USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=27 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: A1011 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A1012 SER OG : rot -98:sc= -0.13! USER MOD Set 2.1: A 942 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 954 MET CE :methyl 143:sc= -5.08! (180deg=-8!) USER MOD Set 3.1: A 939 MET CE :methyl 153:sc= -1.77 (180deg=-3.17!) USER MOD Set 3.2: A1021 MET CE :methyl -167:sc= -3.52! (180deg=-4.42!) USER MOD Single : A 915 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 917 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 921 SER OG : rot 180:sc= -0.12 USER MOD Single : A 922 ASN : amide:sc= -0.665 X(o=-0.66,f=-0.96) USER MOD Single : A 924 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 928 ASN : amide:sc= -0.944 X(o=-0.94,f=-0.53!) USER MOD Single : A 930 THR OG1 : rot -116:sc= -0.953! USER MOD Single : A 934 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 940 SER OG : rot 5:sc= 0.915 USER MOD Single : A 941 SER OG : rot 180:sc= 0 USER MOD Single : A 944 GLN : amide:sc= -0.0056 X(o=-0.0056,f=-0.063) USER MOD Single : A 951 TYR OH : rot 130:sc= -1.42 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 -23:sc= -2.79! USER MOD Single : A 972 SER OG : rot -45:sc= -8.85! USER MOD Single : A 979 SER OG : rot 180:sc= 0 USER MOD Single : A 980 THR OG1 : rot -34:sc= -1.85! USER MOD Single : A 981 HIS :FLIP no HD1:sc= -0.813 F(o=-2.1!,f=-0.81) USER MOD Single : A 986 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 988 GLN : amide:sc= -5.05! C(o=-5!,f=-7.8!) USER MOD Single : A 989 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 992 ASN : amide:sc= -0.0937 X(o=-0.094,f=-0.58) USER MOD Single : A 993 SER OG : rot 180:sc= 0 USER MOD Single : A1000 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A1001 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1002 MET CE :methyl -148:sc= -3.29 (180deg=-6.87!) USER MOD Single : A1003 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1006 GLN : amide:sc= -10.4! C(o=-10!,f=-15!) USER MOD Single : A1007 GLN : amide:sc= -0.231 K(o=-0.23,f=-2!) USER MOD Single : A1008 TYR OH : rot 180:sc= 0 USER MOD Single : A1010 MET CE :methyl 156:sc= -0.155 (180deg=-0.537) USER MOD Single : A1014 GLN : amide:sc= -0.175 K(o=-0.18,f=-4.7!) USER MOD Single : A1015 GLN : amide:sc= -0.257 K(o=-0.26,f=-1.5!) USER MOD Single : A1017 TYR OH : rot 68:sc= -0.554! USER MOD Single : A1018 LYS NZ :NH3+ -115:sc= -8.07! (180deg=-11.7!) USER MOD Single : A1019 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1020 GLN : amide:sc= -0.992 K(o=-0.99,f=-2.4!) USER MOD Single : A1023 THR OG1 : rot -150:sc= -0.471 USER MOD Single : A1026 HIS : no HD1:sc= -0.941 K(o=-0.94,f=-1.9!) USER MOD Single : A1033 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1034 ASN : amide:sc= -0.0391 K(o=-0.039,f=-1.3) USER MOD Single : A1041 GLN : amide:sc= -0.349 X(o=-0.35,f=0) USER MOD Single : A1045 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1046 MET CE :methyl -141:sc= -0.392 (180deg=-1.99!) USER MOD Single : A1048 SER OG : rot 180:sc= 0 USER MOD Single : A1049 GLN : amide:sc=-0.00826 X(o=-0.0083,f=-0.036) USER MOD Single : A1050 SER OG : rot 180:sc= 0 USER MOD Single : A1053 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 915 8.814 -23.425 -6.134 1.00 0.00 N ATOM 2 CA MET A 915 8.859 -23.646 -4.699 1.00 0.00 C ATOM 3 C MET A 915 8.505 -22.368 -3.936 1.00 0.00 C ATOM 4 O MET A 915 7.552 -22.348 -3.158 1.00 0.00 O ATOM 5 CB MET A 915 10.261 -24.109 -4.297 1.00 0.00 C ATOM 6 CG MET A 915 10.201 -25.083 -3.119 1.00 0.00 C ATOM 7 SD MET A 915 10.352 -26.762 -3.707 1.00 0.00 S ATOM 8 CE MET A 915 10.072 -27.650 -2.184 1.00 0.00 C ATOM 0 HA MET A 915 8.127 -24.413 -4.445 1.00 0.00 H new ATOM 0 HB2 MET A 915 10.746 -24.590 -5.146 1.00 0.00 H new ATOM 0 HB3 MET A 915 10.870 -23.246 -4.029 1.00 0.00 H new ATOM 0 HG2 MET A 915 11.002 -24.863 -2.413 1.00 0.00 H new ATOM 0 HG3 MET A 915 9.260 -24.960 -2.582 1.00 0.00 H new ATOM 0 HE1 MET A 915 10.132 -28.722 -2.372 1.00 0.00 H new ATOM 0 HE2 MET A 915 10.830 -27.367 -1.453 1.00 0.00 H new ATOM 0 HE3 MET A 915 9.084 -27.404 -1.796 1.00 0.00 H new ATOM 18 N ALA A 916 9.292 -21.331 -4.184 1.00 0.00 N ATOM 19 CA ALA A 916 9.074 -20.052 -3.530 1.00 0.00 C ATOM 20 C ALA A 916 8.426 -19.082 -4.521 1.00 0.00 C ATOM 21 O ALA A 916 9.111 -18.492 -5.355 1.00 0.00 O ATOM 22 CB ALA A 916 10.402 -19.526 -2.982 1.00 0.00 C ATOM 0 H ALA A 916 10.082 -21.351 -4.829 1.00 0.00 H new ATOM 0 HA ALA A 916 8.394 -20.163 -2.685 1.00 0.00 H new ATOM 0 HB1 ALA A 916 10.239 -18.566 -2.491 1.00 0.00 H new ATOM 0 HB2 ALA A 916 10.806 -20.238 -2.262 1.00 0.00 H new ATOM 0 HB3 ALA A 916 11.109 -19.399 -3.802 1.00 0.00 H new ATOM 28 N ASN A 917 7.114 -18.947 -4.396 1.00 0.00 N ATOM 29 CA ASN A 917 6.367 -18.059 -5.269 1.00 0.00 C ATOM 30 C ASN A 917 6.850 -16.622 -5.062 1.00 0.00 C ATOM 31 O ASN A 917 6.231 -15.856 -4.325 1.00 0.00 O ATOM 32 CB ASN A 917 4.871 -18.105 -4.952 1.00 0.00 C ATOM 33 CG ASN A 917 4.158 -19.143 -5.821 1.00 0.00 C ATOM 34 OD1 ASN A 917 4.046 -20.308 -5.477 1.00 0.00 O ATOM 35 ND2 ASN A 917 3.684 -18.657 -6.965 1.00 0.00 N ATOM 0 H ASN A 917 6.549 -19.438 -3.703 1.00 0.00 H new ATOM 0 HA ASN A 917 6.528 -18.383 -6.297 1.00 0.00 H new ATOM 0 HB2 ASN A 917 4.726 -18.346 -3.899 1.00 0.00 H new ATOM 0 HB3 ASN A 917 4.430 -17.122 -5.118 1.00 0.00 H new ATOM 0 HD21 ASN A 917 3.192 -19.270 -7.615 1.00 0.00 H new ATOM 0 HD22 ASN A 917 3.812 -17.671 -7.192 1.00 0.00 H new ATOM 42 N LEU A 918 7.950 -16.300 -5.726 1.00 0.00 N ATOM 43 CA LEU A 918 8.523 -14.968 -5.624 1.00 0.00 C ATOM 44 C LEU A 918 8.674 -14.374 -7.026 1.00 0.00 C ATOM 45 O LEU A 918 9.790 -14.201 -7.514 1.00 0.00 O ATOM 46 CB LEU A 918 9.829 -15.007 -4.828 1.00 0.00 C ATOM 47 CG LEU A 918 9.748 -14.515 -3.382 1.00 0.00 C ATOM 48 CD1 LEU A 918 10.350 -15.541 -2.419 1.00 0.00 C ATOM 49 CD2 LEU A 918 10.400 -13.139 -3.233 1.00 0.00 C ATOM 0 H LEU A 918 8.460 -16.938 -6.337 1.00 0.00 H new ATOM 0 HA LEU A 918 7.857 -14.308 -5.068 1.00 0.00 H new ATOM 0 HB2 LEU A 918 10.197 -16.033 -4.822 1.00 0.00 H new ATOM 0 HB3 LEU A 918 10.570 -14.406 -5.354 1.00 0.00 H new ATOM 0 HG LEU A 918 8.696 -14.403 -3.118 1.00 0.00 H new ATOM 0 HD11 LEU A 918 10.280 -15.166 -1.398 1.00 0.00 H new ATOM 0 HD12 LEU A 918 9.803 -16.480 -2.499 1.00 0.00 H new ATOM 0 HD13 LEU A 918 11.397 -15.708 -2.673 1.00 0.00 H new ATOM 0 HD21 LEU A 918 10.328 -12.813 -2.195 1.00 0.00 H new ATOM 0 HD22 LEU A 918 11.449 -13.200 -3.523 1.00 0.00 H new ATOM 0 HD23 LEU A 918 9.888 -12.422 -3.875 1.00 0.00 H new ATOM 61 N ASP A 919 7.535 -14.077 -7.634 1.00 0.00 N ATOM 62 CA ASP A 919 7.526 -13.506 -8.970 1.00 0.00 C ATOM 63 C ASP A 919 7.713 -11.990 -8.873 1.00 0.00 C ATOM 64 O ASP A 919 8.122 -11.477 -7.833 1.00 0.00 O ATOM 65 CB ASP A 919 6.195 -13.774 -9.675 1.00 0.00 C ATOM 66 CG ASP A 919 6.308 -14.100 -11.166 1.00 0.00 C ATOM 67 OD1 ASP A 919 7.372 -14.630 -11.552 1.00 0.00 O ATOM 68 OD2 ASP A 919 5.327 -13.812 -11.885 1.00 0.00 O ATOM 0 H ASP A 919 6.611 -14.221 -7.226 1.00 0.00 H new ATOM 0 HA ASP A 919 8.334 -13.966 -9.539 1.00 0.00 H new ATOM 0 HB2 ASP A 919 5.696 -14.603 -9.174 1.00 0.00 H new ATOM 0 HB3 ASP A 919 5.556 -12.899 -9.557 1.00 0.00 H new ATOM 73 N ARG A 920 7.403 -11.317 -9.971 1.00 0.00 N ATOM 74 CA ARG A 920 7.531 -9.870 -10.023 1.00 0.00 C ATOM 75 C ARG A 920 6.243 -9.205 -9.533 1.00 0.00 C ATOM 76 O ARG A 920 6.046 -8.007 -9.729 1.00 0.00 O ATOM 77 CB ARG A 920 7.834 -9.395 -11.445 1.00 0.00 C ATOM 78 CG ARG A 920 9.338 -9.198 -11.649 1.00 0.00 C ATOM 79 CD ARG A 920 9.767 -9.663 -13.042 1.00 0.00 C ATOM 80 NE ARG A 920 10.829 -8.775 -13.566 1.00 0.00 N ATOM 81 CZ ARG A 920 11.097 -8.609 -14.879 1.00 0.00 C ATOM 82 NH1 ARG A 920 10.381 -9.271 -15.813 1.00 0.00 N ATOM 83 NH2 ARG A 920 12.069 -7.791 -15.236 1.00 0.00 N ATOM 0 H ARG A 920 7.064 -11.746 -10.832 1.00 0.00 H new ATOM 0 HA ARG A 920 8.359 -9.587 -9.374 1.00 0.00 H new ATOM 0 HB2 ARG A 920 7.458 -10.124 -12.163 1.00 0.00 H new ATOM 0 HB3 ARG A 920 7.311 -8.458 -11.638 1.00 0.00 H new ATOM 0 HG2 ARG A 920 9.592 -8.146 -11.519 1.00 0.00 H new ATOM 0 HG3 ARG A 920 9.888 -9.755 -10.890 1.00 0.00 H new ATOM 0 HD2 ARG A 920 10.130 -10.690 -12.996 1.00 0.00 H new ATOM 0 HD3 ARG A 920 8.911 -9.657 -13.716 1.00 0.00 H new ATOM 0 HE ARG A 920 11.394 -8.256 -12.893 1.00 0.00 H new ATOM 0 HH11 ARG A 920 9.632 -9.902 -15.529 1.00 0.00 H new ATOM 0 HH12 ARG A 920 10.590 -9.140 -16.803 1.00 0.00 H new ATOM 0 HH21 ARG A 920 12.605 -7.295 -14.524 1.00 0.00 H new ATOM 0 HH22 ARG A 920 12.284 -7.655 -16.224 1.00 0.00 H new ATOM 96 N SER A 921 5.400 -10.012 -8.905 1.00 0.00 N ATOM 97 CA SER A 921 4.137 -9.517 -8.386 1.00 0.00 C ATOM 98 C SER A 921 4.335 -8.950 -6.979 1.00 0.00 C ATOM 99 O SER A 921 4.216 -7.743 -6.769 1.00 0.00 O ATOM 100 CB SER A 921 3.078 -10.621 -8.369 1.00 0.00 C ATOM 101 OG SER A 921 2.911 -11.220 -9.651 1.00 0.00 O ATOM 0 H SER A 921 5.567 -11.005 -8.744 1.00 0.00 H new ATOM 0 HA SER A 921 3.785 -8.723 -9.044 1.00 0.00 H new ATOM 0 HB2 SER A 921 3.363 -11.385 -7.646 1.00 0.00 H new ATOM 0 HB3 SER A 921 2.127 -10.206 -8.036 1.00 0.00 H new ATOM 0 HG SER A 921 2.228 -11.921 -9.598 1.00 0.00 H new ATOM 107 N ASN A 922 4.635 -9.846 -6.051 1.00 0.00 N ATOM 108 CA ASN A 922 4.851 -9.451 -4.670 1.00 0.00 C ATOM 109 C ASN A 922 5.980 -8.419 -4.610 1.00 0.00 C ATOM 110 O ASN A 922 6.121 -7.705 -3.619 1.00 0.00 O ATOM 111 CB ASN A 922 5.260 -10.649 -3.811 1.00 0.00 C ATOM 112 CG ASN A 922 6.650 -11.155 -4.201 1.00 0.00 C ATOM 113 OD1 ASN A 922 7.663 -10.749 -3.654 1.00 0.00 O ATOM 114 ND2 ASN A 922 6.642 -12.061 -5.174 1.00 0.00 N ATOM 0 H ASN A 922 4.734 -10.846 -6.229 1.00 0.00 H new ATOM 0 HA ASN A 922 3.918 -9.036 -4.289 1.00 0.00 H new ATOM 0 HB2 ASN A 922 5.255 -10.365 -2.759 1.00 0.00 H new ATOM 0 HB3 ASN A 922 4.531 -11.451 -3.928 1.00 0.00 H new ATOM 0 HD21 ASN A 922 7.520 -12.460 -5.506 1.00 0.00 H new ATOM 0 HD22 ASN A 922 5.758 -12.357 -5.588 1.00 0.00 H new ATOM 121 N ASP A 923 6.754 -8.374 -5.684 1.00 0.00 N ATOM 122 CA ASP A 923 7.866 -7.442 -5.766 1.00 0.00 C ATOM 123 C ASP A 923 7.351 -6.081 -6.237 1.00 0.00 C ATOM 124 O ASP A 923 7.387 -5.106 -5.487 1.00 0.00 O ATOM 125 CB ASP A 923 8.915 -7.924 -6.770 1.00 0.00 C ATOM 126 CG ASP A 923 10.023 -8.797 -6.178 1.00 0.00 C ATOM 127 OD1 ASP A 923 9.696 -9.936 -5.779 1.00 0.00 O ATOM 128 OD2 ASP A 923 11.173 -8.307 -6.139 1.00 0.00 O ATOM 0 H ASP A 923 6.633 -8.968 -6.505 1.00 0.00 H new ATOM 0 HA ASP A 923 8.319 -7.370 -4.777 1.00 0.00 H new ATOM 0 HB2 ASP A 923 8.412 -8.486 -7.557 1.00 0.00 H new ATOM 0 HB3 ASP A 923 9.372 -7.054 -7.242 1.00 0.00 H new ATOM 133 N LYS A 924 6.883 -6.057 -7.476 1.00 0.00 N ATOM 134 CA LYS A 924 6.361 -4.832 -8.056 1.00 0.00 C ATOM 135 C LYS A 924 5.432 -4.151 -7.048 1.00 0.00 C ATOM 136 O LYS A 924 5.576 -2.961 -6.772 1.00 0.00 O ATOM 137 CB LYS A 924 5.700 -5.116 -9.406 1.00 0.00 C ATOM 138 CG LYS A 924 5.359 -3.815 -10.135 1.00 0.00 C ATOM 139 CD LYS A 924 6.581 -3.265 -10.874 1.00 0.00 C ATOM 140 CE LYS A 924 6.472 -1.750 -11.059 1.00 0.00 C ATOM 141 NZ LYS A 924 6.733 -1.380 -12.469 1.00 0.00 N ATOM 0 H LYS A 924 6.855 -6.867 -8.095 1.00 0.00 H new ATOM 0 HA LYS A 924 7.172 -4.135 -8.265 1.00 0.00 H new ATOM 0 HB2 LYS A 924 6.368 -5.718 -10.022 1.00 0.00 H new ATOM 0 HB3 LYS A 924 4.793 -5.701 -9.255 1.00 0.00 H new ATOM 0 HG2 LYS A 924 4.550 -3.992 -10.844 1.00 0.00 H new ATOM 0 HG3 LYS A 924 4.999 -3.076 -9.419 1.00 0.00 H new ATOM 0 HD2 LYS A 924 7.486 -3.503 -10.315 1.00 0.00 H new ATOM 0 HD3 LYS A 924 6.671 -3.749 -11.847 1.00 0.00 H new ATOM 0 HE2 LYS A 924 5.478 -1.412 -10.766 1.00 0.00 H new ATOM 0 HE3 LYS A 924 7.185 -1.246 -10.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 6.655 -0.349 -12.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 7.691 -1.685 -12.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 6.037 -1.846 -13.085 1.00 0.00 H new ATOM 155 N VAL A 925 4.501 -4.935 -6.526 1.00 0.00 N ATOM 156 CA VAL A 925 3.550 -4.423 -5.555 1.00 0.00 C ATOM 157 C VAL A 925 4.309 -3.788 -4.389 1.00 0.00 C ATOM 158 O VAL A 925 4.180 -2.590 -4.138 1.00 0.00 O ATOM 159 CB VAL A 925 2.601 -5.540 -5.113 1.00 0.00 C ATOM 160 CG1 VAL A 925 1.538 -5.006 -4.151 1.00 0.00 C ATOM 161 CG2 VAL A 925 1.956 -6.221 -6.321 1.00 0.00 C ATOM 0 H VAL A 925 4.385 -5.922 -6.757 1.00 0.00 H new ATOM 0 HA VAL A 925 2.930 -3.645 -6.001 1.00 0.00 H new ATOM 0 HB VAL A 925 3.188 -6.289 -4.581 1.00 0.00 H new ATOM 0 HG11 VAL A 925 0.877 -5.819 -3.852 1.00 0.00 H new ATOM 0 HG12 VAL A 925 2.023 -4.589 -3.268 1.00 0.00 H new ATOM 0 HG13 VAL A 925 0.956 -4.229 -4.647 1.00 0.00 H new ATOM 0 HG21 VAL A 925 1.287 -7.010 -5.979 1.00 0.00 H new ATOM 0 HG22 VAL A 925 1.389 -5.487 -6.893 1.00 0.00 H new ATOM 0 HG23 VAL A 925 2.732 -6.652 -6.953 1.00 0.00 H new ATOM 171 N TYR A 926 5.085 -4.617 -3.707 1.00 0.00 N ATOM 172 CA TYR A 926 5.866 -4.151 -2.574 1.00 0.00 C ATOM 173 C TYR A 926 6.728 -2.948 -2.960 1.00 0.00 C ATOM 174 O TYR A 926 6.940 -2.046 -2.151 1.00 0.00 O ATOM 175 CB TYR A 926 6.780 -5.315 -2.184 1.00 0.00 C ATOM 176 CG TYR A 926 6.109 -6.361 -1.292 1.00 0.00 C ATOM 177 CD1 TYR A 926 4.804 -6.739 -1.534 1.00 0.00 C ATOM 178 CD2 TYR A 926 6.808 -6.927 -0.246 1.00 0.00 C ATOM 179 CE1 TYR A 926 4.172 -7.724 -0.695 1.00 0.00 C ATOM 180 CE2 TYR A 926 6.177 -7.912 0.593 1.00 0.00 C ATOM 181 CZ TYR A 926 4.890 -8.262 0.328 1.00 0.00 C ATOM 182 OH TYR A 926 4.293 -9.192 1.120 1.00 0.00 O ATOM 0 H TYR A 926 5.190 -5.610 -3.917 1.00 0.00 H new ATOM 0 HA TYR A 926 5.212 -3.842 -1.758 1.00 0.00 H new ATOM 0 HB2 TYR A 926 7.138 -5.802 -3.091 1.00 0.00 H new ATOM 0 HB3 TYR A 926 7.655 -4.919 -1.668 1.00 0.00 H new ATOM 0 HD1 TYR A 926 4.257 -6.296 -2.353 1.00 0.00 H new ATOM 0 HD2 TYR A 926 7.829 -6.631 -0.056 1.00 0.00 H new ATOM 0 HE1 TYR A 926 3.151 -8.029 -0.874 1.00 0.00 H new ATOM 0 HE2 TYR A 926 6.714 -8.363 1.415 1.00 0.00 H new ATOM 0 HH TYR A 926 4.924 -9.489 1.808 1.00 0.00 H new ATOM 192 N GLU A 927 7.204 -2.974 -4.196 1.00 0.00 N ATOM 193 CA GLU A 927 8.039 -1.896 -4.700 1.00 0.00 C ATOM 194 C GLU A 927 7.203 -0.632 -4.910 1.00 0.00 C ATOM 195 O GLU A 927 7.575 0.446 -4.448 1.00 0.00 O ATOM 196 CB GLU A 927 8.745 -2.308 -5.993 1.00 0.00 C ATOM 197 CG GLU A 927 9.909 -3.258 -5.703 1.00 0.00 C ATOM 198 CD GLU A 927 11.137 -2.488 -5.213 1.00 0.00 C ATOM 199 OE1 GLU A 927 11.919 -2.054 -6.085 1.00 0.00 O ATOM 200 OE2 GLU A 927 11.265 -2.351 -3.977 1.00 0.00 O ATOM 0 H GLU A 927 7.028 -3.725 -4.864 1.00 0.00 H new ATOM 0 HA GLU A 927 8.808 -1.681 -3.958 1.00 0.00 H new ATOM 0 HB2 GLU A 927 8.033 -2.792 -6.662 1.00 0.00 H new ATOM 0 HB3 GLU A 927 9.114 -1.421 -6.508 1.00 0.00 H new ATOM 0 HG2 GLU A 927 9.609 -3.987 -4.951 1.00 0.00 H new ATOM 0 HG3 GLU A 927 10.161 -3.816 -6.605 1.00 0.00 H new ATOM 207 N ASN A 928 6.091 -0.805 -5.609 1.00 0.00 N ATOM 208 CA ASN A 928 5.200 0.309 -5.886 1.00 0.00 C ATOM 209 C ASN A 928 4.737 0.927 -4.565 1.00 0.00 C ATOM 210 O ASN A 928 4.800 2.142 -4.389 1.00 0.00 O ATOM 211 CB ASN A 928 3.960 -0.155 -6.652 1.00 0.00 C ATOM 212 CG ASN A 928 3.412 0.965 -7.538 1.00 0.00 C ATOM 213 OD1 ASN A 928 2.440 1.628 -7.215 1.00 0.00 O ATOM 214 ND2 ASN A 928 4.087 1.138 -8.671 1.00 0.00 N ATOM 0 H ASN A 928 5.787 -1.700 -5.992 1.00 0.00 H new ATOM 0 HA ASN A 928 5.745 1.035 -6.489 1.00 0.00 H new ATOM 0 HB2 ASN A 928 4.210 -1.020 -7.266 1.00 0.00 H new ATOM 0 HB3 ASN A 928 3.192 -0.475 -5.948 1.00 0.00 H new ATOM 0 HD21 ASN A 928 3.799 1.861 -9.331 1.00 0.00 H new ATOM 0 HD22 ASN A 928 4.892 0.548 -8.880 1.00 0.00 H new ATOM 221 N VAL A 929 4.281 0.061 -3.672 1.00 0.00 N ATOM 222 CA VAL A 929 3.807 0.507 -2.372 1.00 0.00 C ATOM 223 C VAL A 929 4.874 1.387 -1.719 1.00 0.00 C ATOM 224 O VAL A 929 4.604 2.532 -1.359 1.00 0.00 O ATOM 225 CB VAL A 929 3.421 -0.700 -1.514 1.00 0.00 C ATOM 226 CG1 VAL A 929 3.060 -0.268 -0.092 1.00 0.00 C ATOM 227 CG2 VAL A 929 2.275 -1.485 -2.156 1.00 0.00 C ATOM 0 H VAL A 929 4.230 -0.947 -3.822 