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 940 SER OG : rot 140:sc= 0.00885 USER MOD Set 1.2: A1021 MET CE :methyl 143:sc= -0.844 (180deg=-4.62!) USER MOD Set 2.1: A 944 GLN : amide:sc= 0 X(o=-3.5,f=-3.1) USER MOD Set 2.2: A1014 GLN : amide:sc= -3.46! C(o=-3.5!,f=-6.9!) USER MOD Single : A 915 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 917 ASN : amide:sc= -0.337 K(o=-0.34,f=-2.8!) USER MOD Single : A 921 SER OG : rot -71:sc= 0.267 USER MOD Single : A 922 ASN : amide:sc= -1.65 K(o=-1.7,f=-4.4!) USER MOD Single : A 924 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 928 ASN : amide:sc= -3.06 K(o=-3.1,f=-6.7!) USER MOD Single : A 930 THR OG1 : rot 98:sc= 0.933 USER MOD Single : A 934 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 939 MET CE :methyl -147:sc= -1.11 (180deg=-2.32) USER MOD Single : A 941 SER OG : rot 180:sc= 0 USER MOD Single : A 942 LYS NZ :NH3+ -106:sc= -0.181 (180deg=-2.06!) USER MOD Single : A 951 TYR OH : rot 19:sc= 0.877 USER MOD Single : A 954 MET CE :methyl -127:sc= -1.21 (180deg=-7.22!) USER MOD Single : A 956 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0441) USER MOD Single : A 964 THR OG1 : rot 180:sc= 0 USER MOD Single : A 968 THR OG1 : rot -34:sc= -0.623 USER MOD Single : A 972 SER OG : rot -179:sc= -0.296 USER MOD Single : A 979 SER OG : rot 180:sc= 0 USER MOD Single : A 980 THR OG1 : rot -4:sc= -1.32 USER MOD Single : A 981 HIS : no HD1:sc= -0.981 X(o=-0.98,f=-0.53) USER MOD Single : A 986 MET CE :methyl -157:sc= -1.63 (180deg=-3.66!) USER MOD Single : A 988 GLN : amide:sc= -5.23 K(o=-5.2,f=-14!) USER MOD Single : A 989 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 992 ASN : amide:sc= -0.84 K(o=-0.84,f=-5.4!) USER MOD Single : A 993 SER OG : rot 180:sc= 0 USER MOD Single : A1000 ASN : amide:sc=-0.00821 X(o=-0.0082,f=0) USER MOD Single : A1001 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0248) USER MOD Single : A1002 MET CE :methyl 174:sc= 0 (180deg=-0.0716) USER MOD Single : A1003 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1006 GLN : amide:sc= -8.05! C(o=-8.1!,f=-9.3!) USER MOD Single : A1007 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1008 TYR OH : rot 180:sc= 0 USER MOD Single : A1010 MET CE :methyl -120:sc= -7.66! (180deg=-12.6!) USER MOD Single : A1011 THR OG1 : rot -170:sc= 0 USER MOD Single : A1012 SER OG : rot 180:sc= -0.723 USER MOD Single : A1015 GLN : amide:sc= -0.0185 X(o=-0.019,f=-0.046) USER MOD Single : A1017 TYR OH : rot 86:sc= 1.09 USER MOD Single : A1018 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.097) USER MOD Single : A1019 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1020 GLN : amide:sc= 0.152 K(o=0.15,f=-1.5!) USER MOD Single : A1023 THR OG1 : rot 95:sc= 0.715 USER MOD Single : A1026 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1033 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1034 ASN : amide:sc= -0.251 K(o=-0.25,f=-2.5!) USER MOD Single : A1041 GLN : amide:sc= -0.0164 X(o=-0.016,f=0) USER MOD Single : A1045 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1046 MET CE :methyl -141:sc= -0.646 (180deg=-2.81!) USER MOD Single : A1048 SER OG : rot 180:sc= 0 USER MOD Single : A1049 GLN : amide:sc= -0.608 K(o=-0.61,f=-0.078) USER MOD Single : A1050 SER OG : rot 180:sc= 0 USER MOD Single : A1053 HIS : no HD1:sc= -0.271 X(o=-0.27,f=-0.56) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 915 13.034 -22.148 -2.333 1.00 0.00 N ATOM 2 CA MET A 915 11.844 -21.356 -2.593 1.00 0.00 C ATOM 3 C MET A 915 11.317 -21.606 -4.007 1.00 0.00 C ATOM 4 O MET A 915 12.095 -21.826 -4.934 1.00 0.00 O ATOM 5 CB MET A 915 12.173 -19.871 -2.425 1.00 0.00 C ATOM 6 CG MET A 915 11.113 -19.167 -1.575 1.00 0.00 C ATOM 7 SD MET A 915 11.834 -17.768 -0.734 1.00 0.00 S ATOM 8 CE MET A 915 11.092 -17.958 0.878 1.00 0.00 C ATOM 0 HA MET A 915 11.072 -21.649 -1.881 1.00 0.00 H new ATOM 0 HB2 MET A 915 13.151 -19.762 -1.956 1.00 0.00 H new ATOM 0 HB3 MET A 915 12.234 -19.395 -3.404 1.00 0.00 H new ATOM 0 HG2 MET A 915 10.289 -18.836 -2.207 1.00 0.00 H new ATOM 0 HG3 MET A 915 10.697 -19.864 -0.848 1.00 0.00 H new ATOM 0 HE1 MET A 915 11.438 -17.159 1.534 1.00 0.00 H new ATOM 0 HE2 MET A 915 10.007 -17.909 0.787 1.00 0.00 H new ATOM 0 HE3 MET A 915 11.377 -18.922 1.299 1.00 0.00 H new ATOM 18 N ALA A 916 9.998 -21.564 -4.128 1.00 0.00 N ATOM 19 CA ALA A 916 9.357 -21.783 -5.414 1.00 0.00 C ATOM 20 C ALA A 916 9.691 -20.620 -6.350 1.00 0.00 C ATOM 21 O ALA A 916 10.243 -19.609 -5.917 1.00 0.00 O ATOM 22 CB ALA A 916 7.850 -21.955 -5.211 1.00 0.00 C ATOM 0 H ALA A 916 9.356 -21.382 -3.357 1.00 0.00 H new ATOM 0 HA ALA A 916 9.729 -22.696 -5.878 1.00 0.00 H new ATOM 0 HB1 ALA A 916 7.369 -22.119 -6.175 1.00 0.00 H new ATOM 0 HB2 ALA A 916 7.666 -22.812 -4.563 1.00 0.00 H new ATOM 0 HB3 ALA A 916 7.440 -21.057 -4.750 1.00 0.00 H new ATOM 28 N ASN A 917 9.341 -20.801 -7.615 1.00 0.00 N ATOM 29 CA ASN A 917 9.596 -19.779 -8.616 1.00 0.00 C ATOM 30 C ASN A 917 8.498 -18.716 -8.545 1.00 0.00 C ATOM 31 O ASN A 917 7.357 -18.972 -8.925 1.00 0.00 O ATOM 32 CB ASN A 917 9.588 -20.374 -10.025 1.00 0.00 C ATOM 33 CG ASN A 917 11.011 -20.516 -10.569 1.00 0.00 C ATOM 34 OD1 ASN A 917 11.989 -20.200 -9.911 1.00 0.00 O ATOM 35 ND2 ASN A 917 11.072 -21.008 -11.803 1.00 0.00 N ATOM 0 H ASN A 917 8.883 -21.640 -7.970 1.00 0.00 H new ATOM 0 HA ASN A 917 10.575 -19.346 -8.413 1.00 0.00 H new ATOM 0 HB2 ASN A 917 9.102 -21.350 -10.009 1.00 0.00 H new ATOM 0 HB3 ASN A 917 9.003 -19.738 -10.689 1.00 0.00 H new ATOM 0 HD21 ASN A 917 11.977 -21.141 -12.255 1.00 0.00 H new ATOM 0 HD22 ASN A 917 10.214 -21.252 -12.298 1.00 0.00 H new ATOM 42 N LEU A 918 8.882 -17.547 -8.054 1.00 0.00 N ATOM 43 CA LEU A 918 7.944 -16.444 -7.928 1.00 0.00 C ATOM 44 C LEU A 918 8.502 -15.220 -8.658 1.00 0.00 C ATOM 45 O LEU A 918 9.504 -14.645 -8.236 1.00 0.00 O ATOM 46 CB LEU A 918 7.615 -16.186 -6.457 1.00 0.00 C ATOM 47 CG LEU A 918 6.240 -16.662 -5.983 1.00 0.00 C ATOM 48 CD1 LEU A 918 6.192 -18.189 -5.887 1.00 0.00 C ATOM 49 CD2 LEU A 918 5.852 -15.992 -4.664 1.00 0.00 C ATOM 0 H LEU A 918 9.830 -17.339 -7.739 1.00 0.00 H new ATOM 0 HA LEU A 918 6.995 -16.694 -8.403 1.00 0.00 H new ATOM 0 HB2 LEU A 918 8.376 -16.670 -5.845 1.00 0.00 H new ATOM 0 HB3 LEU A 918 7.690 -15.115 -6.271 1.00 0.00 H new ATOM 0 HG LEU A 918 5.500 -16.362 -6.725 1.00 0.00 H new ATOM 0 HD11 LEU A 918 5.204 -18.501 -5.548 1.00 0.00 H new ATOM 0 HD12 LEU A 918 6.393 -18.622 -6.867 1.00 0.00 H new ATOM 0 HD13 LEU A 918 6.945 -18.533 -5.177 1.00 0.00 H new ATOM 0 HD21 LEU A 918 4.871 -16.348 -4.350 1.00 0.00 H new ATOM 0 HD22 LEU A 918 6.589 -16.239 -3.900 1.00 0.00 H new ATOM 0 HD23 LEU A 918 5.819 -14.911 -4.801 1.00 0.00 H new ATOM 61 N ASP A 919 7.828 -14.858 -9.739 1.00 0.00 N ATOM 62 CA ASP A 919 8.244 -13.712 -10.531 1.00 0.00 C ATOM 63 C ASP A 919 8.342 -12.482 -9.627 1.00 0.00 C ATOM 64 O ASP A 919 8.266 -12.597 -8.405 1.00 0.00 O ATOM 65 CB ASP A 919 7.229 -13.408 -11.635 1.00 0.00 C ATOM 66 CG ASP A 919 7.837 -13.014 -12.982 1.00 0.00 C ATOM 67 OD1 ASP A 919 8.806 -13.692 -13.387 1.00 0.00 O ATOM 68 OD2 ASP A 919 7.319 -12.045 -13.577 1.00 0.00 O ATOM 0 H ASP A 919 6.997 -15.337 -10.086 1.00 0.00 H new ATOM 0 HA ASP A 919 9.208 -13.946 -10.982 1.00 0.00 H new ATOM 0 HB2 ASP A 919 6.599 -14.286 -11.781 1.00 0.00 H new ATOM 0 HB3 ASP A 919 6.578 -12.601 -11.297 1.00 0.00 H new ATOM 73 N ARG A 920 8.511 -11.332 -10.263 1.00 0.00 N ATOM 74 CA ARG A 920 8.621 -10.081 -9.532 1.00 0.00 C ATOM 75 C ARG A 920 7.234 -9.477 -9.302 1.00 0.00 C ATOM 76 O ARG A 920 7.052 -8.267 -9.427 1.00 0.00 O ATOM 77 CB ARG A 920 9.489 -9.074 -10.290 1.00 0.00 C ATOM 78 CG ARG A 920 10.969 -9.265 -9.954 1.00 0.00 C ATOM 79 CD ARG A 920 11.358 -8.458 -8.714 1.00 0.00 C ATOM 80 NE ARG A 920 12.655 -8.936 -8.185 1.00 0.00 N ATOM 81 CZ ARG A 920 13.844 -8.718 -8.786 1.00 0.00 C ATOM 82 NH1 ARG A 920 13.910 -8.025 -9.943 1.00 0.00 N ATOM 83 NH2 ARG A 920 14.941 -9.191 -8.225 1.00 0.00 N ATOM 0 H ARG A 920 8.574 -11.240 -11.277 1.00 0.00 H new ATOM 0 HA ARG A 920 9.090 -10.298 -8.573 1.00 0.00 H new ATOM 0 HB2 ARG A 920 9.338 -9.193 -11.363 1.00 0.00 H new ATOM 0 HB3 ARG A 920 9.182 -8.060 -10.035 1.00 0.00 H new ATOM 0 HG2 ARG A 920 11.173 -10.322 -9.783 1.00 0.00 H new ATOM 0 HG3 ARG A 920 11.581 -8.955 -10.801 1.00 0.00 H new ATOM 0 HD2 ARG A 920 11.426 -7.400 -8.966 1.00 0.00 H new ATOM 0 HD3 ARG A 920 10.586 -8.555 -7.950 1.00 0.00 H new ATOM 0 HE ARG A 920 12.650 -9.463 -7.312 1.00 0.00 H new ATOM 0 HH11 ARG A 920 13.057 -7.662 -10.369 1.00 0.00 H new ATOM 0 HH12 ARG A 920 14.812 -7.865 -10.391 1.00 0.00 H new ATOM 0 HH21 ARG A 920 14.882 -9.712 -7.350 1.00 0.00 H new ATOM 0 HH22 ARG A 920 15.847 -9.035 -8.666 1.00 0.00 H new ATOM 96 N SER A 921 6.292 -10.348 -8.970 1.00 0.00 N ATOM 97 CA SER A 921 4.927 -9.915 -8.721 1.00 0.00 C ATOM 98 C SER A 921 4.774 -9.479 -7.263 1.00 0.00 C ATOM 99 O SER A 921 4.144 -8.461 -6.979 1.00 0.00 O ATOM 100 CB SER A 921 3.929 -11.026 -9.051 1.00 0.00 C ATOM 101 OG SER A 921 3.646 -11.095 -10.446 1.00 0.00 O ATOM 0 H SER A 921 6.447 -11.351 -8.868 1.00 0.00 H new ATOM 0 HA SER A 921 4.713 -9.067 -9.371 1.00 0.00 H new ATOM 0 HB2 SER A 921 4.328 -11.983 -8.715 1.00 0.00 H new ATOM 0 HB3 SER A 921 3.003 -10.856 -8.502 1.00 0.00 H new ATOM 0 HG SER A 921 3.114 -10.316 -10.711 1.00 0.00 H new ATOM 107 N ASN A 922 5.361 -10.270 -6.377 1.00 0.00 N ATOM 108 CA ASN A 922 5.297 -9.979 -4.955 1.00 0.00 C ATOM 109 C ASN A 922 6.016 -8.657 -4.678 1.00 0.00 C ATOM 110 O ASN A 922 5.575 -7.870 -3.841 1.00 0.00 O ATOM 111 CB ASN A 922 5.987 -11.072 -4.137 1.00 0.00 C ATOM 112 CG ASN A 922 5.215 -12.390 -4.222 1.00 0.00 C ATOM 113 OD1 ASN A 922 4.627 -12.731 -5.236 1.00 0.00 O ATOM 114 ND2 ASN A 922 5.248 -13.110 -3.104 1.00 0.00 N ATOM 0 H ASN A 922 5.883 -11.113 -6.617 1.00 0.00 H new ATOM 0 HA ASN A 922 4.247 -9.924 -4.669 1.00 0.00 H new ATOM 0 HB2 ASN A 922 7.004 -11.218 -4.502 1.00 0.00 H new ATOM 0 HB3 ASN A 922 6.064 -10.758 -3.096 1.00 0.00 H new ATOM 0 HD21 ASN A 922 4.762 -14.006 -3.060 1.00 0.00 H new ATOM 0 HD22 ASN A 922 5.759 -12.766 -2.291 1.00 0.00 H new ATOM 121 N ASP A 923 7.111 -8.453 -5.395 1.00 0.00 N ATOM 122 CA ASP A 923 7.894 -7.240 -5.237 1.00 0.00 C ATOM 123 C ASP A 923 7.159 -6.073 -5.899 1.00 0.00 C ATOM 124 O ASP A 923 7.097 -4.977 -5.343 1.00 0.00 O ATOM 125 CB ASP A 923 9.263 -7.377 -5.906 1.00 0.00 C ATOM 126 CG ASP A 923 10.429 -6.768 -5.124 1.00 0.00 C ATOM 127 OD1 ASP A 923 10.497 -5.521 -5.085 1.00 0.00 O ATOM 128 OD2 ASP A 923 11.227 -7.565 -4.584 1.00 0.00 O ATOM 0 H ASP A 923 7.475 -9.108 -6.087 1.00 0.00 H new ATOM 0 HA ASP A 923 8.030 -7.064 -4.170 1.00 0.00 H new ATOM 0 HB2 ASP A 923 9.467 -8.435 -6.068 1.00 0.00 H new ATOM 0 HB3 ASP A 923 9.219 -6.907 -6.888 1.00 0.00 H new ATOM 133 N LYS A 924 6.620 -6.347 -7.078 1.00 0.00 N ATOM 134 CA LYS A 924 5.892 -5.333 -7.822 1.00 0.00 C ATOM 135 C LYS A 924 5.024 -4.523 -6.856 1.00 0.00 C ATOM 136 O LYS A 924 5.312 -3.359 -6.585 1.00 0.00 O ATOM 137 CB LYS A 924 5.105 -5.972 -8.968 1.00 0.00 C ATOM 138 CG LYS A 924 5.794 -5.725 -10.311 1.00 0.00 C ATOM 139 CD LYS A 924 5.562 -4.290 -10.791 1.00 0.00 C ATOM 140 CE LYS A 924 6.300 -4.026 -12.105 1.00 0.00 C ATOM 141 NZ LYS A 924 5.339 -3.904 -13.223 1.00 0.00 N ATOM 0 H LYS A 924 6.673 -7.257 -7.536 1.00 0.00 H new ATOM 0 HA LYS A 924 6.584 -4.634 -8.292 1.00 0.00 H new ATOM 0 HB2 LYS A 924 5.011 -7.044 -8.796 1.00 0.00 H new ATOM 0 HB3 LYS A 924 4.095 -5.563 -8.993 1.00 0.00 H new ATOM 0 HG2 LYS A 924 6.864 -5.912 -10.215 1.00 0.00 H new ATOM 0 HG3 LYS A 924 5.414 -6.427 -11.053 1.00 0.00 H new ATOM 0 HD2 LYS A 924 4.495 -4.116 -10.928 1.00 0.00 H new ATOM 0 HD3 LYS A 924 5.904 -3.588 -10.030 1.00 0.00 H new ATOM 0 HE2 LYS A 924 6.888 -3.112 -12.022 1.00 0.00 H new ATOM 0 HE3 LYS A 924 6.999 -4.838 -12.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 5.856 -3.725 -14.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 4.796 -4.787 -13.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 4.688 -3.115 -13.037 1.00 0.00 H new ATOM 155 N VAL A 925 3.979 -5.172 -6.364 1.00 0.00 N ATOM 156 CA VAL A 925 3.067 -4.527 -5.435 1.00 0.00 C ATOM 157 C VAL A 925 3.873 -3.848 -4.325 1.00 0.00 C ATOM 158 O VAL A 925 3.831 -2.627 -4.181 1.00 0.00 O ATOM 159 CB VAL A 925 2.056 -5.544 -4.902 1.00 0.00 C ATOM 160 CG1 VAL A 925 1.087 -4.889 -3.916 1.00 0.00 C ATOM 161 CG2 VAL A 925 1.299 -6.217 -6.050 1.00 0.00 C ATOM 0 H VAL A 925 3.744 -6.138 -6.591 1.00 0.00 H new ATOM 0 HA VAL A 925 2.492 -3.752 -5.941 1.00 0.00 H new ATOM 0 HB VAL A 925 2.608 -6.316 -4.366 1.00 0.00 H new ATOM 0 HG11 VAL A 925 0.379 -5.634 -3.552 1.00 0.00 H new ATOM 0 HG12 VAL A 925 1.646 -4.479 -3.075 1.00 0.00 H new ATOM 0 HG13 VAL A 925 0.545 -4.087 -4.417 1.00 0.00 H new ATOM 0 HG21 VAL A 925 0.587 -6.935 -5.644 1.00 0.00 H new ATOM 0 HG22 VAL A 925 0.764 -5.461 -6.626 1.00 0.00 H new ATOM 0 HG23 VAL A 925 2.006 -6.734 -6.698 1.00 0.00 H new ATOM 171 N TYR A 926 4.587 -4.669 -3.570 1.00 0.00 N ATOM 172 CA TYR A 926 5.401 -4.163 -2.478 1.00 0.00 C ATOM 173 C TYR A 926 6.078 -2.846 -2.862 1.00 0.00 C ATOM 174 O TYR A 926 5.822 -1.811 -2.249 1.00 0.00 O ATOM 175 CB TYR A 926 6.478 -5.222 -2.229 1.00 0.00 C ATOM 176 CG TYR A 926 6.388 -5.891 -0.856 1.00 0.00 C ATOM 177 CD1 TYR A 926 6.609 -5.151 0.288 1.00 0.00 C ATOM 178 CD2 TYR A 926 6.085 -7.234 -0.761 1.00 0.00 C ATOM 179 CE1 TYR A 926 6.523 -5.780 1.580 1.00 0.00 C ATOM 180 CE2 TYR A 926 6.000 -7.863 0.531 1.00 0.00 C ATOM 181 CZ TYR A 926 6.223 -7.105 1.638 1.00 0.00 C ATOM 182 OH TYR A 926 6.143 -7.700 2.859 1.00 0.00 O ATOM 0 H TYR A 926 4.619 -5.681 -3.693 1.00 0.00 H new ATOM 0 HA TYR A 926 4.787 -3.975 -1.597 1.00 0.00 H new ATOM 0 HB2 TYR A 926 6.405 -5.988 -3.001 1.00 0.00 H new ATOM 0 HB3 TYR A 926 7.459 -4.759 -2.332 1.00 0.00 H new ATOM 0 HD1 TYR A 926 6.846 -4.100 0.214 1.00 0.00 H new ATOM 0 HD2 TYR A 926 5.912 -7.813 -1.656 1.00 0.00 H new ATOM 0 HE1 TYR A 926 6.693 -5.212 2.483 1.00 0.00 H new ATOM 0 HE2 TYR A 926 5.764 -8.913 0.619 1.00 0.00 H new ATOM 0 HH TYR A 926 5.920 -8.648 2.747 1.00 0.00 H new ATOM 192 N GLU A 927 6.927 -2.928 -3.876 1.00 0.00 N ATOM 193 CA GLU A 927 7.642 -1.755 -4.350 1.00 0.00 C ATOM 194 C GLU A 927 6.703 -0.548 -4.407 1.00 0.00 C ATOM 195 O GLU A 927 6.808 0.365 -3.590 1.00 0.00 O ATOM 196 CB GLU A 927 8.282 -2.017 -5.714 1.00 0.00 C ATOM 197 CG GLU A 927 9.801 -2.153 -5.590 1.00 0.00 C ATOM 198 CD GLU A 927 10.447 -0.806 -5.257 1.00 0.00 C ATOM 199 OE1 GLU A 927 10.776 -0.081 -6.220 1.00 0.00 O ATOM 200 OE2 GLU A 927 10.596 -0.532 -4.046 1.00 0.00 O ATOM 0 H GLU A 927 7.136 -3.788 -4.382 1.00 0.00 H new ATOM 0 HA GLU A 927 8.444 -1.533 -3.646 1.00 0.00 H new ATOM 0 HB2 GLU A 927 7.866 -2.927 -6.146 1.00 0.00 H new ATOM 0 HB3 GLU A 927 8.041 -1.201 -6.396 1.00 0.00 H new ATOM 0 HG2 GLU A 927 10.043 -2.878 -4.813 1.00 0.00 H new ATOM 0 HG3 GLU A 927 10.213 -2.537 -6.523 1.00 0.00 H new ATOM 207 N ASN A 928 5.805 -0.583 -5.381 1.00 0.00 N ATOM 208 CA ASN A 928 4.848 0.496 -5.557 1.00 0.00 C ATOM 209 C ASN A 928 4.365 0.971 -4.185 1.00 0.00 C ATOM 210 O ASN A 928 4.621 2.108 -3.792 1.00 0.00 O ATOM 211 CB ASN A 928 3.628 0.027 -6.352 1.00 0.00 C ATOM 212 CG ASN A 928 4.052 -0.770 -7.587 1.00 0.00 C ATOM 213 OD1 ASN A 928 3.761 -1.947 -7.729 1.00 0.00 O ATOM 214 ND2 ASN A 928 4.754 -0.066 -8.470 1.00 0.00 N ATOM 0 H ASN A 928 5.720 -1.342 -6.057 1.00 0.00 H new ATOM 0 HA ASN A 928 5.343 1.301 -6.100 1.00 0.00 H new ATOM 0 HB2 ASN A 928 2.991 -0.590 -5.718 1.00 0.00 H new ATOM 0 HB3 ASN A 928 3.035 0.889 -6.657 1.00 0.00 H new ATOM 0 HD21 ASN A 928 5.084 -0.508 -9.328 1.00 0.00 H new ATOM 0 HD22 ASN A 928 4.963 0.916 -8.289 1.00 0.00 H new ATOM 221 N VAL A 929 3.674 0.076 -3.494 1.00 0.00 N ATOM 222 CA VAL A 929 3.152 0.389 -2.175 1.00 0.00 C ATOM 223 C VAL A 929 4.190 1.205 -1.401 1.00 0.00 C ATOM 224 O VAL A 929 3.916 2.331 -0.988 1.00 0.00 O ATOM 225 CB VAL A 929 2.745 -0.898 -1.454 1.00 0.00 C ATOM 226 CG1 VAL A 929 2.310 -0.607 -0.016 1.00 0.00 C ATOM 227 CG2 VAL A 929 1.644 -1.632 -2.222 1.00 0.00 C ATOM 0 H VAL A 929 3.464 -0.866 -3.823 1.00 0.00 H new ATOM 0 HA VAL A 929 2.252 0.999 -2.255 1.00 0.00 H new ATOM 0 HB VAL A 929 3.618 -1.550 -1.414 1.00 0.00 H new ATOM 0 HG11 VAL A 929 2.026 -1.538 0.474 1.00 0.00 H new ATOM 0 HG12 VAL A 929 3.136 -0.148 0.528 1.00 0.00 H new ATOM 0 HG13 VAL A 929 1.458 0.073 -0.024 1.00 0.00 H new ATOM 0 HG21 VAL A 929 1.373 -2.543 -1.688 1.00 0.00 H new ATOM 0 HG22 VAL A 929 0.769 -0.988 -2.308 1.00 0.00 H new ATOM 0 HG23 VAL A 929 2.004 -1.889 -3.218 1.00 0.00 H new ATOM 237 N THR A 930 5.358 0.605 -1.229 1.00 0.00 N ATOM 238 CA THR A 930 6.438 1.262 -0.513 1.00 0.00 C ATOM 239 C THR A 930 6.748 2.621 -1.144 1.00 0.00 C ATOM 240 O THR A 930 6.611 3.657 -0.494 1.00 0.00 O ATOM 241 CB THR A 930 7.639 0.314 -0.493 1.00 0.00 C ATOM 242 OG1 THR A 930 7.058 -0.978 -0.338 1.00 0.00 O ATOM 243 CG2 THR A 930 8.501 0.487 0.758 1.00 0.00 C ATOM 0 H THR A 930 5.580 -0.329 -1.573 1.00 0.00 H new ATOM 0 HA THR A 930 6.156 1.474 0.518 1.00 0.00 H new ATOM 0 HB THR A 930 8.249 0.483 -1.380 1.00 0.00 H new ATOM 0 HG1 THR A 930 6.984 -1.410 -1.214 1.00 0.00 H new ATOM 0 HG21 THR A 930 9.339 -0.209 0.722 1.00 0.00 H new ATOM 0 HG22 THR A 930 8.879 1.508 0.801 1.00 0.00 H new ATOM 0 HG23 THR A 930 7.900 0.285 1.645 1.00 0.00 H new ATOM 251 N GLY A 931 7.159 2.574 -2.402 1.00 0.00 N ATOM 252 CA GLY A 931 7.489 3.788 -3.128 1.00 0.00 C ATOM 253 C GLY A 931 6.443 4.877 -2.879 1.00 0.00 C ATOM 254 O GLY A 931 6.702 5.836 -2.153 1.00 0.00 O ATOM 0 H GLY A 931 7.271 1.713 -2.938 1.00 0.00 H new ATOM 0 HA2 GLY A 931 8.472 4.145 -2.819 1.00 0.00 H new ATOM 0 HA3 GLY A 931 7.549 3.573 -4.195 1.00 0.00 H new ATOM 258 N LEU A 932 5.285 4.693 -3.495 1.00 0.00 N ATOM 259 CA LEU A 932 4.199 5.648 -3.348 1.00 0.00 C ATOM 260 C LEU A 932 4.172 6.165 -1.909 1.00 0.00 C ATOM 261 O LEU A 932 3.928 7.348 -1.675 1.00 0.00 O ATOM 262 CB LEU A 932 2.877 5.030 -3.805 1.00 0.00 C ATOM 263 CG LEU A 932 1.907 4.624 -2.694 1.00 0.00 C ATOM 264 CD1 LEU A 932 1.415 5.849 -1.921 1.00 0.00 C ATOM 265 CD2 LEU A 932 0.748 3.795 -3.253 1.00 0.00 C ATOM 0 H LEU A 932 5.075 3.897 -4.097 1.00 0.00 H new ATOM 0 HA LEU A 932 4.360 6.511 -3.994 1.00 0.00 H new ATOM 0 HB2 LEU A 932 2.373 5.742 -4.458 1.00 0.00 H new ATOM 0 HB3 LEU A 932 3.100 4.148 -4.406 1.00 0.00 H new ATOM 0 HG LEU A 932 2.443 3.991 -1.987 1.00 0.00 H new ATOM 0 HD11 LEU A 932 0.727 5.532 -1.137 1.00 0.00 H new ATOM 0 HD12 LEU A 932 2.266 6.362 -1.472 1.00 0.00 H new ATOM 0 HD13 LEU A 932 0.901 6.527 -2.602 1.00 0.00 H new ATOM 0 HD21 LEU A 932 0.073 3.520 -2.442 1.00 0.00 H new ATOM 0 HD22 LEU A 932 0.205 4.382 -3.993 1.00 0.00 H new ATOM 0 HD23 LEU A 932 1.139 2.892 -3.722 1.00 0.00 H new ATOM 277 N VAL A 933 4.425 5.254 -0.981 1.00 0.00 N ATOM 278 CA VAL A 933 4.432 5.603 0.429 1.00 0.00 C ATOM 279 C VAL A 933 5.649 6.481 0.727 1.00 0.00 C ATOM 280 O VAL A 933 5.509 7.591 1.236 1.00 0.00 O ATOM 281 CB VAL A 933 4.386 4.335 1.283 1.00 0.00 C ATOM 282 CG1 VAL A 933 5.275 4.474 2.520 1.00 0.00 C ATOM 283 CG2 VAL A 933 2.948 3.990 1.676 1.00 0.00 C ATOM 0 H VAL A 933 4.627 4.274 -1.178 1.00 0.00 H new ATOM 0 HA VAL A 933 3.544 6.182 0.683 1.00 0.00 H new ATOM 0 HB VAL A 933 4.775 3.513 0.682 1.00 0.00 H new ATOM 0 HG11 VAL A 933 5.224 3.559 3.110 1.00 0.00 H new ATOM 0 HG12 VAL A 933 6.305 4.649 2.210 1.00 0.00 H new ATOM 0 HG13 VAL A 933 4.930 5.314 3.123 1.00 0.00 H new ATOM 0 HG21 VAL A 933 2.944 3.084 2.283 1.00 0.00 H new ATOM 0 HG22 VAL A 933 2.520 4.813 2.249 1.00 0.00 H new ATOM 0 HG23 VAL A 933 2.354 3.827 0.777 1.00 0.00 H new ATOM 293 N LYS A 934 6.817 5.949 0.395 1.00 0.00 N ATOM 294 CA LYS A 934 8.058 6.670 0.621 1.00 0.00 C ATOM 295 C LYS A 934 7.953 8.065 0.000 1.00 0.00 C ATOM 296 O LYS A 934 8.685 8.975 0.384 1.00 0.00 O ATOM 297 CB LYS A 934 9.250 5.858 0.109 1.00 0.00 C ATOM 298 CG LYS A 934 9.635 6.283 -1.310 1.00 0.00 C ATOM 299 CD LYS A 934 10.918 5.584 -1.762 1.00 0.00 C ATOM 300 CE LYS A 934 11.912 6.588 -2.350 1.00 0.00 C ATOM 301 NZ LYS A 934 12.798 5.926 -3.333 1.00 0.00 N ATOM 0 H LYS A 934 6.930 5.028 -0.028 1.00 0.00 H new ATOM 0 HA LYS A 934 8.229 6.808 1.689 1.00 0.00 H new ATOM 0 HB2 LYS A 934 10.101 5.994 0.777 1.00 0.00 H new ATOM 0 HB3 LYS A 934 9.003 4.796 0.120 1.00 0.00 H new ATOM 0 HG2 LYS A 934 8.824 6.043 -1.998 1.00 0.00 H new ATOM 0 HG3 LYS A 934 9.774 7.364 -1.345 1.00 0.00 H new ATOM 0 HD2 LYS A 934 11.373 5.069 -0.916 1.00 0.00 H new ATOM 0 HD3 LYS A 934 10.680 4.824 -2.507 1.00 0.00 H new ATOM 0 HE2 LYS A 934 11.372 7.404 -2.830 1.00 0.00 H new ATOM 0 HE3 LYS A 934 12.510 7.027 -1.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 13.466 6.622 -3.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 13.327 5.163 -2.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 12.225 5.528 -4.104 1.00 0.00 H new ATOM 315 N ALA A 935 7.036 8.188 -0.948 1.00 0.00 N ATOM 316 CA ALA A 935 6.826 9.456 -1.625 1.00 0.00 C ATOM 317 C ALA A 935 5.866 10.316 -0.801 1.00 0.00 C ATOM 318 O ALA A 935 6.146 11.484 -0.534 1.00 0.00 O ATOM 319 CB ALA A 935 6.308 9.199 -3.042 1.00 0.00 C ATOM 0 H ALA A 935 6.430 7.430 -1.263 1.00 0.00 H new ATOM 0 HA ALA A 935 7.765 10.003 -1.715 1.00 0.00 H new ATOM 0 HB1 ALA A 935 6.150 10.150 -3.550 1.00 0.00 H new ATOM 0 HB2 ALA A 935 7.039 8.609 -3.595 1.00 0.00 H new ATOM 0 HB3 ALA A 935 5.365 8.654 -2.992 1.00 0.00 H new ATOM 325 N VAL A 936 4.753 9.706 -0.420 1.00 0.00 N ATOM 326 CA VAL A 936 3.751 10.401 0.369 1.00 0.00 C ATOM 327 C VAL A 936 4.447 11.281 1.410 1.00 0.00 C ATOM 328 O VAL A 936 3.996 12.390 1.691 1.00 0.00 O ATOM 329 CB VAL A 936 2.782 9.393 0.990 1.00 0.00 C ATOM 330 CG1 VAL A 936 3.180 9.065 2.430 1.00 0.00 C ATOM 331 CG2 VAL A 936 1.341 9.904 0.922 1.00 0.00 C ATOM 0 H VAL A 936 4.523 8.738 -0.643 1.00 0.00 H new ATOM 0 HA VAL A 936 3.154 11.057 -0.265 1.00 0.00 H new ATOM 0 HB VAL A 936 2.839 8.472 0.409 1.00 0.00 H new ATOM 0 HG11 VAL A 936 2.475 8.346 2.848 1.00 0.00 H new ATOM 0 HG12 VAL A 936 4.183 8.638 2.442 1.00 0.00 H new ATOM 0 HG13 VAL A 936 3.166 9.976 3.028 1.00 0.00 H new ATOM 0 HG21 VAL A 936 0.673 9.169 1.370 1.00 0.00 H new ATOM 0 HG22 VAL A 936 1.263 10.845 1.467 1.00 0.00 H new ATOM 0 HG23 VAL A 936 1.060 10.063 -0.119 1.00 0.00 H new ATOM 341 N ILE A 937 5.533 10.752 1.954 1.00 0.00 N ATOM 342 CA ILE A 937 6.295 11.475 2.957 1.00 0.00 C ATOM 343 C ILE A 937 7.266 12.431 2.263 1.00 0.00 C ATOM 344 O ILE A 937 7.116 13.649 2.355 1.00 0.00 O ATOM 345 CB ILE A 937 6.976 10.498 3.919 1.00 0.00 C ATOM 346 CG1 ILE A 937 5.958 9.865 4.869 1.00 0.00 C ATOM 347 CG2 ILE A 937 8.118 11.180 4.675 1.00 0.00 C ATOM 348 CD1 ILE A 937 6.121 8.344 4.912 1.00 0.00 C ATOM 0 H ILE A 937 5.903 9.831 1.719 1.00 0.00 H new ATOM 0 HA ILE A 937 5.633 12.084 3.572 1.00 0.00 H new ATOM 0 HB ILE A 937 7.415 9.691 3.332 1.00 0.00 H new ATOM 0 HG12 ILE A 937 6.085 10.276 5.870 1.00 0.00 H new ATOM 0 HG13 ILE A 937 4.948 10.117 4.546 1.00 0.00 H new ATOM 0 HG21 ILE A 937 8.585 10.464 5.352 1.00 0.00 H new ATOM 0 HG22 ILE A 937 8.859 11.544 3.963 1.00 0.00 H new ATOM 0 HG23 ILE A 937 7.724 12.019 5.249 1.00 0.00 H new ATOM 0 HD11 ILE A 937 5.385 7.918 5.595 1.00 0.00 H new ATOM 0 HD12 ILE A 937 5.970 7.933 3.914 1.00 0.00 H new ATOM 0 HD13 ILE A 937 7.124 8.095 5.258 1.00 0.00 H new ATOM 360 N GLU A 938 8.240 11.845 1.583 1.00 0.00 N ATOM 361 CA GLU A 938 9.236 12.630 0.873 1.00 0.00 C ATOM 362 C GLU A 938 8.613 13.924 0.345 1.00 0.00 C ATOM 363 O GLU A 938 9.181 15.002 0.509 1.00 0.00 O ATOM 364 CB GLU A 938 9.864 11.820 -0.263 1.00 0.00 C ATOM 365 CG GLU A 938 11.336 11.520 0.028 1.00 0.00 C ATOM 366 CD GLU A 938 11.523 10.064 0.460 1.00 0.00 C ATOM 367 OE1 GLU A 938 11.183 9.770 1.626 1.00 0.00 O ATOM 368 OE2 GLU A 938 12.003 9.278 -0.386 1.00 0.00 O ATOM 0 H GLU A 938 8.361 10.835 1.508 1.00 0.00 H new ATOM 0 HA GLU A 938 10.031 12.891 1.571 1.00 0.00 H new ATOM 0 HB2 GLU A 938 9.318 10.886 -0.394 1.00 0.00 H new ATOM 0 HB3 GLU A 938 9.780 12.373 -1.199 1.00 0.00 H new ATOM 0 HG2 GLU A 938 11.934 11.719 -0.861 1.00 0.00 H new ATOM 0 HG3 GLU A 938 11.699 12.185 0.812 1.00 0.00 H new ATOM 375 N MET A 939 7.453 13.774 -0.278 1.00 0.00 N ATOM 376 CA MET A 939 6.748 14.917 -0.831 1.00 0.00 C ATOM 377 C MET A 939 6.643 16.046 0.196 1.00 0.00 C ATOM 378 O MET A 939 7.234 17.110 0.016 1.00 0.00 O ATOM 379 CB MET A 939 5.344 14.489 -1.265 1.00 0.00 C ATOM 380 CG MET A 939 4.524 15.694 -1.732 1.00 0.00 C ATOM 381 SD MET A 939 2.789 15.277 -1.761 1.00 0.00 S ATOM 382 CE MET A 939 2.840 13.806 -2.772 1.00 0.00 C ATOM 0 H MET A 939 6.984 12.878 -0.412 1.00 0.00 H new ATOM 0 HA MET A 939 7.308 15.285 -1.691 1.00 0.00 H new ATOM 0 HB2 MET A 939 5.415 13.759 -2.071 1.00 0.00 H new ATOM 0 HB3 MET A 939 4.836 13.999 -0.434 1.00 0.00 H new ATOM 0 HG2 MET A 939 4.692 16.539 -1.065 1.00 0.00 H new ATOM 0 HG3 MET A 939 4.849 16.002 -2.726 1.00 0.00 H new ATOM 0 HE1 MET A 939 1.928 13.740 -3.365 1.00 0.00 H new ATOM 0 HE2 MET A 939 3.703 13.851 -3.437 1.00 0.00 H new ATOM 0 HE3 MET A 939 2.921 12.927 -2.132 1.00 0.00 H new ATOM 392 N SER A 940 5.888 15.776 1.250 1.00 0.00 N ATOM 393 CA SER A 940 5.699 16.756 2.306 1.00 0.00 C ATOM 394 C SER A 940 7.024 17.455 2.615 1.00 0.00 C ATOM 395 O SER A 940 7.047 18.650 2.905 1.00 0.00 O ATOM 396 CB SER A 940 5.135 16.103 3.569 1.00 0.00 C ATOM 397 OG SER A 940 4.066 15.208 3.276 1.00 0.00 O ATOM 0 H SER A 940 5.400 14.892 1.396 1.00 0.00 H new ATOM 0 HA SER A 940 4.978 17.497 1.960 1.00 0.00 H new ATOM 0 HB2 SER A 940 5.930 15.562 4.083 1.00 0.00 H new ATOM 0 HB3 SER A 940 4.783 16.877 4.251 1.00 0.00 H new ATOM 0 HG SER A 940 4.143 14.410 3.840 1.00 0.00 H new ATOM 403 N SER A 941 8.096 16.679 2.543 1.00 0.00 N ATOM 404 CA SER A 941 9.422 17.208 2.812 1.00 0.00 C ATOM 405 C SER A 941 9.773 18.286 1.785 1.00 0.00 C ATOM 406 O SER A 941 10.308 19.336 2.140 1.00 0.00 O ATOM 407 CB SER A 941 10.473 16.096 2.795 1.00 0.00 C ATOM 408 OG SER A 941 11.559 16.374 3.675 1.00 0.00 O ATOM 0 H SER A 941 8.073 15.688 2.302 1.00 0.00 H new ATOM 0 HA SER A 941 9.418 17.651 3.808 1.00 0.00 H new ATOM 0 HB2 SER A 941 10.007 15.153 3.081 1.00 0.00 H new ATOM 0 HB3 SER A 941 10.851 15.970 1.781 1.00 0.00 H new ATOM 0 HG SER A 941 12.207 15.640 3.637 1.00 0.00 H new ATOM 414 N LYS A 942 9.459 17.990 0.533 1.00 0.00 N ATOM 415 CA LYS A 942 9.735 18.921 -0.549 1.00 0.00 C ATOM 416 C LYS A 942 8.414 19.467 -1.095 1.00 0.00 C ATOM 417 O LYS A 942 8.327 19.832 -2.266 1.00 0.00 O ATOM 418 CB LYS A 942 10.615 18.261 -1.612 1.00 0.00 C ATOM 419 CG LYS A 942 10.055 16.895 -2.017 1.00 0.00 C ATOM 420 CD LYS A 942 10.044 16.736 -3.538 1.00 0.00 C ATOM 421 CE LYS A 942 8.612 16.664 -4.071 1.00 0.00 C ATOM 422 NZ LYS A 942 8.322 15.311 -4.597 1.00 0.00 N ATOM 0 H LYS A 942 9.016 17.118 0.243 1.00 0.00 H new ATOM 0 HA LYS A 942 10.305 19.774 -0.182 1.00 0.00 H new ATOM 0 HB2 LYS A 942 10.679 18.906 -2.488 1.00 0.00 H new ATOM 0 HB3 LYS A 942 11.628 18.143 -1.228 1.00 0.00 H new ATOM 0 HG2 LYS A 942 10.657 16.104 -1.570 1.00 0.00 H new ATOM 0 HG3 LYS A 942 9.043 16.783 -1.629 1.00 0.00 H new ATOM 0 HD2 LYS A 942 10.566 17.575 -3.999 1.00 0.00 H new ATOM 0 HD3 LYS A 942 10.586 15.832 -3.817 1.00 0.00 H new ATOM 0 HE2 LYS A 942 7.909 16.910 -3.275 1.00 0.00 H new ATOM 0 HE3 LYS A 942 8.473 17.404 -4.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 8.307 15.338 -5.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 9.059 14.649 -4.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 7.396 14.993 -4.246 1.00 0.00 H new ATOM 436 N ILE A 943 7.420 19.506 -0.220 1.00 0.00 N ATOM 437 CA ILE A 943 6.108 20.001 -0.601 1.00 0.00 C ATOM 438 C ILE A 943 6.000 21.482 -0.231 1.00 0.00 C ATOM 439 O ILE A 943 5.597 22.303 -1.053 1.00 0.00 O ATOM 440 CB ILE A 943 5.009 19.132 0.013 1.00 0.00 C ATOM 441 CG1 ILE A 943 3.840 18.959 -0.959 1.00 0.00 C ATOM 442 CG2 ILE A 943 4.554 19.695 1.362 1.00 0.00 C ATOM 443 CD1 ILE A 943 2.797 20.062 -0.765 1.00 0.00 C ATOM 0 H ILE A 943 7.497 19.203 0.751 1.00 0.00 H new ATOM 0 HA ILE A 943 5.972 19.931 -1.680 1.00 0.00 H new ATOM 0 HB ILE A 943 5.422 18.141 0.200 1.00 0.00 H new ATOM 0 HG12 ILE A 943 4.209 18.979 -1.984 1.00 0.00 H new ATOM 0 HG13 ILE A 943 3.376 17.984 -0.806 1.00 0.00 H new ATOM 0 HG21 ILE A 943 3.772 19.059 1.777 1.00 0.00 H new ATOM 0 HG22 ILE A 943 5.400 19.724 2.048 1.00 0.00 H new ATOM 0 HG23 ILE A 943 4.165 20.704 1.223 1.00 0.00 H new ATOM 0 HD11 ILE A 943 1.977 19.915 -1.468 1.00 0.00 H new ATOM 0 HD12 ILE A 943 2.412 20.024 0.254 1.00 0.00 H new ATOM 0 HD13 ILE A 943 3.258 21.034 -0.943 1.00 0.00 H new ATOM 455 N GLN A 944 6.367 21.778 1.007 1.00 0.00 N ATOM 456 CA GLN A 944 6.316 23.146 1.496 1.00 0.00 C ATOM 457 C GLN A 944 6.928 24.100 0.468 1.00 0.00 C ATOM 458 O GLN A 944 6.300 25.081 0.076 1.00 0.00 O ATOM 459 CB GLN A 944 7.021 23.271 2.848 1.00 0.00 C ATOM 460 CG GLN A 944 6.084 23.865 3.902 1.00 0.00 C ATOM 461 CD GLN A 944 6.834 24.832 4.820 1.00 0.00 C ATOM 462 OE1 GLN A 944 6.743 26.042 4.697 1.00 0.00 O ATOM 463 NE2 GLN A 944 7.578 24.232 5.745 1.00 0.00 N ATOM 0 H GLN A 944 6.701 21.094 1.686 1.00 0.00 H new ATOM 0 HA GLN A 944 5.271 23.421 1.641 1.00 0.00 H new ATOM 0 HB2 GLN A 944 7.366 22.290 3.174 1.00 0.00 H new ATOM 0 HB3 GLN A 944 7.904 23.901 2.745 1.00 0.00 H new ATOM 0 HG2 GLN A 944 5.263 24.387 3.411 1.00 0.00 H new ATOM 0 HG3 GLN A 944 5.643 23.064 4.495 1.00 0.00 H new ATOM 0 HE21 GLN A 944 7.609 23.214 5.793 1.00 0.00 H new ATOM 0 HE22 GLN A 944 8.117 24.790 6.407 1.00 0.00 H new ATOM 472 N PRO A 945 8.180 23.769 0.051 1.00 0.00 N ATOM 473 CA PRO A 945 8.884 24.585 -0.924 1.00 0.00 C ATOM 474 C PRO A 945 8.320 24.368 -2.330 1.00 0.00 C ATOM 475 O PRO A 945 8.041 25.329 -3.045 1.00 0.00 O ATOM 476 CB PRO A 945 10.343 24.176 -0.799 1.00 0.00 C ATOM 477 CG PRO A 945 10.339 22.828 -0.097 1.00 0.00 C ATOM 478 CD PRO A 945 8.955 22.614 0.494 1.00 0.00 C ATOM 0 HA PRO A 945 8.767 25.653 -0.742 1.00 0.00 H new ATOM 0 HB2 PRO A 945 10.814 24.104 -1.779 1.00 0.00 H new ATOM 0 HB3 PRO A 945 10.908 24.913 -0.227 1.00 0.00 H new ATOM 0 HG2 PRO A 945 10.581 22.031 -0.800 1.00 0.00 H new ATOM 0 HG3 PRO A 945 11.097 22.803 0.686 1.00 0.00 H new ATOM 0 HD2 PRO A 945 8.514 21.682 0.141 1.00 0.00 H new ATOM 0 HD3 PRO A 945 8.994 22.557 1.582 1.00 0.00 H new ATOM 486 N ALA A 946 8.170 23.100 -2.683 1.00 0.00 N ATOM 487 CA ALA A 946 7.645 22.745 -3.991 1.00 0.00 C ATOM 488 C ALA A 946 6.586 23.769 -4.405 1.00 0.00 C ATOM 489 O ALA A 946 5.624 24.003 -3.675 1.00 0.00 O ATOM 490 CB ALA A 946 7.093 21.319 -3.949 1.00 0.00 C ATOM 0 H ALA A 946 8.403 22.306 -2.087 1.00 0.00 H new ATOM 0 HA ALA A 946 8.435 22.766 -4.741 1.00 0.00 H new ATOM 0 HB1 ALA A 946 6.699 21.052 -4.930 1.00 0.00 H new ATOM 0 HB2 ALA A 946 7.891 20.628 -3.678 1.00 0.00 H new ATOM 0 HB3 ALA A 946 6.295 21.259 -3.209 1.00 0.00 H new ATOM 496 N PRO A 947 6.804 24.367 -5.607 1.00 0.00 N ATOM 497 CA PRO A 947 5.880 25.360 -6.128 1.00 0.00 C ATOM 498 C PRO A 947 4.602 24.699 -6.649 1.00 0.00 C ATOM 499 O PRO A 947 4.487 23.474 -6.647 1.00 0.00 O ATOM 500 CB PRO A 947 6.656 26.090 -7.212 1.00 0.00 C ATOM 501 CG PRO A 947 7.818 25.180 -7.577 1.00 0.00 C ATOM 502 CD PRO A 947 7.932 24.115 -6.499 1.00 0.00 C ATOM 0 HA PRO A 947 5.538 26.058 -5.364 1.00 0.00 H new ATOM 0 HB2 PRO A 947 6.026 26.285 -8.079 1.00 0.00 H new ATOM 0 HB3 PRO A 947 7.013 27.055 -6.854 1.00 0.00 H new ATOM 0 HG2 PRO A 947 7.652 24.721 -8.551 1.00 0.00 H new ATOM 0 HG3 PRO A 947 8.743 25.752 -7.648 1.00 0.00 H new ATOM 0 HD2 PRO A 947 7.883 23.113 -6.926 1.00 0.00 H new ATOM 0 HD3 PRO A 947 8.881 24.189 -5.968 1.00 0.00 H new ATOM 510 N PRO A 948 3.650 25.561 -7.095 1.00 0.00 N ATOM 511 CA PRO A 948 2.385 25.074 -7.619 1.00 0.00 C ATOM 512 C PRO A 948 2.561 24.489 -9.021 1.00 0.00 C ATOM 513 O PRO A 948 1.678 23.796 -9.524 1.00 0.00 O ATOM 514 CB PRO A 948 1.458 26.278 -7.590 1.00 0.00 C ATOM 515 CG PRO A 948 2.360 27.498 -7.492 1.00 0.00 C ATOM 516 CD PRO A 948 3.752 27.018 -7.113 1.00 0.00 C ATOM 0 HA