USER MOD reduce.3.24.130724 H: found=0, std=0, add=1002, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1003 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: A1025 LYS NZ :NH3+ 168:sc= 0.728 (180deg=-0.673) USER MOD Set 1.2: A1026 ASN : amide:sc= 0.902 K(o=1.6,f=-8.3!) USER MOD Set 2.1: A1019 GLN : amide:sc= -0.229 K(o=0.74,f=-0.066) USER MOD Set 2.2: A1023 CYS SG : rot 77:sc= 0.973 USER MOD Set 3.1: A1014 GLN : amide:sc= -0.988 K(o=-0.99,f=0) USER MOD Set 3.2: A1018 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 962 GLN : amide:sc= 0.213 K(o=1.4,f=-2.8!) USER MOD Set 4.2: A 992 SER OG : rot -97:sc= 1.17 USER MOD Set 5.1: A 949 GLN : amide:sc= 0 K(o=-2.2,f=-5.7) USER MOD Set 5.2: A 957 LYS NZ :NH3+ 134:sc= -2.16! (180deg=-2.54!) USER MOD Set 6.1: A 936 GLN : amide:sc= -0.919 K(o=-3.2,f=-1.2) USER MOD Set 6.2: A 956 CYS SG : rot -110:sc= -2.33! USER MOD Single : A 912 THR OG1 : rot 180:sc= -0.401 USER MOD Single : A 915 GLN : amide:sc= -0.0487 K(o=-0.049,f=-8!) USER MOD Single : A 919 HIS : no HD1:sc= -0.782 K(o=-0.78,f=0.22) USER MOD Single : A 922 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 923 GLN : amide:sc= -0.0316 X(o=-0.032,f=-0.53) USER MOD Single : A 927 SER OG : rot 78:sc= 0.306 USER MOD Single : A 929 THR OG1 : rot 82:sc= 1.2 USER MOD Single : A 930 GLN : amide:sc= -0.361 K(o=-0.36,f=-2.7!) USER MOD Single : A 931 THR OG1 : rot 68:sc= -0.0182 USER MOD Single : A 937 HIS : no HD1:sc= -0.011 X(o=-0.011,f=0) USER MOD Single : A 940 SER OG : rot -1:sc= 0.362 USER MOD Single : A 943 LYS NZ :NH3+ 169:sc= -0.0805 (180deg=-0.412) USER MOD Single : A 945 SER OG : rot 5:sc= 0.574 USER MOD Single : A 954 GLN : amide:sc= -0.0131 K(o=-0.013,f=-1.5) USER MOD Single : A 955 SER OG : rot 180:sc= 0 USER MOD Single : A 968 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 973 SER OG : rot -23:sc= 0.0922 USER MOD Single : A 974 GLN : amide:sc= -0.676 X(o=-0.68,f=-1.1) USER MOD Single : A 976 GLN : amide:sc=-0.00633 K(o=-0.0063,f=-1.4) USER MOD Single : A 979 SER OG : rot 180:sc= 0 USER MOD Single : A 981 SER OG : rot 180:sc= 0 USER MOD Single : A 983 GLN : amide:sc= -0.162 K(o=-0.16,f=-2) USER MOD Single : A 990 SER OG : rot 86:sc= 1.19 USER MOD Single : A 991 GLN : amide:sc=-0.00361 K(o=-0.0036,f=-0.76) USER MOD Single : A 995 GLN : amide:sc= -1.4 K(o=-1.4,f=-6.4!) USER MOD Single : A 999 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1000 MET CE :methyl -163:sc= -1.3 (180deg=-1.57) USER MOD Single : A1005 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0261) USER MOD Single : A1007 SER OG : rot 99:sc= 1.25 USER MOD Single : A1010 THR OG1 : rot 10:sc= 0.0375 USER MOD Single : A1012 GLN : amide:sc= -0.0625 X(o=-0.062,f=-0.56) USER MOD Single : A1016 SER OG : rot 180:sc= 0 USER MOD Single : A1021 