00 H new ATOM 0 HH21 ARG A 920 7.990 -10.519 -15.822 1.00 0.00 H new ATOM 0 HH22 ARG A 920 7.478 -8.891 -16.278 1.00 0.00 H new ATOM 96 N SER A 921 6.564 -10.296 -8.680 1.00 0.00 N ATOM 97 CA SER A 921 5.176 -9.900 -8.519 1.00 0.00 C ATOM 98 C SER A 921 4.956 -9.319 -7.121 1.00 0.00 C ATOM 99 O SER A 921 4.344 -8.262 -6.973 1.00 0.00 O ATOM 100 CB SER A 921 4.235 -11.083 -8.755 1.00 0.00 C ATOM 101 OG SER A 921 4.601 -12.221 -7.980 1.00 0.00 O ATOM 0 H SER A 921 6.757 -11.273 -8.461 1.00 0.00 H new ATOM 0 HA SER A 921 4.950 -9.136 -9.263 1.00 0.00 H new ATOM 0 HB2 SER A 921 3.215 -10.789 -8.508 1.00 0.00 H new ATOM 0 HB3 SER A 921 4.243 -11.347 -9.812 1.00 0.00 H new ATOM 0 HG SER A 921 3.975 -12.953 -8.158 1.00 0.00 H new ATOM 107 N ASN A 922 5.467 -10.035 -6.130 1.00 0.00 N ATOM 108 CA ASN A 922 5.335 -9.603 -4.749 1.00 0.00 C ATOM 109 C ASN A 922 6.196 -8.359 -4.523 1.00 0.00 C ATOM 110 O ASN A 922 5.903 -7.547 -3.646 1.00 0.00 O ATOM 111 CB ASN A 922 5.812 -10.690 -3.784 1.00 0.00 C ATOM 112 CG ASN A 922 4.964 -10.704 -2.510 1.00 0.00 C ATOM 113 OD1 ASN A 922 3.812 -10.301 -2.496 1.00 0.00 O ATOM 114 ND2 ASN A 922 5.595 -11.189 -1.445 1.00 0.00 N ATOM 0 H ASN A 922 5.973 -10.911 -6.256 1.00 0.00 H new ATOM 0 HA ASN A 922 4.282 -9.391 -4.562 1.00 0.00 H new ATOM 0 HB2 ASN A 922 5.758 -11.663 -4.272 1.00 0.00 H new ATOM 0 HB3 ASN A 922 6.858 -10.520 -3.527 1.00 0.00 H new ATOM 0 HD21 ASN A 922 5.114 -11.241 -0.547 1.00 0.00 H new ATOM 0 HD22 ASN A 922 6.560 -11.510 -1.526 1.00 0.00 H new ATOM 121 N ASP A 923 7.241 -8.247 -5.329 1.00 0.00 N ATOM 122 CA ASP A 923 8.147 -7.115 -5.229 1.00 0.00 C ATOM 123 C ASP A 923 7.527 -5.907 -5.933 1.00 0.00 C ATOM 124 O ASP A 923 7.481 -4.813 -5.373 1.00 0.00 O ATOM 125 CB ASP A 923 9.486 -7.420 -5.903 1.00 0.00 C ATOM 126 CG ASP A 923 10.512 -6.286 -5.845 1.00 0.00 C ATOM 127 OD1 ASP A 923 11.059 -6.072 -4.742 1.00 0.00 O ATOM 128 OD2 ASP A 923 10.725 -5.659 -6.905 1.00 0.00 O ATOM 0 H ASP A 923 7.481 -8.922 -6.055 1.00 0.00 H new ATOM 0 HA ASP A 923 8.314 -6.910 -4.172 1.00 0.00 H new ATOM 0 HB2 ASP A 923 9.918 -8.305 -5.435 1.00 0.00 H new ATOM 0 HB3 ASP A 923 9.301 -7.670 -6.948 1.00 0.00 H new ATOM 133 N LYS A 924 7.064 -6.146 -7.152 1.00 0.00 N ATOM 134 CA LYS A 924 6.449 -5.091 -7.939 1.00 0.00 C ATOM 135 C LYS A 924 5.493 -4.290 -7.051 1.00 0.00 C ATOM 136 O LYS A 924 5.614 -3.071 -6.945 1.00 0.00 O ATOM 137 CB LYS A 924 5.786 -5.672 -9.189 1.00 0.00 C ATOM 138 CG LYS A 924 5.011 -4.594 -9.950 1.00 0.00 C ATOM 139 CD LYS A 924 5.943 -3.788 -10.858 1.00 0.00 C ATOM 140 CE LYS A 924 5.294 -3.531 -12.219 1.00 0.00 C ATOM 141 NZ LYS A 924 5.857 -4.441 -13.242 1.00 0.00 N ATOM 0 H LYS A 924 7.103 -7.055 -7.613 1.00 0.00 H new ATOM 0 HA LYS A 924 7.206 -4.396 -8.302 1.00 0.00 H new ATOM 0 HB2 LYS A 924 6.545 -6.106 -9.839 1.00 0.00 H new ATOM 0 HB3 LYS A 924 5.110 -6.479 -8.905 1.00 0.00 H new ATOM 0 HG2 LYS A 924 4.227 -5.058 -10.548 1.00 0.00 H new ATOM 0 HG3 LYS A 924 4.519 -3.926 -9.242 1.00 0.00 H new ATOM 0 HD2 LYS A 924 6.188 -2.838 -10.383 1.00 0.00 H new ATOM 0 HD3 LYS A 924 6.880 -4.327 -10.994 1.00 0.00 H new ATOM 0 HE2 LYS A 924 4.216 -3.677 -12.148 1.00 0.00 H new ATOM 0 HE3 LYS A 924 5.457 -2.495 -12.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 5.406 -4.253 -14.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 6.882 -4.283 -13.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 5.680 -5.427 -12.964 1.00 0.00 H new ATOM 155 N VAL A 925 4.565 -5.009 -6.437 1.00 0.00 N ATOM 156 CA VAL A 925 3.590 -4.381 -5.562 1.00 0.00 C ATOM 157 C VAL A 925 4.315 -3.718 -4.389 1.00 0.00 C ATOM 158 O VAL A 925 4.377 -2.493 -4.306 1.00 0.00 O ATOM 159 CB VAL A 925 2.547 -5.408 -5.118 1.00 0.00 C ATOM 160 CG1 VAL A 925 1.597 -4.811 -4.078 1.00 0.00 C ATOM 161 CG2 VAL A 925 1.772 -5.958 -6.317 1.00 0.00 C ATOM 0 H VAL A 925 4.468 -6.020 -6.528 1.00 0.00 H new ATOM 0 HA VAL A 925 3.049 -3.598 -6.093 1.00 0.00 H new ATOM 0 HB VAL A 925 3.075 -6.240 -4.651 1.00 0.00 H new ATOM 0 HG11 VAL A 925 0.866 -5.562 -3.780 1.00 0.00 H new ATOM 0 HG12 VAL A 925 2.167 -4.492 -3.205 1.00 0.00 H new ATOM 0 HG13 VAL A 925 1.081 -3.952 -4.507 1.00 0.00 H new ATOM 0 HG21 VAL A 925 1.037 -6.686 -5.973 1.00 0.00 H new ATOM 0 HG22 VAL A 925 1.262 -5.141 -6.826 1.00 0.00 H new ATOM 0 HG23 VAL A 925 2.464 -6.440 -7.007 1.00 0.00 H new ATOM 171 N TYR A 926 4.844 -4.558 -3.512 1.00 0.00 N ATOM 172 CA TYR A 926 5.562 -4.070 -2.347 1.00 0.00 C ATOM 173 C TYR A 926 6.393 -2.833 -2.694 1.00 0.00 C ATOM 174 O TYR A 926 6.513 -1.914 -1.885 1.00 0.00 O ATOM 175 CB TYR A 926 6.503 -5.201 -1.927 1.00 0.00 C ATOM 176 CG TYR A 926 5.818 -6.321 -1.143 1.00 0.00 C ATOM 177 CD1 TYR A 926 4.454 -6.501 -1.244 1.00 0.00 C ATOM 178 CD2 TYR A 926 6.565 -7.153 -0.333 1.00 0.00 C ATOM 179 CE1 TYR A 926 3.809 -7.556 -0.506 1.00 0.00 C ATOM 180 CE2 TYR A 926 5.920 -8.208 0.405 1.00 0.00 C ATOM 181 CZ TYR A 926 4.574 -8.357 0.282 1.00 0.00 C ATOM 182 OH TYR A 926 3.965 -9.354 0.979 1.00 0.00 O ATOM 0 H TYR A 926 4.790 -5.574 -3.585 1.00 0.00 H new ATOM 0 HA TYR A 926 4.866 -3.790 -1.556 1.00 0.00 H new ATOM 0 HB2 TYR A 926 6.965 -5.625 -2.818 1.00 0.00 H new ATOM 0 HB3 TYR A 926 7.306 -4.785 -1.319 1.00 0.00 H new ATOM 0 HD1 TYR A 926 3.869 -5.850 -1.877 1.00 0.00 H new ATOM 0 HD2 TYR A 926 7.633 -7.013 -0.253 1.00 0.00 H new ATOM 0 HE1 TYR A 926 2.742 -7.707 -0.577 1.00 0.00 H new ATOM 0 HE2 TYR A 926 6.492 -8.866 1.042 1.00 0.00 H new ATOM 0 HH TYR A 926 4.635 -9.846 1.498 1.00 0.00 H new ATOM 192 N GLU A 927 6.945 -2.850 -3.898 1.00 0.00 N ATOM 193 CA GLU A 927 7.762 -1.741 -4.362 1.00 0.00 C ATOM 194 C GLU A 927 6.910 -0.478 -4.504 1.00 0.00 C ATOM 195 O GLU A 927 7.100 0.489 -3.768 1.00 0.00 O ATOM 196 CB GLU A 927 8.455 -2.085 -5.682 1.00 0.00 C ATOM 197 CG GLU A 927 9.707 -2.930 -5.439 1.00 0.00 C ATOM 198 CD GLU A 927 10.881 -2.055 -4.992 1.00 0.00 C ATOM 199 OE1 GLU A 927 11.000 -0.941 -5.545 1.00 0.00 O ATOM 200 OE2 GLU A 927 11.632 -2.521 -4.109 1.00 0.00 O ATOM 0 H GLU A 927 6.843 -3.614 -4.566 1.00 0.00 H new ATOM 0 HA GLU A 927 8.538 -1.552 -3.620 1.00 0.00 H new ATOM 0 HB2 GLU A 927 7.765 -2.628 -6.328 1.00 0.00 H new ATOM 0 HB3 GLU A 927 8.727 -1.168 -6.204 1.00 0.00 H new ATOM 0 HG2 GLU A 927 9.500 -3.683 -4.679 1.00 0.00 H new ATOM 0 HG3 GLU A 927 9.973 -3.463 -6.352 1.00 0.00 H new ATOM 207 N ASN A 928 5.989 -0.527 -5.455 1.00 0.00 N ATOM 208 CA ASN A 928 5.108 0.602 -5.703 1.00 0.00 C ATOM 209 C ASN A 928 4.696 1.224 -4.367 1.00 0.00 C ATOM 210 O ASN A 928 4.664 2.447 -4.232 1.00 0.00 O ATOM 211 CB ASN A 928 3.837 0.159 -6.429 1.00 0.00 C ATOM 212 CG ASN A 928 3.293 1.281 -7.316 1.00 0.00 C ATOM 213 OD1 ASN A 928 2.807 2.297 -6.848 1.00 0.00 O ATOM 214 ND2 ASN A 928 3.401 1.040 -8.620 1.00 0.00 N ATOM 0 H ASN A 928 5.834 -1.331 -6.063 1.00 0.00 H new ATOM 0 HA ASN A 928 5.646 1.320 -6.322 1.00 0.00 H new ATOM 0 HB2 ASN A 928 4.049 -0.720 -7.038 1.00 0.00 H new ATOM 0 HB3 ASN A 928 3.081 -0.133 -5.700 1.00 0.00 H new ATOM 0 HD21 ASN A 928 3.066 1.727 -9.295 1.00 0.00 H new ATOM 0 HD22 ASN A 928 3.819 0.168 -8.945 1.00 0.00 H new ATOM 221 N VAL A 929 4.393 0.355 -3.414 1.00 0.00 N ATOM 222 CA VAL A 929 3.985 0.805 -2.094 1.00 0.00 C ATOM 223 C VAL A 929 5.058 1.733 -1.522 1.00 0.00 C ATOM 224 O VAL A 929 4.808 2.918 -1.305 1.00 0.00 O ATOM 225 CB VAL A 929 3.696 -0.401 -1.197 1.00 0.00 C ATOM 226 CG1 VAL A 929 3.437 0.039 0.245 1.00 0.00 C ATOM 227 CG2 VAL A 929 2.524 -1.220 -1.740 1.00 0.00 C ATOM 0 H VAL A 929 4.422 -0.658 -3.530 1.00 0.00 H new ATOM 0 HA VAL A 929 3.060 1.378 -2.154 1.00 0.00 H new ATOM 0 HB VAL A 929 4.579 -1.040 -1.199 1.00 0.00 H new ATOM 0 HG11 VAL A 929 3.234 -0.837 0.862 1.00 0.00 H new ATOM 0 HG12 VAL A 929 4.314 0.559 0.630 1.00 0.00 H new ATOM 0 HG13 VAL A 929 2.578 0.709 0.272 1.00 0.00 H new ATOM 0 HG21 VAL A 929 2.340 -2.071 -1.084 1.00 0.00 H new ATOM 0 HG22 VAL A 929 1.632 -0.595 -1.783 1.00 0.00 H new ATOM 0 HG23 VAL A 929 2.764 -1.579 -2.741 1.00 0.00 H new ATOM 237 N THR A 930 6.230 1.159 -1.293 1.00 0.00 N ATOM 238 CA THR A 930 7.343 1.920 -0.750 1.00 0.00 C ATOM 239 C THR A 930 7.637 3.136 -1.630 1.00 0.00 C ATOM 240 O THR A 930 7.785 4.250 -1.129 1.00 0.00 O ATOM 241 CB THR A 930 8.536 0.974 -0.602 1.00 0.00 C ATOM 242 OG1 THR A 930 8.801 0.539 -1.933 1.00 0.00 O ATOM 243 CG2 THR A 930 8.174 -0.312 0.145 1.00 0.00 C ATOM 0 H THR A 930 6.433 0.176 -1.473 1.00 0.00 H new ATOM 0 HA THR A 930 7.104 2.321 0.235 1.00 0.00 H new ATOM 0 HB THR A 930 9.342 1.485 -0.075 1.00 0.00 H new ATOM 0 HG1 THR A 930 7.966 0.243 -2.353 1.00 0.00 H new ATOM 0 HG21 THR A 930 9.056 -0.948 0.223 1.00 0.00 H new ATOM 0 HG22 THR A 930 7.816 -0.064 1.144 1.00 0.00 H new ATOM 0 HG23 THR A 930 7.392 -0.841 -0.399 1.00 0.00 H new ATOM 251 N GLY A 931 7.714 2.882 -2.928 1.00 0.00 N ATOM 252 CA GLY A 931 7.988 3.942 -3.884 1.00 0.00 C ATOM 253 C GLY A 931 7.050 5.132 -3.667 1.00 0.00 C ATOM 254 O GLY A 931 7.489 6.280 -3.661 1.00 0.00 O ATOM 0 H GLY A 931 7.591 1.957 -3.340 1.00 0.00 H new ATOM 0 HA2 GLY A 931 9.023 4.268 -3.785 1.00 0.00 H new ATOM 0 HA3 GLY A 931 7.870 3.561 -4.898 1.00 0.00 H new ATOM 258 N LEU A 932 5.775 4.815 -3.495 1.00 0.00 N ATOM 259 CA LEU A 932 4.771 5.843 -3.279 1.00 0.00 C ATOM 260 C LEU A 932 4.907 6.391 -1.857 1.00 0.00 C ATOM 261 O LEU A 932 5.022 7.600 -1.663 1.00 0.00 O ATOM 262 CB LEU A 932 3.375 5.304 -3.600 1.00 0.00 C ATOM 263 CG LEU A 932 2.458 5.062 -2.400 1.00 0.00 C ATOM 264 CD1 LEU A 932 2.151 6.371 -1.671 1.00 0.00 C ATOM 265 CD2 LEU A 932 1.183 4.329 -2.824 1.00 0.00 C ATOM 0 H LEU A 932 5.414 3.861 -3.501 1.00 0.00 H new ATOM 0 HA LEU A 932 4.929 6.679 -3.960 1.00 0.00 H new ATOM 0 HB2 LEU A 932 2.882 6.005 -4.273 1.00 0.00 H new ATOM 0 HB3 LEU A 932 3.485 4.365 -4.143 1.00 0.00 H new ATOM 0 HG LEU A 932 2.982 4.417 -1.695 1.00 0.00 H new ATOM 0 HD11 LEU A 932 1.497 6.170 -0.822 1.00 0.00 H new ATOM 0 HD12 LEU A 932 3.080 6.816 -1.316 1.00 0.00 H new ATOM 0 HD13 LEU A 932 1.656 7.061 -2.355 1.00 0.00 H new ATOM 0 HD21 LEU A 932 0.548 4.169 -1.952 1.00 0.00 H new ATOM 0 HD22 LEU A 932 0.646 4.929 -3.559 1.00 0.00 H new ATOM 0 HD23 LEU A 932 1.446 3.366 -3.263 1.00 0.00 H new ATOM 277 N VAL A 933 4.888 5.476 -0.900 1.00 0.00 N ATOM 278 CA VAL A 933 5.007 5.852 0.498 1.00 0.00 C ATOM 279 C VAL A 933 6.282 6.676 0.693 1.00 0.00 C ATOM 280 O VAL A 933 6.332 7.556 1.551 1.00 0.00 O ATOM 281 CB VAL A 933 4.961 4.605 1.382 1.00 0.00 C ATOM 282 CG1 VAL A 933 6.290 4.400 2.113 1.00 0.00 C ATOM 283 CG2 VAL A 933 3.797 4.677 2.372 1.00 0.00 C ATOM 0 H VAL A 933 4.792 4.474 -1.065 1.00 0.00 H new ATOM 0 HA VAL A 933 4.166 6.477 0.798 1.00 0.00 H new ATOM 0 HB VAL A 933 4.798 3.743 0.735 1.00 0.00 H new ATOM 0 HG11 VAL A 933 6.229 3.506 2.734 1.00 0.00 H new ATOM 0 HG12 VAL A 933 7.092 4.281 1.384 1.00 0.00 H new ATOM 0 HG13 VAL A 933 6.497 5.266 2.742 1.00 0.00 H new ATOM 0 HG21 VAL A 933 3.787 3.778 2.988 1.00 0.00 H new ATOM 0 HG22 VAL A 933 3.915 5.553 3.010 1.00 0.00 H new ATOM 0 HG23 VAL A 933 2.858 4.751 1.824 1.00 0.00 H new ATOM 293 N LYS A 934 7.281 6.362 -0.118 1.00 0.00 N ATOM 294 CA LYS A 934 8.552 7.062 -0.046 1.00 0.00 C ATOM 295 C LYS A 934 8.331 8.544 -0.350 1.00 0.00 C ATOM 296 O LYS A 934 8.816 9.410 0.376 1.00 0.00 O ATOM 297 CB LYS A 934 9.584 6.394 -0.957 1.00 0.00 C ATOM 298 CG LYS A 934 10.115 5.103 -0.331 1.00 0.00 C ATOM 299 CD LYS A 934 11.601 5.230 0.011 1.00 0.00 C ATOM 300 CE LYS A 934 11.823 6.265 1.116 1.00 0.00 C ATOM 301 NZ LYS A 934 13.170 6.867 1.000 1.00 0.00 N ATOM 0 H LYS A 934 7.236 5.632 -0.829 1.00 0.00 H new ATOM 0 HA LYS A 934 8.964 7.001 0.961 1.00 0.00 H new ATOM 0 HB2 LYS A 934 9.132 6.174 -1.924 1.00 0.00 H new ATOM 0 HB3 LYS A 934 10.411 7.080 -1.140 1.00 0.00 H new ATOM 0 HG2 LYS A 934 9.549 4.873 0.572 1.00 0.00 H new ATOM 0 HG3 LYS A 934 9.967 4.272 -1.021 1.00 0.00 H new ATOM 0 HD2 LYS A 934 11.988 4.263 0.331 1.00 0.00 H new ATOM 0 HD3 LYS A 934 12.159 5.518 -0.880 1.00 0.00 H new ATOM 0 HE2 LYS A 934 11.063 7.044 1.051 1.00 0.00 H new ATOM 0 HE3 LYS A 934 11.712 5.793 2.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 13.621 6.893 1.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 13.750 6.297 0.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 13.087 7.835 0.629 1.00 0.00 H new ATOM 315 N ALA A 935 7.598 8.792 -1.426 1.00 0.00 N ATOM 316 CA ALA A 935 7.307 10.155 -1.836 1.00 0.00 C ATOM 317 C ALA A 935 6.318 10.779 -0.849 1.00 0.00 C ATOM 318 O ALA A 935 6.451 11.947 -0.486 1.00 0.00 O ATOM 319 CB ALA A 935 6.777 10.155 -3.271 1.00 0.00 C ATOM 0 H ALA A 935 7.197 8.071 -2.026 1.00 0.00 H new ATOM 0 HA ALA A 935 8.213 10.761 -1.824 1.00 0.00 H new ATOM 0 HB1 ALA A 935 6.559 11.178 -3.578 1.00 0.00 H new ATOM 0 HB2 ALA A 935 7.528 9.729 -3.936 1.00 0.00 H new ATOM 0 HB3 ALA A 935 5.866 9.559 -3.322 1.00 0.00 H new ATOM 325 N VAL A 936 5.348 9.973 -0.443 1.00 0.00 N ATOM 326 CA VAL A 936 4.337 10.431 0.494 1.00 0.00 C ATOM 327 C VAL A 936 4.998 11.298 1.567 1.00 0.00 C ATOM 328 O VAL A 936 4.488 12.364 1.911 1.00 0.00 O ATOM 329 CB VAL A 936 3.581 9.235 1.075 1.00 0.00 C ATOM 330 CG1 VAL A 936 2.982 9.575 2.441 1.00 0.00 C ATOM 331 CG2 VAL A 936 2.499 8.748 0.108 1.00 0.00 C ATOM 0 H VAL A 936 5.241 9.005 -0.746 1.00 0.00 H new ATOM 0 HA VAL A 936 3.598 11.050 -0.015 1.00 0.00 H new ATOM 0 HB VAL A 936 4.295 8.424 1.215 1.00 0.00 H new ATOM 0 HG11 VAL A 936 2.450 8.707 2.831 1.00 0.00 H new ATOM 0 HG12 VAL A 936 3.780 9.851 3.130 1.00 0.00 H new ATOM 0 HG13 VAL A 936 2.288 10.409 2.337 1.00 0.00 H new ATOM 0 HG21 VAL A 936 1.977 7.897 0.545 1.00 0.00 H new ATOM 0 HG22 VAL A 936 1.789 9.553 -0.079 1.00 0.00 H new ATOM 0 HG23 VAL A 936 2.960 8.446 -0.832 1.00 0.00 H new ATOM 341 N ILE A 937 6.124 10.810 2.067 1.00 0.00 N ATOM 342 CA ILE A 937 6.861 11.527 3.094 1.00 0.00 C ATOM 343 C ILE A 937 7.759 12.574 2.433 1.00 0.00 C ATOM 344 O ILE A 937 7.564 13.774 2.623 1.00 0.00 O ATOM 345 CB ILE A 937 7.617 10.547 3.993 1.00 0.00 C ATOM 346 CG1 ILE A 937 6.647 9.713 4.832 1.00 0.00 C ATOM 347 CG2 ILE A 937 8.642 11.279 4.862 1.00 0.00 C ATOM 348 CD1 ILE A 937 7.050 8.237 4.831 1.00 0.00 C ATOM 0 H ILE A 937 6.544 9.926 1.780 1.00 0.00 H new ATOM 0 HA ILE A 937 6.176 12.063 3.751 1.00 0.00 H new ATOM 0 HB ILE A 937 8.169 9.856 3.356 1.00 0.00 H new ATOM 0 HG12 ILE A 937 6.630 10.088 5.855 1.00 0.00 H new ATOM 0 HG13 ILE A 937 5.636 9.818 4.437 1.00 0.00 H new ATOM 0 HG21 ILE A 937 9.165 10.559 5.491 1.00 0.00 H new ATOM 0 HG22 ILE A 937 9.360 11.792 4.223 1.00 0.00 H new ATOM 0 HG23 ILE A 937 8.131 12.008 5.492 1.00 0.00 H new ATOM 0 HD11 ILE A 937 6.344 7.667 5.435 1.00 0.00 H new ATOM 0 HD12 ILE A 937 7.042 7.858 3.809 1.00 0.00 H new ATOM 0 HD13 ILE A 937 8.051 8.133 5.249 1.00 0.00 H new ATOM 360 N GLU A 938 8.725 12.083 1.671 1.00 0.00 N ATOM 361 CA GLU A 938 9.655 12.962 0.982 1.00 0.00 C ATOM 362 C GLU A 938 8.937 14.228 0.510 1.00 0.00 C ATOM 363 O GLU A 938 9.436 15.336 0.701 1.00 0.00 O ATOM 364 CB GLU A 