PRO A 948 1.972 24.256 -7.029 1.00 0.00 H new ATOM 0 HB2 PRO A 948 0.843 26.319 -8.489 1.00 0.00 H new ATOM 0 HB3 PRO A 948 0.778 26.226 -6.740 1.00 0.00 H new ATOM 0 HG2 PRO A 948 2.385 28.031 -8.442 1.00 0.00 H new ATOM 0 HG3 PRO A 948 1.980 28.195 -6.745 1.00 0.00 H new ATOM 0 HD2 PRO A 948 4.497 27.354 -7.835 1.00 0.00 H new ATOM 0 HD3 PRO A 948 4.053 27.406 -6.140 1.00 0.00 H new ATOM 524 N GLU A 949 3.708 24.789 -9.614 1.00 0.00 N ATOM 525 CA GLU A 949 4.011 24.301 -10.948 1.00 0.00 C ATOM 526 C GLU A 949 4.692 22.933 -10.871 1.00 0.00 C ATOM 527 O GLU A 949 4.787 22.226 -11.873 1.00 0.00 O ATOM 528 CB GLU A 949 4.877 25.302 -11.714 1.00 0.00 C ATOM 529 CG GLU A 949 4.218 25.698 -13.037 1.00 0.00 C ATOM 530 CD GLU A 949 5.251 25.773 -14.164 1.00 0.00 C ATOM 531 OE1 GLU A 949 5.626 24.690 -14.663 1.00 0.00 O ATOM 532 OE2 GLU A 949 5.642 26.911 -14.501 1.00 0.00 O ATOM 0 H GLU A 949 4.438 25.364 -9.194 1.00 0.00 H new ATOM 0 HA GLU A 949 3.074 24.188 -11.494 1.00 0.00 H new ATOM 0 HB2 GLU A 949 5.038 26.191 -11.104 1.00 0.00 H new ATOM 0 HB3 GLU A 949 5.857 24.867 -11.908 1.00 0.00 H new ATOM 0 HG2 GLU A 949 3.446 24.973 -13.294 1.00 0.00 H new ATOM 0 HG3 GLU A 949 3.724 26.663 -12.927 1.00 0.00 H new ATOM 539 N GLU A 950 5.148 22.601 -9.672 1.00 0.00 N ATOM 540 CA GLU A 950 5.818 21.331 -9.451 1.00 0.00 C ATOM 541 C GLU A 950 4.991 20.452 -8.511 1.00 0.00 C ATOM 542 O GLU A 950 5.292 19.273 -8.332 1.00 0.00 O ATOM 543 CB GLU A 950 7.230 21.543 -8.904 1.00 0.00 C ATOM 544 CG GLU A 950 8.195 20.491 -9.454 1.00 0.00 C ATOM 545 CD GLU A 950 9.447 20.386 -8.580 1.00 0.00 C ATOM 546 OE1 GLU A 950 9.297 19.928 -7.427 1.00 0.00 O ATOM 547 OE2 GLU A 950 10.526 20.765 -9.086 1.00 0.00 O ATOM 0 H GLU A 950 5.066 23.190 -8.843 1.00 0.00 H new ATOM 0 HA GLU A 950 5.909 20.819 -10.409 1.00 0.00 H new ATOM 0 HB2 GLU A 950 7.582 22.539 -9.172 1.00 0.00 H new ATOM 0 HB3 GLU A 950 7.213 21.493 -7.815 1.00 0.00 H new ATOM 0 HG2 GLU A 950 7.696 19.523 -9.499 1.00 0.00 H new ATOM 0 HG3 GLU A 950 8.479 20.751 -10.474 1.00 0.00 H new ATOM 554 N TYR A 951 3.965 21.060 -7.934 1.00 0.00 N ATOM 555 CA TYR A 951 3.093 20.347 -7.015 1.00 0.00 C ATOM 556 C TYR A 951 1.930 19.690 -7.762 1.00 0.00 C ATOM 557 O TYR A 951 1.516 18.583 -7.422 1.00 0.00 O ATOM 558 CB TYR A 951 2.536 21.402 -6.057 1.00 0.00 C ATOM 559 CG TYR A 951 1.640 20.832 -4.956 1.00 0.00 C ATOM 560 CD1 TYR A 951 1.915 19.592 -4.416 1.00 0.00 C ATOM 561 CD2 TYR A 951 0.557 21.558 -4.504 1.00 0.00 C ATOM 562 CE1 TYR A 951 1.071 19.056 -3.379 1.00 0.00 C ATOM 563 CE2 TYR A 951 -0.287 21.021 -3.467 1.00 0.00 C ATOM 564 CZ TYR A 951 0.012 19.797 -2.956 1.00 0.00 C ATOM 565 OH TYR A 951 -0.784 19.290 -1.977 1.00 0.00 O ATOM 0 H TYR A 951 3.718 22.038 -8.085 1.00 0.00 H new ATOM 0 HA TYR A 951 3.642 19.561 -6.497 1.00 0.00 H new ATOM 0 HB2 TYR A 951 3.368 21.934 -5.595 1.00 0.00 H new ATOM 0 HB3 TYR A 951 1.968 22.135 -6.630 1.00 0.00 H new ATOM 0 HD1 TYR A 951 2.762 19.024 -4.771 1.00 0.00 H new ATOM 0 HD2 TYR A 951 0.342 22.528 -4.927 1.00 0.00 H new ATOM 0 HE1 TYR A 951 1.275 18.087 -2.947 1.00 0.00 H new ATOM 0 HE2 TYR A 951 -1.138 21.578 -3.104 1.00 0.00 H new ATOM 0 HH TYR A 951 -0.308 18.574 -1.506 1.00 0.00 H new ATOM 575 N VAL A 952 1.436 20.400 -8.766 1.00 0.00 N ATOM 576 CA VAL A 952 0.330 19.900 -9.563 1.00 0.00 C ATOM 577 C VAL A 952 0.626 18.462 -9.995 1.00 0.00 C ATOM 578 O VAL A 952 -0.222 17.582 -9.859 1.00 0.00 O ATOM 579 CB VAL A 952 0.070 20.837 -10.745 1.00 0.00 C ATOM 580 CG1 VAL A 952 -0.269 20.045 -12.009 1.00 0.00 C ATOM 581 CG2 VAL A 952 -1.034 21.842 -10.415 1.00 0.00 C ATOM 0 H VAL A 952 1.782 21.318 -9.045 1.00 0.00 H new ATOM 0 HA VAL A 952 -0.586 19.880 -8.973 1.00 0.00 H new ATOM 0 HB VAL A 952 0.986 21.396 -10.936 1.00 0.00 H new ATOM 0 HG11 VAL A 952 -0.449 20.735 -12.833 1.00 0.00 H new ATOM 0 HG12 VAL A 952 0.563 19.388 -12.261 1.00 0.00 H new ATOM 0 HG13 VAL A 952 -1.163 19.447 -11.835 1.00 0.00 H new ATOM 0 HG21 VAL A 952 -1.199 22.496 -11.272 1.00 0.00 H new ATOM 0 HG22 VAL A 952 -1.955 21.307 -10.184 1.00 0.00 H new ATOM 0 HG23 VAL A 952 -0.736 22.440 -9.554 1.00 0.00 H new ATOM 591 N PRO A 953 1.866 18.264 -10.519 1.00 0.00 N ATOM 592 CA PRO A 953 2.285 16.948 -10.971 1.00 0.00 C ATOM 593 C PRO A 953 2.603 16.036 -9.784 1.00 0.00 C ATOM 594 O PRO A 953 2.050 14.943 -9.670 1.00 0.00 O ATOM 595 CB PRO A 953 3.489 17.203 -11.863 1.00 0.00 C ATOM 596 CG PRO A 953 3.982 18.597 -11.509 1.00 0.00 C ATOM 597 CD PRO A 953 2.896 19.282 -10.695 1.00 0.00 C ATOM 0 HA PRO A 953 1.503 16.423 -11.520 1.00 0.00 H new ATOM 0 HB2 PRO A 953 4.267 16.459 -11.692 1.00 0.00 H new ATOM 0 HB3 PRO A 953 3.215 17.141 -12.916 1.00 0.00 H new ATOM 0 HG2 PRO A 953 4.909 18.541 -10.938 1.00 0.00 H new ATOM 0 HG3 PRO A 953 4.198 19.167 -12.413 1.00 0.00 H new ATOM 0 HD2 PRO A 953 3.279 19.627 -9.735 1.00 0.00 H new ATOM 0 HD3 PRO A 953 2.504 20.156 -11.215 1.00 0.00 H new ATOM 605 N MET A 954 3.493 16.519 -8.930 1.00 0.00 N ATOM 606 CA MET A 954 3.891 15.761 -7.756 1.00 0.00 C ATOM 607 C MET A 954 2.758 14.849 -7.281 1.00 0.00 C ATOM 608 O MET A 954 2.878 13.626 -7.334 1.00 0.00 O ATOM 609 CB MET A 954 4.276 16.726 -6.632 1.00 0.00 C ATOM 610 CG MET A 954 5.784 16.700 -6.379 1.00 0.00 C ATOM 611 SD MET A 954 6.362 18.337 -5.967 1.00 0.00 S ATOM 612 CE MET A 954 5.403 18.643 -4.493 1.00 0.00 C ATOM 0 H MET A 954 3.950 17.426 -9.027 1.00 0.00 H new ATOM 0 HA MET A 954 4.745 15.138 -8.021 1.00 0.00 H new ATOM 0 HB2 MET A 954 3.965 17.737 -6.894 1.00 0.00 H new ATOM 0 HB3 MET A 954 3.746 16.456 -5.719 1.00 0.00 H new ATOM 0 HG2 MET A 954 6.013 16.010 -5.567 1.00 0.00 H new ATOM 0 HG3 MET A 954 6.303 16.334 -7.265 1.00 0.00 H new ATOM 0 HE1 MET A 954 4.871 19.589 -4.595 1.00 0.00 H new ATOM 0 HE2 MET A 954 4.684 17.836 -4.353 1.00 0.00 H new ATOM 0 HE3 MET A 954 6.067 18.691 -3.630 1.00 0.00 H new ATOM 622 N VAL A 955 1.685 15.480 -6.828 1.00 0.00 N ATOM 623 CA VAL A 955 0.531 14.740 -6.345 1.00 0.00 C ATOM 624 C VAL A 955 0.000 13.843 -7.465 1.00 0.00 C ATOM 625 O VAL A 955 -0.253 12.658 -7.249 1.00 0.00 O ATOM 626 CB VAL A 955 -0.523 15.709 -5.805 1.00 0.00 C ATOM 627 CG1 VAL A 955 -1.927 15.111 -5.920 1.00 0.00 C ATOM 628 CG2 VAL A 955 -0.213 16.107 -4.361 1.00 0.00 C ATOM 0 H VAL A 955 1.590 16.495 -6.785 1.00 0.00 H new ATOM 0 HA VAL A 955 0.813 14.092 -5.515 1.00 0.00 H new ATOM 0 HB VAL A 955 -0.492 16.612 -6.415 1.00 0.00 H new ATOM 0 HG11 VAL A 955 -2.657 15.820 -5.529 1.00 0.00 H new ATOM 0 HG12 VAL A 955 -2.149 14.901 -6.966 1.00 0.00 H new ATOM 0 HG13 VAL A 955 -1.976 14.186 -5.346 1.00 0.00 H new ATOM 0 HG21 VAL A 955 -0.977 16.796 -4.001 1.00 0.00 H new ATOM 0 HG22 VAL A 955 -0.202 15.217 -3.732 1.00 0.00 H new ATOM 0 HG23 VAL A 955 0.762 16.592 -4.319 1.00 0.00 H new ATOM 638 N LYS A 956 -0.152 14.441 -8.637 1.00 0.00 N ATOM 639 CA LYS A 956 -0.648 13.710 -9.791 1.00 0.00 C ATOM 640 C LYS A 956 0.143 12.409 -9.944 1.00 0.00 C ATOM 641 O LYS A 956 -0.425 11.368 -10.272 1.00 0.00 O ATOM 642 CB LYS A 956 -0.622 14.596 -11.038 1.00 0.00 C ATOM 643 CG LYS A 956 -2.026 14.760 -11.624 1.00 0.00 C ATOM 644 CD LYS A 956 -2.328 16.229 -11.924 1.00 0.00 C ATOM 645 CE LYS A 956 -1.812 16.623 -13.310 1.00 0.00 C ATOM 646 NZ LYS A 956 -2.586 17.765 -13.845 1.00 0.00 N ATOM 0 H LYS A 956 0.059 15.423 -8.813 1.00 0.00 H new ATOM 0 HA LYS A 956 -1.692 13.433 -9.647 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -0.213 15.574 -10.785 1.00 0.00 H new ATOM 0 HB3 LYS A 956 0.039 14.158 -11.786 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -2.113 14.173 -12.539 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -2.764 14.369 -10.923 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -3.403 16.401 -11.870 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -1.865 16.861 -11.166 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -0.756 16.888 -13.250 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -1.890 15.774 -13.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -2.122 18.128 -14.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -3.549 17.452 -14.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -2.632 18.519 -13.130 1.00 0.00 H new ATOM 660 N GLU A 957 1.441 12.512 -9.701 1.00 0.00 N ATOM 661 CA GLU A 957 2.316 11.356 -9.808 1.00 0.00 C ATOM 662 C GLU A 957 1.860 10.255 -8.848 1.00 0.00 C ATOM 663 O GLU A 957 1.867 9.077 -9.202 1.00 0.00 O ATOM 664 CB GLU A 957 3.772 11.745 -9.545 1.00 0.00 C ATOM 665 CG GLU A 957 4.582 11.745 -10.843 1.00 0.00 C ATOM 666 CD GLU A 957 4.489 13.100 -11.547 1.00 0.00 C ATOM 667 OE1 GLU A 957 5.315 13.974 -11.208 1.00 0.00 O ATOM 668 OE2 GLU A 957 3.593 13.231 -12.410 1.00 0.00 O ATOM 0 H GLU A 957 1.908 13.377 -9.430 1.00 0.00 H new ATOM 0 HA GLU A 957 2.256 10.971 -10.826 1.00 0.00 H new ATOM 0 HB2 GLU A 957 3.811 12.734 -9.088 1.00 0.00 H new ATOM 0 HB3 GLU A 957 4.216 11.047 -8.835 1.00 0.00 H new ATOM 0 HG2 GLU A 957 5.625 11.515 -10.625 1.00 0.00 H new ATOM 0 HG3 GLU A 957 4.215 10.961 -11.505 1.00 0.00 H new ATOM 675 N VAL A 958 1.476 10.678 -7.653 1.00 0.00 N ATOM 676 CA VAL A 958 1.018 9.742 -6.640 1.00 0.00 C ATOM 677 C VAL A 958 -0.173 8.951 -7.183 1.00 0.00 C ATOM 678 O VAL A 958 -0.316 7.763 -6.897 1.00 0.00 O ATOM 679 CB VAL A 958 0.698 10.490 -5.344 1.00 0.00 C ATOM 680 CG1 VAL A 958 0.126 9.540 -4.290 1.00 0.00 C ATOM 681 CG2 VAL A 958 1.934 11.219 -4.812 1.00 0.00 C ATOM 0 H VAL A 958 1.472 11.656 -7.363 1.00 0.00 H new ATOM 0 HA VAL A 958 1.802 9.024 -6.401 1.00 0.00 H new ATOM 0 HB VAL A 958 -0.062 11.239 -5.568 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -0.093 10.097 -3.379 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -0.791 9.087 -4.668 1.00 0.00 H new ATOM 0 HG13 VAL A 958 0.854 8.758 -4.072 1.00 0.00 H new ATOM 0 HG21 VAL A 958 1.679 11.742 -3.891 1.00 0.00 H new ATOM 0 HG22 VAL A 958 2.725 10.496 -4.612 1.00 0.00 H new ATOM 0 HG23 VAL A 958 2.280 11.939 -5.554 1.00 0.00 H new ATOM 691 N GLY A 959 -0.997 9.641 -7.958 1.00 0.00 N ATOM 692 CA GLY A 959 -2.171 9.017 -8.544 1.00 0.00 C ATOM 693 C GLY A 959 -1.773 7.937 -9.552 1.00 0.00 C ATOM 694 O GLY A 959 -2.336 6.844 -9.550 1.00 0.00 O ATOM 0 H GLY A 959 -0.875 10.626 -8.194 1.00 0.00 H new ATOM 0 HA2 GLY A 959 -2.784 8.577 -7.757 1.00 0.00 H new ATOM 0 HA3 GLY A 959 -2.781 9.773 -9.038 1.00 0.00 H new ATOM 698 N LEU A 960 -0.805 8.282 -10.389 1.00 0.00 N ATOM 699 CA LEU A 960 -0.324 7.355 -11.400 1.00 0.00 C ATOM 700 C LEU A 960 0.211 6.095 -10.717 1.00 0.00 C ATOM 701 O LEU A 960 -0.040 4.982 -11.177 1.00 0.00 O ATOM 702 CB LEU A 960 0.695 8.040 -12.313 1.00 0.00 C ATOM 703 CG LEU A 960 0.353 8.057 -13.804 1.00 0.00 C ATOM 704 CD1 LEU A 960 0.802 9.367 -14.454 1.00 0.00 C ATOM 705 CD2 LEU A 960 0.939 6.835 -14.515 1.00 0.00 C ATOM 0 H LEU A 960 -0.341 9.190 -10.388 1.00 0.00 H new ATOM 0 HA LEU A 960 -1.141 7.043 -12.051 1.00 0.00 H new ATOM 0 HB2 LEU A 960 0.820 9.069 -11.977 1.00 0.00 H new ATOM 0 HB3 LEU A 960 1.658 7.544 -12.187 1.00 0.00 H new ATOM 0 HG LEU A 960 -0.731 8.001 -13.907 1.00 0.00 H new ATOM 0 HD11 LEU A 960 0.547 9.353 -15.514 1.00 0.00 H new ATOM 0 HD12 LEU A 960 0.299 10.204 -13.970 1.00 0.00 H new ATOM 0 HD13 LEU A 960 1.880 9.478 -14.342 1.00 0.00 H new ATOM 0 HD21 LEU A 960 0.681 6.872 -15.573 1.00 0.00 H new ATOM 0 HD22 LEU A 960 2.023 6.836 -14.405 1.00 0.00 H new ATOM 0 HD23 LEU A 960 0.530 5.926 -14.073 1.00 0.00 H new ATOM 717 N ALA A 961 0.938 6.312 -9.631 1.00 0.00 N ATOM 718 CA ALA A 961 1.510 5.207 -8.881 1.00 0.00 C ATOM 719 C ALA A 961 0.382 4.357 -8.292 1.00 0.00 C ATOM 720 O ALA A 961 0.463 3.130 -8.287 1.00 0.00 O ATOM 721 CB ALA A 961 2.451 5.753 -7.805 1.00 0.00 C ATOM 0 H ALA A 961 1.144 7.237 -9.253 1.00 0.00 H new ATOM 0 HA ALA A 961 2.100 4.565 -9.535 1.00 0.00 H new ATOM 0 HB1 ALA A 961 2.880 4.924 -7.242 1.00 0.00 H new ATOM 0 HB2 ALA A 961 3.251 6.324 -8.277 1.00 0.00 H new ATOM 0 HB3 ALA A 961 1.893 6.401 -7.128 1.00 0.00 H new ATOM 727 N LEU A 962 -0.644 5.044 -7.811 1.00 0.00 N ATOM 728 CA LEU A 962 -1.787 4.367 -7.222 1.00 0.00 C ATOM 729 C LEU A 962 -2.456 3.489 -8.281 1.00 0.00 C ATOM 730 O LEU A 962 -2.766 2.327 -8.024 1.00 0.00 O ATOM 731 CB LEU A 962 -2.733 5.380 -6.574 1.00 0.00 C ATOM 732 CG LEU A 962 -4.224 5.177 -6.852 1.00 0.00 C ATOM 733 CD1 LEU A 962 -5.057 5.444 -5.597 1.00 0.00 C ATOM 734 CD2 LEU A 962 -4.683 6.030 -8.037 1.00 0.00 C ATOM 0 H LEU A 962 -0.708 6.062 -7.817 1.00 0.00 H new ATOM 0 HA LEU A 962 -1.466 3.706 -6.417 1.00 0.00 H new ATOM 0 HB2 LEU A 962 -2.578 5.354 -5.495 1.00 0.00 H new ATOM 0 HB3 LEU A 962 -2.453 6.377 -6.913 1.00 0.00 H new ATOM 0 HG LEU A 962 -4.381 4.134 -7.127 1.00 0.00 H new ATOM 0 HD11 LEU A 962 -6.113 5.293 -5.822 1.00 0.00 H new ATOM 0 HD12 LEU A 962 -4.753 4.759 -4.806 1.00 0.00 H new ATOM 0 HD13 LEU A 962 -4.900 6.471 -5.268 1.00 0.00 H new ATOM 0 HD21 LEU A 962 -5.746 5.867 -8.213 1.00 0.00 H new ATOM 0 HD22 LEU A 962 -4.509 7.083 -7.816 1.00 0.00 H new ATOM 0 HD23 LEU A 962 -4.121 5.749 -8.927 1.00 0.00 H new ATOM 746 N ARG A 963 -2.660 4.079 -9.450 1.00 0.00 N ATOM 747 CA ARG A 963 -3.287 3.365 -10.550 1.00 0.00 C ATOM 748 C ARG A 963 -2.589 2.023 -10.778 1.00 0.00 C ATOM 749 O ARG A 963 -3.241 0.982 -10.835 1.00 0.00 O ATOM 750 CB ARG A 963 -3.234 4.185 -11.840 1.00 0.00 C ATOM 751 CG ARG A 963 -4.106 5.437 -11.730 1.00 0.00 C ATOM 752 CD ARG A 963 -5.044 5.560 -12.932 1.00 0.00 C ATOM 753 NE ARG A 963 -5.183 6.981 -13.324 1.00 0.00 N ATOM 754 CZ ARG A 963 -6.074 7.430 -14.217 1.00 0.00 C ATOM 755 NH1 ARG A 963 -6.912 6.573 -14.818 1.00 0.00 N ATOM 756 NH2 ARG A 963 -6.129 8.737 -14.510 1.00 0.00 N ATOM 0 H ARG A 963 -2.402 5.043 -9.659 1.00 0.00 H new ATOM 0 HA ARG A 963 -4.330 3.195 -10.283 1.00 0.00 H new ATOM 0 HB2 ARG A 963 -2.204 4.472 -12.050 1.00 0.00 H new ATOM 0 HB3 ARG A 963 -3.572 3.574 -12.677 1.00 0.00 H new ATOM 0 HG2 ARG A 963 -4.690 5.398 -10.811 1.00 0.00 H new ATOM 0 HG3 ARG A 963 -3.472 6.321 -11.667 1.00 0.00 H new ATOM 0 HD2 ARG A 963 -4.654 4.980 -13.769 1.00 0.00 H new ATOM 0 HD3 ARG A 963 -6.021 5.145 -12.685 1.00 0.00 H new ATOM 0 HE ARG A 963 -4.561 7.661 -12.886 1.00 0.00 H new ATOM 0 HH11 ARG A 963 -6.871 5.579 -14.595 1.00 0.00 H new ATOM 0 HH12 ARG A 963 -7.591 6.916 -15.498 1.00 0.00 H new ATOM 0 HH21 ARG A 963 -5.492 9.389 -14.053 1.00 0.00 H new ATOM 0 HH22 ARG A 963 -6.808 9.079 -15.190 1.00 0.00 H new ATOM 770 N THR A 964 -1.271 2.091 -10.902 1.00 0.00 N ATOM 771 CA THR A 964 -0.478 0.894 -11.123 1.00 0.00 C ATOM 772 C THR A 964 -0.563 -0.034 -9.909 1.00 0.00 C ATOM 773 O THR A 964 -0.560 -1.255 -10.056 1.00 0.00 O ATOM 774 CB THR A 964 0.951 1.328 -11.456 1.00 0.00 C ATOM 775 OG1 THR A 964 0.880 1.739 -12.818 1.00 0.00 O ATOM 776 CG2 THR A 964 1.932 0.154 -11.471 1.00 0.00 C ATOM 0 H THR A 964 -0.733 2.956 -10.854 1.00 0.00 H new ATOM 0 HA THR A 964 -0.862 0.315 -11.963 1.00 0.00 H new ATOM 0 HB THR A 964 1.284 2.069 -10.729 1.00 0.00 H new ATOM 0 HG1 THR A 964 1.764 2.038 -13.116 1.00 0.00 H new ATOM 0 HG21 THR A 964 2.931 0.518 -11.713 1.00 0.00 H new ATOM 0 HG22 THR A 964 1.946 -0.321 -10.490 1.00 0.00 H new ATOM 0 HG23 THR A 964 1.619 -0.572 -12.221 1.00 0.00 H new ATOM 784 N LEU A 965 -0.638 0.581 -8.738 1.00 0.00 N ATOM 785 CA LEU A 965 -0.725 -0.174 -7.500 1.00 0.00 C ATOM 786 C LEU A 965 -1.933 -1.111 -7.563 1.00 0.00 C ATOM 787 O LEU A 965 -1.869 -2.245 -7.089 1.00 0.00 O ATOM 788 CB LEU A 965 -0.741 0.770 -6.296 1.00 0.00 C ATOM 789 CG LEU A 965 -1.256 0.175 -4.984 1.00 0.00 C ATOM 790 CD1 LEU A 965 -0.457 0.705 -3.791 1.00 0.00 C ATOM 791 CD2 LEU A 965 -2.757 0.420 -4.823 1.00 0.00 C ATOM 0 H LEU A 965 -0.640 1.594 -8.621 1.00 0.00 H new ATOM 0 HA LEU A 965 0.158 -0.800 -7.373 1.00 0.00 H new ATOM 0 HB2 LEU A 965 0.273 1.136 -6.133 1.00 0.00 H new ATOM 0 HB3 LEU A 965 -1.356 1.635 -6.546 1.00 0.00 H new ATOM 0 HG LEU A 965 -1.108 -0.904 -5.017 1.00 0.00 H new ATOM 0 HD11 LEU A 965 -0.843 0.267 -2.871 1.00 0.00 H new ATOM 0 HD12 LEU A 965 0.593 0.437 -3.908 1.00 0.00 H new ATOM 0 HD13 LEU A 965 -0.551 1.790 -3.743 1.00 0.00 H new ATOM 