SER OG : rot 180:sc= 0 USER MOD Single : A1022 GLN : amide:sc= -2.06! C(o=-2.1!,f=-7.1!) USER MOD Single : A1029 THR OG1 : rot 180:sc= 0 USER MOD Single : A1036 THR OG1 : rot 87:sc= 1.23 USER MOD Single : A1039 GLN : amide:sc= -5.76! K(o=-5.8!,f=-1.2) USER MOD Single : A1040 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0345) USER MOD Single : A1042 GLN : amide:sc= -0.864! K(o=-0.86!,f=-0.084) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 907 6.972 11.419 -0.323 1.00 0.00 N ATOM 2 CA GLY A 907 8.450 11.455 -0.443 1.00 0.00 C ATOM 3 C GLY A 907 9.074 12.407 0.556 1.00 0.00 C ATOM 4 O GLY A 907 8.778 13.605 0.551 1.00 0.00 O ATOM 0 HA2 GLY A 907 8.851 10.453 -0.290 1.00 0.00 H new ATOM 0 HA3 GLY A 907 8.725 11.757 -1.453 1.00 0.00 H new ATOM 10 N ILE A 908 9.936 11.883 1.417 1.00 0.00 N ATOM 11 CA ILE A 908 10.568 12.695 2.448 1.00 0.00 C ATOM 12 C ILE A 908 12.095 12.575 2.400 1.00 0.00 C ATOM 13 O ILE A 908 12.660 11.556 2.793 1.00 0.00 O ATOM 14 CB ILE A 908 10.042 12.331 3.859 1.00 0.00 C ATOM 15 CG1 ILE A 908 10.834 13.079 4.942 1.00 0.00 C ATOM 16 CG2 ILE A 908 10.085 10.825 4.090 1.00 0.00 C ATOM 17 CD1 ILE A 908 10.337 12.824 6.350 1.00 0.00 C ATOM 0 H ILE A 908 10.213 10.901 1.422 1.00 0.00 H new ATOM 0 HA ILE A 908 10.302 13.732 2.244 1.00 0.00 H new ATOM 0 HB ILE A 908 9.000 12.645 3.923 1.00 0.00 H new ATOM 0 HG12 ILE A 908 11.882 12.787 4.879 1.00 0.00 H new ATOM 0 HG13 ILE A 908 10.788 14.149 4.739 1.00 0.00 H new ATOM 0 HG21 ILE A 908 9.710 10.599 5.088 1.00 0.00 H new ATOM 0 HG22 ILE A 908 9.463 10.325 3.347 1.00 0.00 H new ATOM 0 HG23 ILE A 908 11.112 10.472 4.000 1.00 0.00 H new ATOM 0 HD11 ILE A 908 10.946 13.386 7.058 1.00 0.00 H new ATOM 0 HD12 ILE A 908 9.298 13.142 6.432 1.00 0.00 H new ATOM 0 HD13 ILE A 908 10.409 11.760 6.574 1.00 0.00 H new ATOM 29 N ASP A 909 12.733 13.631 1.891 1.00 0.00 N ATOM 30 CA ASP A 909 14.198 13.747 1.842 1.00 0.00 C ATOM 31 C ASP A 909 14.853 12.625 1.039 1.00 0.00 C ATOM 32 O ASP A 909 14.975 11.499 1.510 1.00 0.00 O ATOM 33 CB ASP A 909 14.794 13.790 3.251 1.00 0.00 C ATOM 34 CG ASP A 909 16.312 13.859 3.235 1.00 0.00 C ATOM 35 OD1 ASP A 909 16.867 14.787 2.613 1.00 0.00 O ATOM 36 OD2 ASP A 909 16.959 12.980 3.847 1.00 0.00 O ATOM 0 H ASP A 909 12.247 14.437 1.498 1.00 0.00 H new ATOM 0 HA ASP A 909 14.411 14.686 1.330 1.00 0.00 H new ATOM 0 HB2 ASP A 909 14.399 14.655 3.784 1.00 0.00 H new ATOM 0 HB3 ASP A 909 14.479 12.905 3.803 1.00 0.00 H new ATOM 41 N PRO A 910 15.280 12.920 -0.194 1.00 0.00 N ATOM 42 CA PRO A 910 16.023 11.971 -1.020 1.00 0.00 C ATOM 43 C PRO A 910 17.431 11.737 -0.474 1.00 0.00 C ATOM 44 O PRO A 910 18.372 12.455 -0.821 1.00 0.00 O ATOM 45 CB PRO A 910 16.082 12.643 -2.401 1.00 0.00 C ATOM 46 CG PRO A 910 15.124 13.787 -2.333 1.00 0.00 C