1.00 0.00 H new ATOM 0 HA VAL A 929 2.908 1.113 -2.481 1.00 0.00 H new ATOM 0 HB VAL A 929 4.287 -1.360 -1.454 1.00 0.00 H new ATOM 0 HG11 VAL A 929 2.790 -1.144 0.497 1.00 0.00 H new ATOM 0 HG12 VAL A 929 3.916 0.227 0.366 1.00 0.00 H new ATOM 0 HG13 VAL A 929 2.217 0.422 -0.124 1.00 0.00 H new ATOM 0 HG21 VAL A 929 2.020 -2.337 -1.526 1.00 0.00 H new ATOM 0 HG22 VAL A 929 1.404 -0.838 -2.260 1.00 0.00 H new ATOM 0 HG23 VAL A 929 2.583 -1.840 -3.139 1.00 0.00 H new ATOM 237 N THR A 930 6.064 0.820 -1.587 1.00 0.00 N ATOM 238 CA THR A 930 7.173 1.540 -0.984 1.00 0.00 C ATOM 239 C THR A 930 7.405 2.867 -1.708 1.00 0.00 C ATOM 240 O THR A 930 7.409 3.927 -1.084 1.00 0.00 O ATOM 241 CB THR A 930 8.396 0.620 -0.996 1.00 0.00 C ATOM 242 OG1 THR A 930 8.295 -0.076 -2.235 1.00 0.00 O ATOM 243 CG2 THR A 930 8.308 -0.484 0.060 1.00 0.00 C ATOM 0 H THR A 930 6.285 -0.130 -1.887 1.00 0.00 H new ATOM 0 HA THR A 930 6.956 1.804 0.051 1.00 0.00 H new ATOM 0 HB THR A 930 9.296 1.211 -0.829 1.00 0.00 H new ATOM 0 HG1 THR A 930 8.173 -1.033 -2.064 1.00 0.00 H new ATOM 0 HG21 THR A 930 9.200 -1.108 0.009 1.00 0.00 H new ATOM 0 HG22 THR A 930 8.235 -0.035 1.051 1.00 0.00 H new ATOM 0 HG23 THR A 930 7.426 -1.096 -0.126 1.00 0.00 H new ATOM 251 N GLY A 931 7.592 2.766 -3.016 1.00 0.00 N ATOM 252 CA GLY A 931 7.823 3.946 -3.832 1.00 0.00 C ATOM 253 C GLY A 931 6.704 4.971 -3.644 1.00 0.00 C ATOM 254 O GLY A 931 6.940 6.176 -3.725 1.00 0.00 O ATOM 0 H GLY A 931 7.588 1.885 -3.531 1.00 0.00 H new ATOM 0 HA2 GLY A 931 8.780 4.395 -3.566 1.00 0.00 H new ATOM 0 HA3 GLY A 931 7.886 3.660 -4.882 1.00 0.00 H new ATOM 258 N LEU A 932 5.509 4.456 -3.396 1.00 0.00 N ATOM 259 CA LEU A 932 4.352 5.313 -3.195 1.00 0.00 C ATOM 260 C LEU A 932 4.507 6.071 -1.875 1.00 0.00 C ATOM 261 O LEU A 932 4.524 7.301 -1.860 1.00 0.00 O ATOM 262 CB LEU A 932 3.060 4.498 -3.288 1.00 0.00 C ATOM 263 CG LEU A 932 2.132 4.571 -2.073 1.00 0.00 C ATOM 264 CD1 LEU A 932 1.743 6.018 -1.766 1.00 0.00 C ATOM 265 CD2 LEU A 932 0.906 3.676 -2.265 1.00 0.00 C ATOM 0 H LEU A 932 5.316 3.457 -3.330 1.00 0.00 H new ATOM 0 HA LEU A 932 4.289 6.060 -3.986 1.00 0.00 H new ATOM 0 HB2 LEU A 932 2.505 4.832 -4.165 1.00 0.00 H new ATOM 0 HB3 LEU A 932 3.324 3.454 -3.457 1.00 0.00 H new ATOM 0 HG LEU A 932 2.674 4.193 -1.206 1.00 0.00 H new ATOM 0 HD11 LEU A 932 1.083 6.041 -0.898 1.00 0.00 H new ATOM 0 HD12 LEU A 932 2.641 6.599 -1.555 1.00 0.00 H new ATOM 0 HD13 LEU A 932 1.227 6.446 -2.625 1.00 0.00 H new ATOM 0 HD21 LEU A 932 0.263 3.746 -1.388 1.00 0.00 H new ATOM 0 HD22 LEU A 932 0.353 4.000 -3.147 1.00 0.00 H new ATOM 0 HD23 LEU A 932 1.227 2.643 -2.398 1.00 0.00 H new ATOM 277 N VAL A 933 4.617 5.306 -0.799 1.00 0.00 N ATOM 278 CA VAL A 933 4.770 5.890 0.523 1.00 0.00 C ATOM 279 C VAL A 933 6.071 6.693 0.573 1.00 0.00 C ATOM 280 O VAL A 933 6.114 7.778 1.151 1.00 0.00 O ATOM 281 CB VAL A 933 4.701 4.796 1.590 1.00 0.00 C ATOM 282 CG1 VAL A 933 3.343 4.091 1.565 1.00 0.00 C ATOM 283 CG2 VAL A 933 5.843 3.793 1.421 1.00 0.00 C ATOM 0 H VAL A 933 4.603 4.286 -0.816 1.00 0.00 H new ATOM 0 HA VAL A 933 3.953 6.581 0.732 1.00 0.00 H new ATOM 0 HB VAL A 933 4.814 5.271 2.565 1.00 0.00 H new ATOM 0 HG11 VAL A 933 3.320 3.318 2.333 1.00 0.00 H new ATOM 0 HG12 VAL A 933 2.553 4.817 1.757 1.00 0.00 H new ATOM 0 HG13 VAL A 933 3.187 3.635 0.587 1.00 0.00 H new ATOM 0 HG21 VAL A 933 5.771 3.026 2.192 1.00 0.00 H new ATOM 0 HG22 VAL A 933 5.775 3.327 0.438 1.00 0.00 H new ATOM 0 HG23 VAL A 933 6.798 4.310 1.512 1.00 0.00 H new ATOM 293 N LYS A 934 7.101 6.129 -0.041 1.00 0.00 N ATOM 294 CA LYS A 934 8.401 6.778 -0.074 1.00 0.00 C ATOM 295 C LYS A 934 8.226 8.237 -0.501 1.00 0.00 C ATOM 296 O LYS A 934 8.892 9.126 0.027 1.00 0.00 O ATOM 297 CB LYS A 934 9.371 5.991 -0.956 1.00 0.00 C ATOM 298 CG LYS A 934 9.782 4.679 -0.285 1.00 0.00 C ATOM 299 CD LYS A 934 11.182 4.788 0.322 1.00 0.00 C ATOM 300 CE LYS A 934 11.122 4.742 1.850 1.00 0.00 C ATOM 301 NZ LYS A 934 11.617 3.439 2.349 1.00 0.00 N ATOM 0 H LYS A 934 7.062 5.229 -0.520 1.00 0.00 H new ATOM 0 HA LYS A 934 8.848 6.787 0.920 1.00 0.00 H new ATOM 0 HB2 LYS A 934 8.904 5.781 -1.918 1.00 0.00 H new ATOM 0 HB3 LYS A 934 10.257 6.594 -1.156 1.00 0.00 H new ATOM 0 HG2 LYS A 934 9.063 4.424 0.494 1.00 0.00 H new ATOM 0 HG3 LYS A 934 9.761 3.871 -1.016 1.00 0.00 H new ATOM 0 HD2 LYS A 934 11.806 3.974 -0.046 1.00 0.00 H new ATOM 0 HD3 LYS A 934 11.650 5.718 0.001 1.00 0.00 H new ATOM 0 HE2 LYS A 934 11.722 5.550 2.268 1.00 0.00 H new ATOM 0 HE3 LYS A 934 10.097 4.901 2.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 11.570 3.424 3.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 11.027 2.673 1.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 12.602 3.303 2.046 1.00 0.00 H new ATOM 315 N ALA A 935 7.326 8.438 -1.452 1.00 0.00 N ATOM 316 CA ALA A 935 7.056 9.774 -1.956 1.00 0.00 C ATOM 317 C ALA A 935 6.137 10.507 -0.977 1.00 0.00 C ATOM 318 O ALA A 935 6.371 11.670 -0.652 1.00 0.00 O ATOM 319 CB ALA A 935 6.455 9.678 -3.360 1.00 0.00 C ATOM 0 H ALA A 935 6.774 7.698 -1.887 1.00 0.00 H new ATOM 0 HA ALA A 935 7.979 10.349 -2.035 1.00 0.00 H new ATOM 0 HB1 ALA A 935 6.252 10.680 -3.738 1.00 0.00 H new ATOM 0 HB2 ALA A 935 7.159 9.175 -4.023 1.00 0.00 H new ATOM 0 HB3 ALA A 935 5.525 9.110 -3.320 1.00 0.00 H new ATOM 325 N VAL A 936 5.110 9.797 -0.534 1.00 0.00 N ATOM 326 CA VAL A 936 4.154 10.366 0.401 1.00 0.00 C ATOM 327 C VAL A 936 4.893 11.266 1.393 1.00 0.00 C ATOM 328 O VAL A 936 4.426 12.359 1.712 1.00 0.00 O ATOM 329 CB VAL A 936 3.362 9.249 1.083 1.00 0.00 C ATOM 330 CG1 VAL A 936 2.756 9.734 2.402 1.00 0.00 C ATOM 331 CG2 VAL A 936 2.280 8.698 0.153 1.00 0.00 C ATOM 0 H VAL A 936 4.919 8.832 -0.805 1.00 0.00 H new ATOM 0 HA VAL A 936 3.428 10.987 -0.124 1.00 0.00 H new ATOM 0 HB VAL A 936 4.054 8.438 1.310 1.00 0.00 H new ATOM 0 HG11 VAL A 936 2.198 8.921 2.867 1.00 0.00 H new ATOM 0 HG12 VAL A 936 3.553 10.056 3.072 1.00 0.00 H new ATOM 0 HG13 VAL A 936 2.084 10.570 2.208 1.00 0.00 H new ATOM 0 HG21 VAL A 936 1.732 7.905 0.662 1.00 0.00 H new ATOM 0 HG22 VAL A 936 1.592 9.498 -0.119 1.00 0.00 H new ATOM 0 HG23 VAL A 936 2.744 8.297 -0.748 1.00 0.00 H new ATOM 341 N ILE A 937 6.034 10.775 1.854 1.00 0.00 N ATOM 342 CA ILE A 937 6.842 11.522 2.803 1.00 0.00 C ATOM 343 C ILE A 937 7.726 12.514 2.044 1.00 0.00 C ATOM 344 O ILE A 937 7.546 13.725 2.159 1.00 0.00 O ATOM 345 CB ILE A 937 7.624 10.568 3.708 1.00 0.00 C ATOM 346 CG1 ILE A 937 6.679 9.754 4.594 1.00 0.00 C ATOM 347 CG2 ILE A 937 8.670 11.325 4.529 1.00 0.00 C ATOM 348 CD1 ILE A 937 7.337 8.447 5.041 1.00 0.00 C ATOM 0 H ILE A 937 6.418 9.868 1.588 1.00 0.00 H new ATOM 0 HA ILE A 937 6.206 12.106 3.468 1.00 0.00 H new ATOM 0 HB ILE A 937 8.161 9.861 3.076 1.00 0.00 H new ATOM 0 HG12 ILE A 937 6.398 10.341 5.468 1.00 0.00 H new ATOM 0 HG13 ILE A 937 5.761 9.535 4.048 1.00 0.00 H new ATOM 0 HG21 ILE A 937 9.212 10.624 5.164 1.00 0.00 H new ATOM 0 HG22 ILE A 937 9.370 11.822 3.857 1.00 0.00 H new ATOM 0 HG23 ILE A 937 8.174 12.070 5.152 1.00 0.00 H new ATOM 0 HD11 ILE A 937 6.644 7.887 5.669 1.00 0.00 H new ATOM 0 HD12 ILE A 937 7.595 7.851 4.165 1.00 0.00 H new ATOM 0 HD13 ILE A 937 8.241 8.670 5.607 1.00 0.00 H new ATOM 360 N GLU A 938 8.662 11.963 1.286 1.00 0.00 N ATOM 361 CA GLU A 938 9.575 12.784 0.509 1.00 0.00 C ATOM 362 C GLU A 938 8.880 14.072 0.061 1.00 0.00 C ATOM 363 O GLU A 938 9.447 15.158 0.172 1.00 0.00 O ATOM 364 CB GLU A 938 10.121 12.010 -0.693 1.00 0.00 C ATOM 365 CG GLU A 938 11.650 11.955 -0.660 1.00 0.00 C ATOM 366 CD GLU A 938 12.138 10.602 -0.138 1.00 0.00 C ATOM 367 OE1 GLU A 938 11.918 10.344 1.065 1.00 0.00 O ATOM 368 OE2 GLU A 938 12.721 9.856 -0.954 1.00 0.00 O ATOM 0 H GLU A 938 8.808 10.958 1.193 1.00 0.00 H new ATOM 0 HA GLU A 938 10.421 13.051 1.142 1.00 0.00 H new ATOM 0 HB2 GLU A 938 9.717 10.998 -0.692 1.00 0.00 H new ATOM 0 HB3 GLU A 938 9.790 12.485 -1.617 1.00 0.00 H new ATOM 0 HG2 GLU A 938 12.045 12.127 -1.661 1.00 0.00 H new ATOM 0 HG3 GLU A 938 12.033 12.754 -0.025 1.00 0.00 H new ATOM 375 N MET A 939 7.662 13.908 -0.435 1.00 0.00 N ATOM 376 CA MET A 939 6.884 15.044 -0.899 1.00 0.00 C ATOM 377 C MET A 939 6.886 16.170 0.136 1.00 0.00 C ATOM 378 O MET A 939 7.498 17.215 -0.079 1.00 0.00 O ATOM 379 CB MET A 939 5.445 14.601 -1.169 1.00 0.00 C ATOM 380 CG MET A 939 5.161 14.543 -2.671 1.00 0.00 C ATOM 381 SD MET A 939 3.483 14.005 -2.956 1.00 0.00 S ATOM 382 CE MET A 939 2.624 15.031 -1.774 1.00 0.00 C ATOM 0 H MET A 939 7.195 13.006 -0.526 1.00 0.00 H new ATOM 0 HA MET A 939 7.336 15.419 -1.817 1.00 0.00 H new ATOM 0 HB2 MET A 939 5.273 13.620 -0.725 1.00 0.00 H new ATOM 0 HB3 MET A 939 4.752 15.293 -0.691 1.00 0.00 H new ATOM 0 HG2 MET A 939 5.317 15.525 -3.117 1.00 0.00 H new ATOM 0 HG3 MET A 939 5.858 13.859 -3.155 1.00 0.00 H new ATOM 0 HE1 MET A 939 1.602 15.198 -2.113 1.00 0.00 H new ATOM 0 HE2 MET A 939 2.608 14.534 -0.804 1.00 0.00 H new ATOM 0 HE3 MET A 939 3.137 15.988 -1.682 1.00 0.00 H new ATOM 392 N SER A 940 6.195 15.919 1.238 1.00 0.00 N ATOM 393 CA SER A 940 6.110 16.899 2.308 1.00 0.00 C ATOM 394 C SER A 940 7.447 17.626 2.460 1.00 0.00 C ATOM 395 O SER A 940 7.479 18.814 2.776 1.00 0.00 O ATOM 396 CB SER A 940 5.712 16.238 3.629 1.00 0.00 C ATOM 397 OG SER A 940 6.444 15.040 3.869 1.00 0.00 O ATOM 0 H SER A 940 5.689 15.051 1.413 1.00 0.00 H new ATOM 0 HA SER A 940 5.338 17.623 2.048 1.00 0.00 H new ATOM 0 HB2 SER A 940 5.881 16.936 4.449 1.00 0.00 H new ATOM 0 HB3 SER A 940 4.645 16.014 3.615 1.00 0.00 H new ATOM 0 HG SER A 940 7.113 14.918 3.163 1.00 0.00 H new ATOM 403 N SER A 941 8.518 16.882 2.227 1.00 0.00 N ATOM 404 CA SER A 941 9.855 17.441 2.334 1.00 0.00 C ATOM 405 C SER A 941 10.049 18.539 1.285 1.00 0.00 C ATOM 406 O SER A 941 10.443 19.656 1.616 1.00 0.00 O ATOM 407 CB SER A 941 10.921 16.356 2.169 1.00 0.00 C ATOM 408 OG SER A 941 12.142 16.703 2.817 1.00 0.00 O ATOM 0 H SER A 941 8.487 15.897 1.965 1.00 0.00 H new ATOM 0 HA SER A 941 9.966 17.873 3.329 1.00 0.00 H new ATOM 0 HB2 SER A 941 10.548 15.417 2.577 1.00 0.00 H new ATOM 0 HB3 SER A 941 11.108 16.190 1.108 1.00 0.00 H new ATOM 0 HG SER A 941 12.796 15.984 2.690 1.00 0.00 H new ATOM 414 N LYS A 942 9.762 18.182 0.042 1.00 0.00 N ATOM 415 CA LYS A 942 9.900 19.122 -1.057 1.00 0.00 C ATOM 416 C LYS A 942 8.517 19.645 -1.452 1.00 0.00 C ATOM 417 O LYS A 942 8.306 20.050 -2.594 1.00 0.00 O ATOM 418 CB LYS A 942 10.670 18.485 -2.215 1.00 0.00 C ATOM 419 CG LYS A 942 9.931 17.259 -2.756 1.00 0.00 C ATOM 420 CD LYS A 942 9.742 17.356 -4.271 1.00 0.00 C ATOM 421 CE LYS A 942 8.270 17.576 -4.626 1.00 0.00 C ATOM 422 NZ LYS A 942 8.099 17.663 -6.094 1.00 0.00 N ATOM 0 H LYS A 942 9.434 17.255 -0.228 1.00 0.00 H new ATOM 0 HA LYS A 942 10.491 19.984 -0.748 1.00 0.00 H new ATOM 0 HB2 LYS A 942 10.803 19.215 -3.013 1.00 0.00 H new ATOM 0 HB3 LYS A 942 11.665 18.195 -1.879 1.00 0.00 H new ATOM 0 HG2 LYS A 942 10.491 16.356 -2.513 1.00 0.00 H new ATOM 0 HG3 LYS A 942 8.959 17.172 -2.270 1.00 0.00 H new ATOM 0 HD2 LYS A 942 10.341 18.177 -4.664 1.00 0.00 H new ATOM 0 HD3 LYS A 942 10.102 16.443 -4.745 1.00 0.00 H new ATOM 0 HE2 LYS A 942 7.668 16.757 -4.232 1.00 0.00 H new ATOM 0 HE3 LYS A 942 7.909 18.491 -4.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 7.095 17.812 -6.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 8.658 18.459 -6.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 8.424 16.779 -6.534 1.00 0.00 H new ATOM 436 N ILE A 943 7.612 19.618 -0.485 1.00 0.00 N ATOM 437 CA ILE A 943 6.255 20.084 -0.717 1.00 0.00 C ATOM 438 C ILE A 943 6.153 21.560 -0.327 1.00 0.00 C ATOM 439 O ILE A 943 5.679 22.381 -1.110 1.00 0.00 O ATOM 440 CB ILE A 943 5.249 19.186 0.006 1.00 0.00 C ATOM 441 CG1 ILE A 943 4.062 18.852 -0.900 1.00 0.00 C ATOM 442 CG2 ILE A 943 4.803 19.816 1.327 1.00 0.00 C ATOM 443 CD1 ILE A 943 2.908 19.830 -0.675 1.00 0.00 C ATOM 0 H ILE A 943 7.791 19.281 0.461 1.00 0.00 H new ATOM 0 HA ILE A 943 6.005 20.016 -1.776 1.00 0.00 H new ATOM 0 HB ILE A 943 5.743 18.245 0.249 1.00 0.00 H new ATOM 0 HG12 ILE A 943 4.375 18.888 -1.943 1.00 0.00 H new ATOM 0 HG13 ILE A 943 3.725 17.834 -0.703 1.00 0.00 H new ATOM 0 HG21 ILE A 943 4.088 19.158 1.821 1.00 0.00 H new ATOM 0 HG22 ILE A 943 5.670 19.960 1.972 1.00 0.00 H new ATOM 0 HG23 ILE A 943 4.333 20.780 1.130 1.00 0.00 H new ATOM 0 HD11 ILE A 943 2.077 19.570 -1.331 1.00 0.00 H new ATOM 0 HD12 ILE A 943 2.581 19.774 0.363 1.00 0.00 H new ATOM 0 HD13 ILE A 943 3.242 20.844 -0.896 1.00 0.00 H new ATOM 455 N GLN A 944 6.607 21.852 0.883 1.00 0.00 N ATOM 456 CA GLN A 944 6.573 23.215 1.386 1.00 0.00 C ATOM 457 C GLN A 944 7.138 24.180 0.342 1.00 0.00 C ATOM 458 O GLN A 944 6.507 25.183 0.013 1.00 0.00 O ATOM 459 CB GLN A 944 7.335 23.330 2.708 1.00 0.00 C ATOM 460 CG GLN A 944 6.383 23.649 3.863 1.00 0.00 C ATOM 461 CD GLN A 944 7.122 24.355 5.002 1.00 0.00 C ATOM 462 OE1 GLN A 944 7.733 25.396 4.829 1.00 0.00 O ATOM 463 NE2 GLN A 944 7.030 23.732 6.174 1.00 0.00 N ATOM 0 H GLN A 944 7.000 21.168 1.530 1.00 0.00 H new ATOM 0 HA GLN A 944 5.535 23.485 1.578 1.00 0.00 H new ATOM 0 HB2 GLN A 944 7.860 22.397 2.912 1.00 0.00 H new ATOM 0 HB3 GLN A 944 8.092 24.111 2.629 1.00 0.00 H new ATOM 0 HG2 GLN A 944 5.570 24.281 3.505 1.00 0.00 H new ATOM 0 HG3 GLN A 944 5.932 22.728 4.233 1.00 0.00 H new ATOM 0 HE21 GLN A 944 6.502 22.863 6.249 1.00 0.00 H new ATOM 0 HE22 GLN A 944 7.487 24.124 6.997 1.00 0.00 H new ATOM 472 N PRO A 945 8.352 23.834 -0.164 1.00 0.00 N ATOM 473 CA PRO A 945 9.009 24.659 -1.164 1.00 0.00 C ATOM 474 C PRO A 945 8.351 24.487 -2.534 1.00 0.00 C ATOM 475 O PRO A 945 8.063 25.470 -3.216 1.00 0.00 O ATOM 476 CB PRO A 945 10.463 24.218 -1.144 1.00 0.00 C ATOM 477 CG PRO A 945 10.476 22.854 -0.474 1.00 0.00 C ATOM 478 CD PRO A 945 9.129 22.653 0.202 1.00 0.00 C ATOM 0 HA PRO A 945 8.927 25.725 -0.950 1.00 0.00 H new ATOM 0 HB2 PRO A 945 10.868 24.161 -2.155 1.00 0.00 H new ATOM 0 HB3 PRO A 945 11.079 24.929 -0.594 1.00 0.00 H new ATOM 0 HG2 PRO A 945 10.655 22.069 -1.209 1.00 0.00 H new ATOM 0 HG3 PRO A 945 11.282 22.796 0.257 1.00 0.00 H new ATOM 0 HD2 PRO A 945 8.646 21.739 -0.142 1.00 0.00 H new ATOM 0 HD3 PRO A 945 9.237 22.569 1.283 1.00 0.00 H new ATOM 486 N ALA A 946 8.132 23.232 -2.897 1.00 0.00 N ATOM 487 CA ALA A 946 7.513 22.919 -4.174 1.00 0.00 C ATOM 488 C ALA A 946 6.483 23.998 -4.515 1.00 0.00 C ATOM 489 O ALA A 946 5.570 24.259 -3.733 1.00 0.00 O ATOM 490 CB ALA A 946 6.893 21.521 -4.112 1.00 0.00 C ATOM 0 H ALA A 946 8.372 22.420 -2.329 1.00 0.00 H new ATOM 0 HA ALA A 946 8.258 22.911 -4.970 1.00 0.00 H new ATOM 0 HB1 ALA A 946 6.429 21.286 -5.070 1.00 0.00 H new ATOM 0 HB2 ALA A 946 7.670 20.788 -3.896 1.00 0.00 H new ATOM 0 HB3 ALA A 946 6.138 21.492 -3.326 1.00 0.00 H new ATOM 496 N PRO A 947 6.670 24.612 -5.714 1.00 0.00 N ATOM 497 CA PRO A 947 5.768 25.657 -6.168 1.00 0.00 C ATOM 498 C PRO A 947 4.437 25.066 -6.638 1.00 0.00 C ATOM 499 O PRO A 947 4.264 23.849 -6.650 1.00 0.00 O ATOM 500 CB PRO A 947 6.523 26.375 -7.275 1.00 0.00 C ATOM 501 CG PRO A 947 7.623 25.421 -7.715 1.00 0.00 C ATOM 502 CD PRO A 947 7.740 24.328 -6.666 1.00 0.00 C ATOM 0 HA PRO A 947 5.496 26.352 -5.374 1.00 0.00 H new ATOM 0 HB2 PRO A 947 5.861 26.618 -8.106 1.00 0.00 H new ATOM 0 HB3 PRO A 947 6.942 27.315 -6.916 1.00 0.00 H new ATOM 0 HG2 PRO A 947 7.389 24.992 -8.689 1.00 0.00 H new ATOM 0 HG3 PRO A 947 8.569 25.952 -7.820 1.00 0.00 H new ATOM 0 HD2 PRO A 947 7.623 23.339 -7.110 1.00 0.00 H new ATOM 0 HD3 PRO A 947 8.716 24.347 -6.182 1.00 0.00 H new ATOM 510 N PRO A 948 3.507 25.981 -7.024 1.00 0.00 N ATOM 511 CA PRO A 948 2.197 25.563 -7.494 1.00 0.00 C ATOM 512 C PRO A 948 2.279 24.996 -8.913 1.00 0.00 C ATOM 513 O PRO A 948 1.360 24.316 -9.367 1.00 0.00 O ATOM 514 CB PRO A 948 1.331 26.809 -7.402 1.00 0.00 C ATOM 515 CG PRO A 948 2.294 27.982 -7.327 1.00 0.00 C ATOM 516 CD PRO A 948 3.678 27.431 -7.024 1.00 0.00 C ATOM 0 HA PRO A 948 1.774 24.754 -6.898 1.00 0.00 H new ATOM 0 HB2 PRO A 948 0.678 26.895 -8.270 1.00 