938 10.324 12.241 -0.190 1.00 0.00 C ATOM 365 CG GLU A 938 11.811 12.008 0.086 1.00 0.00 C ATOM 366 CD GLU A 938 12.047 10.617 0.676 1.00 0.00 C ATOM 367 OE1 GLU A 938 11.990 10.511 1.921 1.00 0.00 O ATOM 368 OE2 GLU A 938 12.281 9.690 -0.130 1.00 0.00 O ATOM 0 H GLU A 938 8.884 11.088 1.515 1.00 0.00 H new ATOM 0 HA GLU A 938 10.439 13.252 1.682 1.00 0.00 H new ATOM 0 HB2 GLU A 938 9.829 11.286 -0.364 1.00 0.00 H new ATOM 0 HB3 GLU A 938 10.207 12.831 -1.099 1.00 0.00 H new ATOM 0 HG2 GLU A 938 12.378 12.116 -0.839 1.00 0.00 H new ATOM 0 HG3 GLU A 938 12.180 12.767 0.776 1.00 0.00 H new ATOM 375 N MET A 939 7.778 14.021 -0.098 1.00 0.00 N ATOM 376 CA MET A 939 6.987 15.132 -0.599 1.00 0.00 C ATOM 377 C MET A 939 6.909 16.259 0.433 1.00 0.00 C ATOM 378 O MET A 939 7.397 17.361 0.191 1.00 0.00 O ATOM 379 CB MET A 939 5.575 14.645 -0.931 1.00 0.00 C ATOM 380 CG MET A 939 5.550 13.910 -2.273 1.00 0.00 C ATOM 381 SD MET A 939 3.993 13.061 -2.475 1.00 0.00 S ATOM 382 CE MET A 939 2.873 14.449 -2.417 1.00 0.00 C ATOM 0 H MET A 939 7.368 13.100 -0.255 1.00 0.00 H new ATOM 0 HA MET A 939 7.468 15.520 -1.497 1.00 0.00 H new ATOM 0 HB2 MET A 939 5.220 13.982 -0.142 1.00 0.00 H new ATOM 0 HB3 MET A 939 4.892 15.494 -0.964 1.00 0.00 H new ATOM 0 HG2 MET A 939 5.695 14.619 -3.088 1.00 0.00 H new ATOM 0 HG3 MET A 939 6.372 13.196 -2.321 1.00 0.00 H new ATOM 0 HE1 MET A 939 1.850 14.087 -2.314 1.00 0.00 H new ATOM 0 HE2 MET A 939 3.121 15.082 -1.565 1.00 0.00 H new ATOM 0 HE3 MET A 939 2.963 15.028 -3.336 1.00 0.00 H new ATOM 392 N SER A 940 6.291 15.942 1.561 1.00 0.00 N ATOM 393 CA SER A 940 6.142 16.915 2.631 1.00 0.00 C ATOM 394 C SER A 940 7.448 17.689 2.819 1.00 0.00 C ATOM 395 O SER A 940 7.431 18.902 3.021 1.00 0.00 O ATOM 396 CB SER A 940 5.734 16.235 3.940 1.00 0.00 C ATOM 397 OG SER A 940 4.397 15.746 3.893 1.00 0.00 O ATOM 0 H SER A 940 5.888 15.026 1.758 1.00 0.00 H new ATOM 0 HA SER A 940 5.351 17.612 2.353 1.00 0.00 H new ATOM 0 HB2 SER A 940 6.415 15.409 4.147 1.00 0.00 H new ATOM 0 HB3 SER A 940 5.832 16.943 4.763 1.00 0.00 H new ATOM 0 HG SER A 940 4.175 15.318 4.746 1.00 0.00 H new ATOM 403 N SER A 941 8.550 16.955 2.748 1.00 0.00 N ATOM 404 CA SER A 941 9.862 17.558 2.908 1.00 0.00 C ATOM 405 C SER A 941 10.069 18.649 1.855 1.00 0.00 C ATOM 406 O SER A 941 10.184 19.827 2.191 1.00 0.00 O ATOM 407 CB SER A 941 10.968 16.505 2.805 1.00 0.00 C ATOM 408 OG SER A 941 12.188 16.954 3.389 1.00 0.00 O ATOM 0 H SER A 941 8.560 15.949 2.582 1.00 0.00 H new ATOM 0 HA SER A 941 9.914 18.005 3.901 1.00 0.00 H new ATOM 0 HB2 SER A 941 10.644 15.589 3.300 1.00 0.00 H new ATOM 0 HB3 SER A 941 11.137 16.258 1.757 1.00 0.00 H new ATOM 0 HG SER A 941 12.868 16.254 3.305 1.00 0.00 H new ATOM 414 N LYS A 942 10.109 18.218 0.603 1.00 0.00 N ATOM 415 CA LYS A 942 10.300 19.144 -0.501 1.00 0.00 C ATOM 416 C LYS A 942 8.939 19.673 -0.958 1.00 0.00 C ATOM 417 O LYS A 942 8.752 19.979 -2.135 1.00 0.00 O ATOM 418 CB LYS A 942 11.111 18.485 -1.619 1.00 0.00 C ATOM 419 CG LYS A 942 10.364 17.283 -2.202 1.00 0.00 C ATOM 420 CD LYS A 942 10.045 17.502 -3.682 1.00 0.00 C ATOM 421 CE LYS A 942 8.613 17.070 -4.004 1.00 0.00 C ATOM 422 NZ LYS A 942 8.591 15.675 -4.498 1.00 0.00 N ATOM 0 H LYS A 942 10.012 17.240 0.328 1.00 0.00 H new ATOM 0 HA LYS A 942 10.886 20.005 -0.179 1.00 0.00 H new ATOM 0 HB2 LYS A 942 11.309 19.212 -2.407 1.00 0.00 H new ATOM 0 HB3 LYS A 942 12.078 18.164 -1.231 1.00 0.00 H new ATOM 0 HG2 LYS A 942 10.968 16.383 -2.086 1.00 0.00 H new ATOM 0 HG3 LYS A 942 9.440 17.120 -1.647 1.00 0.00 H new ATOM 0 HD2 LYS A 942 10.177 18.554 -3.934 1.00 0.00 H new ATOM 0 HD3 LYS A 942 10.746 16.937 -4.296 1.00 0.00 H new ATOM 0 HE2 LYS A 942 7.992 17.156 -3.113 1.00 0.00 H new ATOM 0 HE3 LYS A 942 8.187 17.735 -4.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 7.617 15.312 -4.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 8.943 15.648 -5.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 9.198 15.084 -3.895 1.00 0.00 H new ATOM 436 N ILE A 943 8.025 19.765 -0.004 1.00 0.00 N ATOM 437 CA ILE A 943 6.687 20.252 -0.294 1.00 0.00 C ATOM 438 C ILE A 943 6.617 21.749 0.012 1.00 0.00 C ATOM 439 O ILE A 943 6.321 22.554 -0.870 1.00 0.00 O ATOM 440 CB ILE A 943 5.641 19.422 0.453 1.00 0.00 C ATOM 441 CG1 ILE A 943 4.869 18.517 -0.510 1.00 0.00 C ATOM 442 CG2 ILE A 943 4.708 20.320 1.268 1.00 0.00 C ATOM 443 CD1 ILE A 943 3.585 19.197 -0.990 1.00 0.00 C ATOM 0 H ILE A 943 8.184 19.511 0.971 1.00 0.00 H new ATOM 0 HA ILE A 943 6.459 20.131 -1.353 1.00 0.00 H new ATOM 0 HB ILE A 943 6.160 18.773 1.158 1.00 0.00 H new ATOM 0 HG12 ILE A 943 5.497 18.271 -1.366 1.00 0.00 H new ATOM 0 HG13 ILE A 943 4.624 17.578 -0.015 1.00 0.00 H new ATOM 0 HG21 ILE A 943 3.974 19.705 1.789 1.00 0.00 H new ATOM 0 HG22 ILE A 943 5.291 20.885 1.996 1.00 0.00 H new ATOM 0 HG23 ILE A 943 4.193 21.011 0.600 1.00 0.00 H new ATOM 0 HD11 ILE A 943 3.055 18.533 -1.673 1.00 0.00 H new ATOM 0 HD12 ILE A 943 2.949 19.419 -0.133 1.00 0.00 H new ATOM 0 HD13 ILE A 943 3.835 20.124 -1.506 1.00 0.00 H new ATOM 455 N GLN A 944 6.893 22.078 1.266 1.00 0.00 N ATOM 456 CA GLN A 944 6.865 23.465 1.699 1.00 0.00 C ATOM 457 C GLN A 944 7.546 24.359 0.661 1.00 0.00 C ATOM 458 O GLN A 944 6.993 25.381 0.259 1.00 0.00 O ATOM 459 CB GLN A 944 7.519 23.623 3.073 1.00 0.00 C ATOM 460 CG GLN A 944 6.532 24.206 4.086 1.00 0.00 C ATOM 461 CD GLN A 944 7.235 25.169 5.045 1.00 0.00 C ATOM 462 OE1 GLN A 944 8.431 25.096 5.274 1.00 0.00 O ATOM 463 NE2 GLN A 944 6.427 26.074 5.591 1.00 0.00 N ATOM 0 H GLN A 944 7.137 21.408 1.995 1.00 0.00 H new ATOM 0 HA GLN A 944 5.824 23.776 1.790 1.00 0.00 H new ATOM 0 HB2 GLN A 944 7.876 22.654 3.423 1.00 0.00 H new ATOM 0 HB3 GLN A 944 8.390 24.273 2.993 1.00 0.00 H new ATOM 0 HG2 GLN A 944 5.733 24.729 3.561 1.00 0.00 H new ATOM 0 HG3 GLN A 944 6.067 23.399 4.652 1.00 0.00 H new ATOM 0 HE21 GLN A 944 5.434 26.079 5.356 1.00 0.00 H new ATOM 0 HE22 GLN A 944 6.800 26.762 6.245 1.00 0.00 H new ATOM 472 N PRO A 945 8.768 23.931 0.247 1.00 0.00 N ATOM 473 CA PRO A 945 9.531 24.682 -0.736 1.00 0.00 C ATOM 474 C PRO A 945 8.951 24.494 -2.140 1.00 0.00 C ATOM 475 O PRO A 945 8.777 25.462 -2.878 1.00 0.00 O ATOM 476 CB PRO A 945 10.955 24.165 -0.608 1.00 0.00 C ATOM 477 CG PRO A 945 10.850 22.829 0.108 1.00 0.00 C ATOM 478 CD PRO A 945 9.455 22.725 0.702 1.00 0.00 C ATOM 0 HA PRO A 945 9.495 25.758 -0.564 1.00 0.00 H new ATOM 0 HB2 PRO A 945 11.418 24.048 -1.588 1.00 0.00 H new ATOM 0 HB3 PRO A 945 11.575 24.863 -0.045 1.00 0.00 H new ATOM 0 HG2 PRO A 945 11.031 22.009 -0.587 1.00 0.00 H new ATOM 0 HG3 PRO A 945 11.605 22.756 0.891 1.00 0.00 H new ATOM 0 HD2 PRO A 945 8.945 21.825 0.359 1.00 0.00 H new ATOM 0 HD3 PRO A 945 9.491 22.676 1.790 1.00 0.00 H new ATOM 486 N ALA A 946 8.667 23.241 -2.465 1.00 0.00 N ATOM 487 CA ALA A 946 8.111 22.914 -3.767 1.00 0.00 C ATOM 488 C ALA A 946 7.130 24.011 -4.188 1.00 0.00 C ATOM 489 O ALA A 946 6.209 24.344 -3.444 1.00 0.00 O ATOM 490 CB ALA A 946 7.452 21.534 -3.708 1.00 0.00 C ATOM 0 H ALA A 946 8.811 22.441 -1.849 1.00 0.00 H new ATOM 0 HA ALA A 946 8.898 22.868 -4.520 1.00 0.00 H new ATOM 0 HB1 ALA A 946 7.035 21.288 -4.684 1.00 0.00 H new ATOM 0 HB2 ALA A 946 8.196 20.787 -3.433 1.00 0.00 H new ATOM 0 HB3 ALA A 946 6.655 21.543 -2.965 1.00 0.00 H new ATOM 496 N PRO A 947 7.367 24.555 -5.411 1.00 0.00 N ATOM 497 CA PRO A 947 6.516 25.607 -5.939 1.00 0.00 C ATOM 498 C PRO A 947 5.176 25.042 -6.413 1.00 0.00 C ATOM 499 O PRO A 947 4.959 23.832 -6.371 1.00 0.00 O ATOM 500 CB PRO A 947 7.323 26.241 -7.061 1.00 0.00 C ATOM 501 CG PRO A 947 8.397 25.228 -7.425 1.00 0.00 C ATOM 502 CD PRO A 947 8.449 24.186 -6.320 1.00 0.00 C ATOM 0 HA PRO A 947 6.252 26.351 -5.187 1.00 0.00 H new ATOM 0 HB2 PRO A 947 6.690 26.465 -7.920 1.00 0.00 H new ATOM 0 HB3 PRO A 947 7.767 27.183 -6.739 1.00 0.00 H new ATOM 0 HG2 PRO A 947 8.170 24.758 -8.382 1.00 0.00 H new ATOM 0 HG3 PRO A 947 9.364 25.719 -7.532 1.00 0.00 H new ATOM 0 HD2 PRO A 947 8.307 23.181 -6.717 1.00 0.00 H new ATOM 0 HD3 PRO A 947 9.413 24.195 -5.812 1.00 0.00 H new ATOM 510 N PRO A 948 4.289 25.968 -6.866 1.00 0.00 N ATOM 511 CA PRO A 948 2.976 25.574 -7.347 1.00 0.00 C ATOM 512 C PRO A 948 3.069 24.935 -8.735 1.00 0.00 C ATOM 513 O PRO A 948 2.121 24.302 -9.195 1.00 0.00 O ATOM 514 CB PRO A 948 2.153 26.852 -7.336 1.00 0.00 C ATOM 515 CG PRO A 948 3.156 27.993 -7.295 1.00 0.00 C ATOM 516 CD PRO A 948 4.512 27.409 -6.931 1.00 0.00 C ATOM 0 HA PRO A 948 2.511 24.811 -6.723 1.00 0.00 H new ATOM 0 HB2 PRO A 948 1.522 26.918 -8.223 1.00 0.00 H new ATOM 0 HB3 PRO A 948 1.491 26.883 -6.471 1.00 0.00 H new ATOM 0 HG2 PRO A 948 3.203 28.494 -8.262 1.00 0.00 H new ATOM 0 HG3 PRO A 948 2.853 28.741 -6.562 1.00 0.00 H new ATOM 0 HD2 PRO A 948 5.265 27.660 -7.678 1.00 0.00 H new ATOM 0 HD3 PRO A 948 4.868 27.798 -5.977 1.00 0.00 H new ATOM 524 N GLU A 949 4.221 25.124 -9.361 1.00 0.00 N ATOM 525 CA GLU A 949 4.451 24.574 -10.686 1.00 0.00 C ATOM 526 C GLU A 949 5.076 23.181 -10.582 1.00 0.00 C ATOM 527 O GLU A 949 5.071 22.420 -11.549 1.00 0.00 O ATOM 528 CB GLU A 949 5.328 25.507 -11.523 1.00 0.00 C ATOM 529 CG GLU A 949 4.561 26.042 -12.734 1.00 0.00 C ATOM 530 CD GLU A 949 5.519 26.613 -13.781 1.00 0.00 C ATOM 531 OE1 GLU A 949 5.933 27.778 -13.597 1.00 0.00 O ATOM 532 OE2 GLU A 949 5.816 25.871 -14.743 1.00 0.00 O ATOM 0 H GLU A 949 5.005 25.650 -8.975 1.00 0.00 H new ATOM 0 HA GLU A 949 3.490 24.483 -11.191 1.00 0.00 H new ATOM 0 HB2 GLU A 949 5.670 26.339 -10.908 1.00 0.00 H new ATOM 0 HB3 GLU A 949 6.217 24.973 -11.858 1.00 0.00 H new ATOM 0 HG2 GLU A 949 3.968 25.241 -13.176 1.00 0.00 H new ATOM 0 HG3 GLU A 949 3.863 26.816 -12.414 1.00 0.00 H new ATOM 539 N GLU A 950 5.599 22.889 -9.400 1.00 0.00 N ATOM 540 CA GLU A 950 6.226 21.601 -9.157 1.00 0.00 C ATOM 541 C GLU A 950 5.404 20.792 -8.152 1.00 0.00 C ATOM 542 O GLU A 950 5.659 19.605 -7.949 1.00 0.00 O ATOM 543 CB GLU A 950 7.667 21.776 -8.672 1.00 0.00 C ATOM 544 CG GLU A 950 8.632 20.928 -9.504 1.00 0.00 C ATOM 545 CD GLU A 950 9.667 21.807 -10.208 1.00 0.00 C ATOM 546 OE1 GLU A 950 10.726 22.045 -9.588 1.00 0.00 O ATOM 547 OE2 GLU A 950 9.376 22.221 -11.351 1.00 0.00 O ATOM 0 H GLU A 950 5.601 23.522 -8.600 1.00 0.00 H new ATOM 0 HA GLU A 950 6.258 21.051 -10.097 1.00 0.00 H new ATOM 0 HB2 GLU A 950 7.951 22.826 -8.737 1.00 0.00 H new ATOM 0 HB3 GLU A 950 7.739 21.491 -7.622 1.00 0.00 H new ATOM 0 HG2 GLU A 950 9.138 20.209 -8.860 1.00 0.00 H new ATOM 0 HG3 GLU A 950 8.073 20.355 -10.244 1.00 0.00 H new ATOM 554 N TYR A 951 4.435 21.465 -7.550 1.00 0.00 N ATOM 555 CA TYR A 951 3.574 20.823 -6.572 1.00 0.00 C ATOM 556 C TYR A 951 2.321 20.248 -7.237 1.00 0.00 C ATOM 557 O TYR A 951 1.874 19.157 -6.888 1.00 0.00 O ATOM 558 CB TYR A 951 3.158 21.921 -5.591 1.00 0.00 C ATOM 559 CG TYR A 951 2.156 21.461 -4.530 1.00 0.00 C ATOM 560 CD1 TYR A 951 0.868 21.126 -4.896 1.00 0.00 C ATOM 561 CD2 TYR A 951 2.540 21.381 -3.207 1.00 0.00 C ATOM 562 CE1 TYR A 951 -0.074 20.693 -3.898 1.00 0.00 C ATOM 563 CE2 TYR A 951 1.597 20.948 -2.208 1.00 0.00 C ATOM 564 CZ TYR A 951 0.336 20.625 -2.603 1.00 0.00 C ATOM 565 OH TYR A 951 -0.554 20.217 -1.660 1.00 0.00 O ATOM 0 H TYR A 951 4.227 22.449 -7.721 1.00 0.00 H new ATOM 0 HA TYR A 951 4.096 20.001 -6.083 1.00 0.00 H new ATOM 0 HB2 TYR A 951 4.048 22.305 -5.093 1.00 0.00 H new ATOM 0 HB3 TYR A 951 2.724 22.749 -6.151 1.00 0.00 H new ATOM 0 HD1 TYR A 951 0.567 21.189 -5.931 1.00 0.00 H new ATOM 0 HD2 TYR A 951 3.548 21.643 -2.921 1.00 0.00 H new ATOM 0 HE1 TYR A 951 -1.085 20.428 -4.171 1.00 0.00 H new ATOM 0 HE2 TYR A 951 1.885 20.881 -1.169 1.00 0.00 H new ATOM 0 HH TYR A 951 -0.121 20.216 -0.781 1.00 0.00 H new ATOM 575 N VAL A 952 1.790 21.010 -8.182 1.00 0.00 N ATOM 576 CA VAL A 952 0.598 20.590 -8.899 1.00 0.00 C ATOM 577 C VAL A 952 0.785 19.156 -9.397 1.00 0.00 C ATOM 578 O VAL A 952 -0.095 18.314 -9.222 1.00 0.00 O ATOM 579 CB VAL A 952 0.290 21.578 -10.026 1.00 0.00 C ATOM 580 CG1 VAL A 952 -0.113 20.842 -11.306 1.00 0.00 C ATOM 581 CG2 VAL A 952 -0.792 22.574 -9.602 1.00 0.00 C ATOM 0 H VAL A 952 2.163 21.915 -8.468 1.00 0.00 H new ATOM 0 HA VAL A 952 -0.267 20.593 -8.236 1.00 0.00 H new ATOM 0 HB VAL A 952 1.200 22.141 -10.236 1.00 0.00 H new ATOM 0 HG11 VAL A 952 -0.326 21.567 -12.091 1.00 0.00 H new ATOM 0 HG12 VAL A 952 0.702 20.192 -11.624 1.00 0.00 H new ATOM 0 HG13 VAL A 952 -1.002 20.241 -11.116 1.00 0.00 H new ATOM 0 HG21 VAL A 952 -0.992 23.265 -10.421 1.00 0.00 H new ATOM 0 HG22 VAL A 952 -1.705 22.034 -9.351 1.00 0.00 H new ATOM 0 HG23 VAL A 952 -0.451 23.133 -8.731 1.00 0.00 H new ATOM 591 N PRO A 953 1.968 18.914 -10.023 1.00 0.00 N ATOM 592 CA PRO A 953 2.283 17.596 -10.547 1.00 0.00 C ATOM 593 C PRO A 953 2.643 16.629 -9.418 1.00 0.00 C ATOM 594 O PRO A 953 2.177 15.491 -9.397 1.00 0.00 O ATOM 595 CB PRO A 953 3.426 17.823 -11.523 1.00 0.00 C ATOM 596 CG PRO A 953 4.016 19.177 -11.165 1.00 0.00 C ATOM 597 CD PRO A 953 3.034 19.886 -10.248 1.00 0.00 C ATOM 0 HA PRO A 953 1.436 17.129 -11.049 1.00 0.00 H new ATOM 0 HB2 PRO A 953 4.175 17.036 -11.438 1.00 0.00 H new ATOM 0 HB3 PRO A 953 3.068 17.813 -12.553 1.00 0.00 H new ATOM 0 HG2 PRO A 953 4.980 19.055 -10.671 1.00 0.00 H new ATOM 0 HG3 PRO A 953 4.192 19.767 -12.065 1.00 0.00 H new ATOM 0 HD2 PRO A 953 3.508 20.178 -9.311 1.00 0.00 H new ATOM 0 HD3 PRO A 953 2.649 20.796 -10.708 1.00 0.00 H new ATOM 605 N MET A 954 3.471 17.117 -8.505 1.00 0.00 N ATOM 606 CA MET A 954 3.899 16.310 -7.375 1.00 0.00 C ATOM 607 C MET A 954 2.780 15.374 -6.915 1.00 0.00 C ATOM 608 O MET A 954 2.992 14.170 -6.773 1.00 0.00 O ATOM 609 CB MET A 954 4.307 17.226 -6.219 1.00 0.00 C ATOM 610 CG MET A 954 5.236 16.498 -5.245 1.00 0.00 C ATOM 611 SD MET A 954 4.941 17.069 -3.580 1.00 0.00 S ATOM 612 CE MET A 954 5.458 18.770 -3.739 1.00 0.00 C ATOM 0 H MET A 954 3.857 18.061 -8.525 1.00 0.00 H new ATOM 0 HA MET A 954 4.749 15.703 -7.687 1.00 0.00 H new ATOM 0 HB2 MET A 954 4.807 18.112 -6.611 1.00 0.00 H new ATOM 0 HB3 MET A 954 3.417 17.570 -5.691 1.00 0.00 H new ATOM 0 HG2 MET A 954 5.069 15.423 -5.305 1.00 0.00 H new ATOM 0 HG3 MET A 954 6.276 16.675 -5.520 1.00 0.00 H new ATOM 0 HE1 MET A 954 6.268 18.971 -3.038 1.00 0.00 H new ATOM 0 HE2 MET A 954 5.805 18.951 -4.756 1.00 0.00 H new ATOM 0 HE3 MET A 954 4.617 19.428 -3.520 1.00 0.00 H new ATOM 622 N VAL A 955 1.614 15.961 -6.694 1.00 0.00 N ATOM 623 CA VAL A 955 0.461 15.195 -6.252 1.00 0.00 C ATOM 624 C VAL A 955 -0.039 14.323 -7.406 1.00 0.00 C ATOM 625 O VAL A 955 -0.203 13.114 -7.249 1.00 0.00 O ATOM 626 CB VAL A 955 -0.614 16.135 -5.703 1.00 0.00 C ATOM 627 CG1 VAL A 955 -1.978 15.444 -5.665 1.00 0.00 C ATOM 628 CG2 VAL A 955 -0.227 16.662 -4.320 1.00 0.00 C ATOM 0 H VAL A 955 1.442 16.959 -6.813 1.00 0.00 H new ATOM 0 HA VAL A 955 0.736 14.527 -5.435 1.00 0.00 H new ATOM 0 HB VAL A 955 -0.689 16.988 -6.377 1.00 0.00 H new ATOM 0 HG11 VAL A 955 -2.724 16.134 -5.271 1.00 0.00 H new ATOM 0 HG12 VAL A 955 -2.261 15.141 -6.673 1.00 0.00 H new ATOM 0 HG13 VAL A 955 -1.922 14.564 -5.024 1.00 0.00 H new ATOM 0 HG21 VAL A 955 -1.008 17.328 -3.953 1.00 0.00 H new ATOM 0 HG22 VAL A 955 -0.110 15.825 -3.631 1.00 0.00 H new ATOM 0 HG23 VAL A 955 0.713 17.209 -4.389 1.00 0.00 H new ATOM 638 N LYS A 956 -0.267 14.971 -8.538 1.00 0.00 N ATOM 639 CA LYS A 956 -0.745 14.270 -9.718 1.00 0.00 C ATOM 640 C LYS A 956 0.048 12.973 -9.892 1.00 0.00 C ATOM 641 O LYS A 956 -0.520 11.934 -10.224 1.00 0.00 O ATOM 642 CB LYS A 956 -0.700 15.188 -10.942 1.00 0.00 C ATOM 643 CG LYS A 956 -2.111 15.547 -11.411 1.00 0.00 C ATOM 644 CD LYS A 956 -2.250 17.055 -11.626 1.00 0.00 C ATOM 645 CE LYS A 956 -2.545 17.375 -13.093 1.00 0.00 C ATOM 646 NZ LYS A 956 -3.376 18.595 -13.201 1.00 0.00 N ATOM 0 H LYS A 956 -0.130 15.974 -8.664 1.00 0.00 H new ATOM 0 HA LYS A 956 -1.791 13.990 -9.597 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -0.152 16.098 -10.698 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -0.159 14.696 -11.750 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -2.334 15.022 -12.340 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -2.840 15.213 -10.673 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -3.051 17.443 -10.997 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -1.332 17.556 -11.318 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -1.610 17.516 -13.636 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -3.060 16.535 -13.