ATOM 47 CD PRO A 910 15.064 14.191 -0.889 1.00 0.00 C ATOM 0 HA PRO A 910 15.549 10.990 -1.045 1.00 0.00 H new ATOM 0 HB2 PRO A 910 17.091 12.989 -2.625 1.00 0.00 H new ATOM 0 HB3 PRO A 910 15.802 11.944 -3.189 1.00 0.00 H new ATOM 0 HG2 PRO A 910 15.461 14.615 -2.956 1.00 0.00 H new ATOM 0 HG3 PRO A 910 14.139 13.494 -2.697 1.00 0.00 H new ATOM 0 HD2 PRO A 910 15.831 14.924 -0.641 1.00 0.00 H new ATOM 0 HD3 PRO A 910 14.103 14.636 -0.632 1.00 0.00 H new ATOM 55 N PHE A 911 17.556 10.767 0.418 1.00 0.00 N ATOM 56 CA PHE A 911 18.842 10.440 1.019 1.00 0.00 C ATOM 57 C PHE A 911 19.516 9.310 0.244 1.00 0.00 C ATOM 58 O PHE A 911 20.605 9.483 -0.301 1.00 0.00 O ATOM 59 CB PHE A 911 18.651 10.053 2.489 1.00 0.00 C ATOM 60 CG PHE A 911 19.931 9.979 3.277 1.00 0.00 C ATOM 61 CD1 PHE A 911 20.517 11.126 3.784 1.00 0.00 C ATOM 62 CD2 PHE A 911 20.547 8.759 3.505 1.00 0.00 C ATOM 63 CE1 PHE A 911 21.695 11.061 4.504 1.00 0.00 C ATOM 64 CE2 PHE A 911 21.726 8.687 4.223 1.00 0.00 C ATOM 65 CZ PHE A 911 22.288 9.850 4.742 1.00 0.00 C ATOM 0 H PHE A 911 16.780 10.190 0.743 1.00 0.00 H new ATOM 0 HA PHE A 911 19.488 11.317 0.974 1.00 0.00 H new ATOM 0 HB2 PHE A 911 17.988 10.778 2.961 1.00 0.00 H new ATOM 0 HB3 PHE A 911 18.151 9.086 2.537 1.00 0.00 H new ATOM 0 HD1 PHE A 911 20.048 12.084 3.615 1.00 0.00 H new ATOM 0 HD2 PHE A 911 20.101 7.855 3.118 1.00 0.00 H new ATOM 0 HE1 PHE A 911 22.148 11.967 4.879 1.00 0.00 H new ATOM 0 HE2 PHE A 911 22.208 7.734 4.380 1.00 0.00 H new ATOM 0 HZ PHE A 911 23.191 9.797 5.332 1.00 0.00 H new ATOM 75 N THR A 912 18.856 8.164 0.178 1.00 0.00 N ATOM 76 CA THR A 912 19.360 7.033 -0.590 1.00 0.00 C ATOM 77 C THR A 912 18.200 6.193 -1.113 1.00 0.00 C ATOM 78 O THR A 912 17.044 6.403 -0.731 1.00 0.00 O ATOM 79 CB THR A 912 20.360 6.162 0.223 1.00 0.00 C ATOM 80 OG1 THR A 912 20.626 4.920 -0.442 1.00 0.00 O ATOM 81 CG2 THR A 912 19.856 5.890 1.626 1.00 0.00 C ATOM 0 H THR A 912 17.967 7.991 0.648 1.00 0.00 H new ATOM 0 HA THR A 912 19.916 7.434 -1.437 1.00 0.00 H new ATOM 0 HB THR A 912 21.286 6.732 0.294 1.00 0.00 H new ATOM 0 HG1 THR A 912 21.259 4.393 0.090 1.00 0.00 H new ATOM 0 HG21 THR A 912 20.583 5.279 2.161 1.00 0.00 H new ATOM 0 HG22 THR A 912 19.718 6.834 2.152 1.00 0.00 H new ATOM 0 HG23 THR A 912 18.904 5.361 1.575 1.00 0.00 H new ATOM 89 N LEU A 913 18.511 5.256 -1.994 1.00 0.00 N ATOM 90 CA LEU A 913 17.502 4.457 -2.673 1.00 0.00 C ATOM 91 C LEU A 913 16.700 3.620 -1.685 1.00 0.00 C ATOM 92 O LEU A 913 15.472 3.564 -1.760 1.00 0.00 O ATOM 93 CB LEU A 913 18.164 3.557 -3.718 1.00 0.00 C ATOM 94 CG LEU A 913 18.964 4.298 -4.792 1.00 0.00 C ATOM 95 CD1 LEU A 913 19.663 3.318 -5.714 1.00 0.00 C ATOM 96 CD2 LEU A 913 18.057 5.223 -5.588 1.00 0.00 C ATOM 0 H LEU A 913 19.469 5.027 -2.259 1.00 0.00 H new