0.00 H new ATOM 0 HB3 PRO A 948 0.689 26.774 -6.522 1.00 0.00 H new ATOM 0 HG2 PRO A 948 2.300 28.532 -8.268 1.00 0.00 H new ATOM 0 HG3 PRO A 948 1.983 28.682 -6.551 1.00 0.00 H new ATOM 0 HD2 PRO A 948 4.402 27.744 -7.776 1.00 0.00 H new ATOM 0 HD3 PRO A 948 4.044 27.787 -6.061 1.00 0.00 H new ATOM 524 N GLU A 949 3.388 25.296 -9.573 1.00 0.00 N ATOM 525 CA GLU A 949 3.601 24.824 -10.931 1.00 0.00 C ATOM 526 C GLU A 949 4.282 23.454 -10.916 1.00 0.00 C ATOM 527 O GLU A 949 4.318 22.764 -11.933 1.00 0.00 O ATOM 528 CB GLU A 949 4.419 25.833 -11.740 1.00 0.00 C ATOM 529 CG GLU A 949 3.507 26.725 -12.585 1.00 0.00 C ATOM 530 CD GLU A 949 3.246 28.061 -11.886 1.00 0.00 C ATOM 531 OE1 GLU A 949 4.237 28.656 -11.411 1.00 0.00 O ATOM 532 OE2 GLU A 949 2.061 28.457 -11.843 1.00 0.00 O ATOM 0 H GLU A 949 4.148 25.860 -9.193 1.00 0.00 H new ATOM 0 HA GLU A 949 2.630 24.721 -11.415 1.00 0.00 H new ATOM 0 HB2 GLU A 949 5.013 26.449 -11.065 1.00 0.00 H new ATOM 0 HB3 GLU A 949 5.118 25.304 -12.388 1.00 0.00 H new ATOM 0 HG2 GLU A 949 3.966 26.903 -13.558 1.00 0.00 H new ATOM 0 HG3 GLU A 949 2.561 26.215 -12.767 1.00 0.00 H new ATOM 539 N GLU A 950 4.805 23.101 -9.751 1.00 0.00 N ATOM 540 CA GLU A 950 5.482 21.826 -9.590 1.00 0.00 C ATOM 541 C GLU A 950 4.712 20.935 -8.612 1.00 0.00 C ATOM 542 O GLU A 950 5.053 19.767 -8.430 1.00 0.00 O ATOM 543 CB GLU A 950 6.926 22.026 -9.127 1.00 0.00 C ATOM 544 CG GLU A 950 7.898 21.233 -10.003 1.00 0.00 C ATOM 545 CD GLU A 950 9.084 22.099 -10.431 1.00 0.00 C ATOM 546 OE1 GLU A 950 8.833 23.274 -10.776 1.00 0.00 O ATOM 547 OE2 GLU A 950 10.215 21.568 -10.404 1.00 0.00 O ATOM 0 H GLU A 950 4.773 23.676 -8.909 1.00 0.00 H new ATOM 0 HA GLU A 950 5.511 21.328 -10.559 1.00 0.00 H new ATOM 0 HB2 GLU A 950 7.180 23.085 -9.163 1.00 0.00 H new ATOM 0 HB3 GLU A 950 7.026 21.710 -8.089 1.00 0.00 H new ATOM 0 HG2 GLU A 950 8.258 20.362 -9.456 1.00 0.00 H new ATOM 0 HG3 GLU A 950 7.377 20.862 -10.886 1.00 0.00 H new ATOM 554 N TYR A 951 3.688 21.521 -8.008 1.00 0.00 N ATOM 555 CA TYR A 951 2.867 20.795 -7.054 1.00 0.00 C ATOM 556 C TYR A 951 1.683 20.122 -7.750 1.00 0.00 C ATOM 557 O TYR A 951 1.360 18.971 -7.461 1.00 0.00 O ATOM 558 CB TYR A 951 2.339 21.842 -6.071 1.00 0.00 C ATOM 559 CG TYR A 951 1.444 21.267 -4.971 1.00 0.00 C ATOM 560 CD1 TYR A 951 1.709 20.016 -4.450 1.00 0.00 C ATOM 561 CD2 TYR A 951 0.372 21.998 -4.501 1.00 0.00 C ATOM 562 CE1 TYR A 951 0.867 19.475 -3.415 1.00 0.00 C ATOM 563 CE2 TYR A 951 -0.470 21.456 -3.466 1.00 0.00 C ATOM 564 CZ TYR A 951 -0.181 20.222 -2.974 1.00 0.00 C ATOM 565 OH TYR A 951 -0.976 19.711 -1.996 1.00 0.00 O ATOM 0 H TYR A 951 3.408 22.490 -8.161 1.00 0.00 H new ATOM 0 HA TYR A 951 3.448 20.015 -6.562 1.00 0.00 H new ATOM 0 HB2 TYR A 951 3.185 22.350 -5.608 1.00 0.00 H new ATOM 0 HB3 TYR A 951 1.778 22.595 -6.625 1.00 0.00 H new ATOM 0 HD1 TYR A 951 2.547 19.444 -4.819 1.00 0.00 H new ATOM 0 HD2 TYR A 951 0.165 22.976 -4.909 1.00 0.00 H new ATOM 0 HE1 TYR A 951 1.063 18.498 -2.998 1.00 0.00 H new ATOM 0 HE2 TYR A 951 -1.312 22.017 -3.089 1.00 0.00 H new ATOM 0 HH TYR A 951 -1.082 20.373 -1.282 1.00 0.00 H new ATOM 575 N VAL A 952 1.066 20.870 -8.654 1.00 0.00 N ATOM 576 CA VAL A 952 -0.076 20.360 -9.393 1.00 0.00 C ATOM 577 C VAL A 952 0.246 18.960 -9.920 1.00 0.00 C ATOM 578 O VAL A 952 -0.551 18.036 -9.766 1.00 0.00 O ATOM 579 CB VAL A 952 -0.462 21.342 -10.502 1.00 0.00 C ATOM 580 CG1 VAL A 952 -0.851 20.598 -11.781 1.00 0.00 C ATOM 581 CG2 VAL A 952 -1.588 22.271 -10.043 1.00 0.00 C ATOM 0 H VAL A 952 1.336 21.825 -8.891 1.00 0.00 H new ATOM 0 HA VAL A 952 -0.944 20.269 -8.740 1.00 0.00 H new ATOM 0 HB VAL A 952 0.410 21.957 -10.725 1.00 0.00 H new ATOM 0 HG11 VAL A 952 -1.121 21.318 -12.553 1.00 0.00 H new ATOM 0 HG12 VAL A 952 -0.008 19.998 -12.123 1.00 0.00 H new ATOM 0 HG13 VAL A 952 -1.702 19.947 -11.579 1.00 0.00 H new ATOM 0 HG21 VAL A 952 -1.844 22.959 -10.849 1.00 0.00 H new ATOM 0 HG22 VAL A 952 -2.464 21.678 -9.780 1.00 0.00 H new ATOM 0 HG23 VAL A 952 -1.259 22.838 -9.172 1.00 0.00 H new ATOM 591 N PRO A 953 1.448 18.845 -10.547 1.00 0.00 N ATOM 592 CA PRO A 953 1.885 17.573 -11.098 1.00 0.00 C ATOM 593 C PRO A 953 2.334 16.621 -9.988 1.00 0.00 C ATOM 594 O PRO A 953 2.008 15.435 -10.013 1.00 0.00 O ATOM 595 CB PRO A 953 3.003 17.928 -12.065 1.00 0.00 C ATOM 596 CG PRO A 953 3.463 19.323 -11.677 1.00 0.00 C ATOM 597 CD PRO A 953 2.417 19.918 -10.748 1.00 0.00 C ATOM 0 HA PRO A 953 1.086 17.039 -11.612 1.00 0.00 H new ATOM 0 HB2 PRO A 953 3.822 17.213 -11.994 1.00 0.00 H new ATOM 0 HB3 PRO A 953 2.649 17.906 -13.096 1.00 0.00 H new ATOM 0 HG2 PRO A 953 4.433 19.281 -11.182 1.00 0.00 H new ATOM 0 HG3 PRO A 953 3.584 19.945 -12.564 1.00 0.00 H new ATOM 0 HD2 PRO A 953 2.860 20.234 -9.803 1.00 0.00 H new ATOM 0 HD3 PRO A 953 1.948 20.797 -11.190 1.00 0.00 H new ATOM 605 N MET A 954 3.076 17.175 -9.040 1.00 0.00 N ATOM 606 CA MET A 954 3.573 16.390 -7.923 1.00 0.00 C ATOM 607 C MET A 954 2.526 15.376 -7.458 1.00 0.00 C ATOM 608 O MET A 954 2.723 14.169 -7.593 1.00 0.00 O ATOM 609 CB MET A 954 3.933 17.321 -6.764 1.00 0.00 C ATOM 610 CG MET A 954 4.356 16.522 -5.530 1.00 0.00 C ATOM 611 SD MET A 954 3.866 17.385 -4.046 1.00 0.00 S ATOM 612 CE MET A 954 4.822 18.881 -4.227 1.00 0.00 C ATOM 0 H MET A 954 3.345 18.159 -9.023 1.00 0.00 H new ATOM 0 HA MET A 954 4.459 15.846 -8.251 1.00 0.00 H new ATOM 0 HB2 MET A 954 4.742 17.987 -7.065 1.00 0.00 H new ATOM 0 HB3 MET A 954 3.077 17.950 -6.519 1.00 0.00 H new ATOM 0 HG2 MET A 954 3.899 15.533 -5.553 1.00 0.00 H new ATOM 0 HG3 MET A 954 5.436 16.374 -5.535 1.00 0.00 H new ATOM 0 HE1 MET A 954 4.242 19.729 -3.864 1.00 0.00 H new ATOM 0 HE2 MET A 954 5.743 18.797 -3.650 1.00 0.00 H new ATOM 0 HE3 MET A 954 5.066 19.032 -5.279 1.00 0.00 H new ATOM 622 N VAL A 955 1.437 15.903 -6.918 1.00 0.00 N ATOM 623 CA VAL A 955 0.359 15.058 -6.432 1.00 0.00 C ATOM 624 C VAL A 955 -0.122 14.149 -7.564 1.00 0.00 C ATOM 625 O VAL A 955 -0.216 12.934 -7.393 1.00 0.00 O ATOM 626 CB VAL A 955 -0.758 15.923 -5.844 1.00 0.00 C ATOM 627 CG1 VAL A 955 -2.078 15.150 -5.790 1.00 0.00 C ATOM 628 CG2 VAL A 955 -0.374 16.450 -4.461 1.00 0.00 C ATOM 0 H VAL A 955 1.278 16.904 -6.806 1.00 0.00 H new ATOM 0 HA VAL A 955 0.712 14.414 -5.627 1.00 0.00 H new ATOM 0 HB VAL A 955 -0.898 16.781 -6.501 1.00 0.00 H new ATOM 0 HG11 VAL A 955 -2.856 15.787 -5.368 1.00 0.00 H new ATOM 0 HG12 VAL A 955 -2.364 14.847 -6.797 1.00 0.00 H new ATOM 0 HG13 VAL A 955 -1.956 14.265 -5.166 1.00 0.00 H new ATOM 0 HG21 VAL A 955 -1.185 17.061 -4.066 1.00 0.00 H new ATOM 0 HG22 VAL A 955 -0.192 15.611 -3.789 1.00 0.00 H new ATOM 0 HG23 VAL A 955 0.530 17.054 -4.540 1.00 0.00 H new ATOM 638 N LYS A 956 -0.412 14.771 -8.697 1.00 0.00 N ATOM 639 CA LYS A 956 -0.881 14.033 -9.858 1.00 0.00 C ATOM 640 C LYS A 956 -0.051 12.757 -10.014 1.00 0.00 C ATOM 641 O LYS A 956 -0.591 11.695 -10.319 1.00 0.00 O ATOM 642 CB LYS A 956 -0.874 14.927 -11.100 1.00 0.00 C ATOM 643 CG LYS A 956 -2.044 15.912 -11.072 1.00 0.00 C ATOM 644 CD LYS A 956 -3.341 15.237 -11.521 1.00 0.00 C ATOM 645 CE LYS A 956 -3.587 15.459 -13.015 1.00 0.00 C ATOM 646 NZ LYS A 956 -4.968 15.070 -13.377 1.00 0.00 N ATOM 0 H LYS A 956 -0.331 15.778 -8.836 1.00 0.00 H new ATOM 0 HA LYS A 956 -1.918 13.725 -9.721 1.00 0.00 H new ATOM 0 HB2 LYS A 956 0.067 15.475 -11.153 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -0.934 14.310 -11.997 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -2.166 16.308 -10.064 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -1.827 16.759 -11.723 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -3.290 14.168 -11.312 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -4.179 15.634 -10.948 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -3.421 16.507 -13.265 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -2.874 14.875 -13.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -5.118 15.227 -14.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -5.114 14.064 -13.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -5.644 15.645 -12.835 1.00 0.00 H new ATOM 660 N GLU A 957 1.248 12.904 -9.798 1.00 0.00 N ATOM 661 CA GLU A 957 2.157 11.776 -9.911 1.00 0.00 C ATOM 662 C GLU A 957 1.735 10.656 -8.958 1.00 0.00 C ATOM 663 O GLU A 957 1.566 9.512 -9.375 1.00 0.00 O ATOM 664 CB GLU A 957 3.601 12.207 -9.646 1.00 0.00 C ATOM 665 CG GLU A 957 4.529 11.737 -10.767 1.00 0.00 C ATOM 666 CD GLU A 957 4.629 10.211 -10.793 1.00 0.00 C ATOM 667 OE1 GLU A 957 3.725 9.593 -11.396 1.00 0.00 O ATOM 668 OE2 GLU A 957 5.607 9.696 -10.209 1.00 0.00 O ATOM 0 H GLU A 957 1.692 13.787 -9.545 1.00 0.00 H new ATOM 0 HA GLU A 957 2.108 11.396 -10.931 1.00 0.00 H new ATOM 0 HB2 GLU A 957 3.650 13.292 -9.560 1.00 0.00 H new ATOM 0 HB3 GLU A 957 3.938 11.796 -8.694 1.00 0.00 H new ATOM 0 HG2 GLU A 957 4.157 12.097 -11.726 1.00 0.00 H new ATOM 0 HG3 GLU A 957 5.521 12.168 -10.627 1.00 0.00 H new ATOM 675 N VAL A 958 1.578 11.025 -7.695 1.00 0.00 N ATOM 676 CA VAL A 958 1.179 10.066 -6.679 1.00 0.00 C ATOM 677 C VAL A 958 0.044 9.196 -7.223 1.00 0.00 C ATOM 678 O VAL A 958 0.007 7.992 -6.977 1.00 0.00 O ATOM 679 CB VAL A 958 0.806 10.797 -5.387 1.00 0.00 C ATOM 680 CG1 VAL A 958 0.240 9.823 -4.351 1.00 0.00 C ATOM 681 CG2 VAL A 958 2.006 11.561 -4.824 1.00 0.00 C ATOM 0 H VAL A 958 1.720 11.975 -7.352 1.00 0.00 H new ATOM 0 HA VAL A 958 2.008 9.402 -6.433 1.00 0.00 H new ATOM 0 HB VAL A 958 0.028 11.523 -5.624 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -0.017 10.367 -3.442 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -0.653 9.344 -4.752 1.00 0.00 H new ATOM 0 HG13 VAL A 958 0.987 9.063 -4.120 1.00 0.00 H new ATOM 0 HG21 VAL A 958 1.714 12.072 -3.906 1.00 0.00 H new ATOM 0 HG22 VAL A 958 2.814 10.862 -4.609 1.00 0.00 H new ATOM 0 HG23 VAL A 958 2.346 12.295 -5.555 1.00 0.00 H new ATOM 691 N GLY A 959 -0.855 9.840 -7.953 1.00 0.00 N ATOM 692 CA GLY A 959 -1.988 9.141 -8.533 1.00 0.00 C ATOM 693 C GLY A 959 -1.523 8.052 -9.502 1.00 0.00 C ATOM 694 O GLY A 959 -2.048 6.940 -9.491 1.00 0.00 O ATOM 0 H GLY A 959 -0.821 10.839 -8.156 1.00 0.00 H new ATOM 0 HA2 GLY A 959 -2.589 8.695 -7.741 1.00 0.00 H new ATOM 0 HA3 GLY A 959 -2.628 9.851 -9.058 1.00 0.00 H new ATOM 698 N LEU A 960 -0.541 8.410 -10.317 1.00 0.00 N ATOM 699 CA LEU A 960 0.001 7.478 -11.290 1.00 0.00 C ATOM 700 C LEU A 960 0.570 6.259 -10.561 1.00 0.00 C ATOM 701 O LEU A 960 0.361 5.124 -10.985 1.00 0.00 O ATOM 702 CB LEU A 960 1.014 8.180 -12.198 1.00 0.00 C ATOM 703 CG LEU A 960 0.782 8.030 -13.703 1.00 0.00 C ATOM 704 CD1 LEU A 960 1.624 9.036 -14.490 1.00 0.00 C ATOM 705 CD2 LEU A 960 1.037 6.591 -14.156 1.00 0.00 C ATOM 0 H LEU A 960 -0.107 9.333 -10.323 1.00 0.00 H new ATOM 0 HA LEU A 960 -0.787 7.116 -11.950 1.00 0.00 H new ATOM 0 HB2 LEU A 960 1.015 9.242 -11.955 1.00 0.00 H new ATOM 0 HB3 LEU A 960 2.008 7.798 -11.964 1.00 0.00 H new ATOM 0 HG LEU A 960 -0.264 8.253 -13.911 1.00 0.00 H new ATOM 0 HD11 LEU A 960 1.441 8.908 -15.557 1.00 0.00 H new ATOM 0 HD12 LEU A 960 1.352 10.049 -14.194 1.00 0.00 H new ATOM 0 HD13 LEU A 960 2.681 8.869 -14.281 1.00 0.00 H new ATOM 0 HD21 LEU A 960 0.865 6.512 -15.229 1.00 0.00 H new ATOM 0 HD22 LEU A 960 2.068 6.316 -13.932 1.00 0.00 H new ATOM 0 HD23 LEU A 960 0.360 5.918 -13.629 1.00 0.00 H new ATOM 717 N ALA A 961 1.279 6.537 -9.476 1.00 0.00 N ATOM 718 CA ALA A 961 1.879 5.477 -8.684 1.00 0.00 C ATOM 719 C ALA A 961 0.774 4.619 -8.065 1.00 0.00 C ATOM 720 O ALA A 961 0.875 3.394 -8.040 1.00 0.00 O ATOM 721 CB ALA A 961 2.801 6.090 -7.628 1.00 0.00 C ATOM 0 H ALA A 961 1.451 7.480 -9.127 1.00 0.00 H new ATOM 0 HA ALA A 961 2.488 4.826 -9.312 1.00 0.00 H new ATOM 0 HB1 ALA A 961 3.252 5.296 -7.033 1.00 0.00 H new ATOM 0 HB2 ALA A 961 3.586 6.665 -8.120 1.00 0.00 H new ATOM 0 HB3 ALA A 961 2.223 6.747 -6.978 1.00 0.00 H new ATOM 727 N LEU A 962 -0.257 5.297 -7.582 1.00 0.00 N ATOM 728 CA LEU A 962 -1.380 4.612 -6.966 1.00 0.00 C ATOM 729 C LEU A 962 -2.073 3.735 -8.011 1.00 0.00 C ATOM 730 O LEU A 962 -2.482 2.614 -7.712 1.00 0.00 O ATOM 731 CB LEU A 962 -2.315 5.617 -6.289 1.00 0.00 C ATOM 732 CG LEU A 962 -3.811 5.412 -6.535 1.00 0.00 C ATOM 733 CD1 LEU A 962 -4.624 5.753 -5.285 1.00 0.00 C ATOM 734 CD2 LEU A 962 -4.280 6.205 -7.757 1.00 0.00 C ATOM 0 H LEU A 962 -0.338 6.314 -7.605 1.00 0.00 H new ATOM 0 HA LEU A 962 -1.033 3.950 -6.173 1.00 0.00 H new ATOM 0 HB2 LEU A 962 -2.136 5.583 -5.214 1.00 0.00 H new ATOM 0 HB3 LEU A 962 -2.045 6.618 -6.626 1.00 0.00 H new ATOM 0 HG LEU A 962 -3.980 4.357 -6.751 1.00 0.00 H new ATOM 0 HD11 LEU A 962 -5.684 5.599 -5.487 1.00 0.00 H new ATOM 0 HD12 LEU A 962 -4.314 5.109 -4.462 1.00 0.00 H new ATOM 0 HD13 LEU A 962 -4.454 6.795 -5.014 1.00 0.00 H new ATOM 0 HD21 LEU A 962 -5.347 6.041 -7.909 1.00 0.00 H new ATOM 0 HD22 LEU A 962 -4.095 7.267 -7.595 1.00 0.00 H new ATOM 0 HD23 LEU A 962 -3.732 5.872 -8.639 1.00 0.00 H new ATOM 746 N ARG A 963 -2.183 4.278 -9.214 1.00 0.00 N ATOM 747 CA ARG A 963 -2.819 3.559 -10.305 1.00 0.00 C ATOM 748 C ARG A 963 -2.191 2.173 -10.464 1.00 0.00 C ATOM 749 O ARG A 963 -2.893 1.163 -10.445 1.00 0.00 O ATOM 750 CB ARG A 963 -2.686 4.326 -11.622 1.00 0.00 C ATOM 751 CG ARG A 963 -3.766 3.898 -12.617 1.00 0.00 C ATOM 752 CD ARG A 963 -4.720 5.054 -12.923 1.00 0.00 C ATOM 753 NE ARG A 963 -4.163 5.897 -14.004 1.00 0.00 N ATOM 754 CZ ARG A 963 -4.831 6.896 -14.598 1.00 0.00 C ATOM 755 NH1 ARG A 963 -6.084 7.182 -14.218 1.00 0.00 N ATOM 756 NH2 ARG A 963 -4.247 7.608 -15.571 1.00 0.00 N ATOM 0 H ARG A 963 -1.842 5.208 -9.458 1.00 0.00 H new ATOM 0 HA ARG A 963 -3.877 3.457 -10.063 1.00 0.00 H new ATOM 0 HB2 ARG A 963 -2.764 5.397 -11.433 1.00 0.00 H new ATOM 0 HB3 ARG A 963 -1.700 4.150 -12.052 1.00 0.00 H new ATOM 0 HG2 ARG A 963 -3.299 3.553 -13.540 1.00 0.00 H new ATOM 0 HG3 ARG A 963 -4.327 3.057 -12.210 1.00 0.00 H new ATOM 0 HD2 ARG A 963 -5.694 4.664 -13.220 1.00 0.00 H new ATOM 0 HD3 ARG A 963 -4.877 5.654 -12.027 1.00 0.00 H new ATOM 0 HE ARG A 963 -3.211 5.706 -14.317 1.00 0.00 H new ATOM 0 HH11 ARG A 963 -6.529 6.640 -13.477 1.00 0.00 H new ATOM 0 HH12 ARG A 963 -6.593 7.942 -14.669 1.00 0.00 H new ATOM 0 HH21 ARG A 963 -3.293 7.390 -15.860 1.00 0.00 H new ATOM 0 HH22 ARG A 963 -4.756 8.368 -16.023 1.00 0.00 H new ATOM 770 N THR A 964 -0.875 2.169 -10.617 1.00 0.00 N ATOM 771 CA THR A 964 -0.144 0.923 -10.780 1.00 0.00 C ATOM 772 C THR A 964 -0.395 -0.002 -9.587 1.00 0.00 C ATOM 773 O THR A 964 -0.718 -1.175 -9.764 1.00 0.00 O ATOM 774 CB THR A 964 1.333 1.264 -10.984 1.00 0.00 C ATOM 775 OG1 THR A 964 1.391 1.775 -12.314 1.00 0.00 O ATOM 776 CG2 THR A 964 2.221 0.019 -11.024 1.00 0.00 C ATOM 0 H THR A 964 -0.296 3.008 -10.632 1.00 0.00 H new ATOM 0 HA THR A 964 -0.489 0.374 -11.656 1.00 0.00 H new ATOM 0 HB THR A 964 1.667 1.923 -10.183 1.00 0.00 H new ATOM 0 HG1 THR A 964 2.314 2.023 -12.529 1.00 0.00 H new ATOM 0 HG21 THR A 964 3.259 0.317 -11.171 1.00 0.00 H new ATOM 0 HG22 THR A 964 2.129 -0.524 -10.083 1.00 0.00 H new ATOM 0 HG23 THR A 964 1.909 -0.624 -11.846 1.00 0.00 H new ATOM 784 N LEU A 965 -0.237 0.562 -8.398 1.00 0.00 N ATOM 785 CA LEU A 965 -0.442 -0.197 -7.177 1.00 0.00 C ATOM 786 C LEU A 965 -1.642 -1.128 -7.355 1.00 0.00 C ATOM 787 O LEU A 965 -1.564 -2.315 -7.039 1.00 0.00 O ATOM 788 CB LEU A 965 -0.567 0.744 -5.976 1.00 0.00 C ATOM 789 CG LEU A 965 -0.526 0.081 -4.598 1.00 0.00 C ATOM 790 CD1 LEU A 965 -1.939 -0.138 -4.054 1.00 0.00 C ATOM 791 CD2 LEU A 965 0.281 -1.218 -4.637 1.00 0.00 C ATOM 0 H LEU A 965 0.031 1.536 -8.255 1.00 0.00 H new ATOM 0 HA LEU A 965 0.423 -0.827 -6.971 1.00 0.00 H new ATOM 0 HB2 LEU A 965 0.238 1.477 -6.029 1.00 0.00 H new ATOM 0 HB3 LEU A 965 -1.504 1.293 -6.066 1.00 0.00 H new ATOM 0 HG LEU A 965 -0.016 0.755 -3.910 1.00 0.00 H new ATOM 0 HD11 LEU A 965 -1.882 -0.611 -3.073 1.00 0.00 H new ATOM 0 HD12 LEU A 965 -2.448 0.822 -3.965 1.00 0.00 H new ATOM 0 HD13 LEU A 965 -2.495 -0.782 -4.735 1.00 0.00 H new ATOM 0 HD21 LEU A 965 0.294 -1.668 -3.644 1.00 0.00 H new ATOM 0 HD22 LEU A 