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -3.567 18.798 -14.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -4.276 18.448 -12.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -2.870 19.398 -12.776 1.00 0.00 H new ATOM 660 N GLU A 957 1.348 13.077 -9.660 1.00 0.00 N ATOM 661 CA GLU A 957 2.225 11.925 -9.787 1.00 0.00 C ATOM 662 C GLU A 957 1.779 10.812 -8.837 1.00 0.00 C ATOM 663 O GLU A 957 1.522 9.689 -9.269 1.00 0.00 O ATOM 664 CB GLU A 957 3.682 12.314 -9.530 1.00 0.00 C ATOM 665 CG GLU A 957 4.452 12.456 -10.844 1.00 0.00 C ATOM 666 CD GLU A 957 4.559 13.924 -11.261 1.00 0.00 C ATOM 667 OE1 GLU A 957 5.484 14.593 -10.751 1.00 0.00 O ATOM 668 OE2 GLU A 957 3.714 14.345 -12.081 1.00 0.00 O ATOM 0 H GLU A 957 1.815 13.941 -9.385 1.00 0.00 H new ATOM 0 HA GLU A 957 2.158 11.553 -10.809 1.00 0.00 H new ATOM 0 HB2 GLU A 957 3.719 13.254 -8.979 1.00 0.00 H new ATOM 0 HB3 GLU A 957 4.159 11.559 -8.905 1.00 0.00 H new ATOM 0 HG2 GLU A 957 5.450 12.032 -10.732 1.00 0.00 H new ATOM 0 HG3 GLU A 957 3.950 11.887 -11.627 1.00 0.00 H new ATOM 675 N VAL A 958 1.701 11.161 -7.562 1.00 0.00 N ATOM 676 CA VAL A 958 1.291 10.205 -6.547 1.00 0.00 C ATOM 677 C VAL A 958 0.143 9.352 -7.091 1.00 0.00 C ATOM 678 O VAL A 958 0.249 8.128 -7.152 1.00 0.00 O ATOM 679 CB VAL A 958 0.930 10.937 -5.253 1.00 0.00 C ATOM 680 CG1 VAL A 958 0.356 9.969 -4.217 1.00 0.00 C ATOM 681 CG2 VAL A 958 2.140 11.687 -4.692 1.00 0.00 C ATOM 0 H VAL A 958 1.915 12.093 -7.208 1.00 0.00 H new ATOM 0 HA VAL A 958 2.112 9.530 -6.304 1.00 0.00 H new ATOM 0 HB VAL A 958 0.160 11.672 -5.487 1.00 0.00 H new ATOM 0 HG11 VAL A 958 0.108 10.515 -3.307 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -0.544 9.501 -4.616 1.00 0.00 H new ATOM 0 HG13 VAL A 958 1.094 9.200 -3.989 1.00 0.00 H new ATOM 0 HG21 VAL A 958 1.856 12.199 -3.772 1.00 0.00 H new ATOM 0 HG22 VAL A 958 2.941 10.979 -4.481 1.00 0.00 H new ATOM 0 HG23 VAL A 958 2.485 12.418 -5.423 1.00 0.00 H new ATOM 691 N GLY A 959 -0.928 10.033 -7.472 1.00 0.00 N ATOM 692 CA GLY A 959 -2.095 9.353 -8.009 1.00 0.00 C ATOM 693 C GLY A 959 -1.686 8.268 -9.008 1.00 0.00 C ATOM 694 O GLY A 959 -2.152 7.133 -8.923 1.00 0.00 O ATOM 0 H GLY A 959 -1.012 11.048 -7.420 1.00 0.00 H new ATOM 0 HA2 GLY A 959 -2.667 8.906 -7.195 1.00 0.00 H new ATOM 0 HA3 GLY A 959 -2.748 10.075 -8.498 1.00 0.00 H new ATOM 698 N LEU A 960 -0.820 8.657 -9.933 1.00 0.00 N ATOM 699 CA LEU A 960 -0.344 7.732 -10.947 1.00 0.00 C ATOM 700 C LEU A 960 0.208 6.477 -10.268 1.00 0.00 C ATOM 701 O LEU A 960 -0.217 5.364 -10.573 1.00 0.00 O ATOM 702 CB LEU A 960 0.660 8.423 -11.872 1.00 0.00 C ATOM 703 CG LEU A 960 0.323 8.399 -13.365 1.00 0.00 C ATOM 704 CD1 LEU A 960 0.583 9.763 -14.007 1.00 0.00 C ATOM 705 CD2 LEU A 960 1.077 7.276 -14.079 1.00 0.00 C ATOM 0 H LEU A 960 -0.436 9.600 -10.001 1.00 0.00 H new ATOM 0 HA LEU A 960 -1.166 7.412 -11.588 1.00 0.00 H new ATOM 0 HB2 LEU A 960 0.757 9.462 -11.558 1.00 0.00 H new ATOM 0 HB3 LEU A 960 1.635 7.955 -11.732 1.00 0.00 H new ATOM 0 HG LEU A 960 -0.741 8.190 -13.472 1.00 0.00 H new ATOM 0 HD11 LEU A 960 0.336 9.719 -15.068 1.00 0.00 H new ATOM 0 HD12 LEU A 960 -0.036 10.518 -13.521 1.00 0.00 H new ATOM 0 HD13 LEU A 960 1.634 10.026 -13.890 1.00 0.00 H new ATOM 0 HD21 LEU A 960 0.820 7.281 -15.138 1.00 0.00 H new ATOM 0 HD22 LEU A 960 2.150 7.429 -13.966 1.00 0.00 H new ATOM 0 HD23 LEU A 960 0.799 6.317 -13.643 1.00 0.00 H new ATOM 717 N ALA A 961 1.148 6.699 -9.360 1.00 0.00 N ATOM 718 CA ALA A 961 1.762 5.599 -8.635 1.00 0.00 C ATOM 719 C ALA A 961 0.669 4.670 -8.103 1.00 0.00 C ATOM 720 O ALA A 961 0.643 3.485 -8.432 1.00 0.00 O ATOM 721 CB ALA A 961 2.648 6.156 -7.519 1.00 0.00 C ATOM 0 H ALA A 961 1.499 7.624 -9.110 1.00 0.00 H new ATOM 0 HA ALA A 961 2.399 5.012 -9.296 1.00 0.00 H new ATOM 0 HB1 ALA A 961 3.109 5.332 -6.975 1.00 0.00 H new ATOM 0 HB2 ALA A 961 3.426 6.785 -7.952 1.00 0.00 H new ATOM 0 HB3 ALA A 961 2.041 6.749 -6.834 1.00 0.00 H new ATOM 727 N LEU A 962 -0.207 5.244 -7.291 1.00 0.00 N ATOM 728 CA LEU A 962 -1.300 4.482 -6.711 1.00 0.00 C ATOM 729 C LEU A 962 -2.069 3.771 -7.826 1.00 0.00 C ATOM 730 O LEU A 962 -2.390 2.589 -7.708 1.00 0.00 O ATOM 731 CB LEU A 962 -2.176 5.382 -5.837 1.00 0.00 C ATOM 732 CG LEU A 962 -1.511 5.950 -4.582 1.00 0.00 C ATOM 733 CD1 LEU A 962 -1.409 7.475 -4.658 1.00 0.00 C ATOM 734 CD2 LEU A 962 -2.239 5.487 -3.318 1.00 0.00 C ATOM 0 H LEU A 962 -0.182 6.227 -7.021 1.00 0.00 H new ATOM 0 HA LEU A 962 -0.914 3.709 -6.046 1.00 0.00 H new ATOM 0 HB2 LEU A 962 -2.528 6.215 -6.446 1.00 0.00 H new ATOM 0 HB3 LEU A 962 -3.056 4.815 -5.533 1.00 0.00 H new ATOM 0 HG LEU A 962 -0.494 5.561 -4.529 1.00 0.00 H new ATOM 0 HD11 LEU A 962 -0.933 7.853 -3.754 1.00 0.00 H new ATOM 0 HD12 LEU A 962 -0.814 7.757 -5.527 1.00 0.00 H new ATOM 0 HD13 LEU A 962 -2.408 7.902 -4.748 1.00 0.00 H new ATOM 0 HD21 LEU A 962 -1.746 5.905 -2.440 1.00 0.00 H new ATOM 0 HD22 LEU A 962 -3.274 5.827 -3.349 1.00 0.00 H new ATOM 0 HD23 LEU A 962 -2.216 4.399 -3.263 1.00 0.00 H new ATOM 746 N ARG A 963 -2.342 4.520 -8.884 1.00 0.00 N ATOM 747 CA ARG A 963 -3.067 3.977 -10.019 1.00 0.00 C ATOM 748 C ARG A 963 -2.467 2.633 -10.439 1.00 0.00 C ATOM 749 O ARG A 963 -3.171 1.626 -10.496 1.00 0.00 O ATOM 750 CB ARG A 963 -3.029 4.938 -11.209 1.00 0.00 C ATOM 751 CG ARG A 963 -4.295 4.811 -12.058 1.00 0.00 C ATOM 752 CD ARG A 963 -5.300 5.912 -11.712 1.00 0.00 C ATOM 753 NE ARG A 963 -6.673 5.361 -11.708 1.00 0.00 N ATOM 754 CZ ARG A 963 -7.717 5.951 -11.110 1.00 0.00 C ATOM 755 NH1 ARG A 963 -7.551 7.112 -10.463 1.00 0.00 N ATOM 756 NH2 ARG A 963 -8.928 5.378 -11.158 1.00 0.00 N ATOM 0 H ARG A 963 -2.074 5.499 -8.979 1.00 0.00 H new ATOM 0 HA ARG A 963 -4.104 3.837 -9.713 1.00 0.00 H new ATOM 0 HB2 ARG A 963 -2.929 5.962 -10.850 1.00 0.00 H new ATOM 0 HB3 ARG A 963 -2.153 4.728 -11.823 1.00 0.00 H new ATOM 0 HG2 ARG A 963 -4.036 4.870 -13.115 1.00 0.00 H new ATOM 0 HG3 ARG A 963 -4.750 3.834 -11.895 1.00 0.00 H new ATOM 0 HD2 ARG A 963 -5.066 6.335 -10.735 1.00 0.00 H new ATOM 0 HD3 ARG A 963 -5.227 6.723 -12.436 1.00 0.00 H new ATOM 0 HE ARG A 963 -6.835 4.477 -12.190 1.00 0.00 H new ATOM 0 HH11 ARG A 963 -6.629 7.548 -10.425 1.00 0.00 H new ATOM 0 HH12 ARG A 963 -8.346 7.561 -10.008 1.00 0.00 H new ATOM 0 HH21 ARG A 963 -9.054 4.493 -11.650 1.00 0.00 H new ATOM 0 HH22 ARG A 963 -9.723 5.827 -10.703 1.00 0.00 H new ATOM 770 N THR A 964 -1.173 2.662 -10.721 1.00 0.00 N ATOM 771 CA THR A 964 -0.470 1.458 -11.133 1.00 0.00 C ATOM 772 C THR A 964 -0.578 0.381 -10.052 1.00 0.00 C ATOM 773 O THR A 964 -0.760 -0.796 -10.359 1.00 0.00 O ATOM 774 CB THR A 964 0.973 1.844 -11.465 1.00 0.00 C ATOM 775 OG1 THR A 964 0.882 2.458 -12.748 1.00 0.00 O ATOM 776 CG2 THR A 964 1.866 0.624 -11.699 1.00 0.00 C ATOM 0 H THR A 964 -0.593 3.500 -10.673 1.00 0.00 H new ATOM 0 HA THR A 964 -0.919 1.023 -12.026 1.00 0.00 H new ATOM 0 HB THR A 964 1.384 2.445 -10.653 1.00 0.00 H new ATOM 0 HG1 THR A 964 1.774 2.741 -13.039 1.00 0.00 H new ATOM 0 HG21 THR A 964 2.879 0.954 -11.931 1.00 0.00 H new ATOM 0 HG22 THR A 964 1.882 0.007 -10.801 1.00 0.00 H new ATOM 0 HG23 THR A 964 1.474 0.041 -12.533 1.00 0.00 H new ATOM 784 N LEU A 965 -0.460 0.823 -8.808 1.00 0.00 N ATOM 785 CA LEU A 965 -0.542 -0.089 -7.679 1.00 0.00 C ATOM 786 C LEU A 965 -1.855 -0.871 -7.755 1.00 0.00 C ATOM 787 O LEU A 965 -1.852 -2.101 -7.718 1.00 0.00 O ATOM 788 CB LEU A 965 -0.353 0.669 -6.364 1.00 0.00 C ATOM 789 CG LEU A 965 -0.476 -0.164 -5.086 1.00 0.00 C ATOM 790 CD1 LEU A 965 0.543 -1.306 -5.076 1.00 0.00 C ATOM 791 CD2 LEU A 965 -0.360 0.719 -3.842 1.00 0.00 C ATOM 0 H LEU A 965 -0.308 1.800 -8.557 1.00 0.00 H new ATOM 0 HA LEU A 965 0.267 -0.819 -7.719 1.00 0.00 H new ATOM 0 HB2 LEU A 965 0.631 1.137 -6.376 1.00 0.00 H new ATOM 0 HB3 LEU A 965 -1.088 1.473 -6.322 1.00 0.00 H new ATOM 0 HG LEU A 965 -1.467 -0.617 -5.067 1.00 0.00 H new ATOM 0 HD11 LEU A 965 0.434 -1.882 -4.157 1.00 0.00 H new ATOM 0 HD12 LEU A 965 0.370 -1.955 -5.934 1.00 0.00 H new ATOM 0 HD13 LEU A 965 1.551 -0.895 -5.129 1.00 0.00 H new ATOM 0 HD21 LEU A 965 -0.451 0.102 -2.948 1.00 0.00 H new ATOM 0 HD22 LEU A 965 0.608 1.220 -3.840 1.00 0.00 H new ATOM 0 HD23 LEU A 965 -1.155 1.465 -3.850 1.00 0.00 H new ATOM 803 N LEU A 966 -2.946 -0.126 -7.861 1.00 0.00 N ATOM 804 CA LEU A 966 -4.263 -0.734 -7.943 1.00 0.00 C ATOM 805 C LEU A 966 -4.204 -1.942 -8.880 1.00 0.00 C ATOM 806 O LEU A 966 -4.577 -3.050 -8.494 1.00 0.00 O ATOM 807 CB LEU A 966 -5.309 0.306 -8.345 1.00 0.00 C ATOM 808 CG LEU A 966 -5.898 1.141 -7.206 1.00 0.00 C ATOM 809 CD1 LEU A 966 -4.828 2.030 -6.568 1.00 0.00 C ATOM 810 CD2 LEU A 966 -7.104 1.951 -7.686 1.00 0.00 C ATOM 0 H LEU A 966 -2.944 0.894 -7.892 1.00 0.00 H new ATOM 0 HA LEU A 966 -4.574 -1.103 -6.966 1.00 0.00 H new ATOM 0 HB2 LEU A 966 -4.858 0.984 -9.070 1.00 0.00 H new ATOM 0 HB3 LEU A 966 -6.126 -0.207 -8.853 1.00 0.00 H new ATOM 0 HG LEU A 966 -6.255 0.460 -6.433 1.00 0.00 H new ATOM 0 HD11 LEU A 966 -5.273 2.613 -5.761 1.00 0.00 H new ATOM 0 HD12 LEU A 966 -4.029 1.407 -6.167 1.00 0.00 H new ATOM 0 HD13 LEU A 966 -4.419 2.704 -7.320 1.00 0.00 H new ATOM 0 HD21 LEU A 966 -7.503 2.535 -6.857 1.00 0.00 H new ATOM 0 HD22 LEU A 966 -6.796 2.622 -8.488 1.00 0.00 H new ATOM 0 HD23 LEU A 966 -7.873 1.273 -8.056 1.00 0.00 H new ATOM 822 N ALA A 967 -3.735 -1.688 -10.092 1.00 0.00 N ATOM 823 CA ALA A 967 -3.623 -2.741 -11.087 1.00 0.00 C ATOM 824 C ALA A 967 -2.687 -3.833 -10.565 1.00 0.00 C ATOM 825 O ALA A 967 -3.019 -5.017 -10.616 1.00 0.00 O ATOM 826 CB ALA A 967 -3.142 -2.144 -12.411 1.00 0.00 C ATOM 0 H ALA A 967 -3.428 -0.768 -10.408 1.00 0.00 H new ATOM 0 HA ALA A 967 -4.594 -3.200 -11.271 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -3.058 -2.934 -13.157 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -3.857 -1.396 -12.754 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -2.168 -1.676 -12.267 1.00 0.00 H new ATOM 832 N THR A 968 -1.536 -3.397 -10.076 1.00 0.00 N ATOM 833 CA THR A 968 -0.549 -4.322 -9.545 1.00 0.00 C ATOM 834 C THR A 968 -1.175 -5.208 -8.466 1.00 0.00 C ATOM 835 O THR A 968 -0.929 -6.413 -8.428 1.00 0.00 O ATOM 836 CB THR A 968 0.644 -3.505 -9.044 1.00 0.00 C ATOM 837 OG1 THR A 968 0.950 -2.635 -10.131 1.00 0.00 O ATOM 838 CG2 THR A 968 1.906 -4.354 -8.880 1.00 0.00 C ATOM 0 H THR A 968 -1.264 -2.415 -10.036 1.00 0.00 H new ATOM 0 HA THR A 968 -0.192 -5.005 -10.316 1.00 0.00 H new ATOM 0 HB THR A 968 0.392 -3.041 -8.091 1.00 0.00 H new ATOM 0 HG1 THR A 968 0.534 -1.761 -9.978 1.00 0.00 H new ATOM 0 HG21 THR A 968 2.723 -3.727 -8.523 1.00 0.00 H new ATOM 0 HG22 THR A 968 1.718 -5.150 -8.160 1.00 0.00 H new ATOM 0 HG23 THR A 968 2.178 -4.791 -9.841 1.00 0.00 H new ATOM 846 N VAL A 969 -1.972 -4.577 -7.617 1.00 0.00 N ATOM 847 CA VAL A 969 -2.635 -5.293 -6.540 1.00 0.00 C ATOM 848 C VAL A 969 -3.466 -6.434 -7.128 1.00 0.00 C ATOM 849 O VAL A 969 -3.415 -7.561 -6.638 1.00 0.00 O ATOM 850 CB VAL A 969 -3.464 -4.321 -5.698 1.00 0.00 C ATOM 851 CG1 VAL A 969 -3.913 -4.974 -4.389 1.00 0.00 C ATOM 852 CG2 VAL A 969 -2.690 -3.029 -5.430 1.00 0.00 C ATOM 0 H VAL A 969 -2.174 -3.578 -7.653 1.00 0.00 H new ATOM 0 HA VAL A 969 -1.901 -5.739 -5.869 1.00 0.00 H new ATOM 0 HB VAL A 969 -4.357 -4.063 -6.267 1.00 0.00 H new ATOM 0 HG11 VAL A 969 -4.500 -4.262 -3.810 1.00 0.00 H new ATOM 0 HG12 VAL A 969 -4.521 -5.851 -4.610 1.00 0.00 H new ATOM 0 HG13 VAL A 969 -3.038 -5.275 -3.814 1.00 0.00 H new ATOM 0 HG21 VAL A 969 -3.302 -2.356 -4.830 1.00 0.00 H new ATOM 0 HG22 VAL A 969 -1.771 -3.260 -4.892 1.00 0.00 H new ATOM 0 HG23 VAL A 969 -2.445 -2.549 -6.377 1.00 0.00 H new ATOM 862 N ASP A 970 -4.213 -6.103 -8.171 1.00 0.00 N ATOM 863 CA ASP A 970 -5.054 -7.086 -8.832 1.00 0.00 C ATOM 864 C ASP A 970 -4.234 -8.346 -9.114 1.00 0.00 C ATOM 865 O ASP A 970 -4.735 -9.461 -8.979 1.00 0.00 O ATOM 866 CB ASP A 970 -5.579 -6.554 -10.167 1.00 0.00 C ATOM 867 CG ASP A 970 -6.620 -7.441 -10.853 1.00 0.00 C ATOM 868 OD1 ASP A 970 -7.684 -7.653 -10.230 1.00 0.00 O ATOM 869 OD2 ASP A 970 -6.330 -7.888 -11.983 1.00 0.00 O ATOM 0 H ASP A 970 -4.253 -5.167 -8.575 1.00 0.00 H new ATOM 0 HA ASP A 970 -5.896 -7.305 -8.175 1.00 0.00 H new ATOM 0 HB2 ASP A 970 -6.015 -5.569 -10.002 1.00 0.00 H new ATOM 0 HB3 ASP A 970 -4.736 -6.420 -10.844 1.00 0.00 H new ATOM 874 N GLU A 971 -2.986 -8.126 -9.502 1.00 0.00 N ATOM 875 CA GLU A 971 -2.091 -9.230 -9.805 1.00 0.00 C ATOM 876 C GLU A 971 -1.584 -9.872 -8.512 1.00 0.00 C ATOM 877 O GLU A 971 -1.193 -11.038 -8.506 1.00 0.00 O ATOM 878 CB GLU A 971 -0.925 -8.766 -10.680 1.00 0.00 C ATOM 879 CG GLU A 971 -1.364 -8.604 -12.137 1.00 0.00 C ATOM 880 CD GLU A 971 -0.163 -8.677 -13.083 1.00 0.00 C ATOM 881 OE1 GLU A 971 0.822 -7.958 -12.806 1.00 0.00 O ATOM 882 OE2 GLU A 971 -0.257 -9.450 -14.061 1.00 0.00 O ATOM 0 H GLU A 971 -2.574 -7.200 -9.613 1.00 0.00 H new ATOM 0 HA GLU A 971 -2.648 -9.980 -10.367 1.00 0.00 H new ATOM 0 HB2 GLU A 971 -0.539 -7.818 -10.305 1.00 0.00 H new ATOM 0 HB3 GLU A 971 -0.111 -9.488 -10.620 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -2.081 -9.384 -12.393 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -1.873 -7.649 -12.263 1.00 0.00 H new ATOM 889 N SER A 972 -1.608 -9.083 -7.448 1.00 0.00 N ATOM 890 CA SER A 972 -1.156 -9.560 -6.152 1.00 0.00 C ATOM 891 C SER A 972 -2.301 -10.269 -5.426 1.00 0.00 C ATOM 892 O SER A 972 -2.067 -11.136 -4.586 1.00 0.00 O ATOM 893 CB SER A 972 -0.618 -8.410 -5.299 1.00 0.00 C ATOM 894 OG