ATOM 0 HA LEU A 913 16.810 5.136 -3.172 1.00 0.00 H new ATOM 0 HB2 LEU A 913 18.828 2.859 -3.207 1.00 0.00 H new ATOM 0 HB3 LEU A 913 17.392 2.963 -4.206 1.00 0.00 H new ATOM 0 HG LEU A 913 19.724 4.901 -4.296 1.00 0.00 H new ATOM 0 HD11 LEU A 913 20.225 3.867 -6.469 1.00 0.00 H new ATOM 0 HD12 LEU A 913 20.345 2.696 -5.134 1.00 0.00 H new ATOM 0 HD13 LEU A 913 18.922 2.685 -6.202 1.00 0.00 H new ATOM 0 HD21 LEU A 913 18.642 5.742 -6.347 1.00 0.00 H new ATOM 0 HD22 LEU A 913 17.274 4.638 -6.071 1.00 0.00 H new ATOM 0 HD23 LEU A 913 17.604 5.953 -4.918 1.00 0.00 H new ATOM 108 N VAL A 914 17.392 2.994 -0.739 1.00 0.00 N ATOM 109 CA VAL A 914 16.729 2.143 0.245 1.00 0.00 C ATOM 110 C VAL A 914 15.985 2.979 1.284 1.00 0.00 C ATOM 111 O VAL A 914 14.984 2.543 1.846 1.00 0.00 O ATOM 112 CB VAL A 914 17.722 1.197 0.953 1.00 0.00 C ATOM 113 CG1 VAL A 914 18.320 0.218 -0.044 1.00 0.00 C ATOM 114 CG2 VAL A 914 18.822 1.978 1.656 1.00 0.00 C ATOM 0 H VAL A 914 18.404 3.058 -0.632 1.00 0.00 H new ATOM 0 HA VAL A 914 16.010 1.534 -0.303 1.00 0.00 H new ATOM 0 HB VAL A 914 17.173 0.637 1.710 1.00 0.00 H new ATOM 0 HG11 VAL A 914 19.018 -0.443 0.469 1.00 0.00 H new ATOM 0 HG12 VAL A 914 17.524 -0.375 -0.494 1.00 0.00 H new ATOM 0 HG13 VAL A 914 18.847 0.769 -0.823 1.00 0.00 H new ATOM 0 HG21 VAL A 914 19.505 1.284 2.145 1.00 0.00 H new ATOM 0 HG22 VAL A 914 19.370 2.572 0.925 1.00 0.00 H new ATOM 0 HG23 VAL A 914 18.380 2.638 2.402 1.00 0.00 H new ATOM 124 N GLN A 915 16.465 4.196 1.505 1.00 0.00 N ATOM 125 CA GLN A 915 15.835 5.111 2.446 1.00 0.00 C ATOM 126 C GLN A 915 14.461 5.521 1.936 1.00 0.00 C ATOM 127 O GLN A 915 13.507 5.638 2.708 1.00 0.00 O ATOM 128 CB GLN A 915 16.741 6.330 2.674 1.00 0.00 C ATOM 129 CG GLN A 915 16.077 7.508 3.371 1.00 0.00 C ATOM 130 CD GLN A 915 15.421 8.461 2.391 1.00 0.00 C ATOM 131 OE1 GLN A 915 15.858 8.586 1.246 1.00 0.00 O ATOM 132 NE2 GLN A 915 14.382 9.144 2.833 1.00 0.00 N ATOM 0 H GLN A 915 17.292 4.573 1.043 1.00 0.00 H new ATOM 0 HA GLN A 915 15.697 4.611 3.405 1.00 0.00 H new ATOM 0 HB2 GLN A 915 17.602 6.017 3.264 1.00 0.00 H new ATOM 0 HB3 GLN A 915 17.121 6.666 1.709 1.00 0.00 H new ATOM 0 HG2 GLN A 915 15.328 7.138 4.071 1.00 0.00 H new ATOM 0 HG3 GLN A 915 16.821 8.048 3.956 1.00 0.00 H new ATOM 0 HE21 GLN A 915 14.053 9.010 3.789 1.00 0.00 H new ATOM 0 HE22 GLN A 915 13.908 9.806 2.219 1.00 0.00 H new ATOM 141 N ARG A 916 14.369 5.734 0.627 1.00 0.00 N ATOM 142 CA ARG A 916 13.090 5.999 -0.013 1.00 0.00 C ATOM 143 C ARG A 916 12.125 4.859 0.276 1.00 0.00 C ATOM 144 O ARG A 916 10.979 5.085 0.657 1.00 0.00 O ATOM 145 CB ARG A 916 13.265 6.158 -1.525 1.00 0.00 C ATOM 146 CG ARG A 916 13.930 7.456 -1.946 1.00 0.00 C ATOM 147 CD ARG A 916 14.193 7.464 -3.443 1.00 0.00 C ATOM 148 NE ARG A 916 14.650 