965 -0.177 -1.910 -5.344 1.00 0.00 H new ATOM 0 HD23 LEU A 965 1.302 -1.003 -4.951 1.00 0.00 H new ATOM 803 N LEU A 966 -2.724 -0.556 -7.862 1.00 0.00 N ATOM 804 CA LEU A 966 -3.939 -1.321 -8.087 1.00 0.00 C ATOM 805 C LEU A 966 -3.623 -2.521 -8.983 1.00 0.00 C ATOM 806 O LEU A 966 -3.754 -3.668 -8.559 1.00 0.00 O ATOM 807 CB LEU A 966 -5.046 -0.419 -8.635 1.00 0.00 C ATOM 808 CG LEU A 966 -5.948 0.246 -7.593 1.00 0.00 C ATOM 809 CD1 LEU A 966 -5.495 1.679 -7.310 1.00 0.00 C ATOM 810 CD2 LEU A 966 -7.416 0.181 -8.018 1.00 0.00 C ATOM 0 H LEU A 966 -2.785 0.428 -8.123 1.00 0.00 H new ATOM 0 HA LEU A 966 -4.319 -1.717 -7.146 1.00 0.00 H new ATOM 0 HB2 LEU A 966 -4.585 0.363 -9.239 1.00 0.00 H new ATOM 0 HB3 LEU A 966 -5.672 -1.011 -9.303 1.00 0.00 H new ATOM 0 HG LEU A 966 -5.859 -0.309 -6.659 1.00 0.00 H new ATOM 0 HD11 LEU A 966 -6.153 2.128 -6.566 1.00 0.00 H new ATOM 0 HD12 LEU A 966 -4.473 1.669 -6.932 1.00 0.00 H new ATOM 0 HD13 LEU A 966 -5.536 2.262 -8.230 1.00 0.00 H new ATOM 0 HD21 LEU A 966 -8.036 0.660 -7.260 1.00 0.00 H new ATOM 0 HD22 LEU A 966 -7.542 0.697 -8.970 1.00 0.00 H new ATOM 0 HD23 LEU A 966 -7.717 -0.861 -8.127 1.00 0.00 H new ATOM 822 N ALA A 967 -3.213 -2.214 -10.205 1.00 0.00 N ATOM 823 CA ALA A 967 -2.878 -3.253 -11.164 1.00 0.00 C ATOM 824 C ALA A 967 -1.950 -4.273 -10.501 1.00 0.00 C ATOM 825 O ALA A 967 -2.266 -5.461 -10.446 1.00 0.00 O ATOM 826 CB ALA A 967 -2.252 -2.618 -12.407 1.00 0.00 C ATOM 0 H ALA A 967 -3.105 -1.261 -10.553 1.00 0.00 H new ATOM 0 HA ALA A 967 -3.775 -3.783 -11.485 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -2.001 -3.397 -13.126 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -2.961 -1.924 -12.857 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -1.347 -2.080 -12.124 1.00 0.00 H new ATOM 832 N THR A 968 -0.824 -3.773 -10.014 1.00 0.00 N ATOM 833 CA THR A 968 0.151 -4.626 -9.356 1.00 0.00 C ATOM 834 C THR A 968 -0.522 -5.468 -8.271 1.00 0.00 C ATOM 835 O THR A 968 -0.278 -6.669 -8.171 1.00 0.00 O ATOM 836 CB THR A 968 1.276 -3.735 -8.825 1.00 0.00 C ATOM 837 OG1 THR A 968 0.608 -2.797 -7.986 1.00 0.00 O ATOM 838 CG2 THR A 968 1.907 -2.873 -9.920 1.00 0.00 C ATOM 0 H THR A 968 -0.565 -2.788 -10.062 1.00 0.00 H new ATOM 0 HA THR A 968 0.586 -5.342 -10.054 1.00 0.00 H new ATOM 0 HB THR A 968 2.045 -4.356 -8.365 1.00 0.00 H new ATOM 0 HG1 THR A 968 -0.333 -2.731 -8.253 1.00 0.00 H new ATOM 0 HG21 THR A 968 2.699 -2.260 -9.490 1.00 0.00 H new ATOM 0 HG22 THR A 968 2.326 -3.517 -10.694 1.00 0.00 H new ATOM 0 HG23 THR A 968 1.146 -2.227 -10.358 1.00 0.00 H new ATOM 846 N VAL A 969 -1.357 -4.803 -7.484 1.00 0.00 N ATOM 847 CA VAL A 969 -2.067 -5.475 -6.410 1.00 0.00 C ATOM 848 C VAL A 969 -2.848 -6.659 -6.983 1.00 0.00 C ATOM 849 O VAL A 969 -2.893 -7.729 -6.378 1.00 0.00 O ATOM 850 CB VAL A 969 -2.956 -4.477 -5.665 1.00 0.00 C ATOM 851 CG1 VAL A 969 -4.007 -5.201 -4.822 1.00 0.00 C ATOM 852 CG2 VAL A 969 -2.116 -3.533 -4.802 1.00 0.00 C ATOM 0 H VAL A 969 -1.557 -3.806 -7.570 1.00 0.00 H new ATOM 0 HA VAL A 969 -1.364 -5.873 -5.678 1.00 0.00 H new ATOM 0 HB VAL A 969 -3.480 -3.875 -6.408 1.00 0.00 H new ATOM 0 HG11 VAL A 969 -4.625 -4.468 -4.303 1.00 0.00 H new ATOM 0 HG12 VAL A 969 -4.635 -5.812 -5.470 1.00 0.00 H new ATOM 0 HG13 VAL A 969 -3.511 -5.839 -4.091 1.00 0.00 H new ATOM 0 HG21 VAL A 969 -2.772 -2.834 -4.283 1.00 0.00 H new ATOM 0 HG22 VAL A 969 -1.553 -4.113 -4.071 1.00 0.00 H new ATOM 0 HG23 VAL A 969 -1.424 -2.979 -5.436 1.00 0.00 H new ATOM 862 N ASP A 970 -3.445 -6.428 -8.143 1.00 0.00 N ATOM 863 CA ASP A 970 -4.222 -7.462 -8.804 1.00 0.00 C ATOM 864 C ASP A 970 -3.359 -8.715 -8.971 1.00 0.00 C ATOM 865 O ASP A 970 -3.849 -9.834 -8.825 1.00 0.00 O ATOM 866 CB ASP A 970 -4.671 -7.009 -10.195 1.00 0.00 C ATOM 867 CG ASP A 970 -5.967 -7.650 -10.697 1.00 0.00 C ATOM 868 OD1 ASP A 970 -6.908 -7.742 -9.879 1.00 0.00 O ATOM 869 OD2 ASP A 970 -5.986 -8.033 -11.887 1.00 0.00 O ATOM 0 H ASP A 970 -3.406 -5.539 -8.642 1.00 0.00 H new ATOM 0 HA ASP A 970 -5.099 -7.668 -8.191 1.00 0.00 H new ATOM 0 HB2 ASP A 970 -4.799 -5.927 -10.184 1.00 0.00 H new ATOM 0 HB3 ASP A 970 -3.875 -7.229 -10.907 1.00 0.00 H new ATOM 874 N GLU A 971 -2.090 -8.484 -9.273 1.00 0.00 N ATOM 875 CA GLU A 971 -1.155 -9.580 -9.461 1.00 0.00 C ATOM 876 C GLU A 971 -0.836 -10.242 -8.119 1.00 0.00 C ATOM 877 O GLU A 971 -0.468 -11.415 -8.073 1.00 0.00 O ATOM 878 CB GLU A 971 0.123 -9.098 -10.151 1.00 0.00 C ATOM 879 CG GLU A 971 -0.096 -8.931 -11.656 1.00 0.00 C ATOM 880 CD GLU A 971 1.228 -9.025 -12.417 1.00 0.00 C ATOM 881 OE1 GLU A 971 2.116 -8.199 -12.113 1.00 0.00 O ATOM 882 OE2 GLU A 971 1.322 -9.919 -13.285 1.00 0.00 O ATOM 0 H GLU A 971 -1.687 -7.554 -9.392 1.00 0.00 H new ATOM 0 HA GLU A 971 -1.621 -10.322 -10.109 1.00 0.00 H new ATOM 0 HB2 GLU A 971 0.438 -8.149 -9.718 1.00 0.00 H new ATOM 0 HB3 GLU A 971 0.928 -9.812 -9.974 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -0.781 -9.699 -12.015 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -0.566 -7.967 -11.854 1.00 0.00 H new ATOM 889 N SER A 972 -0.990 -9.462 -7.059 1.00 0.00 N ATOM 890 CA SER A 972 -0.724 -9.958 -5.720 1.00 0.00 C ATOM 891 C SER A 972 -1.957 -10.683 -5.176 1.00 0.00 C ATOM 892 O SER A 972 -1.833 -11.616 -4.383 1.00 0.00 O ATOM 893 CB SER A 972 -0.321 -8.819 -4.781 1.00 0.00 C ATOM 894 OG SER A 972 -0.078 -7.606 -5.487 1.00 0.00 O ATOM 0 H SER A 972 -1.296 -8.490 -7.101 1.00 0.00 H new ATOM 0 HA SER A 972 0.108 -10.660 -5.774 1.00 0.00 H new ATOM 0 HB2 SER A 972 -1.110 -8.659 -4.046 1.00 0.00 H new ATOM 0 HB3 SER A 972 0.575 -9.103 -4.230 1.00 0.00 H new ATOM 0 HG SER A 972 0.467 -7.793 -6.280 1.00 0.00 H new ATOM 900 N LEU A 973 -3.117 -10.228 -5.623 1.00 0.00 N ATOM 901 CA LEU A 973 -4.371 -10.822 -5.191 1.00 0.00 C ATOM 902 C LEU A 973 -4.192 -12.335 -5.052 1.00 0.00 C ATOM 903 O LEU A 973 -4.498 -12.906 -4.006 1.00 0.00 O ATOM 904 CB LEU A 973 -5.507 -10.421 -6.135 1.00 0.00 C ATOM 905 CG LEU A 973 -6.747 -9.816 -5.473 1.00 0.00 C ATOM 906 CD1 LEU A 973 -8.022 -10.246 -6.201 1.00 0.00 C ATOM 907 CD2 LEU A 973 -6.795 -10.158 -3.982 1.00 0.00 C ATOM 0 H LEU A 973 -3.216 -9.454 -6.280 1.00 0.00 H new ATOM 0 HA LEU A 973 -4.654 -10.442 -4.209 1.00 0.00 H new ATOM 0 HB2 LEU A 973 -5.117 -9.702 -6.856 1.00 0.00 H new ATOM 0 HB3 LEU A 973 -5.814 -11.303 -6.698 1.00 0.00 H new ATOM 0 HG LEU A 973 -6.681 -8.731 -5.552 1.00 0.00 H new ATOM 0 HD11 LEU A 973 -8.888 -9.802 -5.710 1.00 0.00 H new ATOM 0 HD12 LEU A 973 -7.980 -9.910 -7.237 1.00 0.00 H new ATOM 0 HD13 LEU A 973 -8.107 -11.332 -6.175 1.00 0.00 H new ATOM 0 HD21 LEU A 973 -7.686 -9.716 -3.536 1.00 0.00 H new ATOM 0 HD22 LEU A 973 -6.826 -11.240 -3.858 1.00 0.00 H new ATOM 0 HD23 LEU A 973 -5.907 -9.761 -3.489 1.00 0.00 H new ATOM 919 N PRO A 974 -3.685 -12.957 -6.149 1.00 0.00 N ATOM 920 CA PRO A 974 -3.462 -14.393 -6.159 1.00 0.00 C ATOM 921 C PRO A 974 -2.226 -14.761 -5.336 1.00 0.00 C ATOM 922 O PRO A 974 -2.212 -15.786 -4.655 1.00 0.00 O ATOM 923 CB PRO A 974 -3.329 -14.760 -7.628 1.00 0.00 C ATOM 924 CG PRO A 974 -3.018 -13.462 -8.356 1.00 0.00 C ATOM 925 CD PRO A 974 -3.312 -12.313 -7.405 1.00 0.00 C ATOM 0 HA PRO A 974 -4.277 -14.949 -5.696 1.00 0.00 H new ATOM 0 HB2 PRO A 974 -2.535 -15.491 -7.777 1.00 0.00 H new ATOM 0 HB3 PRO A 974 -4.249 -15.208 -8.004 1.00 0.00 H new ATOM 0 HG2 PRO A 974 -1.974 -13.441 -8.670 1.00 0.00 H new ATOM 0 HG3 PRO A 974 -3.624 -13.376 -9.258 1.00 0.00 H new ATOM 0 HD2 PRO A 974 -2.440 -11.672 -7.277 1.00 0.00 H new ATOM 0 HD3 PRO A 974 -4.118 -11.684 -7.782 1.00 0.00 H new ATOM 933 N VAL A 975 -1.218 -13.906 -5.426 1.00 0.00 N ATOM 934 CA VAL A 975 0.020 -14.129 -4.698 1.00 0.00 C ATOM 935 C VAL A 975 -0.304 -14.478 -3.244 1.00 0.00 C ATOM 936 O VAL A 975 0.413 -15.254 -2.614 1.00 0.00 O ATOM 937 CB VAL A 975 0.932 -12.907 -4.830 1.00 0.00 C ATOM 938 CG1 VAL A 975 2.128 -13.011 -3.882 1.00 0.00 C ATOM 939 CG2 VAL A 975 1.393 -12.722 -6.277 1.00 0.00 C ATOM 0 H VAL A 975 -1.233 -13.058 -5.992 1.00 0.00 H new ATOM 0 HA VAL A 975 0.565 -14.973 -5.121 1.00 0.00 H new ATOM 0 HB VAL A 975 0.356 -12.026 -4.547 1.00 0.00 H new ATOM 0 HG11 VAL A 975 2.760 -12.130 -3.996 1.00 0.00 H new ATOM 0 HG12 VAL A 975 1.773 -13.072 -2.853 1.00 0.00 H new ATOM 0 HG13 VAL A 975 2.705 -13.905 -4.120 1.00 0.00 H new ATOM 0 HG21 VAL A 975 2.040 -11.847 -6.344 1.00 0.00 H new ATOM 0 HG22 VAL A 975 1.944 -13.606 -6.599 1.00 0.00 H new ATOM 0 HG23 VAL A 975 0.524 -12.581 -6.920 1.00 0.00 H new ATOM 949 N LEU A 976 -1.385 -13.889 -2.754 1.00 0.00 N ATOM 950 CA LEU A 976 -1.813 -14.129 -1.387 1.00 0.00 C ATOM 951 C LEU A 976 -3.070 -15.001 -1.395 1.00 0.00 C ATOM 952 O LEU A 976 -3.780 -15.062 -2.397 1.00 0.00 O ATOM 953 CB LEU A 976 -1.989 -12.805 -0.640 1.00 0.00 C ATOM 954 CG LEU A 976 -0.831 -11.811 -0.756 1.00 0.00 C ATOM 955 CD1 LEU A 976 0.518 -12.531 -0.691 1.00 0.00 C ATOM 956 CD2 LEU A 976 -0.964 -10.957 -2.018 1.00 0.00 C ATOM 0 H LEU A 976 -1.977 -13.246 -3.280 1.00 0.00 H new ATOM 0 HA LEU A 976 -1.047 -14.678 -0.840 1.00 0.00 H new ATOM 0 HB2 LEU A 976 -2.895 -12.322 -1.006 1.00 0.00 H new ATOM 0 HB3 LEU A 976 -2.149 -13.025 0.416 1.00 0.00 H new ATOM 0 HG LEU A 976 -0.877 -11.134 0.097 1.00 0.00 H new ATOM 0 HD11 LEU A 976 1.324 -11.802 -0.776 1.00 0.00 H new ATOM 0 HD12 LEU A 976 0.604 -13.058 0.259 1.00 0.00 H new ATOM 0 HD13 LEU A 976 0.588 -13.247 -1.510 1.00 0.00 H new ATOM 0 HD21 LEU A 976 -0.128 -10.260 -2.075 1.00 0.00 H new ATOM 0 HD22 LEU A 976 -0.959 -11.602 -2.896 1.00 0.00 H new ATOM 0 HD23 LEU A 976 -1.900 -10.399 -1.983 1.00 0.00 H new ATOM 968 N PRO A 977 -3.312 -15.671 -0.237 1.00 0.00 N ATOM 969 CA PRO A 977 -4.471 -16.537 -0.102 1.00 0.00 C ATOM 970 C PRO A 977 -5.752 -15.717 0.064 1.00 0.00 C ATOM 971 O PRO A 977 -5.737 -14.653 0.681 1.00 0.00 O ATOM 972 CB PRO A 977 -4.168 -17.416 1.101 1.00 0.00 C ATOM 973 CG PRO A 977 -3.070 -16.702 1.872 1.00 0.00 C ATOM 974 CD PRO A 977 -2.493 -15.623 0.970 1.00 0.00 C ATOM 0 HA PRO A 977 -4.647 -17.146 -0.989 1.00 0.00 H new ATOM 0 HB2 PRO A 977 -5.055 -17.551 1.720 1.00 0.00 H new ATOM 0 HB3 PRO A 977 -3.844 -18.408 0.788 1.00 0.00 H new ATOM 0 HG2 PRO A 977 -3.469 -16.262 2.786 1.00 0.00 H new ATOM 0 HG3 PRO A 977 -2.293 -17.406 2.170 1.00 0.00 H new ATOM 0 HD2 PRO A 977 -2.543 -14.643 1.444 1.00 0.00 H new ATOM 0 HD3 PRO A 977 -1.444 -15.815 0.744 1.00 0.00 H new ATOM 982 N ALA A 978 -6.831 -16.244 -0.498 1.00 0.00 N ATOM 983 CA ALA A 978 -8.118 -15.574 -0.420 1.00 0.00 C ATOM 984 C ALA A 978 -8.316 -15.022 0.994 1.00 0.00 C ATOM 985 O ALA A 978 -9.015 -14.028 1.184 1.00 0.00 O ATOM 986 CB ALA A 978 -9.226 -16.547 -0.826 1.00 0.00 C ATOM 0 H ALA A 978 -6.840 -17.127 -1.009 1.00 0.00 H new ATOM 0 HA ALA A 978 -8.155 -14.732 -1.111 1.00 0.00 H new ATOM 0 HB1 ALA A 978 -10.191 -16.044 -0.767 1.00 0.00 H new ATOM 0 HB2 ALA A 978 -9.055 -16.887 -1.847 1.00 0.00 H new ATOM 0 HB3 ALA A 978 -9.222 -17.404 -0.153 1.00 0.00 H new ATOM 992 N SER A 979 -7.688 -15.692 1.949 1.00 0.00 N ATOM 993 CA SER A 979 -7.786 -15.281 3.339 1.00 0.00 C ATOM 994 C SER A 979 -7.793 -13.754 3.435 1.00 0.00 C ATOM 995 O SER A 979 -8.452 -13.185 4.304 1.00 0.00 O ATOM 996 CB SER A 979 -6.637 -15.859 4.167 1.00 0.00 C ATOM 997 OG SER A 979 -6.603 -15.318 5.485 1.00 0.00 O ATOM 0 H SER A 979 -7.110 -16.516 1.788 1.00 0.00 H new ATOM 0 HA SER A 979 -8.721 -15.668 3.744 1.00 0.00 H new ATOM 0 HB2 SER A 979 -6.740 -16.943 4.223 1.00 0.00 H new ATOM 0 HB3 SER A 979 -5.691 -15.654 3.667 1.00 0.00 H new ATOM 0 HG SER A 979 -5.856 -15.713 5.982 1.00 0.00 H new ATOM 1003 N THR A 980 -7.052 -13.133 2.529 1.00 0.00 N ATOM 1004 CA THR A 980 -6.964 -11.683 2.500 1.00 0.00 C ATOM 1005 C THR A 980 -7.544 -11.140 1.192 1.00 0.00 C ATOM 1006 O THR A 980 -6.877 -10.395 0.475 1.00 0.00 O ATOM 1007 CB THR A 980 -5.502 -11.293 2.724 1.00 0.00 C ATOM 1008 OG1 THR A 980 -5.484 -9.882 2.525 1.00 0.00 O ATOM 1009 CG2 THR A 980 -4.577 -11.835 1.632 1.00 0.00 C ATOM 0 H THR A 980 -6.507 -13.608 1.809 1.00 0.00 H new ATOM 0 HA THR A 980 -7.560 -11.235 3.295 1.00 0.00 H new ATOM 0 HB THR A 980 -5.173 -11.663 3.695 1.00 0.00 H new ATOM 0 HG1 THR A 980 -6.138 -9.640 1.836 1.00 0.00 H new ATOM 0 HG21 THR A 980 -3.551 -11.529 1.839 1.00 0.00 H new ATOM 0 HG22 THR A 980 -4.635 -12.923 1.613 1.00 0.00 H new ATOM 0 HG23 THR A 980 -4.885 -11.439 0.664 1.00 0.00 H new ATOM 1017 N HIS A 981 -8.780 -11.533 0.922 1.00 0.00 N ATOM 1018 CA HIS A 981 -9.457 -11.095 -0.287 1.00 0.00 C ATOM 1019 C HIS A 981 -10.044 -9.699 -0.069 1.00 0.00 C ATOM 1020 O HIS A 981 -9.427 -8.699 -0.433 1.00 0.00 O ATOM 1021 CB HIS A 981 -10.508 -12.118 -0.722 1.00 0.00 C ATOM 1022 CG HIS A 981 -10.240 -12.736 -2.074 1.00 0.00 C ATOM 1023 ND1 HIS A 981 -9.071 -13.115 -2.665 1.00 0.00 N flip ATOM 1024 CD2 HIS A 981 -11.247 -13.025 -2.979 1.00 0.00 C flip ATOM 1025 CE1 HIS A 981 -9.348 -13.611 -3.865 1.00 0.00 C flip ATOM 1026 NE2 HIS A 981 -10.697 -13.555 -4.061 1.00 0.00 N flip ATOM 0 H HIS A 981 -9.330 -12.150 1.520 1.00 0.00 H new ATOM 0 HA HIS A 981 -8.740 -11.027 -1.105 1.00 0.00 H new ATOM 0 HB2 HIS A 981 -10.560 -12.910 0.025 1.00 0.00 H new ATOM 0 HB3 HIS A 981 -11.485 -11.634 -0.742 1.00 0.00 H new ATOM 0 HD2 HIS A 981 -12.302 -12.848 -2.828 1.00 0.00 H new ATOM 0 HE1 HIS A 981 -8.625 -13.995 -4.569 1.00 0.00 H new ATOM 0 HE2 HIS A 981 -11.195 -13.867 -4.895 1.00 0.00 H new ATOM 1034 N ARG A 982 -11.228 -9.676 0.524 1.00 0.00 N ATOM 1035 CA ARG A 982 -11.905 -8.419 0.795 1.00 0.00 C ATOM 1036 C ARG A 982 -10.921 -7.400 1.374 1.00 0.00 C ATOM 1037 O ARG A 982 -10.681 -6.353 0.774 1.00 0.00 O ATOM 1038 CB ARG A 982 -13.061 -8.616 1.777 1.00 0.00 C ATOM 1039 CG ARG A 982 -13.892 -7.338 1.910 1.00 0.00 C ATOM 1040 CD ARG A 982 -14.622 -7.020 0.603 1.00 0.00 C ATOM 1041 NE ARG A 982 -15.596 -8.090 0.294 1.00 0.00 N ATOM 1042 CZ ARG A 982 -16.628 -7.946 -0.549 1.00 0.00 C ATOM 1043 NH1 ARG A 982 -16.825 -6.777 -1.172 1.00 0.00 N ATOM 1044 NH2 ARG A 982 -17.461 -8.972 -0.769 1.00 0.00 N ATOM 0 H ARG A 982 -11.736 -10.508 0.825 1.00 0.00 H new ATOM 0 HA ARG A 982 -12.305 -8.048 -0.149 1.00 0.00 H new ATOM 0 HB2 ARG A 982 -13.697 -9.433 1.437 1.00 0.00 H new ATOM 0 HB3 ARG A 982 -12.669 -8.902 2.753 1.00 0.00 H new ATOM 0 HG2 ARG A 982 -14.616 -7.453 2.716 1.00 0.00 H new ATOM 0 HG3 ARG A 982 -13.243 -6.505 2.181 1.00 0.00 H new ATOM 0 HD2 ARG A 982 -15.136 -6.062 0.688 1.00 0.00 H new ATOM 0 HD3 ARG A 982 -13.903 -6.925 -0.211 1.00 0.00 H new ATOM 0 HE ARG A 982 -15.475 -8.994 0.751 1.00 0.00 H new ATOM 0 HH11 ARG A 982 -16.190 -5.997 -1.005 1.00 0.00 H new ATOM 0 HH12 ARG A 982 -17.610 -6.667 -1.814 1.00 0.00 H new ATOM 0 HH21 ARG A 982 -17.310 -9.862 -0.295 1.00 0.00 H new ATOM 0 HH22 ARG A 982 -18.246 -8.863 -1.410 1.00 0.00 H new ATOM 1058 N GLU A 983 -10.379 -7.742 2.534 1.00 0.00 N ATOM 1059 CA GLU A 983 -9.427 -6.871 3.201 1.00 0.00 C ATOM 1060 C GLU A 983 -8.537 -6.170 2.172 1.00 0.00 C ATOM 1061 O GLU A 983 -8.428 -4.945 2.173 1.00 0.00 O ATOM 1062 CB GLU A 983 -8.585 -7.651 4.213 1.00 0.00 C ATOM 1063 CG GLU A 983 -9.438 -8.110 5.397 1.00 0.00 C ATOM 1064 CD GLU A 983 -8.653 -9.064 6.300 1.00 0.00 C ATOM 1065 OE1 GLU A 983 -8.578 -10.257 5.937 1.00 0.00 O ATOM 1066 OE2 GLU A 983 -8.147 -8.577 7.335 1.00 0.00 O ATOM 0 H GLU A 983 -10.581 -8.611 3.029 1.00 0.00 H new ATOM 0 HA GLU A 983 -9.983 -6.111 3.750 1.00 0.00 H new ATOM 0 HB2 GLU A 983 -8.135 -8.517 3.727 1.00 0.00 H new ATOM 0 HB3 GLU A 983 -7.767 -7.025 4.570 1.00 0.00 H new ATOM 0 HG2 GLU A 983 -9.764 -7.244 5.973 1.00 0.00 H new ATOM 0 HG3 GLU A 983 -10.337 -8.606 5.032 1.00 0.00 H new ATOM 1073 N ILE A 984 -7.925 -6.978 1.319 1.00 0.00 N ATOM 1074 CA ILE A 984 -7.048 -6.451 0.287 1.00 0.00 C ATOM 1075 C ILE A 984 -7.831 -5.470 -0.589 1.00 0.00 C ATOM 1076 O ILE A 984 -7.369 -4.359 -0.847 1.00 0.00 O ATOM 1077 CB ILE A 984 -6.398 -7.592 -0.498 1.00 0.00 C ATOM 1078 CG1 ILE A 984 -5.026 -7.943 0.079 1.00 0.00 C ATOM 1079 CG2 ILE A 984 -6.324 -7.259 -1.990 1.00 0.00 C ATOM 1080 CD1 ILE A 984 -4.362 -9.063 -0.725 1.00 0.00 C ATOM 0 