SER A 972 0.712 -8.656 -4.849 1.00 0.00 O ATOM 0 H SER A 972 -1.933 -8.116 -7.457 1.00 0.00 H new ATOM 0 HA SER A 972 -0.343 -10.268 -6.313 1.00 0.00 H new ATOM 0 HB2 SER A 972 -0.640 -7.487 -5.879 1.00 0.00 H new ATOM 0 HB3 SER A 972 -1.270 -8.261 -4.438 1.00 0.00 H new ATOM 0 HG SER A 972 0.962 -7.981 -4.184 1.00 0.00 H new ATOM 900 N LEU A 973 -3.516 -9.874 -5.778 1.00 0.00 N ATOM 901 CA LEU A 973 -4.699 -10.461 -5.170 1.00 0.00 C ATOM 902 C LEU A 973 -4.517 -11.976 -5.071 1.00 0.00 C ATOM 903 O LEU A 973 -4.710 -12.560 -4.005 1.00 0.00 O ATOM 904 CB LEU A 973 -5.957 -10.041 -5.933 1.00 0.00 C ATOM 905 CG LEU A 973 -7.100 -9.479 -5.085 1.00 0.00 C ATOM 906 CD1 LEU A 973 -8.459 -9.895 -5.652 1.00 0.00 C ATOM 907 CD2 LEU A 973 -6.943 -9.883 -3.618 1.00 0.00 C ATOM 0 H LEU A 973 -3.707 -9.155 -6.476 1.00 0.00 H new ATOM 0 HA LEU A 973 -4.831 -10.088 -4.154 1.00 0.00 H new ATOM 0 HB2 LEU A 973 -5.676 -9.290 -6.672 1.00 0.00 H new ATOM 0 HB3 LEU A 973 -6.330 -10.905 -6.483 1.00 0.00 H new ATOM 0 HG LEU A 973 -7.054 -8.391 -5.126 1.00 0.00 H new ATOM 0 HD11 LEU A 973 -9.254 -9.483 -5.031 1.00 0.00 H new ATOM 0 HD12 LEU A 973 -8.560 -9.517 -6.669 1.00 0.00 H new ATOM 0 HD13 LEU A 973 -8.532 -10.983 -5.660 1.00 0.00 H new ATOM 0 HD21 LEU A 973 -7.768 -9.471 -3.037 1.00 0.00 H new ATOM 0 HD22 LEU A 973 -6.950 -10.970 -3.537 1.00 0.00 H new ATOM 0 HD23 LEU A 973 -5.999 -9.496 -3.233 1.00 0.00 H new ATOM 919 N PRO A 974 -4.138 -12.587 -6.225 1.00 0.00 N ATOM 920 CA PRO A 974 -3.928 -14.024 -6.278 1.00 0.00 C ATOM 921 C PRO A 974 -2.612 -14.411 -5.601 1.00 0.00 C ATOM 922 O PRO A 974 -2.520 -15.463 -4.971 1.00 0.00 O ATOM 923 CB PRO A 974 -3.960 -14.372 -7.757 1.00 0.00 C ATOM 924 CG PRO A 974 -3.722 -13.067 -8.498 1.00 0.00 C ATOM 925 CD PRO A 974 -3.901 -11.929 -7.507 1.00 0.00 C ATOM 0 HA PRO A 974 -4.691 -14.581 -5.735 1.00 0.00 H new ATOM 0 HB2 PRO A 974 -3.192 -15.106 -8.002 1.00 0.00 H new ATOM 0 HB3 PRO A 974 -4.919 -14.809 -8.035 1.00 0.00 H new ATOM 0 HG2 PRO A 974 -2.719 -13.048 -8.924 1.00 0.00 H new ATOM 0 HG3 PRO A 974 -4.423 -12.965 -9.327 1.00 0.00 H new ATOM 0 HD2 PRO A 974 -3.016 -11.295 -7.469 1.00 0.00 H new ATOM 0 HD3 PRO A 974 -4.739 -11.290 -7.785 1.00 0.00 H new ATOM 933 N VAL A 975 -1.626 -13.539 -5.755 1.00 0.00 N ATOM 934 CA VAL A 975 -0.319 -13.776 -5.166 1.00 0.00 C ATOM 935 C VAL A 975 -0.492 -14.214 -3.710 1.00 0.00 C ATOM 936 O VAL A 975 0.300 -15.004 -3.198 1.00 0.00 O ATOM 937 CB VAL A 975 0.556 -12.530 -5.316 1.00 0.00 C ATOM 938 CG1 VAL A 975 1.679 -12.521 -4.277 1.00 0.00 C ATOM 939 CG2 VAL A 975 1.121 -12.424 -6.734 1.00 0.00 C ATOM 0 H VAL A 975 -1.706 -12.668 -6.279 1.00 0.00 H new ATOM 0 HA VAL A 975 0.195 -14.583 -5.689 1.00 0.00 H new ATOM 0 HB VAL A 975 -0.072 -11.657 -5.139 1.00 0.00 H new ATOM 0 HG11 VAL A 975 2.286 -11.625 -4.405 1.00 0.00 H new ATOM 0 HG12 VAL A 975 1.248 -12.527 -3.276 1.00 0.00 H new ATOM 0 HG13 VAL A 975 2.304 -13.405 -4.409 1.00 0.00 H new ATOM 0 HG21 VAL A 975 1.739 -11.530 -6.813 1.00 0.00 H new ATOM 0 HG22 VAL A 975 1.726 -13.304 -6.951 1.00 0.00 H new ATOM 0 HG23 VAL A 975 0.301 -12.363 -7.449 1.00 0.00 H new ATOM 949 N LEU A 976 -1.531 -13.681 -3.085 1.00 0.00 N ATOM 950 CA LEU A 976 -1.818 -14.007 -1.698 1.00 0.00 C ATOM 951 C LEU A 976 -3.082 -14.866 -1.632 1.00 0.00 C ATOM 952 O LEU A 976 -3.996 -14.696 -2.437 1.00 0.00 O ATOM 953 CB LEU A 976 -1.894 -12.733 -0.854 1.00 0.00 C ATOM 954 CG LEU A 976 -0.721 -11.762 -0.997 1.00 0.00 C ATOM 955 CD1 LEU A 976 0.616 -12.490 -0.843 1.00 0.00 C ATOM 956 CD2 LEU A 976 -0.805 -10.991 -2.317 1.00 0.00 C ATOM 0 H LEU A 976 -2.185 -13.026 -3.513 1.00 0.00 H new ATOM 0 HA LEU A 976 -1.009 -14.598 -1.269 1.00 0.00 H new ATOM 0 HB2 LEU A 976 -2.811 -12.204 -1.113 1.00 0.00 H new ATOM 0 HB3 LEU A 976 -1.976 -13.020 0.194 1.00 0.00 H new ATOM 0 HG LEU A 976 -0.784 -11.030 -0.192 1.00 0.00 H new ATOM 0 HD11 LEU A 976 1.433 -11.776 -0.949 1.00 0.00 H new ATOM 0 HD12 LEU A 976 0.666 -12.955 0.142 1.00 0.00 H new ATOM 0 HD13 LEU A 976 0.703 -13.258 -1.612 1.00 0.00 H new ATOM 0 HD21 LEU A 976 0.041 -10.308 -2.394 1.00 0.00 H new ATOM 0 HD22 LEU A 976 -0.781 -11.693 -3.151 1.00 0.00 H new ATOM 0 HD23 LEU A 976 -1.735 -10.423 -2.348 1.00 0.00 H new ATOM 968 N PRO A 977 -3.095 -15.794 -0.638 1.00 0.00 N ATOM 969 CA PRO A 977 -4.232 -16.680 -0.455 1.00 0.00 C ATOM 970 C PRO A 977 -5.410 -15.936 0.177 1.00 0.00 C ATOM 971 O PRO A 977 -5.234 -14.867 0.759 1.00 0.00 O ATOM 972 CB PRO A 977 -3.712 -17.814 0.412 1.00 0.00 C ATOM 973 CG PRO A 977 -2.443 -17.291 1.066 1.00 0.00 C ATOM 974 CD PRO A 977 -2.031 -16.024 0.335 1.00 0.00 C ATOM 0 HA PRO A 977 -4.622 -17.064 -1.398 1.00 0.00 H new ATOM 0 HB2 PRO A 977 -4.448 -18.101 1.163 1.00 0.00 H new ATOM 0 HB3 PRO A 977 -3.506 -18.701 -0.187 1.00 0.00 H new ATOM 0 HG2 PRO A 977 -2.615 -17.084 2.122 1.00 0.00 H new ATOM 0 HG3 PRO A 977 -1.650 -18.037 1.013 1.00 0.00 H new ATOM 0 HD2 PRO A 977 -1.935 -15.184 1.023 1.00 0.00 H new ATOM 0 HD3 PRO A 977 -1.065 -16.146 -0.156 1.00 0.00 H new ATOM 982 N ALA A 978 -6.586 -16.532 0.042 1.00 0.00 N ATOM 983 CA ALA A 978 -7.793 -15.940 0.593 1.00 0.00 C ATOM 984 C ALA A 978 -7.568 -15.614 2.071 1.00 0.00 C ATOM 985 O ALA A 978 -6.521 -15.939 2.629 1.00 0.00 O ATOM 986 CB ALA A 978 -8.972 -16.890 0.378 1.00 0.00 C ATOM 0 H ALA A 978 -6.728 -17.419 -0.441 1.00 0.00 H new ATOM 0 HA ALA A 978 -8.030 -15.007 0.082 1.00 0.00 H new ATOM 0 HB1 ALA A 978 -9.877 -16.446 0.791 1.00 0.00 H new ATOM 0 HB2 ALA A 978 -9.108 -17.065 -0.689 1.00 0.00 H new ATOM 0 HB3 ALA A 978 -8.772 -17.837 0.878 1.00 0.00 H new ATOM 992 N SER A 979 -8.567 -14.977 2.663 1.00 0.00 N ATOM 993 CA SER A 979 -8.491 -14.604 4.065 1.00 0.00 C ATOM 994 C SER A 979 -7.823 -13.235 4.207 1.00 0.00 C ATOM 995 O SER A 979 -7.941 -12.588 5.247 1.00 0.00 O ATOM 996 CB SER A 979 -7.727 -15.654 4.873 1.00 0.00 C ATOM 997 OG SER A 979 -8.171 -15.714 6.226 1.00 0.00 O ATOM 0 H SER A 979 -9.434 -14.710 2.197 1.00 0.00 H new ATOM 0 HA SER A 979 -9.505 -14.548 4.460 1.00 0.00 H new ATOM 0 HB2 SER A 979 -7.852 -16.631 4.407 1.00 0.00 H new ATOM 0 HB3 SER A 979 -6.662 -15.424 4.851 1.00 0.00 H new ATOM 0 HG SER A 979 -7.660 -16.397 6.708 1.00 0.00 H new ATOM 1003 N THR A 980 -7.137 -12.834 3.147 1.00 0.00 N ATOM 1004 CA THR A 980 -6.450 -11.554 3.141 1.00 0.00 C ATOM 1005 C THR A 980 -7.051 -10.631 2.078 1.00 0.00 C ATOM 1006 O THR A 980 -6.842 -9.420 2.113 1.00 0.00 O ATOM 1007 CB THR A 980 -4.956 -11.819 2.940 1.00 0.00 C ATOM 1008 OG1 THR A 980 -4.331 -10.601 3.334 1.00 0.00 O ATOM 1009 CG2 THR A 980 -4.582 -11.971 1.464 1.00 0.00 C ATOM 0 H THR A 980 -7.042 -13.373 2.286 1.00 0.00 H new ATOM 0 HA THR A 980 -6.578 -11.033 4.090 1.00 0.00 H new ATOM 0 HB THR A 980 -4.671 -12.721 3.481 1.00 0.00 H new ATOM 0 HG1 THR A 980 -3.825 -10.746 4.160 1.00 0.00 H new ATOM 0 HG21 THR A 980 -3.512 -12.157 1.377 1.00 0.00 H new ATOM 0 HG22 THR A 980 -5.132 -12.808 1.034 1.00 0.00 H new ATOM 0 HG23 THR A 980 -4.836 -11.056 0.928 1.00 0.00 H new ATOM 1017 N HIS A 981 -7.786 -11.240 1.159 1.00 0.00 N ATOM 1018 CA HIS A 981 -8.419 -10.489 0.089 1.00 0.00 C ATOM 1019 C HIS A 981 -9.426 -9.501 0.681 1.00 0.00 C ATOM 1020 O HIS A 981 -9.337 -8.298 0.441 1.00 0.00 O ATOM 1021 CB HIS A 981 -9.047 -11.431 -0.939 1.00 0.00 C ATOM 1022 CG HIS A 981 -8.109 -12.500 -1.447 1.00 0.00 C ATOM 1023 ND1 HIS A 981 -8.552 -13.716 -1.936 1.00 0.00 N ATOM 1024 CD2 HIS A 981 -6.748 -12.522 -1.536 1.00 0.00 C ATOM 1025 CE1 HIS A 981 -7.497 -14.430 -2.300 1.00 0.00 C ATOM 1026 NE2 HIS A 981 -6.380 -13.688 -2.051 1.00 0.00 N ATOM 0 H HIS A 981 -7.957 -12.245 1.134 1.00 0.00 H new ATOM 0 HA HIS A 981 -7.667 -9.910 -0.447 1.00 0.00 H new ATOM 0 HB2 HIS A 981 -9.919 -11.909 -0.493 1.00 0.00 H new ATOM 0 HB3 HIS A 981 -9.404 -10.843 -1.785 1.00 0.00 H new ATOM 0 HD2 HIS A 981 -6.083 -11.725 -1.238 1.00 0.00 H new ATOM 0 HE1 HIS A 981 -7.518 -15.425 -2.720 1.00 0.00 H new ATOM 0 HE2 HIS A 981 -5.420 -13.981 -2.231 1.00 0.00 H new ATOM 1034 N ARG A 982 -10.362 -10.046 1.445 1.00 0.00 N ATOM 1035 CA ARG A 982 -11.385 -9.228 2.074 1.00 0.00 C ATOM 1036 C ARG A 982 -10.787 -7.904 2.551 1.00 0.00 C ATOM 1037 O ARG A 982 -11.010 -6.861 1.938 1.00 0.00 O ATOM 1038 CB ARG A 982 -12.015 -9.954 3.264 1.00 0.00 C ATOM 1039 CG ARG A 982 -13.068 -9.077 3.946 1.00 0.00 C ATOM 1040 CD ARG A 982 -12.860 -9.048 5.461 1.00 0.00 C ATOM 1041 NE ARG A 982 -13.067 -10.400 6.027 1.00 0.00 N ATOM 1042 CZ ARG A 982 -12.581 -10.802 7.209 1.00 0.00 C ATOM 1043 NH1 ARG A 982 -11.857 -9.959 7.957 1.00 0.00 N ATOM 1044 NH2 ARG A 982 -12.819 -12.048 7.642 1.00 0.00 N ATOM 0 H ARG A 982 -10.433 -11.044 1.642 1.00 0.00 H new ATOM 0 HA ARG A 982 -12.158 -9.034 1.331 1.00 0.00 H new ATOM 0 HB2 ARG A 982 -12.474 -10.883 2.926 1.00 0.00 H new ATOM 0 HB3 ARG A 982 -11.240 -10.223 3.982 1.00 0.00 H new ATOM 0 HG2 ARG A 982 -13.015 -8.063 3.549 1.00 0.00 H new ATOM 0 HG3 ARG A 982 -14.064 -9.456 3.719 1.00 0.00 H new ATOM 0 HD2 ARG A 982 -11.854 -8.699 5.691 1.00 0.00 H new ATOM 0 HD3 ARG A 982 -13.555 -8.343 5.918 1.00 0.00 H new ATOM 0 HE ARG A 982 -13.614 -11.067 5.483 1.00 0.00 H new ATOM 0 HH11 ARG A 982 -11.676 -9.011 7.627 1.00 0.00 H new ATOM 0 HH12 ARG A 982 -11.487 -10.265 8.857 1.00 0.00 H new ATOM 0 HH21 ARG A 982 -13.370 -12.690 7.072 1.00 0.00 H new ATOM 0 HH22 ARG A 982 -12.449 -12.355 8.542 1.00 0.00 H new ATOM 1058 N GLU A 983 -10.038 -7.988 3.641 1.00 0.00 N ATOM 1059 CA GLU A 983 -9.406 -6.808 4.207 1.00 0.00 C ATOM 1060 C GLU A 983 -8.642 -6.044 3.124 1.00 0.00 C ATOM 1061 O GLU A 983 -8.667 -4.815 3.092 1.00 0.00 O ATOM 1062 CB GLU A 983 -8.483 -7.185 5.368 1.00 0.00 C ATOM 1063 CG GLU A 983 -9.264 -7.282 6.680 1.00 0.00 C ATOM 1064 CD GLU A 983 -8.339 -7.651 7.842 1.00 0.00 C ATOM 1065 OE1 GLU A 983 -8.129 -8.868 8.036 1.00 0.00 O ATOM 1066 OE2 GLU A 983 -7.864 -6.707 8.510 1.00 0.00 O ATOM 0 H GLU A 983 -9.855 -8.854 4.147 1.00 0.00 H new ATOM 0 HA GLU A 983 -10.185 -6.156 4.602 1.00 0.00 H new ATOM 0 HB2 GLU A 983 -7.999 -8.139 5.157 1.00 0.00 H new ATOM 0 HB3 GLU A 983 -7.693 -6.441 5.465 1.00 0.00 H new ATOM 0 HG2 GLU A 983 -9.753 -6.330 6.888 1.00 0.00 H new ATOM 0 HG3 GLU A 983 -10.051 -8.030 6.585 1.00 0.00 H new ATOM 1073 N ILE A 984 -7.980 -6.804 2.264 1.00 0.00 N ATOM 1074 CA ILE A 984 -7.209 -6.213 1.183 1.00 0.00 C ATOM 1075 C ILE A 984 -8.113 -5.291 0.363 1.00 0.00 C ATOM 1076 O ILE A 984 -7.781 -4.128 0.140 1.00 0.00 O ATOM 1077 CB ILE A 984 -6.528 -7.303 0.353 1.00 0.00 C ATOM 1078 CG1 ILE A 984 -5.175 -7.687 0.956 1.00 0.00 C ATOM 1079 CG2 ILE A 984 -6.403 -6.880 -1.112 1.00 0.00 C ATOM 1080 CD1 ILE A 984 -4.670 -9.008 0.373 1.00 0.00 C ATOM 0 H ILE A 984 -7.961 -7.823 2.294 1.00 0.00 H new ATOM 0 HA ILE A 984 -6.403 -5.598 1.582 1.00 0.00 H new ATOM 0 HB ILE A 984 -7.156 -8.193 0.378 1.00 0.00 H new ATOM 0 HG12 ILE A 984 -4.449 -6.898 0.761 1.00 0.00 H new ATOM 0 HG13 ILE A 984 -5.267 -7.775 2.039 1.00 0.00 H new ATOM 0 HG21 ILE A 984 -5.916 -7.673 -1.679 1.00 0.00 H new ATOM 0 HG22 ILE A 984 -7.395 -6.697 -1.524 1.00 0.00 H new ATOM 0 HG23 ILE A 984 -5.809 -5.969 -1.178 1.00 0.00 H new ATOM 0 HD11 ILE A 984 -3.707 -9.258 0.818 1.00 0.00 H new ATOM 0 HD12 ILE A 984 -5.387 -9.800 0.591 1.00 0.00 H new ATOM 0 HD13 ILE A 984 -4.556 -8.909 -0.706 1.00 0.00 H new ATOM 1092 N GLU A 985 -9.239 -5.844 -0.063 1.00 0.00 N ATOM 1093 CA GLU A 985 -10.194 -5.086 -0.853 1.00 0.00 C ATOM 1094 C GLU A 985 -10.527 -3.764 -0.158 1.00 0.00 C ATOM 1095 O GLU A 985 -10.604 -2.721 -0.805 1.00 0.00 O ATOM 1096 CB GLU A 985 -11.461 -5.902 -1.115 1.00 0.00 C ATOM 1097 CG GLU A 985 -11.996 -5.648 -2.525 1.00 0.00 C ATOM 1098 CD GLU A 985 -13.381 -4.999 -2.478 1.00 0.00 C ATOM 1099 OE1 GLU A 985 -13.567 -4.121 -1.608 1.00 0.00 O ATOM 1100 OE2 GLU A 985 -14.222 -5.397 -3.312 1.00 0.00 O ATOM 0 H GLU A 985 -9.512 -6.809 0.124 1.00 0.00 H new ATOM 0 HA GLU A 985 -9.740 -4.863 -1.819 1.00 0.00 H new ATOM 0 HB2 GLU A 985 -11.247 -6.963 -0.990 1.00 0.00 H new ATOM 0 HB3 GLU A 985 -12.223 -5.642 -0.381 1.00 0.00 H new ATOM 0 HG2 GLU A 985 -11.306 -5.002 -3.069 1.00 0.00 H new ATOM 0 HG3 GLU A 985 -12.050 -6.589 -3.072 1.00 0.00 H new ATOM 1107 N MET A 986 -10.715 -3.851 1.150 1.00 0.00 N ATOM 1108 CA MET A 986 -11.038 -2.675 1.940 1.00 0.00 C ATOM 1109 C MET A 986 -9.827 -1.747 2.062 1.00 0.00 C ATOM 1110 O MET A 986 -9.981 -0.535 2.200 1.00 0.00 O ATOM 1111 CB MET A 986 -11.493 -3.106 3.335 1.00 0.00 C ATOM 1112 CG MET A 986 -12.930 -3.631 3.305 1.00 0.00 C ATOM 1113 SD MET A 986 -13.786 -3.155 4.798 1.00 0.00 S ATOM 1114 CE MET A 986 -15.328 -2.585 4.103 1.00 0.00 C ATOM 0 H MET A 986 -10.650 -4.718 1.683 1.00 0.00 H new ATOM 0 HA MET A 986 -11.839 -2.132 1.438 1.00 0.00 H new ATOM 0 HB2 MET A 986 -10.827 -3.880 3.716 1.00 0.00 H new ATOM 0 HB3 MET A 986 -11.425 -2.262 4.021 1.00 0.00 H new ATOM 0 HG2 MET A 986 -13.453 -3.235 2.434 1.00 0.00 H new ATOM 0 HG3 MET A 986 -12.927 -4.717 3.208 1.00 0.00 H new ATOM 0 HE1 MET A 986 -15.986 -2.249 4.904 1.00 0.00 H new ATOM 0 HE2 MET A 986 -15.135 -1.758 3.420 1.00 0.00 H new ATOM 0 HE3 MET A 986 -15.806 -3.400 3.560 1.00 0.00 H new ATOM 1124 N ALA A 987 -8.650 -2.353 2.007 1.00 0.00 N ATOM 1125 CA ALA A 987 -7.414 -1.596 2.109 1.00 0.00 C ATOM 1126 C ALA A 987 -7.242 -0.736 0.856 1.00 0.00 C ATOM 1127 O ALA A 987 -6.635 0.333 0.911 1.00 0.00 O ATOM 1128 CB ALA A 987 -6.242 -2.558 2.321 1.00 0.00 C ATOM 0 H ALA A 987 -8.526 -3.359 1.893 1.00 0.00 H new ATOM 0 HA ALA A 987 -7.445 -0.925 2.967 1.00 0.00 H new ATOM 0 HB1 ALA A 987 -5.315 -1.990 2.398 1.00 0.00 H new ATOM 0 HB2 ALA A 987 -6.398 -3.124 3.239 1.00 0.00 H new ATOM 0 HB3 ALA A 987 -6.178 -3.245 1.477 1.00 0.00 H new ATOM 1134 N GLN A 988 -7.787 -1.233 -0.244 1.00 0.00 N ATOM 1135 CA GLN A 988 -7.702 -0.523 -1.509 1.00 0.00 C ATOM 1136 C GLN A 988 -8.568 0.737 -1.469 1.00 0.00 C ATOM 1137 O GLN A 988 -8.105 1.824 -1.814 1.00 0.00 O ATOM 1138 CB GLN A 988 -8.105 -1.429 -2.674 1.00 0.00 C ATOM 1139 CG GLN A 988 -7.125 -2.594 -2.828 1.00 0.00 C ATOM 1140 CD GLN A 988 -6.408 -2.533 -4.178 1.00 0.00 C ATOM 1141 OE1 GLN A 988 -5.317 -1.772 -4.178 1.00 0.00 O flip ATOM 1142 NE2 GLN A 988 -6.819 -3.136 -5.156 1.00 0.00 N flip ATOM 0 H GLN A 988 -8.290 -2.120 -0.286 1.00 0.00 H new ATOM 0 HA GLN A 988 -6.666 -0.223 -1.667 1.00 0.00 H new ATOM 0 HB2 GLN A 988 -9.111 -1.815 -2.508 1.00 0.00 H new ATOM 0 HB3 GLN A 988 -8.134 -0.849 -3.597 1.00 0.00 H new ATOM 0 HG2 GLN A 988 -6.392 -2.566 -2.022 1.00 0.00 H new ATOM 0 HG3 GLN A 988 -7.661 -3.539 -2.739 1.00 0.00 H new ATOM 0 HE21 GLN A 988 -7.664 -3.703 -5.087 1.00 0.00 H new ATOM 0 HE22 GLN A 988 -6.318 -3.073 -6.042 1.00 0.00 H new ATOM 1151 N LYS A 989 -9.810 0.551 -1.046 1.00 0.00 N ATOM 1152 CA LYS A 989 -10.744 1.660 -0.957 1.00 0.00 C ATOM 1153 C LYS A 989 -10.198 2.704 0.018 1.00 0.00 C ATOM 1154 O LYS A 989 -10.404 3.902 -0.170 1.00 0.00 O ATOM 1155 CB LYS A 989 -12.143 1.154 -0.597 1.00 0.00 C ATOM 1156 CG LYS A 989 -13.212 2.180 -0.979 1.00 0.00 C ATOM 1157 CD LYS A 989 -14.253 2.326 0.133 1.00 0.00 C ATOM 1158 CE LYS A 989 -15.542 2.952 -0.403 1.00 0.00 C ATOM 1159 NZ LYS A 989 -15.443 4.429 -0.398 1.00 0.00 N ATOM 0 H LYS A 989 -10.191 -0.351 -0.761 1.00 0.00 H new ATOM 0 HA LYS A 989 -10.847 2.151 -1.925 1.00 0.00 H new ATOM 0 HB2 LYS A 989 -12.337 0.213 -1.111 1.00 0.00 H new ATOM 0 HB3 LYS A 989 -12.196 0.949 0.472 1.00 0.00 H new ATOM 0 HG2 LYS A 989 -12.743 3.145 -1.172 1.00 0.00 H new ATOM 0 HG3 LYS A 989 -13.702 1.873 -1.903 1.00 0.00 H new ATOM 0 HD2 LYS A 989 -14.471 1.348 0.563 1.00 0.00 H new ATOM 0 HD3 LYS A 989 -13.850 2.945 0.935 1.00 0.00 H new ATOM 0 HE2 LYS A 989 -15.731 2.598 -1.416 1.00 0.00 H new ATOM 0 HE3 LYS A 989 -16.388 2.636 0.