8.767 -3.926 1.00 0.00 N ATOM 149 CZ ARG A 916 15.928 9.078 -4.136 1.00 0.00 C ATOM 150 NH1 ARG A 916 16.885 8.219 -3.812 1.00 0.00 N ATOM 151 NH2 ARG A 916 16.246 10.256 -4.659 1.00 0.00 N ATOM 0 H ARG A 916 15.166 5.728 -0.009 1.00 0.00 H new ATOM 0 HA ARG A 916 12.687 6.928 0.389 1.00 0.00 H new ATOM 0 HB2 ARG A 916 13.856 5.323 -1.900 1.00 0.00 H new ATOM 0 HB3 ARG A 916 12.286 6.094 -2.000 1.00 0.00 H new ATOM 0 HG2 ARG A 916 13.294 8.300 -1.679 1.00 0.00 H new ATOM 0 HG3 ARG A 916 14.869 7.581 -1.406 1.00 0.00 H new ATOM 0 HD2 ARG A 916 14.942 6.709 -3.681 1.00 0.00 H new ATOM 0 HD3 ARG A 916 13.281 7.185 -3.970 1.00 0.00 H new ATOM 0 HE ARG A 916 13.947 9.481 -4.114 1.00 0.00 H new ATOM 0 HH11 ARG A 916 16.643 7.317 -3.401 1.00 0.00 H new ATOM 0 HH12 ARG A 916 17.863 8.460 -3.974 1.00 0.00 H new ATOM 0 HH21 ARG A 916 15.512 10.922 -4.900 1.00 0.00 H new ATOM 0 HH22 ARG A 916 17.224 10.495 -4.820 1.00 0.00 H new ATOM 165 N LEU A 917 12.619 3.633 0.118 1.00 0.00 N ATOM 166 CA LEU A 917 11.824 2.437 0.369 1.00 0.00 C ATOM 167 C LEU A 917 11.362 2.374 1.819 1.00 0.00 C ATOM 168 O LEU A 917 10.178 2.176 2.080 1.00 0.00 O ATOM 169 CB LEU A 917 12.631 1.185 0.026 1.00 0.00 C ATOM 170 CG LEU A 917 12.902 0.971 -1.462 1.00 0.00 C ATOM 171 CD1 LEU A 917 13.811 -0.230 -1.667 1.00 0.00 C ATOM 172 CD2 LEU A 917 11.593 0.782 -2.211 1.00 0.00 C ATOM 0 H LEU A 917 13.574 3.443 -0.185 1.00 0.00 H new ATOM 0 HA LEU A 917 10.941 2.483 -0.268 1.00 0.00 H new ATOM 0 HB2 LEU A 917 13.586 1.234 0.549 1.00 0.00 H new ATOM 0 HB3 LEU A 917 12.101 0.314 0.411 1.00 0.00 H new ATOM 0 HG LEU A 917 13.404 1.854 -1.857 1.00 0.00 H new ATOM 0 HD11 LEU A 917 13.995 -0.370 -2.732 1.00 0.00 H new ATOM 0 HD12 LEU A 917 14.758 -0.061 -1.154 1.00 0.00 H new ATOM 0 HD13 LEU A 917 13.333 -1.122 -1.261 1.00 0.00 H new ATOM 0 HD21 LEU A 917 11.799 0.630 -3.271 1.00 0.00 H new ATOM 0 HD22 LEU A 917 11.069 -0.088 -1.815 1.00 0.00 H new ATOM 0 HD23 LEU A 917 10.971 1.668 -2.085 1.00 0.00 H new ATOM 184 N GLU A 918 12.299 2.552 2.751 1.00 0.00 N ATOM 185 CA GLU A 918 11.995 2.512 4.182 1.00 0.00 C ATOM 186 C GLU A 918 10.787 3.376 4.526 1.00 0.00 C ATOM 187 O GLU A 918 9.832 2.916 5.153 1.00 0.00 O ATOM 188 CB GLU A 918 13.191 2.998 5.005 1.00 0.00 C ATOM 189 CG GLU A 918 14.375 2.047 5.040 1.00 0.00 C ATOM 190 CD GLU A 918 15.460 2.543 5.973 1.00 0.00 C ATOM 191 OE1 GLU A 918 15.151 2.917 7.125 1.00 0.00 O ATOM 192 OE2 GLU A 918 16.639 2.556 5.555 1.00 0.00 O ATOM 0 H GLU A 918 13.281 2.726 2.538 1.00 0.00 H new ATOM 0 HA GLU A 918 11.771 1.474 4.426 1.00 0.00 H new ATOM 0 HB2 GLU A 918 13.524 3.955 4.603 1.00 0.00 H new ATOM 0 HB3 GLU A 918 12.860 3.180 6.027 1.00 0.00 H new ATOM 0 HG2 GLU A 918 14.041 1.060 5.361 1.00 0.00 H new ATOM 0 HG3 GLU A 918 14.782 1.934 