USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=28 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 130:sc=-0.00809 USER MOD Set 1.2: A1021 MET CE :methyl 161:sc= -1.8 (180deg=-2.99!) USER MOD Set 2.1: A 944 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Set 2.2: A1019 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 915 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 917 ASN : amide:sc= -0.0811 K(o=-0.081,f=-0.92) USER MOD Single : A 921 SER OG : rot 180:sc= 0 USER MOD Single : A 922 ASN : amide:sc= -10.6! C(o=-11!,f=-22!) USER MOD Single : A 924 LYS NZ :NH3+ -166:sc= -0.0023 (180deg=-0.111) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 928 ASN : amide:sc= -4.63 K(o=-4.6,f=-11!) USER MOD Single : A 930 THR OG1 : rot -102:sc= -1.8 USER MOD Single : A 934 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 939 MET CE :methyl -149:sc= -0.126 (180deg=-1.22) USER MOD Single : A 941 SER OG : rot 180:sc= 0 USER MOD Single : A 942 LYS NZ :NH3+ -111:sc= 0.585 (180deg=0) USER MOD Single : A 951 TYR OH : rot 26:sc= 0.999 USER MOD Single : A 954 MET CE :methyl 168:sc= -2.57! (180deg=-3.3!) USER MOD Single : A 956 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 964 THR OG1 : rot 180:sc= 0 USER MOD Single : A 968 THR OG1 : rot 8:sc= -2.94! USER MOD Single : A 972 SER OG : rot -170:sc= -0.594 USER MOD Single : A 979 SER OG : rot 180:sc= 0 USER MOD Single : A 980 THR OG1 : rot -132:sc= 0.954 USER MOD Single : A 981 HIS : no HD1:sc= -0.201 X(o=-0.2,f=-0.2) USER MOD Single : A 986 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 988 GLN : amide:sc= -0.279 K(o=-0.28,f=-2.6!) USER MOD Single : A 989 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 992 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 993 SER OG : rot 180:sc= 0 USER MOD Single : A1000 ASN : amide:sc= -3.14! C(o=-3.1!,f=-6.3!) USER MOD Single : A1001 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1002 MET CE :methyl -154:sc= -3.67! (180deg=-5.6!) USER MOD Single : A1003 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1006 GLN : amide:sc= -0.366 X(o=-0.37,f=-0.16) 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 153:sc= -0.307 (180deg=-1.7!) USER MOD Single : A1011 THR OG1 : rot 180:sc= -0.169 USER MOD Single : A1012 SER OG : rot 180:sc= 0 USER MOD Single : A1014 GLN : amide:sc= -0.57 K(o=-0.57,f=-1.2) USER MOD Single : A1015 GLN : amide:sc= -0.0169 X(o=-0.017,f=0) USER MOD Single : A1017 TYR OH : rot 74:sc= 3.64 USER MOD Single : A1018 LYS NZ :NH3+ -153:sc= 0.131 (180deg=-1.18) USER MOD Single : A1020 GLN : amide:sc= -0.176 X(o=-0.18,f=-0.18) USER MOD Single : A1023 THR OG1 : rot 180:sc= 0.0444 USER MOD Single : A1026 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD Single : A1033 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1034 ASN : amide:sc= -0.67 X(o=-0.67,f=-1.1!) USER MOD Single : A1041 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1045 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1046 MET CE :methyl -145:sc= -0.609 (180deg=-2.62!) USER MOD Single : A1048 SER OG : rot 180:sc= 0 USER MOD Single : A1049 GLN : amide:sc= -0.0579 K(o=-0.058,f=-0.68) USER MOD Single : A1050 SER OG : rot 180:sc= -0.0856 USER MOD Single : A1053 HIS : no HD1:sc=-0.00525 X(o=-0.0052,f=-0.0052) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 915 8.667 -23.273 2.737 1.00 0.00 N ATOM 2 CA MET A 915 9.407 -22.126 2.237 1.00 0.00 C ATOM 3 C MET A 915 9.176 -21.936 0.737 1.00 0.00 C ATOM 4 O MET A 915 9.801 -22.611 -0.081 1.00 0.00 O ATOM 5 CB MET A 915 10.900 -22.326 2.504 1.00 0.00 C ATOM 6 CG MET A 915 11.470 -21.169 3.326 1.00 0.00 C ATOM 7 SD MET A 915 13.241 -21.341 3.477 1.00 0.00 S ATOM 8 CE MET A 915 13.730 -19.629 3.358 1.00 0.00 C ATOM 0 HA MET A 915 9.053 -21.235 2.755 1.00 0.00 H new ATOM 0 HB2 MET A 915 11.055 -23.265 3.035 1.00 0.00 H new ATOM 0 HB3 MET A 915 11.435 -22.403 1.558 1.00 0.00 H new ATOM 0 HG2 MET A 915 11.228 -20.219 2.849 1.00 0.00 H new ATOM 0 HG3 MET A 915 11.012 -21.155 4.315 1.00 0.00 H new ATOM 0 HE1 MET A 915 14.815 -19.554 3.434 1.00 0.00 H new ATOM 0 HE2 MET A 915 13.405 -19.223 2.400 1.00 0.00 H new ATOM 0 HE3 MET A 915 13.270 -19.062 4.167 1.00 0.00 H new ATOM 18 N ALA A 916 8.278 -21.015 0.420 1.00 0.00 N ATOM 19 CA ALA A 916 7.958 -20.728 -0.968 1.00 0.00 C ATOM 20 C ALA A 916 8.641 -19.425 -1.386 1.00 0.00 C ATOM 21 O ALA A 916 8.258 -18.346 -0.935 1.00 0.00 O ATOM 22 CB ALA A 916 6.438 -20.671 -1.140 1.00 0.00 C ATOM 0 H ALA A 916 7.762 -20.458 1.101 1.00 0.00 H new ATOM 0 HA ALA A 916 8.331 -21.519 -1.619 1.00 0.00 H new ATOM 0 HB1 ALA A 916 6.197 -20.456 -2.181 1.00 0.00 H new ATOM 0 HB2 ALA A 916 6.004 -21.630 -0.858 1.00 0.00 H new ATOM 0 HB3 ALA A 916 6.029 -19.886 -0.503 1.00 0.00 H new ATOM 28 N ASN A 917 9.642 -19.567 -2.242 1.00 0.00 N ATOM 29 CA ASN A 917 10.383 -18.415 -2.726 1.00 0.00 C ATOM 30 C ASN A 917 9.689 -17.853 -3.968 1.00 0.00 C ATOM 31 O ASN A 917 10.205 -17.971 -5.078 1.00 0.00 O ATOM 32 CB ASN A 917 11.811 -18.802 -3.116 1.00 0.00 C ATOM 33 CG ASN A 917 12.788 -18.516 -1.974 1.00 0.00 C ATOM 34 OD1 ASN A 917 12.420 -18.427 -0.815 1.00 0.00 O ATOM 35 ND2 ASN A 917 14.052 -18.376 -2.366 1.00 0.00 N ATOM 0 H ASN A 917 9.957 -20.463 -2.613 1.00 0.00 H new ATOM 0 HA ASN A 917 10.416 -17.675 -1.926 1.00 0.00 H new ATOM 0 HB2 ASN A 917 11.847 -19.860 -3.374 1.00 0.00 H new ATOM 0 HB3 ASN A 917 12.112 -18.247 -4.005 1.00 0.00 H new ATOM 0 HD21 ASN A 917 14.781 -18.182 -1.679 1.00 0.00 H new ATOM 0 HD22 ASN A 917 14.292 -18.463 -3.353 1.00 0.00 H new ATOM 42 N LEU A 918 8.530 -17.253 -3.739 1.00 0.00 N ATOM 43 CA LEU A 918 7.760 -16.672 -4.825 1.00 0.00 C ATOM 44 C LEU A 918 7.477 -15.201 -4.515 1.00 0.00 C ATOM 45 O LEU A 918 6.321 -14.804 -4.375 1.00 0.00 O ATOM 46 CB LEU A 918 6.500 -17.498 -5.090 1.00 0.00 C ATOM 47 CG LEU A 918 6.685 -18.745 -5.958 1.00 0.00 C ATOM 48 CD1 LEU A 918 7.271 -19.899 -5.141 1.00 0.00 C ATOM 49 CD2 LEU A 918 5.374 -19.135 -6.644 1.00 0.00 C ATOM 0 H LEU A 918 8.106 -17.157 -2.817 1.00 0.00 H new ATOM 0 HA LEU A 918 8.331 -16.698 -5.753 1.00 0.00 H new ATOM 0 HB2 LEU A 918 6.083 -17.806 -4.131 1.00 0.00 H new ATOM 0 HB3 LEU A 918 5.761 -16.854 -5.567 1.00 0.00 H new ATOM 0 HG LEU A 918 7.402 -18.511 -6.745 1.00 0.00 H new ATOM 0 HD11 LEU A 918 7.393 -20.773 -5.781 1.00 0.00 H new ATOM 0 HD12 LEU A 918 8.241 -19.605 -4.740 1.00 0.00 H new ATOM 0 HD13 LEU A 918 6.597 -20.142 -4.319 1.00 0.00 H new ATOM 0 HD21 LEU A 918 5.533 -20.024 -7.254 1.00 0.00 H new ATOM 0 HD22 LEU A 918 4.616 -19.344 -5.889 1.00 0.00 H new ATOM 0 HD23 LEU A 918 5.037 -18.315 -7.278 1.00 0.00 H new ATOM 61 N ASP A 919 8.552 -14.433 -4.416 1.00 0.00 N ATOM 62 CA ASP A 919 8.433 -13.014 -4.125 1.00 0.00 C ATOM 63 C ASP A 919 8.817 -12.209 -5.368 1.00 0.00 C ATOM 64 O ASP A 919 9.538 -11.217 -5.271 1.00 0.00 O ATOM 65 CB ASP A 919 9.373 -12.605 -2.988 1.00 0.00 C ATOM 66 CG ASP A 919 10.864 -12.759 -3.294 1.00 0.00 C ATOM 67 OD1 ASP A 919 11.358 -13.898 -3.151 1.00 0.00 O ATOM 68 OD2 ASP A 919 11.475 -11.734 -3.665 1.00 0.00 O ATOM 0 H ASP A 919 9.509 -14.766 -4.532 1.00 0.00 H new ATOM 0 HA ASP A 919 7.402 -12.815 -3.831 1.00 0.00 H new ATOM 0 HB2 ASP A 919 9.176 -11.564 -2.731 1.00 0.00 H new ATOM 0 HB3 ASP A 919 9.135 -13.202 -2.107 1.00 0.00 H new ATOM 73 N ARG A 920 8.317 -12.665 -6.507 1.00 0.00 N ATOM 74 CA ARG A 920 8.598 -12.000 -7.767 1.00 0.00 C ATOM 75 C ARG A 920 7.567 -10.899 -8.028 1.00 0.00 C ATOM 76 O ARG A 920 7.929 -9.750 -8.273 1.00 0.00 O ATOM 77 CB ARG A 920 8.579 -12.993 -8.931 1.00 0.00 C ATOM 78 CG ARG A 920 9.932 -13.693 -9.076 1.00 0.00 C ATOM 79 CD ARG A 920 10.844 -12.928 -10.038 1.00 0.00 C ATOM 80 NE ARG A 920 12.255 -13.060 -9.610 1.00 0.00 N ATOM 81 CZ ARG A 920 12.946 -14.220 -9.630 1.00 0.00 C ATOM 82 NH1 ARG A 920 12.361 -15.359 -10.057 1.00 0.00 N ATOM 83 NH2 ARG A 920 14.202 -14.223 -9.225 1.00 0.00 N ATOM 0 H ARG A 920 7.719 -13.488 -6.583 1.00 0.00 H new ATOM 0 HA ARG A 920 9.593 -11.561 -7.695 1.00 0.00 H new ATOM 0 HB2 ARG A 920 7.797 -13.735 -8.768 1.00 0.00 H new ATOM 0 HB3 ARG A 920 8.335 -12.470 -9.856 1.00 0.00 H new ATOM 0 HG2 ARG A 920 10.411 -13.772 -8.100 1.00 0.00 H new ATOM 0 HG3 ARG A 920 9.783 -14.709 -9.441 1.00 0.00 H new ATOM 0 HD2 ARG A 920 10.725 -13.314 -11.050 1.00 0.00 H new ATOM 0 HD3 ARG A 920 10.560 -11.876 -10.063 1.00 0.00 H new ATOM 0 HE ARG A 920 12.735 -12.223 -9.280 1.00 0.00 H new ATOM 0 HH11 ARG A 920 11.390 -15.348 -10.368 1.00 0.00 H new ATOM 0 HH12 ARG A 920 12.890 -16.231 -10.069 1.00 0.00 H new ATOM 0 HH21 ARG A 920 14.636 -13.358 -8.903 1.00 0.00 H new ATOM 0 HH22 ARG A 920 14.739 -15.090 -9.234 1.00 0.00 H new ATOM 96 N SER A 921 6.303 -11.291 -7.966 1.00 0.00 N ATOM 97 CA SER A 921 5.217 -10.352 -8.193 1.00 0.00 C ATOM 98 C SER A 921 5.007 -9.485 -6.950 1.00 0.00 C ATOM 99 O SER A 921 4.661 -8.310 -7.060 1.00 0.00 O ATOM 100 CB SER A 921 3.922 -11.084 -8.554 1.00 0.00 C ATOM 101 OG SER A 921 3.843 -11.373 -9.947 1.00 0.00 O ATOM 0 H SER A 921 6.006 -12.245 -7.762 1.00 0.00 H new ATOM 0 HA SER A 921 5.488 -9.713 -9.033 1.00 0.00 H new ATOM 0 HB2 SER A 921 3.860 -12.013 -7.987 1.00 0.00 H new ATOM 0 HB3 SER A 921 3.067 -10.474 -8.261 1.00 0.00 H new ATOM 0 HG SER A 921 3.003 -11.842 -10.137 1.00 0.00 H new ATOM 107 N ASN A 922 5.226 -10.098 -5.796 1.00 0.00 N ATOM 108 CA ASN A 922 5.065 -9.396 -4.533 1.00 0.00 C ATOM 109 C ASN A 922 6.202 -8.385 -4.369 1.00 0.00 C ATOM 110 O ASN A 922 6.186 -7.573 -3.445 1.00 0.00 O ATOM 111 CB ASN A 922 5.122 -10.367 -3.352 1.00 0.00 C ATOM 112 CG ASN A 922 6.566 -10.766 -3.039 1.00 0.00 C ATOM 113 OD1 ASN A 922 7.471 -10.599 -3.839 1.00 0.00 O ATOM 114 ND2 ASN A 922 6.729 -11.300 -1.832 1.00 0.00 N ATOM 0 H ASN A 922 5.514 -11.073 -5.709 1.00 0.00 H new ATOM 0 HA ASN A 922 4.095 -8.899 -4.544 1.00 0.00 H new ATOM 0 HB2 ASN A 922 4.670 -9.905 -2.474 1.00 0.00 H new ATOM 0 HB3 ASN A 922 4.536 -11.257 -3.580 1.00 0.00 H new ATOM 0 HD21 ASN A 922 7.656 -11.598 -1.527 1.00 0.00 H new ATOM 0 HD22 ASN A 922 5.927 -11.411 -1.211 1.00 0.00 H new ATOM 121 N ASP A 923 7.161 -8.467 -5.279 1.00 0.00 N ATOM 122 CA ASP A 923 8.302 -7.569 -5.247 1.00 0.00 C ATOM 123 C ASP A 923 7.885 -6.200 -5.786 1.00 0.00 C ATOM 124 O ASP A 923 8.211 -5.171 -5.197 1.00 0.00 O ATOM 125 CB ASP A 923 9.442 -8.095 -6.122 1.00 0.00 C ATOM 126 CG ASP A 923 10.845 -7.891 -5.548 1.00 0.00 C ATOM 127 OD1 ASP A 923 10.967 -7.966 -4.306 1.00 0.00 O ATOM 128 OD2 ASP A 923 11.765 -7.666 -6.364 1.00 0.00 O ATOM 0 H ASP A 923 7.171 -9.142 -6.044 1.00 0.00 H new ATOM 0 HA ASP A 923 8.644 -7.496 -4.215 1.00 0.00 H new ATOM 0 HB2 ASP A 923 9.287 -9.160 -6.293 1.00 0.00 H new ATOM 0 HB3 ASP A 923 9.389 -7.605 -7.094 1.00 0.00 H new ATOM 133 N LYS A 924 7.168 -6.232 -6.900 1.00 0.00 N ATOM 134 CA LYS A 924 6.702 -5.006 -7.526 1.00 0.00 C ATOM 135 C LYS A 924 5.666 -4.338 -6.619 1.00 0.00 C ATOM 136 O LYS A 924 5.852 -3.200 -6.192 1.00 0.00 O ATOM 137 CB LYS A 924 6.192 -5.287 -8.940 1.00 0.00 C ATOM 138 CG LYS A 924 7.083 -4.617 -9.988 1.00 0.00 C ATOM 139 CD LYS A 924 6.496 -3.276 -10.432 1.00 0.00 C ATOM 140 CE LYS A 924 7.554 -2.416 -11.126 1.00 0.00 C ATOM 141 NZ LYS A 924 8.486 -1.839 -10.132 1.00 0.00 N ATOM 0 H LYS A 924 6.898 -7.088 -7.385 1.00 0.00 H new ATOM 0 HA LYS A 924 7.525 -4.301 -7.644 1.00 0.00 H new ATOM 0 HB2 LYS A 924 6.166 -6.363 -9.114 1.00 0.00 H new ATOM 0 HB3 LYS A 924 5.170 -4.923 -9.041 1.00 0.00 H new ATOM 0 HG2 LYS A 924 8.081 -4.463 -9.577 1.00 0.00 H new ATOM 0 HG3 LYS A 924 7.192 -5.274 -10.851 1.00 0.00 H new ATOM 0 HD2 LYS A 924 5.660 -3.448 -11.110 1.00 0.00 H new ATOM 0 HD3 LYS A 924 6.100 -2.744 -9.567 1.00 0.00 H new ATOM 0 HE2 LYS A 924 8.108 -3.020 -11.845 1.00 0.00 H new ATOM 0 HE3 LYS A 924 7.070 -1.616 -11.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 9.043 -1.081 -10.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 7.945 -1.448 -9.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 9.127 -2.581 -9.785 1.00 0.00 H new ATOM 155 N VAL A 925 4.597 -5.074 -6.353 1.00 0.00 N ATOM 156 CA VAL A 925 3.532 -4.567 -5.506 1.00 0.00 C ATOM 157 C VAL A 925 4.142 -3.879 -4.283 1.00 0.00 C ATOM 158 O VAL A 925 3.816 -2.731 -3.984 1.00 0.00 O ATOM 159 CB VAL A 925 2.572 -5.701 -5.137 1.00 0.00 C ATOM 160 CG1 VAL A 925 1.504 -5.217 -4.154 1.00 0.00 C ATOM 161 CG2 VAL A 925 1.932 -6.305 -6.388 1.00 0.00 C ATOM 0 H VAL A 925 4.446 -6.018 -6.709 1.00 0.00 H new ATOM 0 HA VAL A 925 2.943 -3.820 -6.039 1.00 0.00 H new ATOM 0 HB VAL A 925 3.150 -6.483 -4.645 1.00 0.00 H new ATOM 0 HG11 VAL A 925 0.835 -6.042 -3.908 1.00 0.00 H new ATOM 0 HG12 VAL A 925 1.984 -4.856 -3.244 1.00 0.00 H new ATOM 0 HG13 VAL A 925 0.931 -4.408 -4.608 1.00 0.00 H new ATOM 0 HG21 VAL A 925 1.255 -7.108 -6.098 1.00 0.00 H new ATOM 0 HG22 VAL A 925 1.374 -5.534 -6.920 1.00 0.00 H new ATOM 0 HG23 VAL A 925 2.710 -6.704 -7.039 1.00 0.00 H new ATOM 171 N TYR A 926 5.017 -4.610 -3.608 1.00 0.00 N ATOM 172 CA TYR A 926 5.676 -4.085 -2.424 1.00 0.00 C ATOM 173 C TYR A 926 6.516 -2.853 -2.765 1.00 0.00 C ATOM 174 O TYR A 926 6.576 -1.903 -1.987 1.00 0.00 O ATOM 175 CB TYR A 926 6.601 -5.198 -1.928 1.00 0.00 C ATOM 176 CG TYR A 926 5.894 -6.273 -1.101 1.00 0.00 C ATOM 177 CD1 TYR A 926 4.666 -6.758 -1.504 1.00 0.00 C ATOM 178 CD2 TYR A 926 6.484 -6.759 0.049 1.00 0.00 C ATOM 179 CE1 TYR A 926 4.001 -7.770 -0.726 1.00 0.00 C ATOM 180 CE2 TYR A 926 5.818 -7.771 0.827 1.00 0.00 C ATOM 181 CZ TYR A 926 4.609 -8.227 0.401 1.00 0.00 C ATOM 182 OH TYR A 926 3.981 -9.183 1.136 1.00 0.00 O ATOM 0 H TYR A 926 5.285 -5.562 -3.859 1.00 0.00 H new ATOM 0 HA TYR A 926 4.941 -3.788 -1.676 1.00 0.00 H new ATOM 0 HB2 TYR A 926 7.077 -5.670 -2.787 1.00 0.00 H new ATOM 0 HB3 TYR A 926 7.395 -4.755 -1.327 1.00 0.00 H new ATOM 0 HD1 TYR A 926 4.204 -6.378 -2.403 1.00 0.00 H new ATOM 0 HD2 TYR A 926 7.445 -6.380 0.365 1.00 0.00 H new ATOM 0 HE1 TYR A 926 3.040 -8.158 -1.031 1.00 0.00 H new ATOM 0 HE2 TYR A 926 6.268 -8.159 1.729 1.00 0.00 H new ATOM 0 HH TYR A 926 4.533 -9.414 1.912 1.00 0.00 H new ATOM 192 N GLU A 927 7.145 -2.910 -3.930 1.00 0.00 N ATOM 193 CA GLU A 927 7.980 -1.810 -4.384 1.00 0.00 C ATOM 194 C GLU A 927 7.117 -0.589 -4.711 1.00 0.00 C ATOM 195 O GLU A 927 7.348 0.497 -4.183 1.00 0.00 O ATOM 196 CB GLU A 927 8.823 -2.225 -5.591 1.00 0.00 C ATOM 197 CG GLU A 927 10.074 -2.988 -5.150 1.00 0.00 C ATOM 198 CD GLU A 927 11.284 -2.056 -5.063 1.00 0.00 C ATOM 199 OE1 GLU A 927 11.197 -1.085 -4.279 1.00 0.00 O ATOM 200 OE2 GLU A 927 12.268 -2.334 -5.782 1.00 0.00 O ATOM 0 H GLU A 927 7.093 -3.700 -4.573 1.00 0.00 H new ATOM 0 HA GLU A 927 8.664 -1.542 -3.579 1.00 0.00 H new ATOM 0 HB2 GLU A 927 8.228 -2.849 -6.257 1.00 0.00 H new ATOM 0 HB3 GLU A 927 9.113 -1.340 -6.158 1.00 0.00 H new ATOM 0 HG2 GLU A 927 9.898 -3.452 -4.180 1.00 0.00 H new ATOM 0 HG3 GLU A 927 10.281 -3.793 -5.855 1.00 0.00 H new ATOM 207 N ASN A 928 6.142 -0.809 -5.581 1.00 0.00 N ATOM 208 CA ASN A 928 5.244 0.259 -5.985 1.00 0.00 C ATOM 209 C ASN A 928 4.700 0.960 -4.739 1.00 0.00 C ATOM 210 O ASN A 928 4.542 2.180 -4.727 1.00 0.00 O ATOM 211 CB ASN A 928 4.056 -0.289 -6.776 1.00 0.00 C ATOM 212 CG ASN A 928 4.528 -1.082 -7.997 1.00 0.00 C ATOM 213 OD1 ASN A 928 4.533 -2.301 -8.014 1.00 0.00 O ATOM 214 ND2 ASN A 928 4.925 -0.322 -9.014 1.00 0.00 N ATOM 0 H ASN A 928 5.954 -1.712 -6.017 1.00 0.00 H new ATOM 0 HA ASN A 928 5.805 0.952 -6.612 1.00 0.00 H new ATOM 0 HB2 ASN A 928 3.451 -0.929 -6.134 1.00 0.00 H new ATOM 0 HB3 ASN A 928 3.418 0.534 -7.097 1.00 0.00 H new ATOM 0 HD21 ASN A 928 5.259 -0.756 -9.875 1.00 0.00 H new ATOM 0 HD22 ASN A 928 4.895 0.694 -8.933 1.00 0.00 H new ATOM 221 N VAL A 929 4.427 0.159 -3.719 1.00 0.00 N ATOM 222 CA VAL A 929 3.903 0.686 -2.471 1.00 0.00 C ATOM 223 C VAL A 929 4.968 1.561 -1.806 1.00 0.00 C ATOM 224 O VAL A 929 4.760 2.758 -1.611 1.00 0.00 O ATOM 225 CB VAL A 929 3.427 -0.460 -1.577 1.00 0.00 C ATOM 226 CG1 VAL A 929 2.927 0.067 -0.230 1.00 0.00 C ATOM 227 CG2 VAL A 929 2.348 -1.289 -2.277 1.00 0.00 C ATOM 0 H