0 HD21 LEU A 965 -3.097 -0.013 -3.882 1.00 0.00 H new ATOM 0 HD22 LEU A 965 -2.952 1.492 -4.821 1.00 0.00 H new ATOM 0 HD23 LEU A 965 -3.292 -0.045 -5.651 1.00 0.00 H new ATOM 803 N LEU A 966 -3.006 -0.603 -8.151 1.00 0.00 N ATOM 804 CA LEU A 966 -4.226 -1.381 -8.282 1.00 0.00 C ATOM 805 C LEU A 966 -3.950 -2.615 -9.143 1.00 0.00 C ATOM 806 O LEU A 966 -4.282 -3.734 -8.756 1.00 0.00 O ATOM 807 CB LEU A 966 -5.365 -0.505 -8.809 1.00 0.00 C ATOM 808 CG LEU A 966 -6.064 0.379 -7.775 1.00 0.00 C ATOM 809 CD1 LEU A 966 -5.245 1.639 -7.487 1.00 0.00 C ATOM 810 CD2 LEU A 966 -7.492 0.711 -8.213 1.00 0.00 C ATOM 0 H LEU A 966 -3.056 0.338 -8.542 1.00 0.00 H new ATOM 0 HA LEU A 966 -4.555 -1.740 -7.307 1.00 0.00 H new ATOM 0 HB2 LEU A 966 -4.969 0.135 -9.597 1.00 0.00 H new ATOM 0 HB3 LEU A 966 -6.112 -1.152 -9.269 1.00 0.00 H new ATOM 0 HG LEU A 966 -6.135 -0.179 -6.841 1.00 0.00 H new ATOM 0 HD11 LEU A 966 -5.765 2.250 -6.749 1.00 0.00 H new ATOM 0 HD12 LEU A 966 -4.266 1.356 -7.100 1.00 0.00 H new ATOM 0 HD13 LEU A 966 -5.120 2.210 -8.407 1.00 0.00 H new ATOM 0 HD21 LEU A 966 -7.966 1.340 -7.460 1.00 0.00 H new ATOM 0 HD22 LEU A 966 -7.467 1.241 -9.165 1.00 0.00 H new ATOM 0 HD23 LEU A 966 -8.062 -0.211 -8.326 1.00 0.00 H new ATOM 822 N ALA A 967 -3.345 -2.369 -10.296 1.00 0.00 N ATOM 823 CA ALA A 967 -3.020 -3.446 -11.215 1.00 0.00 C ATOM 824 C ALA A 967 -2.125 -4.464 -10.506 1.00 0.00 C ATOM 825 O ALA A 967 -2.466 -5.643 -10.420 1.00 0.00 O ATOM 826 CB ALA A 967 -2.363 -2.866 -12.470 1.00 0.00 C ATOM 0 H ALA A 967 -3.071 -1.439 -10.614 1.00 0.00 H new ATOM 0 HA ALA A 967 -3.924 -3.966 -11.531 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -2.119 -3.674 -13.160 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -3.051 -2.172 -12.953 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -1.451 -2.338 -12.192 1.00 0.00 H new ATOM 832 N THR A 968 -0.996 -3.972 -10.016 1.00 0.00 N ATOM 833 CA THR A 968 -0.050 -4.824 -9.317 1.00 0.00 C ATOM 834 C THR A 968 -0.758 -5.619 -8.218 1.00 0.00 C ATOM 835 O THR A 968 -0.467 -6.796 -8.012 1.00 0.00 O ATOM 836 CB THR A 968 1.084 -3.941 -8.793 1.00 0.00 C ATOM 837 OG1 THR A 968 0.453 -3.099 -7.832 1.00 0.00 O ATOM 838 CG2 THR A 968 1.607 -2.969 -9.853 1.00 0.00 C ATOM 0 H THR A 968 -0.716 -2.994 -10.090 1.00 0.00 H new ATOM 0 HA THR A 968 0.381 -5.568 -9.987 1.00 0.00 H new ATOM 0 HB THR A 968 1.902 -4.571 -8.443 1.00 0.00 H new ATOM 0 HG1 THR A 968 -0.462 -2.901 -8.121 1.00 0.00 H new ATOM 0 HG21 THR A 968 2.410 -2.366 -9.429 1.00 0.00 H new ATOM 0 HG22 THR A 968 1.986 -3.531 -10.706 1.00 0.00 H new ATOM 0 HG23 THR A 968 0.797 -2.316 -10.179 1.00 0.00 H new ATOM 846 N VAL A 969 -1.675 -4.943 -7.540 1.00 0.00 N ATOM 847 CA VAL A 969 -2.427 -5.571 -6.467 1.00 0.00 C ATOM 848 C VAL A 969 -3.130 -6.819 -7.006 1.00 0.00 C ATOM 849 O VAL A 969 -3.085 -7.879 -6.384 1.00 0.00 O ATOM 850 CB VAL A 969 -3.394 -4.562 -5.845 1.00 0.00 C ATOM 851 CG1 VAL A 969 -4.490 -5.272 -5.048 1.00 0.00 C ATOM 852 CG2 VAL A 969 -2.646 -3.553 -4.971 1.00 0.00 C ATOM 0 H VAL A 969 -1.914 -3.967 -7.713 1.00 0.00 H new ATOM 0 HA VAL A 969 -1.758 -5.893 -5.669 1.00 0.00 H new ATOM 0 HB VAL A 969 -3.873 -4.013 -6.656 1.00 0.00 H new ATOM 0 HG11 VAL A 969 -5.164 -4.532 -4.616 1.00 0.00 H new ATOM 0 HG12 VAL A 969 -5.052 -5.932 -5.709 1.00 0.00 H new ATOM 0 HG13 VAL A 969 -4.037 -5.859 -4.249 1.00 0.00 H new ATOM 0 HG21 VAL A 969 -3.356 -2.847 -4.541 1.00 0.00 H new ATOM 0 HG22 VAL A 969 -2.127 -4.080 -4.170 1.00 0.00 H new ATOM 0 HG23 VAL A 969 -1.920 -3.013 -5.579 1.00 0.00 H new ATOM 862 N ASP A 970 -3.764 -6.651 -8.157 1.00 0.00 N ATOM 863 CA ASP A 970 -4.475 -7.750 -8.787 1.00 0.00 C ATOM 864 C ASP A 970 -3.560 -8.974 -8.851 1.00 0.00 C ATOM 865 O ASP A 970 -4.000 -10.097 -8.606 1.00 0.00 O ATOM 866 CB ASP A 970 -4.888 -7.393 -10.216 1.00 0.00 C ATOM 867 CG ASP A 970 -5.782 -8.424 -10.908 1.00 0.00 C ATOM 868 OD1 ASP A 970 -6.805 -8.793 -10.291 1.00 0.00 O ATOM 869 OD2 ASP A 970 -5.422 -8.819 -12.038 1.00 0.00 O ATOM 0 H ASP A 970 -3.800 -5.770 -8.670 1.00 0.00 H new ATOM 0 HA ASP A 970 -5.367 -7.957 -8.195 1.00 0.00 H new ATOM 0 HB2 ASP A 970 -5.409 -6.436 -10.199 1.00 0.00 H new ATOM 0 HB3 ASP A 970 -3.988 -7.255 -10.815 1.00 0.00 H new ATOM 874 N GLU A 971 -2.303 -8.717 -9.183 1.00 0.00 N ATOM 875 CA GLU A 971 -1.322 -9.784 -9.283 1.00 0.00 C ATOM 876 C GLU A 971 -0.929 -10.276 -7.888 1.00 0.00 C ATOM 877 O GLU A 971 -0.448 -11.397 -7.735 1.00 0.00 O ATOM 878 CB GLU A 971 -0.092 -9.326 -10.070 1.00 0.00 C ATOM 879 CG GLU A 971 0.449 -10.456 -10.948 1.00 0.00 C ATOM 880 CD GLU A 971 1.049 -9.905 -12.243 1.00 0.00 C ATOM 881 OE1 GLU A 971 0.307 -9.192 -12.953 1.00 0.00 O ATOM 882 OE2 GLU A 971 2.235 -10.209 -12.493 1.00 0.00 O ATOM 0 H GLU A 971 -1.942 -7.785 -9.386 1.00 0.00 H new ATOM 0 HA GLU A 971 -1.772 -10.615 -9.827 1.00 0.00 H new ATOM 0 HB2 GLU A 971 -0.352 -8.470 -10.692 1.00 0.00 H new ATOM 0 HB3 GLU A 971 0.683 -8.994 -9.379 1.00 0.00 H new ATOM 0 HG2 GLU A 971 1.208 -11.015 -10.401 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -0.354 -11.155 -11.183 1.00 0.00 H new ATOM 889 N SER A 972 -1.148 -9.412 -6.908 1.00 0.00 N ATOM 890 CA SER A 972 -0.822 -9.745 -5.531 1.00 0.00 C ATOM 891 C SER A 972 -1.981 -10.511 -4.890 1.00 0.00 C ATOM 892 O SER A 972 -1.782 -11.256 -3.931 1.00 0.00 O ATOM 893 CB SER A 972 -0.505 -8.486 -4.721 1.00 0.00 C ATOM 894 OG SER A 972 0.794 -8.540 -4.138 1.00 0.00 O ATOM 0 H SER A 972 -1.547 -8.482 -7.039 1.00 0.00 H new ATOM 0 HA SER A 972 0.066 -10.377 -5.532 1.00 0.00 H new ATOM 0 HB2 SER A 972 -0.576 -7.611 -5.368 1.00 0.00 H new ATOM 0 HB3 SER A 972 -1.250 -8.363 -3.935 1.00 0.00 H new ATOM 0 HG SER A 972 0.953 -7.725 -3.618 1.00 0.00 H new ATOM 900 N LEU A 973 -3.165 -10.302 -5.445 1.00 0.00 N ATOM 901 CA LEU A 973 -4.356 -10.964 -4.939 1.00 0.00 C ATOM 902 C LEU A 973 -4.055 -12.449 -4.721 1.00 0.00 C ATOM 903 O LEU A 973 -4.286 -12.979 -3.636 1.00 0.00 O ATOM 904 CB LEU A 973 -5.546 -10.707 -5.865 1.00 0.00 C ATOM 905 CG LEU A 973 -6.795 -10.118 -5.206 1.00 0.00 C ATOM 906 CD1 LEU A 973 -8.068 -10.681 -5.840 1.00 0.00 C ATOM 907 CD2 LEU A 973 -6.767 -10.331 -3.691 1.00 0.00 C ATOM 0 H LEU A 973 -3.326 -9.684 -6.240 1.00 0.00 H new ATOM 0 HA LEU A 973 -4.640 -10.550 -3.971 1.00 0.00 H new ATOM 0 HB2 LEU A 973 -5.225 -10.031 -6.657 1.00 0.00 H new ATOM 0 HB3 LEU A 973 -5.820 -11.648 -6.341 1.00 0.00 H new ATOM 0 HG LEU A 973 -6.798 -9.042 -5.381 1.00 0.00 H new ATOM 0 HD11 LEU A 973 -8.940 -10.246 -5.353 1.00 0.00 H new ATOM 0 HD12 LEU A 973 -8.085 -10.435 -6.902 1.00 0.00 H new ATOM 0 HD13 LEU A 973 -8.087 -11.764 -5.718 1.00 0.00 H new ATOM 0 HD21 LEU A 973 -7.666 -9.903 -3.247 1.00 0.00 H new ATOM 0 HD22 LEU A 973 -6.728 -11.399 -3.474 1.00 0.00 H new ATOM 0 HD23 LEU A 973 -5.887 -9.843 -3.271 1.00 0.00 H new ATOM 919 N PRO A 974 -3.532 -13.093 -5.798 1.00 0.00 N ATOM 920 CA PRO A 974 -3.197 -14.505 -5.736 1.00 0.00 C ATOM 921 C PRO A 974 -1.913 -14.730 -4.934 1.00 0.00 C ATOM 922 O PRO A 974 -1.758 -15.759 -4.279 1.00 0.00 O ATOM 923 CB PRO A 974 -3.076 -14.946 -7.185 1.00 0.00 C ATOM 924 CG PRO A 974 -2.889 -13.673 -7.994 1.00 0.00 C ATOM 925 CD PRO A 974 -3.245 -12.496 -7.100 1.00 0.00 C ATOM 0 HA PRO A 974 -3.954 -15.093 -5.217 1.00 0.00 H new ATOM 0 HB2 PRO A 974 -2.231 -15.621 -7.318 1.00 0.00 H new ATOM 0 HB3 PRO A 974 -3.968 -15.485 -7.505 1.00 0.00 H new ATOM 0 HG2 PRO A 974 -1.860 -13.590 -8.343 1.00 0.00 H new ATOM 0 HG3 PRO A 974 -3.525 -13.686 -8.879 1.00 0.00 H new ATOM 0 HD2 PRO A 974 -2.422 -11.784 -7.036 1.00 0.00 H new ATOM 0 HD3 PRO A 974 -4.108 -11.953 -7.485 1.00 0.00 H new ATOM 933 N VAL A 975 -1.026 -13.749 -5.012 1.00 0.00 N ATOM 934 CA VAL A 975 0.239 -13.826 -4.301 1.00 0.00 C ATOM 935 C VAL A 975 -0.017 -14.265 -2.858 1.00 0.00 C ATOM 936 O VAL A 975 0.813 -14.944 -2.256 1.00 0.00 O ATOM 937 CB VAL A 975 0.976 -12.489 -4.397 1.00 0.00 C ATOM 938 CG1 VAL A 975 2.037 -12.367 -3.302 1.00 0.00 C ATOM 939 CG2 VAL A 975 1.595 -12.302 -5.784 1.00 0.00 C ATOM 0 H VAL A 975 -1.158 -12.897 -5.557 1.00 0.00 H new ATOM 0 HA VAL A 975 0.888 -14.573 -4.758 1.00 0.00 H new ATOM 0 HB VAL A 975 0.246 -11.693 -4.246 1.00 0.00 H new ATOM 0 HG11 VAL A 975 2.546 -11.407 -3.394 1.00 0.00 H new ATOM 0 HG12 VAL A 975 1.560 -12.433 -2.324 1.00 0.00 H new ATOM 0 HG13 VAL A 975 2.763 -13.174 -3.407 1.00 0.00 H new ATOM 0 HG21 VAL A 975 2.113 -11.344 -5.825 1.00 0.00 H new ATOM 0 HG22 VAL A 975 2.305 -13.107 -5.977 1.00 0.00 H new ATOM 0 HG23 VAL A 975 0.809 -12.322 -6.539 1.00 0.00 H new ATOM 949 N LEU A 976 -1.170 -13.860 -2.346 1.00 0.00 N ATOM 950 CA LEU A 976 -1.546 -14.203 -0.985 1.00 0.00 C ATOM 951 C LEU A 976 -2.701 -15.206 -1.017 1.00 0.00 C ATOM 952 O LEU A 976 -3.464 -15.249 -1.981 1.00 0.00 O ATOM 953 CB LEU A 976 -1.851 -12.939 -0.178 1.00 0.00 C ATOM 954 CG LEU A 976 -0.782 -11.845 -0.216 1.00 0.00 C ATOM 955 CD1 LEU A 976 0.606 -12.425 0.063 1.00 0.00 C ATOM 956 CD2 LEU A 976 -0.827 -11.080 -1.541 1.00 0.00 C ATOM 0 H LEU A 976 -1.856 -13.298 -2.849 1.00 0.00 H new ATOM 0 HA LEU A 976 -0.716 -14.688 -0.471 1.00 0.00 H new ATOM 0 HB2 LEU A 976 -2.788 -12.517 -0.542 1.00 0.00 H new ATOM 0 HB3 LEU A 976 -2.013 -13.225 0.861 1.00 0.00 H new ATOM 0 HG LEU A 976 -0.998 -11.129 0.577 1.00 0.00 H new ATOM 0 HD11 LEU A 976 1.347 -11.627 0.030 1.00 0.00 H new ATOM 0 HD12 LEU A 976 0.615 -12.888 1.050 1.00 0.00 H new ATOM 0 HD13 LEU A 976 0.846 -13.174 -0.692 1.00 0.00 H new ATOM 0 HD21 LEU A 976 -0.057 -10.308 -1.542 1.00 0.00 H new ATOM 0 HD22 LEU A 976 -0.650 -11.770 -2.366 1.00 0.00 H new ATOM 0 HD23 LEU A 976 -1.806 -10.616 -1.660 1.00 0.00 H new ATOM 968 N PRO A 977 -2.795 -16.009 0.077 1.00 0.00 N ATOM 969 CA PRO A 977 -3.845 -17.008 0.183 1.00 0.00 C ATOM 970 C PRO A 977 -5.192 -16.357 0.501 1.00 0.00 C ATOM 971 O PRO A 977 -5.240 -15.266 1.067 1.00 0.00 O ATOM 972 CB PRO A 977 -3.373 -17.960 1.270 1.00 0.00 C ATOM 973 CG PRO A 977 -2.310 -17.206 2.052 1.00 0.00 C ATOM 974 CD PRO A 977 -1.910 -15.986 1.237 1.00 0.00 C ATOM 0 HA PRO A 977 -4.013 -17.543 -0.752 1.00 0.00 H new ATOM 0 HB2 PRO A 977 -4.199 -18.254 1.917 1.00 0.00 H new ATOM 0 HB3 PRO A 977 -2.965 -18.874 0.838 1.00 0.00 H new ATOM 0 HG2 PRO A 977 -2.694 -16.905 3.026 1.00 0.00 H new ATOM 0 HG3 PRO A 977 -1.445 -17.844 2.234 1.00 0.00 H new ATOM 0 HD2 PRO A 977 -2.034 -15.068 1.811 1.00 0.00 H new ATOM 0 HD3 PRO A 977 -0.863 -16.036 0.937 1.00 0.00 H new ATOM 982 N ALA A 978 -6.254 -17.054 0.124 1.00 0.00 N ATOM 983 CA ALA A 978 -7.598 -16.557 0.363 1.00 0.00 C ATOM 984 C ALA A 978 -7.785 -16.302 1.859 1.00 0.00 C ATOM 985 O ALA A 978 -7.894 -17.242 2.645 1.00 0.00 O ATOM 986 CB ALA A 978 -8.617 -17.556 -0.190 1.00 0.00 C ATOM 0 H ALA A 978 -6.211 -17.959 -0.345 1.00 0.00 H new ATOM 0 HA ALA A 978 -7.755 -15.610 -0.154 1.00 0.00 H new ATOM 0 HB1 ALA A 978 -9.626 -17.184 -0.011 1.00 0.00 H new ATOM 0 HB2 ALA A 978 -8.461 -17.680 -1.262 1.00 0.00 H new ATOM 0 HB3 ALA A 978 -8.491 -18.517 0.308 1.00 0.00 H new ATOM 992 N SER A 979 -7.817 -15.024 2.209 1.00 0.00 N ATOM 993 CA SER A 979 -7.988 -14.633 3.598 1.00 0.00 C ATOM 994 C SER A 979 -7.975 -13.108 3.717 1.00 0.00 C ATOM 995 O SER A 979 -8.702 -12.539 4.531 1.00 0.00 O ATOM 996 CB SER A 979 -6.898 -15.243 4.481 1.00 0.00 C ATOM 997 OG SER A 979 -7.444 -16.028 5.538 1.00 0.00 O ATOM 0 H SER A 979 -7.727 -14.247 1.555 1.00 0.00 H new ATOM 0 HA SER A 979 -8.950 -15.011 3.943 1.00 0.00 H new ATOM 0 HB2 SER A 979 -6.242 -15.863 3.870 1.00 0.00 H new ATOM 0 HB3 SER A 979 -6.284 -14.447 4.901 1.00 0.00 H new ATOM 0 HG SER A 979 -6.716 -16.401 6.078 1.00 0.00 H new ATOM 1003 N THR A 980 -7.141 -12.488 2.895 1.00 0.00 N ATOM 1004 CA THR A 980 -7.024 -11.040 2.898 1.00 0.00 C ATOM 1005 C THR A 980 -7.600 -10.456 1.607 1.00 0.00 C ATOM 1006 O THR A 980 -7.430 -9.270 1.328 1.00 0.00 O ATOM 1007 CB THR A 980 -5.553 -10.685 3.123 1.00 0.00 C ATOM 1008 OG1 THR A 980 -5.507 -9.272 2.949 1.00 0.00 O ATOM 1009 CG2 THR A 980 -4.645 -11.227 2.017 1.00 0.00 C ATOM 0 H THR A 980 -6.539 -12.963 2.222 1.00 0.00 H new ATOM 0 HA THR A 980 -7.607 -10.598 3.706 1.00 0.00 H new ATOM 0 HB THR A 980 -5.227 -11.079 4.086 1.00 0.00 H new ATOM 0 HG1 THR A 980 -6.389 -8.948 2.670 1.00 0.00 H new ATOM 0 HG21 THR A 980 -3.612 -10.947 2.225 1.00 0.00 H new ATOM 0 HG22 THR A 980 -4.726 -12.313 1.979 1.00 0.00 H new ATOM 0 HG23 THR A 980 -4.949 -10.807 1.058 1.00 0.00 H new ATOM 1017 N HIS A 981 -8.269 -11.316 0.853 1.00 0.00 N ATOM 1018 CA HIS A 981 -8.871 -10.900 -0.403 1.00 0.00 C ATOM 1019 C HIS A 981 -9.755 -9.674 -0.167 1.00 0.00 C ATOM 1020 O HIS A 981 -9.389 -8.559 -0.536 1.00 0.00 O ATOM 1021 CB HIS A 981 -9.627 -12.060 -1.054 1.00 0.00 C ATOM 1022 CG HIS A 981 -8.785 -12.893 -1.991 1.00 0.00 C ATOM 1023 ND1 HIS A 981 -9.280 -13.432 -3.165 1.00 0.00 N ATOM 1024 CD2 HIS A 981 -7.477 -13.272 -1.914 1.00 0.00 C ATOM 1025 CE1 HIS A 981 -8.306 -14.105 -3.760 1.00 0.00 C ATOM 1026 NE2 HIS A 981 -7.189 -14.004 -2.983 1.00 0.00 N ATOM 0 H HIS A 981 -8.408 -12.299 1.087 1.00 0.00 H new ATOM 0 HA HIS A 981 -8.090 -10.612 -1.107 1.00 0.00 H new ATOM 0 HB2 HIS A 981 -10.027 -12.705 -0.271 1.00 0.00 H new ATOM 0 HB3 HIS A 981 -10.479 -11.661 -1.605 1.00 0.00 H new ATOM 0 HD2 HIS A 981 -6.792 -13.019 -1.118 1.00 0.00 H new ATOM 0 HE1 HIS A 981 -8.383 -14.639 -4.695 1.00 0.00 H new ATOM 0 HE2 HIS A 981 -6.282 -14.422 -3.190 1.00 0.00 H new ATOM 1034 N ARG A 982 -10.903 -9.922 0.448 1.00 0.00 N ATOM 1035 CA ARG A 982 -11.843 -8.852 0.738 1.00 0.00 C ATOM 1036 C ARG A 982 -11.105 -7.635 1.299 1.00 0.00 C ATOM 1037 O ARG A 982 -11.175 -6.546 0.732 1.00 0.00 O ATOM 1038 CB ARG A 982 -12.902 -9.307 1.744 1.00 0.00 C ATOM 1039 CG ARG A 982 -14.309 -8.956 1.256 1.00 0.00 C ATOM 1040 CD ARG A 982 -15.367 -9.395 2.270 1.00 0.00 C ATOM 1041 NE ARG A 982 -15.167 -8.681 3.551 1.00 0.00 N ATOM 1042 CZ ARG A 982 -16.093 -8.595 4.516 1.00 0.00 C ATOM 1043 NH1 ARG A 982 -17.288 -9.178 4.351 1.00 0.00 N ATOM 1044 NH2 ARG A 982 -15.824 -7.926 5.645 1.00 0.00 N ATOM 0 H ARG A 982 -11.203 -10.848 0.753 1.00 0.00 H new ATOM 0 HA ARG A 982 -12.337 -8.583 -0.195 1.00 0.00 H new ATOM 0 HB2 ARG A 982 -12.824 -10.383 1.897 1.00 0.00 H new ATOM 0 HB3 ARG A 982 -12.719 -8.834 2.709 1.00 0.00 H new ATOM 0 HG2 ARG A 982 -14.383 -7.881 1.091 1.00 0.00 H new ATOM 0 HG3 ARG A 982 -14.496 -9.440 0.297 1.00 0.00 H new ATOM 0 HD2 ARG A 982 -16.364 -9.188 1.881 1.00 0.00 H new ATOM 0 HD3 ARG A 982 -15.304 -10.471 2.430 1.00 0.00 H new ATOM 0 HE ARG A 982 -14.268 -8.226 3.709 1.00 0.00 H new ATOM 0 HH11 ARG A 982 -17.493 -9.687 3.491 1.00 0.00 H new ATOM 0 HH12 ARG A 982 -17.993 -9.113 5.085 1.00 0.00 H new ATOM 0 HH21 ARG A 982 -14.914 -7.482 5.770 1.00 0.00 H new ATOM 0 HH22 ARG A 982 -16.529 -7.861 6.379 1.00 0.00 H new ATOM 1058 N GLU A 983 -10.415 -7.861 2.408 1.00 0.00 N ATOM 1059 CA GLU A 983 -9.666 -6.796 3.052 1.00 0.00 C ATOM 1060 C GLU A 983 -8.786 -6.073 2.031 1.00 0.00 C ATOM 1061 O GLU A 983 -8.763 -4.844 1.985 1.00 0.00 O ATOM 1062 CB GLU A 983 -8.827 -7.340 4.211 1.00 0.00 C ATOM 1063 CG GLU A 983 -9.498 -7.053 5.556 1.00 0.00 C ATOM 1064 CD GLU A 983 -9.149 -8.131 6.584 1.00 0.00 C ATOM 1065 OE1 GLU A 983 -9.679 -9.253 6.431 1.00 0.00 O ATOM 1066 OE2 GLU A 983 -8.361 -7.809 7.499 1.00 0.00 O ATOM 0 H GLU A 983 -10.359 -8.765 2.876 1.00 0.00 H new ATOM 0 HA GLU A 983 -10.375 -6.078 3.464 1.00 0.00 H new ATOM 0 HB2 GLU A 983 -8.689 -8.415 4.092 1.00 0.00 H new ATOM 0 HB3 GLU A 983 -7.836 -6.887 4.191 1.00 0.00 H new ATOM 0 HG2 GLU A 983 -9.180 -6.078 5.924 1.00 0.00 H new ATOM 0 HG3 GLU A 983 -10.579 -7.007 5.425 1.00 0.00 H new ATOM 1073 N ILE A 984 -8.082 -6.866 1.237 1.00 0.00 N ATOM 1074 CA ILE A 984 -7.203 -6.317 0.219 1.00 0.00 C ATOM 1075 C ILE A 984 -7.981 -5.312 -0.633 1.00 0.00 C ATOM 1076 O ILE A 984 -7.531 -4.186 -0.838 1.00 0.00 O ATOM 1077 CB ILE A 984 -6.555 -7.440 -0.594 1.00 0.00 C ATOM 1078 CG1 ILE A 984 -5.248 -7.901 0.053 1.00 0.00 C ATOM 1079 CG2 ILE A 984 -6.357 -7.019 -2.051 1.00 0.00 C ATOM 1080 CD1 ILE A 984 -4.669 -9.112 -0.682 1.00 