H ILE A 984 -8.019 -7.994 1.321 1.00 0.00 H new ATOM 0 HA ILE A 984 -6.225 -5.894 0.734 1.00 0.00 H new ATOM 0 HB ILE A 984 -7.026 -8.477 -0.396 1.00 0.00 H new ATOM 0 HG12 ILE A 984 -4.388 -7.059 0.073 1.00 0.00 H new ATOM 0 HG13 ILE A 984 -5.133 -8.252 1.119 1.00 0.00 H new ATOM 0 HG21 ILE A 984 -5.858 -8.087 -2.525 1.00 0.00 H new ATOM 0 HG22 ILE A 984 -7.330 -7.098 -2.377 1.00 0.00 H new ATOM 0 HG23 ILE A 984 -5.731 -6.355 -2.132 1.00 0.00 H new ATOM 0 HD11 ILE A 984 -3.388 -9.293 -0.293 1.00 0.00 H new ATOM 0 HD12 ILE A 984 -4.991 -9.953 -0.697 1.00 0.00 H new ATOM 0 HD13 ILE A 984 -4.234 -8.742 -1.759 1.00 0.00 H new ATOM 1092 N GLU A 985 -9.001 -5.915 -1.020 1.00 0.00 N ATOM 1093 CA GLU A 985 -9.852 -5.090 -1.861 1.00 0.00 C ATOM 1094 C GLU A 985 -10.238 -3.805 -1.126 1.00 0.00 C ATOM 1095 O GLU A 985 -10.330 -2.741 -1.736 1.00 0.00 O ATOM 1096 CB GLU A 985 -11.096 -5.862 -2.307 1.00 0.00 C ATOM 1097 CG GLU A 985 -11.394 -5.613 -3.787 1.00 0.00 C ATOM 1098 CD GLU A 985 -12.254 -4.361 -3.970 1.00 0.00 C ATOM 1099 OE1 GLU A 985 -13.418 -4.401 -3.515 1.00 0.00 O ATOM 1100 OE2 GLU A 985 -11.729 -3.392 -4.560 1.00 0.00 O ATOM 0 H GLU A 985 -9.381 -6.837 -0.803 1.00 0.00 H new ATOM 0 HA GLU A 985 -9.293 -4.819 -2.756 1.00 0.00 H new ATOM 0 HB2 GLU A 985 -10.947 -6.928 -2.137 1.00 0.00 H new ATOM 0 HB3 GLU A 985 -11.952 -5.559 -1.704 1.00 0.00 H new ATOM 0 HG2 GLU A 985 -10.459 -5.500 -4.336 1.00 0.00 H new ATOM 0 HG3 GLU A 985 -11.908 -6.477 -4.208 1.00 0.00 H new ATOM 1107 N MET A 986 -10.454 -3.946 0.173 1.00 0.00 N ATOM 1108 CA MET A 986 -10.828 -2.809 0.997 1.00 0.00 C ATOM 1109 C MET A 986 -9.614 -1.929 1.302 1.00 0.00 C ATOM 1110 O MET A 986 -9.753 -0.726 1.515 1.00 0.00 O ATOM 1111 CB MET A 986 -11.439 -3.308 2.308 1.00 0.00 C ATOM 1112 CG MET A 986 -12.948 -3.517 2.166 1.00 0.00 C ATOM 1113 SD MET A 986 -13.735 -3.390 3.763 1.00 0.00 S ATOM 1114 CE MET A 986 -14.676 -1.892 3.527 1.00 0.00 C ATOM 0 H MET A 986 -10.377 -4.830 0.676 1.00 0.00 H new ATOM 0 HA MET A 986 -11.557 -2.212 0.449 1.00 0.00 H new ATOM 0 HB2 MET A 986 -10.965 -4.245 2.601 1.00 0.00 H new ATOM 0 HB3 MET A 986 -11.241 -2.588 3.102 1.00 0.00 H new ATOM 0 HG2 MET A 986 -13.364 -2.773 1.486 1.00 0.00 H new ATOM 0 HG3 MET A 986 -13.148 -4.495 1.729 1.00 0.00 H new ATOM 0 HE1 MET A 986 -15.232 -1.665 4.436 1.00 0.00 H new ATOM 0 HE2 MET A 986 -13.999 -1.069 3.301 1.00 0.00 H new ATOM 0 HE3 MET A 986 -15.373 -2.027 2.700 1.00 0.00 H new ATOM 1124 N ALA A 987 -8.451 -2.564 1.312 1.00 0.00 N ATOM 1125 CA ALA A 987 -7.213 -1.854 1.587 1.00 0.00 C ATOM 1126 C ALA A 987 -6.910 -0.900 0.430 1.00 0.00 C ATOM 1127 O ALA A 987 -6.318 0.159 0.632 1.00 0.00 O ATOM 1128 CB ALA A 987 -6.087 -2.863 1.821 1.00 0.00 C ATOM 0 H ALA A 987 -8.340 -3.562 1.134 1.00 0.00 H new ATOM 0 HA ALA A 987 -7.307 -1.255 2.493 1.00 0.00 H new ATOM 0 HB1 ALA A 987 -5.158 -2.331 2.027 1.00 0.00 H new ATOM 0 HB2 ALA A 987 -6.338 -3.498 2.671 1.00 0.00 H new ATOM 0 HB3 ALA A 987 -5.961 -3.481 0.932 1.00 0.00 H new ATOM 1134 N GLN A 988 -7.330 -1.310 -0.759 1.00 0.00 N ATOM 1135 CA GLN A 988 -7.111 -0.505 -1.948 1.00 0.00 C ATOM 1136 C GLN A 988 -8.008 0.734 -1.923 1.00 0.00 C ATOM 1137 O GLN A 988 -7.530 1.855 -2.095 1.00 0.00 O ATOM 1138 CB GLN A 988 -7.345 -1.327 -3.217 1.00 0.00 C ATOM 1139 CG GLN A 988 -6.285 -2.420 -3.366 1.00 0.00 C ATOM 1140 CD GLN A 988 -6.356 -3.067 -4.751 1.00 0.00 C ATOM 1141 OE1 GLN A 988 -5.483 -2.900 -5.588 1.00 0.00 O ATOM 1142 NE2 GLN A 988 -7.440 -3.812 -4.945 1.00 0.00 N ATOM 0 H GLN A 988 -7.821 -2.189 -0.923 1.00 0.00 H new ATOM 0 HA GLN A 988 -6.072 -0.176 -1.954 1.00 0.00 H new ATOM 0 HB2 GLN A 988 -8.336 -1.779 -3.184 1.00 0.00 H new ATOM 0 HB3 GLN A 988 -7.322 -0.672 -4.088 1.00 0.00 H new ATOM 0 HG2 GLN A 988 -5.294 -1.994 -3.210 1.00 0.00 H new ATOM 0 HG3 GLN A 988 -6.430 -3.180 -2.598 1.00 0.00 H new ATOM 0 HE21 GLN A 988 -8.132 -3.909 -4.202 1.00 0.00 H new ATOM 0 HE22 GLN A 988 -7.580 -4.286 -5.837 1.00 0.00 H new ATOM 1151 N LYS A 989 -9.293 0.491 -1.709 1.00 0.00 N ATOM 1152 CA LYS A 989 -10.261 1.573 -1.660 1.00 0.00 C ATOM 1153 C LYS A 989 -9.840 2.581 -0.589 1.00 0.00 C ATOM 1154 O LYS A 989 -10.201 3.754 -0.658 1.00 0.00 O ATOM 1155 CB LYS A 989 -11.674 1.019 -1.462 1.00 0.00 C ATOM 1156 CG LYS A 989 -12.725 2.002 -1.981 1.00 0.00 C ATOM 1157 CD LYS A 989 -13.233 2.906 -0.856 1.00 0.00 C ATOM 1158 CE LYS A 989 -14.705 3.269 -1.066 1.00 0.00 C ATOM 1159 NZ LYS A 989 -15.379 3.475 0.235 1.00 0.00 N ATOM 0 H LYS A 989 -9.686 -0.440 -1.568 1.00 0.00 H new ATOM 0 HA LYS A 989 -10.283 2.108 -2.610 1.00 0.00 H new ATOM 0 HB2 LYS A 989 -11.772 0.067 -1.984 1.00 0.00 H new ATOM 0 HB3 LYS A 989 -11.846 0.822 -0.404 1.00 0.00 H new ATOM 0 HG2 LYS A 989 -12.297 2.611 -2.777 1.00 0.00 H new ATOM 0 HG3 LYS A 989 -13.560 1.452 -2.415 1.00 0.00 H new ATOM 0 HD2 LYS A 989 -13.112 2.402 0.103 1.00 0.00 H new ATOM 0 HD3 LYS A 989 -12.633 3.815 -0.816 1.00 0.00 H new ATOM 0 HE2 LYS A 989 -14.780 4.174 -1.668 1.00 0.00 H new ATOM 0 HE3 LYS A 989 -15.206 2.475 -1.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 -16.377 3.721 0.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 -15.324 2.602 0.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 -14.911 4.248 0.750 1.00 0.00 H new ATOM 1173 N LEU A 990 -9.081 2.086 0.378 1.00 0.00 N ATOM 1174 CA LEU A 990 -8.606 2.928 1.463 1.00 0.00 C ATOM 1175 C LEU A 990 -7.601 3.942 0.913 1.00 0.00 C ATOM 1176 O LEU A 990 -7.771 5.147 1.089 1.00 0.00 O ATOM 1177 CB LEU A 990 -8.054 2.071 2.604 1.00 0.00 C ATOM 1178 CG LEU A 990 -8.710 2.272 3.971 1.00 0.00 C ATOM 1179 CD1 LEU A 990 -8.230 1.217 4.970 1.00 0.00 C ATOM 1180 CD2 LEU A 990 -8.482 3.694 4.486 1.00 0.00 C ATOM 0 H LEU A 990 -8.783 1.112 0.433 1.00 0.00 H new ATOM 0 HA LEU A 990 -9.430 3.497 1.893 1.00 0.00 H new ATOM 0 HB2 LEU A 990 -8.155 1.022 2.326 1.00 0.00 H new ATOM 0 HB3 LEU A 990 -6.988 2.274 2.701 1.00 0.00 H new ATOM 0 HG LEU A 990 -9.786 2.141 3.855 1.00 0.00 H new ATOM 0 HD11 LEU A 990 -8.712 1.383 5.934 1.00 0.00 H new ATOM 0 HD12 LEU A 990 -8.487 0.224 4.602 1.00 0.00 H new ATOM 0 HD13 LEU A 990 -7.149 1.292 5.087 1.00 0.00 H new ATOM 0 HD21 LEU A 990 -8.959 3.809 5.459 1.00 0.00 H new ATOM 0 HD22 LEU A 990 -7.412 3.879 4.582 1.00 0.00 H new ATOM 0 HD23 LEU A 990 -8.912 4.408 3.784 1.00 0.00 H new ATOM 1192 N LEU A 991 -6.577 3.416 0.258 1.00 0.00 N ATOM 1193 CA LEU A 991 -5.544 4.261 -0.319 1.00 0.00 C ATOM 1194 C LEU A 991 -6.198 5.334 -1.192 1.00 0.00 C ATOM 1195 O LEU A 991 -6.017 6.527 -0.955 1.00 0.00 O ATOM 1196 CB LEU A 991 -4.509 3.412 -1.060 1.00 0.00 C ATOM 1197 CG LEU A 991 -3.487 4.181 -1.899 1.00 0.00 C ATOM 1198 CD1 LEU A 991 -2.503 4.939 -1.005 1.00 0.00 C ATOM 1199 CD2 LEU A 991 -2.771 3.250 -2.879 1.00 0.00 C ATOM 0 H LEU A 991 -6.440 2.416 0.114 1.00 0.00 H new ATOM 0 HA LEU A 991 -4.994 4.780 0.466 1.00 0.00 H new ATOM 0 HB2 LEU A 991 -3.970 2.811 -0.328 1.00 0.00 H new ATOM 0 HB3 LEU A 991 -5.038 2.719 -1.714 1.00 0.00 H new ATOM 0 HG LEU A 991 -4.021 4.924 -2.492 1.00 0.00 H new ATOM 0 HD11 LEU A 991 -1.787 5.477 -1.626 1.00 0.00 H new ATOM 0 HD12 LEU A 991 -3.049 5.648 -0.383 1.00 0.00 H new ATOM 0 HD13 LEU A 991 -1.971 4.232 -0.368 1.00 0.00 H new ATOM 0 HD21 LEU A 991 -2.050 3.822 -3.463 1.00 0.00 H new ATOM 0 HD22 LEU A 991 -2.251 2.469 -2.325 1.00 0.00 H new ATOM 0 HD23 LEU A 991 -3.501 2.795 -3.548 1.00 0.00 H new ATOM 1211 N ASN A 992 -6.944 4.870 -2.184 1.00 0.00 N ATOM 1212 CA ASN A 992 -7.626 5.775 -3.094 1.00 0.00 C ATOM 1213 C ASN A 992 -8.389 6.826 -2.285 1.00 0.00 C ATOM 1214 O ASN A 992 -8.236 8.024 -2.517 1.00 0.00 O ATOM 1215 CB ASN A 992 -8.635 5.024 -3.964 1.00 0.00 C ATOM 1216 CG ASN A 992 -8.700 5.623 -5.371 1.00 0.00 C ATOM 1217 OD1 ASN A 992 -7.993 5.219 -6.279 1.00 0.00 O ATOM 1218 ND2 ASN A 992 -9.585 6.608 -5.499 1.00 0.00 N ATOM 0 H ASN A 992 -7.091 3.879 -2.378 1.00 0.00 H new ATOM 0 HA ASN A 992 -6.875 6.240 -3.733 1.00 0.00 H new ATOM 0 HB2 ASN A 992 -8.356 3.972 -4.025 1.00 0.00 H new ATOM 0 HB3 ASN A 992 -9.621 5.065 -3.501 1.00 0.00 H new ATOM 0 HD21 ASN A 992 -9.703 7.074 -6.399 1.00 0.00 H new ATOM 0 HD22 ASN A 992 -10.146 6.897 -4.697 1.00 0.00 H new ATOM 1225 N SER A 993 -9.193 6.339 -1.352 1.00 0.00 N ATOM 1226 CA SER A 993 -9.980 7.221 -0.507 1.00 0.00 C ATOM 1227 C SER A 993 -9.125 8.401 -0.043 1.00 0.00 C ATOM 1228 O SER A 993 -9.359 9.539 -0.446 1.00 0.00 O ATOM 1229 CB SER A 993 -10.546 6.469 0.699 1.00 0.00 C ATOM 1230 OG SER A 993 -11.967 6.369 0.648 1.00 0.00 O ATOM 0 H SER A 993 -9.317 5.344 -1.162 1.00 0.00 H new ATOM 0 HA SER A 993 -10.819 7.596 -1.093 1.00 0.00 H new ATOM 0 HB2 SER A 993 -10.114 5.469 0.738 1.00 0.00 H new ATOM 0 HB3 SER A 993 -10.251 6.980 1.616 1.00 0.00 H new ATOM 0 HG SER A 993 -12.289 5.881 1.434 1.00 0.00 H new ATOM 1236 N ASP A 994 -8.150 8.090 0.799 1.00 0.00 N ATOM 1237 CA ASP A 994 -7.259 9.110 1.323 1.00 0.00 C ATOM 1238 C ASP A 994 -6.709 9.945 0.164 1.00 0.00 C ATOM 1239 O ASP A 994 -6.627 11.168 0.260 1.00 0.00 O ATOM 1240 CB ASP A 994 -6.072 8.482 2.057 1.00 0.00 C ATOM 1241 CG ASP A 994 -6.331 8.131 3.523 1.00 0.00 C ATOM 1242 OD1 ASP A 994 -7.496 7.797 3.830 1.00 0.00 O ATOM 1243 OD2 ASP A 994 -5.359 8.204 4.305 1.00 0.00 O ATOM 0 H ASP A 994 -7.958 7.145 1.131 1.00 0.00 H new ATOM 0 HA ASP A 994 -7.827 9.728 2.018 1.00 0.00 H new ATOM 0 HB2 ASP A 994 -5.776 7.576 1.529 1.00 0.00 H new ATOM 0 HB3 ASP A 994 -5.228 9.170 2.007 1.00 0.00 H new ATOM 1248 N LEU A 995 -6.348 9.250 -0.904 1.00 0.00 N ATOM 1249 CA LEU A 995 -5.809 9.911 -2.080 1.00 0.00 C ATOM 1250 C LEU A 995 -6.778 11.004 -2.535 1.00 0.00 C ATOM 1251 O LEU A 995 -6.428 12.183 -2.547 1.00 0.00 O ATOM 1252 CB LEU A 995 -5.482 8.887 -3.169 1.00 0.00 C ATOM 1253 CG LEU A 995 -4.002 8.539 -3.341 1.00 0.00 C ATOM 1254 CD1 LEU A 995 -3.314 9.525 -4.286 1.00 0.00 C ATOM 1255 CD2 LEU A 995 -3.297 8.457 -1.986 1.00 0.00 C ATOM 0 H LEU A 995 -6.418 8.235 -0.980 1.00 0.00 H new ATOM 0 HA LEU A 995 -4.865 10.400 -1.842 1.00 0.00 H new ATOM 0 HB2 LEU A 995 -6.028 7.969 -2.952 1.00 0.00 H new ATOM 0 HB3 LEU A 995 -5.859 9.264 -4.120 1.00 0.00 H new ATOM 0 HG LEU A 995 -3.934 7.552 -3.799 1.00 0.00 H new ATOM 0 HD11 LEU A 995 -2.263 9.255 -4.391 1.00 0.00 H new ATOM 0 HD12 LEU A 995 -3.797 9.490 -5.263 1.00 0.00 H new ATOM 0 HD13 LEU A 995 -3.391 10.533 -3.879 1.00 0.00 H new ATOM 0 HD21 LEU A 995 -2.247 8.208 -2.137 1.00 0.00 H new ATOM 0 HD22 LEU A 995 -3.373 9.418 -1.478 1.00 0.00 H new ATOM 0 HD23 LEU A 995 -3.768 7.686 -1.377 1.00 0.00 H new ATOM 1267 N ALA A 996 -7.977 10.573 -2.897 1.00 0.00 N ATOM 1268 CA ALA A 996 -9.000 11.500 -3.352 1.00 0.00 C ATOM 1269 C ALA A 996 -8.956 12.764 -2.490 1.00 0.00 C ATOM 1270 O ALA A 996 -8.953 13.877 -3.013 1.00 0.00 O ATOM 1271 CB ALA A 996 -10.366 10.814 -3.310 1.00 0.00 C ATOM 0 H ALA A 996 -8.264 9.594 -2.885 1.00 0.00 H new ATOM 0 HA ALA A 996 -8.816 11.798 -4.384 1.00 0.00 H new ATOM 0 HB1 ALA A 996 -11.133 11.509 -3.651 1.00 0.00 H new ATOM 0 HB2 ALA A 996 -10.354 9.939 -3.960 1.00 0.00 H new ATOM 0 HB3 ALA A 996 -10.586 10.504 -2.289 1.00 0.00 H new ATOM 1277 N GLU A 997 -8.922 12.549 -1.183 1.00 0.00 N ATOM 1278 CA GLU A 997 -8.878 13.656 -0.243 1.00 0.00 C ATOM 1279 C GLU A 997 -7.589 14.459 -0.429 1.00 0.00 C ATOM 1280 O GLU A 997 -7.616 15.689 -0.446 1.00 0.00 O ATOM 1281 CB GLU A 997 -9.011 13.159 1.198 1.00 0.00 C ATOM 1282 CG GLU A 997 -9.202 14.328 2.166 1.00 0.00 C ATOM 1283 CD GLU A 997 -8.689 13.972 3.563 1.00 0.00 C ATOM 1284 OE1 GLU A 997 -9.297 13.070 4.178 1.00 0.00 O ATOM 1285 OE2 GLU A 997 -7.701 14.611 3.984 1.00 0.00 O ATOM 0 H GLU A 997 -8.924 11.624 -0.753 1.00 0.00 H new ATOM 0 HA GLU A 997 -9.725 14.312 -0.445 1.00 0.00 H new ATOM 0 HB2 GLU A 997 -9.858 12.477 1.274 1.00 0.00 H new ATOM 0 HB3 GLU A 997 -8.121 12.594 1.475 1.00 0.00 H new ATOM 0 HG2 GLU A 997 -8.672 15.204 1.793 1.00 0.00 H new ATOM 0 HG3 GLU A 997 -10.258 14.592 2.219 1.00 0.00 H new ATOM 1292 N LEU A 998 -6.490 13.731 -0.563 1.00 0.00 N ATOM 1293 CA LEU A 998 -5.193 14.360 -0.747 1.00 0.00 C ATOM 1294 C LEU A 998 -5.211 15.188 -2.033 1.00 0.00 C ATOM 1295 O LEU A 998 -4.646 16.280 -2.081 1.00 0.00 O ATOM 1296 CB LEU A 998 -4.079 13.312 -0.705 1.00 0.00 C ATOM 1297 CG LEU A 998 -2.716 13.802 -0.212 1.00 0.00 C ATOM 1298 CD1 LEU A 998 -2.141 12.853 0.841 1.00 0.00 C ATOM 1299 CD2 LEU A 998 -1.753 14.012 -1.382 1.00 0.00 C ATOM 0 H LEU A 998 -6.471 12.711 -0.548 1.00 0.00 H new ATOM 0 HA LEU A 998 -4.983 15.048 0.072 1.00 0.00 H new ATOM 0 HB2 LEU A 998 -4.402 12.492 -0.063 1.00 0.00 H new ATOM 0 HB3 LEU A 998 -3.955 12.902 -1.707 1.00 0.00 H new ATOM 0 HG LEU A 998 -2.854 14.771 0.269 1.00 0.00 H new ATOM 0 HD11 LEU A 998 -1.172 13.224 1.175 1.00 0.00 H new ATOM 0 HD12 LEU A 998 -2.821 12.798 1.691 1.00 0.00 H new ATOM 0 HD13 LEU A 998 -2.020 11.860 0.408 1.00 0.00 H new ATOM 0 HD21 LEU A 998 -0.792 14.360 -1.004 1.00 0.00 H new ATOM 0 HD22 LEU A 998 -1.614 13.070 -1.913 1.00 0.00 H new ATOM 0 HD23 LEU A 998 -2.166 14.755 -2.064 1.00 0.00 H new ATOM 1311 N ILE A 999 -5.865 14.638 -3.045 1.00 0.00 N ATOM 1312 CA ILE A 999 -5.964 15.312 -4.329 1.00 0.00 C ATOM 1313 C ILE A 999 -6.729 16.625 -4.153 1.00 0.00 C ATOM 1314 O ILE A 999 -6.186 17.702 -4.392 1.00 0.00 O ATOM 1315 CB ILE A 999 -6.573 14.380 -5.378 1.00 0.00 C ATOM 1316 CG1 ILE A 999 -5.834 13.041 -5.418 1.00 0.00 C ATOM 1317 CG2 ILE A 999 -6.614 15.053 -6.751 1.00 0.00 C ATOM 1318 CD1 ILE A 999 -4.668 13.088 -6.407 1.00 0.00 C ATOM 0 H ILE A 999 -6.332 13.732 -3.002 1.00 0.00 H new ATOM 0 HA ILE A 999 -4.973 15.568 -4.702 1.00 0.00 H new ATOM 0 HB ILE A 999 -7.603 14.170 -5.091 1.00 0.00 H new ATOM 0 HG12 ILE A 999 -5.462 12.797 -4.423 1.00 0.00 H new ATOM 0 HG13 ILE A 999 -6.526 12.248 -5.703 1.00 0.00 H new ATOM 0 HG21 ILE A 999 -7.051 14.369 -7.478 1.00 0.00 H new ATOM 0 HG22 ILE A 999 -7.219 15.958 -6.695 1.00 0.00 H new ATOM 0 HG23 ILE A 999 -5.601 15.312 -7.060 1.00 0.00 H new ATOM 0 HD11 ILE A 999 -4.160 12.124 -6.416 1.00 0.00 H new ATOM 0 HD12 ILE A 999 -5.046 13.308 -7.405 1.00 0.00 H new ATOM 0 HD13 ILE A 999 -3.966 13.865 -6.105 1.00 0.00 H new ATOM 1330 N ASN A1000 -7.980 16.492 -3.735 1.00 0.00 N ATOM 1331 CA ASN A1000 -8.826 17.654 -3.524 1.00 0.00 C ATOM 1332 C ASN A1000 -8.075 18.678 -2.670 1.00 0.00 C ATOM 1333 O ASN A1000 -8.238 19.883 -2.853 1.00 0.00 O ATOM 1334 CB ASN A1000 -10.111 17.274 -2.786 1.00 0.00 C ATOM 1335 CG ASN A1000 -11.263 18.202 -3.176 1.00 0.00 C ATOM 1336 OD1 ASN A1000 -11.070 19.338 -3.576 1.00 0.00 O ATOM 1337 ND2 ASN A1000 -12.468 17.656 -3.037 1.00 0.00 N ATOM 0 H ASN A1000 -8.427 15.597 -3.537 1.00 0.00 H new ATOM 0 HA ASN A1000 -9.080 18.067 -4.500 1.00 0.00 H new ATOM 0 HB2 ASN A1000 -10.376 16.242 -3.018 1.00 0.00 H new ATOM 0 HB3 ASN A1000 -9.946 17.327 -1.710 1.00 0.00 H new ATOM 0 HD21 ASN A1000 -13.302 18.195 -3.271 1.00 0.00 H new ATOM 0 HD22 ASN A1000 -12.558 16.699 -2.696 1.00 0.00 H new ATOM 1344 N LYS A1001 -7.268 18.160 -1.756 1.00 0.00 N ATOM 1345 CA LYS A1001 -6.492 19.014 -0.873 1.00 0.00 C ATOM 1346 C LYS A1001 -5.492 19.823 -1.702 1.00 0.00 C ATOM 1347 O LYS A1001 -5.490 21.052 -1.653 1.00 0.00 O ATOM 1348 CB LYS A1001 -5.842 18.187 0.238 1.00 0.00 C ATOM 1349 CG LYS A1001 -6.326 18.643 1.616 1.00 0.00 C ATOM 1350 CD LYS A1001 -7.585 17.881 2.035 1.00 0.00 C ATOM 1351 CE LYS A1001 -8.844 18.692 1.724 1.00 0.00 C ATOM 1352 NZ LYS A1001 -9.577 19.010 2.970 1.00 0.00 N ATOM 0 H LYS A1001 -7.135 17.160 -1.608 1.00 0.00 H new ATOM 0 HA LYS A1001 -7.141 19.729 -0.368 1.00 0.00 H new ATOM 0 HB2 LYS A1001 -6.078 17.132 0.097 1.00 0.00 H new ATOM 0 HB3 LYS A1001 -4.758 18.282 0.180 1.00 0.00 H new ATOM 0 HG2 LYS A1001 -5.539 18.484 2.353 1.00 0.00 H new ATOM 0 HG3 LYS A1001 -6.534 19.713 1.597 1.00 0.00 H new ATOM 0 HD2 LYS A1001 -7.626 16.924 1.514 1.00 0.00 H new ATOM 0 HD3 LYS A1001 -7.544 17.661 3.102 1.00 0.00 H new ATOM 0 HE2 LYS A1001 -8.572 19.614 1.210 1.00 0.00 H new ATOM 0 HE3 LYS A1001 -9.489 18.129 1.049 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 -10.429 