VAL A 929 4.559 -0.852 -3.732 1.00 0.00 H new ATOM 0 HA VAL A 929 3.033 1.316 -2.657 1.00 0.00 H new ATOM 0 HB VAL A 929 4.279 -1.112 -1.386 1.00 0.00 H new ATOM 0 HG11 VAL A 929 2.594 -0.768 0.387 1.00 0.00 H new ATOM 0 HG12 VAL A 929 3.735 0.593 0.277 1.00 0.00 H new ATOM 0 HG13 VAL A 929 2.095 0.752 -0.393 1.00 0.00 H new ATOM 0 HG21 VAL A 929 2.027 -2.097 -1.620 1.00 0.00 H new ATOM 0 HG22 VAL A 929 1.495 -0.652 -2.512 1.00 0.00 H new ATOM 0 HG23 VAL A 929 2.752 -1.709 -3.198 1.00 0.00 H new ATOM 237 N THR A 930 6.085 0.929 -1.475 1.00 0.00 N ATOM 238 CA THR A 930 7.182 1.635 -0.836 1.00 0.00 C ATOM 239 C THR A 930 7.440 2.970 -1.538 1.00 0.00 C ATOM 240 O THR A 930 7.288 4.031 -0.936 1.00 0.00 O ATOM 241 CB THR A 930 8.400 0.708 -0.827 1.00 0.00 C ATOM 242 OG1 THR A 930 8.283 -0.029 -2.041 1.00 0.00 O ATOM 243 CG2 THR A 930 8.316 -0.359 0.266 1.00 0.00 C ATOM 0 H THR A 930 6.253 -0.064 -1.637 1.00 0.00 H new ATOM 0 HA THR A 930 6.940 1.888 0.196 1.00 0.00 H new ATOM 0 HB THR A 930 9.305 1.299 -0.688 1.00 0.00 H new ATOM 0 HG1 THR A 930 7.928 -0.922 -1.849 1.00 0.00 H new ATOM 0 HG21 THR A 930 9.204 -0.989 0.228 1.00 0.00 H new ATOM 0 HG22 THR A 930 8.255 0.123 1.241 1.00 0.00 H new ATOM 0 HG23 THR A 930 7.429 -0.972 0.108 1.00 0.00 H new ATOM 251 N GLY A 931 7.825 2.872 -2.802 1.00 0.00 N ATOM 252 CA GLY A 931 8.104 4.058 -3.593 1.00 0.00 C ATOM 253 C GLY A 931 6.955 5.063 -3.500 1.00 0.00 C ATOM 254 O GLY A 931 7.166 6.268 -3.633 1.00 0.00 O ATOM 0 H GLY A 931 7.950 1.989 -3.298 1.00 0.00 H new ATOM 0 HA2 GLY A 931 9.027 4.522 -3.245 1.00 0.00 H new ATOM 0 HA3 GLY A 931 8.262 3.776 -4.634 1.00 0.00 H new ATOM 258 N LEU A 932 5.763 4.531 -3.272 1.00 0.00 N ATOM 259 CA LEU A 932 4.579 5.367 -3.159 1.00 0.00 C ATOM 260 C LEU A 932 4.606 6.103 -1.818 1.00 0.00 C ATOM 261 O LEU A 932 4.646 7.331 -1.781 1.00 0.00 O ATOM 262 CB LEU A 932 3.314 4.536 -3.380 1.00 0.00 C ATOM 263 CG LEU A 932 2.147 4.826 -2.433 1.00 0.00 C ATOM 264 CD1 LEU A 932 1.671 6.273 -2.578 1.00 0.00 C ATOM 265 CD2 LEU A 932 1.009 3.825 -2.642 1.00 0.00 C ATOM 0 H LEU A 932 5.591 3.532 -3.162 1.00 0.00 H new ATOM 0 HA LEU A 932 4.573 6.128 -3.940 1.00 0.00 H new ATOM 0 HB2 LEU A 932 2.974 4.694 -4.403 1.00 0.00 H new ATOM 0 HB3 LEU A 932 3.575 3.482 -3.290 1.00 0.00 H new ATOM 0 HG LEU A 932 2.499 4.703 -1.409 1.00 0.00 H new ATOM 0 HD11 LEU A 932 0.841 6.453 -1.894 1.00 0.00 H new ATOM 0 HD12 LEU A 932 2.491 6.951 -2.341 1.00 0.00 H new ATOM 0 HD13 LEU A 932 1.341 6.447 -3.602 1.00 0.00 H new ATOM 0 HD21 LEU A 932 0.193 4.054 -1.957 1.00 0.00 H new ATOM 0 HD22 LEU A 932 0.650 3.891 -3.669 1.00 0.00 H new ATOM 0 HD23 LEU A 932 1.372 2.816 -2.449 1.00 0.00 H new ATOM 277 N VAL A 933 4.583 5.320 -0.749 1.00 0.00 N ATOM 278 CA VAL A 933 4.603 5.882 0.591 1.00 0.00 C ATOM 279 C VAL A 933 5.884 6.699 0.777 1.00 0.00 C ATOM 280 O VAL A 933 5.876 7.726 1.453 1.00 0.00 O ATOM 281 CB VAL A 933 4.449 4.768 1.628 1.00 0.00 C ATOM 282 CG1 VAL A 933 3.036 4.182 1.597 1.00 0.00 C ATOM 283 CG2 VAL A 933 5.500 3.675 1.420 1.00 0.00 C ATOM 0 H VAL A 933 4.551 4.301 -0.784 1.00 0.00 H new ATOM 0 HA VAL A 933 3.761 6.559 0.734 1.00 0.00 H new ATOM 0 HB VAL A 933 4.610 5.204 2.614 1.00 0.00 H new ATOM 0 HG11 VAL A 933 2.953 3.392 2.344 1.00 0.00 H new ATOM 0 HG12 VAL A 933 2.312 4.966 1.817 1.00 0.00 H new ATOM 0 HG13 VAL A 933 2.835 3.769 0.608 1.00 0.00 H new ATOM 0 HG21 VAL A 933 5.368 2.896 2.170 1.00 0.00 H new ATOM 0 HG22 VAL A 933 5.385 3.244 0.425 1.00 0.00 H new ATOM 0 HG23 VAL A 933 6.497 4.106 1.516 1.00 0.00 H new ATOM 293 N LYS A 934 6.953 6.211 0.164 1.00 0.00 N ATOM 294 CA LYS A 934 8.238 6.883 0.254 1.00 0.00 C ATOM 295 C LYS A 934 8.087 8.328 -0.225 1.00 0.00 C ATOM 296 O LYS A 934 8.662 9.244 0.363 1.00 0.00 O ATOM 297 CB LYS A 934 9.309 6.094 -0.502 1.00 0.00 C ATOM 298 CG LYS A 934 9.558 4.736 0.159 1.00 0.00 C ATOM 299 CD LYS A 934 10.956 4.675 0.778 1.00 0.00 C ATOM 300 CE LYS A 934 11.076 5.643 1.956 1.00 0.00 C ATOM 301 NZ LYS A 934 12.212 5.262 2.826 1.00 0.00 N ATOM 0 H LYS A 934 6.955 5.359 -0.396 1.00 0.00 H new ATOM 0 HA LYS A 934 8.575 6.923 1.290 1.00 0.00 H new ATOM 0 HB2 LYS A 934 8.996 5.947 -1.536 1.00 0.00 H new ATOM 0 HB3 LYS A 934 10.237 6.666 -0.528 1.00 0.00 H new ATOM 0 HG2 LYS A 934 8.807 4.560 0.929 1.00 0.00 H new ATOM 0 HG3 LYS A 934 9.449 3.942 -0.580 1.00 0.00 H new ATOM 0 HD2 LYS A 934 11.165 3.659 1.114 1.00 0.00 H new ATOM 0 HD3 LYS A 934 11.703 4.921 0.023 1.00 0.00 H new ATOM 0 HE2 LYS A 934 11.218 6.659 1.587 1.00 0.00 H new ATOM 0 HE3 LYS A 934 10.151 5.640 2.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 12.280 5.929 3.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 12.061 4.301 3.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 13.094 5.288 2.276 1.00 0.00 H new ATOM 315 N ALA A 935 7.311 8.489 -1.287 1.00 0.00 N ATOM 316 CA ALA A 935 7.078 9.807 -1.851 1.00 0.00 C ATOM 317 C ALA A 935 6.048 10.548 -0.996 1.00 0.00 C ATOM 318 O ALA A 935 6.219 11.729 -0.697 1.00 0.00 O ATOM 319 CB ALA A 935 6.634 9.668 -3.308 1.00 0.00 C ATOM 0 H ALA A 935 6.836 7.728 -1.772 1.00 0.00 H new ATOM 0 HA ALA A 935 7.996 10.395 -1.845 1.00 0.00 H new ATOM 0 HB1 ALA A 935 6.459 10.657 -3.731 1.00 0.00 H new ATOM 0 HB2 ALA A 935 7.412 9.162 -3.879 1.00 0.00 H new ATOM 0 HB3 ALA A 935 5.714 9.086 -3.354 1.00 0.00 H new ATOM 325 N VAL A 936 5.003 9.824 -0.625 1.00 0.00 N ATOM 326 CA VAL A 936 3.945 10.398 0.190 1.00 0.00 C ATOM 327 C VAL A 936 4.562 11.326 1.237 1.00 0.00 C ATOM 328 O VAL A 936 4.045 12.413 1.490 1.00 0.00 O ATOM 329 CB VAL A 936 3.096 9.284 0.805 1.00 0.00 C ATOM 330 CG1 VAL A 936 2.337 9.788 2.034 1.00 0.00 C ATOM 331 CG2 VAL A 936 2.134 8.693 -0.229 1.00 0.00 C ATOM 0 H VAL A 936 4.866 8.844 -0.874 1.00 0.00 H new ATOM 0 HA VAL A 936 3.274 10.999 -0.423 1.00 0.00 H new ATOM 0 HB VAL A 936 3.769 8.490 1.129 1.00 0.00 H new ATOM 0 HG11 VAL A 936 1.741 8.976 2.452 1.00 0.00 H new ATOM 0 HG12 VAL A 936 3.048 10.139 2.782 1.00 0.00 H new ATOM 0 HG13 VAL A 936 1.680 10.608 1.745 1.00 0.00 H new ATOM 0 HG21 VAL A 936 1.542 7.903 0.234 1.00 0.00 H new ATOM 0 HG22 VAL A 936 1.470 9.475 -0.597 1.00 0.00 H new ATOM 0 HG23 VAL A 936 2.704 8.279 -1.061 1.00 0.00 H new ATOM 341 N ILE A 937 5.660 10.865 1.818 1.00 0.00 N ATOM 342 CA ILE A 937 6.353 11.641 2.833 1.00 0.00 C ATOM 343 C ILE A 937 7.305 12.626 2.153 1.00 0.00 C ATOM 344 O ILE A 937 7.103 13.838 2.222 1.00 0.00 O ATOM 345 CB ILE A 937 7.041 10.715 3.838 1.00 0.00 C ATOM 346 CG1 ILE A 937 6.014 9.879 4.606 1.00 0.00 C ATOM 347 CG2 ILE A 937 7.953 11.507 4.777 1.00 0.00 C ATOM 348 CD1 ILE A 937 6.665 8.635 5.214 1.00 0.00 C ATOM 0 H ILE A 937 6.087 9.964 1.605 1.00 0.00 H new ATOM 0 HA ILE A 937 5.643 12.231 3.413 1.00 0.00 H new ATOM 0 HB ILE A 937 7.673 10.020 3.285 1.00 0.00 H new ATOM 0 HG12 ILE A 937 5.566 10.482 5.396 1.00 0.00 H new ATOM 0 HG13 ILE A 937 5.208 9.581 3.936 1.00 0.00 H new ATOM 0 HG21 ILE A 937 8.430 10.826 5.481 1.00 0.00 H new ATOM 0 HG22 ILE A 937 8.718 12.020 4.194 1.00 0.00 H new ATOM 0 HG23 ILE A 937 7.362 12.240 5.325 1.00 0.00 H new ATOM 0 HD11 ILE A 937 5.914 8.058 5.754 1.00 0.00 H new ATOM 0 HD12 ILE A 937 7.091 8.022 4.420 1.00 0.00 H new ATOM 0 HD13 ILE A 937 7.455 8.937 5.902 1.00 0.00 H new ATOM 360 N GLU A 938 8.322 12.070 1.511 1.00 0.00 N ATOM 361 CA GLU A 938 9.306 12.886 0.819 1.00 0.00 C ATOM 362 C GLU A 938 8.650 14.151 0.262 1.00 0.00 C ATOM 363 O GLU A 938 9.226 15.235 0.332 1.00 0.00 O ATOM 364 CB GLU A 938 9.994 12.090 -0.292 1.00 0.00 C ATOM 365 CG GLU A 938 11.514 12.117 -0.125 1.00 0.00 C ATOM 366 CD GLU A 938 12.039 10.758 0.344 1.00 0.00 C ATOM 367 OE1 GLU A 938 11.787 9.772 -0.382 1.00 0.00 O ATOM 368 OE2 GLU A 938 12.679 10.737 1.417 1.00 0.00 O ATOM 0 H GLU A 938 8.486 11.065 1.455 1.00 0.00 H new ATOM 0 HA GLU A 938 10.072 13.183 1.536 1.00 0.00 H new ATOM 0 HB2 GLU A 938 9.641 11.059 -0.277 1.00 0.00 H new ATOM 0 HB3 GLU A 938 9.724 12.506 -1.263 1.00 0.00 H new ATOM 0 HG2 GLU A 938 11.983 12.385 -1.072 1.00 0.00 H new ATOM 0 HG3 GLU A 938 11.791 12.886 0.596 1.00 0.00 H new ATOM 375 N MET A 939 7.454 13.969 -0.279 1.00 0.00 N ATOM 376 CA MET A 939 6.714 15.083 -0.848 1.00 0.00 C ATOM 377 C MET A 939 6.657 16.260 0.128 1.00 0.00 C ATOM 378 O MET A 939 7.304 17.283 -0.090 1.00 0.00 O ATOM 379 CB MET A 939 5.291 14.631 -1.186 1.00 0.00 C ATOM 380 CG MET A 939 4.399 15.829 -1.514 1.00 0.00 C ATOM 381 SD MET A 939 2.702 15.300 -1.678 1.00 0.00 S ATOM 382 CE MET A 939 2.860 14.174 -3.054 1.00 0.00 C ATOM 0 H MET A 939 6.979 13.068 -0.335 1.00 0.00 H new ATOM 0 HA MET A 939 7.226 15.410 -1.753 1.00 0.00 H new ATOM 0 HB2 MET A 939 5.315 13.947 -2.035 1.00 0.00 H new ATOM 0 HB3 MET A 939 4.871 14.080 -0.345 1.00 0.00 H new ATOM 0 HG2 MET A 939 4.480 16.579 -0.728 1.00 0.00 H new ATOM 0 HG3 MET A 939 4.733 16.299 -2.439 1.00 0.00 H new ATOM 0 HE1 MET A 939 1.937 14.176 -3.633 1.00 0.00 H new ATOM 0 HE2 MET A 939 3.688 14.490 -3.689 1.00 0.00 H new ATOM 0 HE3 MET A 939 3.052 13.168 -2.681 1.00 0.00 H new ATOM 392 N SER A 940 5.879 16.075 1.184 1.00 0.00 N ATOM 393 CA SER A 940 5.729 17.108 2.194 1.00 0.00 C ATOM 394 C SER A 940 7.083 17.763 2.477 1.00 0.00 C ATOM 395 O SER A 940 7.148 18.946 2.806 1.00 0.00 O ATOM 396 CB SER A 940 5.136 16.537 3.483 1.00 0.00 C ATOM 397 OG SER A 940 3.869 15.923 3.262 1.00 0.00 O ATOM 0 H SER A 940 5.345 15.224 1.362 1.00 0.00 H new ATOM 0 HA SER A 940 5.040 17.862 1.813 1.00 0.00 H new ATOM 0 HB2 SER A 940 5.825 15.805 3.906 1.00 0.00 H new ATOM 0 HB3 SER A 940 5.029 17.335 4.217 1.00 0.00 H new ATOM 0 HG SER A 940 3.865 15.028 3.661 1.00 0.00 H new ATOM 403 N SER A 941 8.131 16.964 2.339 1.00 0.00 N ATOM 404 CA SER A 941 9.479 17.451 2.575 1.00 0.00 C ATOM 405 C SER A 941 9.849 18.499 1.525 1.00 0.00 C ATOM 406 O SER A 941 10.336 19.577 1.863 1.00 0.00 O ATOM 407 CB SER A 941 10.490 16.303 2.558 1.00 0.00 C ATOM 408 OG SER A 941 11.605 16.560 3.408 1.00 0.00 O ATOM 0 H SER A 941 8.074 15.983 2.067 1.00 0.00 H new ATOM 0 HA SER A 941 9.508 17.911 3.563 1.00 0.00 H new ATOM 0 HB2 SER A 941 9.999 15.383 2.873 1.00 0.00 H new ATOM 0 HB3 SER A 941 10.841 16.144 1.538 1.00 0.00 H new ATOM 0 HG SER A 941 12.226 15.803 3.370 1.00 0.00 H new ATOM 414 N LYS A 942 9.604 18.147 0.271 1.00 0.00 N ATOM 415 CA LYS A 942 9.904 19.045 -0.831 1.00 0.00 C ATOM 416 C LYS A 942 8.606 19.676 -1.338 1.00 0.00 C ATOM 417 O LYS A 942 8.529 20.106 -2.488 1.00 0.00 O ATOM 418 CB LYS A 942 10.698 18.313 -1.916 1.00 0.00 C ATOM 419 CG LYS A 942 9.907 17.125 -2.466 1.00 0.00 C ATOM 420 CD LYS A 942 10.181 16.927 -3.958 1.00 0.00 C ATOM 421 CE LYS A 942 8.882 16.969 -4.765 1.00 0.00 C ATOM 422 NZ LYS A 942 9.174 17.050 -6.214 1.00 0.00 N ATOM 0 H LYS A 942 9.201 17.252 -0.006 1.00 0.00 H new ATOM 0 HA LYS A 942 10.544 19.861 -0.495 1.00 0.00 H new ATOM 0 HB2 LYS A 942 10.935 19.003 -2.726 1.00 0.00 H new ATOM 0 HB3 LYS A 942 11.646 17.965 -1.506 1.00 0.00 H new ATOM 0 HG2 LYS A 942 10.176 16.221 -1.920 1.00 0.00 H new ATOM 0 HG3 LYS A 942 8.841 17.288 -2.307 1.00 0.00 H new ATOM 0 HD2 LYS A 942 10.859 17.703 -4.313 1.00 0.00 H new ATOM 0 HD3 LYS A 942 10.680 15.971 -4.116 1.00 0.00 H new ATOM 0 HE2 LYS A 942 8.289 16.079 -4.557 1.00 0.00 H new ATOM 0 HE3 LYS A 942 8.285 17.828 -4.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 8.896 17.986 -6.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 10.192 16.907 -6.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 8.639 16.314 -6.718 1.00 0.00 H new ATOM 436 N ILE A 943 7.619 19.711 -0.456 1.00 0.00 N ATOM 437 CA ILE A 943 6.328 20.282 -0.799 1.00 0.00 C ATOM 438 C ILE A 943 6.294 21.750 -0.369 1.00 0.00 C ATOM 439 O ILE A 943 5.973 22.628 -1.170 1.00 0.00 O ATOM 440 CB ILE A 943 5.195 19.442 -0.207 1.00 0.00 C ATOM 441 CG1 ILE A 943 4.066 19.249 -1.222 1.00 0.00 C ATOM 442 CG2 ILE A 943 4.690 20.048 1.104 1.00 0.00 C ATOM 443 CD1 ILE A 943 3.155 20.478 -1.268 1.00 0.00 C ATOM 0 H ILE A 943 7.687 19.353 0.497 1.00 0.00 H new ATOM 0 HA ILE A 943 6.178 20.261 -1.878 1.00 0.00 H new ATOM 0 HB ILE A 943 5.590 18.453 0.026 1.00 0.00 H new ATOM 0 HG12 ILE A 943 4.488 19.067 -2.210 1.00 0.00 H new ATOM 0 HG13 ILE A 943 3.481 18.368 -0.958 1.00 0.00 H new ATOM 0 HG21 ILE A 943 3.885 19.431 1.504 1.00 0.00 H new ATOM 0 HG22 ILE A 943 5.507 20.089 1.824 1.00 0.00 H new ATOM 0 HG23 ILE A 943 4.318 21.056 0.919 1.00 0.00 H new ATOM 0 HD11 ILE A 943 2.361 20.315 -1.997 1.00 0.00 H new ATOM 0 HD12 ILE A 943 2.716 20.643 -0.284 1.00 0.00 H new ATOM 0 HD13 ILE A 943 3.738 21.353 -1.556 1.00 0.00 H new ATOM 455 N GLN A 944 6.629 21.972 0.893 1.00 0.00 N ATOM 456 CA GLN A 944 6.641 23.318 1.439 1.00 0.00 C ATOM 457 C GLN A 944 7.277 24.290 0.442 1.00 0.00 C ATOM 458 O GLN A 944 6.690 25.319 0.112 1.00 0.00 O ATOM 459 CB GLN A 944 7.369 23.358 2.784 1.00 0.00 C ATOM 460 CG GLN A 944 6.457 23.905 3.885 1.00 0.00 C ATOM 461 CD GLN A 944 7.087 23.710 5.266 1.00 0.00 C ATOM 462 OE1 GLN A 944 8.257 23.394 5.404 1.00 0.00 O ATOM 463 NE2 GLN A 944 6.247 23.915 6.277 1.00 0.00 N ATOM 0 H GLN A 944 6.894 21.242 1.554 1.00 0.00 H new ATOM 0 HA GLN A 944 5.610 23.628 1.612 1.00 0.00 H new ATOM 0 HB2 GLN A 944 7.705 22.356 3.050 1.00 0.00 H new ATOM 0 HB3 GLN A 944 8.259 23.981 2.701 1.00 0.00 H new ATOM 0 HG2 GLN A 944 6.269 24.965 3.713 1.00 0.00 H new ATOM 0 HG3 GLN A 944 5.492 23.400 3.847 1.00 0.00 H new ATOM 0 HE21 GLN A 944 5.279 24.178 6.091 1.00 0.00 H new ATOM 0 HE22 GLN A 944 6.571 23.809 7.238 1.00 0.00 H new ATOM 472 N PRO A 945 8.501 23.918 -0.020 1.00 0.00 N ATOM 473 CA PRO A 945 9.224 24.745 -0.973 1.00 0.00 C ATOM 474 C PRO A 945 8.619 24.624 -2.373 1.00 0.00 C ATOM 475 O PRO A 945 8.300 25.630 -3.004 1.00 0.00 O ATOM 476 CB PRO A 945 10.662 24.259 -0.903 1.00 0.00 C ATOM 477 CG PRO A 945 10.606 22.880 -0.265 1.00 0.00 C ATOM 478 CD PRO A 945 9.227 22.706 0.349 1.00 0.00 C ATOM 0 HA PRO A 945 9.165 25.808 -0.738 1.00 0.00 H new ATOM 0 HB2 PRO A 945 11.107 24.212 -1.897 1.00 0.00 H new ATOM 0 HB3 PRO A 945 11.275 24.938 -0.311 1.00 0.00 H new ATOM 0 HG2 PRO A 945 10.792 22.107 -1.010 1.00 0.00 H new ATOM 0 HG3 PRO A 945 11.379 22.781 0.497 1.00 0.00 H new ATOM 0 HD2 PRO A 945 8.732 21.815 -0.036 1.00 0.00 H new ATOM 0 HD3 PRO A 945 9.287 22.594 1.432 1.00 0.00 H new ATOM 486 N ALA A 946 8.480 23.384 -2.818 1.00 0.00 N ATOM 487 CA ALA A 946 7.919 23.118 -4.132 1.00 0.00 C ATOM 488 C ALA A 946 6.839 24.157 -4.440 1.00 0.00 C ATOM 489 O ALA A 946 5.984 24.436 -3.601 1.00 0.00 O ATOM 490 CB ALA A 946 7.381 21.687 -4.178 1.00 0.00 C ATOM 0 H ALA A 946 8.746 22.552 -2.292 1.00 0.00 H new ATOM 0 HA ALA A 946 8.687 23.202 -4.901 1.00 0.00 H new ATOM 0 HB1 ALA A 946 6.960 21.488 -5.164 1.00 0.00 H new ATOM 0 HB2 ALA A 946 8.193 20.987 -3.982 1.00 0.00 H new ATOM 0 HB3 ALA A 946 6.606 21.565 -3.421 1.00 0.00 H new ATOM 496 N PRO A 947 6.915 24.716 -5.677 1.00 0.00 N ATOM 497 CA PRO A 947 5.954 25.718 -6.107 1.00 0.00 C ATOM 498 C PRO A 947 4.606 25.077 -6.441 1.00 0.00 C ATOM 499 O PRO A 947 4.462 23.857 -6.377 1.00 0.00 O ATOM 500 CB PRO A 947 6.602 26.397 -7.302 1.00 0.00 C ATOM 501 CG PRO A 947 7.687 25.448 -7.784 1.00 0.00 C ATOM 502 CD PRO A 947 7.914 24.410 -6.697 1.00 0.00 C ATOM 0 HA PRO A 947 5.727 26.445 -5.328 1.00 0.00 H new ATOM 0 HB2 PRO A 947 5.871 26.585 -8.088 1.00 0.00 H new ATOM 0 HB3 PRO A 947 7.024 27.362 -7.021 1.00 0.00 H new ATOM 0 HG2 PRO A 947 7.387 24.967 -8.715 1.00 0.00 H new ATOM 0 HG3 PRO A 947 8.608 25.994 -7.989 1.00 0.00 H new ATOM 0 HD2 PRO A 947 7.788 23.398 -7.083 1.00 0.00 H new ATOM 0 HD3 PRO A 947 8.924 24.474 -6.293 1.00 0.00 H new ATOM 510 N PRO A 948 3.628 25.950 -6.800 1.00 0.00 N ATOM 511 CA PRO A 948 2.296 25.482 -7.145 1.00 0.00 C ATOM 512 C PRO A 948 2.282 24.843 -8.535 1.00 0.00 C ATOM 513 O PRO A 948 1.342 24.132 -8.886 1.00 0.00 O ATOM 514 CB PRO A 948 1.409 26.713 -7.049 1.00 0.00 C ATOM 515 CG PRO A 948 2.347 27.908 -7.109 1.00 0.00 C ATOM 516 CD PRO A 948 3.762 27.401 -6.887 1.00 0.00 C ATOM 0 HA PRO A 948 1.940 24.698 -6.477 1.00 0.00 H new ATOM 0 HB2 PRO A 948 