0.00 C ATOM 0 H ILE A 984 -8.103 -7.885 1.278 1.00 0.00 H new ATOM 0 HA ILE A 984 -6.379 -5.774 0.682 1.00 0.00 H new ATOM 0 HB ILE A 984 -7.232 -8.294 -0.596 1.00 0.00 H new ATOM 0 HG12 ILE A 984 -4.525 -7.085 0.042 1.00 0.00 H new ATOM 0 HG13 ILE A 984 -5.425 -8.156 1.098 1.00 0.00 H new ATOM 0 HG21 ILE A 984 -5.895 -7.835 -2.606 1.00 0.00 H new ATOM 0 HG22 ILE A 984 -7.323 -6.780 -2.495 1.00 0.00 H new ATOM 0 HG23 ILE A 984 -5.712 -6.142 -2.092 1.00 0.00 H new ATOM 0 HD11 ILE A 984 -3.740 -9.419 -0.202 1.00 0.00 H new ATOM 0 HD12 ILE A 984 -5.384 -9.934 -0.649 1.00 0.00 H new ATOM 0 HD13 ILE A 984 -4.470 -8.846 -1.720 1.00 0.00 H new ATOM 1092 N GLU A 985 -9.136 -5.756 -1.107 1.00 0.00 N ATOM 1093 CA GLU A 985 -9.981 -4.910 -1.932 1.00 0.00 C ATOM 1094 C GLU A 985 -10.350 -3.631 -1.177 1.00 0.00 C ATOM 1095 O GLU A 985 -10.307 -2.539 -1.741 1.00 0.00 O ATOM 1096 CB GLU A 985 -11.235 -5.661 -2.384 1.00 0.00 C ATOM 1097 CG GLU A 985 -11.554 -5.363 -3.850 1.00 0.00 C ATOM 1098 CD GLU A 985 -12.918 -4.683 -3.988 1.00 0.00 C ATOM 1099 OE1 GLU A 985 -12.947 -3.440 -3.862 1.00 0.00 O ATOM 1100 OE2 GLU A 985 -13.900 -5.422 -4.216 1.00 0.00 O ATOM 0 H GLU A 985 -9.506 -6.691 -0.935 1.00 0.00 H new ATOM 0 HA GLU A 985 -9.422 -4.633 -2.826 1.00 0.00 H new ATOM 0 HB2 GLU A 985 -11.089 -6.733 -2.251 1.00 0.00 H new ATOM 0 HB3 GLU A 985 -12.080 -5.374 -1.759 1.00 0.00 H new ATOM 0 HG2 GLU A 985 -10.780 -4.722 -4.271 1.00 0.00 H new ATOM 0 HG3 GLU A 985 -11.546 -6.290 -4.423 1.00 0.00 H new ATOM 1107 N MET A 986 -10.705 -3.809 0.087 1.00 0.00 N ATOM 1108 CA MET A 986 -11.082 -2.684 0.924 1.00 0.00 C ATOM 1109 C MET A 986 -9.864 -1.822 1.264 1.00 0.00 C ATOM 1110 O MET A 986 -9.997 -0.626 1.520 1.00 0.00 O ATOM 1111 CB MET A 986 -11.719 -3.199 2.216 1.00 0.00 C ATOM 1112 CG MET A 986 -13.244 -3.232 2.100 1.00 0.00 C ATOM 1113 SD MET A 986 -13.862 -4.821 2.629 1.00 0.00 S ATOM 1114 CE MET A 986 -14.594 -5.393 1.104 1.00 0.00 C ATOM 0 H MET A 986 -10.739 -4.716 0.552 1.00 0.00 H new ATOM 0 HA MET A 986 -11.797 -2.071 0.376 1.00 0.00 H new ATOM 0 HB2 MET A 986 -11.346 -4.199 2.436 1.00 0.00 H new ATOM 0 HB3 MET A 986 -11.428 -2.560 3.049 1.00 0.00 H new ATOM 0 HG2 MET A 986 -13.681 -2.441 2.710 1.00 0.00 H new ATOM 0 HG3 MET A 986 -13.543 -3.041 1.069 1.00 0.00 H new ATOM 0 HE1 MET A 986 -15.356 -6.141 1.324 1.00 0.00 H new ATOM 0 HE2 MET A 986 -15.051 -4.552 0.582 1.00 0.00 H new ATOM 0 HE3 MET A 986 -13.823 -5.836 0.474 1.00 0.00 H new ATOM 1124 N ALA A 987 -8.704 -2.463 1.256 1.00 0.00 N ATOM 1125 CA ALA A 987 -7.464 -1.770 1.560 1.00 0.00 C ATOM 1126 C ALA A 987 -7.117 -0.825 0.409 1.00 0.00 C ATOM 1127 O ALA A 987 -6.441 0.183 0.610 1.00 0.00 O ATOM 1128 CB ALA A 987 -6.359 -2.794 1.827 1.00 0.00 C ATOM 0 H ALA A 987 -8.597 -3.455 1.044 1.00 0.00 H new ATOM 0 HA ALA A 987 -7.573 -1.166 2.461 1.00 0.00 H new ATOM 0 HB1 ALA A 987 -5.429 -2.274 2.055 1.00 0.00 H new ATOM 0 HB2 ALA A 987 -6.641 -3.421 2.673 1.00 0.00 H new ATOM 0 HB3 ALA A 987 -6.219 -3.417 0.944 1.00 0.00 H new ATOM 1134 N GLN A 988 -7.596 -1.183 -0.774 1.00 0.00 N ATOM 1135 CA GLN A 988 -7.345 -0.379 -1.958 1.00 0.00 C ATOM 1136 C GLN A 988 -8.205 0.886 -1.932 1.00 0.00 C ATOM 1137 O GLN A 988 -7.701 1.988 -2.145 1.00 0.00 O ATOM 1138 CB GLN A 988 -7.596 -1.188 -3.232 1.00 0.00 C ATOM 1139 CG GLN A 988 -6.492 -2.223 -3.451 1.00 0.00 C ATOM 1140 CD GLN A 988 -5.938 -2.142 -4.876 1.00 0.00 C ATOM 1141 OE1 GLN A 988 -5.013 -1.403 -5.168 1.00 0.00 O ATOM 1142 NE2 GLN A 988 -6.555 -2.941 -5.742 1.00 0.00 N ATOM 0 H GLN A 988 -8.157 -2.019 -0.938 1.00 0.00 H new ATOM 0 HA GLN A 988 -6.296 -0.081 -1.957 1.00 0.00 H new ATOM 0 HB2 GLN A 988 -8.561 -1.690 -3.164 1.00 0.00 H new ATOM 0 HB3 GLN A 988 -7.645 -0.517 -4.089 1.00 0.00 H new ATOM 0 HG2 GLN A 988 -5.687 -2.059 -2.734 1.00 0.00 H new ATOM 0 HG3 GLN A 988 -6.884 -3.223 -3.266 1.00 0.00 H new ATOM 0 HE21 GLN A 988 -7.323 -3.535 -5.430 1.00 0.00 H new ATOM 0 HE22 GLN A 988 -6.260 -2.960 -6.718 1.00 0.00 H new ATOM 1151 N LYS A 989 -9.488 0.686 -1.670 1.00 0.00 N ATOM 1152 CA LYS A 989 -10.423 1.797 -1.614 1.00 0.00 C ATOM 1153 C LYS A 989 -9.955 2.799 -0.557 1.00 0.00 C ATOM 1154 O LYS A 989 -10.129 4.005 -0.720 1.00 0.00 O ATOM 1155 CB LYS A 989 -11.848 1.287 -1.390 1.00 0.00 C ATOM 1156 CG LYS A 989 -12.840 2.450 -1.315 1.00 0.00 C ATOM 1157 CD LYS A 989 -13.604 2.433 0.011 1.00 0.00 C ATOM 1158 CE LYS A 989 -15.053 2.883 -0.186 1.00 0.00 C ATOM 1159 NZ LYS A 989 -15.112 4.334 -0.470 1.00 0.00 N ATOM 0 H LYS A 989 -9.902 -0.229 -1.494 1.00 0.00 H new ATOM 0 HA LYS A 989 -10.444 2.325 -2.567 1.00 0.00 H new ATOM 0 HB2 LYS A 989 -12.130 0.616 -2.201 1.00 0.00 H new ATOM 0 HB3 LYS A 989 -11.890 0.708 -0.468 1.00 0.00 H new ATOM 0 HG2 LYS A 989 -12.307 3.395 -1.420 1.00 0.00 H new ATOM 0 HG3 LYS A 989 -13.543 2.387 -2.145 1.00 0.00 H new ATOM 0 HD2 LYS A 989 -13.586 1.428 0.433 1.00 0.00 H new ATOM 0 HD3 LYS A 989 -13.110 3.089 0.728 1.00 0.00 H new ATOM 0 HE2 LYS A 989 -15.504 2.327 -1.008 1.00 0.00 H new ATOM 0 HE3 LYS A 989 -15.635 2.658 0.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 -16.103 4.622 -0.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 -14.701 4.861 0.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 -14.574 4.540 -1.336 1.00 0.00 H new ATOM 1173 N LEU A 990 -9.368 2.262 0.503 1.00 0.00 N ATOM 1174 CA LEU A 990 -8.874 3.094 1.586 1.00 0.00 C ATOM 1175 C LEU A 990 -7.862 4.098 1.031 1.00 0.00 C ATOM 1176 O LEU A 990 -8.026 5.306 1.197 1.00 0.00 O ATOM 1177 CB LEU A 990 -8.320 2.226 2.719 1.00 0.00 C ATOM 1178 CG LEU A 990 -8.897 2.492 4.111 1.00 0.00 C ATOM 1179 CD1 LEU A 990 -8.441 1.424 5.107 1.00 0.00 C ATOM 1180 CD2 LEU A 990 -8.551 3.905 4.587 1.00 0.00 C ATOM 0 H LEU A 990 -9.224 1.261 0.634 1.00 0.00 H new ATOM 0 HA LEU A 990 -9.688 3.670 2.025 1.00 0.00 H new ATOM 0 HB2 LEU A 990 -8.496 1.180 2.468 1.00 0.00 H new ATOM 0 HB3 LEU A 990 -7.240 2.366 2.762 1.00 0.00 H new ATOM 0 HG LEU A 990 -9.983 2.430 4.048 1.00 0.00 H new ATOM 0 HD11 LEU A 990 -8.865 1.637 6.088 1.00 0.00 H new ATOM 0 HD12 LEU A 990 -8.779 0.444 4.770 1.00 0.00 H new ATOM 0 HD13 LEU A 990 -7.353 1.429 5.173 1.00 0.00 H new ATOM 0 HD21 LEU A 990 -8.973 4.068 5.579 1.00 0.00 H new ATOM 0 HD22 LEU A 990 -7.468 4.019 4.630 1.00 0.00 H new ATOM 0 HD23 LEU A 990 -8.966 4.635 3.892 1.00 0.00 H new ATOM 1192 N LEU A 991 -6.838 3.562 0.383 1.00 0.00 N ATOM 1193 CA LEU A 991 -5.800 4.397 -0.198 1.00 0.00 C ATOM 1194 C LEU A 991 -6.448 5.481 -1.061 1.00 0.00 C ATOM 1195 O LEU A 991 -6.328 6.669 -0.765 1.00 0.00 O ATOM 1196 CB LEU A 991 -4.781 3.539 -0.950 1.00 0.00 C ATOM 1197 CG LEU A 991 -3.655 4.298 -1.654 1.00 0.00 C ATOM 1198 CD1 LEU A 991 -2.876 5.165 -0.663 1.00 0.00 C ATOM 1199 CD2 LEU A 991 -2.740 3.338 -2.417 1.00 0.00 C ATOM 0 H LEU A 991 -6.705 2.560 0.247 1.00 0.00 H new ATOM 0 HA LEU A 991 -5.237 4.906 0.585 1.00 0.00 H new ATOM 0 HB2 LEU A 991 -4.334 2.838 -0.244 1.00 0.00 H new ATOM 0 HB3 LEU A 991 -5.313 2.946 -1.694 1.00 0.00 H new ATOM 0 HG LEU A 991 -4.102 4.969 -2.388 1.00 0.00 H new ATOM 0 HD11 LEU A 991 -2.081 5.694 -1.189 1.00 0.00 H new ATOM 0 HD12 LEU A 991 -3.550 5.887 -0.203 1.00 0.00 H new ATOM 0 HD13 LEU A 991 -2.441 4.532 0.110 1.00 0.00 H new ATOM 0 HD21 LEU A 991 -1.948 3.903 -2.908 1.00 0.00 H new ATOM 0 HD22 LEU A 991 -2.298 2.625 -1.720 1.00 0.00 H new ATOM 0 HD23 LEU A 991 -3.321 2.800 -3.167 1.00 0.00 H new ATOM 1211 N ASN A 992 -7.120 5.034 -2.112 1.00 0.00 N ATOM 1212 CA ASN A 992 -7.786 5.951 -3.020 1.00 0.00 C ATOM 1213 C ASN A 992 -8.512 7.027 -2.210 1.00 0.00 C ATOM 1214 O ASN A 992 -8.318 8.219 -2.440 1.00 0.00 O ATOM 1215 CB ASN A 992 -8.824 5.222 -3.876 1.00 0.00 C ATOM 1216 CG ASN A 992 -9.075 5.969 -5.188 1.00 0.00 C ATOM 1217 OD1 ASN A 992 -8.174 6.219 -5.972 1.00 0.00 O ATOM 1218 ND2 ASN A 992 -10.346 6.309 -5.382 1.00 0.00 N ATOM 0 H ASN A 992 -7.217 4.048 -2.355 1.00 0.00 H new ATOM 0 HA ASN A 992 -7.029 6.392 -3.669 1.00 0.00 H new ATOM 0 HB2 ASN A 992 -8.479 4.210 -4.090 1.00 0.00 H new ATOM 0 HB3 ASN A 992 -9.758 5.130 -3.321 1.00 0.00 H new ATOM 0 HD21 ASN A 992 -10.616 6.810 -6.228 1.00 0.00 H new ATOM 0 HD22 ASN A 992 -11.050 6.069 -4.685 1.00 0.00 H new ATOM 1225 N SER A 993 -9.334 6.566 -1.278 1.00 0.00 N ATOM 1226 CA SER A 993 -10.091 7.474 -0.433 1.00 0.00 C ATOM 1227 C SER A 993 -9.201 8.635 0.016 1.00 0.00 C ATOM 1228 O SER A 993 -9.376 9.766 -0.434 1.00 0.00 O ATOM 1229 CB SER A 993 -10.665 6.745 0.783 1.00 0.00 C ATOM 1230 OG SER A 993 -12.048 7.030 0.973 1.00 0.00 O ATOM 0 H SER A 993 -9.492 5.576 -1.090 1.00 0.00 H new ATOM 0 HA SER A 993 -10.925 7.867 -1.014 1.00 0.00 H new ATOM 0 HB2 SER A 993 -10.530 5.671 0.658 1.00 0.00 H new ATOM 0 HB3 SER A 993 -10.109 7.035 1.675 1.00 0.00 H new ATOM 0 HG SER A 993 -12.377 6.544 1.758 1.00 0.00 H new ATOM 1236 N ASP A 994 -8.266 8.315 0.898 1.00 0.00 N ATOM 1237 CA ASP A 994 -7.348 9.317 1.413 1.00 0.00 C ATOM 1238 C ASP A 994 -6.733 10.088 0.243 1.00 0.00 C ATOM 1239 O ASP A 994 -6.578 11.307 0.311 1.00 0.00 O ATOM 1240 CB ASP A 994 -6.209 8.668 2.202 1.00 0.00 C ATOM 1241 CG ASP A 994 -6.573 8.233 3.623 1.00 0.00 C ATOM 1242 OD1 ASP A 994 -7.719 7.766 3.798 1.00 0.00 O ATOM 1243 OD2 ASP A 994 -5.697 8.378 4.503 1.00 0.00 O ATOM 0 H ASP A 994 -8.124 7.376 1.269 1.00 0.00 H new ATOM 0 HA ASP A 994 -7.909 9.981 2.070 1.00 0.00 H new ATOM 0 HB2 ASP A 994 -5.856 7.797 1.651 1.00 0.00 H new ATOM 0 HB3 ASP A 994 -5.377 9.371 2.255 1.00 0.00 H new ATOM 1248 N LEU A 995 -6.399 9.346 -0.802 1.00 0.00 N ATOM 1249 CA LEU A 995 -5.804 9.945 -1.985 1.00 0.00 C ATOM 1250 C LEU A 995 -6.706 11.074 -2.488 1.00 0.00 C ATOM 1251 O LEU A 995 -6.287 12.229 -2.546 1.00 0.00 O ATOM 1252 CB LEU A 995 -5.514 8.874 -3.039 1.00 0.00 C ATOM 1253 CG LEU A 995 -4.041 8.506 -3.232 1.00 0.00 C ATOM 1254 CD1 LEU A 995 -3.390 9.388 -4.299 1.00 0.00 C ATOM 1255 CD2 LEU A 995 -3.284 8.559 -1.904 1.00 0.00 C ATOM 0 H LEU A 995 -6.529 8.336 -0.855 1.00 0.00 H new ATOM 0 HA LEU A 995 -4.839 10.391 -1.742 1.00 0.00 H new ATOM 0 HB2 LEU A 995 -6.062 7.971 -2.771 1.00 0.00 H new ATOM 0 HB3 LEU A 995 -5.911 9.216 -3.995 1.00 0.00 H new ATOM 0 HG LEU A 995 -3.990 7.478 -3.590 1.00 0.00 H new ATOM 0 HD11 LEU A 995 -2.344 9.105 -4.416 1.00 0.00 H new ATOM 0 HD12 LEU A 995 -3.910 9.255 -5.248 1.00 0.00 H new ATOM 0 HD13 LEU A 995 -3.452 10.433 -3.995 1.00 0.00 H new ATOM 0 HD21 LEU A 995 -2.240 8.293 -2.069 1.00 0.00 H new ATOM 0 HD22 LEU A 995 -3.341 9.567 -1.493 1.00 0.00 H new ATOM 0 HD23 LEU A 995 -3.731 7.855 -1.202 1.00 0.00 H new ATOM 1267 N ALA A 996 -7.927 10.701 -2.840 1.00 0.00 N ATOM 1268 CA ALA A 996 -8.892 11.668 -3.336 1.00 0.00 C ATOM 1269 C ALA A 996 -8.755 12.970 -2.545 1.00 0.00 C ATOM 1270 O ALA A 996 -8.592 14.041 -3.129 1.00 0.00 O ATOM 1271 CB ALA A 996 -10.300 11.077 -3.247 1.00 0.00 C ATOM 0 H ALA A 996 -8.271 9.742 -2.792 1.00 0.00 H new ATOM 0 HA ALA A 996 -8.701 11.897 -4.384 1.00 0.00 H new ATOM 0 HB1 ALA A 996 -11.023 11.803 -3.619 1.00 0.00 H new ATOM 0 HB2 ALA A 996 -10.353 10.170 -3.850 1.00 0.00 H new ATOM 0 HB3 ALA A 996 -10.529 10.836 -2.209 1.00 0.00 H new ATOM 1277 N GLU A 997 -8.826 12.836 -1.229 1.00 0.00 N ATOM 1278 CA GLU A 997 -8.712 13.989 -0.352 1.00 0.00 C ATOM 1279 C GLU A 997 -7.384 14.710 -0.594 1.00 0.00 C ATOM 1280 O GLU A 997 -7.345 15.937 -0.673 1.00 0.00 O ATOM 1281 CB GLU A 997 -8.854 13.579 1.115 1.00 0.00 C ATOM 1282 CG GLU A 997 -9.201 14.784 1.990 1.00 0.00 C ATOM 1283 CD GLU A 997 -10.499 14.543 2.765 1.00 0.00 C ATOM 1284 OE1 GLU A 997 -10.457 13.713 3.698 1.00 0.00 O ATOM 1285 OE2 GLU A 997 -11.503 15.195 2.406 1.00 0.00 O ATOM 0 H GLU A 997 -8.961 11.946 -0.749 1.00 0.00 H new ATOM 0 HA GLU A 997 -9.525 14.678 -0.582 1.00 0.00 H new ATOM 0 HB2 GLU A 997 -9.631 12.820 1.211 1.00 0.00 H new ATOM 0 HB3 GLU A 997 -7.924 13.129 1.462 1.00 0.00 H new ATOM 0 HG2 GLU A 997 -8.387 14.977 2.688 1.00 0.00 H new ATOM 0 HG3 GLU A 997 -9.305 15.673 1.367 1.00 0.00 H new ATOM 1292 N LEU A 998 -6.328 13.917 -0.704 1.00 0.00 N ATOM 1293 CA LEU A 998 -5.002 14.465 -0.934 1.00 0.00 C ATOM 1294 C LEU A 998 -4.974 15.168 -2.293 1.00 0.00 C ATOM 1295 O LEU A 998 -4.435 16.266 -2.416 1.00 0.00 O ATOM 1296 CB LEU A 998 -3.939 13.375 -0.784 1.00 0.00 C ATOM 1297 CG LEU A 998 -2.525 13.858 -0.453 1.00 0.00 C ATOM 1298 CD1 LEU A 998 -1.840 12.912 0.535 1.00 0.00 C ATOM 1299 CD2 LEU A 998 -1.700 14.052 -1.727 1.00 0.00 C ATOM 0 H LEU A 998 -6.364 12.900 -0.638 1.00 0.00 H new ATOM 0 HA LEU A 998 -4.764 15.216 -0.181 1.00 0.00 H new ATOM 0 HB2 LEU A 998 -4.260 12.688 -0.001 1.00 0.00 H new ATOM 0 HB3 LEU A 998 -3.899 12.804 -1.712 1.00 0.00 H new ATOM 0 HG LEU A 998 -2.601 14.831 0.033 1.00 0.00 H new ATOM 0 HD11 LEU A 998 -0.837 13.278 0.753 1.00 0.00 H new ATOM 0 HD12 LEU A 998 -2.419 12.868 1.457 1.00 0.00 H new ATOM 0 HD13 LEU A 998 -1.775 11.915 0.099 1.00 0.00 H new ATOM 0 HD21 LEU A 998 -0.700 14.395 -1.464 1.00 0.00 H new ATOM 0 HD22 LEU A 998 -1.629 13.105 -2.262 1.00 0.00 H new ATOM 0 HD23 LEU A 998 -2.183 14.794 -2.364 1.00 0.00 H new ATOM 1311 N ILE A 999 -5.562 14.505 -3.278 1.00 0.00 N ATOM 1312 CA ILE A 999 -5.612 15.053 -4.623 1.00 0.00 C ATOM 1313 C ILE A 999 -6.296 16.421 -4.587 1.00 0.00 C ATOM 1314 O ILE A 999 -5.791 17.387 -5.156 1.00 0.00 O ATOM 1315 CB ILE A 999 -6.273 14.060 -5.582 1.00 0.00 C ATOM 1316 CG1 ILE A 999 -5.525 12.725 -5.590 1.00 0.00 C ATOM 1317 CG2 ILE A 999 -6.398 14.655 -6.986 1.00 0.00 C ATOM 1318 CD1 ILE A 999 -4.224 12.830 -6.388 1.00 0.00 C ATOM 0 H ILE A 999 -6.008 13.594 -3.172 1.00 0.00 H new ATOM 0 HA ILE A 999 -4.604 15.210 -5.008 1.00 0.00 H new ATOM 0 HB ILE A 999 -7.283 13.861 -5.225 1.00 0.00 H new ATOM 0 HG12 ILE A 999 -5.305 12.422 -4.567 1.00 0.00 H new ATOM 0 HG13 ILE A 999 -6.159 11.951 -6.022 1.00 0.00 H new ATOM 0 HG21 ILE A 999 -6.871 13.929 -7.648 1.00 0.00 H new ATOM 0 HG22 ILE A 999 -7.006 15.559 -6.945 1.00 0.00 H new ATOM 0 HG23 ILE A 999 -5.407 14.901 -7.366 1.00 0.00 H new ATOM 0 HD11 ILE A 999 -3.712 11.868 -6.378 1.00 0.00 H new ATOM 0 HD12 ILE A 999 -4.450 13.110 -7.417 1.00 0.00 H new ATOM 0 HD13 ILE A 999 -3.582 13.587 -5.939 1.00 0.00 H new ATOM 1330 N ASN A1000 -7.436 16.460 -3.912 1.00 0.00 N ATOM 1331 CA ASN A1000 -8.194 17.693 -3.794 1.00 0.00 C ATOM 1332 C ASN A1000 -7.386 18.709 -2.985 1.00 0.00 C ATOM 1333 O ASN A1000 -7.270 19.870 -3.376 1.00 0.00 O ATOM 1334 CB ASN A1000 -9.520 17.458 -3.068 1.00 0.00 C ATOM 1335 CG ASN A1000 -10.621 18.360 -3.629 1.00 0.00 C ATOM 1336 OD1 ASN A1000 -10.623 19.566 -3.447 1.00 0.00 O ATOM 1337 ND2 ASN A1000 -11.553 17.710 -4.320 1.00 0.00 N ATOM 0 H ASN A1000 -7.853 15.657 -3.441 1.00 0.00 H new ATOM 0 HA ASN A1000 -8.394 18.062 -4.800 1.00 0.00 H new ATOM 0 HB2 ASN A1000 -9.814 16.413 -3.170 1.00 0.00 H new ATOM 0 HB3 ASN A1000 -9.394 17.651 -2.003 1.00 0.00 H new ATOM 0 HD21 ASN A1000 -12.330 18.223 -4.736 1.00 0.00 H new ATOM 0 HD22 ASN A1000 -11.491 16.698 -4.434 1.00 0.00 H new ATOM 1344 N LYS A1001 -6.846 18.235 -1.871 1.00 0.00 N ATOM 1345 CA LYS A1001 -6.052 19.088 -1.003 1.00 0.00 C ATOM 1346 C LYS A1001 -5.071 19.899 -1.851 1.00 0.00 C ATOM 1347 O LYS A1001 -4.915 21.102 -1.646 1.00 0.00 O ATOM 1348 CB LYS A1001 -5.378 18.258 0.092 1.00 0.00 C ATOM 1349 CG LYS A1001 -6.372 17.900 1.199 1.00 0.00 C ATOM 1350 CD LYS A1001 -6.243 18.860 2.383 1.00 0.00 C ATOM 1351 CE LYS A1001 -7.582 19.024 3.105 1.00 0.00 C ATOM 1352 NZ LYS A1001 -8.294 20.223 2.609 1.00 0.00 N ATOM 0 H LYS A1001 -6.943 17.272 -1.550 1.00 0.00 H new ATOM 0 HA LYS A1001 -6.690 19.802 -0.483 1.00 0.00 H new ATOM 0 HB2 LYS A1001 -4.965 17.346 -0.340 1.00 0.00 H new ATOM 0 HB3 LYS A1001 -4.543 18.817 0.515 1.00 0.00 H new ATOM 0 HG2 LYS A1001 -7.388 17.936 0.806 1.00 0.00 H new ATOM 0 HG3 LYS A1001 -6.196 16.878 1.534 1.00 0.00 H new ATOM 0 HD2 LYS A1001 -5.494 18.485 3.080 1.00 0.00 H new ATOM 0 HD3 LYS A1001 -5.894 19.831 2.032 1.00 0.00 H new ATOM 0 HE2 LYS A1001 -8.197 18.138 2.949 1.00 0.00 H new ATOM 0 HE3 LYS A1001 -7.415 19.111 4.179 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 -9.142 20.388 3.188 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 -7.666 21.050 2.671 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 -8.575 20.075 1.619 1.00 0.00 H new ATOM 1366 N MET A1002 -4.434 19.208 -2.786 1.00 0.00 N ATOM 1367 CA MET A1002 -3.473 19.850 -3.666 1.00 0.00 C ATOM 1368 C MET A1002 -4.152 20.897 -4.551 1.00 0.00 C ATOM 1369 O MET A1002 -3.629 21.995 -4.734 1.00 0.00 O ATOM 1370 CB MET A1002 -2.803 18.793 -4.548 1.00 0.00 C ATOM 1371 CG MET A1002 -1.844 19.442 -5.548 1.00 0.00 C ATOM 1372 SD MET A1002 -1.963 18.620 -7.128 1.00 0.00 S ATOM 1373 CE MET A1002 -3.432 19.400 -7.774 1.00 0.00 C ATOM 0 H MET A1002 -4.565 18.210 -2.953 1.00 0.00 H new ATOM 0 HA MET A1002 -2.725 20.352 -3.052 1.00 0.00 H new ATOM 0 HB2 MET A1002 -2.258 18.085 -3.923 1.00 0.00 H new ATOM 0 HB3 MET A1002 -3.564 18.226 -5.084 1.00 0.00 H new ATOM 0 HG2 MET A1002 -2.083 20.500 -5.660 1.00 0.00 H new ATOM 0 HG3 MET A1002 -0.822 19.384 -5.174 1.00 0.00 H new ATOM 0 HE1 MET A1002 -3.592 19.079 -8.803 1.00 0.00 H new ATOM 0 HE2 MET A1002 -4.292 19.115 -7.168 1.00 0.00 H new ATOM 0 HE3 MET A1002 -3.311 20.483 -7.746 1.00 0.00 H new ATOM 1383 N LYS A1003 -5.309 20.520 -5.077 1.00 0.00 N ATOM 1384 CA LYS A1003 -6.066 21.413 -5.938 1.00 0.00 C ATOM 1385 C LYS A1003 -6.336 22.723 -5.195 1.00 0.00 C ATOM 1386 O LYS A1003 -6.487 23.774 -5.817 1.00 0.00 O ATOM 1387 CB LYS A1003 -7.332 20.721 -6.446 1.00 0.00 C ATOM 1388 CG LYS A1003 -7.173 20.290 -7.906 1.00 0.00 C ATOM 1389 CD LYS A1003 -8.524 19.911 -8.516 1.00 0.00 C ATOM 1390 CE LYS A1003 -9.366 21.156 -8.799 1.00 0.00 C ATOM 1391 NZ LYS A1003 -10.161 20.975 -10.034 1.00 0.00 N ATOM 0 H LYS A1003 -5.740 19.608 -4.923 1.00 0.00 H new ATOM 0 HA LYS A1003 -5.489 21.664 -6.828 1.00 0.00 H new ATOM 0 HB2 LYS A1003 -7.548 19.850 -5.827 1.00 0.00 H new ATOM 0 HB3 LYS A1003 -8.182 21.397 -6.353 1.00 0.00 H new ATOM 0 HG2 LYS A1003 -6.725 21.100 -8.481 1.00 0.00 H new ATOM 0 HG3 LYS A1003 -6.492 19.441 -7.966 1.00 0.00 H new ATOM 0 HD2 LYS A1003 -8.367 19.356 -9.441 1.00 0.00 H new ATOM 0 HD3 LYS A1003 -9.062 19.251 -7.836 1.00 0.00 H new ATOM 0 HE2 LYS A1003 -10.030 21.352 -7.957 1.00 0.00 H new ATOM 0 HE3 LYS A1003 -8.717 22.026 -8.902 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 -10.727 21.830 -10.211 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 -9.522 20.810 -10.837 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 -10.794 20.158 -9.923 1.00 0.00 H new ATOM 1405 N LEU A1004 -6.391 22.618 -3.875 1.00 0.00 N ATOM 1406 CA LEU A1004 -6.641 23.781 -3.041 1.00 0.00 C ATOM 1407 C LEU A1004 -5.335 24.555 -2.849 1.00 0.00 C ATOM 1408 O LEU A1004 -5.249 25.731 -3.199 1.00 0.00 O ATOM 1409 CB LEU A1004 -7.309 23.365 -1.729 1.00 0.00 C ATOM 1410 CG LEU A1004 -8.543 22.471 -1.859 1.00 0.00 C ATOM 1411 CD1 LEU A1004 -9.140 22.157 -0.485 1.00 0.00 C ATOM 1412 CD2 LEU A1004 -9.574 23.092 -2.803 1.00 0.00 C ATOM 0 H LEU A1004 -6.267 21.745 -3.363 1.00 0.00 H new ATOM 0 HA LEU A1004 -7.343 24.457 -3.529 1.00 0.00 H new ATOM 0 HB2 LEU A1004 -6.571 22.845 -1.118 1.00 0.00 H new ATOM 0 HB3 LEU A1004 -7.594 24.267 -1.187 1.00 0.00 H new ATOM 0 HG LEU A1004 -8.233 21.524 -2.300 1.00 0.00 H new ATOM 0 HD11 LEU A1004 -10.016 21.520 -0.606 1.00 0.00 H new ATOM 0 HD12 LEU A1004 -8.398 21.642 0.125 1.00 0.00 H new ATOM 0 HD13 LEU A1004 -9.432 23.086 0.006 1.00 0.00 H new ATOM 0 HD21 LEU A1004 -10.441 22.436 -2.877 1.00 0.00 H new ATOM 0 HD22 LEU A1004 -9.885 24.062 -2.415 1.00 0.00 H new ATOM 0 HD23 LEU A1004 -9.131 23.222 -3.791 1.00 0.00 H new ATOM 1424 N ALA A1005 -4.351 23.864 -2.292 1.00 0.00 N ATOM 1425 CA ALA A1005 -3.054 24.472 -2.048 1.00 0.00 C ATOM 1426 C ALA A1005 -2.673 25.347 -3.244 1.00 0.00 C ATOM 1427 O ALA A1005 -2.184 26.462 -3.072 1.00 0.00 O ATOM 1428 CB ALA A1005 -2.021 23.378 -1.774 1.00 0.00 C ATOM 0 H ALA A1005 -4.426 22.889 -2.003 1.00 0.00 H new ATOM 0 HA ALA A1005 -3.090 25.114 -1.168 1.00 0.00 H new ATOM 0 HB1 ALA A1005 -1.048 23.834 -1.591 1.00 0.00 H new ATOM 0 HB2 ALA A1005 -2.323 22.803 -0.898 1.00 0.00 H new ATOM 0 HB3 ALA A1005 -1.955 22.716 -2.637 1.00 0.00 H new ATOM 1434 N GLN A1006 -2.912 24.808 -4.431 1.00 0.00 N ATOM 1435 CA GLN A1006 -2.600 25.525 -5.655 1.00 0.00 C ATOM 1436 C GLN A1006 -3.001 26.996 -5.526 1.00 0.00 C ATOM 1437 O GLN A1006 -2.252 27.885 -5.926 1.00 0.00 O ATOM 1438 CB GLN A1006 -3.281 24.875 -6.861 1.00 0.00 C ATOM 1439 CG GLN A1006 -2.256 24.488 -7.928 1.00 0.00 C ATOM 1440 CD GLN A1006 -1.425 23.283 -7.480 1.00 0.00 C ATOM 1441 OE1 GLN A1006 -1.876 22.429 -6.735 1.00 0.00 O ATOM 1442 NE2 GLN A1006 -0.191 23.264 -7.974 1.00 0.00 N ATOM 0 H GLN A1006 -3.318 23.883 -4.570 1.00 0.00 H new ATOM 0 HA GLN A1006 -1.523 25.475 -5.817 1.00 0.00 H new ATOM 0 HB2 GLN A1006 -3.829 23.989 -6.540 1.00 0.00 H new ATOM 0 HB3 GLN A1006 -4.011 25.564 -7.286 1.00 0.00 H new ATOM 0 HG2 GLN A1006 -2.768 24.254 -8.861 1.00 0.00 H new ATOM 0 HG3 GLN A1006 -1.598 25.333 -8.129 1.00 0.00 H new ATOM 0 HE21 GLN A1006 0.122 24.012 -8.593 1.00 0.00 H new ATOM 0 HE22 GLN A1006 0.443 22.502 -7.734 1.00 0.00 H new ATOM 1451 N GLN A1007 -4.183 27.206 -4.965 1.00 0.00 N ATOM 1452 CA GLN A1007 -4.693 28.554 -4.777 1.00 0.00 C ATOM 1453 C GLN A1007 -4.453 29.017 -3.339 1.00 0.00 C ATOM 1454 O GLN A1007 -4.206 30.197 -3.096 1.00 0.00 O ATOM 1455 CB GLN A1007 -6.177 28.633 -5.139 1.00 0.00 C ATOM 1456 CG GLN A1007 -6.518 29.989 -5.761 1.00 0.00 C ATOM 1457 CD GLN A1007 -7.750 30.605 -5.093 1.00 0.00 C ATOM 1458 OE1 GLN A1007 -7.658 31.370 -4.148 1.00 0.00 O ATOM 1459 NE2 GLN A1007 -8.904 30.228 -5.636 1.00 0.00 N ATOM 0 H GLN A1007 -4.802 26.466 -4.635 1.00 0.00 H new ATOM 0 HA GLN A1007 -4.153 29.223 -5.447 1.00 0.00 H new ATOM 0 HB2 GLN A1007 -6.428 27.835 -5.838 1.00 0.00 H new ATOM 0 HB3 GLN A1007 -6.782 28.476 -4.246 1.00 0.00 H new ATOM 0 HG2 GLN A1007 -5.668 30.664 -5.658 1.00 0.00 H new ATOM 0 HG3 GLN A1007 -6.701 29.868 -6.829 1.00 0.00 H new ATOM 0 HE21 GLN A1007 -8.909 29.584 -6.427 1.00 0.00 H new ATOM 0 HE22 GLN A1007 -9.784 30.583 -5.262 1.00 0.00 H new ATOM 1468 N TYR A1008 -4.534 28.063 -2.423 1.00 0.00 N ATOM 1469 CA TYR A1008 -4.329 28.358 -1.015 1.00 0.00 C ATOM 1470 C TYR A1008 -2.848 28.263 -0.645 1.00 0.00 C ATOM 1471 O TYR A1008 -2.502 27.761 0.424 1.00 0.00 O ATOM 1472 CB TYR A1008 -5.105 27.290 -0.242 1.00 0.00 C ATOM 1473 CG TYR A1008 -6.606 27.565 -0.136 1.00 0.00 C ATOM 1474 CD1 TYR A1008 -7.074 28.499 0.766 1.00 0.00 C ATOM 1475 CD2 TYR A1008 -7.492 26.881 -0.943 1.00 0.00 C ATOM 1476 CE1 TYR A1008 -8.487 28.759 0.865 1.00 0.00 C ATOM 1477 CE2 TYR A1008 -8.905 27.140 -0.843 1.00 0.00 C ATOM 1478 CZ TYR A1008 -9.333 28.066 0.056 1.00 0.00 C ATOM 1479 OH TYR A1008 -10.667 28.312 0.150 1.00 0.00 O ATOM 0 H TYR A1008 -4.739 27.085 -2.628 1.00 0.00 H new ATOM 0 HA TYR A1008 -4.665 29.369 -0.782 1.00 0.00 H new ATOM 0 HB2 TYR A1008 -4.956 26.325 -0.727 1.00 0.00 H new ATOM 0 HB3 TYR A1008 -4.689 27.209 0.762 1.00 0.00 H new ATOM 0 HD1 TYR A1008 -6.381 29.035 1.397 1.00 0.00 H new ATOM 0 HD2 TYR A1008 -7.126 26.151 -1.650 1.00 0.00 H new ATOM 0 HE1 TYR A1008 -8.866 29.488 1.566 1.00 0.00 H new ATOM 0 HE2 TYR A1008 -9.609 26.611 -1.468 1.00 0.00 H new ATOM 0 HH TYR A1008 -11.150 27.746 -0.488 1.00 0.00 H new ATOM 1489 N VAL A1009 -2.012 28.753 -1.549 1.00 0.00 N ATOM 1490 CA VAL A1009 -0.576 28.729 -1.331 1.00 0.00 C ATOM 1491 C VAL A1009 -0.067 30.162 -1.157 1.00 0.00 C ATOM 1492 O VAL A1009 0.713 30.442 -0.248 1.00 0.00 O ATOM 1493 CB VAL A1009 0.115 27.984 -2.474 1.00 0.00 C ATOM 1494 CG1 VAL A1009 -0.358 28.504 -3.833 1.00 0.00 C ATOM 1495 CG2 VAL A1009 1.637 28.079 -2.351 1.00 0.00 C ATOM 0 H VAL A1009 -2.302 29.169 -2.434 1.00 0.00 H new ATOM 0 HA VAL A1009 -0.338 28.186 -0.417 1.00 0.00 H new ATOM 0 HB VAL A1009 -0.162 26.932 -2.402 1.00 0.00 H new ATOM 0 HG11 VAL A1009 0.149 27.957 -4.628 1.00 0.00 H new ATOM 0 HG12 VAL A1009 -1.435 28.360 -3.923 1.00 0.00 H new ATOM 0 HG13 VAL A1009 -0.126 29.566 -3.917 1.00 0.00 H new ATOM 0 HG21 VAL A1009 2.103 27.541 -3.176 1.00 0.00 H new ATOM 0 HG22 VAL A1009 1.940 29.126 -2.383 1.00 0.00 H new ATOM 0 HG23 VAL A1009 1.954 27.638 -1.406 1.00 0.00 H new ATOM 1505 N MET A1010 -0.529 31.031 -2.045 1.00 0.00 N ATOM 1506 CA MET A1010 -0.130 32.428 -2.001 1.00 0.00 C ATOM 1507 C MET A1010 -1.040 33.229 -1.068 1.00 0.00 C ATOM 1508 O MET A1010 -1.667 34.199 -1.490 1.00 0.00 O ATOM 1509 CB MET A1010 -0.193 33.021 -3.410 1.00 0.00 C ATOM 1510 CG MET A1010 0.869 34.106 -3.597 1.00 0.00 C ATOM 1511 SD MET A1010 0.293 35.649 -2.907 1.00 0.00 S ATOM 1512 CE MET A1010 0.696 35.389 -1.188 1.00 0.00 C ATOM 0 H MET A1010 -1.175 30.795 -2.798 1.00 0.00 H new ATOM 0 HA MET A1010 0.889 32.484 -1.619 1.00 0.00 H new ATOM 0 HB2 MET A1010 -0.045 32.232 -4.147 1.00 0.00 H new ATOM 0 HB3 MET A1010 -1.183 33.442 -3.587 1.00 0.00 H new ATOM 0 HG2 MET A1010 1.798 33.805 -3.112 1.00 0.00 H new ATOM 0 HG3 MET A1010 1.090 34.232 -4.657 1.00 0.00 H new ATOM 0 HE1 MET A1010 -0.213 35.440 -0.589 1.00 0.00 H new ATOM 0 HE2 MET A1010 1.156 34.408 -1.066 1.00 0.00 H new ATOM 0 HE3 MET A1010 1.392 36.160 -0.857 1.00 0.00 H new ATOM 1522 N THR A1011 -1.084 32.793 0.182 1.00 0.00 N ATOM 1523 CA THR A1011 -1.907 33.457 1.178 1.00 0.00 C ATOM 1524 C THR A1011 -1.353 33.205 2.582 1.00 0.00 C ATOM 1525 O THR A1011 -2.072 33.341 3.570 1.00 0.00 O ATOM 1526 CB THR A1011 -3.348 32.977 0.998 1.00 0.00 C ATOM 1527 OG1 THR A1011 -3.213 31.615 0.599 1.00 0.00 O ATOM 1528 CG2 THR A1011 -4.044 33.645 -0.190 1.00 0.00 C ATOM 0 H THR A1011 -0.563 31.987 0.528 1.00 0.00 H new ATOM 0 HA THR A1011 -1.891 34.539 1.046 1.00 0.00 H new ATOM 0 HB THR A1011 -3.913 33.176 1.909 1.00 0.00 H new ATOM 0 HG1 THR A1011 -4.084 31.271 0.309 1.00 0.00 H new ATOM 0 HG21 THR A1011 -5.064 33.269 -0.273 1.00 0.00 H new ATOM 0 HG22 THR A1011 -4.066 34.724 -0.039 1.00 0.00 H new ATOM 0 HG23 THR A1011 -3.498 33.418 -1.106 1.00 0.00 H new ATOM 1536 N SER A1012 -0.080 32.841 2.625 1.00 0.00 N ATOM 1537 CA SER A1012 0.578 32.568 3.891 1.00 0.00 C ATOM 1538 C SER A1012 0.090 31.233 4.457 1.00 0.00 C ATOM 1539 O SER A1012 0.893 30.351 4.758 1.00 0.00 O ATOM 1540 CB SER A1012 0.328 33.694 4.896 1.00 0.00 C ATOM 1541 OG SER A1012 -0.005 34.920 4.251 1.00 0.00 O ATOM 0 H SER A1012 0.513 32.729 1.803 1.00 0.00 H new ATOM 0 HA SER A1012 1.652 32.509 3.713 1.00 0.00 H new ATOM 0 HB2 SER A1012 -0.480 33.407 5.569 1.00 0.00 H new ATOM 0 HB3 SER A1012 1.218 33.837 5.509 1.00 0.00 H new ATOM 0 HG SER A1012 -0.159 35.614 4.926 1.00 0.00 H new ATOM 1547 N LEU A1013 -1.225 31.127 4.586 1.00 0.00 N ATOM 1548 CA LEU A1013 -1.829 29.915 5.111 1.00 0.00 C ATOM 1549 C LEU A1013 -1.072 28.698 4.575 1.00 0.00 C ATOM 1550 O LEU A1013 -1.053 27.645 5.210 1.00 0.00 O ATOM 1551 CB LEU A1013 -3.329 29.888 4.806 1.00 0.00 C ATOM 1552 CG LEU A1013 -3.824 30.916 3.787 1.00 0.00 C ATOM 1553 CD1 LEU A1013 -4.917 30.322 2.896 1.00 0.00 C ATOM 1554 CD2 LEU A1013 -4.284 32.199 4.481 1.00 0.00 C ATOM 0 H LEU A1013 -1.888 31.861 4.336 1.00 0.00 H new ATOM 0 HA LEU A1013 -1.746 29.889 6.198 1.00 0.00 H new ATOM 0 HB2 LEU A1013 -3.588 28.893 4.444 1.00 0.00 H new ATOM 0 HB3 LEU A1013 -3.872 30.040 5.739 1.00 0.00 H new ATOM 0 HG LEU A1013 -2.990 31.183 3.138 1.00 0.00 H new ATOM 0 HD11 LEU A1013 -5.251 31.073 2.181 1.00 0.00 H new ATOM 0 HD12 LEU A1013 -4.520 29.461 2.359 1.00 0.00 H new ATOM 0 HD13 LEU A1013 -5.759 30.008 3.513 1.00 0.00 H new ATOM 0 HD21 LEU A1013 -4.631 32.913 3.734 1.00 0.00 H new ATOM 0 HD22 LEU A1013 -5.098 31.969 5.168 1.00 0.00 H new ATOM 0 HD23 LEU A1013 -3.451 32.631 5.036 1.00 0.00 H new ATOM 1566 N GLN A1014 -0.465 28.884 3.412 1.00 0.00 N ATOM 1567 CA GLN A1014 0.292 27.815 2.784 1.00 0.00 C ATOM 1568 C GLN A1014 0.903 26.901 3.848 1.00 0.00 C ATOM 1569 O GLN A1014 0.492 25.751 3.994 1.00 0.00 O ATOM 1570 CB GLN A1014 1.372 28.379 1.859 1.00 0.00 C ATOM 1571 CG GLN A1014 2.462 27.339 1.591 1.00 0.00 C ATOM 1572 CD GLN A1014 3.717 27.635 2.416 1.00 0.00 C ATOM 1573 OE1 GLN A1014 4.162 26.837 3.225 1.00 0.00 O ATOM 1574 NE2 GLN A1014 4.260 28.823 2.167 1.00 0.00 N ATOM 0 H GLN A1014 -0.482 29.759 2.888 1.00 0.00 H new ATOM 0 HA GLN A1014 -0.390 27.223 2.173 1.00 0.00 H new ATOM 0 HB2 GLN A1014 0.922 28.691 0.916 1.00 0.00 H new ATOM 0 HB3 GLN A1014 1.815 29.267 2.310 1.00 0.00 H new ATOM 0 HG2 GLN A1014 2.088 26.344 1.835 1.00 0.00 H new ATOM 0 HG3 GLN A1014 2.712 27.334 0.530 1.00 0.00 H new ATOM 0 HE21 GLN A1014 3.836 29.443 1.477 1.00 0.00 H new ATOM 0 HE22 GLN A1014 5.100 29.114 2.666 1.00 0.00 H new ATOM 1583 N GLN A1015 1.875 27.447 4.563 1.00 0.00 N ATOM 1584 CA GLN A1015 2.547 26.695 5.609 1.00 0.00 C ATOM 1585 C GLN A1015 1.551 25.787 6.333 1.00 0.00 C ATOM 1586 O GLN A1015 1.810 24.599 6.518 1.00 0.00 O ATOM 1587 CB GLN A1015 3.250 27.632 6.593 1.00 0.00 C ATOM 1588 CG GLN A1015 2.527 28.978 6.680 1.00 0.00 C ATOM 1589 CD GLN A1015 2.639 29.571 8.086 1.00 0.00 C ATOM 1590 OE1 GLN A1015 2.163 29.015 9.062 1.00 0.00 O ATOM 1591 NE2 GLN A1015 3.293 30.728 8.135 1.00 0.00 N ATOM 0 H GLN A1015 2.213 28.401 4.439 1.00 0.00 H new ATOM 0 HA GLN A1015 3.310 26.069 5.146 1.00 0.00 H new ATOM 0 HB2 GLN A1015 3.285 27.169 7.579 1.00 0.00 H new ATOM 0 HB3 GLN A1015 4.282 27.789 6.278 1.00 0.00 H new ATOM 0 HG2 GLN A1015 2.953 29.671 5.954 1.00 0.00 H new ATOM 0 HG3 GLN A1015 1.477 28.848 6.419 1.00 0.00 H new ATOM 0 HE21 GLN A1015 3.667 31.139 7.280 1.00 0.00 H new ATOM 0 HE22 GLN A1015 3.421 31.204 9.028 1.00 0.00 H new ATOM 1600 N GLU A1016 0.433 26.381 6.724 1.00 0.00 N ATOM 1601 CA GLU A1016 -0.603 25.640 7.423 1.00 0.00 C ATOM 1602 C GLU A1016 -1.207 24.576 6.505 1.00 0.00 C ATOM 1603 O GLU A1016 -1.164 23.386 6.814 1.00 0.00 O ATOM 1604 CB GLU A1016 -1.684 26.581 7.958 1.00 0.00 C ATOM 1605 CG GLU A1016 -2.936 25.803 8.365 1.00 0.00 C ATOM 1606 CD GLU A1016 -2.565 24.505 9.086 1.00 0.00 C ATOM 1607 OE1 GLU A1016 -1.828 24.605 10.090 1.00 0.00 O ATOM 1608 OE2 GLU A1016 -3.027 23.443 8.616 1.00 0.00 O ATOM 0 H GLU A1016 0.222 27.367 6.570 1.00 0.00 H new ATOM 0 HA GLU A1016 -0.149 25.138 8.278 1.00 0.00 H new ATOM 0 HB2 GLU A1016 -1.299 27.132 8.816 1.00 0.00 H new ATOM 0 HB3 GLU A1016 -1.941 27.317 7.196 1.00 0.00 H new ATOM 0 HG2 GLU A1016 -3.556 26.420 9.015 1.00 0.00 H new ATOM 0 HG3 GLU A1016 -3.530 25.575 7.480 1.00 0.00 H new ATOM 1615 N TYR A1017 -1.756 25.043 5.393 1.00 0.00 N ATOM 1616 CA TYR A1017 -2.369 24.147 4.427 1.00 0.00 C ATOM 1617 C TYR A1017 -1.475 22.934 4.161 1.00 0.00 C ATOM 1618 O TYR A1017 -1.968 21.821 3.985 1.00 0.00 O ATOM 1619 CB TYR A1017 -2.513 24.954 3.135 1.00 0.00 C ATOM 1620 CG TYR A1017 -3.960 25.278 2.762 1.00 0.00 C ATOM 1621 CD1 TYR A1017 -4.602 26.348 3.351 1.00 0.00 C ATOM 1622 CD2 TYR A1017 -4.625 24.500 1.836 1.00 0.00 C ATOM 1623 CE1 TYR A1017 -5.964 26.654 3.000 1.00 0.00 C ATOM 1624 CE2 TYR A1017 -5.988 24.806 1.484 1.00 0.00 C ATOM 1625 CZ TYR A1017 -6.590 25.867 2.084 1.00 0.00 C ATOM 1626 OH TYR A1017 -7.877 26.156 1.752 1.00 0.00 O ATOM 0 H TYR A1017 -1.789 26.030 5.140 1.00 0.00 H new ATOM 0 HA TYR A1017 -3.326 23.779 4.798 1.00 0.00 H new ATOM 0 HB2 TYR A1017 -1.958 25.886 3.237 1.00 0.00 H new ATOM 0 HB3 TYR A1017 -2.054 24.397 2.318 1.00 0.00 H new ATOM 0 HD1 TYR A1017 -4.082 26.957 4.076 1.00 0.00 H new ATOM 0 HD2 TYR A1017 -4.123 23.662 1.375 1.00 0.00 H new ATOM 0 HE1 TYR A1017 -6.477 27.489 3.453 1.00 0.00 H new ATOM 0 HE2 TYR A1017 -6.519 24.206 0.760 1.00 0.00 H new ATOM 0 HH TYR A1017 -7.888 26.823 1.034 1.00 0.00 H new ATOM 1636 N LYS A1018 -0.175 23.191 4.139 1.00 0.00 N ATOM 1637 CA LYS A1018 0.792 22.134 3.896 1.00 0.00 C ATOM 1638 C LYS A1018 0.651 21.061 4.978 1.00 0.00 C ATOM 1639 O LYS A1018 0.636 19.869 4.676 1.00 0.00 O ATOM 1640 CB LYS A1018 2.204 22.715 3.787 1.00 0.00 C ATOM 1641 CG LYS A1018 2.713 22.652 2.346 1.00 0.00 C ATOM 1642 CD LYS A1018 2.634 24.025 1.676 1.00 0.00 C ATOM 1643 CE LYS A1018 3.162 23.966 0.241 1.00 0.00 C ATOM 1644 NZ LYS A1018 2.210 24.616 -0.688 1.00 0.00 N ATOM 0 H LYS A1018 0.231 24.115 4.285 1.00 0.00 H new ATOM 0 HA LYS A1018 0.596 21.650 