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 -16.326 4.837 -0.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 -15.285 4.763 0.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 -14.648 4.726 -1.000 1.00 0.00 H new ATOM 1173 N LEU A 990 -9.512 2.212 1.039 1.00 0.00 N ATOM 1174 CA LEU A 990 -8.935 3.088 2.045 1.00 0.00 C ATOM 1175 C LEU A 990 -7.843 3.945 1.402 1.00 0.00 C ATOM 1176 O LEU A 990 -7.807 5.159 1.594 1.00 0.00 O ATOM 1177 CB LEU A 990 -8.452 2.277 3.249 1.00 0.00 C ATOM 1178 CG LEU A 990 -9.087 2.631 4.595 1.00 0.00 C ATOM 1179 CD1 LEU A 990 -8.559 1.722 5.706 1.00 0.00 C ATOM 1180 CD2 LEU A 990 -8.888 4.112 4.922 1.00 0.00 C ATOM 0 H LEU A 990 -9.343 1.218 1.191 1.00 0.00 H new ATOM 0 HA LEU A 990 -9.690 3.771 2.434 1.00 0.00 H new ATOM 0 HB2 LEU A 990 -8.637 1.222 3.049 1.00 0.00 H new ATOM 0 HB3 LEU A 990 -7.372 2.400 3.335 1.00 0.00 H new ATOM 0 HG LEU A 990 -10.161 2.459 4.522 1.00 0.00 H new ATOM 0 HD11 LEU A 990 -9.026 1.995 6.652 1.00 0.00 H new ATOM 0 HD12 LEU A 990 -8.795 0.684 5.470 1.00 0.00 H new ATOM 0 HD13 LEU A 990 -7.478 1.838 5.788 1.00 0.00 H new ATOM 0 HD21 LEU A 990 -9.349 4.337 5.884 1.00 0.00 H new ATOM 0 HD22 LEU A 990 -7.822 4.334 4.969 1.00 0.00 H new ATOM 0 HD23 LEU A 990 -9.351 4.721 4.146 1.00 0.00 H new ATOM 1192 N LEU A 991 -6.978 3.279 0.651 1.00 0.00 N ATOM 1193 CA LEU A 991 -5.887 3.964 -0.021 1.00 0.00 C ATOM 1194 C LEU A 991 -6.458 5.052 -0.932 1.00 0.00 C ATOM 1195 O LEU A 991 -6.160 6.232 -0.759 1.00 0.00 O ATOM 1196 CB LEU A 991 -4.991 2.960 -0.749 1.00 0.00 C ATOM 1197 CG LEU A 991 -3.758 3.541 -1.443 1.00 0.00 C ATOM 1198 CD1 LEU A 991 -2.890 4.324 -0.455 1.00 0.00 C ATOM 1199 CD2 LEU A 991 -2.965 2.447 -2.160 1.00 0.00 C ATOM 0 H LEU A 991 -7.011 2.272 0.493 1.00 0.00 H new ATOM 0 HA LEU A 991 -5.244 4.461 0.706 1.00 0.00 H new ATOM 0 HB2 LEU A 991 -4.659 2.211 -0.030 1.00 0.00 H new ATOM 0 HB3 LEU A 991 -5.592 2.441 -1.495 1.00 0.00 H new ATOM 0 HG LEU A 991 -4.095 4.245 -2.204 1.00 0.00 H new ATOM 0 HD11 LEU A 991 -2.020 4.726 -0.974 1.00 0.00 H new ATOM 0 HD12 LEU A 991 -3.470 5.143 -0.031 1.00 0.00 H new ATOM 0 HD13 LEU A 991 -2.560 3.661 0.345 1.00 0.00 H new ATOM 0 HD21 LEU A 991 -2.094 2.888 -2.645 1.00 0.00 H new ATOM 0 HD22 LEU A 991 -2.639 1.700 -1.436 1.00 0.00 H new ATOM 0 HD23 LEU A 991 -3.597 1.972 -2.911 1.00 0.00 H new ATOM 1211 N ASN A 992 -7.270 4.615 -1.884 1.00 0.00 N ATOM 1212 CA ASN A 992 -7.886 5.537 -2.823 1.00 0.00 C ATOM 1213 C ASN A 992 -8.474 6.723 -2.056 1.00 0.00 C ATOM 1214 O ASN A 992 -8.175 7.875 -2.363 1.00 0.00 O ATOM 1215 CB ASN A 992 -9.022 4.861 -3.593 1.00 0.00 C ATOM 1216 CG ASN A 992 -9.329 5.613 -4.890 1.00 0.00 C ATOM 1217 OD1 ASN A 992 -8.820 6.691 -5.148 1.00 0.00 O ATOM 1218 ND2 ASN A 992 -10.188 4.986 -5.689 1.00 0.00 N ATOM 0 H ASN A 992 -7.515 3.635 -2.025 1.00 0.00 H new ATOM 0 HA ASN A 992 -7.120 5.865 -3.525 1.00 0.00 H new ATOM 0 HB2 ASN A 992 -8.749 3.831 -3.822 1.00 0.00 H new ATOM 0 HB3 ASN A 992 -9.916 4.823 -2.970 1.00 0.00 H new ATOM 0 HD21 ASN A 992 -10.457 5.406 -6.578 1.00 0.00 H new ATOM 0 HD22 ASN A 992 -10.577 4.085 -5.412 1.00 0.00 H new ATOM 1225 N SER A 993 -9.302 6.398 -1.073 1.00 0.00 N ATOM 1226 CA SER A 993 -9.935 7.423 -0.260 1.00 0.00 C ATOM 1227 C SER A 993 -8.936 8.541 0.045 1.00 0.00 C ATOM 1228 O SER A 993 -9.078 9.657 -0.451 1.00 0.00 O ATOM 1229 CB SER A 993 -10.483 6.832 1.041 1.00 0.00 C ATOM 1230 OG SER A 993 -11.850 7.176 1.249 1.00 0.00 O ATOM 0 H SER A 993 -9.549 5.441 -0.822 1.00 0.00 H new ATOM 0 HA SER A 993 -10.772 7.837 -0.822 1.00 0.00 H new ATOM 0 HB2 SER A 993 -10.382 5.747 1.017 1.00 0.00 H new ATOM 0 HB3 SER A 993 -9.887 7.189 1.881 1.00 0.00 H new ATOM 0 HG SER A 993 -12.163 6.779 2.088 1.00 0.00 H new ATOM 1236 N ASP A 994 -7.947 8.202 0.859 1.00 0.00 N ATOM 1237 CA ASP A 994 -6.924 9.163 1.235 1.00 0.00 C ATOM 1238 C ASP A 994 -6.384 9.845 -0.023 1.00 0.00 C ATOM 1239 O ASP A 994 -6.101 11.042 -0.011 1.00 0.00 O ATOM 1240 CB ASP A 994 -5.754 8.475 1.940 1.00 0.00 C ATOM 1241 CG ASP A 994 -5.832 8.468 3.468 1.00 0.00 C ATOM 1242 OD1 ASP A 994 -6.720 7.758 3.988 1.00 0.00 O ATOM 1243 OD2 ASP A 994 -5.002 9.173 4.082 1.00 0.00 O ATOM 0 H ASP A 994 -7.832 7.275 1.269 1.00 0.00 H new ATOM 0 HA ASP A 994 -7.376 9.889 1.912 1.00 0.00 H new ATOM 0 HB2 ASP A 994 -5.694 7.445 1.590 1.00 0.00 H new ATOM 0 HB3 ASP A 994 -4.829 8.968 1.641 1.00 0.00 H new ATOM 1248 N LEU A 995 -6.256 9.054 -1.078 1.00 0.00 N ATOM 1249 CA LEU A 995 -5.755 9.567 -2.341 1.00 0.00 C ATOM 1250 C LEU A 995 -6.587 10.780 -2.761 1.00 0.00 C ATOM 1251 O LEU A 995 -6.072 11.895 -2.837 1.00 0.00 O ATOM 1252 CB LEU A 995 -5.714 8.456 -3.392 1.00 0.00 C ATOM 1253 CG LEU A 995 -4.459 8.404 -4.266 1.00 0.00 C ATOM 1254 CD1 LEU A 995 -4.557 7.282 -5.301 1.00 0.00 C ATOM 1255 CD2 LEU A 995 -4.189 9.762 -4.918 1.00 0.00 C ATOM 0 H LEU A 995 -6.491 8.061 -1.084 1.00 0.00 H new ATOM 0 HA LEU A 995 -4.726 9.909 -2.231 1.00 0.00 H new ATOM 0 HB2 LEU A 995 -5.818 7.498 -2.883 1.00 0.00 H new ATOM 0 HB3 LEU A 995 -6.581 8.567 -4.043 1.00 0.00 H new ATOM 0 HG LEU A 995 -3.606 8.178 -3.626 1.00 0.00 H new ATOM 0 HD11 LEU A 995 -3.652 7.267 -5.909 1.00 0.00 H new ATOM 0 HD12 LEU A 995 -4.667 6.325 -4.791 1.00 0.00 H new ATOM 0 HD13 LEU A 995 -5.422 7.453 -5.942 1.00 0.00 H new ATOM 0 HD21 LEU A 995 -3.292 9.698 -5.534 1.00 0.00 H new ATOM 0 HD22 LEU A 995 -5.038 10.041 -5.542 1.00 0.00 H new ATOM 0 HD23 LEU A 995 -4.045 10.515 -4.143 1.00 0.00 H new ATOM 1267 N ALA A 996 -7.860 10.522 -3.023 1.00 0.00 N ATOM 1268 CA ALA A 996 -8.769 11.579 -3.433 1.00 0.00 C ATOM 1269 C ALA A 996 -8.601 12.780 -2.500 1.00 0.00 C ATOM 1270 O ALA A 996 -8.507 13.918 -2.958 1.00 0.00 O ATOM 1271 CB ALA A 996 -10.203 11.045 -3.443 1.00 0.00 C ATOM 0 H ALA A 996 -8.283 9.596 -2.959 1.00 0.00 H new ATOM 0 HA ALA A 996 -8.538 11.912 -4.445 1.00 0.00 H new ATOM 0 HB1 ALA A 996 -10.884 11.838 -3.751 1.00 0.00 H new ATOM 0 HB2 ALA A 996 -10.276 10.212 -4.142 1.00 0.00 H new ATOM 0 HB3 ALA A 996 -10.471 10.704 -2.443 1.00 0.00 H new ATOM 1277 N GLU A 997 -8.569 12.486 -1.208 1.00 0.00 N ATOM 1278 CA GLU A 997 -8.414 13.528 -0.207 1.00 0.00 C ATOM 1279 C GLU A 997 -7.099 14.280 -0.423 1.00 0.00 C ATOM 1280 O GLU A 997 -6.992 15.459 -0.088 1.00 0.00 O ATOM 1281 CB GLU A 997 -8.488 12.945 1.206 1.00 0.00 C ATOM 1282 CG GLU A 997 -8.615 14.056 2.250 1.00 0.00 C ATOM 1283 CD GLU A 997 -10.084 14.340 2.572 1.00 0.00 C ATOM 1284 OE1 GLU A 997 -10.661 15.201 1.873 1.00 0.00 O ATOM 1285 OE2 GLU A 997 -10.596 13.690 3.509 1.00 0.00 O ATOM 0 H GLU A 997 -8.648 11.541 -0.832 1.00 0.00 H new ATOM 0 HA GLU A 997 -9.236 14.236 -0.316 1.00 0.00 H new ATOM 0 HB2 GLU A 997 -9.341 12.271 1.281 1.00 0.00 H new ATOM 0 HB3 GLU A 997 -7.595 12.353 1.406 1.00 0.00 H new ATOM 0 HG2 GLU A 997 -8.089 13.767 3.160 1.00 0.00 H new ATOM 0 HG3 GLU A 997 -8.138 14.964 1.880 1.00 0.00 H new ATOM 1292 N LEU A 998 -6.132 13.567 -0.980 1.00 0.00 N ATOM 1293 CA LEU A 998 -4.828 14.153 -1.244 1.00 0.00 C ATOM 1294 C LEU A 998 -4.899 14.990 -2.523 1.00 0.00 C ATOM 1295 O LEU A 998 -4.456 16.137 -2.544 1.00 0.00 O ATOM 1296 CB LEU A 998 -3.750 13.068 -1.279 1.00 0.00 C ATOM 1297 CG LEU A 998 -2.329 13.523 -0.943 1.00 0.00 C ATOM 1298 CD1 LEU A 998 -1.534 12.396 -0.281 1.00 0.00 C ATOM 1299 CD2 LEU A 998 -1.621 14.071 -2.184 1.00 0.00 C ATOM 0 H LEU A 998 -6.224 12.589 -1.256 1.00 0.00 H new ATOM 0 HA LEU A 998 -4.543 14.827 -0.436 1.00 0.00 H new ATOM 0 HB2 LEU A 998 -4.033 12.280 -0.581 1.00 0.00 H new ATOM 0 HB3 LEU A 998 -3.742 12.624 -2.274 1.00 0.00 H new ATOM 0 HG LEU A 998 -2.393 14.338 -0.222 1.00 0.00 H new ATOM 0 HD11 LEU A 998 -0.527 12.746 -0.053 1.00 0.00 H new ATOM 0 HD12 LEU A 998 -2.031 12.093 0.641 1.00 0.00 H new ATOM 0 HD13 LEU A 998 -1.477 11.544 -0.959 1.00 0.00 H new ATOM 0 HD21 LEU A 998 -0.613 14.388 -1.918 1.00 0.00 H new ATOM 0 HD22 LEU A 998 -1.568 13.293 -2.946 1.00 0.00 H new ATOM 0 HD23 LEU A 998 -2.178 14.923 -2.574 1.00 0.00 H new ATOM 1311 N ILE A 999 -5.460 14.384 -3.559 1.00 0.00 N ATOM 1312 CA ILE A 999 -5.595 15.059 -4.838 1.00 0.00 C ATOM 1313 C ILE A 999 -6.390 16.352 -4.646 1.00 0.00 C ATOM 1314 O ILE A 999 -5.924 17.431 -5.010 1.00 0.00 O ATOM 1315 CB ILE A 999 -6.199 14.116 -5.881 1.00 0.00 C ATOM 1316 CG1 ILE A 999 -5.360 12.843 -6.020 1.00 0.00 C ATOM 1317 CG2 ILE A 999 -6.386 14.828 -7.222 1.00 0.00 C ATOM 1318 CD1 ILE A 999 -4.200 13.056 -6.995 1.00 0.00 C ATOM 0 H ILE A 999 -5.826 13.432 -3.538 1.00 0.00 H new ATOM 0 HA ILE A 999 -4.616 15.340 -5.225 1.00 0.00 H new ATOM 0 HB ILE A 999 -7.188 13.814 -5.536 1.00 0.00 H new ATOM 0 HG12 ILE A 999 -4.971 12.551 -5.045 1.00 0.00 H new ATOM 0 HG13 ILE A 999 -5.989 12.025 -6.370 1.00 0.00 H new ATOM 0 HG21 ILE A 999 -6.817 14.135 -7.945 1.00 0.00 H new ATOM 0 HG22 ILE A 999 -7.055 15.679 -7.092 1.00 0.00 H new ATOM 0 HG23 ILE A 999 -5.420 15.178 -7.586 1.00 0.00 H new ATOM 0 HD11 ILE A 999 -3.619 12.137 -7.076 1.00 0.00 H new ATOM 0 HD12 ILE A 999 -4.593 13.324 -7.975 1.00 0.00 H new ATOM 0 HD13 ILE A 999 -3.560 13.859 -6.629 1.00 0.00 H new ATOM 1330 N ASN A1000 -7.576 16.201 -4.075 1.00 0.00 N ATOM 1331 CA ASN A1000 -8.439 17.344 -3.830 1.00 0.00 C ATOM 1332 C ASN A1000 -7.656 18.416 -3.069 1.00 0.00 C ATOM 1333 O ASN A1000 -7.660 19.584 -3.455 1.00 0.00 O ATOM 1334 CB ASN A1000 -9.648 16.949 -2.979 1.00 0.00 C ATOM 1335 CG ASN A1000 -10.789 17.954 -3.148 1.00 0.00 C ATOM 1336 OD1 ASN A1000 -11.080 18.425 -4.235 1.00 0.00 O ATOM 1337 ND2 ASN A1000 -11.417 18.254 -2.014 1.00 0.00 N ATOM 0 H ASN A1000 -7.960 15.305 -3.775 1.00 0.00 H new ATOM 0 HA ASN A1000 -8.783 17.719 -4.794 1.00 0.00 H new ATOM 0 HB2 ASN A1000 -9.989 15.954 -3.265 1.00 0.00 H new ATOM 0 HB3 ASN A1000 -9.357 16.896 -1.930 1.00 0.00 H new ATOM 0 HD21 ASN A1000 -12.194 18.915 -2.021 1.00 0.00 H new ATOM 0 HD22 ASN A1000 -11.122 17.823 -1.138 1.00 0.00 H new ATOM 1344 N LYS A1001 -7.004 17.980 -2.001 1.00 0.00 N ATOM 1345 CA LYS A1001 -6.218 18.888 -1.183 1.00 0.00 C ATOM 1346 C LYS A1001 -5.256 19.672 -2.078 1.00 0.00 C ATOM 1347 O LYS A1001 -5.092 20.880 -1.911 1.00 0.00 O ATOM 1348 CB LYS A1001 -5.523 18.126 -0.053 1.00 0.00 C ATOM 1349 CG LYS A1001 -6.478 17.891 1.119 1.00 0.00 C ATOM 1350 CD LYS A1001 -6.197 18.871 2.260 1.00 0.00 C ATOM 1351 CE LYS A1001 -7.291 19.936 2.351 1.00 0.00 C ATOM 1352 NZ LYS A1001 -6.959 20.933 3.393 1.00 0.00 N ATOM 0 H LYS A1001 -7.004 17.011 -1.683 1.00 0.00 H new ATOM 0 HA LYS A1001 -6.865 19.617 -0.695 1.00 0.00 H new ATOM 0 HB2 LYS A1001 -5.157 17.169 -0.426 1.00 0.00 H new ATOM 0 HB3 LYS A1001 -4.654 18.688 0.289 1.00 0.00 H new ATOM 0 HG2 LYS A1001 -7.508 18.005 0.782 1.00 0.00 H new ATOM 0 HG3 LYS A1001 -6.372 16.868 1.479 1.00 0.00 H new ATOM 0 HD2 LYS A1001 -6.134 18.328 3.203 1.00 0.00 H new ATOM 0 HD3 LYS A1001 -5.231 19.350 2.103 1.00 0.00 H new ATOM 0 HE2 LYS A1001 -7.404 20.433 1.387 1.00 0.00 H new ATOM 0 HE3 LYS A1001 -8.247 19.465 2.581 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 -7.573 21.765 3.286 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 -7.105 20.514 4.334 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 -5.965 21.222 3.293 1.00 0.00 H new ATOM 1366 N MET A1002 -4.646 18.954 -3.009 1.00 0.00 N ATOM 1367 CA MET A1002 -3.705 19.567 -3.931 1.00 0.00 C ATOM 1368 C MET A1002 -4.420 20.522 -4.889 1.00 0.00 C ATOM 1369 O MET A1002 -3.911 21.600 -5.192 1.00 0.00 O ATOM 1370 CB MET A1002 -2.992 18.477 -4.733 1.00 0.00 C ATOM 1371 CG MET A1002 -2.181 19.083 -5.881 1.00 0.00 C ATOM 1372 SD MET A1002 -2.774 18.457 -7.444 1.00 0.00 S ATOM 1373 CE MET A1002 -2.782 19.966 -8.398 1.00 0.00 C ATOM 0 H MET A1002 -4.785 17.953 -3.145 1.00 0.00 H new ATOM 0 HA MET A1002 -2.979 20.138 -3.353 1.00 0.00 H new ATOM 0 HB2 MET A1002 -2.332 17.910 -4.076 1.00 0.00 H new ATOM 0 HB3 MET A1002 -3.725 17.775 -5.131 1.00 0.00 H new ATOM 0 HG2 MET A1002 -2.262 20.170 -5.861 1.00 0.00 H new ATOM 0 HG3 MET A1002 -1.125 18.840 -5.759 1.00 0.00 H new ATOM 0 HE1 MET A1002 -3.794 20.171 -8.746 1.00 0.00 H new ATOM 0 HE2 MET A1002 -2.438 20.792 -7.775 1.00 0.00 H new ATOM 0 HE3 MET A1002 -2.119 19.857 -9.256 1.00 0.00 H new ATOM 1383 N LYS A1003 -5.589 20.091 -5.340 1.00 0.00 N ATOM 1384 CA LYS A1003 -6.379 20.894 -6.258 1.00 0.00 C ATOM 1385 C LYS A1003 -6.618 22.276 -5.645 1.00 0.00 C ATOM 1386 O LYS A1003 -6.790 23.257 -6.366 1.00 0.00 O ATOM 1387 CB LYS A1003 -7.666 20.161 -6.641 1.00 0.00 C ATOM 1388 CG LYS A1003 -7.516 19.459 -7.992 1.00 0.00 C ATOM 1389 CD LYS A1003 -7.477 20.475 -9.136 1.00 0.00 C ATOM 1390 CE LYS A1003 -8.854 21.102 -9.360 1.00 0.00 C ATOM 1391 NZ LYS A1003 -8.815 22.042 -10.502 1.00 0.00 N ATOM 0 H LYS A1003 -6.008 19.196 -5.087 1.00 0.00 H new ATOM 0 HA LYS A1003 -5.837 21.048 -7.191 1.00 0.00 H new ATOM 0 HB2 LYS A1003 -7.914 19.429 -5.872 1.00 0.00 H new ATOM 0 HB3 LYS A1003 -8.493 20.870 -6.685 1.00 0.00 H new ATOM 0 HG2 LYS A1003 -6.603 18.864 -7.998 1.00 0.00 H new ATOM 0 HG3 LYS A1003 -8.346 18.769 -8.142 1.00 0.00 H new ATOM 0 HD2 LYS A1003 -6.751 21.256 -8.909 1.00 0.00 H new ATOM 0 HD3 LYS A1003 -7.143 19.985 -10.051 1.00 0.00 H new ATOM 0 HE2 LYS A1003 -9.590 20.320 -9.550 1.00 0.00 H new ATOM 0 HE3 LYS A1003 -9.172 21.627 -8.459 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 -9.758 22.459 -10.641 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 -8.128 22.797 -10.306 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 -8.532 21.531 -11.363 1.00 0.00 H new ATOM 1405 N LEU A1004 -6.621 22.307 -4.321 1.00 0.00 N ATOM 1406 CA LEU A1004 -6.835 23.552 -3.602 1.00 0.00 C ATOM 1407 C LEU A1004 -5.482 24.157 -3.224 1.00 0.00 C ATOM 1408 O LEU A1004 -5.331 25.378 -3.193 1.00 0.00 O ATOM 1409 CB LEU A1004 -7.764 23.328 -2.407 1.00 0.00 C ATOM 1410 CG LEU A1004 -8.980 22.434 -2.662 1.00 0.00 C ATOM 1411 CD1 LEU A1004 -9.664 22.052 -1.347 1.00 0.00 C ATOM 1412 CD2 LEU A1004 -9.950 23.094 -3.643 1.00 0.00 C ATOM 0 H LEU A1004 -6.479 21.490 -3.727 1.00 0.00 H new ATOM 0 HA LEU A1004 -7.342 24.277 -4.239 1.00 0.00 H new ATOM 0 HB2 LEU A1004 -7.181 22.892 -1.595 1.00 0.00 H new ATOM 0 HB3 LEU A1004 -8.118 24.299 -2.060 1.00 0.00 H new ATOM 0 HG LEU A1004 -8.634 21.510 -3.125 1.00 0.00 H new ATOM 0 HD11 LEU A1004 -10.525 21.417 -1.556 1.00 0.00 H new ATOM 0 HD12 LEU A1004 -8.960 21.512 -0.714 1.00 0.00 H new ATOM 0 HD13 LEU A1004 -9.995 22.955 -0.834 1.00 0.00 H new ATOM 0 HD21 LEU A1004 -10.805 22.438 -3.807 1.00 0.00 H new ATOM 0 HD22 LEU A1004 -10.294 24.043 -3.231 1.00 0.00 H new ATOM 0 HD23 LEU A1004 -9.443 23.273 -4.591 1.00 0.00 H new ATOM 1424 N ALA A1005 -4.533 23.276 -2.945 1.00 0.00 N ATOM 1425 CA ALA A1005 -3.197 23.708 -2.570 1.00 0.00 C ATOM 1426 C ALA A1005 -2.516 24.353 -3.779 1.00 0.00 C ATOM 1427 O ALA A1005 -1.435 24.927 -3.654 1.00 0.00 O ATOM 1428 CB ALA A1005 -2.409 22.516 -2.023 1.00 0.00 C ATOM 0 H ALA A1005 -4.663 22.265 -2.971 1.00 0.00 H new ATOM 0 HA ALA A1005 -3.244 24.457 -1.780 1.00 0.00 H new ATOM 0 HB1 ALA A1005 -1.407 22.840 -1.742 1.00 0.00 H new ATOM 0 HB2 ALA A1005 -2.919 22.113 -1.148 1.00 0.00 H new ATOM 0 HB3 ALA A1005 -2.339 21.744 -2.789 1.00 0.00 H new ATOM 1434 N GLN A1006 -3.176 24.236 -4.922 1.00 0.00 N ATOM 1435 CA GLN A1006 -2.647 24.800 -6.152 1.00 0.00 C ATOM 1436 C GLN A1006 -2.916 26.305 -6.204 1.00 0.00 C ATOM 1437 O GLN A1006 -2.101 27.067 -6.721 1.00 0.00 O ATOM 1438 CB GLN A1006 -3.236 24.095 -7.375 1.00 0.00 C ATOM 1439 CG GLN A1006 -2.652 24.663 -8.670 1.00 0.00 C ATOM 1440 CD GLN A1006 -3.347 25.969 -9.059 1.00 0.00 C ATOM 1441 OE1 GLN A1006 -4.457 26.259 -8.643 1.00 0.00 O ATOM 1442 NE2 GLN A1006 -2.635 26.739 -9.876 1.00 0.00 N ATOM 0 H GLN A1006 -4.072 23.759 -5.022 1.00 0.00 H new ATOM 0 HA GLN A1006 -1.568 24.643 -6.167 1.00 0.00 H new ATOM 0 HB2 GLN A1006 -3.030 23.026 -7.317 1.00 0.00 H new ATOM 0 HB3 GLN A1006 -4.320 24.211 -7.379 1.00 0.00 H new ATOM 0 HG2 GLN A1006 -1.584 24.839 -8.545 1.00 0.00 H new ATOM 0 HG3 GLN A1006 -2.763 23.935 -9.473 1.00 0.00 H new ATOM 0 HE21 GLN A1006 -1.712 26.436 -10.187 1.00 0.00 H new ATOM 0 HE22 GLN A1006 -3.012 27.632 -10.192 1.00 0.00 H new ATOM 1451 N GLN A1007 -4.063 26.688 -5.663 1.00 0.00 N ATOM 1452 CA GLN A1007 -4.450 28.089 -5.641 1.00 0.00 C ATOM 1453 C GLN A1007 -4.119 28.710 -4.283 1.00 0.00 C ATOM 1454 O GLN A1007 -3.270 29.595 -4.191 1.00 0.00 O ATOM 1455 CB GLN A1007 -5.935 28.253 -5.973 1.00 0.00 C ATOM 1456 CG GLN A1007 -6.281 29.721 -6.226 1.00 0.00 C ATOM 1457 CD GLN A1007 -7.794 29.915 -6.345 1.00 0.00 C ATOM 1458 OE1 GLN A1007 -8.441 29.410 -7.248 1.00 0.00 O ATOM 1459 NE2 GLN A1007 -8.319 30.673 -5.387 1.00 0.00 N ATOM 0 H GLN A1007 -4.737 26.053 -5.236 1.00 0.00 H new ATOM 0 HA GLN A1007 -3.880 28.615 -6.407 1.00 0.00 H new ATOM 0 HB2 GLN A1007 -6.182 27.660 -6.854 1.00 0.00 H new ATOM 0 HB3 GLN A1007 -6.540 27.870 -5.151 1.00 0.00 H new ATOM 0 HG2 GLN A1007 -5.895 30.335 -5.412 1.00 0.00 H new ATOM 0 HG3 GLN A1007 -5.794 30.061 -7.140 1.00 0.00 H new ATOM 0 HE21 GLN A1007 -7.720 31.065 -4.661 1.00 0.00 H new ATOM 0 HE22 GLN A1007 -9.321 30.863 -5.378 1.00 0.00 H new ATOM 1468 N TYR A1008 -4.808 28.222 -3.261 1.00 0.00 N ATOM 1469 CA TYR A1008 -4.598 28.718 -1.912 1.00 0.00 C ATOM 1470 C TYR A1008 -3.120 29.031 -1.667 1.00 0.00 C ATOM 1471 O TYR A1008 -2.793 29.922 -0.885 1.00 0.00 O ATOM 1472 CB TYR A1008 -5.029 27.588 -0.975 1.00 0.00 C ATOM 1473 CG TYR A1008 -6.506 27.639 -0.577 1.00 0.00 C ATOM 1474 CD1 TYR A1008 -7.468 27.132 -1.427 1.00 0.00 C ATOM 1475 CD2 TYR A1008 -6.876 28.193 0.632 1.00 0.00 C ATOM 1476 CE1 TYR A1008 -8.857 27.181 -1.052 1.00 0.00 C ATOM 1477 CE2 TYR A1008 -8.265 28.242 1.006 1.00 0.00 C ATOM 1478 CZ TYR A1008 -9.187 27.733 0.146 1.00 0.00 C ATOM 1479 OH TYR A1008 -10.500 27.779 0.500 1.00 0.00 O ATOM 0 H TYR A1008 -5.512 27.488 -3.341 1.00 0.00 H new ATOM 0 HA TYR A1008 -5.163 29.636 -1.748 1.00 0.00 H new ATOM 0 HB2 TYR A1008 -4.826 26.632 -1.458 1.00 0.00 H new ATOM 0 HB3 TYR A1008 -4.419 27.625 -0.073 1.00 0.00 H new ATOM 0 HD1 TYR A1008 -7.179 26.699 -2.373 1.00 0.00 H new ATOM 0 HD2 TYR A1008 -6.123 28.590 1.297 1.00 0.00 H new ATOM 0 HE1 TYR A1008 -9.620 26.788 -1.708 1.00 0.00 H new ATOM 0 HE2 TYR A1008 -8.568 28.673 1.949 1.00 0.00 H new ATOM 0 HH TYR A1008 -10.587 28.199 1.381 1.00 0.00 H new ATOM 1489 N VAL A1009 -2.268 28.281 -2.349 1.00 0.00 N ATOM 1490 CA VAL A1009 -0.833 28.467 -2.215 1.00 0.00 C ATOM 1491 C VAL A1009 -0.520 29.964 -2.166 1.00 0.00 C ATOM 1492 O VAL A1009 0.326 30.399 -1.386 1.00 0.00 O ATOM 1493 CB VAL A1009 -0.103 27.741 -3.347 1.00 0.00 C ATOM 1494 CG1 VAL A1009 -0.695 28.112 -4.708 1.00 0.00 C ATOM 1495 CG2 VAL A1009 1.399 28.029 -3.304 1.00 0.00 C ATOM 0 H VAL A1009 -2.544 27.543 -2.997 1.00 0.00 H new ATOM 0 HA VAL A1009 -0.477 28.029 -1.283 1.00 0.00 H new ATOM 0 HB VAL A1009 -0.242 26.670 -3.203 1.00 0.00 H new ATOM 0 HG11 VAL A1009 -0.158 27.582 -5.495 1.00 0.00 H new ATOM 0 HG12 VAL A1009 -1.748 27.832 -4.735 1.00 0.00 H new ATOM 0 HG13 VAL A1009 -0.601 29.187 -4.865 1.00 0.00 H new ATOM 0 HG21 VAL A1009 1.894 27.501 -4.119 1.00 0.00 H new ATOM 0 HG22 VAL A1009 1.567 29.101 -3.411 1.00 0.00 H new ATOM 0 HG23 VAL A1009 1.807 27.691 -2.352 1.00 0.00 H new ATOM 1505 N MET A1010 -1.220 30.710 -3.008 1.00 0.00 N ATOM 1506 CA MET A1010 -1.027 32.149 -3.070 1.00 0.00 C ATOM 1507 C MET A1010 -1.622 32.836 -1.839 1.00 0.00 C ATOM 1508 O MET A1010 -2.412 33.769 -1.965 1.00 0.00 O ATOM 1509 CB MET A1010 -1.693 32.699 -4.333 1.00 0.00 C ATOM 1510 CG MET A1010 -3.173 32.316 -4.384 1.00 0.00 C ATOM 1511 SD MET A1010 -4.188 33.777 -4.247 1.00 0.00 S ATOM 1512 CE MET A1010 -4.883 33.521 -2.623 1.00 0.00 C ATOM 0 H MET A1010 -1.921 30.345 -3.653 1.00 0.00 H new ATOM 0 HA MET A1010 0.044 32.352 -3.094 1.00 0.00 H new ATOM 0 HB2 MET A1010 -1.594 33.784 -4.358 1.00 0.00 H new ATOM 0 HB3 MET A1010 -1.183 32.312 -5.215 1.00 0.00 H new ATOM 0 HG2 MET A1010 -3.391 31.798 -5.318 1.00 0.00 H new ATOM 0 HG3 MET A1010 -3.406 31.624 -3.574 1.00 0.00 H new ATOM 0 HE1 MET A1010 -5.970 33.575 -2.680 1.00 0.00 H new ATOM 0 HE2 MET A1010 -4.587 32.540 -2.251 1.00 0.00 H new ATOM 0 HE3 MET A1010 -4.517 34.292 -1.945 1.00 0.00 H new ATOM 1522 N THR A1011 -1.218 32.346 -0.675 1.00 0.00 N ATOM 1523 CA THR A1011 -1.701 32.901 0.578 1.00 0.00 C ATOM 1524 C THR A1011 -0.997 32.236 1.762 1.00 0.00 C ATOM 1525 O THR A1011 -0.235 31.288 1.583 1.00 0.00 O ATOM 1526 CB THR A1011 -3.223 32.743 0.609 1.00 0.00 C ATOM 1527 OG1 THR A1011 -3.642 33.624 1.649 1.00 0.00 O ATOM 1528 CG2 THR A1011 -3.658 31.359 1.096 1.00 0.00 C ATOM 0 H THR A1011 -0.562 31.571 -0.574 1.00 0.00 H new ATOM 0 HA THR A1011 -1.468 33.963 0.657 1.00 0.00 H new ATOM 0 HB THR A1011 -3.627 32.921 -0.388 1.00 0.00 H new ATOM 0 HG1 THR A1011 -4.617 33.586 1.737 1.00 0.00 H new ATOM 0 HG21 THR A1011 -4.746 31.300 1.099 1.00 0.00 H new ATOM 0 HG22 THR A1011 -3.255 30.596 0.430 1.00 0.00 H new ATOM 0 HG23 THR A1011 -3.283 31.194 2.106 1.00 0.00 H new ATOM 1536 N SER A1012 -1.276 32.761 2.946 1.00 0.00 N ATOM 1537 CA SER A1012 -0.679 32.230 4.160 1.00 0.00 C ATOM 1538 C SER A1012 -1.190 30.811 4.417 1.00 0.00 C ATOM 1539 O SER A1012 -0.471 29.980 4.970 1.00 0.00 O ATOM 1540 CB SER A1012 -0.980 33.129 5.360 1.00 0.00 C ATOM 1541 OG SER A1012 -0.138 34.279 5.391 1.00 0.00 O ATOM 0 H SER A1012 -1.908 33.549 3.091 1.00 0.00 H new ATOM 0 HA SER A1012 0.402 32.200 4.025 1.00 0.00 H new ATOM 0 HB2 SER A1012 -2.023 33.444 5.324 1.00 0.00 H new ATOM 0 HB3 SER A1012 -0.850 32.560 6.281 1.00 0.00 H new ATOM 0 HG SER A1012 -0.363 34.828 6.171 1.00 0.00 H new ATOM 1547 N LEU A1013 -2.427 30.579 4.005 1.00 0.00 N ATOM 1548 CA LEU A1013 -3.043 29.275 4.185 1.00 0.00 C ATOM 1549 C LEU A1013 -2.104 28.194 3.645 1.00 0.00 C ATOM 1550 O LEU A1013 -2.115 27.061 4.125 1.00 0.00 O ATOM 1551 CB LEU A1013 -4.437 29.249 3.555 1.00 0.00 C ATOM 1552 CG LEU A1013 -5.460 30.219 4.150 1.00 0.00 C ATOM 1553 CD1 LEU A1013 -6.851 29.585 4.202 1.00 0.00 C ATOM 1554 CD2 LEU A1013 -5.006 30.720 5.523 1.00 0.00 C ATOM 0 H LEU A1013 -3.020 31.271 3.547 1.00 0.00 H new ATOM 0 HA LEU A1013 -3.194 29.068 5.244 1.00 0.00 H new ATOM 0 HB2 LEU A1013 -4.337 29.465 2.491 1.00 0.00 H new ATOM 0 HB3 LEU A1013 -4.833 28.237 3.639 1.00 0.00 H new ATOM 0 HG LEU A1013 -5.527 31.088 3.496 1.00 0.00 H new ATOM 0 HD11 LEU A1013 -7.559 30.295 4.629 1.00 0.00 H new ATOM 0 HD12 LEU A1013 -7.168 29.319 3.193 1.00 0.00 H new ATOM 0 HD13 LEU A1013 -6.819 28.688 4.821 1.00 0.00 H new ATOM 0 HD21 LEU A1013 -5.751 31.408 5.924 1.00 0.00 H new ATOM 0 HD22 LEU A1013 -4.892 29.873 6.200 1.00 0.00 H new ATOM 0 HD23 LEU A1013 -4.051 31.236 5.424 1.00 0.00 H new ATOM 1566 N GLN A1014 -1.315 28.581 2.654 1.00 0.00 N ATOM 1567 CA GLN A1014 -0.373 27.659 2.043 1.00 0.00 C ATOM 1568 C GLN A1014 0.244 26.749 3.107 1.00 0.00 C ATOM 1569 O GLN A1014 -0.030 25.550 3.138 1.00 0.00 O ATOM 1570 CB GLN A1014 0.712 28.415 1.273 1.00 0.00 C ATOM 1571 CG GLN A1014 1.623 27.446 0.516 1.00 0.00 C ATOM 1572 CD GLN A1014 3.024 28.034 0.340 1.00 0.00 C ATOM 1573 OE1 GLN A1014 3.461 28.349 -0.755 1.00 0.00 O ATOM 1574 NE2 GLN A1014 3.703 28.164 1.477 1.00 0.00 N ATOM 0 H GLN A1014 -1.309 29.521 2.259 1.00 0.00 H new ATOM 0 HA GLN A1014 -0.913 27.037 1.329 1.00 0.00 H new ATOM 0 HB2 GLN A1014 0.249 29.108 0.571 1.00 0.00 H new ATOM 0 HB3 GLN A1014 1.305 29.012 1.965 1.00 0.00 H new ATOM 0 HG2 GLN A1014 1.686 26.502 1.058 1.00 0.00 H new ATOM 0 HG3 GLN A1014 1.193 27.224 -0.461 1.00 0.00 H new ATOM 0 HE21 GLN A1014 3.278 27.881 2.360 1.00 0.00 H new ATOM 0 HE22 GLN A1014 4.648 28.547 1.466 1.00 0.00 H new ATOM 1583 N GLN A1015 1.065 27.353 3.954 1.00 0.00 N ATOM 1584 CA GLN A1015 1.722 26.611 5.016 1.00 0.00 C ATOM 1585 C GLN A1015 0.711 25.731 5.753 1.00 0.00 C ATOM 1586 O GLN A1015 1.023 24.601 6.127 1.00 0.00 O ATOM 1587 CB GLN A1015 2.435 27.557 5.985 1.00 0.00 C ATOM 1588 CG GLN A1015 1.590 28.805 6.254 1.00 0.00 C ATOM 1589 CD GLN A1015 1.996 29.468 7.572 1.00 0.00 C ATOM 1590 OE1 GLN A1015 2.420 28.823 8.516 1.00 0.00 O ATOM 1591 NE2 GLN A1015 1.843 30.789 7.582 1.00 0.00 N ATOM 0 H GLN A1015 1.290 28.348 3.926 1.00 0.00 H new ATOM 0 HA GLN A1015 2.477 25.965 4.568 1.00 0.00 H new ATOM 0 HB2 GLN A1015 2.635 27.040 6.923 1.00 0.00 H new ATOM 0 HB3 GLN A1015 3.400 27.849 5.570 1.00 0.00 H new ATOM 0 HG2 GLN A1015 1.710 29.513 5.434 1.00 0.00 H new ATOM 0 HG3 GLN A1015 0.535 28.534 6.289 1.00 0.00 H new ATOM 0 HE21 GLN A1015 1.482 31.267 6.756 1.00 0.00 H new ATOM 0 HE22 GLN A1015 2.086 31.324 8.415 1.00 0.00 H new ATOM 1600 N GLU A1016 -0.479 26.281 5.940 1.00 0.00 N ATOM 1601 CA GLU A1016 -1.538 25.560 6.625 1.00 0.00 C ATOM 1602 C GLU A1016 -1.910 24.296 5.846 1.00 0.00 C ATOM 1603 O GLU A1016 -1.965 23.206 6.413 1.00 0.00 O ATOM 1604 CB GLU A1016 -2.762 26.453 6.838 1.00 0.00 C ATOM 1605 CG GLU A1016 -3.676 25.881 7.923 1.00 0.00 C ATOM 1606 CD GLU A1016 -5.135 26.266 7.669 1.00 0.00 C ATOM 1607 OE1 GLU A1016 -5.476 27.430 7.971 1.00 0.00 O ATOM 1608 OE2 GLU A1016 -5.877 25.387 7.179 1.00 0.00 O ATOM 0 H GLU A1016 -0.734 27.218 5.629 1.00 0.00 H new ATOM 0 HA GLU A1016 -1.171 25.263 7.608 1.00 0.00 H new ATOM 0 HB2 GLU A1016 -2.440 27.456 7.120 1.00 0.00 H new ATOM 0 HB3 GLU A1016 -3.315 26.547 5.904 1.00 0.00 H new ATOM 0 HG2 GLU A1016 -3.582 24.795 7.948 1.00 0.00 H new ATOM 0 HG3 GLU A1016 -3.363 26.251 8.899 1.00 0.00 H new ATOM 1615 N TYR A1017 -2.157 24.485 4.558 1.00 0.00 N ATOM 1616 CA TYR A1017 -2.523 23.375 3.695 1.00 0.00 C ATOM 1617 C TYR A1017 -1.426 22.308 3.680 1.00 0.00 C ATOM 1618 O TYR A1017 -1.716 21.116 3.594 1.00 0.00 O ATOM 1619 CB TYR A1017 -2.665 23.962 2.290 1.00 0.00 C ATOM 1620 CG TYR A1017 -4.086 24.414 1.945 1.00 0.00 C ATOM 1621 CD1 TYR A1017 -4.861 25.039 2.900 1.00 0.00 C ATOM 1622 CD2 TYR A1017 -4.591 24.196 0.680 1.00 0.00 C ATOM 1623 CE1 TYR A1017 -6.198 25.465 2.576 1.00 0.00 C ATOM 1624 CE2 TYR A1017 -5.928 24.622 0.356 1.00 0.00 C ATOM 1625 CZ TYR A1017 -6.666 25.235 1.320 1.00 0.00 C ATOM 1626 OH TYR A1017 -7.929 25.637 1.014 1.00 0.00 O ATOM 0 H TYR A1017 -2.111 25.391 4.091 1.00 0.00 H new ATOM 0 HA TYR A1017 -3.441 22.903 4.046 1.00 0.00 H new ATOM 0 HB2 TYR A1017 -1.990 24.813 2.193 1.00 0.00 H new ATOM 0 HB3 TYR A1017 -2.345 23.217 1.562 1.00 0.00 H new ATOM 0 HD1 TYR A1017 -4.465 25.209 3.890 1.00 0.00 H new ATOM 0 HD2 TYR A1017 -3.984 23.706 -0.067 1.00 0.00 H new ATOM 0 HE1 TYR A1017 -6.815 25.956 3.314 1.00 0.00 H new ATOM 0 HE2 TYR A1017 -6.336 24.458 -0.631 1.00 0.00 H new ATOM 0 HH TYR A1017 -7.899 26.525 0.601 1.00 0.00 H new ATOM 1636 N LYS A1018 -0.189 22.775 3.766 1.00 0.00 N ATOM 1637 CA LYS A1018 0.952 21.876 3.764 1.00 0.00 C ATOM 1638 C LYS A1018 0.779 20.835 4.872 1.00 0.00 C ATOM 1639 O LYS A1018 0.963 19.641 4.641 1.00 0.00 O ATOM 1640 CB LYS A1018 2.258 22.667 3.863 1.00 0.00 C ATOM 1641 CG LYS A1018 2.982 22.701 2.515 1.00 0.00 C ATOM 1642 CD LYS A1018 2.354 23.737 1.581 1.00 0.00 C ATOM 1643 CE LYS A1018 3.239 23.980 0.357 1.00 0.00 C ATOM 1644 NZ LYS A1018 2.417 24.389 -0.804 1.00 0.00 N ATOM 0 H LYS A1018 0.048 23.765 3.838 1.00 0.00 H new ATOM 0 HA LYS A1018 1.006 21.332 2.821 1.00 0.00 H new ATOM 0 HB2 LYS A1018 2.047 23.684 4.192 1.00 0.00 H new ATOM 0 HB3 LYS A1018 2.904 22.216 4.616 1.00 0.00 H new ATOM 0 HG2 LYS A1018 4.035 22.937 2.670 1.00 0.00 H new ATOM 0 HG3 LYS A1018 2.941 21.716 2.051 1.00 0.00 H new ATOM 0 HD2 LYS A1018 1.370 23.394 1.261 1.00 0.00 H new ATOM 0 HD3 LYS A1018 2.205 24.674 2.118 1.00 0.00 H new ATOM 0 HE2 LYS A1018 3.974 24.753 0.580 1.00 0.00 H new ATOM 0 HE3 LYS A1018 3.794 23.073 0.116 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 2.986 24.984 -1.440 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 2.095 23.543 -1.317 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 1.592 24.928 -0.472 1.00 0.00 H new ATOM 1658 N LYS A1019 0.426 21.326 6.051 1.00 0.00 N ATOM 1659 CA LYS A1019 0.226 20.454 7.195 1.00 0.00 C ATOM 1660 C LYS A1019 -0.833 19.404 6.852 1.00 0.00 C ATOM 1661 O LYS A1019 -0.660 18.223 7.146 1.00 0.00 O ATOM 1662 CB LYS A1019 -0.104 21.275 8.444 1.00 0.00 C ATOM 1663 CG LYS A1019 1.053 22.206 8.809 1.00 0.00 C ATOM 1664 CD LYS A1019 2.369 21.432 8.909 1.00 0.00 C ATOM 1665 CE LYS A1019 3.194 21.585 7.630 1.00 0.00 C ATOM 1666 NZ LYS A1019 4.582 21.984 7.952 1.00 0.00 N ATOM 0 H LYS A1019 0.273 22.317 6.238 1.00 0.00 H new ATOM 0 HA LYS A1019 1.145 19.916 7.429 1.00 0.00 H new ATOM 0 HB2 LYS A1019 -1.006 21.861 8.270 1.00 0.00 H new ATOM 0 HB3 LYS A1019 -0.314 20.606 9.278 1.00 0.00 H new ATOM 0 HG2 LYS A1019 1.144 22.990 8.057 1.00 0.00 H new ATOM 0 HG3 LYS A1019 0.843 22.698 9.759 1.00 0.00 H new ATOM 0 HD2 LYS A1019 2.944 21.793 9.762 1.00 0.00 H new ATOM 0 HD3 LYS A1019 2.162 20.377 9.088 1.00 0.00 H new ATOM 0 HE2 LYS A1019 3.198 20.645 7.079 1.00 0.00 H new ATOM 0 HE3 LYS A1019 2.736 22.332 6.982 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 5.128 22.083 7.072 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 4.573 22.892 8.458 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 5.022 21.257 8.552 1.00 0.00 H new ATOM 1680 N GLN A1020 -1.907 19.874 6.233 1.00 0.00 N ATOM 1681 CA GLN A1020 -2.994 18.991 5.846 1.00 0.00 C ATOM 1682 C GLN A1020 -2.453 17.799 5.053 1.00 0.00 C ATOM 1683 