0.689 26.740 -7.867 1.00 0.00 H new ATOM 0 HB3 PRO A 948 0.837 26.711 -6.121 1.00 0.00 H new ATOM 0 HG2 PRO A 948 2.268 28.408 -8.075 1.00 0.00 H new ATOM 0 HG3 PRO A 948 2.080 28.641 -6.348 1.00 0.00 H new ATOM 0 HD2 PRO A 948 4.419 27.689 -7.708 1.00 0.00 H new ATOM 0 HD3 PRO A 948 4.192 27.814 -5.974 1.00 0.00 H new ATOM 524 N GLU A 949 3.337 25.118 -9.288 1.00 0.00 N ATOM 525 CA GLU A 949 3.458 24.578 -10.632 1.00 0.00 C ATOM 526 C GLU A 949 4.088 23.184 -10.589 1.00 0.00 C ATOM 527 O GLU A 949 3.866 22.371 -11.485 1.00 0.00 O ATOM 528 CB GLU A 949 4.266 25.518 -11.529 1.00 0.00 C ATOM 529 CG GLU A 949 3.471 25.899 -12.780 1.00 0.00 C ATOM 530 CD GLU A 949 4.402 26.129 -13.972 1.00 0.00 C ATOM 531 OE1 GLU A 949 5.247 27.044 -13.864 1.00 0.00 O ATOM 532 OE2 GLU A 949 4.248 25.385 -14.964 1.00 0.00 O ATOM 0 H GLU A 949 4.116 25.707 -8.993 1.00 0.00 H new ATOM 0 HA GLU A 949 2.459 24.491 -11.059 1.00 0.00 H new ATOM 0 HB2 GLU A 949 4.531 26.418 -10.974 1.00 0.00 H new ATOM 0 HB3 GLU A 949 5.200 25.036 -11.820 1.00 0.00 H new ATOM 0 HG2 GLU A 949 2.759 25.109 -13.017 1.00 0.00 H new ATOM 0 HG3 GLU A 949 2.892 26.802 -12.586 1.00 0.00 H new ATOM 539 N GLU A 950 4.861 22.951 -9.538 1.00 0.00 N ATOM 540 CA GLU A 950 5.524 21.670 -9.367 1.00 0.00 C ATOM 541 C GLU A 950 4.725 20.782 -8.412 1.00 0.00 C ATOM 542 O GLU A 950 5.058 19.613 -8.220 1.00 0.00 O ATOM 543 CB GLU A 950 6.959 21.857 -8.870 1.00 0.00 C ATOM 544 CG GLU A 950 7.914 20.893 -9.576 1.00 0.00 C ATOM 545 CD GLU A 950 7.991 19.557 -8.834 1.00 0.00 C ATOM 546 OE1 GLU A 950 8.534 19.564 -7.708 1.00 0.00 O ATOM 547 OE2 GLU A 950 7.506 18.559 -9.409 1.00 0.00 O ATOM 0 H GLU A 950 5.043 23.628 -8.797 1.00 0.00 H new ATOM 0 HA GLU A 950 5.572 21.176 -10.337 1.00 0.00 H new ATOM 0 HB2 GLU A 950 7.278 22.884 -9.046 1.00 0.00 H new ATOM 0 HB3 GLU A 950 6.999 21.691 -7.793 1.00 0.00 H new ATOM 0 HG2 GLU A 950 7.577 20.726 -10.599 1.00 0.00 H new ATOM 0 HG3 GLU A 950 8.907 21.338 -9.636 1.00 0.00 H new ATOM 554 N TYR A 951 3.685 21.370 -7.839 1.00 0.00 N ATOM 555 CA TYR A 951 2.836 20.646 -6.908 1.00 0.00 C ATOM 556 C TYR A 951 1.684 19.955 -7.641 1.00 0.00 C ATOM 557 O TYR A 951 1.394 18.787 -7.387 1.00 0.00 O ATOM 558 CB TYR A 951 2.261 21.697 -5.956 1.00 0.00 C ATOM 559 CG TYR A 951 1.641 21.114 -4.686 1.00 0.00 C ATOM 560 CD1 TYR A 951 1.555 19.745 -4.525 1.00 0.00 C ATOM 561 CD2 TYR A 951 1.167 21.955 -3.700 1.00 0.00 C ATOM 562 CE1 TYR A 951 0.971 19.196 -3.329 1.00 0.00 C ATOM 563 CE2 TYR A 951 0.582 21.406 -2.504 1.00 0.00 C ATOM 564 CZ TYR A 951 0.514 20.053 -2.377 1.00 0.00 C ATOM 565 OH TYR A 951 -0.038 19.535 -1.248 1.00 0.00 O ATOM 0 H TYR A 951 3.411 22.339 -8.001 1.00 0.00 H new ATOM 0 HA TYR A 951 3.406 19.877 -6.387 1.00 0.00 H new ATOM 0 HB2 TYR A 951 3.054 22.390 -5.675 1.00 0.00 H new ATOM 0 HB3 TYR A 951 1.504 22.276 -6.485 1.00 0.00 H new ATOM 0 HD1 TYR A 951 1.926 19.086 -5.296 1.00 0.00 H new ATOM 0 HD2 TYR A 951 1.235 23.026 -3.825 1.00 0.00 H new ATOM 0 HE1 TYR A 951 0.897 18.127 -3.191 1.00 0.00 H new ATOM 0 HE2 TYR A 951 0.206 22.053 -1.726 1.00 0.00 H new ATOM 0 HH TYR A 951 0.325 18.639 -1.088 1.00 0.00 H new ATOM 575 N VAL A 952 1.058 20.706 -8.535 1.00 0.00 N ATOM 576 CA VAL A 952 -0.056 20.181 -9.306 1.00 0.00 C ATOM 577 C VAL A 952 0.333 18.824 -9.895 1.00 0.00 C ATOM 578 O VAL A 952 -0.423 17.859 -9.792 1.00 0.00 O ATOM 579 CB VAL A 952 -0.480 21.195 -10.370 1.00 0.00 C ATOM 580 CG1 VAL A 952 -0.842 20.495 -11.682 1.00 0.00 C ATOM 581 CG2 VAL A 952 -1.640 22.059 -9.872 1.00 0.00 C ATOM 0 H VAL A 952 1.301 21.675 -8.743 1.00 0.00 H new ATOM 0 HA VAL A 952 -0.923 20.021 -8.665 1.00 0.00 H new ATOM 0 HB VAL A 952 0.368 21.852 -10.564 1.00 0.00 H new ATOM 0 HG11 VAL A 952 -1.140 21.239 -12.421 1.00 0.00 H new ATOM 0 HG12 VAL A 952 0.023 19.943 -12.051 1.00 0.00 H new ATOM 0 HG13 VAL A 952 -1.667 19.804 -11.510 1.00 0.00 H new ATOM 0 HG21 VAL A 952 -1.922 22.771 -10.647 1.00 0.00 H new ATOM 0 HG22 VAL A 952 -2.493 21.422 -9.636 1.00 0.00 H new ATOM 0 HG23 VAL A 952 -1.333 22.600 -8.977 1.00 0.00 H new ATOM 591 N PRO A 953 1.543 18.792 -10.516 1.00 0.00 N ATOM 592 CA PRO A 953 2.041 17.569 -11.122 1.00 0.00 C ATOM 593 C PRO A 953 2.524 16.585 -10.054 1.00 0.00 C ATOM 594 O PRO A 953 2.088 15.436 -10.021 1.00 0.00 O ATOM 595 CB PRO A 953 3.148 18.018 -12.061 1.00 0.00 C ATOM 596 CG PRO A 953 3.543 19.413 -11.604 1.00 0.00 C ATOM 597 CD PRO A 953 2.464 19.915 -10.658 1.00 0.00 C ATOM 0 HA PRO A 953 1.270 17.026 -11.668 1.00 0.00 H new ATOM 0 HB2 PRO A 953 3.998 17.337 -12.016 1.00 0.00 H new ATOM 0 HB3 PRO A 953 2.803 18.029 -13.095 1.00 0.00 H new ATOM 0 HG2 PRO A 953 4.511 19.391 -11.103 1.00 0.00 H new ATOM 0 HG3 PRO A 953 3.642 20.081 -12.459 1.00 0.00 H new ATOM 0 HD2 PRO A 953 2.885 20.206 -9.696 1.00 0.00 H new ATOM 0 HD3 PRO A 953 1.959 20.792 -11.063 1.00 0.00 H new ATOM 605 N MET A 954 3.419 17.073 -9.207 1.00 0.00 N ATOM 606 CA MET A 954 3.966 16.252 -8.141 1.00 0.00 C ATOM 607 C MET A 954 2.920 15.268 -7.615 1.00 0.00 C ATOM 608 O MET A 954 3.171 14.066 -7.548 1.00 0.00 O ATOM 609 CB MET A 954 4.444 17.150 -6.998 1.00 0.00 C ATOM 610 CG MET A 954 4.493 16.378 -5.678 1.00 0.00 C ATOM 611 SD MET A 954 5.858 16.956 -4.684 1.00 0.00 S ATOM 612 CE MET A 954 5.363 18.652 -4.433 1.00 0.00 C ATOM 0 H MET A 954 3.779 18.027 -9.238 1.00 0.00 H new ATOM 0 HA MET A 954 4.804 15.682 -8.541 1.00 0.00 H new ATOM 0 HB2 MET A 954 5.433 17.544 -7.230 1.00 0.00 H new ATOM 0 HB3 MET A 954 3.775 18.005 -6.899 1.00 0.00 H new ATOM 0 HG2 MET A 954 3.557 16.509 -5.136 1.00 0.00 H new ATOM 0 HG3 MET A 954 4.601 15.311 -5.875 1.00 0.00 H new ATOM 0 HE1 MET A 954 5.987 19.103 -3.661 1.00 0.00 H new ATOM 0 HE2 MET A 954 5.480 19.207 -5.364 1.00 0.00 H new ATOM 0 HE3 MET A 954 4.319 18.684 -4.120 1.00 0.00 H new ATOM 622 N VAL A 955 1.768 15.816 -7.254 1.00 0.00 N ATOM 623 CA VAL A 955 0.683 15.001 -6.735 1.00 0.00 C ATOM 624 C VAL A 955 0.230 14.016 -7.814 1.00 0.00 C ATOM 625 O VAL A 955 0.209 12.807 -7.587 1.00 0.00 O ATOM 626 CB VAL A 955 -0.450 15.898 -6.231 1.00 0.00 C ATOM 627 CG1 VAL A 955 -1.803 15.194 -6.354 1.00 0.00 C ATOM 628 CG2 VAL A 955 -0.194 16.347 -4.791 1.00 0.00 C ATOM 0 H VAL A 955 1.563 16.814 -7.311 1.00 0.00 H new ATOM 0 HA VAL A 955 1.021 14.415 -5.880 1.00 0.00 H new ATOM 0 HB VAL A 955 -0.478 16.788 -6.860 1.00 0.00 H new ATOM 0 HG11 VAL A 955 -2.591 15.853 -5.989 1.00 0.00 H new ATOM 0 HG12 VAL A 955 -1.991 14.948 -7.399 1.00 0.00 H new ATOM 0 HG13 VAL A 955 -1.792 14.279 -5.762 1.00 0.00 H new ATOM 0 HG21 VAL A 955 -1.014 16.983 -4.457 1.00 0.00 H new ATOM 0 HG22 VAL A 955 -0.126 15.473 -4.144 1.00 0.00 H new ATOM 0 HG23 VAL A 955 0.741 16.906 -4.745 1.00 0.00 H new ATOM 638 N LYS A 956 -0.122 14.569 -8.965 1.00 0.00 N ATOM 639 CA LYS A 956 -0.574 13.754 -10.080 1.00 0.00 C ATOM 640 C LYS A 956 0.268 12.477 -10.147 1.00 0.00 C ATOM 641 O LYS A 956 -0.235 11.416 -10.513 1.00 0.00 O ATOM 642 CB LYS A 956 -0.563 14.566 -11.377 1.00 0.00 C ATOM 643 CG LYS A 956 -1.980 14.984 -11.774 1.00 0.00 C ATOM 644 CD LYS A 956 -2.491 16.111 -10.875 1.00 0.00 C ATOM 645 CE LYS A 956 -3.932 15.849 -10.433 1.00 0.00 C ATOM 646 NZ LYS A 956 -4.637 17.126 -10.181 1.00 0.00 N ATOM 0 H LYS A 956 -0.103 15.572 -9.150 1.00 0.00 H new ATOM 0 HA LYS A 956 -1.609 13.447 -9.932 1.00 0.00 H new ATOM 0 HB2 LYS A 956 0.059 15.452 -11.250 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -0.117 13.975 -12.177 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -1.989 15.311 -12.814 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -2.649 14.126 -11.704 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -1.849 16.202 -9.999 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -2.437 17.060 -11.409 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -4.457 15.282 -11.202 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -3.936 15.240 -9.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -5.614 16.930 -9.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -4.144 17.653 -9.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -4.649 17.694 -11.052 1.00 0.00 H new ATOM 660 N GLU A 957 1.535 12.623 -9.787 1.00 0.00 N ATOM 661 CA GLU A 957 2.451 11.495 -9.802 1.00 0.00 C ATOM 662 C GLU A 957 2.029 10.455 -8.762 1.00 0.00 C ATOM 663 O GLU A 957 1.762 9.304 -9.102 1.00 0.00 O ATOM 664 CB GLU A 957 3.890 11.955 -9.564 1.00 0.00 C ATOM 665 CG GLU A 957 4.867 11.176 -10.448 1.00 0.00 C ATOM 666 CD GLU A 957 5.211 9.822 -9.824 1.00 0.00 C ATOM 667 OE1 GLU A 957 6.156 9.798 -9.005 1.00 0.00 O ATOM 668 OE2 GLU A 957 4.522 8.842 -10.179 1.00 0.00 O ATOM 0 H GLU A 957 1.948 13.505 -9.483 1.00 0.00 H new ATOM 0 HA GLU A 957 2.410 11.032 -10.788 1.00 0.00 H new ATOM 0 HB2 GLU A 957 3.974 13.021 -9.774 1.00 0.00 H new ATOM 0 HB3 GLU A 957 4.152 11.815 -8.515 1.00 0.00 H new ATOM 0 HG2 GLU A 957 4.429 11.025 -11.435 1.00 0.00 H new ATOM 0 HG3 GLU A 957 5.778 11.757 -10.589 1.00 0.00 H new ATOM 675 N VAL A 958 1.981 10.898 -7.514 1.00 0.00 N ATOM 676 CA VAL A 958 1.596 10.020 -6.422 1.00 0.00 C ATOM 677 C VAL A 958 0.316 9.274 -6.801 1.00 0.00 C ATOM 678 O VAL A 958 0.178 8.085 -6.515 1.00 0.00 O ATOM 679 CB VAL A 958 1.458 10.825 -5.128 1.00 0.00 C ATOM 680 CG1 VAL A 958 0.003 11.233 -4.888 1.00 0.00 C ATOM 681 CG2 VAL A 958 2.012 10.043 -3.935 1.00 0.00 C ATOM 0 H VAL A 958 2.202 11.854 -7.235 1.00 0.00 H new ATOM 0 HA VAL A 958 2.368 9.271 -6.243 1.00 0.00 H new ATOM 0 HB VAL A 958 2.047 11.736 -5.235 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -0.067 11.804 -3.962 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -0.345 11.846 -5.719 1.00 0.00 H new ATOM 0 HG13 VAL A 958 -0.617 10.340 -4.811 1.00 0.00 H new ATOM 0 HG21 VAL A 958 1.902 10.637 -3.028 1.00 0.00 H new ATOM 0 HG22 VAL A 958 1.462 9.108 -3.826 1.00 0.00 H new ATOM 0 HG23 VAL A 958 3.067 9.826 -4.101 1.00 0.00 H new ATOM 691 N GLY A 959 -0.589 10.001 -7.439 1.00 0.00 N ATOM 692 CA GLY A 959 -1.853 9.422 -7.860 1.00 0.00 C ATOM 693 C GLY A 959 -1.630 8.289 -8.864 1.00 0.00 C ATOM 694 O GLY A 959 -2.312 7.266 -8.812 1.00 0.00 O ATOM 0 H GLY A 959 -0.472 10.986 -7.675 1.00 0.00 H new ATOM 0 HA2 GLY A 959 -2.390 9.042 -6.991 1.00 0.00 H new ATOM 0 HA3 GLY A 959 -2.479 10.193 -8.310 1.00 0.00 H new ATOM 698 N LEU A 960 -0.674 8.510 -9.754 1.00 0.00 N ATOM 699 CA LEU A 960 -0.353 7.520 -10.768 1.00 0.00 C ATOM 700 C LEU A 960 0.164 6.250 -10.089 1.00 0.00 C ATOM 701 O LEU A 960 -0.166 5.141 -10.506 1.00 0.00 O ATOM 702 CB LEU A 960 0.616 8.104 -11.798 1.00 0.00 C ATOM 703 CG LEU A 960 0.103 8.170 -13.239 1.00 0.00 C ATOM 704 CD1 LEU A 960 0.435 9.520 -13.878 1.00 0.00 C ATOM 705 CD2 LEU A 960 0.637 6.998 -14.065 1.00 0.00 C ATOM 0 H LEU A 960 -0.111 9.360 -9.794 1.00 0.00 H new ATOM 0 HA LEU A 960 -1.247 7.242 -11.326 1.00 0.00 H new ATOM 0 HB2 LEU A 960 0.886 9.112 -11.483 1.00 0.00 H new ATOM 0 HB3 LEU A 960 1.530 7.510 -11.785 1.00 0.00 H new ATOM 0 HG LEU A 960 -0.983 8.082 -13.219 1.00 0.00 H new ATOM 0 HD11 LEU A 960 0.060 9.540 -14.901 1.00 0.00 H new ATOM 0 HD12 LEU A 960 -0.033 10.319 -13.304 1.00 0.00 H new ATOM 0 HD13 LEU A 960 1.516 9.663 -13.885 1.00 0.00 H new ATOM 0 HD21 LEU A 960 0.258 7.069 -15.084 1.00 0.00 H new ATOM 0 HD22 LEU A 960 1.726 7.030 -14.080 1.00 0.00 H new ATOM 0 HD23 LEU A 960 0.308 6.059 -13.620 1.00 0.00 H new ATOM 717 N ALA A 961 0.966 6.454 -9.054 1.00 0.00 N ATOM 718 CA ALA A 961 1.531 5.339 -8.314 1.00 0.00 C ATOM 719 C ALA A 961 0.400 4.433 -7.824 1.00 0.00 C ATOM 720 O ALA A 961 0.453 3.217 -8.002 1.00 0.00 O ATOM 721 CB ALA A 961 2.390 5.872 -7.166 1.00 0.00 C ATOM 0 H ALA A 961 1.238 7.375 -8.711 1.00 0.00 H new ATOM 0 HA ALA A 961 2.178 4.741 -8.955 1.00 0.00 H new ATOM 0 HB1 ALA A 961 2.814 5.036 -6.610 1.00 0.00 H new ATOM 0 HB2 ALA A 961 3.196 6.486 -7.569 1.00 0.00 H new ATOM 0 HB3 ALA A 961 1.773 6.475 -6.499 1.00 0.00 H new ATOM 727 N LEU A 962 -0.596 5.059 -7.216 1.00 0.00 N ATOM 728 CA LEU A 962 -1.738 4.324 -6.699 1.00 0.00 C ATOM 729 C LEU A 962 -2.362 3.500 -7.827 1.00 0.00 C ATOM 730 O LEU A 962 -2.591 2.301 -7.671 1.00 0.00 O ATOM 731 CB LEU A 962 -2.723 5.275 -6.015 1.00 0.00 C ATOM 732 CG LEU A 962 -2.208 5.985 -4.761 1.00 0.00 C ATOM 733 CD1 LEU A 962 -2.565 7.473 -4.789 1.00 0.00 C ATOM 734 CD2 LEU A 962 -2.717 5.297 -3.493 1.00 0.00 C ATOM 0 H LEU A 962 -0.636 6.068 -7.069 1.00 0.00 H new ATOM 0 HA LEU A 962 -1.421 3.622 -5.928 1.00 0.00 H new ATOM 0 HB2 LEU A 962 -3.028 6.032 -6.738 1.00 0.00 H new ATOM 0 HB3 LEU A 962 -3.616 4.711 -5.748 1.00 0.00 H new ATOM 0 HG LEU A 962 -1.120 5.914 -4.750 1.00 0.00 H new ATOM 0 HD11 LEU A 962 -2.188 7.955 -3.887 1.00 0.00 H new ATOM 0 HD12 LEU A 962 -2.114 7.939 -5.665 1.00 0.00 H new ATOM 0 HD13 LEU A 962 -3.648 7.587 -4.835 1.00 0.00 H new ATOM 0 HD21 LEU A 962 -2.336 5.822 -2.617 1.00 0.00 H new ATOM 0 HD22 LEU A 962 -3.807 5.315 -3.482 1.00 0.00 H new ATOM 0 HD23 LEU A 962 -2.371 4.263 -3.476 1.00 0.00 H new ATOM 746 N ARG A 963 -2.618 4.175 -8.937 1.00 0.00 N ATOM 747 CA ARG A 963 -3.211 3.520 -10.091 1.00 0.00 C ATOM 748 C ARG A 963 -2.464 2.222 -10.407 1.00 0.00 C ATOM 749 O ARG A 963 -3.069 1.154 -10.476 1.00 0.00 O ATOM 750 CB ARG A 963 -3.178 4.431 -11.319 1.00 0.00 C ATOM 751 CG ARG A 963 -3.870 5.765 -11.031 1.00 0.00 C ATOM 752 CD ARG A 963 -5.132 5.923 -11.881 1.00 0.00 C ATOM 753 NE ARG A 963 -4.893 6.903 -12.965 1.00 0.00 N ATOM 754 CZ ARG A 963 -5.844 7.351 -13.795 1.00 0.00 C ATOM 755 NH1 ARG A 963 -7.103 6.910 -13.672 1.00 0.00 N ATOM 756 NH2 ARG A 963 -5.535 8.239 -14.750 1.00 0.00 N ATOM 0 H ARG A 963 -2.426 5.169 -9.062 1.00 0.00 H new ATOM 0 HA ARG A 963 -4.249 3.296 -9.847 1.00 0.00 H new ATOM 0 HB2 ARG A 963 -2.145 4.610 -11.616 1.00 0.00 H new ATOM 0 HB3 ARG A 963 -3.669 3.936 -12.157 1.00 0.00 H new ATOM 0 HG2 ARG A 963 -4.130 5.823 -9.974 1.00 0.00 H new ATOM 0 HG3 ARG A 963 -3.184 6.587 -11.236 1.00 0.00 H new ATOM 0 HD2 ARG A 963 -5.417 4.961 -12.306 1.00 0.00 H new ATOM 0 HD3 ARG A 963 -5.962 6.254 -11.257 1.00 0.00 H new ATOM 0 HE ARG A 963 -3.945 7.259 -13.087 1.00 0.00 H new ATOM 0 HH11 ARG A 963 -7.338 6.233 -12.946 1.00 0.00 H new ATOM 0 HH12 ARG A 963 -7.827 7.251 -14.304 1.00 0.00 H new ATOM 0 HH21 ARG A 963 -4.576 8.573 -14.845 1.00 0.00 H new ATOM 0 HH22 ARG A 963 -6.259 8.580 -15.382 1.00 0.00 H new ATOM 770 N THR A 964 -1.159 2.358 -10.591 1.00 0.00 N ATOM 771 CA THR A 964 -0.322 1.211 -10.897 1.00 0.00 C ATOM 772 C THR A 964 -0.359 0.201 -9.748 1.00 0.00 C ATOM 773 O THR A 964 -0.372 -1.007 -9.978 1.00 0.00 O ATOM 774 CB THR A 964 1.085 1.722 -11.213 1.00 0.00 C ATOM 775 OG1 THR A 964 0.954 2.330 -12.494 1.00 0.00 O ATOM 776 CG2 THR A 964 2.083 0.585 -11.440 1.00 0.00 C ATOM 0 H THR A 964 -0.661 3.246 -10.534 1.00 0.00 H new ATOM 0 HA THR A 964 -0.692 0.674 -11.771 1.00 0.00 H new ATOM 0 HB THR A 964 1.434 2.353 -10.396 1.00 0.00 H new ATOM 0 HG1 THR A 964 1.821 2.690 -12.775 1.00 0.00 H new ATOM 0 HG21 THR A 964 3.066 1.002 -11.661 1.00 0.00 H new ATOM 0 HG22 THR A 964 2.143 -0.031 -10.543 1.00 0.00 H new ATOM 0 HG23 THR A 964 1.752 -0.027 -12.279 1.00 0.00 H new ATOM 784 N LEU A 965 -0.375 0.735 -8.535 1.00 0.00 N ATOM 785 CA LEU A 965 -0.410 -0.104 -7.350 1.00 0.00 C ATOM 786 C LEU A 965 -1.590 -1.074 -7.450 1.00 0.00 C ATOM 787 O LEU A 965 -1.464 -2.248 -7.107 1.00 0.00 O ATOM 788 CB LEU A 965 -0.428 0.756 -6.085 1.00 0.00 C ATOM 789 CG LEU A 965 -0.442 -0.004 -4.757 1.00 0.00 C ATOM 790 CD1 LEU A 965 -1.871 -0.372 -4.351 1.00 0.00 C ATOM 791 CD2 LEU A 965 0.471 -1.230 -4.817 1.00 0.00 C ATOM 0 H LEU A 965 -0.364 1.738 -8.348 1.00 0.00 H new ATOM 0 HA LEU A 965 0.495 -0.708 -7.285 1.00 0.00 H new ATOM 0 HB2 LEU A 965 0.447 1.406 -6.099 1.00 0.00 H new ATOM 0 HB3 LEU A 965 -1.306 1.401 -6.121 1.00 0.00 H new ATOM 0 HG LEU A 965 -0.047 0.654 -3.983 1.00 0.00 H new ATOM 0 HD11 LEU A 965 -1.853 -0.911 -3.404 1.00 0.00 H new ATOM 0 HD12 LEU A 965 -2.463 0.536 -4.240 1.00 0.00 H new ATOM 0 HD13 LEU A 965 -2.316 -1.004 -5.120 1.00 0.00 H new ATOM 0 HD21 LEU A 965 0.443 -1.752 -3.861 1.00 0.00 H new ATOM 0 HD22 