4.035 1.00 0.00 H new ATOM 199 N HIS A 919 10.829 4.627 4.100 1.00 0.00 N ATOM 200 CA HIS A 919 9.801 5.589 4.472 1.00 0.00 C ATOM 201 C HIS A 919 8.524 5.384 3.667 1.00 0.00 C ATOM 202 O HIS A 919 7.422 5.484 4.211 1.00 0.00 O ATOM 203 CB HIS A 919 10.319 7.019 4.305 1.00 0.00 C ATOM 204 CG HIS A 919 11.405 7.375 5.276 1.00 0.00 C ATOM 205 ND1 HIS A 919 11.219 8.240 6.329 1.00 0.00 N ATOM 206 CD2 HIS A 919 12.694 6.969 5.348 1.00 0.00 C ATOM 207 CE1 HIS A 919 12.348 8.351 7.006 1.00 0.00 C ATOM 208 NE2 HIS A 919 13.260 7.589 6.432 1.00 0.00 N ATOM 0 H HIS A 919 11.562 5.002 3.497 1.00 0.00 H new ATOM 0 HA HIS A 919 9.559 5.425 5.522 1.00 0.00 H new ATOM 0 HB2 HIS A 919 10.694 7.146 3.289 1.00 0.00 H new ATOM 0 HB3 HIS A 919 9.489 7.715 4.428 1.00 0.00 H new ATOM 0 HD2 HIS A 919 13.186 6.283 4.675 1.00 0.00 H new ATOM 0 HE1 HIS A 919 12.499 8.963 7.883 1.00 0.00 H new ATOM 0 HE2 HIS A 919 14.225 7.480 6.743 1.00 0.00 H new ATOM 216 N ALA A 920 8.669 5.078 2.383 1.00 0.00 N ATOM 217 CA ALA A 920 7.516 4.895 1.512 1.00 0.00 C ATOM 218 C ALA A 920 6.735 3.643 1.886 1.00 0.00 C ATOM 219 O ALA A 920 5.509 3.652 1.895 1.00 0.00 O ATOM 220 CB ALA A 920 7.950 4.832 0.055 1.00 0.00 C ATOM 0 H ALA A 920 9.571 4.952 1.924 1.00 0.00 H new ATOM 0 HA ALA A 920 6.859 5.755 1.645 1.00 0.00 H new ATOM 0 HB1 ALA A 920 7.075 4.695 -0.580 1.00 0.00 H new ATOM 0 HB2 ALA A 920 8.453 5.761 -0.215 1.00 0.00 H new ATOM 0 HB3 ALA A 920 8.634 3.995 -0.085 1.00 0.00 H new ATOM 226 N ALA A 921 7.448 2.574 2.217 1.00 0.00 N ATOM 227 CA ALA A 921 6.810 1.312 2.561 1.00 0.00 C ATOM 228 C ALA A 921 6.018 1.422 3.861 1.00 0.00 C ATOM 229 O ALA A 921 4.916 0.886 3.965 1.00 0.00 O ATOM 230 CB ALA A 921 7.838 0.198 2.656 1.00 0.00 C ATOM 0 H ALA A 921 8.467 2.557 2.254 1.00 0.00 H new ATOM 0 HA ALA A 921 6.108 1.070 1.763 1.00 0.00 H new ATOM 0 HB1 ALA A 921 7.339 -0.736 2.914 1.00 0.00 H new ATOM 0 HB2 ALA A 921 8.343 0.087 1.697 1.00 0.00 H new ATOM 0 HB3 ALA A 921 8.570 0.443 3.425 1.00 0.00 H new ATOM 236 N LYS A 922 6.571 2.129 4.841 1.00 0.00 N ATOM 237 CA LYS A 922 5.899 2.290 6.128 1.00 0.00 C ATOM 238 C LYS A 922 4.612 3.100 5.988 1.00 0.00 C ATOM 239 O LYS A 922 3.597 2.775 6.603 1.00 0.00 O ATOM 240 CB LYS A 922 6.822 2.954 7.155 1.00 0.00 C ATOM 241 CG LYS A 922 7.958 2.058 7.625 1.00 0.00 C ATOM 242 CD LYS A 922 8.730 2.685 8.777 1.00 0.00 C ATOM 243 CE LYS A 922 9.459 3.951 8.352 1.00 0.00 C ATOM 244 NZ LYS A 922 10.139 4.604 9.499 1.00 0.00 N ATOM 0 H LYS A 922 7.475 2.597 4.771 1.00 0.00 H new ATOM 0 HA LYS A 922 5.642 1.292 6.482 1.00 0.00 H new ATOM 0 HB2 LYS A 922 7.242 3.861 6.720 1.00 0.00 H new ATOM 0 HB3 LYS A 922 6.231 3.259 8.018 1.00 0.00 H new ATOM 0 HG2 LYS A 922 7.556 1.095 7.938 1.00 0.00 H new ATOM 0 HG3 LYS A 922 8.637 1.865 6.794 1.00 0.00 H new ATOM 0 HD2 LYS A 922 8.042 2.918 9.590 1.00 0.00 H new ATOM 0 HD3 LYS A 922 9.450 1.965 9.165 1.00 0.00 H new ATOM 0 HE2 LYS A 922 10.193 3.708 7.584 1.00 0.00 H new ATOM 0 HE3 LYS A 922 8.749 4.647 7.