2.939 1.00 0.00 H new ATOM 0 HB2 LYS A1018 2.203 23.749 4.131 1.00 0.00 H new ATOM 0 HB3 LYS A1018 2.880 22.162 4.440 1.00 0.00 H new ATOM 0 HG2 LYS A1018 3.744 22.297 2.336 1.00 0.00 H new ATOM 0 HG3 LYS A1018 2.122 21.932 1.779 1.00 0.00 H new ATOM 0 HD2 LYS A1018 1.601 24.373 1.673 1.00 0.00 H new ATOM 0 HD3 LYS A1018 3.213 24.748 2.251 1.00 0.00 H new ATOM 0 HE2 LYS A1018 4.131 24.461 0.183 1.00 0.00 H new ATOM 0 HE3 LYS A1018 3.316 22.928 -0.054 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 2.699 24.858 -1.573 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 1.425 23.965 -0.892 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 1.836 25.483 -0.252 1.00 0.00 H new ATOM 1658 N LYS A1019 0.550 21.523 6.215 1.00 0.00 N ATOM 1659 CA LYS A1019 0.410 20.618 7.343 1.00 0.00 C ATOM 1660 C LYS A1019 -0.747 19.653 7.076 1.00 0.00 C ATOM 1661 O LYS A1019 -0.650 18.464 7.375 1.00 0.00 O ATOM 1662 CB LYS A1019 0.267 21.405 8.647 1.00 0.00 C ATOM 1663 CG LYS A1019 1.516 22.245 8.921 1.00 0.00 C ATOM 1664 CD LYS A1019 2.738 21.353 9.148 1.00 0.00 C ATOM 1665 CE LYS A1019 3.859 21.698 8.166 1.00 0.00 C ATOM 1666 NZ LYS A1019 5.076 22.119 8.895 1.00 0.00 N ATOM 0 H LYS A1019 0.562 22.513 6.461 1.00 0.00 H new ATOM 0 HA LYS A1019 1.309 20.013 7.461 1.00 0.00 H new ATOM 0 HB2 LYS A1019 -0.607 22.054 8.590 1.00 0.00 H new ATOM 0 HB3 LYS A1019 0.099 20.716 9.475 1.00 0.00 H new ATOM 0 HG2 LYS A1019 1.701 22.914 8.080 1.00 0.00 H new ATOM 0 HG3 LYS A1019 1.352 22.872 9.797 1.00 0.00 H new ATOM 0 HD2 LYS A1019 3.096 21.474 10.171 1.00 0.00 H new ATOM 0 HD3 LYS A1019 2.456 20.307 9.030 1.00 0.00 H new ATOM 0 HE2 LYS A1019 4.083 20.833 7.542 1.00 0.00 H new ATOM 0 HE3 LYS A1019 3.533 22.496 7.499 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 5.827 22.349 8.213 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 4.863 22.958 9.472 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 5.395 21.346 9.513 1.00 0.00 H new ATOM 1680 N GLN A1020 -1.815 20.201 6.517 1.00 0.00 N ATOM 1681 CA GLN A1020 -2.990 19.404 6.207 1.00 0.00 C ATOM 1682 C GLN A1020 -2.601 18.195 5.354 1.00 0.00 C ATOM 1683 O GLN A1020 -2.843 17.053 5.742 1.00 0.00 O ATOM 1684 CB GLN A1020 -4.056 20.248 5.506 1.00 0.00 C ATOM 1685 CG GLN A1020 -4.470 21.439 6.373 1.00 0.00 C ATOM 1686 CD GLN A1020 -5.419 21.001 7.490 1.00 0.00 C ATOM 1687 OE1 GLN A1020 -5.979 19.917 7.474 1.00 0.00 O ATOM 1688 NE2 GLN A1020 -5.567 21.901 8.458 1.00 0.00 N ATOM 0 H GLN A1020 -1.892 21.188 6.270 1.00 0.00 H new ATOM 0 HA GLN A1020 -3.417 19.043 7.143 1.00 0.00 H new ATOM 0 HB2 GLN A1020 -3.672 20.605 4.551 1.00 0.00 H new ATOM 0 HB3 GLN A1020 -4.928 19.631 5.288 1.00 0.00 H new ATOM 0 HG2 GLN A1020 -3.584 21.904 6.805 1.00 0.00 H new ATOM 0 HG3 GLN A1020 -4.955 22.193 5.753 1.00 0.00 H new ATOM 0 HE21 GLN A1020 -5.068 22.789 8.409 1.00 0.00 H new ATOM 0 HE22 GLN A1020 -6.179 21.703 9.249 1.00 0.00 H new ATOM 1697 N MET A1021 -2.003 18.487 4.208 1.00 0.00 N ATOM 1698 CA MET A1021 -1.578 17.438 3.297 1.00 0.00 C ATOM 1699 C MET A1021 -0.735 16.389 4.024 1.00 0.00 C ATOM 1700 O MET A1021 -0.966 15.189 3.876 1.00 0.00 O ATOM 1701 CB MET A1021 -0.760 18.050 2.158 1.00 0.00 C ATOM 1702 CG MET A1021 -1.176 17.464 0.807 1.00 0.00 C ATOM 1703 SD MET A1021 0.264 16.886 -0.076 1.00 0.00 S ATOM 1704 CE MET A1021 0.784 15.568 1.009 1.00 0.00 C ATOM 0 H MET A1021 -1.803 19.435 3.890 1.00 0.00 H new ATOM 0 HA MET A1021 -2.466 16.950 2.896 1.00 0.00 H new ATOM 0 HB2 MET A1021 -0.897 19.131 2.147 1.00 0.00 H new ATOM 0 HB3 MET A1021 0.301 17.865 2.327 1.00 0.00 H new ATOM 0 HG2 MET A1021 -1.875 16.641 0.958 1.00 0.00 H new ATOM 0 HG3 MET A1021 -1.695 18.220 0.218 1.00 0.00 H new ATOM 0 HE1 MET A1021 1.167 14.738 0.415 1.00 0.00 H new ATOM 0 HE2 MET A1021 1.568 15.931 1.673 1.00 0.00 H new ATOM 0 HE3 MET A1021 -0.065 15.229 1.602 1.00 0.00 H new ATOM 1714 N LEU A1022 0.224 16.878 4.796 1.00 0.00 N ATOM 1715 CA LEU A1022 1.103 15.998 5.547 1.00 0.00 C ATOM 1716 C LEU A1022 0.259 15.026 6.374 1.00 0.00 C ATOM 1717 O LEU A1022 0.440 13.813 6.289 1.00 0.00 O ATOM 1718 CB LEU A1022 2.095 16.813 6.379 1.00 0.00 C ATOM 1719 CG LEU A1022 3.035 16.009 7.279 1.00 0.00 C ATOM 1720 CD1 LEU A1022 2.253 15.260 8.359 1.00 0.00 C ATOM 1721 CD2 LEU A1022 3.915 15.069 6.453 1.00 0.00 C ATOM 0 H LEU A1022 0.412 17.873 4.918 1.00 0.00 H new ATOM 0 HA LEU A1022 1.710 15.397 4.869 1.00 0.00 H new ATOM 0 HB2 LEU A1022 2.700 17.414 5.700 1.00 0.00 H new ATOM 0 HB3 LEU A1022 1.532 17.507 7.003 1.00 0.00 H new ATOM 0 HG LEU A1022 3.699 16.707 7.788 1.00 0.00 H new ATOM 0 HD11 LEU A1022 2.945 14.697 8.985 1.00 0.00 H new ATOM 0 HD12 LEU A1022 1.707 15.975 8.975 1.00 0.00 H new ATOM 0 HD13 LEU A1022 1.549 14.574 7.888 1.00 0.00 H new ATOM 0 HD21 LEU A1022 4.574 14.510 7.117 1.00 0.00 H new ATOM 0 HD22 LEU A1022 3.285 14.374 5.898 1.00 0.00 H new ATOM 0 HD23 LEU A1022 4.515 15.652 5.754 1.00 0.00 H new ATOM 1733 N THR A1023 -0.646 15.597 7.156 1.00 0.00 N ATOM 1734 CA THR A1023 -1.519 14.797 7.998 1.00 0.00 C ATOM 1735 C THR A1023 -1.967 13.536 7.256 1.00 0.00 C ATOM 1736 O THR A1023 -1.834 12.427 7.772 1.00 0.00 O ATOM 1737 CB THR A1023 -2.682 15.682 8.449 1.00 0.00 C ATOM 1738 OG1 THR A1023 -2.066 16.923 8.782 1.00 0.00 O ATOM 1739 CG2 THR A1023 -3.302 15.209 9.766 1.00 0.00 C ATOM 0 H THR A1023 -0.793 16.604 7.224 1.00 0.00 H new ATOM 0 HA THR A1023 -0.996 14.444 8.887 1.00 0.00 H new ATOM 0 HB THR A1023 -3.447 15.698 7.673 1.00 0.00 H new ATOM 0 HG1 THR A1023 -2.110 17.527 8.012 1.00 0.00 H new ATOM 0 HG21 THR A1023 -4.123 15.872 10.041 1.00 0.00 H new ATOM 0 HG22 THR A1023 -3.680 14.194 9.646 1.00 0.00 H new ATOM 0 HG23 THR A1023 -2.545 15.224 10.550 1.00 0.00 H new ATOM 1747 N ALA A1024 -2.488 13.748 6.057 1.00 0.00 N ATOM 1748 CA ALA A1024 -2.956 12.642 5.238 1.00 0.00 C ATOM 1749 C ALA A1024 -1.792 11.689 4.962 1.00 0.00 C ATOM 1750 O ALA A1024 -1.916 10.480 5.152 1.00 0.00 O ATOM 1751 CB ALA A1024 -3.581 13.187 3.953 1.00 0.00 C ATOM 0 H ALA A1024 -2.597 14.669 5.632 1.00 0.00 H new ATOM 0 HA ALA A1024 -3.727 12.077 5.761 1.00 0.00 H new ATOM 0 HB1 ALA A1024 -3.932 12.358 3.339 1.00 0.00 H new ATOM 0 HB2 ALA A1024 -4.422 13.834 4.203 1.00 0.00 H new ATOM 0 HB3 ALA A1024 -2.836 13.758 3.400 1.00 0.00 H new ATOM 1757 N ALA A1025 -0.686 12.269 4.519 1.00 0.00 N ATOM 1758 CA ALA A1025 0.500 11.486 4.215 1.00 0.00 C ATOM 1759 C ALA A1025 0.741 10.476 5.338 1.00 0.00 C ATOM 1760 O ALA A1025 1.158 9.347 5.084 1.00 0.00 O ATOM 1761 CB ALA A1025 1.691 12.423 4.007 1.00 0.00 C ATOM 0 H ALA A1025 -0.586 13.272 4.363 1.00 0.00 H new ATOM 0 HA ALA A1025 0.363 10.924 3.291 1.00 0.00 H new ATOM 0 HB1 ALA A1025 2.581 11.836 3.779 1.00 0.00 H new ATOM 0 HB2 ALA A1025 1.481 13.100 3.179 1.00 0.00 H new ATOM 0 HB3 ALA A1025 1.861 13.002 4.915 1.00 0.00 H new ATOM 1767 N HIS A1026 0.468 10.919 6.557 1.00 0.00 N ATOM 1768 CA HIS A1026 0.651 10.068 7.720 1.00 0.00 C ATOM 1769 C HIS A1026 -0.278 8.856 7.621 1.00 0.00 C ATOM 1770 O HIS A1026 0.178 7.715 7.659 1.00 0.00 O ATOM 1771 CB HIS A1026 0.451 10.863 9.012 1.00 0.00 C ATOM 1772 CG HIS A1026 1.465 10.553 10.087 1.00 0.00 C ATOM 1773 ND1 HIS A1026 2.748 11.070 10.079 1.00 0.00 N ATOM 1774 CD2 HIS A1026 1.370 9.775 11.204 1.00 0.00 C ATOM 1775 CE1 HIS A1026 3.389 10.616 11.147 1.00 0.00 C ATOM 1776 NE2 HIS A1026 2.533 9.813 11.842 1.00 0.00 N ATOM 0 H HIS A1026 0.122 11.856 6.764 1.00 0.00 H new ATOM 0 HA HIS A1026 1.675 9.696 7.745 1.00 0.00 H new ATOM 0 HB2 HIS A1026 0.495 11.928 8.782 1.00 0.00 H new ATOM 0 HB3 HIS A1026 -0.548 10.661 9.400 1.00 0.00 H new ATOM 0 HD2 HIS A1026 0.496 9.222 11.516 1.00 0.00 H new ATOM 0 HE1 HIS A1026 4.409 10.842 11.419 1.00 0.00 H new ATOM 0 HE2 HIS A1026 2.751 9.322 12.709 1.00 0.00 H new ATOM 1784 N ALA A1027 -1.565 9.146 7.495 1.00 0.00 N ATOM 1785 CA ALA A1027 -2.562 8.095 7.389 1.00 0.00 C ATOM 1786 C ALA A1027 -2.313 7.287 6.114 1.00 0.00 C ATOM 1787 O ALA A1027 -2.509 6.073 6.095 1.00 0.00 O ATOM 1788 CB ALA A1027 -3.962 8.713 7.423 1.00 0.00 C ATOM 0 H ALA A1027 -1.940 10.094 7.464 1.00 0.00 H new ATOM 0 HA ALA A1027 -2.487 7.410 8.233 1.00 0.00 H new ATOM 0 HB1 ALA A1027 -4.710 7.924 7.343 1.00 0.00 H new ATOM 0 HB2 ALA A1027 -4.100 9.250 8.361 1.00 0.00 H new ATOM 0 HB3 ALA A1027 -4.075 9.405 6.589 1.00 0.00 H new ATOM 1794 N LEU A1028 -1.884 7.994 5.079 1.00 0.00 N ATOM 1795 CA LEU A1028 -1.605 7.358 3.802 1.00 0.00 C ATOM 1796 C LEU A1028 -0.540 6.277 3.997 1.00 0.00 C ATOM 1797 O LEU A1028 -0.818 5.090 3.835 1.00 0.00 O ATOM 1798 CB LEU A1028 -1.233 8.406 2.751 1.00 0.00 C ATOM 1799 CG LEU A1028 -2.403 9.091 2.043 1.00 0.00 C ATOM 1800 CD1 LEU A1028 -1.915 9.921 0.855 1.00 0.00 C ATOM 1801 CD2 LEU A1028 -3.468 8.072 1.632 1.00 0.00 C ATOM 0 H LEU A1028 -1.723 9.001 5.098 1.00 0.00 H new ATOM 0 HA LEU A1028 -2.497 6.861 3.421 1.00 0.00 H new ATOM 0 HB2 LEU A1028 -0.625 9.173 3.231 1.00 0.00 H new ATOM 0 HB3 LEU A1028 -0.607 7.929 1.997 1.00 0.00 H new ATOM 0 HG LEU A1028 -2.871 9.780 2.746 1.00 0.00 H new ATOM 0 HD11 LEU A1028 -2.767 10.397 0.369 1.00 0.00 H new ATOM 0 HD12 LEU A1028 -1.223 10.686 1.206 1.00 0.00 H new ATOM 0 HD13 LEU A1028 -1.407 9.272 0.142 1.00 0.00 H new ATOM 0 HD21 LEU A1028 -4.289 8.585 1.131 1.00 0.00 H new ATOM 0 HD22 LEU A1028 -3.029 7.341 0.953 1.00 0.00 H new ATOM 0 HD23 LEU A1028 -3.846 7.563 2.519 1.00 0.00 H new ATOM 1813 N ALA A1029 0.657 6.727 4.343 1.00 0.00 N ATOM 1814 CA ALA A1029 1.765 5.813 4.562 1.00 0.00 C ATOM 1815 C ALA A1029 1.251 4.552 5.259 1.00 0.00 C ATOM 1816 O ALA A1029 1.701 3.447 4.962 1.00 0.00 O ATOM 1817 CB ALA A1029 2.858 6.519 5.367 1.00 0.00 C ATOM 0 H ALA A1029 0.884 7.712 4.477 1.00 0.00 H new ATOM 0 HA ALA A1029 2.204 5.509 3.612 1.00 0.00 H new ATOM 0 HB1 ALA A1029 3.689 5.833 5.531 1.00 0.00 H new ATOM 0 HB2 ALA A1029 3.210 7.391 4.816 1.00 0.00 H new ATOM 0 HB3 ALA A1029 2.454 6.837 6.328 1.00 0.00 H new ATOM 1823 N VAL A1030 0.314 4.760 6.173 1.00 0.00 N ATOM 1824 CA VAL A1030 -0.266 3.654 6.915 1.00 0.00 C ATOM 1825 C VAL A1030 -1.268 2.918 6.023 1.00 0.00 C ATOM 1826 O VAL A1030 -1.219 1.694 5.907 1.00 0.00 O ATOM 1827 CB VAL A1030 -0.887 4.165 8.217 1.00 0.00 C ATOM 1828 CG1 VAL A1030 -1.961 3.202 8.727 1.00 0.00 C ATOM 1829 CG2 VAL A1030 0.186 4.404 9.280 1.00 0.00 C ATOM 0 H VAL A1030 -0.058 5.678 6.416 1.00 0.00 H new ATOM 0 HA VAL A1030 0.505 2.938 7.198 1.00 0.00 H new ATOM 0 HB VAL A1030 -1.367 5.121 8.007 1.00 0.00 H new ATOM 0 HG11 VAL A1030 -2.386 3.589 9.653 1.00 0.00 H new ATOM 0 HG12 VAL A1030 -2.748 3.105 7.979 1.00 0.00 H new ATOM 0 HG13 VAL A1030 -1.515 2.225 8.913 1.00 0.00 H new ATOM 0 HG21 VAL A1030 -0.283 4.767 10.195 1.00 0.00 H new ATOM 0 HG22 VAL A1030 0.709 3.470 9.486 1.00 0.00 H new ATOM 0 HG23 VAL A1030 0.898 5.146 8.918 1.00 0.00 H new ATOM 1839 N ASP A1031 -2.153 3.694 5.416 1.00 0.00 N ATOM 1840 CA ASP A1031 -3.165 3.131 4.538 1.00 0.00 C ATOM 1841 C ASP A1031 -2.517 2.093 3.620 1.00 0.00 C ATOM 1842 O ASP A1031 -2.908 0.927 3.622 1.00 0.00 O ATOM 1843 CB ASP A1031 -3.795 4.213 3.659 1.00 0.00 C ATOM 1844 CG ASP A1031 -5.042 3.775 2.888 1.00 0.00 C ATOM 1845 OD1 ASP A1031 -5.068 2.596 2.474 1.00 0.00 O ATOM 1846 OD2 ASP A1031 -5.941 4.629 2.730 1.00 0.00 O ATOM 0 H ASP A1031 -2.191 4.709 5.515 1.00 0.00 H new ATOM 0 HA ASP A1031 -3.937 2.677 5.160 1.00 0.00 H new ATOM 0 HB2 ASP A1031 -4.055 5.065 4.288 1.00 0.00 H new ATOM 0 HB3 ASP A1031 -3.048 4.560 2.945 1.00 0.00 H new ATOM 1851 N ALA A1032 -1.537 2.555 2.857 1.00 0.00 N ATOM 1852 CA ALA A1032 -0.831 1.680 1.936 1.00 0.00 C ATOM 1853 C ALA A1032 -0.204 0.524 2.716 1.00 0.00 C ATOM 1854 O ALA A1032 -0.104 -0.591 2.208 1.00 0.00 O ATOM 1855 CB ALA A1032 0.208 2.491 1.158 1.00 0.00 C ATOM 0 H ALA A1032 -1.215 3.523 2.858 1.00 0.00 H new ATOM 0 HA ALA A1032 -1.521 1.250 1.209 1.00 0.00 H new ATOM 0 HB1 ALA A1032 0.738 1.836 0.467 1.00 0.00 H new ATOM 0 HB2 ALA A1032 -0.292 3.281 0.598 1.00 0.00 H new ATOM 0 HB3 ALA A1032 0.919 2.935 1.855 1.00 0.00 H new ATOM 1861 N LYS A1033 0.204 0.830 3.940 1.00 0.00 N ATOM 1862 CA LYS A1033 0.819 -0.170 4.795 1.00 0.00 C ATOM 1863 C LYS A1033 -0.217 -1.239 5.150 1.00 0.00 C ATOM 1864 O LYS A1033 -0.010 -2.422 4.883 1.00 0.00 O ATOM 1865 CB LYS A1033 1.462 0.491 6.016 1.00 0.00 C ATOM 1866 CG LYS A1033 2.477 -0.444 6.676 1.00 0.00 C ATOM 1867 CD LYS A1033 1.790 -1.689 7.240 1.00 0.00 C ATOM 1868 CE LYS A1033 2.393 -2.085 8.589 1.00 0.00 C ATOM 1869 NZ LYS A1033 1.573 -1.551 9.700 1.00 0.00 N ATOM 0 H LYS A1033 0.120 1.756 4.359 1.00 0.00 H new ATOM 0 HA LYS A1033 1.630 -0.673 4.269 1.00 0.00 H new ATOM 0 HB2 LYS A1033 1.956 1.415 5.716 1.00 0.00 H new ATOM 0 HB3 LYS A1033 0.690 0.762 6.736 1.00 0.00 H new ATOM 0 HG2 LYS A1033 3.232 -0.740 5.947 1.00 0.00 H new ATOM 0 HG3 LYS A1033 2.996 0.083 7.476 1.00 0.00 H new ATOM 0 HD2 LYS A1033 0.723 -1.499 7.357 1.00 0.00 H new ATOM 0 HD3 LYS A1033 1.891 -2.515 6.536 1.00 0.00 H new ATOM 0 HE2 LYS A1033 2.453 -3.171 8.663 1.00 0.00 H new ATOM 0 HE3 LYS A1033 3.411 -1.704 8.665 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 1.996 -1.829 10.608 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 1.537 -0.513 9.638 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 0.609 -1.935 9.635 1.00 0.00 H new ATOM 1883 N ASN A1034 -1.310 -0.784 5.745 1.00 0.00 N ATOM 1884 CA ASN A1034 -2.378 -1.687 6.139 1.00 0.00 C ATOM 1885 C ASN A1034 -2.693 -2.634 4.979 1.00 0.00 C ATOM 1886 O ASN A1034 -3.097 -3.775 5.197 1.00 0.00 O ATOM 1887 CB ASN A1034 -3.655 -0.914 6.478 1.00 0.00 C ATOM 1888 CG ASN A1034 -4.456 -1.631 7.567 1.00 0.00 C ATOM 1889 OD1 ASN A1034 -3.989 -2.556 8.210 1.00 0.00 O ATOM 1890 ND2 ASN A1034 -5.686 -1.153 7.736 1.00 0.00 N ATOM 0 H ASN A1034 -1.479 0.198 5.964 1.00 0.00 H new ATOM 0 HA ASN A1034 -2.046 -2.239 7.018 1.00 0.00 H new ATOM 0 HB2 ASN A1034 -3.398 0.091 6.812 1.00 0.00 H new ATOM 0 HB3 ASN A1034 -4.267 -0.805 5.583 1.00 0.00 H new ATOM 0 HD21 ASN A1034 -6.301 -1.564 8.439 1.00 0.00 H new ATOM 0 HD22 ASN A1034 -6.014 -0.376 7.163 1.00 0.00 H new ATOM 1897 N LEU A1035 -2.496 -2.126 3.771 1.00 0.00 N ATOM 1898 CA LEU A1035 -2.753 -2.912 2.577 1.00 0.00 C ATOM 1899 C LEU A1035 -1.878 -4.167 2.600 1.00 0.00 C ATOM 1900 O LEU A1035 -2.387 -5.281 2.719 1.00 0.00 O ATOM 1901 CB LEU A1035 -2.569 -2.057 1.322 1.00 0.00 C ATOM 1902 CG LEU A1035 -3.168 -2.621 0.032 1.00 0.00 C ATOM 1903 CD1 LEU A1035 -3.738 -1.502 -0.842 1.00 0.00 C ATOM 1904 CD2 LEU A1035 -2.145 -3.472 -0.721 1.00 0.00 C ATOM 0 H LEU A1035 -2.161 -1.179 3.594 1.00 0.00 H new ATOM 0 HA LEU A1035 -3.790 -3.246 2.557 1.00 0.00 H new ATOM 0 HB2 LEU A1035 -3.010 -1.077 1.506 1.00 0.00 H new ATOM 0 HB3 LEU A1035 -1.502 -1.902 1.166 1.00 0.00 H new ATOM 0 HG LEU A1035 -3.998 -3.276 0.298 1.00 0.00 H new ATOM 0 HD11 LEU A1035 -4.158 -1.930 -1.753 1.00 0.00 H new ATOM 0 HD12 LEU A1035 -4.520 -0.975 -0.295 1.00 0.00 H new ATOM 0 HD13 LEU A1035 -2.943 -0.803 -1.102 1.00 0.00 H new ATOM 0 HD21 LEU A1035 -2.596 -3.861 -1.634 1.00 0.00 H new ATOM 0 HD22 LEU A1035 -1.280 -2.860 -0.976 1.00 0.00 H new ATOM 0 HD23 LEU A1035 -1.828 -4.303 -0.091 1.00 0.00 H new ATOM 1916 N LEU A1036 -0.577 -3.945 2.483 1.00 0.00 N ATOM 1917 CA LEU A1036 0.373 -5.044 2.489 1.00 0.00 C ATOM 1918 C LEU A1036 0.378 -5.701 3.870 1.00 0.00 C ATOM 1919 O LEU A1036 0.534 -6.916 3.983 1.00 0.00 O ATOM 1920 CB LEU A1036 1.752 -4.563 2.032 1.00 0.00 C ATOM 1921 CG LEU A1036 2.357 -5.299 0.835 1.00 0.00 C ATOM 1922 CD1 LEU A1036 1.997 -4.600 -0.477 1.00 0.00 C ATOM 1923 CD2 LEU A1036 3.869 -5.465 1.001 1.00 0.00 C ATOM 0 H LEU A1036 -0.159 -3.020 2.383 1.00 0.00 H new ATOM 0 HA LEU A1036 0.074 -5.809 1.773 1.00 0.00 H new ATOM 0 HB2 LEU A1036 1.682 -3.504 1.784 1.00 0.00 H new ATOM 0 HB3 LEU A1036 2.441 -4.649 2.872 1.00 0.00 H new ATOM 0 HG LEU A1036 1.926 -6.299 0.795 1.00 0.00 H new ATOM 0 HD11 LEU A1036 2.439 -5.143 -1.312 1.00 0.00 H new ATOM 0 HD12 LEU A1036 0.913 -4.578 -0.592 1.00 0.00 H new ATOM 0 HD13 LEU A1036 2.381 -3.580 -0.463 1.00 0.00 H new ATOM 0 HD21 LEU A1036 4.274 -5.991 0.137 1.00 0.00 H new ATOM 0 HD22 