LEU A 965 0.129 -1.900 -5.606 1.00 0.00 H new ATOM 0 HD23 LEU A 965 1.493 -0.913 -5.027 1.00 0.00 H new ATOM 803 N LEU A 966 -2.709 -0.546 -7.923 1.00 0.00 N ATOM 804 CA LEU A 966 -3.911 -1.350 -8.073 1.00 0.00 C ATOM 805 C LEU A 966 -3.612 -2.539 -8.988 1.00 0.00 C ATOM 806 O LEU A 966 -3.780 -3.691 -8.590 1.00 0.00 O ATOM 807 CB LEU A 966 -5.078 -0.484 -8.552 1.00 0.00 C ATOM 808 CG LEU A 966 -5.829 0.289 -7.466 1.00 0.00 C ATOM 809 CD1 LEU A 966 -4.999 1.472 -6.962 1.00 0.00 C ATOM 810 CD2 LEU A 966 -7.210 0.726 -7.959 1.00 0.00 C ATOM 0 H LEU A 966 -2.809 0.428 -8.207 1.00 0.00 H new ATOM 0 HA LEU A 966 -4.220 -1.757 -7.110 1.00 0.00 H new ATOM 0 HB2 LEU A 966 -4.698 0.231 -9.282 1.00 0.00 H new ATOM 0 HB3 LEU A 966 -5.790 -1.124 -9.073 1.00 0.00 H new ATOM 0 HG LEU A 966 -5.986 -0.378 -6.619 1.00 0.00 H new ATOM 0 HD11 LEU A 966 -5.556 2.005 -6.191 1.00 0.00 H new ATOM 0 HD12 LEU A 966 -4.060 1.107 -6.545 1.00 0.00 H new ATOM 0 HD13 LEU A 966 -4.789 2.148 -7.791 1.00 0.00 H new ATOM 0 HD21 LEU A 966 -7.722 1.273 -7.168 1.00 0.00 H new ATOM 0 HD22 LEU A 966 -7.098 1.370 -8.832 1.00 0.00 H new ATOM 0 HD23 LEU A 966 -7.795 -0.153 -8.229 1.00 0.00 H new ATOM 822 N ALA A 967 -3.174 -2.220 -10.197 1.00 0.00 N ATOM 823 CA ALA A 967 -2.850 -3.248 -11.172 1.00 0.00 C ATOM 824 C ALA A 967 -1.900 -4.265 -10.537 1.00 0.00 C ATOM 825 O ALA A 967 -2.208 -5.454 -10.478 1.00 0.00 O ATOM 826 CB ALA A 967 -2.257 -2.597 -12.423 1.00 0.00 C ATOM 0 H ALA A 967 -3.036 -1.264 -10.524 1.00 0.00 H new ATOM 0 HA ALA A 967 -3.749 -3.783 -11.479 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -2.014 -3.368 -13.154 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -2.982 -1.906 -12.852 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -1.351 -2.053 -12.155 1.00 0.00 H new ATOM 832 N THR A 968 -0.764 -3.760 -10.078 1.00 0.00 N ATOM 833 CA THR A 968 0.233 -4.610 -9.450 1.00 0.00 C ATOM 834 C THR A 968 -0.417 -5.495 -8.384 1.00 0.00 C ATOM 835 O THR A 968 -0.152 -6.695 -8.324 1.00 0.00 O ATOM 836 CB THR A 968 1.341 -3.711 -8.900 1.00 0.00 C ATOM 837 OG1 THR A 968 0.645 -2.725 -8.143 1.00 0.00 O ATOM 838 CG2 THR A 968 2.045 -2.910 -9.997 1.00 0.00 C ATOM 0 H THR A 968 -0.512 -2.773 -10.129 1.00 0.00 H new ATOM 0 HA THR A 968 0.679 -5.296 -10.170 1.00 0.00 H new ATOM 0 HB THR A 968 2.073 -4.321 -8.370 1.00 0.00 H new ATOM 0 HG1 THR A 968 -0.302 -2.969 -8.080 1.00 0.00 H new ATOM 0 HG21 THR A 968 2.822 -2.289 -9.552 1.00 0.00 H new ATOM 0 HG22 THR A 968 2.495 -3.595 -10.716 1.00 0.00 H new ATOM 0 HG23 THR A 968 1.320 -2.275 -10.506 1.00 0.00 H new ATOM 846 N VAL A 969 -1.254 -4.869 -7.570 1.00 0.00 N ATOM 847 CA VAL A 969 -1.942 -5.585 -6.510 1.00 0.00 C ATOM 848 C VAL A 969 -2.754 -6.731 -7.118 1.00 0.00 C ATOM 849 O VAL A 969 -2.801 -7.827 -6.561 1.00 0.00 O ATOM 850 CB VAL A 969 -2.798 -4.615 -5.693 1.00 0.00 C ATOM 851 CG1 VAL A 969 -3.974 -5.340 -5.036 1.00 0.00 C ATOM 852 CG2 VAL A 969 -1.952 -3.884 -4.649 1.00 0.00 C ATOM 0 H VAL A 969 -1.471 -3.874 -7.623 1.00 0.00 H new ATOM 0 HA VAL A 969 -1.224 -6.026 -5.819 1.00 0.00 H new ATOM 0 HB VAL A 969 -3.205 -3.870 -6.377 1.00 0.00 H new ATOM 0 HG11 VAL A 969 -4.566 -4.627 -4.462 1.00 0.00 H new ATOM 0 HG12 VAL A 969 -4.598 -5.793 -5.806 1.00 0.00 H new ATOM 0 HG13 VAL A 969 -3.597 -6.117 -4.371 1.00 0.00 H new ATOM 0 HG21 VAL A 969 -2.584 -3.201 -4.082 1.00 0.00 H new ATOM 0 HG22 VAL A 969 -1.503 -4.610 -3.971 1.00 0.00 H new ATOM 0 HG23 VAL A 969 -1.165 -3.320 -5.149 1.00 0.00 H new ATOM 862 N ASP A 970 -3.372 -6.439 -8.253 1.00 0.00 N ATOM 863 CA ASP A 970 -4.178 -7.432 -8.942 1.00 0.00 C ATOM 864 C ASP A 970 -3.359 -8.711 -9.125 1.00 0.00 C ATOM 865 O ASP A 970 -3.905 -9.813 -9.086 1.00 0.00 O ATOM 866 CB ASP A 970 -4.596 -6.936 -10.328 1.00 0.00 C ATOM 867 CG ASP A 970 -5.955 -7.442 -10.814 1.00 0.00 C ATOM 868 OD1 ASP A 970 -6.968 -6.983 -10.245 1.00 0.00 O ATOM 869 OD2 ASP A 970 -5.950 -8.278 -11.744 1.00 0.00 O ATOM 0 H ASP A 970 -3.331 -5.529 -8.712 1.00 0.00 H new ATOM 0 HA ASP A 970 -5.068 -7.619 -8.342 1.00 0.00 H new ATOM 0 HB2 ASP A 970 -4.614 -5.846 -10.317 1.00 0.00 H new ATOM 0 HB3 ASP A 970 -3.835 -7.235 -11.049 1.00 0.00 H new ATOM 874 N GLU A 971 -2.062 -8.523 -9.321 1.00 0.00 N ATOM 875 CA GLU A 971 -1.163 -9.648 -9.509 1.00 0.00 C ATOM 876 C GLU A 971 -0.773 -10.249 -8.157 1.00 0.00 C ATOM 877 O GLU A 971 -0.395 -11.416 -8.079 1.00 0.00 O ATOM 878 CB GLU A 971 0.078 -9.231 -10.302 1.00 0.00 C ATOM 879 CG GLU A 971 -0.208 -9.227 -11.805 1.00 0.00 C ATOM 880 CD GLU A 971 1.077 -9.442 -12.608 1.00 0.00 C ATOM 881 OE1 GLU A 971 1.555 -10.597 -12.616 1.00 0.00 O ATOM 882 OE2 GLU A 971 1.552 -8.446 -13.196 1.00 0.00 O ATOM 0 H GLU A 971 -1.613 -7.608 -9.354 1.00 0.00 H new ATOM 0 HA GLU A 971 -1.684 -10.411 -10.087 1.00 0.00 H new ATOM 0 HB2 GLU A 971 0.399 -8.238 -9.987 1.00 0.00 H new ATOM 0 HB3 GLU A 971 0.899 -9.915 -10.086 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -0.926 -10.011 -12.044 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -0.665 -8.279 -12.089 1.00 0.00 H new ATOM 889 N SER A 972 -0.879 -9.423 -7.126 1.00 0.00 N ATOM 890 CA SER A 972 -0.543 -9.858 -5.781 1.00 0.00 C ATOM 891 C SER A 972 -1.746 -10.550 -5.139 1.00 0.00 C ATOM 892 O SER A 972 -1.584 -11.487 -4.358 1.00 0.00 O ATOM 893 CB SER A 972 -0.086 -8.680 -4.919 1.00 0.00 C ATOM 894 OG SER A 972 1.295 -8.772 -4.577 1.00 0.00 O ATOM 0 H SER A 972 -1.193 -8.455 -7.195 1.00 0.00 H new ATOM 0 HA SER A 972 0.283 -10.566 -5.847 1.00 0.00 H new ATOM 0 HB2 SER A 972 -0.265 -7.748 -5.455 1.00 0.00 H new ATOM 0 HB3 SER A 972 -0.683 -8.644 -4.008 1.00 0.00 H new ATOM 0 HG SER A 972 1.511 -8.095 -3.903 1.00 0.00 H new ATOM 900 N LEU A 973 -2.927 -10.063 -5.491 1.00 0.00 N ATOM 901 CA LEU A 973 -4.157 -10.623 -4.959 1.00 0.00 C ATOM 902 C LEU A 973 -4.032 -12.146 -4.894 1.00 0.00 C ATOM 903 O LEU A 973 -4.297 -12.751 -3.856 1.00 0.00 O ATOM 904 CB LEU A 973 -5.361 -10.138 -5.769 1.00 0.00 C ATOM 905 CG LEU A 973 -6.237 -9.077 -5.099 1.00 0.00 C ATOM 906 CD1 LEU A 973 -7.693 -9.203 -5.551 1.00 0.00 C ATOM 907 CD2 LEU A 973 -6.102 -9.136 -3.577 1.00 0.00 C ATOM 0 H LEU A 973 -3.058 -9.286 -6.139 1.00 0.00 H new ATOM 0 HA LEU A 973 -4.326 -10.273 -3.941 1.00 0.00 H new ATOM 0 HB2 LEU A 973 -4.999 -9.737 -6.716 1.00 0.00 H new ATOM 0 HB3 LEU A 973 -5.985 -11.000 -6.006 1.00 0.00 H new ATOM 0 HG LEU A 973 -5.886 -8.095 -5.415 1.00 0.00 H new ATOM 0 HD11 LEU A 973 -8.294 -8.437 -5.060 1.00 0.00 H new ATOM 0 HD12 LEU A 973 -7.751 -9.072 -6.632 1.00 0.00 H new ATOM 0 HD13 LEU A 973 -8.073 -10.189 -5.284 1.00 0.00 H new ATOM 0 HD21 LEU A 973 -6.735 -8.372 -3.126 1.00 0.00 H new ATOM 0 HD22 LEU A 973 -6.411 -10.119 -3.222 1.00 0.00 H new ATOM 0 HD23 LEU A 973 -5.064 -8.959 -3.297 1.00 0.00 H new ATOM 919 N PRO A 974 -3.619 -12.739 -6.046 1.00 0.00 N ATOM 920 CA PRO A 974 -3.456 -14.180 -6.129 1.00 0.00 C ATOM 921 C PRO A 974 -2.188 -14.632 -5.401 1.00 0.00 C ATOM 922 O PRO A 974 -2.162 -15.705 -4.800 1.00 0.00 O ATOM 923 CB PRO A 974 -3.427 -14.487 -7.618 1.00 0.00 C ATOM 924 CG PRO A 974 -3.108 -13.172 -8.309 1.00 0.00 C ATOM 925 CD PRO A 974 -3.296 -12.055 -7.295 1.00 0.00 C ATOM 0 HA PRO A 974 -4.264 -14.723 -5.639 1.00 0.00 H new ATOM 0 HB2 PRO A 974 -2.674 -15.241 -7.847 1.00 0.00 H new ATOM 0 HB3 PRO A 974 -4.386 -14.882 -7.954 1.00 0.00 H new ATOM 0 HG2 PRO A 974 -2.085 -13.177 -8.686 1.00 0.00 H new ATOM 0 HG3 PRO A 974 -3.763 -13.023 -9.167 1.00 0.00 H new ATOM 0 HD2 PRO A 974 -2.392 -11.454 -7.195 1.00 0.00 H new ATOM 0 HD3 PRO A 974 -4.097 -11.379 -7.595 1.00 0.00 H new ATOM 933 N VAL A 975 -1.168 -13.791 -5.479 1.00 0.00 N ATOM 934 CA VAL A 975 0.100 -14.090 -4.835 1.00 0.00 C ATOM 935 C VAL A 975 -0.157 -14.526 -3.391 1.00 0.00 C ATOM 936 O VAL A 975 0.637 -15.265 -2.811 1.00 0.00 O ATOM 937 CB VAL A 975 1.036 -12.885 -4.938 1.00 0.00 C ATOM 938 CG1 VAL A 975 2.208 -13.016 -3.962 1.00 0.00 C ATOM 939 CG2 VAL A 975 1.536 -12.699 -6.372 1.00 0.00 C ATOM 0 H VAL A 975 -1.193 -12.902 -5.979 1.00 0.00 H new ATOM 0 HA VAL A 975 0.600 -14.917 -5.340 1.00 0.00 H new ATOM 0 HB VAL A 975 0.468 -11.996 -4.663 1.00 0.00 H new ATOM 0 HG11 VAL A 975 2.858 -12.146 -4.056 1.00 0.00 H new ATOM 0 HG12 VAL A 975 1.827 -13.077 -2.942 1.00 0.00 H new ATOM 0 HG13 VAL A 975 2.774 -13.919 -4.192 1.00 0.00 H new ATOM 0 HG21 VAL A 975 2.200 -11.835 -6.417 1.00 0.00 H new ATOM 0 HG22 VAL A 975 2.079 -13.590 -6.687 1.00 0.00 H new ATOM 0 HG23 VAL A 975 0.686 -12.539 -7.036 1.00 0.00 H new ATOM 949 N LEU A 976 -1.270 -14.049 -2.852 1.00 0.00 N ATOM 950 CA LEU A 976 -1.641 -14.380 -1.487 1.00 0.00 C ATOM 951 C LEU A 976 -2.821 -15.353 -1.506 1.00 0.00 C ATOM 952 O LEU A 976 -3.555 -15.426 -2.490 1.00 0.00 O ATOM 953 CB LEU A 976 -1.907 -13.107 -0.680 1.00 0.00 C ATOM 954 CG LEU A 976 -0.762 -12.093 -0.631 1.00 0.00 C ATOM 955 CD1 LEU A 976 0.551 -12.767 -0.231 1.00 0.00 C ATOM 956 CD2 LEU A 976 -0.640 -11.341 -1.958 1.00 0.00 C ATOM 0 H LEU A 976 -1.926 -13.436 -3.336 1.00 0.00 H new ATOM 0 HA LEU A 976 -0.818 -14.885 -0.981 1.00 0.00 H new ATOM 0 HB2 LEU A 976 -2.785 -12.614 -1.096 1.00 0.00 H new ATOM 0 HB3 LEU A 976 -2.156 -13.394 0.342 1.00 0.00 H new ATOM 0 HG LEU A 976 -0.991 -11.355 0.138 1.00 0.00 H new ATOM 0 HD11 LEU A 976 1.348 -12.024 -0.204 1.00 0.00 H new ATOM 0 HD12 LEU A 976 0.442 -13.219 0.755 1.00 0.00 H new ATOM 0 HD13 LEU A 976 0.800 -13.539 -0.959 1.00 0.00 H new ATOM 0 HD21 LEU A 976 0.181 -10.626 -1.897 1.00 0.00 H new ATOM 0 HD22 LEU A 976 -0.444 -12.051 -2.762 1.00 0.00 H new ATOM 0 HD23 LEU A 976 -1.569 -10.809 -2.162 1.00 0.00 H new ATOM 968 N PRO A 977 -2.972 -16.096 -0.376 1.00 0.00 N ATOM 969 CA PRO A 977 -4.050 -17.062 -0.254 1.00 0.00 C ATOM 970 C PRO A 977 -5.389 -16.362 -0.013 1.00 0.00 C ATOM 971 O PRO A 977 -5.439 -15.141 0.126 1.00 0.00 O ATOM 972 CB PRO A 977 -3.639 -17.968 0.895 1.00 0.00 C ATOM 973 CG PRO A 977 -2.580 -17.202 1.671 1.00 0.00 C ATOM 974 CD PRO A 977 -2.122 -16.037 0.810 1.00 0.00 C ATOM 0 HA PRO A 977 -4.201 -17.640 -1.165 1.00 0.00 H new ATOM 0 HB2 PRO A 977 -4.493 -18.206 1.530 1.00 0.00 H new ATOM 0 HB3 PRO A 977 -3.244 -18.914 0.525 1.00 0.00 H new ATOM 0 HG2 PRO A 977 -2.986 -16.842 2.616 1.00 0.00 H new ATOM 0 HG3 PRO A 977 -1.739 -17.852 1.912 1.00 0.00 H new ATOM 0 HD2 PRO A 977 -2.238 -15.088 1.334 1.00 0.00 H new ATOM 0 HD3 PRO A 977 -1.068 -16.129 0.547 1.00 0.00 H new ATOM 982 N ALA A 978 -6.442 -17.165 0.028 1.00 0.00 N ATOM 983 CA ALA A 978 -7.778 -16.638 0.249 1.00 0.00 C ATOM 984 C ALA A 978 -7.746 -15.660 1.426 1.00 0.00 C ATOM 985 O ALA A 978 -6.724 -15.523 2.097 1.00 0.00 O ATOM 986 CB ALA A 978 -8.752 -17.795 0.479 1.00 0.00 C ATOM 0 H ALA A 978 -6.397 -18.177 -0.088 1.00 0.00 H new ATOM 0 HA ALA A 978 -8.125 -16.090 -0.627 1.00 0.00 H new ATOM 0 HB1 ALA A 978 -9.754 -17.400 0.645 1.00 0.00 H new ATOM 0 HB2 ALA A 978 -8.758 -18.445 -0.396 1.00 0.00 H new ATOM 0 HB3 ALA A 978 -8.438 -18.366 1.353 1.00 0.00 H new ATOM 992 N SER A 979 -8.878 -15.006 1.640 1.00 0.00 N ATOM 993 CA SER A 979 -8.994 -14.045 2.724 1.00 0.00 C ATOM 994 C SER A 979 -8.134 -12.815 2.426 1.00 0.00 C ATOM 995 O SER A 979 -7.686 -12.129 3.344 1.00 0.00 O ATOM 996 CB SER A 979 -8.583 -14.669 4.059 1.00 0.00 C ATOM 997 OG SER A 979 -9.262 -15.897 4.307 1.00 0.00 O ATOM 0 H SER A 979 -9.723 -15.123 1.081 1.00 0.00 H new ATOM 0 HA SER A 979 -10.038 -13.741 2.802 1.00 0.00 H new ATOM 0 HB2 SER A 979 -7.507 -14.843 4.062 1.00 0.00 H new ATOM 0 HB3 SER A 979 -8.795 -13.968 4.867 1.00 0.00 H new ATOM 0 HG SER A 979 -8.971 -16.264 5.168 1.00 0.00 H new ATOM 1003 N THR A 980 -7.930 -12.573 1.140 1.00 0.00 N ATOM 1004 CA THR A 980 -7.132 -11.437 0.709 1.00 0.00 C ATOM 1005 C THR A 980 -7.991 -10.454 -0.089 1.00 0.00 C ATOM 1006 O THR A 980 -8.183 -9.312 0.327 1.00 0.00 O ATOM 1007 CB THR A 980 -5.933 -11.972 -0.075 1.00 0.00 C ATOM 1008 OG1 THR A 980 -6.434 -13.136 -0.725 1.00 0.00 O ATOM 1009 CG2 THR A 980 -4.826 -12.502 0.838 1.00 0.00 C ATOM 0 H THR A 980 -8.303 -13.144 0.382 1.00 0.00 H new ATOM 0 HA THR A 980 -6.755 -10.872 1.562 1.00 0.00 H new ATOM 0 HB THR A 980 -5.533 -11.181 -0.710 1.00 0.00 H new ATOM 0 HG1 THR A 980 -5.814 -13.882 -0.584 1.00 0.00 H new ATOM 0 HG21 THR A 980 -3.999 -12.870 0.231 1.00 0.00 H new ATOM 0 HG22 THR A 980 -4.473 -11.699 1.485 1.00 0.00 H new ATOM 0 HG23 THR A 980 -5.217 -13.315 1.449 1.00 0.00 H new ATOM 1017 N HIS A 981 -8.485 -10.933 -1.221 1.00 0.00 N ATOM 1018 CA HIS A 981 -9.319 -10.111 -2.081 1.00 0.00 C ATOM 1019 C HIS A 981 -10.327 -9.336 -1.230 1.00 0.00 C ATOM 1020 O HIS A 981 -10.769 -8.255 -1.617 1.00 0.00 O ATOM 1021 CB HIS A 981 -9.987 -10.961 -3.164 1.00 0.00 C ATOM 1022 CG HIS A 981 -10.304 -12.372 -2.728 1.00 0.00 C ATOM 1023 ND1 HIS A 981 -11.256 -12.664 -1.767 1.00 0.00 N ATOM 1024 CD2 HIS A 981 -9.787 -13.567 -3.133 1.00 0.00 C ATOM 1025 CE1 HIS A 981 -11.300 -13.978 -1.607 1.00 0.00 C ATOM 1026 NE2 HIS A 981 -10.389 -14.536 -2.455 1.00 0.00 N ATOM 0 H HIS A 981 -8.324 -11.880 -1.563 1.00 0.00 H new ATOM 0 HA HIS A 981 -8.700 -9.381 -2.604 1.00 0.00 H new ATOM 0 HB2 HIS A 981 -10.910 -10.472 -3.478 1.00 0.00 H new ATOM 0 HB3 HIS A 981 -9.334 -10.999 -4.036 1.00 0.00 H new ATOM 0 HD2 HIS A 981 -9.018 -13.702 -3.879 1.00 0.00 H new ATOM 0 HE1 HIS A 981 -11.944 -14.513 -0.925 1.00 0.00 H new ATOM 0 HE2 HIS A 981 -10.201 -15.534 -2.552 1.00 0.00 H new ATOM 1034 N ARG A 982 -10.659 -9.917 -0.087 1.00 0.00 N ATOM 1035 CA ARG A 982 -11.606 -9.294 0.822 1.00 0.00 C ATOM 1036 C ARG A 982 -10.928 -8.168 1.604 1.00 0.00 C ATOM 1037 O ARG A 982 -11.235 -6.994 1.401 1.00 0.00 O ATOM 1038 CB ARG A 982 -12.180 -10.317 1.805 1.00 0.00 C ATOM 1039 CG ARG A 982 -12.934 -9.622 2.941 1.00 0.00 C ATOM 1040 CD ARG A 982 -14.351 -10.180 3.080 1.00 0.00 C ATOM 1041 NE ARG A 982 -14.310 -11.659 3.132 1.00 0.00 N ATOM 1042 CZ ARG A 982 -15.398 -12.439 3.190 1.00 0.00 C ATOM 1043 NH1 ARG A 982 -16.619 -11.886 3.205 1.00 0.00 N ATOM 1044 NH2 ARG A 982 -15.265 -13.771 3.234 1.00 0.00 N ATOM 0 H ARG A 982 -10.289 -10.813 0.231 1.00 0.00 H new ATOM 0 HA ARG A 982 -12.421 -8.885 0.224 1.00 0.00 H new ATOM 0 HB2 ARG A 982 -12.852 -10.995 1.279 1.00 0.00 H new ATOM 0 HB3 ARG A 982 -11.373 -10.924 2.217 1.00 0.00 H new ATOM 0 HG2 ARG A 982 -12.393 -9.757 3.877 1.00 0.00 H new ATOM 0 HG3 ARG A 982 -12.979 -8.550 2.750 1.00 0.00 H new ATOM 0 HD2 ARG A 982 -14.818 -9.789 3.984 1.00 0.00 H new ATOM 0 HD3 ARG A 982 -14.963 -9.854 2.239 1.00 0.00 H new ATOM 0 HE ARG A 982 -13.396 -12.113 3.123 1.00 0.00 H new ATOM 0 HH11 ARG A 982 -16.720 -10.872 3.172 1.00 0.00 H new ATOM 0 HH12 ARG A 982 -17.447 -12.480 3.249 1.00 0.00 H new ATOM 0 HH21 ARG A 982 -14.336 -14.191 3.223 1.00 0.00 H new ATOM 0 HH22 ARG A 982 -16.093 -14.365 3.278 1.00 0.00 H new ATOM 1058 N GLU A 983 -10.020 -8.565 2.483 1.00 0.00 N ATOM 1059 CA GLU A 983 -9.296 -7.604 3.297 1.00 0.00 C ATOM 1060 C GLU A 983 -8.575 -6.590 2.407 1.00 0.00 C ATOM 1061 O GLU A 983 -8.606 -5.390 2.674 1.00 0.00 O ATOM 1062 CB GLU A 983 -8.312 -8.309 4.234 1.00 0.00 C ATOM 1063 CG GLU A 983 -9.053 -9.074 5.332 1.00 0.00 C ATOM 1064 CD GLU A 983 -8.192 -9.196 6.591 1.00 0.00 C ATOM 1065 OE1 GLU A 983 -7.798 -8.131 7.115 1.00 0.00 O ATOM 1066 OE2 GLU A 983 -7.948 -10.351 7.002 1.00 0.00 O ATOM 0 H GLU A 983 -9.769 -9.540 2.649 1.00 0.00 H new ATOM 0 HA GLU A 983 -10.015 -7.068 3.916 1.00 0.00 H new ATOM 0 HB2 GLU A 983 -7.690 -8.998 3.662 1.00 0.00 H new ATOM 0 HB3 GLU A 983 -7.644 -7.575 4.685 1.00 0.00 H new ATOM 0 HG2 GLU A 983 -9.984 -8.561 5.572 1.00 0.00 H new ATOM 0 HG3 GLU A 983 -9.320 -10.068 4.972 1.00 0.00 H new ATOM 1073 N ILE A 984 -7.942 -7.110 1.365 1.00 0.00 N ATOM 1074 CA ILE A 984 -7.214 -6.266 0.434 1.00 0.00 C ATOM 1075 C ILE A 984 -8.169 -5.229 -0.161 1.00 0.00 C ATOM 1076 O ILE A 984 -7.763 -4.107 -0.461 1.00 0.00 O ATOM 1077 CB ILE A 984 -6.500 -7.118 -0.617 1.00 0.00 C ATOM 1078 CG1 ILE A 984 -5.138 -7.593 -0.106 1.00 0.00 C ATOM 1079 CG2 ILE A 984 -6.384 -6.368 -1.946 1.00 0.00 C ATOM 1080 CD1 ILE A 984 -5.300 -8.698 0.940 1.00 0.00 C ATOM 0 H ILE