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 922 10.625 5.463 9.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 922 9.435 4.859 10.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 922 10.834 3.948 9.909 1.00 0.00 H new ATOM 258 N GLN A 923 4.645 4.149 5.175 1.00 0.00 N ATOM 259 CA GLN A 923 3.458 4.972 4.977 1.00 0.00 C ATOM 260 C GLN A 923 2.469 4.273 4.048 1.00 0.00 C ATOM 261 O GLN A 923 1.261 4.411 4.212 1.00 0.00 O ATOM 262 CB GLN A 923 3.818 6.362 4.443 1.00 0.00 C ATOM 263 CG GLN A 923 4.533 6.346 3.104 1.00 0.00 C ATOM 264 CD GLN A 923 4.847 7.736 2.590 1.00 0.00 C ATOM 265 OE1 GLN A 923 5.045 8.673 3.368 1.00 0.00 O ATOM 266 NE2 GLN A 923 4.896 7.878 1.277 1.00 0.00 N ATOM 0 H GLN A 923 5.467 4.447 4.649 1.00 0.00 H new ATOM 0 HA GLN A 923 2.983 5.108 5.949 1.00 0.00 H new ATOM 0 HB2 GLN A 923 2.905 6.951 4.348 1.00 0.00 H new ATOM 0 HB3 GLN A 923 4.449 6.868 5.174 1.00 0.00 H new ATOM 0 HG2 GLN A 923 5.460 5.781 3.199 1.00 0.00 H new ATOM 0 HG3 GLN A 923 3.915 5.824 2.373 1.00 0.00 H new ATOM 0 HE21 GLN A 923 4.726 7.076 0.671 1.00 0.00 H new ATOM 0 HE22 GLN A 923 5.104 8.790 0.870 1.00 0.00 H new ATOM 275 N ALA A 924 2.983 3.510 3.086 1.00 0.00 N ATOM 276 CA ALA A 924 2.129 2.728 2.201 1.00 0.00 C ATOM 277 C ALA A 924 1.403 1.650 2.990 1.00 0.00 C ATOM 278 O ALA A 924 0.197 1.463 2.838 1.00 0.00 O ATOM 279 CB ALA A 924 2.942 2.104 1.075 1.00 0.00 C ATOM 0 H ALA A 924 3.982 3.418 2.901 1.00 0.00 H new ATOM 0 HA ALA A 924 1.391 3.397 1.757 1.00 0.00 H new ATOM 0 HB1 ALA A 924 2.283 1.525 0.428 1.00 0.00 H new ATOM 0 HB2 ALA A 924 3.422 2.891 0.494 1.00 0.00 H new ATOM 0 HB3 ALA A 924 3.704 1.448 1.496 1.00 0.00 H new ATOM 285 N ALA A 925 2.147 0.958 3.847 1.00 0.00 N ATOM 286 CA ALA A 925 1.578 -0.054 4.726 1.00 0.00 C ATOM 287 C ALA A 925 0.500 0.558 5.616 1.00 0.00 C ATOM 288 O ALA A 925 -0.568 -0.027 5.823 1.00 0.00 O ATOM 289 CB ALA A 925 2.677 -0.691 5.574 1.00 0.00 C ATOM 0 H ALA A 925 3.154 1.082 3.951 1.00 0.00 H new ATOM 0 HA ALA A 925 1.117 -0.830 4.115 1.00 0.00 H new ATOM 0 HB1 ALA A 925 2.241 -1.446 6.228 1.00 0.00 H new ATOM 0 HB2 ALA A 925 3.415 -1.158 4.922 1.00 0.00 H new ATOM 0 HB3 ALA A 925 3.161 0.076 6.179 1.00 0.00 H new ATOM 295 N ALA A 926 0.783 1.752 6.122 1.00 0.00 N ATOM 296 CA ALA A 926 -0.159 2.484 6.957 1.00 0.00 C ATOM 297 C ALA A 926 -1.408 2.870 6.171 1.00 0.00 C ATOM 298 O ALA A 926 -2.521 2.522 6.556 1.00 0.00 O ATOM 299 CB ALA A 926 0.506 3.724 7.532 1.00 0.00 C ATOM 0 H ALA A 926 1.667 2.237 5.966 1.00 0.00 H new ATOM 0 HA ALA A 926 -0.465 1.832 7.775 1.00 