O GLN A1020 -2.805 16.653 5.330 1.00 0.00 O ATOM 1684 CB GLN A1020 -4.055 19.746 5.045 1.00 0.00 C ATOM 1685 CG GLN A1020 -4.601 20.934 5.840 1.00 0.00 C ATOM 1686 CD GLN A1020 -5.116 20.487 7.209 1.00 0.00 C ATOM 1687 OE1 GLN A1020 -5.892 19.554 7.335 1.00 0.00 O ATOM 1688 NE2 GLN A1020 -4.642 21.202 8.226 1.00 0.00 N ATOM 0 H GLN A1020 -2.047 20.855 5.990 1.00 0.00 H new ATOM 0 HA GLN A1020 -3.470 18.614 6.751 1.00 0.00 H new ATOM 0 HB2 GLN A1020 -3.625 20.098 4.107 1.00 0.00 H new ATOM 0 HB3 GLN A1020 -4.871 19.070 4.788 1.00 0.00 H new ATOM 0 HG2 GLN A1020 -3.818 21.681 5.968 1.00 0.00 H new ATOM 0 HG3 GLN A1020 -5.407 21.410 5.282 1.00 0.00 H new ATOM 0 HE21 GLN A1020 -3.995 21.971 8.051 1.00 0.00 H new ATOM 0 HE22 GLN A1020 -4.926 20.981 9.181 1.00 0.00 H new ATOM 1697 N MET A1021 -1.606 18.110 4.083 1.00 0.00 N ATOM 1698 CA MET A1021 -1.013 17.080 3.248 1.00 0.00 C ATOM 1699 C MET A1021 -0.387 15.975 4.102 1.00 0.00 C ATOM 1700 O MET A1021 -0.568 14.791 3.823 1.00 0.00 O ATOM 1701 CB MET A1021 0.060 17.702 2.352 1.00 0.00 C ATOM 1702 CG MET A1021 -0.138 17.289 0.892 1.00 0.00 C ATOM 1703 SD MET A1021 0.494 15.640 0.634 1.00 0.00 S ATOM 1704 CE MET A1021 2.165 15.852 1.226 1.00 0.00 C ATOM 0 H MET A1021 -1.316 19.061 3.857 1.00 0.00 H new ATOM 0 HA MET A1021 -1.799 16.639 2.635 1.00 0.00 H new ATOM 0 HB2 MET A1021 0.023 18.788 2.435 1.00 0.00 H new ATOM 0 HB3 MET A1021 1.048 17.390 2.691 1.00 0.00 H new ATOM 0 HG2 MET A1021 -1.197 17.326 0.635 1.00 0.00 H new ATOM 0 HG3 MET A1021 0.374 17.991 0.234 1.00 0.00 H new ATOM 0 HE1 MET A1021 2.824 15.149 0.716 1.00 0.00 H new ATOM 0 HE2 MET A1021 2.496 16.871 1.024 1.00 0.00 H new ATOM 0 HE3 MET A1021 2.197 15.666 2.300 1.00 0.00 H new ATOM 1714 N LEU A1022 0.338 16.402 5.126 1.00 0.00 N ATOM 1715 CA LEU A1022 0.992 15.464 6.022 1.00 0.00 C ATOM 1716 C LEU A1022 -0.063 14.568 6.674 1.00 0.00 C ATOM 1717 O LEU A1022 0.162 13.373 6.860 1.00 0.00 O ATOM 1718 CB LEU A1022 1.873 16.209 7.028 1.00 0.00 C ATOM 1719 CG LEU A1022 3.161 15.498 7.447 1.00 0.00 C ATOM 1720 CD1 LEU A1022 4.364 16.438 7.346 1.00 0.00 C ATOM 1721 CD2 LEU A1022 3.023 14.892 8.845 1.00 0.00 C ATOM 0 H LEU A1022 0.487 17.385 5.355 1.00 0.00 H new ATOM 0 HA LEU A1022 1.665 14.812 5.465 1.00 0.00 H new ATOM 0 HB2 LEU A1022 2.138 17.177 6.602 1.00 0.00 H new ATOM 0 HB3 LEU A1022 1.282 16.405 7.923 1.00 0.00 H new ATOM 0 HG LEU A1022 3.337 14.674 6.755 1.00 0.00 H new ATOM 0 HD11 LEU A1022 5.267 15.908 7.650 1.00 0.00 H new ATOM 0 HD12 LEU A1022 4.473 16.780 6.317 1.00 0.00 H new ATOM 0 HD13 LEU A1022 4.211 17.297 8.000 1.00 0.00 H new ATOM 0 HD21 LEU A1022 3.952 14.393 9.118 1.00 0.00 H new ATOM 0 HD22 LEU A1022 2.810 15.682 9.565 1.00 0.00 H new ATOM 0 HD23 LEU A1022 2.208 14.169 8.849 1.00 0.00 H new ATOM 1733 N THR A1023 -1.191 15.180 7.003 1.00 0.00 N ATOM 1734 CA THR A1023 -2.281 14.452 7.631 1.00 0.00 C ATOM 1735 C THR A1023 -2.579 13.167 6.857 1.00 0.00 C ATOM 1736 O THR A1023 -2.675 12.091 7.446 1.00 0.00 O ATOM 1737 CB THR A1023 -3.483 15.394 7.729 1.00 0.00 C ATOM 1738 OG1 THR A1023 -2.916 16.640 8.128 1.00 0.00 O ATOM 1739 CG2 THR A1023 -4.422 15.027 8.880 1.00 0.00 C ATOM 0 H THR A1023 -1.374 16.171 6.847 1.00 0.00 H new ATOM 0 HA THR A1023 -2.015 14.133 8.639 1.00 0.00 H new ATOM 0 HB THR A1023 -4.036 15.376 6.790 1.00 0.00 H new ATOM 0 HG1 THR A1023 -3.614 17.207 8.518 1.00 0.00 H new ATOM 0 HG21 THR A1023 -5.258 15.726 8.905 1.00 0.00 H new ATOM 0 HG22 THR A1023 -4.800 14.015 8.733 1.00 0.00 H new ATOM 0 HG23 THR A1023 -3.878 15.078 9.823 1.00 0.00 H new ATOM 1747 N ALA A1024 -2.718 13.320 5.548 1.00 0.00 N ATOM 1748 CA ALA A1024 -3.003 12.184 4.688 1.00 0.00 C ATOM 1749 C ALA A1024 -1.744 11.326 4.549 1.00 0.00 C ATOM 1750 O ALA A1024 -1.783 10.119 4.779 1.00 0.00 O ATOM 1751 CB ALA A1024 -3.520 12.684 3.337 1.00 0.00 C ATOM 0 H ALA A1024 -2.639 14.213 5.062 1.00 0.00 H new ATOM 0 HA ALA A1024 -3.782 11.558 5.124 1.00 0.00 H new ATOM 0 HB1 ALA A1024 -3.734 11.832 2.691 1.00 0.00 H new ATOM 0 HB2 ALA A1024 -4.431 13.263 3.488 1.00 0.00 H new ATOM 0 HB3 ALA A1024 -2.764 13.313 2.868 1.00 0.00 H new ATOM 1757 N ALA A1025 -0.657 11.984 4.173 1.00 0.00 N ATOM 1758 CA ALA A1025 0.611 11.296 4.001 1.00 0.00 C ATOM 1759 C ALA A1025 0.874 10.407 5.218 1.00 0.00 C ATOM 1760 O ALA A1025 1.571 9.399 5.116 1.00 0.00 O ATOM 1761 CB ALA A1025 1.723 12.323 3.778 1.00 0.00 C ATOM 0 H ALA A1025 -0.628 12.986 3.983 1.00 0.00 H new ATOM 0 HA ALA A1025 0.581 10.651 3.123 1.00 0.00 H new ATOM 0 HB1 ALA A1025 2.674 11.807 3.649 1.00 0.00 H new ATOM 0 HB2 ALA A1025 1.504 12.909 2.885 1.00 0.00 H new ATOM 0 HB3 ALA A1025 1.784 12.986 4.641 1.00 0.00 H new ATOM 1767 N HIS A1026 0.302 10.813 6.342 1.00 0.00 N ATOM 1768 CA HIS A1026 0.465 10.066 7.577 1.00 0.00 C ATOM 1769 C HIS A1026 -0.376 8.790 7.520 1.00 0.00 C ATOM 1770 O HIS A1026 0.153 7.687 7.647 1.00 0.00 O ATOM 1771 CB HIS A1026 0.135 10.940 8.789 1.00 0.00 C ATOM 1772 CG HIS A1026 0.509 10.320 10.114 1.00 0.00 C ATOM 1773 ND1 HIS A1026 1.805 9.955 10.431 1.00 0.00 N ATOM 1774 CD2 HIS A1026 -0.256 10.006 11.198 1.00 0.00 C ATOM 1775 CE1 HIS A1026 1.809 9.444 11.654 1.00 0.00 C ATOM 1776 NE2 HIS A1026 0.530 9.477 12.127 1.00 0.00 N ATOM 0 H HIS A1026 -0.275 11.650 6.423 1.00 0.00 H new ATOM 0 HA HIS A1026 1.507 9.768 7.690 1.00 0.00 H new ATOM 0 HB2 HIS A1026 0.652 11.894 8.687 1.00 0.00 H new ATOM 0 HB3 HIS A1026 -0.934 11.155 8.789 1.00 0.00 H new ATOM 0 HD2 HIS A1026 -1.321 10.161 11.286 1.00 0.00 H new ATOM 0 HE1 HIS A1026 2.672 9.068 12.183 1.00 0.00 H new ATOM 0 HE2 HIS A1026 0.227 9.149 13.044 1.00 0.00 H new ATOM 1784 N ALA A1027 -1.673 8.982 7.329 1.00 0.00 N ATOM 1785 CA ALA A1027 -2.593 7.860 7.253 1.00 0.00 C ATOM 1786 C ALA A1027 -2.246 7.002 6.034 1.00 0.00 C ATOM 1787 O ALA A1027 -2.375 5.780 6.074 1.00 0.00 O ATOM 1788 CB ALA A1027 -4.031 8.380 7.209 1.00 0.00 C ATOM 0 H ALA A1027 -2.109 9.898 7.225 1.00 0.00 H new ATOM 0 HA ALA A1027 -2.501 7.229 8.137 1.00 0.00 H new ATOM 0 HB1 ALA A1027 -4.721 7.538 7.152 1.00 0.00 H new ATOM 0 HB2 ALA A1027 -4.237 8.957 8.110 1.00 0.00 H new ATOM 0 HB3 ALA A1027 -4.161 9.016 6.333 1.00 0.00 H new ATOM 1794 N LEU A1028 -1.811 7.677 4.980 1.00 0.00 N ATOM 1795 CA LEU A1028 -1.445 6.993 3.752 1.00 0.00 C ATOM 1796 C LEU A1028 -0.512 5.826 4.083 1.00 0.00 C ATOM 1797 O LEU A1028 -0.856 4.667 3.853 1.00 0.00 O ATOM 1798 CB LEU A1028 -0.858 7.981 2.742 1.00 0.00 C ATOM 1799 CG LEU A1028 -1.842 8.566 1.727 1.00 0.00 C ATOM 1800 CD1 LEU A1028 -1.102 9.282 0.596 1.00 0.00 C ATOM 1801 CD2 LEU A1028 -2.792 7.489 1.200 1.00 0.00 C ATOM 0 H LEU A1028 -1.704 8.691 4.951 1.00 0.00 H new ATOM 0 HA LEU A1028 -2.329 6.571 3.273 1.00 0.00 H new ATOM 0 HB2 LEU A1028 -0.402 8.804 3.292 1.00 0.00 H new ATOM 0 HB3 LEU A1028 -0.058 7.480 2.196 1.00 0.00 H new ATOM 0 HG LEU A1028 -2.453 9.312 2.235 1.00 0.00 H new ATOM 0 HD11 LEU A1028 -1.825 9.688 -0.112 1.00 0.00 H new ATOM 0 HD12 LEU A1028 -0.503 10.093 1.010 1.00 0.00 H new ATOM 0 HD13 LEU A1028 -0.450 8.575 0.083 1.00 0.00 H new ATOM 0 HD21 LEU A1028 -3.481 7.932 0.480 1.00 0.00 H new ATOM 0 HD22 LEU A1028 -2.216 6.702 0.714 1.00 0.00 H new ATOM 0 HD23 LEU A1028 -3.357 7.065 2.030 1.00 0.00 H new ATOM 1813 N ALA A1029 0.650 6.172 4.618 1.00 0.00 N ATOM 1814 CA ALA A1029 1.634 5.167 4.982 1.00 0.00 C ATOM 1815 C ALA A1029 0.963 4.085 5.830 1.00 0.00 C ATOM 1816 O ALA A1029 1.312 2.910 5.733 1.00 0.00 O ATOM 1817 CB ALA A1029 2.802 5.837 5.710 1.00 0.00 C ATOM 0 H ALA A1029 0.932 7.134 4.808 1.00 0.00 H new ATOM 0 HA ALA A1029 2.037 4.685 4.092 1.00 0.00 H new ATOM 0 HB1 ALA A1029 3.541 5.084 5.983 1.00 0.00 H new ATOM 0 HB2 ALA A1029 3.263 6.576 5.055 1.00 0.00 H new ATOM 0 HB3 ALA A1029 2.435 6.329 6.611 1.00 0.00 H new ATOM 1823 N VAL A1030 0.011 4.521 6.643 1.00 0.00 N ATOM 1824 CA VAL A1030 -0.712 3.604 7.507 1.00 0.00 C ATOM 1825 C VAL A1030 -1.628 2.722 6.655 1.00 0.00 C ATOM 1826 O VAL A1030 -1.361 1.535 6.476 1.00 0.00 O ATOM 1827 CB VAL A1030 -1.468 4.386 8.583 1.00 0.00 C ATOM 1828 CG1 VAL A1030 -2.626 3.561 9.149 1.00 0.00 C ATOM 1829 CG2 VAL A1030 -0.522 4.840 9.697 1.00 0.00 C ATOM 0 H VAL A1030 -0.276 5.497 6.721 1.00 0.00 H new ATOM 0 HA VAL A1030 -0.019 2.944 8.029 1.00 0.00 H new ATOM 0 HB VAL A1030 -1.888 5.277 8.117 1.00 0.00 H new ATOM 0 HG11 VAL A1030 -3.147 4.140 9.912 1.00 0.00 H new ATOM 0 HG12 VAL A1030 -3.320 3.310 8.347 1.00 0.00 H new ATOM 0 HG13 VAL A1030 -2.237 2.644 9.592 1.00 0.00 H new ATOM 0 HG21 VAL A1030 -1.084 5.394 10.449 1.00 0.00 H new ATOM 0 HG22 VAL A1030 -0.059 3.968 10.159 1.00 0.00 H new ATOM 0 HG23 VAL A1030 0.252 5.482 9.278 1.00 0.00 H new ATOM 1839 N ASP A1031 -2.689 3.337 6.154 1.00 0.00 N ATOM 1840 CA ASP A1031 -3.645 2.622 5.325 1.00 0.00 C ATOM 1841 C ASP A1031 -2.892 1.783 4.292 1.00 0.00 C ATOM 1842 O ASP A1031 -3.273 0.648 4.011 1.00 0.00 O ATOM 1843 CB ASP A1031 -4.555 3.594 4.572 1.00 0.00 C ATOM 1844 CG ASP A1031 -3.841 4.789 3.936 1.00 0.00 C ATOM 1845 OD1 ASP A1031 -3.066 4.546 2.985 1.00 0.00 O ATOM 1846 OD2 ASP A1031 -4.085 5.917 4.416 1.00 0.00 O ATOM 0 H ASP A1031 -2.908 4.322 6.306 1.00 0.00 H new ATOM 0 HA ASP A1031 -4.250 1.991 5.976 1.00 0.00 H new ATOM 0 HB2 ASP A1031 -5.079 3.045 3.790 1.00 0.00 H new ATOM 0 HB3 ASP A1031 -5.312 3.967 5.262 1.00 0.00 H new ATOM 1851 N ALA A1032 -1.835 2.374 3.754 1.00 0.00 N ATOM 1852 CA ALA A1032 -1.024 1.694 2.758 1.00 0.00 C ATOM 1853 C ALA A1032 -0.353 0.477 3.396 1.00 0.00 C ATOM 1854 O ALA A1032 -0.204 -0.562 2.755 1.00 0.00 O ATOM 1855 CB ALA A1032 -0.010 2.677 2.168 1.00 0.00 C ATOM 0 H ALA A1032 -1.522 3.316 3.989 1.00 0.00 H new ATOM 0 HA ALA A1032 -1.645 1.335 1.938 1.00 0.00 H new ATOM 0 HB1 ALA A1032 0.599 2.167 1.421 1.00 0.00 H new ATOM 0 HB2 ALA A1032 -0.538 3.508 1.700 1.00 0.00 H new ATOM 0 HB3 ALA A1032 0.633 3.057 2.962 1.00 0.00 H new ATOM 1861 N LYS A1033 0.033 0.645 4.652 1.00 0.00 N ATOM 1862 CA LYS A1033 0.685 -0.428 5.385 1.00 0.00 C ATOM 1863 C LYS A1033 -0.344 -1.510 5.717 1.00 0.00 C ATOM 1864 O LYS A1033 -0.122 -2.688 5.440 1.00 0.00 O ATOM 1865 CB LYS A1033 1.413 0.126 6.612 1.00 0.00 C ATOM 1866 CG LYS A1033 2.730 0.794 6.212 1.00 0.00 C ATOM 1867 CD LYS A1033 3.885 -0.209 6.244 1.00 0.00 C ATOM 1868 CE LYS A1033 5.202 0.482 6.601 1.00 0.00 C ATOM 1869 NZ LYS A1033 6.352 -0.295 6.085 1.00 0.00 N ATOM 0 H LYS A1033 -0.093 1.508 5.181 1.00 0.00 H new ATOM 0 HA LYS A1033 1.455 -0.896 4.771 1.00 0.00 H new ATOM 0 HB2 LYS A1033 0.775 0.848 7.123 1.00 0.00 H new ATOM 0 HB3 LYS A1033 1.610 -0.681 7.318 1.00 0.00 H new ATOM 0 HG2 LYS A1033 2.638 1.217 5.212 1.00 0.00 H new ATOM 0 HG3 LYS A1033 2.943 1.621 6.889 1.00 0.00 H new ATOM 0 HD2 LYS A1033 3.672 -0.991 6.972 1.00 0.00 H new ATOM 0 HD3 LYS A1033 3.977 -0.694 5.272 1.00 0.00 H new ATOM 0 HE2 LYS A1033 5.217 1.488 6.181 1.00 0.00 H new ATOM 0 HE3 LYS A1033 5.283 0.587 7.683 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 7.238 0.188 6.336 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 6.345 -1.246 6.506 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 6.282 -0.373 5.050 1.00 0.00 H new ATOM 1883 N ASN A1034 -1.447 -1.073 6.307 1.00 0.00 N ATOM 1884 CA ASN A1034 -2.510 -1.990 6.680 1.00 0.00 C ATOM 1885 C ASN A1034 -2.858 -2.875 5.481 1.00 0.00 C ATOM 1886 O ASN A1034 -3.251 -4.028 5.650 1.00 0.00 O ATOM 1887 CB ASN A1034 -3.773 -1.231 7.090 1.00 0.00 C ATOM 1888 CG ASN A1034 -4.608 -2.049 8.078 1.00 0.00 C ATOM 1889 OD1 ASN A1034 -4.244 -3.141 8.483 1.00 0.00 O ATOM 1890 ND2 ASN A1034 -5.744 -1.462 8.442 1.00 0.00 N ATOM 0 H ASN A1034 -1.627 -0.096 6.536 1.00 0.00 H new ATOM 0 HA ASN A1034 -2.160 -2.588 7.521 1.00 0.00 H new ATOM 0 HB2 ASN A1034 -3.498 -0.278 7.542 1.00 0.00 H new ATOM 0 HB3 ASN A1034 -4.368 -1.004 6.206 1.00 0.00 H new ATOM 0 HD21 ASN A1034 -6.371 -1.927 9.098 1.00 0.00 H new ATOM 0 HD22 ASN A1034 -5.989 -0.546 8.065 1.00 0.00 H new ATOM 1897 N LEU A1035 -2.701 -2.301 4.298 1.00 0.00 N ATOM 1898 CA LEU A1035 -2.994 -3.024 3.071 1.00 0.00 C ATOM 1899 C LEU A1035 -2.087 -4.252 2.979 1.00 0.00 C ATOM 1900 O LEU A1035 -2.561 -5.385 3.056 1.00 0.00 O ATOM 1901 CB LEU A1035 -2.891 -2.091 1.863 1.00 0.00 C ATOM 1902 CG LEU A1035 -3.285 -2.696 0.513 1.00 0.00 C ATOM 1903 CD1 LEU A1035 -4.014 -1.670 -0.356 1.00 0.00 C ATOM 1904 CD2 LEU A1035 -2.066 -3.287 -0.198 1.00 0.00 C ATOM 0 H LEU A1035 -2.375 -1.344 4.162 1.00 0.00 H new ATOM 0 HA LEU A1035 -4.022 -3.387 3.078 1.00 0.00 H new ATOM 0 HB2 LEU A1035 -3.521 -1.220 2.046 1.00 0.00 H new ATOM 0 HB3 LEU A1035 -1.864 -1.732 1.792 1.00 0.00 H new ATOM 0 HG LEU A1035 -3.981 -3.515 0.695 1.00 0.00 H new ATOM 0 HD11 LEU A1035 -4.283 -2.126 -1.309 1.00 0.00 H new ATOM 0 HD12 LEU A1035 -4.918 -1.337 0.155 1.00 0.00 H new ATOM 0 HD13 LEU A1035 -3.362 -0.815 -0.534 1.00 0.00 H new ATOM 0 HD21 LEU A1035 -2.373 -3.710 -1.154 1.00 0.00 H new ATOM 0 HD22 LEU A1035 -1.328 -2.503 -0.368 1.00 0.00 H new ATOM 0 HD23 LEU A1035 -1.627 -4.069 0.421 1.00 0.00 H new ATOM 1916 N LEU A1036 -0.800 -3.987 2.815 1.00 0.00 N ATOM 1917 CA LEU A1036 0.178 -5.057 2.712 1.00 0.00 C ATOM 1918 C LEU A1036 0.184 -5.864 4.012 1.00 0.00 C ATOM 1919 O LEU A1036 0.243 -7.092 3.984 1.00 0.00 O ATOM 1920 CB LEU A1036 1.549 -4.495 2.330 1.00 0.00 C ATOM 1921 CG LEU A1036 2.292 -5.238 1.219 1.00 0.00 C ATOM 1922 CD1 LEU A1036 2.032 -4.592 -0.143 1.00 0.00 C ATOM 1923 CD2 LEU A1036 3.787 -5.336 1.530 1.00 0.00 C ATOM 0 H LEU A1036 -0.411 -3.046 2.751 1.00 0.00 H new ATOM 0 HA LEU A1036 -0.093 -5.745 1.911 1.00 0.00 H new ATOM 0 HB2 LEU A1036 1.421 -3.457 2.023 1.00 0.00 H new ATOM 0 HB3 LEU A1036 2.178 -4.489 3.220 1.00 0.00 H new ATOM 0 HG LEU A1036 1.905 -6.256 1.171 1.00 0.00 H new ATOM 0 HD11 LEU A1036 2.572 -5.140 -0.915 1.00 0.00 H new ATOM 0 HD12 LEU A1036 0.964 -4.618 -0.360 1.00 0.00 H new ATOM 0 HD13 LEU A1036 2.374 -3.557 -0.126 1.00 0.00 H new ATOM 0 HD21 LEU A1036 4.292 -5.869 0.724 1.00 0.00 H new ATOM 0 HD22 LEU A1036 4.206 -4.334 1.621 1.00 0.00 H new ATOM 0 HD23 LEU A1036 3.929 -5.875 2.467 1.00 0.00 H new ATOM 1935 N ASP A1037 0.122 -5.140 5.120 1.00 0.00 N ATOM 1936 CA ASP A1037 0.120 -5.774 6.428 1.00 0.00 C ATOM 1937 C ASP A1037 -0.788 -7.005 6.392 1.00 0.00 C ATOM 1938 O ASP A1037 -0.423 -8.065 6.898 1.00 0.00 O ATOM 1939 CB ASP A1037 -0.416 -4.822 7.499 1.00 0.00 C ATOM 1940 CG ASP A1037 -0.153 -5.259 8.942 1.00 0.00 C ATOM 1941 OD1 ASP A1037 1.007 -5.636 9.218 1.00 0.00 O ATOM 1942 OD2 ASP A1037 -1.117 -5.206 9.736 1.00 0.00 O ATOM 0 H ASP A1037 0.073 -4.121 5.139 1.00 0.00 H new ATOM 0 HA ASP A1037 1.146 -6.050 6.671 1.00 0.00 H new ATOM 0 HB2 ASP A1037 0.029 -3.839 7.346 1.00 0.00 H new ATOM 0 HB3 ASP A1037 -1.491 -4.710 7.359 1.00 0.00 H new ATOM 1947 N VAL A1038 -1.954 -6.824 5.788 1.00 0.00 N ATOM 1948 CA VAL A1038 -2.916 -7.907 5.680 1.00 0.00 C ATOM 1949 C VAL A1038 -2.334 -9.015 4.800 1.00 0.00 C ATOM 1950 O VAL A1038 -2.450 -10.195 5.124 1.00 0.00 O ATOM 1951 CB VAL A1038 -4.252 -7.370 5.160 1.00 0.00 C ATOM 1952 CG1 VAL A1038 -5.261 -8.503 4.969 1.00 0.00 C ATOM 1953 CG2 VAL A1038 -4.808 -6.291 6.091 1.00 0.00 C ATOM 0 H VAL A1038 -2.254 -5.944 5.369 1.00 0.00 H new ATOM 0 HA VAL A1038 -3.114 -8.341 6.660 1.00 0.00 H new ATOM 0 HB VAL A1038 -4.074 -6.913 4.187 1.00 0.00 H new ATOM 0 HG11 VAL A1038 -6.201 -8.094 4.599 1.00 0.00 H new ATOM 0 HG12 VAL A1038 -4.869 -9.221 4.249 1.00 0.00 H new ATOM 0 HG13 VAL A1038 -5.433 -9.002 5.923 1.00 0.00 H new ATOM 0 HG21 VAL A1038 -5.757 -5.926 5.699 1.00 0.00 H new ATOM 0 HG22 VAL A1038 -4.963 -6.712 7.084 1.00 0.00 H new ATOM 0 HG23 VAL A1038 -4.100 -5.465 6.154 1.00 0.00 H new ATOM 1963 N ILE A1039 -1.721 -8.594 3.703 1.00 0.00 N ATOM 1964 CA ILE A1039 -1.120 -9.536 2.774 1.00 0.00 C ATOM 1965 C ILE A1039 -0.141 -10.437 3.529 1.00 0.00 C ATOM 1966 O ILE A1039 -0.162 -11.656 3.366 1.00 0.00 O ATOM 1967 CB ILE A1039 -0.489 -8.795 1.593 1.00 0.00 C ATOM 1968 CG1 ILE A1039 -1.532 -8.490 0.516 1.00 0.00 C ATOM 1969 CG2 ILE A1039 0.704 -9.573 1.033 1.00 0.00 C ATOM 1970 CD1 ILE A1039 -0.911 -7.707 -0.642 1.00 0.00 C ATOM 0 H ILE A1039 -1.628 -7.614 3.437 1.00 0.00 H new ATOM 0 HA ILE A1039 -1.882 -10.185 2.343 1.00 0.00 H new ATOM 0 HB ILE A1039 -0.110 -7.838 1.953 1.00 0.00 H new ATOM 0 HG12 ILE A1039 -1.958 -9.421 0.143 1.00 0.00 H new ATOM 0 HG13 ILE A1039 -2.351 -7.916 0.950 1.00 0.00 H new ATOM 0 HG21 ILE A1039 1.135 -9.025 0.195 1.00 0.00 H new ATOM 0 HG22 ILE A1039 1.457 -9.695 1.812 1.00 0.00 H new ATOM 0 HG23 ILE A1039 0.372 -10.554 0.693 1.00 0.00 H new ATOM 0 HD11 ILE A1039 -1.674 -7.503 -1.394 1.00 0.00 H new ATOM 0 HD12 ILE A1039 -0.508 -6.765 -0.270 1.00 0.00 H new ATOM 0 HD13 ILE A1039 -0.109 -8.294 -1.089 1.00 0.00 H new ATOM 1982 N ASP A1040 0.693 -9.802 4.339 1.00 0.00 N ATOM 1983 CA ASP A1040 1.678 -10.531 5.120 1.00 0.00 C ATOM 1984 C ASP A1040 0.982 -11.655 5.891 1.00 0.00 C ATOM 1985 O ASP A1040 1.506 -12.763 5.988 1.00 0.00 O ATOM 1986 CB ASP A1040 2.364 -9.615 6.136 1.00 0.00 C ATOM 1987 CG ASP A1040 3.747 -10.080 6.596 1.00 0.00 C ATOM 1988 OD1 ASP A1040 4.469 -10.641 5.743 1.00 0.00 O ATOM 1989 OD2 ASP A1040 4.051 -9.863 7.789 1.00 0.00 O ATOM 0 H ASP A1040 0.707 -8.791 4.471 1.00 0.00 H new ATOM 0 HA ASP A1040 2.424 -10.930 4.433 1.00 0.00 H new ATOM 0 HB2 ASP A1040 2.458 -8.620 5.700 1.00 0.00 H new ATOM 0 HB3 ASP A1040 1.720 -9.520 7.010 1.00 0.00 H new ATOM 1994 N GLN A1041 -0.189 -11.329 6.418 1.00 0.00 N ATOM 1995 CA GLN A1041 -0.962 -12.297 7.177 1.00 0.00 C ATOM 1996 C GLN A1041 -1.384 -13.462 6.279 1.00 0.00 C ATOM 1997 O GLN A1041 -1.640 -14.563 6.763 1.00 0.00 O ATOM 1998 CB GLN A1041 -2.180 -11.637 7.827 1.00 0.00 C ATOM 1999 CG GLN A1041 -1.871 -11.210 9.264 1.00 0.00 C ATOM 2000 CD GLN A1041 -3.158 -11.033 10.072 1.00 0.00 C ATOM 2001 OE1 GLN A1041 -4.217 -11.525 9.718 1.00 0.00 O ATOM 2002 NE2 GLN A1041 -3.009 -10.304 11.174 1.00 0.00 N ATOM 0 H GLN A1041 -0.621 -10.409 6.334 1.00 0.00 H new ATOM 0 HA GLN A1041 -0.332 -12.689 7.976 1.00 0.00 H new ATOM 0 HB2 GLN A1041 -2.482 -10.768 7.243 1.00 0.00 H new ATOM 0 HB3 GLN A1041 -3.020 -12.332 7.823 1.00 0.00 H new ATOM 0 HG2 GLN A1041 -1.238 -11.958 9.741 1.00 0.00 H new ATOM 0 HG3 GLN A1041 -1.310 -10.275 9.257 1.00 0.00 H new ATOM 0 HE21 GLN A1041 -2.094 -9.921 11.412 1.00 0.00 H new ATOM 0 HE22 GLN A1041 -3.810 -10.128 11.781 1.00 0.00 H new ATOM 2011 N ALA A1042 -1.443 -13.178 4.986 1.00 0.00 N ATOM 2012 CA ALA A1042 -1.829 -14.188 4.015 1.00 0.00 C ATOM 2013 C ALA A1042 -0.657 -15.146 3.788 1.00 0.00 C ATOM 2014 O ALA A1042 -0.787 -16.351 3.995 1.00 0.00 O ATOM 2015 CB ALA A1042 -2.284 -13.507 2.723 1.00 0.00 C ATOM 0 H ALA A1042 -1.230 -12.263 4.588 1.00 0.00 H new ATOM 0 HA ALA A1042 -2.668 -14.776 4.386 1.00 0.00 H new ATOM 0 HB1 ALA A1042 -2.573 -14.265 1.995 1.00 0.00 H new ATOM 0 HB2 ALA A1042 -3.136 -12.861 2.933 1.00 0.00 H new ATOM 0 HB3 ALA A1042 -1.467 -12.909 2.319 1.00 0.00 H new ATOM 2021 N ARG A1043 0.460 -14.573 3.366 1.00 0.00 N ATOM 2022 CA ARG A1043 1.654 -15.360 3.109 1.00 0.00 C ATOM 2023 C ARG A1043 1.761 -16.507 4.117 1.00 0.00 C ATOM 2024 O ARG A1043 1.799 -17.675 3.731 1.00 0.00 O ATOM 2025 CB ARG A1043 2.913 -14.496 3.196 1.00 0.00 C ATOM 2026 CG ARG A1043 2.887 -13.382 2.147 1.00 0.00 C ATOM 2027 CD ARG A1043 4.184 -13.364 1.335 1.00 0.00 C ATOM 2028 NE ARG A1043 3.902 -13.708 -0.077 1.00 0.00 N ATOM 2029 CZ ARG A1043 3.806 -14.962 -0.540 1.00 0.00 C ATOM 2030 NH1 ARG A1043 3.969 -15.998 0.294 1.00 0.00 N ATOM 2031 NH2 ARG A1043 3.547 -15.180 -1.836 1.00 0.00 N ATOM 0 H ARG A1043 0.564 -13.573 3.195 1.00 0.00 H new ATOM 0 HA ARG A1043 1.573 -15.764 2.100 1.00 0.00 H new ATOM 0 HB2 ARG A1043 2.991 -14.061 4.192 1.00 0.00 H new ATOM 0 HB3 ARG A1043 3.796 -15.118 3.049 1.00 0.00 H new ATOM 0 HG2 ARG A1043 2.038 -13.526 1.479 1.00 0.00 H new ATOM 0 HG3 ARG A1043 2.747 -12.419 2.638 1.00 0.00 H new ATOM 0 HD2 ARG A1043 4.645 -12.378 1.393 1.00 0.00 H new ATOM 0 HD3 ARG A1043 4.896 -14.074 1.756 1.00 0.00 H new ATOM 0 HE ARG A1043 3.773 -12.943 -0.739 1.00 0.00 H new ATOM 0 HH11 ARG A1043 4.166 -15.832 1.281 1.00 0.00 H new ATOM 0 HH12 ARG A1043 3.896 -16.953 -0.058 1.00 0.00 H new ATOM 0 HH21 ARG A1043 3.423 -14.391 -2.471 1.00 0.00 H new ATOM 0 HH22 ARG A1043 3.474 -16.135 -2.188 1.00 0.00 H new ATOM 2045 N LEU A1044 1.805 -16.134 5.387 1.00 0.00 N ATOM 2046 CA LEU A1044 1.907 -17.117 6.453 1.00 0.00 C ATOM 2047 C LEU A1044 0.813 -18.172 6.273 1.00 0.00 C ATOM 2048 O LEU A1044 1.088 -19.370 6.318 1.00 0.00 O ATOM 2049 CB LEU A1044 1.881 -16.430 7.819 1.00 0.00 C ATOM 2050 CG LEU A1044 0.787 -15.379 8.021 1.00 0.00 C ATOM 2051 CD1 LEU A1044 -0.446 -15.991 8.689 1.00 0.00 C ATOM 2052 CD2 LEU A1044 1.322 -14.174 8.798 1.00 0.00 C ATOM 0 H LEU A1044 1.772 -15.165 5.703 1.00 0.00 H new ATOM 0 HA LEU A1044 2.864 -17.637 6.403 1.00 0.00 H new ATOM 0 HB2 LEU A1044 1.768 -17.196 8.586 1.00 0.00 H new ATOM 0 HB3 LEU A1044 2.848 -15.955 7.983 1.00 0.00 H new ATOM 0 HG LEU A1044 0.475 -15.018 7.041 1.00 0.00 H new ATOM 0 HD11 LEU A1044 -1.208 -15.222 8.821 1.00 0.00 H new ATOM 0 HD12 LEU A1044 -0.841 -16.790 8.061 1.00 0.00 H new ATOM 0 HD13 LEU A1044 -0.169 -16.397 9.662 1.00 0.00 H new ATOM 0 HD21 LEU A1044 0.525 -13.442 8.928 1.00 0.00 H new ATOM 0 HD22 LEU A1044 1.678 -14.500 9.775 1.00 0.00 H new ATOM 0 HD23 LEU A1044 2.145 -13.720 8.245 1.00 0.00 H new ATOM 2064 N LYS A1045 -0.404 -17.688 6.074 1.00 0.00 N ATOM 2065 CA LYS A1045 -1.540 -18.574 5.888 1.00 0.00 C ATOM 2066 C LYS A1045 -1.171 -19.664 4.879 1.00 0.00 C ATOM 2067 O LYS A1045 -1.723 -20.763 4.918 1.00 0.00 O ATOM 2068 CB LYS A1045 -2.786 -17.775 5.501 1.00 0.00 C ATOM 2069 CG LYS A1045 -4.040 -18.648 5.566 1.00 0.00 C ATOM 2070 CD LYS A1045 -4.483 -19.077 4.165 1.00 0.00 C ATOM 2071 CE LYS A1045 -5.870 -19.722 4.202 1.00 0.00 C ATOM 2072 NZ LYS A1045 -5.857 -21.018 3.487 1.00 0.00 N ATOM 0 H LYS A1045 -0.628 -16.694 6.038 1.00 0.00 H new ATOM 0 HA LYS A1045 -1.789 -19.075 6.823 1.00 0.00 H new ATOM 0 HB2 LYS A1045 -2.898 -16.922 6.170 1.00 0.00 H new ATOM 0 HB3 LYS A1045 -2.668 -17.376 4.493 1.00 0.00 H new ATOM 0 HG2 LYS A1045 -3.842 -19.530 6.175 1.00 0.00 H new ATOM 0 HG3 LYS A1045 -4.845 -18.098 6.054 1.00 0.00 H new ATOM 0 HD2 LYS A1045 -4.498 -18.211 3.503 1.00 0.00 H new ATOM 0 HD3 LYS A1045 -3.761 -19.781 3.751 1.00 0.00 H new ATOM 0 HE2 LYS A1045 -6.180 -19.873 5.236 1.00 0.00 H new ATOM 0 HE3 LYS A1045 -6.600 -19.055 3.745 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 -6.806 -21.443 3.521 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 -5.582 -20.865 2.496 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 -5.174 -21.658 3.941 1.00 0.00 H new ATOM 2086 N MET A1046 -0.242 -19.321 4.000 1.00 0.00 N ATOM 2087 CA MET A1046 0.207 -20.257 2.982 1.00 0.00 C ATOM 2088 C MET A1046 1.315 -21.163 3.521 1.00 0.00 C ATOM 2089 O MET A1046 1.254 -22.382 3.369 1.00 0.00 O ATOM 2090 CB MET A1046 0.726 -19.482 1.769 1.00 0.00 C ATOM 2091 CG MET A1046 0.602 -20.315 0.492 1.00 0.00 C ATOM 2092 SD MET A1046 0.457 -19.241 -0.926 1.00 0.00 S ATOM 2093 CE MET A1046 1.472 -17.876 -0.386 1.00 0.00 C ATOM 0 H MET A1046 0.213 -18.408 3.971 1.00 0.00 H new ATOM 0 HA MET A1046 -0.638 -20.881 2.691 1.00 0.00 H new ATOM 0 HB2 MET A1046 0.164 -18.554 1.658 1.00 0.00 H new ATOM 0 HB3 MET A1046 1.769 -19.206 1.928 1.00 0.00 H new ATOM 0 HG2 MET A1046 1.474 -20.960 0.382 1.00 0.00 H new ATOM 0 HG3 MET A1046 -0.270 -20.966 0.556 1.00 0.00 H new ATOM 0 HE1 MET A1046 1.784 -17.290 -1.251 1.00 0.00 H new ATOM 0 HE2 MET A1046 0.900 -17.244 0.293 1.00 0.00 H new ATOM 0 HE3 MET A1046 2.352 -18.259 0.130 1.00 0.00 H new ATOM 2103 N ILE A1047 2.303 -20.533 4.141 1.00 0.00 N ATOM 2104 CA ILE A1047 3.423 -21.268 4.703 1.00 0.00 C ATOM 2105 C ILE A1047 2.906 -22.248 5.759 1.00 0.00 C ATOM 2106 O ILE A1047 3.124 -23.453 5.650 1.00 0.00 O ATOM 2107 CB ILE A1047 4.487 -20.302 5.229 1.00 0.00 C ATOM 2108 CG1 ILE A1047 5.217 -19.610 4.076 1.00 0.00 C ATOM 2109 CG2 ILE A1047 5.455 -21.015 6.175 1.00 0.00 C ATOM 2110 CD1 ILE A1047 5.043 -18.092 4.150 1.00 0.00 C ATOM 0 H ILE A1047 2.351 -19.522 4.266 1.00 0.00 H new ATOM 0 HA ILE A1047 3.916 -21.860 3.932 1.00 0.00 H new ATOM 0 HB ILE A1047 3.987 -19.524 5.806 1.00 0.00 H new ATOM 0 HG12 ILE A1047 6.277 -19.860 4.110 1.00 0.00 H new ATOM 0 HG13 ILE A1047 4.833 -19.978 3.125 1.00 0.00 H new ATOM 0 HG21 ILE A1047 6.201 -20.306 6.534 1.00 0.00 H new ATOM 0 HG22 ILE A1047 4.903 -21.421 7.022 1.00 0.00 H new ATOM 0 HG23 ILE A1047 5.952 -21.826 5.643 1.00 0.00 H new ATOM 0 HD11 ILE A1047 5.571 -17.624 3.319 1.00 0.00 H new ATOM 0 HD12 ILE A1047 3.983 -17.844 4.092 1.00 0.00 H new ATOM 0 HD13 ILE A1047 5.450 -17.725 5.092 1.00 0.00 H new ATOM 2122 N SER A1048 2.232 -21.693 6.755 1.00 0.00 N ATOM 2123 CA SER A1048 1.683 -22.503 7.829 1.00 0.00 C ATOM 2124 C SER A1048 0.391 -23.179 7.366 1.00 0.00 C ATOM 2125 O SER A1048 -0.690 -22.870 7.866 1.00 0.00 O ATOM 2126 CB SER A1048 1.422 -21.658 9.078 1.00 0.00 C ATOM 2127 OG SER A1048 0.395 -20.694 8.865 1.00 0.00 O ATOM 0 H SER A1048 2.054 -20.692 6.841 1.00 0.00 H new ATOM 0 HA SER A1048 2.414 -23.269 8.088 1.00 0.00 H new ATOM 0 HB2 SER A1048 1.141 -22.310 9.905 1.00 0.00 H new ATOM 0 HB3 SER A1048 2.341 -21.150 9.371 1.00 0.00 H new ATOM 0 HG SER A1048 -0.415 -21.144 8.546 1.00 0.00 H new ATOM 2133 N GLN A1049 0.545 -24.091 6.417 1.00 0.00 N ATOM 2134 CA GLN A1049 -0.596 -24.813 5.881 1.00 0.00 C ATOM 2135 C GLN A1049 -0.124 -25.978 5.008 1.00 0.00 C ATOM 2136 O GLN A1049 -0.284 -27.140 5.377 1.00 0.00 O ATOM 2137 CB GLN A1049 -1.518 -23.878 5.096 1.00 0.00 C ATOM 2138 CG GLN A1049 -2.895 -23.787 5.756 1.00 0.00 C ATOM 2139 CD GLN A1049 -3.795 -24.941 5.309 1.00 0.00 C ATOM 2140 OE1 GLN A1049 -3.426 -25.770 4.494 1.00 0.00 O ATOM 2141 NE2 GLN A1049 -4.993 -24.948 5.886 1.00 0.00 N ATOM 0 H GLN A1049 1.443 -24.346 6.006 1.00 0.00 H new ATOM 0 HA GLN A1049 -1.169 -25.218 6.715 1.00 0.00 H new ATOM 0 HB2 GLN A1049 -1.072 -22.885 5.038 1.00 0.00 H new ATOM 0 HB3 GLN A1049 -1.624 -24.240 4.073 1.00 0.00 H new ATOM 0 HG2 GLN A1049 -2.784 -23.806 6.840 1.00 0.00 H new ATOM 0 HG3 GLN A1049 -3.363 -22.836 5.500 1.00 0.00 H new ATOM 0 HE21 GLN A1049 -5.238 -24.224 6.561 1.00 0.00 H new ATOM 0 HE22 GLN A1049 -5.667 -25.678 5.654 1.00 0.00 H new ATOM 2150 N SER A1050 0.449 -25.625 3.866 1.00 0.00 N ATOM 2151 CA SER A1050 0.946 -26.626 2.937 1.00 0.00 C ATOM 2152 C SER A1050 1.979 -26.002 1.997 1.00 0.00 C ATOM 2153 O SER A1050 1.619 -25.306 1.049 1.00 0.00 O ATOM 2154 CB SER A1050 -0.198 -27.246 2.132 1.00 0.00 C ATOM 2155 OG SER A1050 0.213 -28.420 1.437 1.00 0.00 O ATOM 0 H SER A1050 0.580 -24.660 3.563 1.00 0.00 H new ATOM 0 HA SER A1050 1.422 -27.420 3.513 1.00 0.00 H new ATOM 0 HB2 SER A1050 -1.022 -27.491 2.802 1.00 0.00 H new ATOM 0 HB3 SER A1050 -0.576 -26.515 1.417 1.00 0.00 H new ATOM 0 HG SER A1050 0.712 -28.166 0.633 1.00 0.00 H new ATOM 2161 N ARG A1051 3.241 -26.273 2.293 1.00 0.00 N ATOM 2162 CA ARG A1051 4.329 -25.746 1.487 1.00 0.00 C ATOM 2163 C ARG A1051 4.317 -26.386 0.097 1.00 0.00 C ATOM 2164 O ARG A1051 4.345 -25.686 -0.914 1.00 0.00 O ATOM 2165 CB ARG A1051 5.683 -26.007 2.149 1.00 0.00 C ATOM 2166 CG ARG A1051 6.350 -24.695 2.569 1.00 0.00 C ATOM 2167 CD ARG A1051 7.680 -24.958 3.277 1.00 0.00 C ATOM 2168 NE ARG A1051 8.696 -23.981 2.826 1.00 0.00 N ATOM 2169 CZ ARG A1051 8.797 -22.731 3.298 1.00 0.00 C ATOM 2170 NH1 ARG A1051 7.945 -22.298 4.237 1.00 0.00 N ATOM 2171 NH2 ARG A1051 9.750 -21.914 2.830 1.00 0.00 N ATOM 0 H ARG A1051 3.535 -26.851 3.080 1.00 0.00 H new ATOM 0 HA ARG A1051 4.184 -24.669 1.397 1.00 0.00 H new ATOM 0 HB2 ARG A1051 5.548 -26.646 3.022 1.00 0.00 H new ATOM 0 HB3 ARG A1051 6.332 -26.544 1.458 1.00 0.00 H new ATOM 0 HG2 ARG A1051 6.518 -24.071 1.691 1.00 0.00 H new ATOM 0 HG3 ARG A1051 5.685 -24.141 3.231 1.00 0.00 H new ATOM 0 HD2 ARG A1051 7.547 -24.885 4.356 1.00 0.00 H new ATOM 0 HD3 ARG A1051 8.020 -25.972 3.066 1.00 0.00 H new ATOM 0 HE ARG A1051 9.361 -24.278 2.111 1.00 0.00 H new ATOM 0 HH11 ARG A1051 7.219 -22.920 4.593 1.00 0.00 H new ATOM 0 HH12 ARG A1051 8.022 -21.346 4.596 1.00 0.00 H new ATOM 0 HH21 ARG A1051 10.398 -22.244 2.115 1.00 0.00 H new ATOM 0 HH22 ARG A1051 9.827 -20.962 3.189 1.00 0.00 H new ATOM 2185 N PRO A1052 4.276 -27.746 0.091 1.00 0.00 N ATOM 2186 CA PRO A1052 4.260 -28.488 -1.158 1.00 0.00 C ATOM 2187 C PRO A1052 2.886 -28.409 -1.826 1.00 0.00 C ATOM 2188 O PRO A1052 1.861 -28.404 -1.147 1.00 0.00 O ATOM 2189 CB PRO A1052 4.654 -29.906 -0.777 1.00 0.00 C ATOM 2190 CG PRO A1052 4.424 -30.015 0.721 1.00 0.00 C ATOM 2191 CD PRO A1052 4.242 -28.608 1.268 1.00 0.00 C ATOM 0 HA PRO A1052 4.950 -28.081 -1.898 1.00 0.00 H new ATOM 0 HB2 PRO A1052 4.053 -30.637 -1.318 1.00 0.00 H new ATOM 0 HB3 PRO A1052 5.697 -30.102 -1.027 1.00 0.00 H new ATOM 0 HG2 PRO A1052 3.543 -30.622 0.929 1.00 0.00 H new ATOM 0 HG3 PRO A1052 5.270 -30.505 1.203 1.00 0.00 H new ATOM 0 HD2 PRO A1052 3.298 -28.510 1.803 1.00 0.00 H new ATOM 0 HD3 PRO A1052 5.035 -28.351 1.970 1.00 0.00 H new ATOM 2199 N HIS A1053 2.910 -28.348 -3.149 1.00 0.00 N ATOM 2200 CA HIS A1053 1.679 -28.269 -3.917 1.00 0.00 C ATOM 2201 C HIS A1053 1.085 -29.670 -4.081 1.00 0.00 C ATOM 2202 O HIS A1053 -0.085 -29.892 -3.775 1.00 0.00 O ATOM 2203 CB HIS A1053 1.916 -27.566 -5.255 1.00 0.00 C ATOM 2204 CG HIS A1053 2.621 -28.420 -6.281 1.00 0.00 C ATOM 2205 ND1 HIS A1053 2.190 -28.525 -7.592 1.00 0.00 N ATOM 2206 CD2 HIS A1053 3.730 -29.207 -6.176 1.00 0.00 C ATOM 2207 CE1 HIS A1053 3.010 -29.342 -8.238 1.00 0.00 C ATOM 2208 NE2 HIS A1053 3.963 -29.764 -7.358 1.00 0.00 N ATOM 0 H HIS A1053 3.763 -28.352 -3.709 1.00 0.00 H new ATOM 0 HA HIS A1053 0.950 -27.663 -3.379 1.00 0.00 H new ATOM 0 HB2 HIS A1053 0.956 -27.247 -5.661 1.00 0.00 H new ATOM 0 HB3 HIS A1053 2.504 -26.665 -5.081 1.00 0.00 H new ATOM 0 HD2 HIS A1053 4.319 -29.352 -5.282 1.00 0.00 H new ATOM 0 HE1 HIS A1053 2.936 -29.624 -9.278 1.00 0.00 H new ATOM 0 HE2 HIS A1053 4.729 -30.403 -7.573 1.00 0.00 H new TER 2216 HIS A1053