A 984 -7.919 -8.106 1.146 1.00 0.00 H new ATOM 0 HA ILE A 984 -6.428 -5.717 0.953 1.00 0.00 H new ATOM 0 HB ILE A 984 -7.103 -8.007 -0.801 1.00 0.00 H new ATOM 0 HG12 ILE A 984 -4.541 -7.962 -0.940 1.00 0.00 H new ATOM 0 HG13 ILE A 984 -4.595 -6.753 0.328 1.00 0.00 H new ATOM 0 HG21 ILE A 984 -5.873 -6.997 -2.675 1.00 0.00 H new ATOM 0 HG22 ILE A 984 -7.380 -6.123 -2.314 1.00 0.00 H new ATOM 0 HG23 ILE A 984 -5.816 -5.450 -1.797 1.00 0.00 H new ATOM 0 HD11 ILE A 984 -4.317 -9.018 1.287 1.00 0.00 H new ATOM 0 HD12 ILE A 984 -5.877 -8.319 1.784 1.00 0.00 H new ATOM 0 HD13 ILE A 984 -5.822 -9.546 0.496 1.00 0.00 H new ATOM 1092 N GLU A 985 -9.419 -5.640 -0.312 1.00 0.00 N ATOM 1093 CA GLU A 985 -10.435 -4.761 -0.865 1.00 0.00 C ATOM 1094 C GLU A 985 -10.741 -3.623 0.111 1.00 0.00 C ATOM 1095 O GLU A 985 -10.939 -2.482 -0.302 1.00 0.00 O ATOM 1096 CB GLU A 985 -11.704 -5.540 -1.214 1.00 0.00 C ATOM 1097 CG GLU A 985 -11.914 -5.597 -2.728 1.00 0.00 C ATOM 1098 CD GLU A 985 -13.002 -4.615 -3.168 1.00 0.00 C ATOM 1099 OE1 GLU A 985 -14.042 -4.572 -2.475 1.00 0.00 O ATOM 1100 OE2 GLU A 985 -12.770 -3.930 -4.187 1.00 0.00 O ATOM 0 H GLU A 985 -9.752 -6.571 -0.061 1.00 0.00 H new ATOM 0 HA GLU A 985 -10.049 -4.328 -1.788 1.00 0.00 H new ATOM 0 HB2 GLU A 985 -11.635 -6.552 -0.815 1.00 0.00 H new ATOM 0 HB3 GLU A 985 -12.566 -5.069 -0.741 1.00 0.00 H new ATOM 0 HG2 GLU A 985 -10.979 -5.362 -3.237 1.00 0.00 H new ATOM 0 HG3 GLU A 985 -12.192 -6.609 -3.022 1.00 0.00 H new ATOM 1107 N MET A 986 -10.770 -3.974 1.389 1.00 0.00 N ATOM 1108 CA MET A 986 -11.048 -2.997 2.427 1.00 0.00 C ATOM 1109 C MET A 986 -9.963 -1.920 2.472 1.00 0.00 C ATOM 1110 O MET A 986 -10.262 -0.739 2.644 1.00 0.00 O ATOM 1111 CB MET A 986 -11.125 -3.701 3.783 1.00 0.00 C ATOM 1112 CG MET A 986 -12.498 -4.345 3.990 1.00 0.00 C ATOM 1113 SD MET A 986 -13.074 -4.033 5.650 1.00 0.00 S ATOM 1114 CE MET A 986 -14.577 -3.138 5.294 1.00 0.00 C ATOM 0 H MET A 986 -10.605 -4.922 1.728 1.00 0.00 H new ATOM 0 HA MET A 986 -12.000 -2.517 2.202 1.00 0.00 H new ATOM 0 HB2 MET A 986 -10.349 -4.464 3.845 1.00 0.00 H new ATOM 0 HB3 MET A 986 -10.932 -2.984 4.581 1.00 0.00 H new ATOM 0 HG2 MET A 986 -13.209 -3.944 3.268 1.00 0.00 H new ATOM 0 HG3 MET A 986 -12.436 -5.419 3.814 1.00 0.00 H new ATOM 0 HE1 MET A 986 -15.067 -2.864 6.228 1.00 0.00 H new ATOM 0 HE2 MET A 986 -14.338 -2.236 4.731 1.00 0.00 H new ATOM 0 HE3 MET A 986 -15.244 -3.767 4.705 1.00 0.00 H new ATOM 1124 N ALA A 987 -8.725 -2.365 2.313 1.00 0.00 N ATOM 1125 CA ALA A 987 -7.594 -1.454 2.332 1.00 0.00 C ATOM 1126 C ALA A 987 -7.551 -0.672 1.018 1.00 0.00 C ATOM 1127 O ALA A 987 -7.180 0.501 1.001 1.00 0.00 O ATOM 1128 CB ALA A 987 -6.307 -2.243 2.584 1.00 0.00 C ATOM 0 H ALA A 987 -8.481 -3.345 2.170 1.00 0.00 H new ATOM 0 HA ALA A 987 -7.697 -0.731 3.141 1.00 0.00 H new ATOM 0 HB1 ALA A 987 -5.458 -1.559 2.598 1.00 0.00 H new ATOM 0 HB2 ALA A 987 -6.376 -2.756 3.543 1.00 0.00 H new ATOM 0 HB3 ALA A 987 -6.169 -2.977 1.790 1.00 0.00 H new ATOM 1134 N GLN A 988 -7.935 -1.353 -0.051 1.00 0.00 N ATOM 1135 CA GLN A 988 -7.945 -0.737 -1.367 1.00 0.00 C ATOM 1136 C GLN A 988 -8.853 0.494 -1.370 1.00 0.00 C ATOM 1137 O GLN A 988 -8.550 1.492 -2.023 1.00 0.00 O ATOM 1138 CB GLN A 988 -8.379 -1.740 -2.439 1.00 0.00 C ATOM 1139 CG GLN A 988 -7.194 -2.588 -2.907 1.00 0.00 C ATOM 1140 CD GLN A 988 -6.838 -2.275 -4.362 1.00 0.00 C ATOM 1141 OE1 GLN A 988 -5.766 -1.781 -4.673 1.00 0.00 O ATOM 1142 NE2 GLN A 988 -7.793 -2.588 -5.233 1.00 0.00 N ATOM 0 H GLN A 988 -8.242 -2.326 -0.033 1.00 0.00 H new ATOM 0 HA GLN A 988 -6.930 -0.417 -1.604 1.00 0.00 H new ATOM 0 HB2 GLN A 988 -9.160 -2.388 -2.041 1.00 0.00 H new ATOM 0 HB3 GLN A 988 -8.808 -1.208 -3.288 1.00 0.00 H new ATOM 0 HG2 GLN A 988 -6.331 -2.398 -2.269 1.00 0.00 H new ATOM 0 HG3 GLN A 988 -7.437 -3.646 -2.808 1.00 0.00 H new ATOM 0 HE21 GLN A 988 -8.667 -2.999 -4.905 1.00 0.00 H new ATOM 0 HE22 GLN A 988 -7.651 -2.417 -6.229 1.00 0.00 H new ATOM 1151 N LYS A 989 -9.948 0.385 -0.632 1.00 0.00 N ATOM 1152 CA LYS A 989 -10.902 1.477 -0.540 1.00 0.00 C ATOM 1153 C LYS A 989 -10.372 2.531 0.434 1.00 0.00 C ATOM 1154 O LYS A 989 -10.708 3.709 0.323 1.00 0.00 O ATOM 1155 CB LYS A 989 -12.290 0.947 -0.178 1.00 0.00 C ATOM 1156 CG LYS A 989 -13.281 1.177 -1.321 1.00 0.00 C ATOM 1157 CD LYS A 989 -13.539 -0.120 -2.091 1.00 0.00 C ATOM 1158 CE LYS A 989 -14.889 -0.071 -2.809 1.00 0.00 C ATOM 1159 NZ LYS A 989 -14.723 -0.379 -4.247 1.00 0.00 N ATOM 0 H LYS A 989 -10.196 -0.444 -0.092 1.00 0.00 H new ATOM 0 HA LYS A 989 -11.016 1.966 -1.508 1.00 0.00 H new ATOM 0 HB2 LYS A 989 -12.229 -0.118 0.046 1.00 0.00 H new ATOM 0 HB3 LYS A 989 -12.649 1.443 0.724 1.00 0.00 H new ATOM 0 HG2 LYS A 989 -14.220 1.560 -0.922 1.00 0.00 H new ATOM 0 HG3 LYS A 989 -12.890 1.935 -1.999 1.00 0.00 H new ATOM 0 HD2 LYS A 989 -12.742 -0.281 -2.817 1.00 0.00 H new ATOM 0 HD3 LYS A 989 -13.519 -0.966 -1.403 1.00 0.00 H new ATOM 0 HE2 LYS A 989 -15.575 -0.786 -2.355 1.00 0.00 H new ATOM 0 HE3 LYS A 989 -15.334 0.917 -2.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 -15.649 -0.341 -4.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 -14.085 0.319 -4.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 -14.318 -1.331 -4.354 1.00 0.00 H new ATOM 1173 N LEU A 990 -9.552 2.069 1.367 1.00 0.00 N ATOM 1174 CA LEU A 990 -8.973 2.957 2.360 1.00 0.00 C ATOM 1175 C LEU A 990 -7.949 3.872 1.685 1.00 0.00 C ATOM 1176 O LEU A 990 -8.063 5.095 1.754 1.00 0.00 O ATOM 1177 CB LEU A 990 -8.401 2.153 3.530 1.00 0.00 C ATOM 1178 CG LEU A 990 -8.837 2.600 4.927 1.00 0.00 C ATOM 1179 CD1 LEU A 990 -8.328 1.630 5.996 1.00 0.00 C ATOM 1180 CD2 LEU A 990 -8.400 4.039 5.204 1.00 0.00 C ATOM 0 H LEU A 990 -9.275 1.091 1.456 1.00 0.00 H new ATOM 0 HA LEU A 990 -9.741 3.600 2.790 1.00 0.00 H new ATOM 0 HB2 LEU A 990 -8.683 1.108 3.400 1.00 0.00 H new ATOM 0 HB3 LEU A 990 -7.313 2.198 3.479 1.00 0.00 H new ATOM 0 HG LEU A 990 -9.926 2.582 4.967 1.00 0.00 H new ATOM 0 HD11 LEU A 990 -8.651 1.970 6.980 1.00 0.00 H new ATOM 0 HD12 LEU A 990 -8.730 0.635 5.806 1.00 0.00 H new ATOM 0 HD13 LEU A 990 -7.239 1.593 5.965 1.00 0.00 H new ATOM 0 HD21 LEU A 990 -8.723 4.331 6.203 1.00 0.00 H new ATOM 0 HD22 LEU A 990 -7.314 4.109 5.138 1.00 0.00 H new ATOM 0 HD23 LEU A 990 -8.851 4.704 4.468 1.00 0.00 H new ATOM 1192 N LEU A 991 -6.972 3.245 1.046 1.00 0.00 N ATOM 1193 CA LEU A 991 -5.929 3.987 0.359 1.00 0.00 C ATOM 1194 C LEU A 991 -6.572 5.021 -0.567 1.00 0.00 C ATOM 1195 O LEU A 991 -6.398 6.224 -0.376 1.00 0.00 O ATOM 1196 CB LEU A 991 -4.974 3.030 -0.356 1.00 0.00 C ATOM 1197 CG LEU A 991 -3.835 3.683 -1.142 1.00 0.00 C ATOM 1198 CD1 LEU A 991 -3.099 4.715 -0.285 1.00 0.00 C ATOM 1199 CD2 LEU A 991 -2.884 2.627 -1.710 1.00 0.00 C ATOM 0 H LEU A 991 -6.881 2.231 0.990 1.00 0.00 H new ATOM 0 HA LEU A 991 -5.316 4.536 1.074 1.00 0.00 H new ATOM 0 HB2 LEU A 991 -4.540 2.360 0.386 1.00 0.00 H new ATOM 0 HB3 LEU A 991 -5.555 2.413 -1.041 1.00 0.00 H new ATOM 0 HG LEU A 991 -4.267 4.216 -1.989 1.00 0.00 H new ATOM 0 HD11 LEU A 991 -2.294 5.164 -0.867 1.00 0.00 H new ATOM 0 HD12 LEU A 991 -3.797 5.491 0.029 1.00 0.00 H new ATOM 0 HD13 LEU A 991 -2.681 4.226 0.595 1.00 0.00 H new ATOM 0 HD21 LEU A 991 -2.084 3.118 -2.264 1.00 0.00 H new ATOM 0 HD22 LEU A 991 -2.456 2.046 -0.893 1.00 0.00 H new ATOM 0 HD23 LEU A 991 -3.434 1.964 -2.378 1.00 0.00 H new ATOM 1211 N ASN A 992 -7.301 4.516 -1.551 1.00 0.00 N ATOM 1212 CA ASN A 992 -7.970 5.381 -2.508 1.00 0.00 C ATOM 1213 C ASN A 992 -8.609 6.556 -1.766 1.00 0.00 C ATOM 1214 O ASN A 992 -8.335 7.714 -2.076 1.00 0.00 O ATOM 1215 CB ASN A 992 -9.079 4.630 -3.248 1.00 0.00 C ATOM 1216 CG ASN A 992 -8.740 4.476 -4.732 1.00 0.00 C ATOM 1217 OD1 ASN A 992 -8.182 3.482 -5.168 1.00 0.00 O ATOM 1218 ND2 ASN A 992 -9.107 5.511 -5.481 1.00 0.00 N ATOM 0 H ASN A 992 -7.443 3.518 -1.706 1.00 0.00 H new ATOM 0 HA ASN A 992 -7.227 5.727 -3.227 1.00 0.00 H new ATOM 0 HB2 ASN A 992 -9.219 3.647 -2.799 1.00 0.00 H new ATOM 0 HB3 ASN A 992 -10.021 5.167 -3.140 1.00 0.00 H new ATOM 0 HD21 ASN A 992 -8.925 5.504 -6.485 1.00 0.00 H new ATOM 0 HD22 ASN A 992 -9.570 6.312 -5.052 1.00 0.00 H new ATOM 1225 N SER A 993 -9.450 6.218 -0.799 1.00 0.00 N ATOM 1226 CA SER A 993 -10.130 7.230 -0.010 1.00 0.00 C ATOM 1227 C SER A 993 -9.151 8.343 0.371 1.00 0.00 C ATOM 1228 O SER A 993 -9.242 9.457 -0.143 1.00 0.00 O ATOM 1229 CB SER A 993 -10.756 6.622 1.246 1.00 0.00 C ATOM 1230 OG SER A 993 -12.176 6.551 1.154 1.00 0.00 O ATOM 0 H SER A 993 -9.676 5.256 -0.544 1.00 0.00 H new ATOM 0 HA SER A 993 -10.932 7.652 -0.615 1.00 0.00 H new ATOM 0 HB2 SER A 993 -10.353 5.622 1.404 1.00 0.00 H new ATOM 0 HB3 SER A 993 -10.478 7.219 2.115 1.00 0.00 H new ATOM 0 HG SER A 993 -12.538 6.156 1.975 1.00 0.00 H new ATOM 1236 N ASP A 994 -8.237 8.002 1.267 1.00 0.00 N ATOM 1237 CA ASP A 994 -7.242 8.957 1.722 1.00 0.00 C ATOM 1238 C ASP A 994 -6.518 9.550 0.511 1.00 0.00 C ATOM 1239 O ASP A 994 -6.134 10.718 0.524 1.00 0.00 O ATOM 1240 CB ASP A 994 -6.197 8.283 2.614 1.00 0.00 C ATOM 1241 CG ASP A 994 -5.176 9.231 3.244 1.00 0.00 C ATOM 1242 OD1 ASP A 994 -4.863 10.247 2.587 1.00 0.00 O ATOM 1243 OD2 ASP A 994 -4.730 8.918 4.369 1.00 0.00 O ATOM 0 H ASP A 994 -8.165 7.077 1.690 1.00 0.00 H new ATOM 0 HA ASP A 994 -7.755 9.732 2.291 1.00 0.00 H new ATOM 0 HB2 ASP A 994 -6.713 7.747 3.411 1.00 0.00 H new ATOM 0 HB3 ASP A 994 -5.663 7.539 2.023 1.00 0.00 H new ATOM 1248 N LEU A 995 -6.355 8.717 -0.506 1.00 0.00 N ATOM 1249 CA LEU A 995 -5.685 9.143 -1.722 1.00 0.00 C ATOM 1250 C LEU A 995 -6.431 10.338 -2.319 1.00 0.00 C ATOM 1251 O LEU A 995 -5.859 11.415 -2.479 1.00 0.00 O ATOM 1252 CB LEU A 995 -5.532 7.968 -2.690 1.00 0.00 C ATOM 1253 CG LEU A 995 -5.831 8.267 -4.161 1.00 0.00 C ATOM 1254 CD1 LEU A 995 -4.948 9.403 -4.680 1.00 0.00 C ATOM 1255 CD2 LEU A 995 -5.702 7.004 -5.014 1.00 0.00 C ATOM 0 H LEU A 995 -6.676 7.749 -0.513 1.00 0.00 H new ATOM 0 HA LEU A 995 -4.672 9.478 -1.501 1.00 0.00 H new ATOM 0 HB2 LEU A 995 -4.511 7.593 -2.616 1.00 0.00 H new ATOM 0 HB3 LEU A 995 -6.191 7.164 -2.362 1.00 0.00 H new ATOM 0 HG LEU A 995 -6.865 8.603 -4.238 1.00 0.00 H new ATOM 0 HD11 LEU A 995 -5.181 9.595 -5.727 1.00 0.00 H new ATOM 0 HD12 LEU A 995 -5.134 10.304 -4.096 1.00 0.00 H new ATOM 0 HD13 LEU A 995 -3.899 9.120 -4.587 1.00 0.00 H new ATOM 0 HD21 LEU A 995 -5.920 7.244 -6.055 1.00 0.00 H new ATOM 0 HD22 LEU A 995 -4.687 6.614 -4.936 1.00 0.00 H new ATOM 0 HD23 LEU A 995 -6.407 6.252 -4.660 1.00 0.00 H new ATOM 1267 N ALA A 996 -7.698 10.107 -2.631 1.00 0.00 N ATOM 1268 CA ALA A 996 -8.529 11.151 -3.207 1.00 0.00 C ATOM 1269 C ALA A 996 -8.574 12.346 -2.252 1.00 0.00 C ATOM 1270 O ALA A 996 -8.355 13.484 -2.665 1.00 0.00 O ATOM 1271 CB ALA A 996 -9.921 10.590 -3.504 1.00 0.00 C ATOM 0 H ALA A 996 -8.169 9.213 -2.496 1.00 0.00 H new ATOM 0 HA ALA A 996 -8.109 11.499 -4.151 1.00 0.00 H new ATOM 0 HB1 ALA A 996 -10.544 11.373 -3.936 1.00 0.00 H new ATOM 0 HB2 ALA A 996 -9.837 9.763 -4.209 1.00 0.00 H new ATOM 0 HB3 ALA A 996 -10.375 10.234 -2.579 1.00 0.00 H new ATOM 1277 N GLU A 997 -8.858 12.046 -0.993 1.00 0.00 N ATOM 1278 CA GLU A 997 -8.934 13.081 0.024 1.00 0.00 C ATOM 1279 C GLU A 997 -7.655 13.920 0.024 1.00 0.00 C ATOM 1280 O GLU A 997 -7.682 15.100 0.369 1.00 0.00 O ATOM 1281 CB GLU A 997 -9.193 12.476 1.405 1.00 0.00 C ATOM 1282 CG GLU A 997 -9.374 13.570 2.459 1.00 0.00 C ATOM 1283 CD GLU A 997 -10.851 13.931 2.626 1.00 0.00 C ATOM 1284 OE1 GLU A 997 -11.383 14.587 1.705 1.00 0.00 O ATOM 1285 OE2 GLU A 997 -11.415 13.543 3.672 1.00 0.00 O ATOM 0 H GLU A 997 -9.038 11.101 -0.654 1.00 0.00 H new ATOM 0 HA GLU A 997 -9.774 13.734 -0.213 1.00 0.00 H new ATOM 0 HB2 GLU A 997 -10.084 11.849 1.370 1.00 0.00 H new ATOM 0 HB3 GLU A 997 -8.360 11.831 1.685 1.00 0.00 H new ATOM 0 HG2 GLU A 997 -8.968 13.232 3.413 1.00 0.00 H new ATOM 0 HG3 GLU A 997 -8.810 14.456 2.169 1.00 0.00 H new ATOM 1292 N LEU A 998 -6.564 13.277 -0.366 1.00 0.00 N ATOM 1293 CA LEU A 998 -5.276 13.949 -0.415 1.00 0.00 C ATOM 1294 C LEU A 998 -5.231 14.866 -1.639 1.00 0.00 C ATOM 1295 O LEU A 998 -4.935 16.054 -1.519 1.00 0.00 O ATOM 1296 CB LEU A 998 -4.137 12.929 -0.368 1.00 0.00 C ATOM 1297 CG LEU A 998 -2.753 13.451 -0.757 1.00 0.00 C ATOM 1298 CD1 LEU A 998 -2.616 13.564 -2.277 1.00 0.00 C ATOM 1299 CD2 LEU A 998 -2.449 14.776 -0.055 1.00 0.00 C ATOM 0 H LEU A 998 -6.545 12.298 -0.651 1.00 0.00 H new ATOM 0 HA LEU A 998 -5.142 14.581 0.463 1.00 0.00 H new ATOM 0 HB2 LEU A 998 -4.080 12.524 0.642 1.00 0.00 H new ATOM 0 HB3 LEU A 998 -4.390 12.101 -1.030 1.00 0.00 H new ATOM 0 HG LEU A 998 -2.009 12.729 -0.419 1.00 0.00 H new ATOM 0 HD11 LEU A 998 -1.623 13.937 -2.526 1.00 0.00 H new ATOM 0 HD12 LEU A 998 -2.759 12.582 -2.729 1.00 0.00 H new ATOM 0 HD13 LEU A 998 -3.369 14.253 -2.660 1.00 0.00 H new ATOM 0 HD21 LEU A 998 -1.459 15.125 -0.349 1.00 0.00 H new ATOM 0 HD22 LEU A 998 -3.195 15.518 -0.340 1.00 0.00 H new ATOM 0 HD23 LEU A 998 -2.476 14.630 1.025 1.00 0.00 H new ATOM 1311 N ILE A 999 -5.528 14.280 -2.789 1.00 0.00 N ATOM 1312 CA ILE A 999 -5.525 15.029 -4.034 1.00 0.00 C ATOM 1313 C ILE A 999 -6.229 16.370 -3.819 1.00 0.00 C ATOM 1314 O ILE A 999 -5.775 17.400 -4.315 1.00 0.00 O ATOM 1315 CB ILE A 999 -6.127 14.192 -5.165 1.00 0.00 C ATOM 1316 CG1 ILE A 999 -5.256 12.972 -5.468 1.00 0.00 C ATOM 1317 CG2 ILE A 999 -6.370 15.047 -6.410 1.00 0.00 C ATOM 1318 CD1 ILE A 999 -3.892 13.394 -6.017 1.00 0.00 C ATOM 0 H ILE A 999 -5.773 13.294 -2.885 1.00 0.00 H new ATOM 0 HA ILE A 999 -4.503 15.251 -4.343 1.00 0.00 H new ATOM 0 HB ILE A 999 -7.097 13.820 -4.836 1.00 0.00 H new ATOM 0 HG12 ILE A 999 -5.120 12.383 -4.561 1.00 0.00 H new ATOM 0 HG13 ILE A 999 -5.761 12.331 -6.191 1.00 0.00 H new ATOM 0 HG21 ILE A 999 -6.798 14.428 -7.199 1.00 0.00 H new ATOM 0 HG22 ILE A 999 -7.061 15.855 -6.168 1.00 0.00 H new ATOM 0 HG23 ILE A 999 -5.425 15.468 -6.752 1.00 0.00 H new ATOM 0 HD11 ILE A 999 -3.293 12.507 -6.224 1.00 0.00 H new ATOM 0 HD12 ILE A 999 -4.030 13.962 -6.937 1.00 0.00 H new ATOM 0 HD13 ILE A 999 -3.380 14.014 -5.282 1.00 0.00 H new ATOM 1330 N ASN A1000 -7.327 16.314 -3.080 1.00 0.00 N ATOM 1331 CA ASN A1000 -8.098 17.511 -2.793 1.00 0.00 C ATOM 1332 C ASN A1000 -7.212 18.520 -2.060 1.00 0.00 C ATOM 1333 O ASN A1000 -6.975 19.620 -2.558 1.00 0.00 O ATOM 1334 CB ASN A1000 -9.295 17.194 -1.894 1.00 0.00 C ATOM 1335 CG ASN A1000 -10.186 18.424 -1.712 1.00 0.00 C ATOM 1336 OD1 ASN A1000 -10.166 19.359 -2.496 1.00 0.00 O ATOM 1337 ND2 ASN A1000 -10.966 18.372 -0.637 1.00 0.00 N ATOM 0 H ASN A1000 -7.701 15.458 -2.671 1.00 0.00 H new ATOM 0 HA ASN A1000 -8.455 17.916 -3.740 1.00 0.00 H new ATOM 0 HB2 ASN A1000 -9.876 16.381 -2.330 1.00 0.00 H new ATOM 0 HB3 ASN A1000 -8.943 16.849 -0.922 1.00 0.00 H new ATOM 0 HD21 ASN A1000 -11.597 19.145 -0.427 1.00 0.00 H new ATOM 0 HD22 ASN A1000 -10.933 17.559 -0.022 1.00 0.00 H new ATOM 1344 N LYS A1001 -6.746 18.110 -0.889 1.00 0.00 N ATOM 1345 CA LYS A1001 -5.891 18.965 -0.083 1.00 0.00 C ATOM 1346 C LYS A1001 -4.790 19.556 -0.966 1.00 0.00 C ATOM 1347 O LYS A1001 -4.233 20.606 -0.649 1.00 0.00 O ATOM 1348 CB LYS A1001 -5.361 18.199 1.131 1.00 0.00 C ATOM 1349 CG LYS A1001 -6.130 18.579 2.397 1.00 0.00 C ATOM 1350 CD LYS A1001 -7.347 17.672 2.592 1.00 0.00 C ATOM 1351 CE LYS A1001 -7.566 17.359 4.073 1.00 0.00 C ATOM 1352 NZ LYS A1001 -8.994 17.516 4.431 1.00 0.00 N ATOM 0 H LYS A1001 -6.944 17.197 -0.479 1.00 0.00 H new ATOM 0 HA LYS A1001 -6.460 19.803 0.320 1.00 0.00 H new ATOM 0 HB2 LYS A1001 -5.449 17.127 0.956 1.00 0.00 H new ATOM 0 HB3 LYS A1001 -4.301 18.414 1.267 1.00 0.00 H new ATOM 0 HG2 LYS A1001 -5.472 18.503 3.263 1.00 0.00 H new ATOM 0 HG3 LYS A1001 -6.453 19.618 2.333 1.00 0.00 H new ATOM 0 HD2 LYS A1001 -8.234 18.156 2.184 1.00 0.00 H new ATOM 0 HD3 LYS A1001 -7.206 16.744 2.038 1.00 0.00 H new ATOM 0 HE2 LYS A1001 -7.241 16.341 4.287 1.00 0.00 H new ATOM 0 HE3 LYS A1001 -6.956 18.024 4.685 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 -9.125 