19.561 2.741 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 -9.853 18.127 3.445 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 -8.965 19.566 3.601 1.00 0.00 H new ATOM 1366 N MET A1002 -4.666 19.100 -2.445 1.00 0.00 N ATOM 1367 CA MET A1002 -3.664 19.735 -3.284 1.00 0.00 C ATOM 1368 C MET A1002 -4.308 20.736 -4.246 1.00 0.00 C ATOM 1369 O MET A1002 -3.627 21.599 -4.797 1.00 0.00 O ATOM 1370 CB MET A1002 -2.916 18.667 -4.084 1.00 0.00 C ATOM 1371 CG MET A1002 -3.715 18.247 -5.319 1.00 0.00 C ATOM 1372 SD MET A1002 -2.752 18.530 -6.795 1.00 0.00 S ATOM 1373 CE MET A1002 -3.295 20.179 -7.208 1.00 0.00 C ATOM 0 H MET A1002 -4.670 18.081 -2.483 1.00 0.00 H new ATOM 0 HA MET A1002 -2.968 20.274 -2.641 1.00 0.00 H new ATOM 0 HB2 MET A1002 -1.943 19.051 -4.390 1.00 0.00 H new ATOM 0 HB3 MET A1002 -2.731 17.798 -3.453 1.00 0.00 H new ATOM 0 HG2 MET A1002 -3.984 17.193 -5.247 1.00 0.00 H new ATOM 0 HG3 MET A1002 -4.646 18.811 -5.369 1.00 0.00 H new ATOM 0 HE1 MET A1002 -3.284 20.305 -8.291 1.00 0.00 H new ATOM 0 HE2 MET A1002 -4.308 20.333 -6.835 1.00 0.00 H new ATOM 0 HE3 MET A1002 -2.626 20.908 -6.751 1.00 0.00 H new ATOM 1383 N LYS A1003 -5.613 20.586 -4.418 1.00 0.00 N ATOM 1384 CA LYS A1003 -6.357 21.466 -5.304 1.00 0.00 C ATOM 1385 C LYS A1003 -6.548 22.823 -4.625 1.00 0.00 C ATOM 1386 O LYS A1003 -6.468 23.864 -5.276 1.00 0.00 O ATOM 1387 CB LYS A1003 -7.667 20.806 -5.739 1.00 0.00 C ATOM 1388 CG LYS A1003 -7.566 20.280 -7.173 1.00 0.00 C ATOM 1389 CD LYS A1003 -8.943 20.234 -7.838 1.00 0.00 C ATOM 1390 CE LYS A1003 -9.368 21.625 -8.314 1.00 0.00 C ATOM 1391 NZ LYS A1003 -10.693 21.566 -8.969 1.00 0.00 N ATOM 0 H LYS A1003 -6.174 19.869 -3.959 1.00 0.00 H new ATOM 0 HA LYS A1003 -5.797 21.644 -6.222 1.00 0.00 H new ATOM 0 HB2 LYS A1003 -7.907 19.985 -5.063 1.00 0.00 H new ATOM 0 HB3 LYS A1003 -8.482 21.526 -5.668 1.00 0.00 H new ATOM 0 HG2 LYS A1003 -6.899 20.919 -7.752 1.00 0.00 H new ATOM 0 HG3 LYS A1003 -7.127 19.282 -7.168 1.00 0.00 H new ATOM 0 HD2 LYS A1003 -8.920 19.547 -8.684 1.00 0.00 H new ATOM 0 HD3 LYS A1003 -9.679 19.846 -7.133 1.00 0.00 H new ATOM 0 HE2 LYS A1003 -9.405 22.310 -7.467 1.00 0.00 H new ATOM 0 HE3 LYS A1003 -8.628 22.019 -9.011 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 -10.966 22.518 -9.286 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 -10.647 20.928 -9.789 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 -11.399 21.210 -8.293 1.00 0.00 H new ATOM 1405 N LEU A1004 -6.798 22.768 -3.325 1.00 0.00 N ATOM 1406 CA LEU A1004 -7.001 23.981 -2.550 1.00 0.00 C ATOM 1407 C LEU A1004 -5.646 24.629 -2.260 1.00 0.00 C ATOM 1408 O LEU A1004 -5.498 25.845 -2.375 1.00 0.00 O ATOM 1409 CB LEU A1004 -7.821 23.682 -1.293 1.00 0.00 C ATOM 1410 CG LEU A1004 -9.023 22.754 -1.481 1.00 0.00 C ATOM 1411 CD1 LEU A1004 -9.637 22.372 -0.133 1.00 0.00 C ATOM 1412 CD2 LEU A1004 -10.054 23.376 -2.425 1.00 0.00 C ATOM 0 H LEU A1004 -6.865 21.903 -2.789 1.00 0.00 H new ATOM 0 HA LEU A1004 -7.585 24.704 -3.120 1.00 0.00 H new ATOM 0 HB2 LEU A1004 -7.159 23.240 -0.548 1.00 0.00 H new ATOM 0 HB3 LEU A1004 -8.177 24.627 -0.882 1.00 0.00 H new ATOM 0 HG LEU A1004 -8.674 21.833 -1.948 1.00 0.00 H new ATOM 0 HD11 LEU A1004 -10.489 21.712 -0.295 1.00 0.00 H new ATOM 0 HD12 LEU A1004 -8.891 21.859 0.474 1.00 0.00 H new ATOM 0 HD13 LEU A1004 -9.969 23.272 0.384 1.00 0.00 H new ATOM 0 HD21 LEU A1004 -10.898 22.696 -2.541 1.00 0.00 H new ATOM 0 HD22 LEU A1004 -10.404 24.321 -2.010 1.00 0.00 H new ATOM 0 HD23 LEU A1004 -9.596 23.555 -3.398 1.00 0.00 H new ATOM 1424 N ALA A1005 -4.691 23.789 -1.889 1.00 0.00 N ATOM 1425 CA ALA A1005 -3.353 24.265 -1.582 1.00 0.00 C ATOM 1426 C ALA A1005 -2.824 25.082 -2.763 1.00 0.00 C ATOM 1427 O ALA A1005 -2.047 26.018 -2.576 1.00 0.00 O ATOM 1428 CB ALA A1005 -2.452 23.075 -1.246 1.00 0.00 C ATOM 0 H ALA A1005 -4.817 22.781 -1.794 1.00 0.00 H new ATOM 0 HA ALA A1005 -3.369 24.918 -0.710 1.00 0.00 H new ATOM 0 HB1 ALA A1005 -1.448 23.432 -1.016 1.00 0.00 H new ATOM 0 HB2 ALA A1005 -2.856 22.545 -0.383 1.00 0.00 H new ATOM 0 HB3 ALA A1005 -2.409 22.398 -2.100 1.00 0.00 H new ATOM 1434 N GLN A1006 -3.265 24.699 -3.952 1.00 0.00 N ATOM 1435 CA GLN A1006 -2.845 25.384 -5.162 1.00 0.00 C ATOM 1436 C GLN A1006 -3.261 26.856 -5.110 1.00 0.00 C ATOM 1437 O GLN A1006 -2.553 27.723 -5.619 1.00 0.00 O ATOM 1438 CB GLN A1006 -3.413 24.697 -6.406 1.00 0.00 C ATOM 1439 CG GLN A1006 -2.438 23.650 -6.947 1.00 0.00 C ATOM 1440 CD GLN A1006 -1.345 24.304 -7.795 1.00 0.00 C ATOM 1441 OE1 GLN A1006 -0.161 24.189 -7.525 1.00 0.00 O ATOM 1442 NE2 GLN A1006 -1.807 24.996 -8.833 1.00 0.00 N ATOM 0 H GLN A1006 -3.909 23.923 -4.103 1.00 0.00 H new ATOM 0 HA GLN A1006 -1.758 25.336 -5.225 1.00 0.00 H new ATOM 0 HB2 GLN A1006 -4.363 24.222 -6.162 1.00 0.00 H new ATOM 0 HB3 GLN A1006 -3.617 25.441 -7.176 1.00 0.00 H new ATOM 0 HG2 GLN A1006 -1.984 23.108 -6.117 1.00 0.00 H new ATOM 0 HG3 GLN A1006 -2.980 22.919 -7.547 1.00 0.00 H new ATOM 0 HE21 GLN A1006 -2.811 25.052 -9.002 1.00 0.00 H new ATOM 0 HE22 GLN A1006 -1.157 25.470 -9.460 1.00 0.00 H new ATOM 1451 N GLN A1007 -4.408 27.092 -4.490 1.00 0.00 N ATOM 1452 CA GLN A1007 -4.927 28.444 -4.365 1.00 0.00 C ATOM 1453 C GLN A1007 -4.598 29.012 -2.984 1.00 0.00 C ATOM 1454 O GLN A1007 -4.429 30.221 -2.830 1.00 0.00 O ATOM 1455 CB GLN A1007 -6.433 28.479 -4.629 1.00 0.00 C ATOM 1456 CG GLN A1007 -6.871 29.860 -5.121 1.00 0.00 C ATOM 1457 CD GLN A1007 -8.220 30.256 -4.516 1.00 0.00 C ATOM 1458 OE1 GLN A1007 -8.891 29.472 -3.865 1.00 0.00 O ATOM 1459 NE2 GLN A1007 -8.577 31.512 -4.767 1.00 0.00 N ATOM 0 H GLN A1007 -4.993 26.370 -4.069 1.00 0.00 H new ATOM 0 HA GLN A1007 -4.446 29.069 -5.117 1.00 0.00 H new ATOM 0 HB2 GLN A1007 -6.693 27.725 -5.372 1.00 0.00 H new ATOM 0 HB3 GLN A1007 -6.972 28.226 -3.716 1.00 0.00 H new ATOM 0 HG2 GLN A1007 -6.117 30.601 -4.854 1.00 0.00 H new ATOM 0 HG3 GLN A1007 -6.943 29.856 -6.209 1.00 0.00 H new ATOM 0 HE21 GLN A1007 -7.967 32.115 -5.319 1.00 0.00 H new ATOM 0 HE22 GLN A1007 -9.461 31.873 -4.407 1.00 0.00 H new ATOM 1468 N TYR A1008 -4.517 28.114 -2.013 1.00 0.00 N ATOM 1469 CA TYR A1008 -4.211 28.512 -0.649 1.00 0.00 C ATOM 1470 C TYR A1008 -2.700 28.538 -0.411 1.00 0.00 C ATOM 1471 O TYR A1008 -2.238 28.268 0.696 1.00 0.00 O ATOM 1472 CB TYR A1008 -4.839 27.446 0.251 1.00 0.00 C ATOM 1473 CG TYR A1008 -6.312 27.697 0.580 1.00 0.00 C ATOM 1474 CD1 TYR A1008 -6.655 28.614 1.553 1.00 0.00 C ATOM 1475 CD2 TYR A1008 -7.297 27.008 -0.097 1.00 0.00 C ATOM 1476 CE1 TYR A1008 -8.042 28.850 1.862 1.00 0.00 C ATOM 1477 CE2 TYR A1008 -8.684 27.244 0.212 1.00 0.00 C ATOM 1478 CZ TYR A1008 -8.987 28.154 1.176 1.00 0.00 C ATOM 1479 OH TYR A1008 -10.297 28.378 1.468 1.00 0.00 O ATOM 0 H TYR A1008 -4.658 27.112 -2.144 1.00 0.00 H new ATOM 0 HA TYR A1008 -4.595 29.511 -0.445 1.00 0.00 H new ATOM 0 HB2 TYR A1008 -4.746 26.475 -0.235 1.00 0.00 H new ATOM 0 HB3 TYR A1008 -4.274 27.392 1.181 1.00 0.00 H new ATOM 0 HD1 TYR A1008 -5.884 29.154 2.082 1.00 0.00 H new ATOM 0 HD2 TYR A1008 -7.028 26.291 -0.859 1.00 0.00 H new ATOM 0 HE1 TYR A1008 -8.325 29.564 2.622 1.00 0.00 H new ATOM 0 HE2 TYR A1008 -9.465 26.711 -0.310 1.00 0.00 H new ATOM 0 HH TYR A1008 -10.860 27.812 0.900 1.00 0.00 H new ATOM 1489 N VAL A1009 -1.972 28.865 -1.469 1.00 0.00 N ATOM 1490 CA VAL A1009 -0.523 28.931 -1.389 1.00 0.00 C ATOM 1491 C VAL A1009 -0.064 30.361 -1.680 1.00 0.00 C ATOM 1492 O VAL A1009 0.844 30.871 -1.025 1.00 0.00 O ATOM 1493 CB VAL A1009 0.100 27.899 -2.332 1.00 0.00 C ATOM 1494 CG1 VAL A1009 -0.520 27.987 -3.728 1.00 0.00 C ATOM 1495 CG2 VAL A1009 1.620 28.062 -2.395 1.00 0.00 C ATOM 0 H VAL A1009 -2.359 29.087 -2.386 1.00 0.00 H new ATOM 0 HA VAL A1009 -0.184 28.680 -0.384 1.00 0.00 H new ATOM 0 HB VAL A1009 -0.114 26.908 -1.933 1.00 0.00 H new ATOM 0 HG11 VAL A1009 -0.060 27.243 -4.378 1.00 0.00 H new ATOM 0 HG12 VAL A1009 -1.592 27.798 -3.663 1.00 0.00 H new ATOM 0 HG13 VAL A1009 -0.351 28.982 -4.139 1.00 0.00 H new ATOM 0 HG21 VAL A1009 2.038 27.317 -3.072 1.00 0.00 H new ATOM 0 HG22 VAL A1009 1.864 29.060 -2.759 1.00 0.00 H new ATOM 0 HG23 VAL A1009 2.042 27.925 -1.399 1.00 0.00 H new ATOM 1505 N MET A1010 -0.713 30.968 -2.663 1.00 0.00 N ATOM 1506 CA MET A1010 -0.383 32.329 -3.049 1.00 0.00 C ATOM 1507 C MET A1010 -0.700 33.311 -1.920 1.00 0.00 C ATOM 1508 O MET A1010 -1.582 34.158 -2.058 1.00 0.00 O ATOM 1509 CB MET A1010 -1.179 32.713 -4.298 1.00 0.00 C ATOM 1510 CG MET A1010 -2.661 32.373 -4.130 1.00 0.00 C ATOM 1511 SD MET A1010 -3.632 33.871 -4.104 1.00 0.00 S ATOM 1512 CE MET A1010 -4.523 33.635 -2.576 1.00 0.00 C ATOM 0 H MET A1010 -1.466 30.542 -3.204 1.00 0.00 H new ATOM 0 HA MET A1010 0.685 32.378 -3.259 1.00 0.00 H new ATOM 0 HB2 MET A1010 -1.067 33.780 -4.491 1.00 0.00 H new ATOM 0 HB3 MET A1010 -0.778 32.188 -5.165 1.00 0.00 H new ATOM 0 HG2 MET A1010 -2.990 31.731 -4.947 1.00 0.00 H new ATOM 0 HG3 MET A1010 -2.812 31.816 -3.206 1.00 0.00 H new ATOM 0 HE1 MET A1010 -4.835 34.603 -2.184 1.00 0.00 H new ATOM 0 HE2 MET A1010 -5.402 33.017 -2.759 1.00 0.00 H new ATOM 0 HE3 MET A1010 -3.877 33.141 -1.851 1.00 0.00 H new ATOM 1522 N THR A1011 0.036 33.166 -0.828 1.00 0.00 N ATOM 1523 CA THR A1011 -0.156 34.030 0.325 1.00 0.00 C ATOM 1524 C THR A1011 0.662 33.522 1.514 1.00 0.00 C ATOM 1525 O THR A1011 1.500 34.246 2.050 1.00 0.00 O ATOM 1526 CB THR A1011 -1.657 34.111 0.610 1.00 0.00 C ATOM 1527 OG1 THR A1011 -1.730 34.513 1.975 1.00 0.00 O ATOM 1528 CG2 THR A1011 -2.332 32.738 0.590 1.00 0.00 C ATOM 0 H THR A1011 0.767 32.463 -0.717 1.00 0.00 H new ATOM 0 HA THR A1011 0.207 35.039 0.128 1.00 0.00 H new ATOM 0 HB THR A1011 -2.131 34.760 -0.126 1.00 0.00 H new ATOM 0 HG1 THR A1011 -2.669 34.592 2.243 1.00 0.00 H new ATOM 0 HG21 THR A1011 -3.396 32.852 0.798 1.00 0.00 H new ATOM 0 HG22 THR A1011 -2.201 32.283 -0.392 1.00 0.00 H new ATOM 0 HG23 THR A1011 -1.881 32.100 1.349 1.00 0.00 H new ATOM 1536 N SER A1012 0.390 32.281 1.891 1.00 0.00 N ATOM 1537 CA SER A1012 1.091 31.668 3.007 1.00 0.00 C ATOM 1538 C SER A1012 0.238 30.551 3.610 1.00 0.00 C ATOM 1539 O SER A1012 0.763 29.639 4.247 1.00 0.00 O ATOM 1540 CB SER A1012 1.439 32.706 4.076 1.00 0.00 C ATOM 1541 OG SER A1012 0.447 33.725 4.173 1.00 0.00 O ATOM 0 H SER A1012 -0.306 31.684 1.444 1.00 0.00 H new ATOM 0 HA SER A1012 2.023 31.244 2.634 1.00 0.00 H new ATOM 0 HB2 SER A1012 1.546 32.211 5.041 1.00 0.00 H new ATOM 0 HB3 SER A1012 2.402 33.159 3.842 1.00 0.00 H new ATOM 0 HG SER A1012 0.737 34.513 3.669 1.00 0.00 H new ATOM 1547 N LEU A1013 -1.064 30.657 3.387 1.00 0.00 N ATOM 1548 CA LEU A1013 -1.995 29.667 3.901 1.00 0.00 C ATOM 1549 C LEU A1013 -1.382 28.273 3.753 1.00 0.00 C ATOM 1550 O LEU A1013 -1.666 27.379 4.549 1.00 0.00 O ATOM 1551 CB LEU A1013 -3.360 29.813 3.225 1.00 0.00 C ATOM 1552 CG LEU A1013 -4.483 30.377 4.097 1.00 0.00 C ATOM 1553 CD1 LEU A1013 -5.253 29.253 4.793 1.00 0.00 C ATOM 1554 CD2 LEU A1013 -3.940 31.403 5.095 1.00 0.00 C ATOM 0 H LEU A1013 -1.496 31.414 2.857 1.00 0.00 H new ATOM 0 HA LEU A1013 -2.173 29.827 4.964 1.00 0.00 H new ATOM 0 HB2 LEU A1013 -3.245 30.458 2.354 1.00 0.00 H new ATOM 0 HB3 LEU A1013 -3.668 28.834 2.858 1.00 0.00 H new ATOM 0 HG LEU A1013 -5.188 30.899 3.450 1.00 0.00 H new ATOM 0 HD11 LEU A1013 -6.046 29.681 5.407 1.00 0.00 H new ATOM 0 HD12 LEU A1013 -5.690 28.593 4.044 1.00 0.00 H new ATOM 0 HD13 LEU A1013 -4.572 28.683 5.425 1.00 0.00 H new ATOM 0 HD21 LEU A1013 -4.759 31.788 5.702 1.00 0.00 H new ATOM 0 HD22 LEU A1013 -3.202 30.927 5.741 1.00 0.00 H new ATOM 0 HD23 LEU A1013 -3.472 32.225 4.553 1.00 0.00 H new ATOM 1566 N GLN A1014 -0.553 28.131 2.729 1.00 0.00 N ATOM 1567 CA GLN A1014 0.102 26.861 2.467 1.00 0.00 C ATOM 1568 C GLN A1014 0.505 26.190 3.782 1.00 0.00 C ATOM 1569 O GLN A1014 0.093 25.065 4.061 1.00 0.00 O ATOM 1570 CB GLN A1014 1.315 27.048 1.553 1.00 0.00 C ATOM 1571 CG GLN A1014 2.070 25.730 1.368 1.00 0.00 C ATOM 1572 CD GLN A1014 1.196 24.692 0.662 1.00 0.00 C ATOM 1573 OE1 GLN A1014 0.252 25.012 -0.042 1.00 0.00 O ATOM 1574 NE2 GLN A1014 1.563 23.433 0.887 1.00 0.00 N ATOM 0 H GLN A1014 -0.320 28.875 2.071 1.00 0.00 H new ATOM 0 HA GLN A1014 -0.604 26.210 1.951 1.00 0.00 H new ATOM 0 HB2 GLN A1014 0.990 27.424 0.583 1.00 0.00 H new ATOM 0 HB3 GLN A1014 1.983 27.797 1.978 1.00 0.00 H new ATOM 0 HG2 GLN A1014 2.976 25.904 0.787 1.00 0.00 H new ATOM 0 HG3 GLN A1014 2.383 25.347 2.339 1.00 0.00 H new ATOM 0 HE21 GLN A1014 2.364 23.235 1.487 1.00 0.00 H new ATOM 0 HE22 GLN A1014 1.044 22.666 0.459 1.00 0.00 H new ATOM 1583 N GLN A1015 1.306 26.909 4.555 1.00 0.00 N ATOM 1584 CA GLN A1015 1.769 26.398 5.834 1.00 0.00 C ATOM 1585 C GLN A1015 0.642 25.647 6.545 1.00 0.00 C ATOM 1586 O GLN A1015 0.876 24.612 7.167 1.00 0.00 O ATOM 1587 CB GLN A1015 2.315 27.526 6.711 1.00 0.00 C ATOM 1588 CG GLN A1015 1.346 28.710 6.746 1.00 0.00 C ATOM 1589 CD GLN A1015 0.865 28.982 8.173 1.00 0.00 C ATOM 1590 OE1 GLN A1015 1.526 28.669 9.149 1.00 0.00 O ATOM 1591 NE2 GLN A1015 -0.321 29.581 8.239 1.00 0.00 N ATOM 0 H GLN A1015 1.646 27.841 4.320 1.00 0.00 H new ATOM 0 HA GLN A1015 2.585 25.699 5.649 1.00 0.00 H new ATOM 0 HB2 GLN A1015 2.481 27.157 7.723 1.00 0.00 H new ATOM 0 HB3 GLN A1015 3.282 27.854 6.329 1.00 0.00 H new ATOM 0 HG2 GLN A1015 1.837 29.598 6.348 1.00 0.00 H new ATOM 0 HG3 GLN A1015 0.490 28.504 6.103 1.00 0.00 H new ATOM 0 HE21 GLN A1015 -0.822 29.816 7.382 1.00 0.00 H new ATOM 0 HE22 GLN A1015 -0.729 29.805 9.146 1.00 0.00 H new ATOM 1600 N GLU A1016 -0.558 26.198 6.429 1.00 0.00 N ATOM 1601 CA GLU A1016 -1.722 25.593 7.054 1.00 0.00 C ATOM 1602 C GLU A1016 -2.083 24.284 6.348 1.00 0.00 C ATOM 1603 O GLU A1016 -1.964 23.207 6.931 1.00 0.00 O ATOM 1604 CB GLU A1016 -2.908 26.560 7.055 1.00 0.00 C ATOM 1605 CG GLU A1016 -4.097 25.969 7.815 1.00 0.00 C ATOM 1606 CD GLU A1016 -5.071 27.066 8.248 1.00 0.00 C ATOM 1607 OE1 GLU A1016 -4.575 28.129 8.678 1.00 0.00 O ATOM 1608 OE2 GLU A1016 -6.291 26.817 8.138 1.00 0.00 O ATOM 0 H GLU A1016 -0.749 27.056 5.912 1.00 0.00 H new ATOM 0 HA GLU A1016 -1.477 25.368 8.092 1.00 0.00 H new ATOM 0 HB2 GLU A1016 -2.612 27.504 7.513 1.00 0.00 H new ATOM 0 HB3 GLU A1016 -3.202 26.782 6.029 1.00 0.00 H new ATOM 0 HG2 GLU A1016 -4.614 25.247 7.183 1.00 0.00 H new ATOM 0 HG3 GLU A1016 -3.740 25.428 8.691 1.00 0.00 H new ATOM 1615 N TYR A1017 -2.516 24.419 5.104 1.00 0.00 N ATOM 1616 CA TYR A1017 -2.895 23.261 4.313 1.00 0.00 C ATOM 1617 C TYR A1017 -1.754 22.244 4.248 1.00 0.00 C ATOM 1618 O TYR A1017 -1.972 21.081 3.914 1.00 0.00 O ATOM 1619 CB TYR A1017 -3.176 23.786 2.903 1.00 0.00 C ATOM 1620 CG TYR A1017 -4.611 24.272 2.694 1.00 0.00 C ATOM 1621 CD1 TYR A1017 -4.981 25.533 3.116 1.00 0.00 C ATOM 1622 CD2 TYR A1017 -5.536 23.450 2.084 1.00 0.00 C ATOM 1623 CE1 TYR A1017 -6.332 25.991 2.920 1.00 0.00 C ATOM 1624 CE2 TYR A1017 -6.887 23.907 1.888 1.00 0.00 C ATOM 1625 CZ TYR A1017 -7.219 25.155 2.315 1.00 0.00 C ATOM 1626 OH TYR A1017 -8.495 25.588 2.129 1.00 0.00 O ATOM 0 H TYR A1017 -2.613 25.314 4.624 1.00 0.00 H new ATOM 0 HA TYR A1017 -3.759 22.762 4.753 1.00 0.00 H new ATOM 0 HB2 TYR A1017 -2.491 24.606 2.689 1.00 0.00 H new ATOM 0 HB3 TYR A1017 -2.963 22.996 2.183 1.00 0.00 H new ATOM 0 HD1 TYR A1017 -4.257 26.176 3.593 1.00 0.00 H new ATOM 0 HD2 TYR A1017 -5.246 22.463 1.753 1.00 0.00 H new ATOM 0 HE1 TYR A1017 -6.634 26.975 3.246 1.00 0.00 H new ATOM 0 HE2 TYR A1017 -7.621 23.273 1.412 1.00 0.00 H new ATOM 0 HH TYR A1017 -8.502 26.310 1.466 1.00 0.00 H new ATOM 1636 N LYS A1018 -0.560 22.721 4.571 1.00 0.00 N ATOM 1637 CA LYS A1018 0.616 21.868 4.554 1.00 0.00 C ATOM 1638 C LYS A1018 0.480 20.797 5.638 1.00 0.00 C ATOM 1639 O LYS A1018 0.504 19.603 5.342 1.00 0.00 O ATOM 1640 CB LYS A1018 1.889 22.709 4.676 1.00 0.00 C ATOM 1641 CG LYS A1018 3.100 21.827 4.989 1.00 0.00 C ATOM 1642 CD LYS A1018 3.407 20.884 3.824 1.00 0.00 C ATOM 1643 CE LYS A1018 3.003 19.447 4.161 1.00 0.00 C ATOM 1644 NZ LYS A1018 4.144 18.527 3.957 1.00 0.00 N ATOM 0 H LYS A1018 -0.382 23.687 4.846 1.00 0.00 H new ATOM 0 HA LYS A1018 0.695 