LEU A1036 4.336 -4.483 1.080 1.00 0.00 H new ATOM 0 HD23 LEU A1036 4.075 -6.039 1.905 1.00 0.00 H new ATOM 1935 N ASP A1037 0.205 -4.870 4.887 1.00 0.00 N ATOM 1936 CA ASP A1037 0.188 -5.355 6.256 1.00 0.00 C ATOM 1937 C ASP A1037 -0.735 -6.572 6.350 1.00 0.00 C ATOM 1938 O ASP A1037 -0.312 -7.644 6.779 1.00 0.00 O ATOM 1939 CB ASP A1037 -0.342 -4.285 7.213 1.00 0.00 C ATOM 1940 CG ASP A1037 -0.011 -4.516 8.689 1.00 0.00 C ATOM 1941 OD1 ASP A1037 1.010 -5.191 8.942 1.00 0.00 O ATOM 1942 OD2 ASP A1037 -0.786 -4.012 9.530 1.00 0.00 O ATOM 0 H ASP A1037 0.075 -3.863 4.790 1.00 0.00 H new ATOM 0 HA ASP A1037 1.209 -5.614 6.535 1.00 0.00 H new ATOM 0 HB2 ASP A1037 0.062 -3.318 6.913 1.00 0.00 H new ATOM 0 HB3 ASP A1037 -1.425 -4.226 7.104 1.00 0.00 H new ATOM 1947 N VAL A1038 -1.978 -6.365 5.941 1.00 0.00 N ATOM 1948 CA VAL A1038 -2.964 -7.431 5.973 1.00 0.00 C ATOM 1949 C VAL A1038 -2.469 -8.603 5.124 1.00 0.00 C ATOM 1950 O VAL A1038 -2.761 -9.760 5.424 1.00 0.00 O ATOM 1951 CB VAL A1038 -4.326 -6.899 5.522 1.00 0.00 C ATOM 1952 CG1 VAL A1038 -4.300 -6.511 4.042 1.00 0.00 C ATOM 1953 CG2 VAL A1038 -5.433 -7.917 5.803 1.00 0.00 C ATOM 0 H VAL A1038 -2.325 -5.474 5.585 1.00 0.00 H new ATOM 0 HA VAL A1038 -3.095 -7.799 6.991 1.00 0.00 H new ATOM 0 HB VAL A1038 -4.543 -6.001 6.100 1.00 0.00 H new ATOM 0 HG11 VAL A1038 -5.280 -6.136 3.747 1.00 0.00 H new ATOM 0 HG12 VAL A1038 -3.551 -5.735 3.882 1.00 0.00 H new ATOM 0 HG13 VAL A1038 -4.050 -7.385 3.441 1.00 0.00 H new ATOM 0 HG21 VAL A1038 -6.390 -7.514 5.473 1.00 0.00 H new ATOM 0 HG22 VAL A1038 -5.223 -8.841 5.264 1.00 0.00 H new ATOM 0 HG23 VAL A1038 -5.475 -8.123 6.873 1.00 0.00 H new ATOM 1963 N ILE A1039 -1.728 -8.264 4.079 1.00 0.00 N ATOM 1964 CA ILE A1039 -1.189 -9.274 3.184 1.00 0.00 C ATOM 1965 C ILE A1039 -0.147 -10.108 3.931 1.00 0.00 C ATOM 1966 O ILE A1039 -0.150 -11.335 3.844 1.00 0.00 O ATOM 1967 CB ILE A1039 -0.657 -8.626 1.904 1.00 0.00 C ATOM 1968 CG1 ILE A1039 -1.768 -8.470 0.865 1.00 0.00 C ATOM 1969 CG2 ILE A1039 0.539 -9.405 1.352 1.00 0.00 C ATOM 1970 CD1 ILE A1039 -1.332 -7.541 -0.270 1.00 0.00 C ATOM 0 H ILE A1039 -1.488 -7.304 3.832 1.00 0.00 H new ATOM 0 HA ILE A1039 -1.975 -9.958 2.864 1.00 0.00 H new ATOM 0 HB ILE A1039 -0.304 -7.624 2.150 1.00 0.00 H new ATOM 0 HG12 ILE A1039 -2.031 -9.447 0.459 1.00 0.00 H new ATOM 0 HG13 ILE A1039 -2.663 -8.072 1.342 1.00 0.00 H new ATOM 0 HG21 ILE A1039 0.898 -8.924 0.442 1.00 0.00 H new ATOM 0 HG22 ILE A1039 1.337 -9.420 2.094 1.00 0.00 H new ATOM 0 HG23 ILE A1039 0.235 -10.427 1.126 1.00 0.00 H new ATOM 0 HD11 ILE A1039 -2.141 -7.448 -0.995 1.00 0.00 H new ATOM 0 HD12 ILE A1039 -1.093 -6.558 0.136 1.00 0.00 H new ATOM 0 HD13 ILE A1039 -0.451 -7.955 -0.761 1.00 0.00 H new ATOM 1982 N ASP A1040 0.720 -9.409 4.649 1.00 0.00 N ATOM 1983 CA ASP A1040 1.766 -10.070 5.410 1.00 0.00 C ATOM 1984 C ASP A1040 1.153 -11.208 6.228 1.00 0.00 C ATOM 1985 O ASP A1040 1.748 -12.278 6.354 1.00 0.00 O ATOM 1986 CB ASP A1040 2.438 -9.098 6.382 1.00 0.00 C ATOM 1987 CG ASP A1040 3.864 -9.472 6.788 1.00 0.00 C ATOM 1988 OD1 ASP A1040 4.080 -10.672 7.062 1.00 0.00 O ATOM 1989 OD2 ASP A1040 4.707 -8.549 6.817 1.00 0.00 O ATOM 0 H ASP A1040 0.719 -8.391 4.720 1.00 0.00 H new ATOM 0 HA ASP A1040 2.508 -10.447 4.706 1.00 0.00 H new ATOM 0 HB2 ASP A1040 2.454 -8.107 5.928 1.00 0.00 H new ATOM 0 HB3 ASP A1040 1.827 -9.027 7.282 1.00 0.00 H new ATOM 1994 N GLN A1041 -0.029 -10.940 6.764 1.00 0.00 N ATOM 1995 CA GLN A1041 -0.728 -11.928 7.567 1.00 0.00 C ATOM 1996 C GLN A1041 -1.284 -13.040 6.674 1.00 0.00 C ATOM 1997 O GLN A1041 -1.460 -14.172 7.123 1.00 0.00 O ATOM 1998 CB GLN A1041 -1.842 -11.278 8.389 1.00 0.00 C ATOM 1999 CG GLN A1041 -1.365 -10.966 9.809 1.00 0.00 C ATOM 2000 CD GLN A1041 -2.207 -9.854 10.439 1.00 0.00 C ATOM 2001 OE1 GLN A1041 -1.702 -8.847 10.907 1.00 0.00 O ATOM 2002 NE2 GLN A1041 -3.515 -10.092 10.424 1.00 0.00 N ATOM 0 H GLN A1041 -0.520 -10.052 6.658 1.00 0.00 H new ATOM 0 HA GLN A1041 -0.017 -12.369 8.265 1.00 0.00 H new ATOM 0 HB2 GLN A1041 -2.170 -10.360 7.902 1.00 0.00 H new ATOM 0 HB3 GLN A1041 -2.705 -11.943 8.429 1.00 0.00 H new ATOM 0 HG2 GLN A1041 -1.426 -11.865 10.423 1.00 0.00 H new ATOM 0 HG3 GLN A1041 -0.317 -10.666 9.787 1.00 0.00 H new ATOM 0 HE21 GLN A1041 -3.871 -10.956 10.016 1.00 0.00 H new ATOM 0 HE22 GLN A1041 -4.162 -9.410 10.820 1.00 0.00 H new ATOM 2011 N ALA A1042 -1.544 -12.679 5.426 1.00 0.00 N ATOM 2012 CA ALA A1042 -2.075 -13.632 4.467 1.00 0.00 C ATOM 2013 C ALA A1042 -0.930 -14.475 3.903 1.00 0.00 C ATOM 2014 O ALA A1042 -1.043 -15.695 3.803 1.00 0.00 O ATOM 2015 CB ALA A1042 -2.841 -12.883 3.374 1.00 0.00 C ATOM 0 H ALA A1042 -1.397 -11.740 5.057 1.00 0.00 H new ATOM 0 HA ALA A1042 -2.777 -14.312 4.950 1.00 0.00 H new ATOM 0 HB1 ALA A1042 -3.240 -13.598 2.654 1.00 0.00 H new ATOM 0 HB2 ALA A1042 -3.662 -12.324 3.823 1.00 0.00 H new ATOM 0 HB3 ALA A1042 -2.168 -12.193 2.865 1.00 0.00 H new ATOM 2021 N ARG A1043 0.148 -13.789 3.549 1.00 0.00 N ATOM 2022 CA ARG A1043 1.314 -14.460 2.998 1.00 0.00 C ATOM 2023 C ARG A1043 1.733 -15.622 3.900 1.00 0.00 C ATOM 2024 O ARG A1043 1.977 -16.728 3.420 1.00 0.00 O ATOM 2025 CB ARG A1043 2.487 -13.490 2.849 1.00 0.00 C ATOM 2026 CG ARG A1043 3.724 -14.206 2.301 1.00 0.00 C ATOM 2027 CD ARG A1043 4.651 -13.225 1.580 1.00 0.00 C ATOM 2028 NE ARG A1043 5.804 -12.889 2.445 1.00 0.00 N ATOM 2029 CZ ARG A1043 5.795 -11.912 3.362 1.00 0.00 C ATOM 2030 NH1 ARG A1043 4.694 -11.169 3.539 1.00 0.00 N ATOM 2031 NH2 ARG A1043 6.887 -11.678 4.102 1.00 0.00 N ATOM 0 H ARG A1043 0.238 -12.776 3.633 1.00 0.00 H new ATOM 0 HA ARG A1043 1.044 -14.840 2.013 1.00 0.00 H new ATOM 0 HB2 ARG A1043 2.208 -12.676 2.180 1.00 0.00 H new ATOM 0 HB3 ARG A1043 2.719 -13.043 3.816 1.00 0.00 H new ATOM 0 HG2 ARG A1043 4.262 -14.687 3.118 1.00 0.00 H new ATOM 0 HG3 ARG A1043 3.418 -14.994 1.614 1.00 0.00 H new ATOM 0 HD2 ARG A1043 5.002 -13.663 0.646 1.00 0.00 H new ATOM 0 HD3 ARG A1043 4.104 -12.319 1.321 1.00 0.00 H new ATOM 0 HE ARG A1043 6.659 -13.435 2.336 1.00 0.00 H new ATOM 0 HH11 ARG A1043 3.863 -11.347 2.976 1.00 0.00 H new ATOM 0 HH12 ARG A1043 4.687 -10.425 4.237 1.00 0.00 H new ATOM 0 HH21 ARG A1043 7.725 -12.244 3.967 1.00 0.00 H new ATOM 0 HH22 ARG A1043 6.880 -10.934 4.800 1.00 0.00 H new ATOM 2045 N LEU A1044 1.805 -15.332 5.191 1.00 0.00 N ATOM 2046 CA LEU A1044 2.191 -16.339 6.164 1.00 0.00 C ATOM 2047 C LEU A1044 1.165 -17.474 6.152 1.00 0.00 C ATOM 2048 O LEU A1044 1.531 -18.648 6.172 1.00 0.00 O ATOM 2049 CB LEU A1044 2.390 -15.704 7.542 1.00 0.00 C ATOM 2050 CG LEU A1044 1.206 -14.904 8.089 1.00 0.00 C ATOM 2051 CD1 LEU A1044 0.166 -15.829 8.724 1.00 0.00 C ATOM 2052 CD2 LEU A1044 1.678 -13.821 9.061 1.00 0.00 C ATOM 0 H LEU A1044 1.602 -14.413 5.586 1.00 0.00 H new ATOM 0 HA LEU A1044 3.153 -16.776 5.898 1.00 0.00 H new ATOM 0 HB2 LEU A1044 2.628 -16.495 8.253 1.00 0.00 H new ATOM 0 HB3 LEU A1044 3.257 -15.045 7.495 1.00 0.00 H new ATOM 0 HG LEU A1044 0.721 -14.398 7.254 1.00 0.00 H new ATOM 0 HD11 LEU A1044 -0.665 -15.235 9.105 1.00 0.00 H new ATOM 0 HD12 LEU A1044 -0.202 -16.530 7.975 1.00 0.00 H new ATOM 0 HD13 LEU A1044 0.623 -16.381 9.545 1.00 0.00 H new ATOM 0 HD21 LEU A1044 0.817 -13.267 9.435 1.00 0.00 H new ATOM 0 HD22 LEU A1044 2.202 -14.285 9.897 1.00 0.00 H new ATOM 0 HD23 LEU A1044 2.352 -13.138 8.545 1.00 0.00 H new ATOM 2064 N LYS A1045 -0.101 -17.083 6.120 1.00 0.00 N ATOM 2065 CA LYS A1045 -1.183 -18.053 6.105 1.00 0.00 C ATOM 2066 C LYS A1045 -0.786 -19.240 5.225 1.00 0.00 C ATOM 2067 O LYS A1045 -1.188 -20.373 5.486 1.00 0.00 O ATOM 2068 CB LYS A1045 -2.494 -17.387 5.684 1.00 0.00 C ATOM 2069 CG LYS A1045 -3.548 -17.503 6.787 1.00 0.00 C ATOM 2070 CD LYS A1045 -3.615 -16.220 7.619 1.00 0.00 C ATOM 2071 CE LYS A1045 -4.804 -16.253 8.581 1.00 0.00 C ATOM 2072 NZ LYS A1045 -4.336 -16.266 9.984 1.00 0.00 N ATOM 0 H LYS A1045 -0.401 -16.108 6.104 1.00 0.00 H new ATOM 0 HA LYS A1045 -1.358 -18.443 7.107 1.00 0.00 H new ATOM 0 HB2 LYS A1045 -2.315 -16.336 5.456 1.00 0.00 H new ATOM 0 HB3 LYS A1045 -2.865 -17.852 4.771 1.00 0.00 H new ATOM 0 HG2 LYS A1045 -4.523 -17.704 6.343 1.00 0.00 H new ATOM 0 HG3 LYS A1045 -3.311 -18.348 7.434 1.00 0.00 H new ATOM 0 HD2 LYS A1045 -2.690 -16.099 8.182 1.00 0.00 H new ATOM 0 HD3 LYS A1045 -3.701 -15.358 6.958 1.00 0.00 H new ATOM 0 HE2 LYS A1045 -5.440 -15.384 8.412 1.00 0.00 H new ATOM 0 HE3 LYS A1045 -5.412 -17.136 8.386 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 -5.156 -16.288 10.623 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 -3.748 -17.108 10.146 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 -3.775 -15.411 10.171 1.00 0.00 H new ATOM 2086 N MET A1046 -0.003 -18.940 4.200 1.00 0.00 N ATOM 2087 CA MET A1046 0.453 -19.968 3.279 1.00 0.00 C ATOM 2088 C MET A1046 1.643 -20.734 3.859 1.00 0.00 C ATOM 2089 O MET A1046 1.604 -21.959 3.969 1.00 0.00 O ATOM 2090 CB MET A1046 0.858 -19.322 1.953 1.00 0.00 C ATOM 2091 CG MET A1046 1.640 -20.307 1.080 1.00 0.00 C ATOM 2092 SD MET A1046 3.325 -19.749 0.889 1.00 0.00 S ATOM 2093 CE MET A1046 3.037 -18.065 0.371 1.00 0.00 C ATOM 0 H MET A1046 0.328 -17.999 3.986 1.00 0.00 H new ATOM 0 HA MET A1046 -0.363 -20.672 3.116 1.00 0.00 H new ATOM 0 HB2 MET A1046 -0.032 -18.986 1.421 1.00 0.00 H new ATOM 0 HB3 MET A1046 1.467 -18.438 2.146 1.00 0.00 H new ATOM 0 HG2 MET A1046 1.626 -21.298 1.533 1.00 0.00 H new ATOM 0 HG3 MET A1046 1.165 -20.396 0.103 1.00 0.00 H new ATOM 0 HE1 MET A1046 3.760 -17.792 -0.398 1.00 0.00 H new ATOM 0 HE2 MET A1046 2.028 -17.976 -0.031 1.00 0.00 H new ATOM 0 HE3 MET A1046 3.148 -17.397 1.226 1.00 0.00 H new ATOM 2103 N ILE A1047 2.674 -19.982 4.216 1.00 0.00 N ATOM 2104 CA ILE A1047 3.873 -20.575 4.782 1.00 0.00 C ATOM 2105 C ILE A1047 3.476 -21.622 5.825 1.00 0.00 C ATOM 2106 O ILE A1047 3.924 -22.766 5.763 1.00 0.00 O ATOM 2107 CB ILE A1047 4.804 -19.488 5.325 1.00 0.00 C ATOM 2108 CG1 ILE A1047 5.531 -18.770 4.187 1.00 0.00 C ATOM 2109 CG2 ILE A1047 5.778 -20.065 6.355 1.00 0.00 C ATOM 2110 CD1 ILE A1047 5.198 -17.277 4.179 1.00 0.00 C ATOM 0 H ILE A1047 2.703 -18.967 4.124 1.00 0.00 H new ATOM 0 HA ILE A1047 4.442 -21.093 4.010 1.00 0.00 H new ATOM 0 HB ILE A1047 4.197 -18.743 5.839 1.00 0.00 H new ATOM 0 HG12 ILE A1047 6.607 -18.906 4.296 1.00 0.00 H new ATOM 0 HG13 ILE A1047 5.248 -19.214 3.233 1.00 0.00 H new ATOM 0 HG21 ILE A1047 6.428 -19.272 6.725 1.00 0.00 H new ATOM 0 HG22 ILE A1047 5.217 -20.492 7.186 1.00 0.00 H new ATOM 0 HG23 ILE A1047 6.383 -20.842 5.888 1.00 0.00 H new ATOM 0 HD11 ILE A1047 5.728 -16.790 3.360 1.00 0.00 H new ATOM 0 HD12 ILE A1047 4.124 -17.144 4.046 1.00 0.00 H new ATOM 0 HD13 ILE A1047 5.504 -16.831 5.125 1.00 0.00 H new ATOM 2122 N SER A1048 2.639 -21.193 6.758 1.00 0.00 N ATOM 2123 CA SER A1048 2.177 -22.079 7.813 1.00 0.00 C ATOM 2124 C SER A1048 1.009 -22.929 7.307 1.00 0.00 C ATOM 2125 O SER A1048 -0.120 -22.777 7.771 1.00 0.00 O ATOM 2126 CB SER A1048 1.759 -21.288 9.053 1.00 0.00 C ATOM 2127 OG SER A1048 2.863 -21.024 9.915 1.00 0.00 O ATOM 0 H SER A1048 2.269 -20.244 6.805 1.00 0.00 H new ATOM 0 HA SER A1048 3.001 -22.735 8.095 1.00 0.00 H new ATOM 0 HB2 SER A1048 1.305 -20.346 8.746 1.00 0.00 H new ATOM 0 HB3 SER A1048 0.998 -21.845 9.599 1.00 0.00 H new ATOM 0 HG SER A1048 2.555 -20.516 10.694 1.00 0.00 H new ATOM 2133 N GLN A1049 1.321 -23.805 6.363 1.00 0.00 N ATOM 2134 CA GLN A1049 0.311 -24.678 5.790 1.00 0.00 C ATOM 2135 C GLN A1049 0.974 -25.820 5.016 1.00 0.00 C ATOM 2136 O GLN A1049 2.194 -25.840 4.857 1.00 0.00 O ATOM 2137 CB GLN A1049 -0.649 -23.893 4.894 1.00 0.00 C ATOM 2138 CG GLN A1049 -2.072 -23.923 5.456 1.00 0.00 C ATOM 2139 CD GLN A1049 -2.986 -22.970 4.684 1.00 0.00 C ATOM 2140 OE1 GLN A1049 -3.289 -23.167 3.519 1.00 0.00 O ATOM 2141 NE2 GLN A1049 -3.407 -21.928 5.396 1.00 0.00 N ATOM 0 H GLN A1049 2.259 -23.929 5.981 1.00 0.00 H new ATOM 0 HA GLN A1049 -0.274 -25.107 6.604 1.00 0.00 H new ATOM 0 HB2 GLN A1049 -0.310 -22.861 4.808 1.00 0.00 H new ATOM 0 HB3 GLN A1049 -0.642 -24.316 3.889 1.00 0.00 H new ATOM 0 HG2 GLN A1049 -2.468 -24.937 5.400 1.00 0.00 H new ATOM 0 HG3 GLN A1049 -2.057 -23.644 6.510 1.00 0.00 H new ATOM 0 HE21 GLN A1049 -3.115 -21.823 6.368 1.00 0.00 H new ATOM 0 HE22 GLN A1049 -4.022 -21.234 4.970 1.00 0.00 H new ATOM 2150 N SER A1050 0.142 -26.741 4.555 1.00 0.00 N ATOM 2151 CA SER A1050 0.632 -27.883 3.802 1.00 0.00 C ATOM 2152 C SER A1050 0.926 -27.470 2.358 1.00 0.00 C ATOM 2153 O SER A1050 0.120 -27.713 1.462 1.00 0.00 O ATOM 2154 CB SER A1050 -0.375 -29.035 3.829 1.00 0.00 C ATOM 2155 OG SER A1050 -0.112 -29.948 4.891 1.00 0.00 O ATOM 0 H SER A1050 -0.869 -26.720 4.688 1.00 0.00 H new ATOM 0 HA SER A1050 1.553 -28.231 4.270 1.00 0.00 H new ATOM 0 HB2 SER A1050 -1.383 -28.634 3.937 1.00 0.00 H new ATOM 0 HB3 SER A1050 -0.344 -29.566 2.878 1.00 0.00 H new ATOM 0 HG SER A1050 -0.777 -30.668 4.876 1.00 0.00 H new ATOM 2161 N ARG A1051 2.084 -26.852 2.178 1.00 0.00 N ATOM 2162 CA ARG A1051 2.495 -26.402 0.858 1.00 0.00 C ATOM 2163 C ARG A1051 2.663 -27.598 -0.081 1.00 0.00 C ATOM 2164 O ARG A1051 3.574 -28.406 0.093 1.00 0.00 O ATOM 2165 CB ARG A1051 3.812 -25.627 0.926 1.00 0.00 C ATOM 2166 CG ARG A1051 3.773 -24.400 0.012 1.00 0.00 C ATOM 2167 CD ARG A1051 4.970 -23.483 0.274 1.00 0.00 C ATOM 2168 NE ARG A1051 6.124 -23.911 -0.549 1.00 0.00 N ATOM 2169 CZ ARG A1051 6.984 -24.875 -0.193 1.00 0.00 C ATOM 2170 NH1 ARG A1051 6.826 -25.518 0.972 1.00 0.00 N ATOM 2171 NH2 ARG A1051 8.003 -25.196 -1.002 1.00 0.00 N ATOM 0 H ARG A1051 2.751 -26.652 2.924 1.00 0.00 H new ATOM 0 HA ARG A1051 1.717 -25.741 0.475 1.00 0.00 H new ATOM 0 HB2 ARG A1051 4.002 -25.314 1.953 1.00 0.00 H new ATOM 0 HB3 ARG A1051 4.636 -26.277 0.633 1.00 0.00 H new ATOM 0 HG2 ARG A1051 3.776 -24.718 -1.030 1.00 0.00 H new ATOM 0 HG3 ARG A1051 2.846 -23.850 0.175 1.00 0.00 H new ATOM 0 HD2 ARG A1051 4.707 -22.452 0.039 1.00 0.00 H new ATOM 0 HD3 ARG A1051 5.236 -23.511 1.331 1.00 0.00 H new ATOM 0 HE ARG A1051 6.274 -23.443 -1.443 1.00 0.00 H new ATOM 0 HH11 ARG A1051 6.051 -25.274 1.588 1.00 0.00 H new ATOM 0 HH12 ARG A1051 7.481 -26.252 1.242 1.00 0.00 H new ATOM 0 HH21 ARG A1051 8.124 -24.707 -1.889 1.00 0.00 H new ATOM 0 HH22 ARG A1051 8.658 -25.930 -0.731 1.00 0.00 H new ATOM 2185 N PRO A1052 1.747 -27.676 -1.083 1.00 0.00 N ATOM 2186 CA PRO A1052 1.785 -28.759 -2.050 1.00 0.00 C ATOM 2187 C PRO A1052 2.919 -28.556 -3.057 1.00 0.00 C ATOM 2188 O PRO A1052 3.701 -27.614 -2.935 1.00 0.00 O ATOM 2189 CB PRO A1052 0.409 -28.758 -2.697 1.00 0.00 C ATOM 2190 CG PRO A1052 -0.187 -27.390 -2.405 1.00 0.00 C ATOM 2191 CD PRO A1052 0.654 -26.737 -1.320 1.00 0.00 C ATOM 0 HA PRO A1052 1.994 -29.725 -1.591 1.00 0.00 H new ATOM 0 HB2 PRO A1052 0.482 -28.931 -3.771 1.00 0.00 H new ATOM 0 HB3 PRO A1052 -0.216 -29.552 -2.288 1.00 0.00 H new ATOM 0 HG2 PRO A1052 -0.192 -26.776 -3.305 1.00 0.00 H new ATOM 0 HG3 PRO A1052 -1.223 -27.486 -2.079 1.00 0.00 H new ATOM 0 HD2 PRO A1052 1.029 -25.765 -1.641 1.00 0.00 H new ATOM 0 HD3 PRO A1052 0.072 -26.570 -0.414 1.00 0.00 H new ATOM 2199 N HIS A1053 2.973 -29.455 -4.029 1.00 0.00 N ATOM 2200 CA HIS A1053 3.998 -29.386 -5.056 1.00 0.00 C ATOM 2201 C HIS A1053 3.920 -28.035 -5.769 1.00 0.00 C ATOM 2202 O HIS A1053 4.944 -27.401 -6.020 1.00 0.00 O ATOM 2203 CB HIS A1053 3.885 -30.571 -6.017 1.00 0.00 C ATOM 2204 CG HIS A1053 5.197 -31.265 -6.294 1.00 0.00 C ATOM 2205 ND1 HIS A1053 6.120 -31.547 -5.301 1.00 0.00 N ATOM 2206 CD2 HIS A1053 5.731 -31.730 -7.459 1.00 0.00 C ATOM 2207 CE1 HIS A1053 7.158 -32.154 -5.857 1.00 0.00 C ATOM 2208 NE2 HIS A1053 6.916 -32.266 -7.194 1.00 0.00 N ATOM 0 H HIS A1053 2.323 -30.235 -4.127 1.00 0.00 H new ATOM 0 HA HIS A1053 4.984 -29.459 -4.596 1.00 0.00 H new ATOM 0 HB2 HIS A1053 3.183 -31.295 -5.603 1.00 0.00 H new ATOM 0 HB3 HIS A1053 3.464 -30.222 -6.960 1.00 0.00 H new ATOM 0 HD2 HIS A1053 5.268 -31.672 -8.433 1.00 0.00 H new ATOM 0 HE1 HIS A1053 8.042 -32.500 -5.341 1.00 0.00 H new ATOM 0 HE2 HIS A1053 7.542 -32.691 -7.878 1.00 0.00 H new TER 2216 HIS A1053