17.300 5.440 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 -9.293 18.495 4.245 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 -9.569 16.864 3.860 1.00 0.00 H new ATOM 1366 N MET A1002 -4.511 18.857 -2.056 1.00 0.00 N ATOM 1367 CA MET A1002 -3.487 19.300 -2.987 1.00 0.00 C ATOM 1368 C MET A1002 -4.068 20.265 -4.023 1.00 0.00 C ATOM 1369 O MET A1002 -3.552 21.366 -4.209 1.00 0.00 O ATOM 1370 CB MET A1002 -2.886 18.088 -3.700 1.00 0.00 C ATOM 1371 CG MET A1002 -2.509 18.431 -5.143 1.00 0.00 C ATOM 1372 SD MET A1002 -1.348 19.787 -5.165 1.00 0.00 S ATOM 1373 CE MET A1002 -1.958 20.694 -6.576 1.00 0.00 C ATOM 0 H MET A1002 -4.976 17.987 -2.316 1.00 0.00 H new ATOM 0 HA MET A1002 -2.713 19.823 -2.425 1.00 0.00 H new ATOM 0 HB2 MET A1002 -2.002 17.746 -3.161 1.00 0.00 H new ATOM 0 HB3 MET A1002 -3.602 17.266 -3.693 1.00 0.00 H new ATOM 0 HG2 MET A1002 -2.072 17.559 -5.630 1.00 0.00 H new ATOM 0 HG3 MET A1002 -3.403 18.697 -5.708 1.00 0.00 H new ATOM 0 HE1 MET A1002 -1.145 21.271 -7.017 1.00 0.00 H new ATOM 0 HE2 MET A1002 -2.350 19.996 -7.316 1.00 0.00 H new ATOM 0 HE3 MET A1002 -2.752 21.370 -6.259 1.00 0.00 H new ATOM 1383 N LYS A1003 -5.134 19.817 -4.670 1.00 0.00 N ATOM 1384 CA LYS A1003 -5.790 20.627 -5.682 1.00 0.00 C ATOM 1385 C LYS A1003 -6.108 22.006 -5.099 1.00 0.00 C ATOM 1386 O LYS A1003 -6.142 22.998 -5.825 1.00 0.00 O ATOM 1387 CB LYS A1003 -7.015 19.899 -6.240 1.00 0.00 C ATOM 1388 CG LYS A1003 -6.822 19.554 -7.718 1.00 0.00 C ATOM 1389 CD LYS A1003 -8.151 19.613 -8.473 1.00 0.00 C ATOM 1390 CE LYS A1003 -8.694 21.043 -8.518 1.00 0.00 C ATOM 1391 NZ LYS A1003 -9.447 21.273 -9.771 1.00 0.00 N ATOM 0 H LYS A1003 -5.560 18.903 -4.513 1.00 0.00 H new ATOM 0 HA LYS A1003 -5.126 20.785 -6.532 1.00 0.00 H new ATOM 0 HB2 LYS A1003 -7.191 18.987 -5.670 1.00 0.00 H new ATOM 0 HB3 LYS A1003 -7.900 20.525 -6.121 1.00 0.00 H new ATOM 0 HG2 LYS A1003 -6.113 20.249 -8.168 1.00 0.00 H new ATOM 0 HG3 LYS A1003 -6.392 18.557 -7.809 1.00 0.00 H new ATOM 0 HD2 LYS A1003 -8.013 19.241 -9.488 1.00 0.00 H new ATOM 0 HD3 LYS A1003 -8.877 18.960 -7.989 1.00 0.00 H new ATOM 0 HE2 LYS A1003 -9.342 21.219 -7.660 1.00 0.00 H new ATOM 0 HE3 LYS A1003 -7.870 21.753 -8.446 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 -9.808 22.248 -9.785 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 -8.818 21.125 -10.586 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 -10.245 20.608 -9.824 1.00 0.00 H new ATOM 1405 N LEU A1004 -6.331 22.023 -3.793 1.00 0.00 N ATOM 1406 CA LEU A1004 -6.644 23.264 -3.104 1.00 0.00 C ATOM 1407 C LEU A1004 -5.357 24.063 -2.891 1.00 0.00 C ATOM 1408 O LEU A1004 -5.292 25.244 -3.227 1.00 0.00 O ATOM 1409 CB LEU A1004 -7.413 22.980 -1.812 1.00 0.00 C ATOM 1410 CG LEU A1004 -8.556 21.969 -1.920 1.00 0.00 C ATOM 1411 CD1 LEU A1004 -8.663 21.124 -0.649 1.00 0.00 C ATOM 1412 CD2 LEU A1004 -9.876 22.667 -2.257 1.00 0.00 C ATOM 0 H LEU A1004 -6.301 21.198 -3.194 1.00 0.00 H new ATOM 0 HA LEU A1004 -7.305 23.881 -3.712 1.00 0.00 H new ATOM 0 HB2 LEU A1004 -6.706 22.621 -1.064 1.00 0.00 H new ATOM 0 HB3 LEU A1004 -7.820 23.920 -1.441 1.00 0.00 H new ATOM 0 HG LEU A1004 -8.333 21.288 -2.741 1.00 0.00 H new ATOM 0 HD11 LEU A1004 -9.483 20.414 -0.752 1.00 0.00 H new ATOM 0 HD12 LEU A1004 -7.731 20.581 -0.493 1.00 0.00 H new ATOM 0 HD13 LEU A1004 -8.852 21.774 0.205 1.00 0.00 H new ATOM 0 HD21 LEU A1004 -10.672 21.926 -2.328 1.00 0.00 H new ATOM 0 HD22 LEU A1004 -10.118 23.385 -1.474 1.00 0.00 H new ATOM 0 HD23 LEU A1004 -9.779 23.188 -3.210 1.00 0.00 H new ATOM 1424 N ALA A1005 -4.364 23.386 -2.333 1.00 0.00 N ATOM 1425 CA ALA A1005 -3.082 24.018 -2.071 1.00 0.00 C ATOM 1426 C ALA A1005 -2.727 24.944 -3.236 1.00 0.00 C ATOM 1427 O ALA A1005 -2.350 26.096 -3.025 1.00 0.00 O ATOM 1428 CB ALA A1005 -2.020 22.942 -1.838 1.00 0.00 C ATOM 0 H ALA A1005 -4.421 22.406 -2.055 1.00 0.00 H new ATOM 0 HA ALA A1005 -3.132 24.627 -1.169 1.00 0.00 H new ATOM 0 HB1 ALA A1005 -1.058 23.416 -1.642 1.00 0.00 H new ATOM 0 HB2 ALA A1005 -2.304 22.330 -0.982 1.00 0.00 H new ATOM 0 HB3 ALA A1005 -1.940 22.312 -2.724 1.00 0.00 H new ATOM 1434 N GLN A1006 -2.861 24.407 -4.440 1.00 0.00 N ATOM 1435 CA GLN A1006 -2.560 25.171 -5.638 1.00 0.00 C ATOM 1436 C GLN A1006 -3.039 26.615 -5.481 1.00 0.00 C ATOM 1437 O GLN A1006 -2.307 27.553 -5.794 1.00 0.00 O ATOM 1438 CB GLN A1006 -3.180 24.518 -6.875 1.00 0.00 C ATOM 1439 CG GLN A1006 -2.405 24.892 -8.140 1.00 0.00 C ATOM 1440 CD GLN A1006 -2.975 26.160 -8.778 1.00 0.00 C ATOM 1441 OE1 GLN A1006 -4.146 26.248 -9.108 1.00 0.00 O ATOM 1442 NE2 GLN A1006 -2.083 27.135 -8.932 1.00 0.00 N ATOM 0 H GLN A1006 -3.174 23.451 -4.611 1.00 0.00 H new ATOM 0 HA GLN A1006 -1.479 25.181 -5.777 1.00 0.00 H new ATOM 0 HB2 GLN A1006 -3.185 23.435 -6.755 1.00 0.00 H new ATOM 0 HB3 GLN A1006 -4.219 24.833 -6.974 1.00 0.00 H new ATOM 0 HG2 GLN A1006 -1.354 25.045 -7.895 1.00 0.00 H new ATOM 0 HG3 GLN A1006 -2.449 24.070 -8.854 1.00 0.00 H new ATOM 0 HE21 GLN A1006 -1.118 26.995 -8.634 1.00 0.00 H new ATOM 0 HE22 GLN A1006 -2.364 28.023 -9.348 1.00 0.00 H new ATOM 1451 N GLN A1007 -4.265 26.749 -4.997 1.00 0.00 N ATOM 1452 CA GLN A1007 -4.850 28.064 -4.795 1.00 0.00 C ATOM 1453 C GLN A1007 -4.629 28.527 -3.354 1.00 0.00 C ATOM 1454 O GLN A1007 -4.440 29.716 -3.103 1.00 0.00 O ATOM 1455 CB GLN A1007 -6.339 28.061 -5.148 1.00 0.00 C ATOM 1456 CG GLN A1007 -6.796 29.447 -5.608 1.00 0.00 C ATOM 1457 CD GLN A1007 -7.787 29.340 -6.769 1.00 0.00 C ATOM 1458 OE1 GLN A1007 -7.418 29.266 -7.930 1.00 0.00 O ATOM 1459 NE2 GLN A1007 -9.062 29.335 -6.392 1.00 0.00 N ATOM 0 H GLN A1007 -4.869 25.969 -4.739 1.00 0.00 H new ATOM 0 HA GLN A1007 -4.353 28.768 -5.462 1.00 0.00 H new ATOM 0 HB2 GLN A1007 -6.528 27.332 -5.936 1.00 0.00 H new ATOM 0 HB3 GLN A1007 -6.922 27.751 -4.280 1.00 0.00 H new ATOM 0 HG2 GLN A1007 -7.261 29.975 -4.776 1.00 0.00 H new ATOM 0 HG3 GLN A1007 -5.932 30.035 -5.916 1.00 0.00 H new ATOM 0 HE21 GLN A1007 -9.302 29.400 -5.403 1.00 0.00 H new ATOM 0 HE22 GLN A1007 -9.801 29.266 -7.092 1.00 0.00 H new ATOM 1468 N TYR A1008 -4.661 27.564 -2.445 1.00 0.00 N ATOM 1469 CA TYR A1008 -4.466 27.859 -1.035 1.00 0.00 C ATOM 1470 C TYR A1008 -2.981 27.835 -0.670 1.00 0.00 C ATOM 1471 O TYR A1008 -2.608 27.348 0.397 1.00 0.00 O ATOM 1472 CB TYR A1008 -5.186 26.747 -0.269 1.00 0.00 C ATOM 1473 CG TYR A1008 -6.706 26.909 -0.217 1.00 0.00 C ATOM 1474 CD1 TYR A1008 -7.285 27.674 0.775 1.00 0.00 C ATOM 1475 CD2 TYR A1008 -7.498 26.292 -1.163 1.00 0.00 C ATOM 1476 CE1 TYR A1008 -8.716 27.827 0.823 1.00 0.00 C ATOM 1477 CE2 TYR A1008 -8.929 26.445 -1.115 1.00 0.00 C ATOM 1478 CZ TYR A1008 -9.468 27.205 -0.124 1.00 0.00 C ATOM 1479 OH TYR A1008 -10.819 27.350 -0.078 1.00 0.00 O ATOM 0 H TYR A1008 -4.819 26.579 -2.657 1.00 0.00 H new ATOM 0 HA TYR A1008 -4.850 28.850 -0.793 1.00 0.00 H new ATOM 0 HB2 TYR A1008 -4.949 25.789 -0.732 1.00 0.00 H new ATOM 0 HB3 TYR A1008 -4.800 26.713 0.750 1.00 0.00 H new ATOM 0 HD1 TYR A1008 -6.665 28.158 1.515 1.00 0.00 H new ATOM 0 HD2 TYR A1008 -7.045 25.694 -1.940 1.00 0.00 H new ATOM 0 HE1 TYR A1008 -9.182 28.423 1.594 1.00 0.00 H new ATOM 0 HE2 TYR A1008 -9.560 25.967 -1.849 1.00 0.00 H new ATOM 0 HH TYR A1008 -11.227 26.852 -0.817 1.00 0.00 H new ATOM 1489 N VAL A1009 -2.173 28.366 -1.576 1.00 0.00 N ATOM 1490 CA VAL A1009 -0.736 28.412 -1.362 1.00 0.00 C ATOM 1491 C VAL A1009 -0.234 29.837 -1.606 1.00 0.00 C ATOM 1492 O VAL A1009 0.502 30.387 -0.789 1.00 0.00 O ATOM 1493 CB VAL A1009 -0.043 27.374 -2.247 1.00 0.00 C ATOM 1494 CG1 VAL A1009 1.426 27.739 -2.472 1.00 0.00 C ATOM 1495 CG2 VAL A1009 -0.174 25.971 -1.652 1.00 0.00 C ATOM 0 H VAL A1009 -2.486 28.768 -2.460 1.00 0.00 H new ATOM 0 HA VAL A1009 -0.494 28.154 -0.331 1.00 0.00 H new ATOM 0 HB VAL A1009 -0.541 27.374 -3.217 1.00 0.00 H new ATOM 0 HG11 VAL A1009 1.896 26.985 -3.104 1.00 0.00 H new ATOM 0 HG12 VAL A1009 1.489 28.712 -2.960 1.00 0.00 H new ATOM 0 HG13 VAL A1009 1.942 27.780 -1.513 1.00 0.00 H new ATOM 0 HG21 VAL A1009 0.327 25.252 -2.301 1.00 0.00 H new ATOM 0 HG22 VAL A1009 0.286 25.950 -0.664 1.00 0.00 H new ATOM 0 HG23 VAL A1009 -1.229 25.709 -1.567 1.00 0.00 H new ATOM 1505 N MET A1010 -0.652 30.393 -2.733 1.00 0.00 N ATOM 1506 CA MET A1010 -0.254 31.743 -3.094 1.00 0.00 C ATOM 1507 C MET A1010 -0.169 32.639 -1.857 1.00 0.00 C ATOM 1508 O MET A1010 0.651 33.554 -1.804 1.00 0.00 O ATOM 1509 CB MET A1010 -1.268 32.328 -4.080 1.00 0.00 C ATOM 1510 CG MET A1010 -2.660 31.735 -3.852 1.00 0.00 C ATOM 1511 SD MET A1010 -3.904 32.993 -4.082 1.00 0.00 S ATOM 1512 CE MET A1010 -4.965 32.638 -2.691 1.00 0.00 C ATOM 0 H MET A1010 -1.262 29.933 -3.409 1.00 0.00 H new ATOM 0 HA MET A1010 0.732 31.700 -3.556 1.00 0.00 H new ATOM 0 HB2 MET A1010 -1.307 33.411 -3.967 1.00 0.00 H new ATOM 0 HB3 MET A1010 -0.946 32.126 -5.101 1.00 0.00 H new ATOM 0 HG2 MET A1010 -2.831 30.911 -4.545 1.00 0.00 H new ATOM 0 HG3 MET A1010 -2.729 31.324 -2.845 1.00 0.00 H new ATOM 0 HE1 MET A1010 -5.485 33.547 -2.389 1.00 0.00 H new ATOM 0 HE2 MET A1010 -5.695 31.879 -2.974 1.00 0.00 H new ATOM 0 HE3 MET A1010 -4.364 32.271 -1.859 1.00 0.00 H new ATOM 1522 N THR A1011 -1.028 32.344 -0.892 1.00 0.00 N ATOM 1523 CA THR A1011 -1.060 33.112 0.341 1.00 0.00 C ATOM 1524 C THR A1011 -0.407 32.323 1.478 1.00 0.00 C ATOM 1525 O THR A1011 -0.251 31.106 1.384 1.00 0.00 O ATOM 1526 CB THR A1011 -2.515 33.492 0.623 1.00 0.00 C ATOM 1527 OG1 THR A1011 -2.448 34.251 1.827 1.00 0.00 O ATOM 1528 CG2 THR A1011 -3.376 32.282 0.992 1.00 0.00 C ATOM 0 H THR A1011 -1.707 31.584 -0.939 1.00 0.00 H new ATOM 0 HA THR A1011 -0.480 34.031 0.250 1.00 0.00 H new ATOM 0 HB THR A1011 -2.938 33.984 -0.253 1.00 0.00 H new ATOM 0 HG1 THR A1011 -3.349 34.540 2.082 1.00 0.00 H new ATOM 0 HG21 THR A1011 -4.399 32.608 1.182 1.00 0.00 H new ATOM 0 HG22 THR A1011 -3.370 31.567 0.170 1.00 0.00 H new ATOM 0 HG23 THR A1011 -2.974 31.809 1.888 1.00 0.00 H new ATOM 1536 N SER A1012 -0.043 33.047 2.525 1.00 0.00 N ATOM 1537 CA SER A1012 0.589 32.430 3.679 1.00 0.00 C ATOM 1538 C SER A1012 -0.143 31.140 4.049 1.00 0.00 C ATOM 1539 O SER A1012 0.472 30.187 4.527 1.00 0.00 O ATOM 1540 CB SER A1012 0.614 33.388 4.871 1.00 0.00 C ATOM 1541 OG SER A1012 1.872 34.043 5.005 1.00 0.00 O ATOM 0 H SER A1012 -0.173 34.056 2.599 1.00 0.00 H new ATOM 0 HA SER A1012 1.620 32.192 3.418 1.00 0.00 H new ATOM 0 HB2 SER A1012 -0.172 34.134 4.753 1.00 0.00 H new ATOM 0 HB3 SER A1012 0.394 32.835 5.784 1.00 0.00 H new ATOM 0 HG SER A1012 1.846 34.647 5.776 1.00 0.00 H new ATOM 1547 N LEU A1013 -1.448 31.149 3.815 1.00 0.00 N ATOM 1548 CA LEU A1013 -2.271 29.991 4.119 1.00 0.00 C ATOM 1549 C LEU A1013 -1.515 28.718 3.732 1.00 0.00 C ATOM 1550 O LEU A1013 -1.715 27.665 4.335 1.00 0.00 O ATOM 1551 CB LEU A1013 -3.642 30.118 3.452 1.00 0.00 C ATOM 1552 CG LEU A1013 -4.849 29.798 4.335 1.00 0.00 C ATOM 1553 CD1 LEU A1013 -4.860 28.321 4.734 1.00 0.00 C ATOM 1554 CD2 LEU A1013 -4.898 30.721 5.554 1.00 0.00 C ATOM 0 H LEU A1013 -1.955 31.940 3.418 1.00 0.00 H new ATOM 0 HA LEU A1013 -2.467 29.934 5.190 1.00 0.00 H new ATOM 0 HB2 LEU A1013 -3.750 31.136 3.079 1.00 0.00 H new ATOM 0 HB3 LEU A1013 -3.665 29.457 2.586 1.00 0.00 H new ATOM 0 HG LEU A1013 -5.754 29.982 3.756 1.00 0.00 H new ATOM 0 HD11 LEU A1013 -5.728 28.120 5.361 1.00 0.00 H new ATOM 0 HD12 LEU A1013 -4.909 27.702 3.838 1.00 0.00 H new ATOM 0 HD13 LEU A1013 -3.951 28.087 5.287 1.00 0.00 H new ATOM 0 HD21 LEU A1013 -5.766 30.472 6.165 1.00 0.00 H new ATOM 0 HD22 LEU A1013 -3.990 30.593 6.144 1.00 0.00 H new ATOM 0 HD23 LEU A1013 -4.973 31.757 5.223 1.00 0.00 H new ATOM 1566 N GLN A1014 -0.662 28.857 2.727 1.00 0.00 N ATOM 1567 CA GLN A1014 0.125 27.731 2.253 1.00 0.00 C ATOM 1568 C GLN A1014 0.528 26.834 3.424 1.00 0.00 C ATOM 1569 O GLN A1014 -0.033 25.754 3.606 1.00 0.00 O ATOM 1570 CB GLN A1014 1.355 28.209 1.479 1.00 0.00 C ATOM 1571 CG GLN A1014 2.166 27.024 0.952 1.00 0.00 C ATOM 1572 CD GLN A1014 3.647 27.172 1.305 1.00 0.00 C ATOM 1573 OE1 GLN A1014 4.097 26.797 2.376 1.00 0.00 O ATOM 1574 NE2 GLN A1014 4.378 27.738 0.349 1.00 0.00 N ATOM 0 H GLN A1014 -0.499 29.732 2.228 1.00 0.00 H new ATOM 0 HA GLN A1014 -0.489 27.146 1.568 1.00 0.00 H new ATOM 0 HB2 GLN A1014 1.043 28.839 0.646 1.00 0.00 H new ATOM 0 HB3 GLN A1014 1.981 28.823 2.127 1.00 0.00 H new ATOM 0 HG2 GLN A1014 1.779 26.097 1.375 1.00 0.00 H new ATOM 0 HG3 GLN A1014 2.052 26.953 -0.130 1.00 0.00 H new ATOM 0 HE21 GLN A1014 3.939 28.029 -0.524 1.00 0.00 H new ATOM 0 HE22 GLN A1014 5.378 27.881 0.489 1.00 0.00 H new ATOM 1583 N GLN A1015 1.498 27.313 4.189 1.00 0.00 N ATOM 1584 CA GLN A1015 1.983 26.568 5.338 1.00 0.00 C ATOM 1585 C GLN A1015 0.824 25.850 6.032 1.00 0.00 C ATOM 1586 O GLN A1015 0.963 24.702 6.454 1.00 0.00 O ATOM 1587 CB GLN A1015 2.723 27.485 6.314 1.00 0.00 C ATOM 1588 CG GLN A1015 1.756 28.458 6.992 1.00 0.00 C ATOM 1589 CD GLN A1015 2.492 29.356 7.989 1.00 0.00 C ATOM 1590 OE1 GLN A1015 3.305 30.192 7.629 1.00 0.00 O ATOM 1591 NE2 GLN A1015 2.162 29.138 9.259 1.00 0.00 N ATOM 0 H GLN A1015 1.961 28.209 4.035 1.00 0.00 H new ATOM 0 HA GLN A1015 2.692 25.818 4.987 1.00 0.00 H new ATOM 0 HB2 GLN A1015 3.230 26.885 7.070 1.00 0.00 H new ATOM 0 HB3 GLN A1015 3.493 28.043 5.781 1.00 0.00 H new ATOM 0 HG2 GLN A1015 1.264 29.072 6.238 1.00 0.00 H new ATOM 0 HG3 GLN A1015 0.975 27.900 7.508 1.00 0.00 H new ATOM 0 HE21 GLN A1015 1.473 28.422 9.491 1.00 0.00 H new ATOM 0 HE22 GLN A1015 2.597 29.687 10.000 1.00 0.00 H new ATOM 1600 N GLU A1016 -0.294 26.554 6.130 1.00 0.00 N ATOM 1601 CA GLU A1016 -1.476 25.998 6.766 1.00 0.00 C ATOM 1602 C GLU A1016 -1.854 24.667 6.113 1.00 0.00 C ATOM 1603 O GLU A1016 -1.950 23.645 6.790 1.00 0.00 O ATOM 1604 CB GLU A1016 -2.643 26.986 6.713 1.00 0.00 C ATOM 1605 CG GLU A1016 -3.358 27.063 8.063 1.00 0.00 C ATOM 1606 CD GLU A1016 -3.422 28.506 8.568 1.00 0.00 C ATOM 1607 OE1 GLU A1016 -2.433 28.928 9.205 1.00 0.00 O ATOM 1608 OE2 GLU A1016 -4.459 29.153 8.307 1.00 0.00 O ATOM 0 H GLU A1016 -0.406 27.505 5.779 1.00 0.00 H new ATOM 0 HA GLU A1016 -1.247 25.813 7.815 1.00 0.00 H new ATOM 0 HB2 GLU A1016 -2.275 27.974 6.435 1.00 0.00 H new ATOM 0 HB3 GLU A1016 -3.349 26.680 5.941 1.00 0.00 H new ATOM 0 HG2 GLU A1016 -4.367 26.662 7.967 1.00 0.00 H new ATOM 0 HG3 GLU A1016 -2.836 26.442 8.791 1.00 0.00 H new ATOM 1615 N TYR A1017 -2.057 24.723 4.805 1.00 0.00 N ATOM 1616 CA TYR A1017 -2.423 23.535 4.053 1.00 0.00 C ATOM 1617 C TYR A1017 -1.269 22.531 4.020 1.00 0.00 C ATOM 1618 O TYR A1017 -1.494 21.323 3.958 1.00 0.00 O ATOM 1619 CB TYR A1017 -2.710 24.010 2.627 1.00 0.00 C ATOM 1620 CG TYR A1017 -4.187 24.299 2.353 1.00 0.00 C ATOM 1621 CD1 TYR A1017 -4.748 25.486 2.779 1.00 0.00 C ATOM 1622 CD2 TYR A1017 -4.957 23.374 1.679 1.00 0.00 C ATOM 1623 CE1 TYR A1017 -6.139 25.758 2.522 1.00 0.00 C ATOM 1624 CE2 TYR A1017 -6.348 23.646 1.421 1.00 0.00 C ATOM 1625 CZ TYR A1017 -6.870 24.825 1.855 1.00 0.00 C ATOM 1626 OH TYR A1017 -8.183 25.082 1.611 1.00 0.00 O ATOM 0 H TYR A1017 -1.975 25.573 4.247 1.00 0.00 H new ATOM 0 HA TYR A1017 -3.280 23.041 4.510 1.00 0.00 H new ATOM 0 HB2 TYR A1017 -2.131 24.913 2.432 1.00 0.00 H new ATOM 0 HB3 TYR A1017 -2.363 23.252 1.925 1.00 0.00 H new ATOM 0 HD1 TYR A1017 -4.144 26.211 3.305 1.00 0.00 H new ATOM 0 HD2 TYR A1017 -4.517 22.446 1.345 1.00 0.00 H new ATOM 0 HE1 TYR A1017 -6.591 26.682 2.851 1.00 0.00 H new ATOM 0 HE2 TYR A1017 -6.962 22.930 0.895 1.00 0.00 H new ATOM 0 HH TYR A1017 -8.259 25.753 0.901 1.00 0.00 H new ATOM 1636 N LYS A1018 -0.058 23.067 4.064 1.00 0.00 N ATOM 1637 CA LYS A1018 1.131 22.233 4.040 1.00 0.00 C ATOM 1638 C LYS A1018 1.039 21.189 5.155 1.00 0.00 C ATOM 1639 O LYS A1018 1.427 20.038 4.965 1.00 0.00 O ATOM 1640 CB LYS A1018 2.393 23.097 4.109 1.00 0.00 C ATOM 1641 CG LYS A1018 2.581 23.896 2.818 1.00 0.00 C ATOM 1642 CD LYS A1018 2.517 22.982 1.593 1.00 0.00 C ATOM 1643 CE LYS A1018 3.283 23.589 0.415 1.00 0.00 C ATOM 1644 NZ LYS A1018 2.456 23.559 -0.812 1.00 0.00 N ATOM 0 H LYS A1018 0.125 24.069 4.116 1.00 0.00 H new ATOM 0 HA LYS A1018 