21.347 3.600 1.00 0.00 H new ATOM 0 HB2 LYS A1018 2.061 23.253 3.747 1.00 0.00 H new ATOM 0 HB3 LYS A1018 1.764 23.453 5.462 1.00 0.00 H new ATOM 0 HG2 LYS A1018 3.968 22.454 5.193 1.00 0.00 H new ATOM 0 HG3 LYS A1018 2.908 21.246 5.891 1.00 0.00 H new ATOM 0 HD2 LYS A1018 2.874 21.216 2.933 1.00 0.00 H new ATOM 0 HD3 LYS A1018 4.471 20.921 3.592 1.00 0.00 H new ATOM 0 HE2 LYS A1018 2.664 19.391 5.195 1.00 0.00 H new ATOM 0 HE3 LYS A1018 2.165 19.142 3.534 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 3.923 17.866 3.185 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 4.992 19.076 3.710 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 4.320 17.992 4.832 1.00 0.00 H new ATOM 1658 N LYS A1019 0.340 21.262 6.870 1.00 0.00 N ATOM 1659 CA LYS A1019 0.200 20.359 8.000 1.00 0.00 C ATOM 1660 C LYS A1019 -0.893 19.333 7.695 1.00 0.00 C ATOM 1661 O LYS A1019 -0.756 18.157 8.027 1.00 0.00 O ATOM 1662 CB LYS A1019 -0.038 21.146 9.290 1.00 0.00 C ATOM 1663 CG LYS A1019 1.285 21.481 9.981 1.00 0.00 C ATOM 1664 CD LYS A1019 1.967 22.675 9.310 1.00 0.00 C ATOM 1665 CE LYS A1019 2.860 22.218 8.154 1.00 0.00 C ATOM 1666 NZ LYS A1019 4.287 22.300 8.538 1.00 0.00 N ATOM 0 H LYS A1019 0.320 22.253 7.111 1.00 0.00 H new ATOM 0 HA LYS A1019 1.124 19.803 8.160 1.00 0.00 H new ATOM 0 HB2 LYS A1019 -0.577 22.066 9.064 1.00 0.00 H new ATOM 0 HB3 LYS A1019 -0.667 20.565 9.964 1.00 0.00 H new ATOM 0 HG2 LYS A1019 1.104 21.705 11.032 1.00 0.00 H new ATOM 0 HG3 LYS A1019 1.946 20.615 9.949 1.00 0.00 H new ATOM 0 HD2 LYS A1019 1.212 23.368 8.939 1.00 0.00 H new ATOM 0 HD3 LYS A1019 2.564 23.217 10.043 1.00 0.00 H new ATOM 0 HE2 LYS A1019 2.610 21.194 7.877 1.00 0.00 H new ATOM 0 HE3 LYS A1019 2.677 22.839 7.277 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 4.879 21.986 7.743 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 4.525 23.283 8.781 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 4.461 21.688 9.361 1.00 0.00 H new ATOM 1680 N GLN A1020 -1.954 19.816 7.065 1.00 0.00 N ATOM 1681 CA GLN A1020 -3.070 18.955 6.711 1.00 0.00 C ATOM 1682 C GLN A1020 -2.596 17.815 5.807 1.00 0.00 C ATOM 1683 O GLN A1020 -2.912 16.652 6.051 1.00 0.00 O ATOM 1684 CB GLN A1020 -4.189 19.756 6.042 1.00 0.00 C ATOM 1685 CG GLN A1020 -4.665 20.894 6.947 1.00 0.00 C ATOM 1686 CD GLN A1020 -5.092 20.363 8.317 1.00 0.00 C ATOM 1687 OE1 GLN A1020 -5.414 19.199 8.487 1.00 0.00 O ATOM 1688 NE2 GLN A1020 -5.075 21.279 9.281 1.00 0.00 N ATOM 0 H GLN A1020 -2.064 20.792 6.791 1.00 0.00 H new ATOM 0 HA GLN A1020 -3.474 18.522 7.626 1.00 0.00 H new ATOM 0 HB2 GLN A1020 -3.834 20.164 5.096 1.00 0.00 H new ATOM 0 HB3 GLN A1020 -5.025 19.096 5.811 1.00 0.00 H new ATOM 0 HG2 GLN A1020 -3.866 21.625 7.069 1.00 0.00 H new ATOM 0 HG3 GLN A1020 -5.501 21.412 6.477 1.00 0.00 H new ATOM 0 HE21 GLN A1020 -4.795 22.237 9.070 1.00 0.00 H new ATOM 0 HE22 GLN A1020 -5.342 21.024 10.232 1.00 0.00 H new ATOM 1697 N MET A1021 -1.844 18.189 4.782 1.00 0.00 N ATOM 1698 CA MET A1021 -1.323 17.213 3.840 1.00 0.00 C ATOM 1699 C MET A1021 -0.609 16.074 4.570 1.00 0.00 C ATOM 1700 O MET A1021 -0.753 14.909 4.202 1.00 0.00 O ATOM 1701 CB MET A1021 -0.346 17.898 2.883 1.00 0.00 C ATOM 1702 CG MET A1021 -1.028 18.243 1.557 1.00 0.00 C ATOM 1703 SD MET A1021 -1.232 16.768 0.573 1.00 0.00 S ATOM 1704 CE MET A1021 0.449 16.166 0.565 1.00 0.00 C ATOM 0 H MET A1021 -1.583 19.155 4.583 1.00 0.00 H new ATOM 0 HA MET A1021 -2.159 16.793 3.281 1.00 0.00 H new ATOM 0 HB2 MET A1021 0.043 18.806 3.343 1.00 0.00 H new ATOM 0 HB3 MET A1021 0.506 17.244 2.698 1.00 0.00 H new ATOM 0 HG2 MET A1021 -1.999 18.701 1.746 1.00 0.00 H new ATOM 0 HG3 MET A1021 -0.432 18.974 1.011 1.00 0.00 H new ATOM 0 HE1 MET A1021 0.552 15.385 -0.188 1.00 0.00 H new ATOM 0 HE2 MET A1021 1.128 16.986 0.332 1.00 0.00 H new ATOM 0 HE3 MET A1021 0.694 15.759 1.546 1.00 0.00 H new ATOM 1714 N LEU A1022 0.145 16.450 5.593 1.00 0.00 N ATOM 1715 CA LEU A1022 0.881 15.474 6.378 1.00 0.00 C ATOM 1716 C LEU A1022 -0.106 14.542 7.083 1.00 0.00 C ATOM 1717 O LEU A1022 0.169 13.356 7.256 1.00 0.00 O ATOM 1718 CB LEU A1022 1.851 16.176 7.331 1.00 0.00 C ATOM 1719 CG LEU A1022 3.217 15.510 7.508 1.00 0.00 C ATOM 1720 CD1 LEU A1022 4.350 16.513 7.281 1.00 0.00 C ATOM 1721 CD2 LEU A1022 3.322 14.827 8.873 1.00 0.00 C ATOM 0 H LEU A1022 0.262 17.417 5.896 1.00 0.00 H new ATOM 0 HA LEU A1022 1.499 14.852 5.730 1.00 0.00 H new ATOM 0 HB2 LEU A1022 2.009 17.193 6.973 1.00 0.00 H new ATOM 0 HB3 LEU A1022 1.377 16.252 8.309 1.00 0.00 H new ATOM 0 HG LEU A1022 3.318 14.733 6.750 1.00 0.00 H new ATOM 0 HD11 LEU A1022 5.310 16.014 7.413 1.00 0.00 H new ATOM 0 HD12 LEU A1022 4.285 16.913 6.269 1.00 0.00 H new ATOM 0 HD13 LEU A1022 4.263 17.328 7.999 1.00 0.00 H new ATOM 0 HD21 LEU A1022 4.303 14.362 8.973 1.00 0.00 H new ATOM 0 HD22 LEU A1022 3.190 15.568 9.662 1.00 0.00 H new ATOM 0 HD23 LEU A1022 2.548 14.064 8.959 1.00 0.00 H new ATOM 1733 N THR A1023 -1.237 15.114 7.471 1.00 0.00 N ATOM 1734 CA THR A1023 -2.267 14.350 8.153 1.00 0.00 C ATOM 1735 C THR A1023 -2.627 13.101 7.345 1.00 0.00 C ATOM 1736 O THR A1023 -2.627 11.992 7.876 1.00 0.00 O ATOM 1737 CB THR A1023 -3.458 15.277 8.401 1.00 0.00 C ATOM 1738 OG1 THR A1023 -2.861 16.530 8.726 1.00 0.00 O ATOM 1739 CG2 THR A1023 -4.242 14.900 9.660 1.00 0.00 C ATOM 0 H THR A1023 -1.462 16.098 7.326 1.00 0.00 H new ATOM 0 HA THR A1023 -1.915 13.985 9.118 1.00 0.00 H new ATOM 0 HB THR A1023 -4.123 15.251 7.538 1.00 0.00 H new ATOM 0 HG1 THR A1023 -3.449 17.025 9.334 1.00 0.00 H new ATOM 0 HG21 THR A1023 -5.076 15.589 9.789 1.00 0.00 H new ATOM 0 HG22 THR A1023 -4.623 13.884 9.561 1.00 0.00 H new ATOM 0 HG23 THR A1023 -3.586 14.958 10.528 1.00 0.00 H new ATOM 1747 N ALA A1024 -2.926 13.324 6.073 1.00 0.00 N ATOM 1748 CA ALA A1024 -3.287 12.231 5.186 1.00 0.00 C ATOM 1749 C ALA A1024 -2.030 11.441 4.820 1.00 0.00 C ATOM 1750 O ALA A1024 -2.069 10.215 4.719 1.00 0.00 O ATOM 1751 CB ALA A1024 -4.006 12.788 3.956 1.00 0.00 C ATOM 0 H ALA A1024 -2.926 14.246 5.636 1.00 0.00 H new ATOM 0 HA ALA A1024 -3.974 11.545 5.681 1.00 0.00 H new ATOM 0 HB1 ALA A1024 -4.277 11.968 3.291 1.00 0.00 H new ATOM 0 HB2 ALA A1024 -4.908 13.314 4.269 1.00 0.00 H new ATOM 0 HB3 ALA A1024 -3.346 13.479 3.431 1.00 0.00 H new ATOM 1757 N ALA A1025 -0.943 12.174 4.630 1.00 0.00 N ATOM 1758 CA ALA A1025 0.324 11.557 4.276 1.00 0.00 C ATOM 1759 C ALA A1025 0.728 10.568 5.371 1.00 0.00 C ATOM 1760 O ALA A1025 1.358 9.549 5.091 1.00 0.00 O ATOM 1761 CB ALA A1025 1.378 12.644 4.055 1.00 0.00 C ATOM 0 H ALA A1025 -0.913 13.190 4.715 1.00 0.00 H new ATOM 0 HA ALA A1025 0.231 10.999 3.344 1.00 0.00 H new ATOM 0 HB1 ALA A1025 2.328 12.181 3.789 1.00 0.00 H new ATOM 0 HB2 ALA A1025 1.057 13.303 3.248 1.00 0.00 H new ATOM 0 HB3 ALA A1025 1.500 13.224 4.970 1.00 0.00 H new ATOM 1767 N HIS A1026 0.349 10.903 6.596 1.00 0.00 N ATOM 1768 CA HIS A1026 0.663 10.056 7.734 1.00 0.00 C ATOM 1769 C HIS A1026 -0.168 8.774 7.665 1.00 0.00 C ATOM 1770 O HIS A1026 0.377 7.672 7.723 1.00 0.00 O ATOM 1771 CB HIS A1026 0.470 10.818 9.047 1.00 0.00 C ATOM 1772 CG HIS A1026 1.758 11.124 9.774 1.00 0.00 C ATOM 1773 ND1 HIS A1026 2.871 11.647 9.139 1.00 0.00 N ATOM 1774 CD2 HIS A1026 2.097 10.978 11.087 1.00 0.00 C ATOM 1775 CE1 HIS A1026 3.831 11.802 10.039 1.00 0.00 C ATOM 1776 NE2 HIS A1026 3.350 11.387 11.245 1.00 0.00 N ATOM 0 H HIS A1026 -0.172 11.749 6.825 1.00 0.00 H new ATOM 0 HA HIS A1026 1.714 9.768 7.699 1.00 0.00 H new ATOM 0 HB2 HIS A1026 -0.049 11.754 8.839 1.00 0.00 H new ATOM 0 HB3 HIS A1026 -0.176 10.234 9.703 1.00 0.00 H new ATOM 0 HD2 HIS A1026 1.455 10.595 11.866 1.00 0.00 H new ATOM 0 HE1 HIS A1026 4.821 12.189 9.850 1.00 0.00 H new ATOM 0 HE2 HIS A1026 3.868 11.390 12.124 1.00 0.00 H new ATOM 1784 N ALA A1027 -1.474 8.959 7.543 1.00 0.00 N ATOM 1785 CA ALA A1027 -2.386 7.830 7.465 1.00 0.00 C ATOM 1786 C ALA A1027 -2.116 7.049 6.178 1.00 0.00 C ATOM 1787 O ALA A1027 -2.235 5.825 6.153 1.00 0.00 O ATOM 1788 CB ALA A1027 -3.829 8.332 7.551 1.00 0.00 C ATOM 0 H ALA A1027 -1.923 9.874 7.496 1.00 0.00 H new ATOM 0 HA ALA A1027 -2.227 7.150 8.302 1.00 0.00 H new ATOM 0 HB1 ALA A1027 -4.513 7.485 7.492 1.00 0.00 H new ATOM 0 HB2 ALA A1027 -3.977 8.853 8.497 1.00 0.00 H new ATOM 0 HB3 ALA A1027 -4.026 9.015 6.725 1.00 0.00 H new ATOM 1794 N LEU A1028 -1.757 7.789 5.139 1.00 0.00 N ATOM 1795 CA LEU A1028 -1.470 7.182 3.851 1.00 0.00 C ATOM 1796 C LEU A1028 -0.377 6.125 4.023 1.00 0.00 C ATOM 1797 O LEU A1028 -0.628 4.933 3.853 1.00 0.00 O ATOM 1798 CB LEU A1028 -1.129 8.256 2.816 1.00 0.00 C ATOM 1799 CG LEU A1028 -2.313 8.852 2.053 1.00 0.00 C ATOM 1800 CD1 LEU A1028 -1.835 9.685 0.862 1.00 0.00 C ATOM 1801 CD2 LEU A1028 -3.299 7.761 1.631 1.00 0.00 C ATOM 0 H LEU A1028 -1.658 8.804 5.163 1.00 0.00 H new ATOM 0 HA LEU A1028 -2.352 6.670 3.466 1.00 0.00 H new ATOM 0 HB2 LEU A1028 -0.603 9.066 3.322 1.00 0.00 H new ATOM 0 HB3 LEU A1028 -0.435 7.828 2.093 1.00 0.00 H new ATOM 0 HG LEU A1028 -2.847 9.526 2.723 1.00 0.00 H new ATOM 0 HD11 LEU A1028 -2.697 10.097 0.337 1.00 0.00 H new ATOM 0 HD12 LEU A1028 -1.203 10.499 1.217 1.00 0.00 H new ATOM 0 HD13 LEU A1028 -1.264 9.053 0.182 1.00 0.00 H new ATOM 0 HD21 LEU A1028 -4.131 8.212 1.090 1.00 0.00 H new ATOM 0 HD22 LEU A1028 -2.793 7.043 0.985 1.00 0.00 H new ATOM 0 HD23 LEU A1028 -3.676 7.249 2.516 1.00 0.00 H new ATOM 1813 N ALA A1029 0.814 6.600 4.359 1.00 0.00 N ATOM 1814 CA ALA A1029 1.946 5.711 4.556 1.00 0.00 C ATOM 1815 C ALA A1029 1.473 4.440 5.265 1.00 0.00 C ATOM 1816 O ALA A1029 1.886 3.337 4.910 1.00 0.00 O ATOM 1817 CB ALA A1029 3.039 6.442 5.338 1.00 0.00 C ATOM 0 H ALA A1029 1.019 7.589 4.500 1.00 0.00 H new ATOM 0 HA ALA A1029 2.373 5.415 3.598 1.00 0.00 H new ATOM 0 HB1 ALA A1029 3.888 5.775 5.486 1.00 0.00 H new ATOM 0 HB2 ALA A1029 3.361 7.321 4.779 1.00 0.00 H new ATOM 0 HB3 ALA A1029 2.648 6.752 6.307 1.00 0.00 H new ATOM 1823 N VAL A1030 0.614 4.637 6.254 1.00 0.00 N ATOM 1824 CA VAL A1030 0.081 3.520 7.016 1.00 0.00 C ATOM 1825 C VAL A1030 -0.887 2.725 6.137 1.00 0.00 C ATOM 1826 O VAL A1030 -0.771 1.506 6.025 1.00 0.00 O ATOM 1827 CB VAL A1030 -0.563 4.027 8.307 1.00 0.00 C ATOM 1828 CG1 VAL A1030 -1.633 3.054 8.806 1.00 0.00 C ATOM 1829 CG2 VAL A1030 0.493 4.279 9.385 1.00 0.00 C ATOM 0 H VAL A1030 0.274 5.553 6.545 1.00 0.00 H new ATOM 0 HA VAL A1030 0.882 2.843 7.313 1.00 0.00 H new ATOM 0 HB VAL A1030 -1.050 4.977 8.086 1.00 0.00 H new ATOM 0 HG11 VAL A1030 -2.075 3.439 9.725 1.00 0.00 H new ATOM 0 HG12 VAL A1030 -2.409 2.946 8.048 1.00 0.00 H new ATOM 0 HG13 VAL A1030 -1.179 2.082 9.001 1.00 0.00 H new ATOM 0 HG21 VAL A1030 0.008 4.639 10.292 1.00 0.00 H new ATOM 0 HG22 VAL A1030 1.022 3.351 9.600 1.00 0.00 H new ATOM 0 HG23 VAL A1030 1.202 5.027 9.032 1.00 0.00 H new ATOM 1839 N ASP A1031 -1.821 3.449 5.536 1.00 0.00 N ATOM 1840 CA ASP A1031 -2.809 2.826 4.671 1.00 0.00 C ATOM 1841 C ASP A1031 -2.117 1.804 3.767 1.00 0.00 C ATOM 1842 O ASP A1031 -2.425 0.615 3.819 1.00 0.00 O ATOM 1843 CB ASP A1031 -3.490 3.864 3.777 1.00 0.00 C ATOM 1844 CG ASP A1031 -4.910 4.248 4.198 1.00 0.00 C ATOM 1845 OD1 ASP A1031 -5.257 3.950 5.361 1.00 0.00 O ATOM 1846 OD2 ASP A1031 -5.616 4.830 3.346 1.00 0.00 O ATOM 0 H ASP A1031 -1.914 4.460 5.631 1.00 0.00 H new ATOM 0 HA ASP A1031 -3.557 2.348 5.303 1.00 0.00 H new ATOM 0 HB2 ASP A1031 -2.876 4.765 3.759 1.00 0.00 H new ATOM 0 HB3 ASP A1031 -3.521 3.479 2.758 1.00 0.00 H new ATOM 1851 N ALA A1032 -1.194 2.306 2.959 1.00 0.00 N ATOM 1852 CA ALA A1032 -0.455 1.451 2.045 1.00 0.00 C ATOM 1853 C ALA A1032 0.175 0.298 2.828 1.00 0.00 C ATOM 1854 O ALA A1032 0.326 -0.805 2.303 1.00 0.00 O ATOM 1855 CB ALA A1032 0.586 2.285 1.295 1.00 0.00 C ATOM 0 H ALA A1032 -0.941 3.293 2.918 1.00 0.00 H new ATOM 0 HA ALA A1032 -1.123 1.017 1.301 1.00 0.00 H new ATOM 0 HB1 ALA A1032 1.140 1.644 0.609 1.00 0.00 H new ATOM 0 HB2 ALA A1032 0.084 3.071 0.731 1.00 0.00 H new ATOM 0 HB3 ALA A1032 1.276 2.734 2.010 1.00 0.00 H new ATOM 1861 N LYS A1033 0.525 0.591 4.071 1.00 0.00 N ATOM 1862 CA LYS A1033 1.136 -0.408 4.932 1.00 0.00 C ATOM 1863 C LYS A1033 0.095 -1.472 5.288 1.00 0.00 C ATOM 1864 O LYS A1033 0.323 -2.663 5.078 1.00 0.00 O ATOM 1865 CB LYS A1033 1.779 0.255 6.151 1.00 0.00 C ATOM 1866 CG LYS A1033 2.946 -0.581 6.679 1.00 0.00 C ATOM 1867 CD LYS A1033 4.199 -0.375 5.826 1.00 0.00 C ATOM 1868 CE LYS A1033 5.031 -1.657 5.756 1.00 0.00 C ATOM 1869 NZ LYS A1033 6.476 -1.338 5.787 1.00 0.00 N ATOM 0 H LYS A1033 0.397 1.506 4.503 1.00 0.00 H new ATOM 0 HA LYS A1033 1.947 -0.916 4.410 1.00 0.00 H new ATOM 0 HB2 LYS A1033 2.132 1.251 5.883 1.00 0.00 H new ATOM 0 HB3 LYS A1033 1.033 0.382 6.936 1.00 0.00 H new ATOM 0 HG2 LYS A1033 3.156 -0.306 7.713 1.00 0.00 H new ATOM 0 HG3 LYS A1033 2.671 -1.636 6.679 1.00 0.00 H new ATOM 0 HD2 LYS A1033 3.912 -0.068 4.820 1.00 0.00 H new ATOM 0 HD3 LYS A1033 4.801 0.431 6.246 1.00 0.00 H new ATOM 0 HE2 LYS A1033 4.778 -2.308 6.593 1.00 0.00 H new ATOM 0 HE3 LYS A1033 4.792 -2.203 4.843 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 7.027 -2.219 5.739 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 6.716 -0.735 4.975 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 6.702 -0.836 6.670 1.00 0.00 H new ATOM 1883 N ASN A1034 -1.024 -1.005 5.821 1.00 0.00 N ATOM 1884 CA ASN A1034 -2.100 -1.901 6.209 1.00 0.00 C ATOM 1885 C ASN A1034 -2.445 -2.815 5.031 1.00 0.00 C ATOM 1886 O ASN A1034 -2.861 -3.956 5.227 1.00 0.00 O ATOM 1887 CB ASN A1034 -3.359 -1.119 6.586 1.00 0.00 C ATOM 1888 CG ASN A1034 -4.276 -1.955 7.482 1.00 0.00 C ATOM 1889 OD1 ASN A1034 -4.012 -3.108 7.781 1.00 0.00 O ATOM 1890 ND2 ASN A1034 -5.364 -1.311 7.893 1.00 0.00 N ATOM 0 H ASN A1034 -1.209 -0.017 5.993 1.00 0.00 H new ATOM 0 HA ASN A1034 -1.764 -2.479 7.070 1.00 0.00 H new ATOM 0 HB2 ASN A1034 -3.080 -0.200 7.102 1.00 0.00 H new ATOM 0 HB3 ASN A1034 -3.895 -0.827 5.683 1.00 0.00 H new ATOM 0 HD21 ASN A1034 -6.038 -1.782 8.496 1.00 0.00 H new ATOM 0 HD22 ASN A1034 -5.524 -0.346 7.605 1.00 0.00 H new ATOM 1897 N LEU A1035 -2.261 -2.279 3.834 1.00 0.00 N ATOM 1898 CA LEU A1035 -2.549 -3.031 2.624 1.00 0.00 C ATOM 1899 C LEU A1035 -1.702 -4.305 2.609 1.00 0.00 C ATOM 1900 O LEU A1035 -2.239 -5.412 2.595 1.00 0.00 O ATOM 1901 CB LEU A1035 -2.359 -2.151 1.388 1.00 0.00 C ATOM 1902 CG LEU A1035 -2.807 -2.759 0.057 1.00 0.00 C ATOM 1903 CD1 LEU A1035 -3.230 -1.668 -0.929 1.00 0.00 C ATOM 1904 CD2 LEU A1035 -1.722 -3.667 -0.525 1.00 0.00 C ATOM 0 H LEU A1035 -1.916 -1.332 3.676 1.00 0.00 H new ATOM 0 HA LEU A1035 -3.594 -3.341 2.607 1.00 0.00 H new ATOM 0 HB2 LEU A1035 -2.905 -1.220 1.542 1.00 0.00 H new ATOM 0 HB3 LEU A1035 -1.303 -1.892 1.309 1.00 0.00 H new ATOM 0 HG LEU A1035 -3.682 -3.382 0.244 1.00 0.00 H new ATOM 0 HD11 LEU A1035 -3.544 -2.127 -1.867 1.00 0.00 H new ATOM 0 HD12 LEU A1035 -4.059 -1.099 -0.508 1.00 0.00 H new ATOM 0 HD13 LEU A1035 -2.389 -1.000 -1.115 1.00 0.00 H new ATOM 0 HD21 LEU A1035 -2.067 -4.086 -1.471 1.00 0.00 H new ATOM 0 HD22 LEU A1035 -0.815 -3.087 -0.694 1.00 0.00 H new ATOM 0 HD23 LEU A1035 -1.511 -4.476 0.174 1.00 0.00 H new ATOM 1916 N LEU A1036 -0.392 -4.107 2.611 1.00 0.00 N ATOM 1917 CA LEU A1036 0.535 -5.226 2.597 1.00 0.00 C ATOM 1918 C LEU A1036 0.444 -5.975 3.928 1.00 0.00 C ATOM 1919 O LEU A1036 0.470 -7.204 3.956 1.00 0.00 O ATOM 1920 CB LEU A1036 1.947 -4.748 2.255 1.00 0.00 C ATOM 1921 CG LEU A1036 2.688 -5.554 1.185 1.00 0.00 C ATOM 1922 CD1 LEU A1036 2.616 -4.855 -0.174 1.00 0.00 C ATOM 1923 CD2 LEU A1036 4.130 -5.834 1.610 1.00 0.00 C ATOM 0 H LEU A1036 0.050 -3.188 2.622 1.00 0.00 H new ATOM 0 HA LEU A1036 0.265 -5.934 1.814 1.00 0.00 H new ATOM 0 HB2 LEU A1036 1.888 -3.711 1.924 1.00 0.00 H new ATOM 0 HB3 LEU A1036 2.543 -4.758 3.167 1.00 0.00 H new ATOM 0 HG LEU A1036 2.192 -6.519 1.078 1.00 0.00 H new ATOM 0 HD11 LEU A1036 3.150 -5.448 -0.917 1.00 0.00 H new ATOM 0 HD12 LEU A1036 1.573 -4.750 -0.474 1.00 0.00 H new ATOM 0 HD13 LEU A1036 3.073 -3.868 -0.100 1.00 0.00 H new ATOM 0 HD21 LEU A1036 4.634 -6.408 0.832 1.00 0.00 H new ATOM 