1.196 21.689 3.098 1.00 0.00 H new ATOM 0 HB2 LYS A1018 2.325 23.779 4.957 1.00 0.00 H new ATOM 0 HB3 LYS A1018 3.263 22.463 4.279 1.00 0.00 H new ATOM 0 HG2 LYS A1018 1.809 24.662 2.745 1.00 0.00 H new ATOM 0 HG3 LYS A1018 3.541 24.411 2.842 1.00 0.00 H new ATOM 0 HD2 LYS A1018 2.936 22.007 1.840 1.00 0.00 H new ATOM 0 HD3 LYS A1018 1.477 22.819 1.310 1.00 0.00 H new ATOM 0 HE2 LYS A1018 3.563 24.617 0.647 1.00 0.00 H new ATOM 0 HE3 LYS A1018 4.208 23.036 0.251 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 3.075 23.527 -1.647 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 1.847 22.716 -0.800 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 1.864 24.413 -0.853 1.00 0.00 H new ATOM 1658 N LYS A1019 0.523 21.629 6.293 1.00 0.00 N ATOM 1659 CA LYS A1019 0.375 20.747 7.438 1.00 0.00 C ATOM 1660 C LYS A1019 -0.751 19.748 7.164 1.00 0.00 C ATOM 1661 O LYS A1019 -0.609 18.557 7.437 1.00 0.00 O ATOM 1662 CB LYS A1019 0.178 21.561 8.719 1.00 0.00 C ATOM 1663 CG LYS A1019 1.514 21.809 9.422 1.00 0.00 C ATOM 1664 CD LYS A1019 2.273 22.964 8.765 1.00 0.00 C ATOM 1665 CE LYS A1019 3.134 22.464 7.603 1.00 0.00 C ATOM 1666 NZ LYS A1019 4.483 22.088 8.082 1.00 0.00 N ATOM 0 H LYS A1019 0.202 22.585 6.447 1.00 0.00 H new ATOM 0 HA LYS A1019 1.285 20.167 7.593 1.00 0.00 H new ATOM 0 HB2 LYS A1019 -0.293 22.514 8.480 1.00 0.00 H new ATOM 0 HB3 LYS A1019 -0.498 21.031 9.391 1.00 0.00 H new ATOM 0 HG2 LYS A1019 1.339 22.036 10.474 1.00 0.00 H new ATOM 0 HG3 LYS A1019 2.121 20.904 9.388 1.00 0.00 H new ATOM 0 HD2 LYS A1019 1.565 23.710 8.403 1.00 0.00 H new ATOM 0 HD3 LYS A1019 2.904 23.456 9.505 1.00 0.00 H new ATOM 0 HE2 LYS A1019 2.656 21.605 7.132 1.00 0.00 H new ATOM 0 HE3 LYS A1019 3.215 23.240 6.842 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 5.054 21.751 7.281 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 4.943 22.917 8.511 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 4.401 21.332 8.791 1.00 0.00 H new ATOM 1680 N GLN A1020 -1.845 20.270 6.630 1.00 0.00 N ATOM 1681 CA GLN A1020 -2.995 19.439 6.316 1.00 0.00 C ATOM 1682 C GLN A1020 -2.568 18.242 5.464 1.00 0.00 C ATOM 1683 O GLN A1020 -2.764 17.094 5.859 1.00 0.00 O ATOM 1684 CB GLN A1020 -4.084 20.252 5.613 1.00 0.00 C ATOM 1685 CG GLN A1020 -4.442 21.502 6.420 1.00 0.00 C ATOM 1686 CD GLN A1020 -4.708 21.151 7.885 1.00 0.00 C ATOM 1687 OE1 GLN A1020 -5.679 20.496 8.227 1.00 0.00 O ATOM 1688 NE2 GLN A1020 -3.795 21.622 8.729 1.00 0.00 N ATOM 0 H GLN A1020 -1.960 21.259 6.407 1.00 0.00 H new ATOM 0 HA GLN A1020 -3.414 19.064 7.250 1.00 0.00 H new ATOM 0 HB2 GLN A1020 -3.742 20.542 4.619 1.00 0.00 H new ATOM 0 HB3 GLN A1020 -4.973 19.636 5.477 1.00 0.00 H new ATOM 0 HG2 GLN A1020 -3.629 22.225 6.357 1.00 0.00 H new ATOM 0 HG3 GLN A1020 -5.324 21.977 5.990 1.00 0.00 H new ATOM 0 HE21 GLN A1020 -3.006 22.164 8.376 1.00 0.00 H new ATOM 0 HE22 GLN A1020 -3.884 21.442 9.729 1.00 0.00 H new ATOM 1697 N MET A1021 -1.993 18.552 4.312 1.00 0.00 N ATOM 1698 CA MET A1021 -1.537 17.516 3.401 1.00 0.00 C ATOM 1699 C MET A1021 -0.685 16.477 4.133 1.00 0.00 C ATOM 1700 O MET A1021 -0.823 15.278 3.897 1.00 0.00 O ATOM 1701 CB MET A1021 -0.714 18.150 2.277 1.00 0.00 C ATOM 1702 CG MET A1021 -1.091 17.555 0.919 1.00 0.00 C ATOM 1703 SD MET A1021 0.340 16.799 0.165 1.00 0.00 S ATOM 1704 CE MET A1021 0.724 15.566 1.397 1.00 0.00 C ATOM 0 H MET A1021 -1.832 19.506 3.988 1.00 0.00 H new ATOM 0 HA MET A1021 -2.411 17.014 2.986 1.00 0.00 H new ATOM 0 HB2 MET A1021 -0.878 19.227 2.264 1.00 0.00 H new ATOM 0 HB3 MET A1021 0.348 17.992 2.465 1.00 0.00 H new ATOM 0 HG2 MET A1021 -1.881 16.814 1.044 1.00 0.00 H new ATOM 0 HG3 MET A1021 -1.486 18.335 0.268 1.00 0.00 H new ATOM 0 HE1 MET A1021 1.358 14.796 0.956 1.00 0.00 H new ATOM 0 HE2 MET A1021 1.248 16.035 2.230 1.00 0.00 H new ATOM 0 HE3 MET A1021 -0.199 15.113 1.758 1.00 0.00 H new ATOM 1714 N LEU A1022 0.175 16.975 5.009 1.00 0.00 N ATOM 1715 CA LEU A1022 1.048 16.105 5.778 1.00 0.00 C ATOM 1716 C LEU A1022 0.200 15.110 6.572 1.00 0.00 C ATOM 1717 O LEU A1022 0.520 13.924 6.631 1.00 0.00 O ATOM 1718 CB LEU A1022 1.999 16.932 6.646 1.00 0.00 C ATOM 1719 CG LEU A1022 3.076 16.147 7.397 1.00 0.00 C ATOM 1720 CD1 LEU A1022 2.464 15.325 8.533 1.00 0.00 C ATOM 1721 CD2 LEU A1022 3.891 15.278 6.436 1.00 0.00 C ATOM 0 H LEU A1022 0.286 17.970 5.203 1.00 0.00 H new ATOM 0 HA LEU A1022 1.685 15.522 5.113 1.00 0.00 H new ATOM 0 HB2 LEU A1022 2.491 17.669 6.011 1.00 0.00 H new ATOM 0 HB3 LEU A1022 1.406 17.485 7.375 1.00 0.00 H new ATOM 0 HG LEU A1022 3.765 16.860 7.850 1.00 0.00 H new ATOM 0 HD11 LEU A1022 3.251 14.777 9.050 1.00 0.00 H new ATOM 0 HD12 LEU A1022 1.964 15.991 9.236 1.00 0.00 H new ATOM 0 HD13 LEU A1022 1.740 14.620 8.123 1.00 0.00 H new ATOM 0 HD21 LEU A1022 4.650 14.730 6.995 1.00 0.00 H new ATOM 0 HD22 LEU A1022 3.230 14.572 5.934 1.00 0.00 H new ATOM 0 HD23 LEU A1022 4.375 15.912 5.693 1.00 0.00 H new ATOM 1733 N THR A1023 -0.867 15.629 7.162 1.00 0.00 N ATOM 1734 CA THR A1023 -1.765 14.801 7.949 1.00 0.00 C ATOM 1735 C THR A1023 -2.159 13.548 7.165 1.00 0.00 C ATOM 1736 O THR A1023 -2.074 12.435 7.682 1.00 0.00 O ATOM 1737 CB THR A1023 -2.961 15.661 8.362 1.00 0.00 C ATOM 1738 OG1 THR A1023 -2.385 16.924 8.686 1.00 0.00 O ATOM 1739 CG2 THR A1023 -3.593 15.192 9.675 1.00 0.00 C ATOM 0 H THR A1023 -1.130 16.613 7.111 1.00 0.00 H new ATOM 0 HA THR A1023 -1.278 14.440 8.855 1.00 0.00 H new ATOM 0 HB THR A1023 -3.711 15.644 7.571 1.00 0.00 H new ATOM 0 HG1 THR A1023 -3.091 17.544 8.963 1.00 0.00 H new ATOM 0 HG21 THR A1023 -4.437 15.836 9.923 1.00 0.00 H new ATOM 0 HG22 THR A1023 -3.940 14.165 9.565 1.00 0.00 H new ATOM 0 HG23 THR A1023 -2.852 15.241 10.473 1.00 0.00 H new ATOM 1747 N ALA A1024 -2.583 13.770 5.929 1.00 0.00 N ATOM 1748 CA ALA A1024 -2.991 12.673 5.069 1.00 0.00 C ATOM 1749 C ALA A1024 -1.780 11.785 4.774 1.00 0.00 C ATOM 1750 O ALA A1024 -1.877 10.560 4.827 1.00 0.00 O ATOM 1751 CB ALA A1024 -3.628 13.232 3.795 1.00 0.00 C ATOM 0 H ALA A1024 -2.653 14.694 5.503 1.00 0.00 H new ATOM 0 HA ALA A1024 -3.740 12.056 5.564 1.00 0.00 H new ATOM 0 HB1 ALA A1024 -3.934 12.409 3.150 1.00 0.00 H new ATOM 0 HB2 ALA A1024 -4.500 13.831 4.057 1.00 0.00 H new ATOM 0 HB3 ALA A1024 -2.904 13.855 3.269 1.00 0.00 H new ATOM 1757 N ALA A1025 -0.668 12.437 4.469 1.00 0.00 N ATOM 1758 CA ALA A1025 0.560 11.722 4.166 1.00 0.00 C ATOM 1759 C ALA A1025 0.848 10.715 5.282 1.00 0.00 C ATOM 1760 O ALA A1025 1.423 9.657 5.034 1.00 0.00 O ATOM 1761 CB ALA A1025 1.701 12.724 3.976 1.00 0.00 C ATOM 0 H ALA A1025 -0.592 13.453 4.425 1.00 0.00 H new ATOM 0 HA ALA A1025 0.459 11.163 3.236 1.00 0.00 H new ATOM 0 HB1 ALA A1025 2.622 12.188 3.749 1.00 0.00 H new ATOM 0 HB2 ALA A1025 1.461 13.397 3.153 1.00 0.00 H new ATOM 0 HB3 ALA A1025 1.834 13.302 4.891 1.00 0.00 H new ATOM 1767 N HIS A1026 0.434 11.081 6.486 1.00 0.00 N ATOM 1768 CA HIS A1026 0.640 10.223 7.641 1.00 0.00 C ATOM 1769 C HIS A1026 -0.227 8.969 7.510 1.00 0.00 C ATOM 1770 O HIS A1026 0.285 7.851 7.538 1.00 0.00 O ATOM 1771 CB HIS A1026 0.383 10.989 8.940 1.00 0.00 C ATOM 1772 CG HIS A1026 1.059 10.391 10.150 1.00 0.00 C ATOM 1773 ND1 HIS A1026 2.429 10.437 10.342 1.00 0.00 N ATOM 1774 CD2 HIS A1026 0.541 9.735 11.228 1.00 0.00 C ATOM 1775 CE1 HIS A1026 2.711 9.831 11.486 1.00 0.00 C ATOM 1776 NE2 HIS A1026 1.540 9.397 12.033 1.00 0.00 N ATOM 0 H HIS A1026 -0.043 11.960 6.687 1.00 0.00 H new ATOM 0 HA HIS A1026 1.681 9.901 7.678 1.00 0.00 H new ATOM 0 HB2 HIS A1026 0.724 12.017 8.817 1.00 0.00 H new ATOM 0 HB3 HIS A1026 -0.691 11.029 9.120 1.00 0.00 H new ATOM 0 HD2 HIS A1026 -0.505 9.526 11.397 1.00 0.00 H new ATOM 0 HE1 HIS A1026 3.696 9.703 11.911 1.00 0.00 H new ATOM 0 HE2 HIS A1026 1.447 8.895 12.916 1.00 0.00 H new ATOM 1784 N ALA A1027 -1.524 9.198 7.370 1.00 0.00 N ATOM 1785 CA ALA A1027 -2.467 8.101 7.234 1.00 0.00 C ATOM 1786 C ALA A1027 -2.184 7.349 5.933 1.00 0.00 C ATOM 1787 O ALA A1027 -2.361 6.134 5.863 1.00 0.00 O ATOM 1788 CB ALA A1027 -3.896 8.645 7.295 1.00 0.00 C ATOM 0 H ALA A1027 -1.944 10.127 7.348 1.00 0.00 H new ATOM 0 HA ALA A1027 -2.353 7.393 8.055 1.00 0.00 H new ATOM 0 HB1 ALA A1027 -4.603 7.822 7.193 1.00 0.00 H new ATOM 0 HB2 ALA A1027 -4.055 9.144 8.251 1.00 0.00 H new ATOM 0 HB3 ALA A1027 -4.049 9.357 6.484 1.00 0.00 H new ATOM 1794 N LEU A1028 -1.750 8.103 4.933 1.00 0.00 N ATOM 1795 CA LEU A1028 -1.441 7.522 3.638 1.00 0.00 C ATOM 1796 C LEU A1028 -0.427 6.391 3.819 1.00 0.00 C ATOM 1797 O LEU A1028 -0.758 5.221 3.633 1.00 0.00 O ATOM 1798 CB LEU A1028 -0.984 8.607 2.660 1.00 0.00 C ATOM 1799 CG LEU A1028 -2.082 9.254 1.815 1.00 0.00 C ATOM 1800 CD1 LEU A1028 -1.483 10.166 0.742 1.00 0.00 C ATOM 1801 CD2 LEU A1028 -3.008 8.195 1.214 1.00 0.00 C ATOM 0 H LEU A1028 -1.605 9.111 4.994 1.00 0.00 H new ATOM 0 HA LEU A1028 -2.334 7.081 3.196 1.00 0.00 H new ATOM 0 HB2 LEU A1028 -0.480 9.390 3.227 1.00 0.00 H new ATOM 0 HB3 LEU A1028 -0.244 8.174 1.988 1.00 0.00 H new ATOM 0 HG LEU A1028 -2.690 9.880 2.468 1.00 0.00 H new ATOM 0 HD11 LEU A1028 -2.285 10.613 0.155 1.00 0.00 H new ATOM 0 HD12 LEU A1028 -0.899 10.954 1.218 1.00 0.00 H new ATOM 0 HD13 LEU A1028 -0.837 9.581 0.087 1.00 0.00 H new ATOM 0 HD21 LEU A1028 -3.780 8.682 0.618 1.00 0.00 H new ATOM 0 HD22 LEU A1028 -2.429 7.524 0.580 1.00 0.00 H new ATOM 0 HD23 LEU A1028 -3.476 7.623 2.016 1.00 0.00 H new ATOM 1813 N ALA A1029 0.787 6.779 4.180 1.00 0.00 N ATOM 1814 CA ALA A1029 1.851 5.812 4.389 1.00 0.00 C ATOM 1815 C ALA A1029 1.277 4.567 5.067 1.00 0.00 C ATOM 1816 O ALA A1029 1.614 3.443 4.697 1.00 0.00 O ATOM 1817 CB ALA A1029 2.974 6.456 5.205 1.00 0.00 C ATOM 0 H ALA A1029 1.058 7.750 4.333 1.00 0.00 H new ATOM 0 HA ALA A1029 2.279 5.500 3.436 1.00 0.00 H new ATOM 0 HB1 ALA A1029 3.772 5.730 5.362 1.00 0.00 H new ATOM 0 HB2 ALA A1029 3.368 7.318 4.666 1.00 0.00 H new ATOM 0 HB3 ALA A1029 2.583 6.780 6.170 1.00 0.00 H new ATOM 1823 N VAL A1030 0.420 4.809 6.048 1.00 0.00 N ATOM 1824 CA VAL A1030 -0.204 3.721 6.782 1.00 0.00 C ATOM 1825 C VAL A1030 -1.182 2.986 5.862 1.00 0.00 C ATOM 1826 O VAL A1030 -1.098 1.769 5.707 1.00 0.00 O ATOM 1827 CB VAL A1030 -0.867 4.259 8.052 1.00 0.00 C ATOM 1828 CG1 VAL A1030 -2.042 3.374 8.474 1.00 0.00 C ATOM 1829 CG2 VAL A1030 0.151 4.396 9.185 1.00 0.00 C ATOM 0 H VAL A1030 0.143 5.743 6.352 1.00 0.00 H new ATOM 0 HA VAL A1030 0.545 2.998 7.104 1.00 0.00 H new ATOM 0 HB VAL A1030 -1.258 5.252 7.831 1.00 0.00 H new ATOM 0 HG11 VAL A1030 -2.495 3.778 9.379 1.00 0.00 H new ATOM 0 HG12 VAL A1030 -2.784 3.350 7.676 1.00 0.00 H new ATOM 0 HG13 VAL A1030 -1.685 2.363 8.668 1.00 0.00 H new ATOM 0 HG21 VAL A1030 -0.346 4.780 10.076 1.00 0.00 H new ATOM 0 HG22 VAL A1030 0.585 3.421 9.404 1.00 0.00 H new ATOM 0 HG23 VAL A1030 0.940 5.085 8.884 1.00 0.00 H new ATOM 1839 N ASP A1031 -2.087 3.757 5.277 1.00 0.00 N ATOM 1840 CA ASP A1031 -3.080 3.195 4.377 1.00 0.00 C ATOM 1841 C ASP A1031 -2.414 2.150 3.480 1.00 0.00 C ATOM 1842 O ASP A1031 -2.758 0.970 3.535 1.00 0.00 O ATOM 1843 CB ASP A1031 -3.682 4.276 3.477 1.00 0.00 C ATOM 1844 CG ASP A1031 -4.530 5.322 4.203 1.00 0.00 C ATOM 1845 OD1 ASP A1031 -5.263 4.915 5.130 1.00 0.00 O ATOM 1846 OD2 ASP A1031 -4.426 6.506 3.814 1.00 0.00 O ATOM 0 H ASP A1031 -2.153 4.766 5.409 1.00 0.00 H new ATOM 0 HA ASP A1031 -3.869 2.749 4.982 1.00 0.00 H new ATOM 0 HB2 ASP A1031 -2.872 4.785 2.955 1.00 0.00 H new ATOM 0 HB3 ASP A1031 -4.298 3.794 2.718 1.00 0.00 H new ATOM 1851 N ALA A1032 -1.474 2.621 2.674 1.00 0.00 N ATOM 1852 CA ALA A1032 -0.757 1.741 1.766 1.00 0.00 C ATOM 1853 C ALA A1032 -0.178 0.564 2.554 1.00 0.00 C ATOM 1854 O ALA A1032 -0.080 -0.547 2.034 1.00 0.00 O ATOM 1855 CB ALA A1032 0.323 2.537 1.030 1.00 0.00 C ATOM 0 H ALA A1032 -1.192 3.600 2.631 1.00 0.00 H new ATOM 0 HA ALA A1032 -1.432 1.334 1.013 1.00 0.00 H new ATOM 0 HB1 ALA A1032 0.861 1.877 0.349 1.00 0.00 H new ATOM 0 HB2 ALA A1032 -0.142 3.343 0.463 1.00 0.00 H new ATOM 0 HB3 ALA A1032 1.021 2.959 1.753 1.00 0.00 H new ATOM 1861 N LYS A1033 0.189 0.847 3.795 1.00 0.00 N ATOM 1862 CA LYS A1033 0.756 -0.174 4.659 1.00 0.00 C ATOM 1863 C LYS A1033 -0.328 -1.194 5.014 1.00 0.00 C ATOM 1864 O LYS A1033 -0.172 -2.387 4.756 1.00 0.00 O ATOM 1865 CB LYS A1033 1.421 0.465 5.879 1.00 0.00 C ATOM 1866 CG LYS A1033 2.349 -0.529 6.581 1.00 0.00 C ATOM 1867 CD LYS A1033 1.636 -1.214 7.749 1.00 0.00 C ATOM 1868 CE LYS A1033 2.642 -1.739 8.774 1.00 0.00 C ATOM 1869 NZ LYS A1033 2.107 -1.597 10.146 1.00 0.00 N ATOM 0 H LYS A1033 0.105 1.769 4.223 1.00 0.00 H new ATOM 0 HA LYS A1033 1.547 -0.715 4.140 1.00 0.00 H new ATOM 0 HB2 LYS A1033 1.989 1.343 5.570 1.00 0.00 H new ATOM 0 HB3 LYS A1033 0.657 0.809 6.576 1.00 0.00 H new ATOM 0 HG2 LYS A1033 2.690 -1.280 5.868 1.00 0.00 H new ATOM 0 HG3 LYS A1033 3.235 -0.010 6.945 1.00 0.00 H new ATOM 0 HD2 LYS A1033 0.957 -0.509 8.229 1.00 0.00 H new ATOM 0 HD3 LYS A1033 1.028 -2.038 7.376 1.00 0.00 H new ATOM 0 HE2 LYS A1033 2.864 -2.787 8.571 1.00 0.00 H new ATOM 0 HE3 LYS A1033 3.580 -1.191 8.685 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 2.803 -1.958 10.829 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 1.918 -0.593 10.343 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 1.224 -2.139 10.232 1.00 0.00 H new ATOM 1883 N ASN A1034 -1.403 -0.688 5.600 1.00 0.00 N ATOM 1884 CA ASN A1034 -2.513 -1.540 5.993 1.00 0.00 C ATOM 1885 C ASN A1034 -2.859 -2.483 4.839 1.00 0.00 C ATOM 1886 O ASN A1034 -3.313 -3.604 5.064 1.00 0.00 O ATOM 1887 CB ASN A1034 -3.757 -0.710 6.315 1.00 0.00 C ATOM 1888 CG ASN A1034 -4.789 -1.543 7.078 1.00 0.00 C ATOM 1889 OD1 ASN A1034 -4.969 -2.726 6.840 1.00 0.00 O ATOM 1890 ND2 ASN A1034 -5.454 -0.861 8.007 1.00 0.00 N ATOM 0 H ASN A1034 -1.529 0.302 5.812 1.00 0.00 H new ATOM 0 HA ASN A1034 -2.213 -2.098 6.880 1.00 0.00 H new ATOM 0 HB2 ASN A1034 -3.475 0.159 6.909 1.00 0.00 H new ATOM 0 HB3 ASN A1034 -4.198 -0.335 5.391 1.00 0.00 H new ATOM 0 HD21 ASN A1034 -6.164 -1.327 8.571 1.00 0.00 H new ATOM 0 HD22 ASN A1034 -5.254 0.128 8.155 1.00 0.00 H new ATOM 1897 N LEU A1035 -2.632 -1.995 3.629 1.00 0.00 N ATOM 1898 CA LEU A1035 -2.914 -2.780 2.440 1.00 0.00 C ATOM 1899 C LEU A1035 -2.077 -4.060 2.468 1.00 0.00 C ATOM 1900 O LEU A1035 -2.615 -5.156 2.618 1.00 0.00 O ATOM 1901 CB LEU A1035 -2.707 -1.938 1.179 1.00 0.00 C ATOM 1902 CG LEU A1035 -3.615 -2.270 -0.007 1.00 0.00 C ATOM 1903 CD1 LEU A1035 -3.644 -1.119 -1.014 1.00 0.00 C ATOM 1904 CD2 LEU A1035 -3.205 -3.592 -0.658 1.00 0.00 C ATOM 0 H LEU A1035 -2.256 -1.065 3.446 1.00 0.00 H new ATOM 0 HA LEU A1035 -3.961 -3.083 2.425 1.00 0.00 H new ATOM 0 HB2 LEU A1035 -2.851 -0.889 1.439 1.00 0.00 H new ATOM 0 HB3 LEU A1035 -1.671 -2.048 0.859 1.00 0.00 H new ATOM 0 HG LEU A1035 -4.631 -2.397 0.366 1.00 0.00 H new ATOM 0 HD11 LEU A1035 -4.296 -1.381 -1.847 1.00 0.00 H new ATOM 0 HD12 LEU A1035 -4.020 -0.219 -0.527 1.00 0.00 H new ATOM 0 HD13 LEU A1035 -2.636 -0.936 -1.386 1.00 0.00 H new ATOM 0 HD21 LEU A1035 -3.866 -3.804 -1.498 1.00 0.00 H new ATOM 0 HD22 LEU A1035 -2.178 -3.519 -1.014 1.00 0.00 H new ATOM 0 HD23 LEU A1035 -3.279 -4.396 0.074 1.00 0.00 H new ATOM 1916 N LEU A1036 -0.772 -3.879 2.322 1.00 0.00 N ATOM 1917 CA LEU A1036 0.145 -5.006 2.330 1.00 0.00 C ATOM 1918 C LEU A1036 0.095 -5.690 3.698 1.00 0.00 C ATOM 1919 O LEU A1036 0.128 -6.916 3.784 1.00 0.00 O ATOM 1920 CB LEU A1036 1.549 -4.557 1.918 1.00 0.00 C ATOM 1921 CG LEU A1036 2.324 -5.520 1.017 1.00 0.00 C ATOM 1922 CD1 LEU A1036 2.359 -5.013 -0.426 1.00 0.00 C ATOM 1923 CD2 LEU A1036 3.727 -5.778 1.568 1.00 0.00 C ATOM 0 H LEU A1036 -0.328 -2.969 2.198 1.00 0.00 H new ATOM 0 HA LEU A1036 -0.157 -5.748 1.591 1.00 0.00 H new ATOM 0 HB2 LEU A1036 1.467 -3.598 1.406 1.00 0.00 H new ATOM 0 HB3 LEU A1036 2.134 -4.386 2.822 1.00 0.00 H new ATOM 0 HG LEU A1036 1.801 -6.476 1.010 1.00 0.00 H new ATOM 0 HD11 LEU A1036 2.916 -5.716 -1.045 1.00 0.00 H new ATOM 0 HD12 LEU A1036 1.341 -4.923 -0.805 1.00 0.00 H new ATOM 0 HD13 LEU A1036 2.845 -4.038 -0.457 1.00 0.00 H new ATOM 0 HD21 LEU A1036 4.256 -6.466 0.908 1.00 0.00 H new ATOM 0 HD22 LEU A1036 4.274 -4.837 1.625 1.00 0.00 H new ATOM 0 HD23 LEU A1036 3.652 -6.215 2.564 1.00 0.00 H new ATOM 1935 N ASP A1037 0.017 -4.866 4.733 1.00 0.00 N ATOM 1936 CA ASP A1037 -0.038 -5.376 6.092 1.00 0.00 C ATOM 1937 C ASP A1037 -0.913 -6.631 6.127 1.00 0.00 C ATOM 1938 O ASP A1037 -0.482 -7.680 6.603 1.00 0.00 O ATOM 1939 CB ASP A1037 -0.652 -4.346 7.043 1.00 0.00 C ATOM 1940 CG ASP A1037 -0.316 -4.550 8.521 1.00 0.00 C ATOM 1941 OD1 ASP A1037 0.673 -5.268 8.785 1.00 0.00 O ATOM 1942 OD2 ASP A1037 -1.056 -3.983 9.355 1.00 0.00 O ATOM 0 H ASP A1037 -0.009 -3.849 4.657 1.00 0.00 H new ATOM 0 HA ASP A1037 0.981 -5.598 6.409 1.00 0.00 H new ATOM 0 HB2 ASP A1037 -0.318 -3.353 6.744 1.00 0.00 H new ATOM 0 HB3 ASP A1037 -1.736 -4.366 6.926 1.00 0.00 H new ATOM 1947 N VAL A1038 -2.126 -6.482 5.615 1.00 0.00 N ATOM 1948 CA VAL A1038 -3.065 -7.591 5.581 1.00 0.00 C ATOM 1949 C VAL A1038 -2.471 -8.732 4.754 1.00 0.00 C ATOM 1950 O VAL A1038 -2.554 -9.896 5.145 1.00 0.00 O ATOM 1951 CB VAL A1038 -4.420 -7.113 5.054 1.00 0.00 C ATOM 1952 CG1 VAL A1038 -5.367 -8.293 4.828 1.00 0.00 C ATOM 1953 CG2 VAL A1038 -5.043 -6.083 5.998 1.00 0.00 C ATOM 0 H VAL A1038 -2.480 -5.611 5.220 1.00 0.00 H new ATOM 0 HA VAL A1038 -3.239 -7.975 6.586 1.00 0.00 H new ATOM 0 HB VAL A1038 -4.253 -6.628 4.092 1.00 0.00 H new ATOM 0 HG11 VAL A1038 -6.323 -7.926 4.454 1.00 0.00 H new ATOM 0 HG12 VAL A1038 -4.930 -8.976 4.100 1.00 0.00 H new ATOM 0 HG13 VAL A1038 -5.524 -8.819 5.770 1.00 0.00 H new ATOM 0 HG21 VAL A1038 -6.005 -5.760 5.600 1.00 0.00 H new ATOM 0 HG22 VAL A1038 -5.189 -6.532 6.981 1.00 0.00 H new ATOM 0 HG23 VAL A1038 -4.380 -5.223 6.087 1.00 0.00 H new ATOM 1963 N ILE A1039 -1.884 -8.360 3.626 1.00 0.00 N ATOM 1964 CA ILE A1039 -1.276 -9.338 2.740 1.00 0.00 C ATOM 1965 C ILE A1039 -0.232 -10.143 3.517 1.00 0.00 C ATOM 1966 O ILE A1039 -0.201 -11.370 3.432 1.00 0.00 O ATOM 1967 CB ILE A1039 -0.719 -8.655 1.489 1.00 0.00 C ATOM 1968 CG1 ILE A1039 -1.825 -8.411 0.460 1.00 0.00 C ATOM 1969 CG2 ILE A1039 0.446 -9.453 0.901 1.00 0.00 C ATOM 1970 CD1 ILE A1039 -1.275 -7.698 -0.777 1.00 0.00 C ATOM 0 H ILE A1039 -1.817 -7.394 3.305 1.00 0.00 H new ATOM 0 HA ILE A1039 -2.024 -10.045 2.382 1.00 0.00 H new ATOM 0 HB ILE A1039 -0.327 -7.680 1.778 1.00 0.00 H new ATOM 0 HG12 ILE A1039 -2.271 -9.362 0.168 1.00 0.00 H new ATOM 0 HG13 ILE A1039 -2.617 -7.811 0.908 1.00 0.00 H new ATOM 0 HG21 ILE A1039 0.823 -8.946 0.013 1.00 0.00 H new ATOM 0 HG22 ILE A1039 1.243 -9.531 1.640 1.00 0.00 H new ATOM 0 HG23 ILE A1039 0.103 -10.452 0.630 1.00 0.00 H new ATOM 0 HD11 ILE A1039 -2.081 -7.537 -1.493 1.00 0.00 H new ATOM 0 HD12 ILE A1039 -0.851 -6.737 -0.485 1.00 0.00 H new ATOM 0 HD13 ILE A1039 -0.500 -8.312 -1.236 1.00 0.00 H new ATOM 1982 N ASP A1040 0.597 -9.420 4.255 1.00 0.00 N ATOM 1983 CA ASP A1040 1.640 -10.052 5.046 1.00 0.00 C ATOM 1984 C ASP A1040 1.030 -11.187 5.872 1.00 0.00 C ATOM 1985 O ASP A1040 1.649 -12.236 6.044 1.00 0.00 O ATOM 1986 CB ASP A1040 2.279 -9.054 6.014 1.00 0.00 C ATOM 1987 CG ASP A1040 3.628 -9.486 6.591 1.00 0.00 C ATOM 1988 OD1 ASP A1040 4.289 -10.315 5.929 1.00 0.00 O ATOM 1989 OD2 ASP A1040 3.967 -8.978 7.682 1.00 0.00 O ATOM 0 H ASP A1040 0.568 -8.403 4.322 1.00 0.00 H new ATOM 0 HA ASP A1040 2.401 -10.428 4.362 1.00 0.00 H new ATOM 0 HB2 ASP A1040 2.409 -8.103 5.498 1.00 0.00 H new ATOM 0 HB3 ASP A1040 1.588 -8.877 6.838 1.00 0.00 H new ATOM 1994 N GLN A1041 -0.176 -10.938 6.361 1.00 0.00 N ATOM 1995 CA GLN A1041 -0.876 -11.926 7.165 1.00 0.00 C ATOM 1996 C GLN A1041 -1.469 -13.015 6.269 1.00 0.00 C ATOM 1997 O GLN A1041 -1.717 -14.131 6.724 1.00 0.00 O ATOM 1998 CB GLN A1041 -1.961 -11.268 8.020 1.00 0.00 C ATOM 1999 CG GLN A1041 -1.384 -10.760 9.342 1.00 0.00 C ATOM 2000 CD GLN A1041 -2.392 -10.928 10.481 1.00 0.00 C ATOM 2001 OE1 GLN A1041 -2.549 -11.993 11.054 1.00 0.00 O ATOM 2002 NE2 GLN A1041 -3.066 -9.819 10.775 1.00 0.00 N ATOM 0 H GLN A1041 -0.686 -10.067 6.216 1.00 0.00 H new ATOM 0 HA GLN A1041 -0.158 -12.390 7.842 1.00 0.00 H new ATOM 0 HB2 GLN A1041 -2.408 -10.439 7.472 1.00 0.00 H new ATOM 0 HB3 GLN A1041 -2.757 -11.985 8.218 1.00 0.00 H new ATOM 0 HG2 GLN A1041 -0.470 -11.305 9.577 1.00 0.00 H new ATOM 0 HG3 GLN A1041 -1.112 -9.709 9.244 1.00 0.00 H new ATOM 0 HE21 GLN A1041 -2.886 -8.960 10.256 1.00 0.00 H new ATOM 0 HE22 GLN A1041 -3.763 -9.828 11.520 1.00 0.00 H new ATOM 2011 N ALA A1042 -1.679 -12.654 5.012 1.00 0.00 N ATOM 2012 CA ALA A1042 -2.238 -13.586 4.048 1.00 0.00 C ATOM 2013 C ALA A1042 -1.130 -14.508 3.535 1.00 0.00 C ATOM 2014 O ALA A1042 -1.312 -15.723 3.461 1.00 0.00 O ATOM 2015 CB ALA A1042 -2.918 -12.809 2.920 1.00 0.00 C ATOM 0 H ALA A1042 -1.472 -11.728 4.638 1.00 0.00 H new ATOM 0 HA ALA A1042 -2.998 -14.212 4.516 1.00 0.00 H new ATOM 0 HB1 ALA A1042 -3.337 -13.509 2.197 1.00 0.00 H new ATOM 0 HB2 ALA A1042 -3.716 -12.192 3.333 1.00 0.00 H new ATOM 0 HB3 ALA A1042 -2.186 -12.171 2.425 1.00 0.00 H new ATOM 2021 N ARG A1043 -0.005 -13.897 3.195 1.00 0.00 N ATOM 2022 CA ARG A1043 1.133 -14.647 2.691 1.00 0.00 C ATOM 2023 C ARG A1043 1.474 -15.796 3.643 1.00 0.00 C ATOM 2024 O ARG A1043 1.638 -16.936 3.212 1.00 0.00 O ATOM 2025 CB ARG A1043 2.359 -13.747 2.529 1.00 0.00 C ATOM 2026 CG ARG A1043 3.445 -14.442 1.705 1.00 0.00 C ATOM 2027 CD ARG A1043 4.550 -13.459 1.315 1.00 0.00 C ATOM 2028 NE ARG A1043 5.875 -14.103 1.462 1.00 0.00 N ATOM 2029 CZ ARG A1043 6.479 -14.318 2.638 1.00 0.00 C ATOM 2030 NH1 ARG A1043 5.882 -13.941 3.777 1.00 0.00 N ATOM 2031 NH2 ARG A1043 7.681 -14.909 2.676 1.00 0.00 N ATOM 0 H ARG A1043 0.143 -12.890 3.259 1.00 0.00 H new ATOM 0 HA ARG A1043 0.860 -15.047 1.715 1.00 0.00 H new ATOM 0 HB2 ARG A1043 2.069 -12.816 2.043 1.00 0.00 H new ATOM 0 HB3 ARG A1043 2.754 -13.485 3.510 1.00 0.00 H new ATOM 0 HG2 ARG A1043 3.871 -15.265 2.279 1.00 0.00 H new ATOM 0 HG3 ARG A1043 3.004 -14.874 0.807 1.00 0.00 H new ATOM 0 HD2 ARG A1043 4.409 -13.130 0.286 1.00 0.00 H new ATOM 0 HD3 ARG A1043 4.496 -12.570 1.944 1.00 0.00 H new ATOM 0 HE ARG A1043 6.358 -14.402 0.615 1.00 0.00 H new ATOM 0 HH11 ARG A1043 4.967 -13.490 3.748 1.00 0.00 H new ATOM 0 HH12 ARG A1043 6.342 -14.105 4.672 1.00 0.00 H new ATOM 0 HH21 ARG A1043 8.136 -15.195 1.809 1.00 0.00 H new ATOM 0 HH22 ARG A1043 8.141 -15.073 3.572 1.00 0.00 H new ATOM 2045 N LEU A1044 1.572 -15.455 4.920 1.00 0.00 N ATOM 2046 CA LEU A1044 1.891 -16.443 5.936 1.00 0.00 C ATOM 2047 C LEU A1044 0.815 -17.530 5.940 1.00 0.00 C ATOM 2048 O LEU A1044 1.126 -18.717 6.030 1.00 0.00 O ATOM 2049 CB LEU A1044 2.089 -15.769 7.295 1.00 0.00 C ATOM 2050 CG LEU A1044 0.895 -14.977 7.832 1.00 0.00 C ATOM 2051 CD1 LEU A1044 -0.169 -15.913 8.409 1.00 0.00 C ATOM 2052 CD2 LEU A1044 1.346 -13.926 8.848 1.00 0.00 C ATOM 0 H LEU A1044 1.436 -14.508 5.274 1.00 0.00 H new ATOM 0 HA LEU A1044 2.838 -16.932 5.707 1.00 0.00 H new ATOM 0 HB2 LEU A1044 2.348 -16.536 8.024 1.00 0.00 H new ATOM 0 HB3 LEU A1044 2.943 -15.096 7.223 1.00 0.00 H new ATOM 0 HG LEU A1044 0.437 -14.443 6.999 1.00 0.00 H new ATOM 0 HD11 LEU A1044 -1.007 -15.325 8.784 1.00 0.00 H new ATOM 0 HD12 LEU A1044 -0.520 -16.589 7.629 1.00 0.00 H new ATOM 0 HD13 LEU A1044 0.261 -16.493 9.225 1.00 0.00 H new ATOM 0 HD21 LEU A1044 0.478 -13.377 9.214 1.00 0.00 H new ATOM 0 HD22 LEU A1044 1.843 -14.418 9.684 1.00 0.00 H new ATOM 0 HD23 LEU A1044 2.039 -13.233 8.371 1.00 0.00 H new ATOM 2064 N LYS A1045 -0.430 -17.086 5.840 1.00 0.00 N ATOM 2065 CA LYS A1045 -1.554 -18.007 5.831 1.00 0.00 C ATOM 2066 C LYS A1045 -1.194 -19.237 4.995 1.00 0.00 C ATOM 2067 O LYS A1045 -1.664 -20.339 5.271 1.00 0.00 O ATOM 2068 CB LYS A1045 -2.825 -17.296 5.362 1.00 0.00 C ATOM 2069 CG LYS A1045 -3.939 -17.421 6.403 1.00 0.00 C ATOM 2070 CD LYS A1045 -3.957 -16.207 7.335 1.00 0.00 C ATOM 2071 CE LYS A1045 -5.303 -16.087 8.052 1.00 0.00 C ATOM 2072 NZ LYS A1045 -5.132 -16.271 9.511 1.00 0.00 N ATOM 0 H LYS A1045 -0.685 -16.101 5.765 1.00 0.00 H new ATOM 0 HA LYS A1045 -1.766 -18.358 6.841 1.00 0.00 H new ATOM 0 HB2 LYS A1045 -2.610 -16.243 5.178 1.00 0.00 H new ATOM 0 HB3 LYS A1045 -3.157 -17.723 4.416 1.00 0.00 H new ATOM 0 HG2 LYS A1045 -4.902 -17.513 5.901 1.00 0.00 H new ATOM 0 HG3 LYS A1045 -3.796 -18.330 6.987 1.00 0.00 H new ATOM 0 HD2 LYS A1045 -3.156 -16.296 8.069 1.00 0.00 H new ATOM 0 HD3 LYS A1045 -3.764 -15.300 6.761 1.00 0.00 H new ATOM 0 HE2 LYS A1045 -5.742 -15.110 7.852 1.00 0.00 H new ATOM 0 HE3 LYS A1045 -5.996 -16.834 7.664 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 -6.055 -16.186 9.982 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 -4.733 -17.213 9.698 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 -4.487 -15.543 9.880 1.00 0.00 H new ATOM 2086 N MET A1046 -0.362 -19.006 3.989 1.00 0.00 N ATOM 2087 CA MET A1046 0.067 -20.082 3.111 1.00 0.00 C ATOM 2088 C MET A1046 1.232 -20.860 3.726 1.00 0.00 C ATOM 2089 O MET A1046 1.192 -22.086 3.804 1.00 0.00 O ATOM 2090 CB MET A1046 0.495 -19.500 1.763 1.00 0.00 C ATOM 2091 CG MET A1046 1.215 -20.551 0.916 1.00 0.00 C ATOM 2092 SD MET A1046 2.893 -20.033 0.596 1.00 0.00 S ATOM 2093 CE MET A1046 2.598 -18.373 0.012 1.00 0.00 C ATOM 0 H MET A1046 0.026 -18.090 3.763 1.00 0.00 H new ATOM 0 HA MET A1046 -0.769 -20.768 2.971 1.00 0.00 H new ATOM 0 HB2 MET A1046 -0.380 -19.133 1.227 1.00 0.00 H new ATOM 0 HB3 MET A1046 1.152 -18.645 1.924 1.00 0.00 H new ATOM 0 HG2 MET A1046 1.214 -21.510 1.434 1.00 0.00 H new ATOM 0 HG3 MET A1046 0.685 -20.697 -0.025 1.00 0.00 H new ATOM 0 HE1 MET A1046 3.323 -18.126 -0.764 1.00 0.00 H new ATOM 0 HE2 MET A1046 1.590 -18.305 -0.398 1.00 0.00 H new ATOM 0 HE3 MET A1046 2.701 -17.672 0.841 1.00 0.00 H new ATOM 2103 N ILE A1047 2.243 -20.114 4.146 1.00 0.00 N ATOM 2104 CA ILE A1047 3.418 -20.718 4.751 1.00 0.00 C ATOM 2105 C ILE A1047 2.978 -21.708 5.831 1.00 0.00 C ATOM 2106 O ILE A1047 3.513 -22.813 5.921 1.00 0.00 O ATOM 2107 CB ILE A1047 4.374 -19.637 5.261 1.00 0.00 C ATOM 2108 CG1 ILE A1047 5.159 -19.011 4.106 1.00 0.00 C ATOM 2109 CG2 ILE A1047 5.298 -20.191 6.348 1.00 0.00 C ATOM 2110 CD1 ILE A1047 4.981 -17.491 4.083 1.00 0.00 C ATOM 0 H ILE A1047 2.273 -19.097 4.079 1.00 0.00 H new ATOM 0 HA ILE A1047 3.980 -21.284 4.008 1.00 0.00 H new ATOM 0 HB ILE A1047 3.781 -18.843 5.716 1.00 0.00 H new ATOM 0 HG12 ILE A1047 6.217 -19.256 4.206 1.00 0.00 H new ATOM 0 HG13 ILE A1047 4.821 -19.435 3.160 1.00 0.00 H new ATOM 0 HG21 ILE A1047 5.967 -19.403 6.693 1.00 0.00 H new ATOM 0 HG22 ILE A1047 4.700 -20.552 7.185 1.00 0.00 H new ATOM 0 HG23 ILE A1047 5.886 -21.014 5.941 1.00 0.00 H new ATOM 0 HD11 ILE A1047 5.549 -17.071 3.253 1.00 0.00 H new ATOM 0 HD12 ILE A1047 3.925 -17.250 3.959 1.00 0.00 H new ATOM 0 HD13 ILE A1047 5.342 -17.068 5.021 1.00 0.00 H new ATOM 2122 N SER A1048 2.008 -21.278 6.624 1.00 0.00 N ATOM 2123 CA SER A1048 1.490 -22.113 7.694 1.00 0.00 C ATOM 2124 C SER A1048 0.175 -22.764 7.260 1.00 0.00 C ATOM 2125 O SER A1048 -0.857 -22.576 7.903 1.00 0.00 O ATOM 2126 CB SER A1048 1.283 -21.303 8.975 1.00 0.00 C ATOM 2127 OG SER A1048 1.619 -22.051 10.140 1.00 0.00 O ATOM 0 H SER A1048 1.567 -20.362 6.547 1.00 0.00 H new ATOM 0 HA SER A1048 2.223 -22.892 7.904 1.00 0.00 H new ATOM 0 HB2 SER A1048 1.893 -20.400 8.936 1.00 0.00 H new ATOM 0 HB3 SER A1048 0.243 -20.983 9.037 1.00 0.00 H new ATOM 0 HG SER A1048 1.475 -21.498 10.936 1.00 0.00 H new ATOM 2133 N GLN A1049 0.254 -23.516 6.172 1.00 0.00 N ATOM 2134 CA GLN A1049 -0.917 -24.195 5.644 1.00 0.00 C ATOM 2135 C GLN A1049 -0.955 -25.645 6.133 1.00 0.00 C ATOM 2136 O GLN A1049 -2.018 -26.263 6.172 1.00 0.00 O ATOM 2137 CB GLN A1049 -0.947 -24.130 4.116 1.00 0.00 C ATOM 2138 CG GLN A1049 0.286 -24.808 3.515 1.00 0.00 C ATOM 2139 CD GLN A1049 -0.116 -25.980 2.616 1.00 0.00 C ATOM 2140 OE1 GLN A1049 -1.006 -26.755 2.925 1.00 0.00 O ATOM 2141 NE2 GLN A1049 0.588 -26.065 1.491 1.00 0.00 N ATOM 0 H GLN A1049 1.111 -23.670 5.641 1.00 0.00 H new ATOM 0 HA GLN A1049 -1.806 -23.684 6.013 1.00 0.00 H new ATOM 0 HB2 GLN A1049 -1.850 -24.615 3.745 1.00 0.00 H new ATOM 0 HB3 GLN A1049 -0.988 -23.090 3.793 1.00 0.00 H new ATOM 0 HG2 GLN A1049 0.859 -24.082 2.938 1.00 0.00 H new ATOM 0 HG3 GLN A1049 0.935 -25.164 4.315 1.00 0.00 H new ATOM 0 HE21 GLN A1049 1.320 -25.382 1.294 1.00 0.00 H new ATOM 0 HE22 GLN A1049 0.396 -26.813 0.825 1.00 0.00 H new ATOM 2150 N SER A1050 0.218 -26.145 6.492 1.00 0.00 N ATOM 2151 CA SER A1050 0.333 -27.510 6.976 1.00 0.00 C ATOM 2152 C SER A1050 1.807 -27.887 7.136 1.00 0.00 C ATOM 2153 O SER A1050 2.290 -28.058 8.254 1.00 0.00 O ATOM 2154 CB SER A1050 -0.366 -28.490 6.031 1.00 0.00 C ATOM 2155 OG SER A1050 0.297 -29.751 5.985 1.00 0.00 O ATOM 0 H SER A1050 1.097 -25.629 6.457 1.00 0.00 H new ATOM 0 HA SER A1050 -0.158 -27.571 7.947 1.00 0.00 H new ATOM 0 HB2 SER A1050 -1.397 -28.634 6.355 1.00 0.00 H new ATOM 0 HB3 SER A1050 -0.404 -28.063 5.029 1.00 0.00 H new ATOM 0 HG SER A1050 -0.180 -30.349 5.373 1.00 0.00 H new ATOM 2161 N ARG A1051 2.481 -28.004 6.002 1.00 0.00 N ATOM 2162 CA ARG A1051 3.891 -28.358 6.002 1.00 0.00 C ATOM 2163 C ARG A1051 4.683 -27.377 6.869 1.00 0.00 C ATOM 2164 O ARG A1051 4.610 -26.166 6.668 1.00 0.00 O ATOM 2165 CB ARG A1051 4.461 -28.348 4.582 1.00 0.00 C ATOM 2166 CG ARG A1051 5.399 -29.536 4.360 1.00 0.00 C ATOM 2167 CD ARG A1051 5.802 -29.650 2.888 1.00 0.00 C ATOM 2168 NE ARG A1051 5.715 -31.060 2.447 1.00 0.00 N ATOM 2169 CZ ARG A1051 6.471 -32.050 2.941 1.00 0.00 C ATOM 2170 NH1 ARG A1051 7.375 -31.790 3.895 1.00 0.00 N ATOM 2171 NH2 ARG A1051 6.323 -33.299 2.480 1.00 0.00 N ATOM 0 H ARG A1051 2.077 -27.860 5.076 1.00 0.00 H new ATOM 0 HA ARG A1051 3.981 -29.365 6.410 1.00 0.00 H new ATOM 0 HB2 ARG A1051 3.646 -28.383 3.859 1.00 0.00 H new ATOM 0 HB3 ARG A1051 5.000 -27.417 4.409 1.00 0.00 H new ATOM 0 HG2 ARG A1051 6.290 -29.420 4.977 1.00 0.00 H new ATOM 0 HG3 ARG A1051 4.908 -30.456 4.679 1.00 0.00 H new ATOM 0 HD2 ARG A1051 5.150 -29.028 2.275 1.00 0.00 H new ATOM 0 HD3 ARG A1051 6.818 -29.279 2.751 1.00 0.00 H new ATOM 0 HE ARG A1051 5.037 -31.293 1.721 1.00 0.00 H new ATOM 0 HH11 ARG A1051 7.488 -30.839 4.245 1.00 0.00 H new ATOM 0 HH12 ARG A1051 7.951 -32.543 4.271 1.00 0.00 H new ATOM 0 HH21 ARG A1051 5.635 -33.496 1.753 1.00 0.00 H new ATOM 0 HH22 ARG A1051 6.898 -34.053 2.856 1.00 0.00 H new ATOM 2185 N PRO A1052 5.443 -27.953 7.839 1.00 0.00 N ATOM 2186 CA PRO A1052 6.249 -27.143 8.737 1.00 0.00 C ATOM 2187 C PRO A1052 7.496 -26.612 8.028 1.00 0.00 C ATOM 2188 O PRO A1052 7.615 -25.411 7.790 1.00 0.00 O ATOM 2189 CB PRO A1052 6.575 -28.059 9.906 1.00 0.00 C ATOM 2190 CG PRO A1052 6.337 -29.474 9.406 1.00 0.00 C ATOM 2191 CD PRO A1052 5.555 -29.384 8.106 1.00 0.00 C ATOM 0 HA PRO A1052 5.727 -26.250 9.081 1.00 0.00 H new ATOM 0 HB2 PRO A1052 7.608 -27.927 10.229 1.00 0.00 H new ATOM 0 HB3 PRO A1052 5.942 -27.837 10.765 1.00 0.00 H new ATOM 0 HG2 PRO A1052 7.285 -29.987 9.246 1.00 0.00 H new ATOM 0 HG3 PRO A1052 5.783 -30.052 10.146 1.00 0.00 H new ATOM 0 HD2 PRO A1052 6.072 -29.899 7.296 1.00 0.00 H new ATOM 0 HD3 PRO A1052 4.573 -29.847 8.202 1.00 0.00 H new ATOM 2199 N HIS A1053 8.393 -27.533 7.709 1.00 0.00 N ATOM 2200 CA HIS A1053 9.627 -27.173 7.031 1.00 0.00 C ATOM 2201 C HIS A1053 9.589 -27.685 5.590 1.00 0.00 C ATOM 2202 O HIS A1053 9.156 -28.808 5.337 1.00 0.00 O ATOM 2203 CB HIS A1053 10.843 -27.682 7.809 1.00 0.00 C ATOM 2204 CG HIS A1053 11.155 -29.141 7.575 1.00 0.00 C ATOM 2205 ND1 HIS A1053 12.345 -29.572 7.015 1.00 0.00 N ATOM 2206 CD2 HIS A1053 10.421 -30.262 7.832 1.00 0.00 C ATOM 2207 CE1 HIS A1053 12.317 -30.895 6.942 1.00 0.00 C ATOM 2208 NE2 HIS A1053 11.124 -31.320 7.448 1.00 0.00 N ATOM 0 H HIS A1053 8.290 -28.528 7.907 1.00 0.00 H new ATOM 0 HA HIS A1053 9.721 -26.088 6.992 1.00 0.00 H new ATOM 0 HB2 HIS A1053 11.713 -27.086 7.533 1.00 0.00 H new ATOM 0 HB3 HIS A1053 10.672 -27.524 8.874 1.00 0.00 H new ATOM 0 HD2 HIS A1053 9.435 -30.284 8.273 1.00 0.00 H new ATOM 0 HE1 HIS A1053 13.101 -31.526 6.551 1.00 0.00 H new ATOM 0 HE2 HIS A1053 10.822 -32.292 7.520 1.00 0.00 H new TER 2216 HIS A1053