0 HD22 LEU A1036 4.654 -4.891 1.762 1.00 0.00 H new ATOM 0 HD23 LEU A1036 4.131 -6.404 2.539 1.00 0.00 H new ATOM 1935 N ASP A1037 0.339 -5.202 4.999 1.00 0.00 N ATOM 1936 CA ASP A1037 0.244 -5.776 6.330 1.00 0.00 C ATOM 1937 C ASP A1037 -0.735 -6.951 6.305 1.00 0.00 C ATOM 1938 O ASP A1037 -0.362 -8.081 6.617 1.00 0.00 O ATOM 1939 CB ASP A1037 -0.276 -4.748 7.337 1.00 0.00 C ATOM 1940 CG ASP A1037 0.327 -4.855 8.739 1.00 0.00 C ATOM 1941 OD1 ASP A1037 1.568 -4.986 8.815 1.00 0.00 O ATOM 1942 OD2 ASP A1037 -0.466 -4.802 9.704 1.00 0.00 O ATOM 0 H ASP A1037 0.318 -4.183 4.972 1.00 0.00 H new ATOM 0 HA ASP A1037 1.240 -6.102 6.629 1.00 0.00 H new ATOM 0 HB2 ASP A1037 -0.079 -3.749 6.948 1.00 0.00 H new ATOM 0 HB3 ASP A1037 -1.358 -4.852 7.414 1.00 0.00 H new ATOM 1947 N VAL A1038 -1.969 -6.645 5.931 1.00 0.00 N ATOM 1948 CA VAL A1038 -3.004 -7.661 5.862 1.00 0.00 C ATOM 1949 C VAL A1038 -2.524 -8.812 4.975 1.00 0.00 C ATOM 1950 O VAL A1038 -2.830 -9.974 5.239 1.00 0.00 O ATOM 1951 CB VAL A1038 -4.316 -7.040 5.377 1.00 0.00 C ATOM 1952 CG1 VAL A1038 -4.429 -7.117 3.853 1.00 0.00 C ATOM 1953 CG2 VAL A1038 -5.519 -7.704 6.050 1.00 0.00 C ATOM 0 H VAL A1038 -2.275 -5.707 5.673 1.00 0.00 H new ATOM 0 HA VAL A1038 -3.201 -8.073 6.852 1.00 0.00 H new ATOM 0 HB VAL A1038 -4.313 -5.987 5.660 1.00 0.00 H new ATOM 0 HG11 VAL A1038 -5.370 -6.669 3.535 1.00 0.00 H new ATOM 0 HG12 VAL A1038 -3.598 -6.577 3.399 1.00 0.00 H new ATOM 0 HG13 VAL A1038 -4.399 -8.160 3.538 1.00 0.00 H new ATOM 0 HG21 VAL A1038 -6.438 -7.244 5.688 1.00 0.00 H new ATOM 0 HG22 VAL A1038 -5.527 -8.768 5.813 1.00 0.00 H new ATOM 0 HG23 VAL A1038 -5.449 -7.574 7.130 1.00 0.00 H new ATOM 1963 N ILE A1039 -1.780 -8.449 3.940 1.00 0.00 N ATOM 1964 CA ILE A1039 -1.255 -9.437 3.013 1.00 0.00 C ATOM 1965 C ILE A1039 -0.222 -10.307 3.733 1.00 0.00 C ATOM 1966 O ILE A1039 -0.249 -11.531 3.617 1.00 0.00 O ATOM 1967 CB ILE A1039 -0.714 -8.756 1.754 1.00 0.00 C ATOM 1968 CG1 ILE A1039 -1.818 -8.579 0.710 1.00 0.00 C ATOM 1969 CG2 ILE A1039 0.489 -9.516 1.193 1.00 0.00 C ATOM 1970 CD1 ILE A1039 -1.368 -7.638 -0.410 1.00 0.00 C ATOM 0 H ILE A1039 -1.529 -7.485 3.723 1.00 0.00 H new ATOM 0 HA ILE A1039 -2.050 -10.100 2.673 1.00 0.00 H new ATOM 0 HB ILE A1039 -0.366 -7.760 2.027 1.00 0.00 H new ATOM 0 HG12 ILE A1039 -2.085 -9.549 0.290 1.00 0.00 H new ATOM 0 HG13 ILE A1039 -2.714 -8.181 1.187 1.00 0.00 H new ATOM 0 HG21 ILE A1039 0.854 -9.011 0.299 1.00 0.00 H new ATOM 0 HG22 ILE A1039 1.281 -9.547 1.941 1.00 0.00 H new ATOM 0 HG23 ILE A1039 0.191 -10.533 0.939 1.00 0.00 H new ATOM 0 HD11 ILE A1039 -2.171 -7.529 -1.139 1.00 0.00 H new ATOM 0 HD12 ILE A1039 -1.125 -6.662 0.010 1.00 0.00 H new ATOM 0 HD13 ILE A1039 -0.487 -8.051 -0.900 1.00 0.00 H new ATOM 1982 N ASP A1040 0.663 -9.641 4.460 1.00 0.00 N ATOM 1983 CA ASP A1040 1.702 -10.338 5.198 1.00 0.00 C ATOM 1984 C ASP A1040 1.060 -11.401 6.093 1.00 0.00 C ATOM 1985 O ASP A1040 1.549 -12.526 6.175 1.00 0.00 O ATOM 1986 CB ASP A1040 2.482 -9.375 6.094 1.00 0.00 C ATOM 1987 CG ASP A1040 3.988 -9.321 5.828 1.00 0.00 C ATOM 1988 OD1 ASP A1040 4.629 -10.383 5.979 1.00 0.00 O ATOM 1989 OD2 ASP A1040 4.464 -8.219 5.481 1.00 0.00 O ATOM 0 H ASP A1040 0.682 -8.625 4.554 1.00 0.00 H new ATOM 0 HA ASP A1040 2.382 -10.790 4.476 1.00 0.00 H new ATOM 0 HB2 ASP A1040 2.070 -8.373 5.971 1.00 0.00 H new ATOM 0 HB3 ASP A1040 2.322 -9.660 7.134 1.00 0.00 H new ATOM 1994 N GLN A1041 -0.026 -11.005 6.741 1.00 0.00 N ATOM 1995 CA GLN A1041 -0.740 -11.910 7.627 1.00 0.00 C ATOM 1996 C GLN A1041 -1.396 -13.033 6.822 1.00 0.00 C ATOM 1997 O GLN A1041 -1.696 -14.096 7.363 1.00 0.00 O ATOM 1998 CB GLN A1041 -1.777 -11.155 8.461 1.00 0.00 C ATOM 1999 CG GLN A1041 -1.553 -11.389 9.956 1.00 0.00 C ATOM 2000 CD GLN A1041 -2.751 -10.900 10.773 1.00 0.00 C ATOM 2001 OE1 GLN A1041 -3.247 -11.574 11.660 1.00 0.00 O ATOM 2002 NE2 GLN A1041 -3.185 -9.692 10.425 1.00 0.00 N ATOM 0 H GLN A1041 -0.429 -10.071 6.670 1.00 0.00 H new ATOM 0 HA GLN A1041 -0.022 -12.355 8.316 1.00 0.00 H new ATOM 0 HB2 GLN A1041 -1.718 -10.089 8.243 1.00 0.00 H new ATOM 0 HB3 GLN A1041 -2.779 -11.482 8.184 1.00 0.00 H new ATOM 0 HG2 GLN A1041 -1.391 -12.451 10.141 1.00 0.00 H new ATOM 0 HG3 GLN A1041 -0.651 -10.868 10.278 1.00 0.00 H new ATOM 0 HE21 GLN A1041 -2.723 -9.181 9.672 1.00 0.00 H new ATOM 0 HE22 GLN A1041 -3.980 -9.276 10.911 1.00 0.00 H new ATOM 2011 N ALA A1042 -1.599 -12.760 5.541 1.00 0.00 N ATOM 2012 CA ALA A1042 -2.214 -13.734 4.656 1.00 0.00 C ATOM 2013 C ALA A1042 -1.130 -14.643 4.074 1.00 0.00 C ATOM 2014 O ALA A1042 -1.179 -15.861 4.243 1.00 0.00 O ATOM 2015 CB ALA A1042 -3.010 -13.008 3.571 1.00 0.00 C ATOM 0 H ALA A1042 -1.348 -11.878 5.095 1.00 0.00 H new ATOM 0 HA ALA A1042 -2.913 -14.364 5.206 1.00 0.00 H new ATOM 0 HB1 ALA A1042 -3.471 -13.739 2.907 1.00 0.00 H new ATOM 0 HB2 ALA A1042 -3.786 -12.399 4.035 1.00 0.00 H new ATOM 0 HB3 ALA A1042 -2.341 -12.367 2.996 1.00 0.00 H new ATOM 2021 N ARG A1043 -0.176 -14.017 3.400 1.00 0.00 N ATOM 2022 CA ARG A1043 0.918 -14.754 2.792 1.00 0.00 C ATOM 2023 C ARG A1043 1.364 -15.896 3.708 1.00 0.00 C ATOM 2024 O ARG A1043 1.707 -16.978 3.236 1.00 0.00 O ATOM 2025 CB ARG A1043 2.111 -13.838 2.512 1.00 0.00 C ATOM 2026 CG ARG A1043 3.253 -14.612 1.850 1.00 0.00 C ATOM 2027 CD ARG A1043 4.482 -13.720 1.660 1.00 0.00 C ATOM 2028 NE ARG A1043 5.396 -13.866 2.814 1.00 0.00 N ATOM 2029 CZ ARG A1043 6.696 -13.540 2.789 1.00 0.00 C ATOM 2030 NH1 ARG A1043 7.241 -13.047 1.668 1.00 0.00 N ATOM 2031 NH2 ARG A1043 7.450 -13.707 3.884 1.00 0.00 N ATOM 0 H ARG A1043 -0.138 -13.007 3.262 1.00 0.00 H new ATOM 0 HA ARG A1043 0.558 -15.162 1.847 1.00 0.00 H new ATOM 0 HB2 ARG A1043 1.800 -13.017 1.865 1.00 0.00 H new ATOM 0 HB3 ARG A1043 2.460 -13.394 3.444 1.00 0.00 H new ATOM 0 HG2 ARG A1043 3.516 -15.474 2.463 1.00 0.00 H new ATOM 0 HG3 ARG A1043 2.925 -14.996 0.884 1.00 0.00 H new ATOM 0 HD2 ARG A1043 4.999 -13.991 0.739 1.00 0.00 H new ATOM 0 HD3 ARG A1043 4.174 -12.679 1.559 1.00 0.00 H new ATOM 0 HE ARG A1043 5.013 -14.238 3.683 1.00 0.00 H new ATOM 0 HH11 ARG A1043 6.667 -12.920 0.835 1.00 0.00 H new ATOM 0 HH12 ARG A1043 8.230 -12.799 1.648 1.00 0.00 H new ATOM 0 HH21 ARG A1043 7.035 -14.082 4.737 1.00 0.00 H new ATOM 0 HH22 ARG A1043 8.439 -13.459 3.865 1.00 0.00 H new ATOM 2045 N LEU A1044 1.343 -15.614 5.003 1.00 0.00 N ATOM 2046 CA LEU A1044 1.741 -16.604 5.990 1.00 0.00 C ATOM 2047 C LEU A1044 0.633 -17.650 6.132 1.00 0.00 C ATOM 2048 O LEU A1044 0.901 -18.850 6.111 1.00 0.00 O ATOM 2049 CB LEU A1044 2.118 -15.924 7.308 1.00 0.00 C ATOM 2050 CG LEU A1044 1.011 -15.115 7.986 1.00 0.00 C ATOM 2051 CD1 LEU A1044 0.070 -16.028 8.776 1.00 0.00 C ATOM 2052 CD2 LEU A1044 1.599 -14.005 8.860 1.00 0.00 C ATOM 0 H LEU A1044 1.057 -14.715 5.391 1.00 0.00 H new ATOM 0 HA LEU A1044 2.637 -17.131 5.662 1.00 0.00 H new ATOM 0 HB2 LEU A1044 2.459 -16.690 8.004 1.00 0.00 H new ATOM 0 HB3 LEU A1044 2.964 -15.262 7.123 1.00 0.00 H new ATOM 0 HG LEU A1044 0.417 -14.633 7.210 1.00 0.00 H new ATOM 0 HD11 LEU A1044 -0.708 -15.428 9.248 1.00 0.00 H new ATOM 0 HD12 LEU A1044 -0.389 -16.750 8.100 1.00 0.00 H new ATOM 0 HD13 LEU A1044 0.636 -16.557 9.543 1.00 0.00 H new ATOM 0 HD21 LEU A1044 0.790 -13.445 9.330 1.00 0.00 H new ATOM 0 HD22 LEU A1044 2.232 -14.445 9.631 1.00 0.00 H new ATOM 0 HD23 LEU A1044 2.194 -13.333 8.242 1.00 0.00 H new ATOM 2064 N LYS A1045 -0.588 -17.156 6.274 1.00 0.00 N ATOM 2065 CA LYS A1045 -1.738 -18.033 6.420 1.00 0.00 C ATOM 2066 C LYS A1045 -1.572 -19.241 5.497 1.00 0.00 C ATOM 2067 O LYS A1045 -2.050 -20.332 5.804 1.00 0.00 O ATOM 2068 CB LYS A1045 -3.036 -17.257 6.191 1.00 0.00 C ATOM 2069 CG LYS A1045 -4.249 -18.187 6.253 1.00 0.00 C ATOM 2070 CD LYS A1045 -4.581 -18.748 4.868 1.00 0.00 C ATOM 2071 CE LYS A1045 -5.992 -19.339 4.840 1.00 0.00 C ATOM 2072 NZ LYS A1045 -5.937 -20.816 4.915 1.00 0.00 N ATOM 0 H LYS A1045 -0.806 -16.160 6.291 1.00 0.00 H new ATOM 0 HA LYS A1045 -1.799 -18.416 7.439 1.00 0.00 H new ATOM 0 HB2 LYS A1045 -3.134 -16.475 6.944 1.00 0.00 H new ATOM 0 HB3 LYS A1045 -3.002 -16.762 5.220 1.00 0.00 H new ATOM 0 HG2 LYS A1045 -4.048 -19.007 6.943 1.00 0.00 H new ATOM 0 HG3 LYS A1045 -5.109 -17.644 6.645 1.00 0.00 H new ATOM 0 HD2 LYS A1045 -4.499 -17.957 4.122 1.00 0.00 H new ATOM 0 HD3 LYS A1045 -3.856 -19.516 4.599 1.00 0.00 H new ATOM 0 HE2 LYS A1045 -6.573 -18.948 5.675 1.00 0.00 H new ATOM 0 HE3 LYS A1045 -6.502 -19.034 3.926 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 -6.903 -21.201 4.895 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 -5.400 -21.185 4.104 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 -5.469 -21.102 5.799 1.00 0.00 H new ATOM 2086 N MET A1046 -0.893 -19.006 4.383 1.00 0.00 N ATOM 2087 CA MET A1046 -0.659 -20.062 3.413 1.00 0.00 C ATOM 2088 C MET A1046 0.492 -20.967 3.855 1.00 0.00 C ATOM 2089 O MET A1046 0.332 -22.184 3.944 1.00 0.00 O ATOM 2090 CB MET A1046 -0.328 -19.442 2.053 1.00 0.00 C ATOM 2091 CG MET A1046 0.231 -20.493 1.093 1.00 0.00 C ATOM 2092 SD MET A1046 1.936 -20.127 0.713 1.00 0.00 S ATOM 2093 CE MET A1046 1.768 -18.454 0.115 1.00 0.00 C ATOM 0 H MET A1046 -0.498 -18.100 4.131 1.00 0.00 H new ATOM 0 HA MET A1046 -1.563 -20.666 3.337 1.00 0.00 H new ATOM 0 HB2 MET A1046 -1.225 -18.994 1.625 1.00 0.00 H new ATOM 0 HB3 MET A1046 0.398 -18.639 2.182 1.00 0.00 H new ATOM 0 HG2 MET A1046 0.154 -21.484 1.541 1.00 0.00 H new ATOM 0 HG3 MET A1046 -0.359 -20.511 0.177 1.00 0.00 H new ATOM 0 HE1 MET A1046 2.436 -18.302 -0.733 1.00 0.00 H new ATOM 0 HE2 MET A1046 0.738 -18.281 -0.198 1.00 0.00 H new ATOM 0 HE3 MET A1046 2.027 -17.755 0.911 1.00 0.00 H new ATOM 2103 N ILE A1047 1.628 -20.339 4.120 1.00 0.00 N ATOM 2104 CA ILE A1047 2.806 -21.073 4.551 1.00 0.00 C ATOM 2105 C ILE A1047 2.490 -21.820 5.848 1.00 0.00 C ATOM 2106 O ILE A1047 2.364 -23.043 5.849 1.00 0.00 O ATOM 2107 CB ILE A1047 4.011 -20.136 4.659 1.00 0.00 C ATOM 2108 CG1 ILE A1047 4.494 -19.702 3.273 1.00 0.00 C ATOM 2109 CG2 ILE A1047 5.132 -20.776 5.481 1.00 0.00 C ATOM 2110 CD1 ILE A1047 4.408 -18.183 3.114 1.00 0.00 C ATOM 0 H ILE A1047 1.758 -19.330 4.045 1.00 0.00 H new ATOM 0 HA ILE A1047 3.080 -21.823 3.809 1.00 0.00 H new ATOM 0 HB ILE A1047 3.697 -19.236 5.188 1.00 0.00 H new ATOM 0 HG12 ILE A1047 5.523 -20.029 3.123 1.00 0.00 H new ATOM 0 HG13 ILE A1047 3.891 -20.186 2.505 1.00 0.00 H new ATOM 0 HG21 ILE A1047 5.976 -20.089 5.542 1.00 0.00 H new ATOM 0 HG22 ILE A1047 4.768 -20.994 6.485 1.00 0.00 H new ATOM 0 HG23 ILE A1047 5.451 -21.702 5.002 1.00 0.00 H new ATOM 0 HD11 ILE A1047 4.757 -17.901 2.121 1.00 0.00 H new ATOM 0 HD12 ILE A1047 3.374 -17.862 3.240 1.00 0.00 H new ATOM 0 HD13 ILE A1047 5.032 -17.702 3.868 1.00 0.00 H new ATOM 2122 N SER A1048 2.372 -21.052 6.922 1.00 0.00 N ATOM 2123 CA SER A1048 2.073 -21.626 8.223 1.00 0.00 C ATOM 2124 C SER A1048 0.625 -22.119 8.257 1.00 0.00 C ATOM 2125 O SER A1048 -0.263 -21.416 8.739 1.00 0.00 O ATOM 2126 CB SER A1048 2.315 -20.611 9.341 1.00 0.00 C ATOM 2127 OG SER A1048 3.669 -20.620 9.787 1.00 0.00 O ATOM 0 H SER A1048 2.478 -20.038 6.917 1.00 0.00 H new ATOM 0 HA SER A1048 2.741 -22.471 8.386 1.00 0.00 H new ATOM 0 HB2 SER A1048 2.057 -19.613 8.987 1.00 0.00 H new ATOM 0 HB3 SER A1048 1.655 -20.832 10.180 1.00 0.00 H new ATOM 0 HG SER A1048 3.783 -19.957 10.500 1.00 0.00 H new ATOM 2133 N GLN A1049 0.430 -23.323 7.741 1.00 0.00 N ATOM 2134 CA GLN A1049 -0.895 -23.918 7.706 1.00 0.00 C ATOM 2135 C GLN A1049 -0.806 -25.388 7.293 1.00 0.00 C ATOM 2136 O GLN A1049 -1.196 -26.275 8.051 1.00 0.00 O ATOM 2137 CB GLN A1049 -1.821 -23.140 6.770 1.00 0.00 C ATOM 2138 CG GLN A1049 -3.015 -22.563 7.534 1.00 0.00 C ATOM 2139 CD GLN A1049 -4.225 -23.495 7.446 1.00 0.00 C ATOM 2140 OE1 GLN A1049 -4.769 -23.749 6.384 1.00 0.00 O ATOM 2141 NE2 GLN A1049 -4.614 -23.989 8.618 1.00 0.00 N ATOM 0 H GLN A1049 1.168 -23.904 7.343 1.00 0.00 H new ATOM 0 HA GLN A1049 -1.321 -23.868 8.708 1.00 0.00 H new ATOM 0 HB2 GLN A1049 -1.266 -22.333 6.292 1.00 0.00 H new ATOM 0 HB3 GLN A1049 -2.176 -23.797 5.976 1.00 0.00 H new ATOM 0 HG2 GLN A1049 -2.744 -22.411 8.579 1.00 0.00 H new ATOM 0 HG3 GLN A1049 -3.274 -21.586 7.127 1.00 0.00 H new ATOM 0 HE21 GLN A1049 -4.114 -23.735 9.470 1.00 0.00 H new ATOM 0 HE22 GLN A1049 -5.413 -24.622 8.665 1.00 0.00 H new ATOM 2150 N SER A1050 -0.291 -25.602 6.091 1.00 0.00 N ATOM 2151 CA SER A1050 -0.146 -26.949 5.567 1.00 0.00 C ATOM 2152 C SER A1050 1.335 -27.280 5.374 1.00 0.00 C ATOM 2153 O SER A1050 1.854 -28.206 5.995 1.00 0.00 O ATOM 2154 CB SER A1050 -0.902 -27.112 4.247 1.00 0.00 C ATOM 2155 OG SER A1050 -1.340 -28.452 4.043 1.00 0.00 O ATOM 0 H SER A1050 0.031 -24.864 5.465 1.00 0.00 H new ATOM 0 HA SER A1050 -0.576 -27.643 6.289 1.00 0.00 H new ATOM 0 HB2 SER A1050 -1.763 -26.444 4.238 1.00 0.00 H new ATOM 0 HB3 SER A1050 -0.257 -26.812 3.421 1.00 0.00 H new ATOM 0 HG SER A1050 -1.820 -28.513 3.191 1.00 0.00 H new ATOM 2161 N ARG A1051 1.974 -26.503 4.512 1.00 0.00 N ATOM 2162 CA ARG A1051 3.386 -26.702 4.229 1.00 0.00 C ATOM 2163 C ARG A1051 4.188 -26.732 5.531 1.00 0.00 C ATOM 2164 O ARG A1051 3.849 -26.041 6.491 1.00 0.00 O ATOM 2165 CB ARG A1051 3.929 -25.590 3.330 1.00 0.00 C ATOM 2166 CG ARG A1051 3.963 -26.036 1.867 1.00 0.00 C ATOM 2167 CD ARG A1051 5.268 -25.605 1.192 1.00 0.00 C ATOM 2168 NE ARG A1051 4.999 -24.531 0.210 1.00 0.00 N ATOM 2169 CZ ARG A1051 4.856 -23.238 0.531 1.00 0.00 C ATOM 2170 NH1 ARG A1051 4.955 -22.851 1.810 1.00 0.00 N ATOM 2171 NH2 ARG A1051 4.614 -22.333 -0.426 1.00 0.00 N ATOM 0 H ARG A1051 1.540 -25.735 4.000 1.00 0.00 H new ATOM 0 HA ARG A1051 3.490 -27.656 3.711 1.00 0.00 H new ATOM 0 HB2 ARG A1051 3.306 -24.701 3.429 1.00 0.00 H new ATOM 0 HB3 ARG A1051 4.933 -25.314 3.653 1.00 0.00 H new ATOM 0 HG2 ARG A1051 3.861 -27.120 1.811 1.00 0.00 H new ATOM 0 HG3 ARG A1051 3.115 -25.608 1.333 1.00 0.00 H new ATOM 0 HD2 ARG A1051 5.976 -25.254 1.942 1.00 0.00 H new ATOM 0 HD3 ARG A1051 5.728 -26.458 0.693 1.00 0.00 H new ATOM 0 HE ARG A1051 4.917 -24.791 -0.773 1.00 0.00 H new ATOM 0 HH11 ARG A1051 5.139 -23.541 2.539 1.00 0.00 H new ATOM 0 HH12 ARG A1051 4.846 -21.867 2.055 1.00 0.00 H new ATOM 0 HH21 ARG A1051 4.538 -22.628 -1.399 1.00 0.00 H new ATOM 0 HH22 ARG A1051 4.505 -21.349 -0.181 1.00 0.00 H new ATOM 2185 N PRO A1052 5.266 -27.562 5.523 1.00 0.00 N ATOM 2186 CA PRO A1052 6.120 -27.692 6.692 1.00 0.00 C ATOM 2187 C PRO A1052 7.021 -26.466 6.851 1.00 0.00 C ATOM 2188 O PRO A1052 6.982 -25.792 7.879 1.00 0.00 O ATOM 2189 CB PRO A1052 6.899 -28.978 6.469 1.00 0.00 C ATOM 2190 CG PRO A1052 6.796 -29.275 4.981 1.00 0.00 C ATOM 2191 CD PRO A1052 5.698 -28.396 4.405 1.00 0.00 C ATOM 0 HA PRO A1052 5.555 -27.741 7.623 1.00 0.00 H new ATOM 0 HB2 PRO A1052 7.939 -28.862 6.773 1.00 0.00 H new ATOM 0 HB3 PRO A1052 6.483 -29.794 7.060 1.00 0.00 H new ATOM 0 HG2 PRO A1052 7.746 -29.074 4.485 1.00 0.00 H new ATOM 0 HG3 PRO A1052 6.567 -30.328 4.817 1.00 0.00 H new ATOM 0 HD2 PRO A1052 6.069 -27.790 3.579 1.00 0.00 H new ATOM 0 HD3 PRO A1052 4.874 -28.995 4.016 1.00 0.00 H new ATOM 2199 N HIS A1053 7.812 -26.215 5.818 1.00 0.00 N ATOM 2200 CA HIS A1053 8.722 -25.083 5.831 1.00 0.00 C ATOM 2201 C HIS A1053 7.941 -23.794 5.567 1.00 0.00 C ATOM 2202 O HIS A1053 6.891 -23.567 6.166 1.00 0.00 O ATOM 2203 CB HIS A1053 9.867 -25.295 4.838 1.00 0.00 C ATOM 2204 CG HIS A1053 11.056 -26.023 5.419 1.00 0.00 C ATOM 2205 ND1 HIS A1053 12.055 -25.382 6.129 1.00 0.00 N ATOM 2206 CD2 HIS A1053 11.394 -27.345 5.387 1.00 0.00 C ATOM 2207 CE1 HIS A1053 12.949 -26.285 6.503 1.00 0.00 C ATOM 2208 NE2 HIS A1053 12.538 -27.501 6.042 1.00 0.00 N ATOM 0 H HIS A1053 7.841 -26.776 4.967 1.00 0.00 H new ATOM 0 HA HIS A1053 9.183 -24.994 6.815 1.00 0.00 H new ATOM 0 HB2 HIS A1053 9.493 -25.856 3.982 1.00 0.00 H new ATOM 0 HB3 HIS A1053 10.195 -24.325 4.464 1.00 0.00 H new ATOM 0 HD2 HIS A1053 10.827 -28.131 4.910 1.00 0.00 H new ATOM 0 HE1 HIS A1053 13.846 -26.092 7.073 1.00 0.00 H new ATOM 0 HE2 HIS A1053 13.029 -28.385 6.178 1.00 0.00 H new TER 2216 HIS A1053