0.00 H new ATOM 0 HB1 ALA A 926 -0.207 4.264 8.155 1.00 0.00 H new ATOM 0 HB2 ALA A 926 1.365 3.430 8.136 1.00 0.00 H new ATOM 0 HB3 ALA A 926 0.838 4.369 6.719 1.00 0.00 H new ATOM 305 N SER A 927 -1.212 3.577 5.060 1.00 0.00 N ATOM 306 CA SER A 927 -2.319 4.040 4.229 1.00 0.00 C ATOM 307 C SER A 927 -3.173 2.874 3.733 1.00 0.00 C ATOM 308 O SER A 927 -4.397 2.985 3.648 1.00 0.00 O ATOM 309 CB SER A 927 -1.786 4.852 3.049 1.00 0.00 C ATOM 310 OG SER A 927 -1.147 6.037 3.499 1.00 0.00 O ATOM 0 H SER A 927 -0.290 3.843 4.714 1.00 0.00 H new ATOM 0 HA SER A 927 -2.956 4.678 4.842 1.00 0.00 H new ATOM 0 HB2 SER A 927 -1.082 4.249 2.476 1.00 0.00 H new ATOM 0 HB3 SER A 927 -2.606 5.108 2.378 1.00 0.00 H new ATOM 0 HG SER A 927 -0.250 5.820 3.829 1.00 0.00 H new ATOM 316 N ALA A 928 -2.531 1.755 3.418 1.00 0.00 N ATOM 317 CA ALA A 928 -3.253 0.558 3.014 1.00 0.00 C ATOM 318 C ALA A 928 -4.154 0.081 4.140 1.00 0.00 C ATOM 319 O ALA A 928 -5.333 -0.195 3.929 1.00 0.00 O ATOM 320 CB ALA A 928 -2.288 -0.542 2.613 1.00 0.00 C ATOM 0 H ALA A 928 -1.516 1.653 3.435 1.00 0.00 H new ATOM 0 HA ALA A 928 -3.870 0.806 2.150 1.00 0.00 H new ATOM 0 HB1 ALA A 928 -2.849 -1.427 2.315 1.00 0.00 H new ATOM 0 HB2 ALA A 928 -1.676 -0.202 1.778 1.00 0.00 H new ATOM 0 HB3 ALA A 928 -1.645 -0.788 3.458 1.00 0.00 H new ATOM 326 N THR A 929 -3.593 0.016 5.343 1.00 0.00 N ATOM 327 CA THR A 929 -4.347 -0.393 6.518 1.00 0.00 C ATOM 328 C THR A 929 -5.483 0.594 6.793 1.00 0.00 C ATOM 329 O THR A 929 -6.571 0.205 7.218 1.00 0.00 O ATOM 330 CB THR A 929 -3.433 -0.497 7.757 1.00 0.00 C ATOM 331 OG1 THR A 929 -2.293 -1.319 7.462 1.00 0.00 O ATOM 332 CG2 THR A 929 -4.185 -1.088 8.939 1.00 0.00 C ATOM 0 H THR A 929 -2.616 0.242 5.528 1.00 0.00 H new ATOM 0 HA THR A 929 -4.769 -1.378 6.317 1.00 0.00 H new ATOM 0 HB THR A 929 -3.103 0.509 8.017 1.00 0.00 H new ATOM 0 HG1 THR A 929 -1.620 -0.787 6.989 1.00 0.00 H new ATOM 0 HG21 THR A 929 -3.519 -1.151 9.799 1.00 0.00 H new ATOM 0 HG22 THR A 929 -5.035 -0.452 9.184 1.00 0.00 H new ATOM 0 HG23 THR A 929 -4.541 -2.086 8.682 1.00 0.00 H new ATOM 340 N GLN A 930 -5.226 1.873 6.535 1.00 0.00 N ATOM 341 CA GLN A 930 -6.245 2.904 6.689 1.00 0.00 C ATOM 342 C GLN A 930 -7.393 2.676 5.714 1.00 0.00 C ATOM 343 O GLN A 930 -8.562 2.779 6.087 1.00 0.00 O ATOM 344 CB GLN A 930 -5.648 4.297 6.480 1.00 0.00 C ATOM 345 CG GLN A 930 -4.605 4.676 7.517 1.00 0.00 C ATOM 346 CD GLN A 930 -4.059 6.073 7.309 1.00 0.00 C ATOM 347 OE1 GLN A 930 -3.077 6.271 6.594 1.00 0.00 O ATOM 348 NE2 GLN A 930 -4.692 7.055 7.932 1.00 0.00 N ATOM 0 H GLN A 930 -4.320 2.219 6.218 1.00 0.00 H new ATOM 0 HA GLN A 930 -6.632 2.842 7.706 1.00 0.00 H new ATOM 0 HB2 GLN A 930 -5.196 4.344 5.489 1.00 0.00 H new ATOM 0 HB3 GLN A 930 -6.451 5.034 6.499 1.00 0.00 H new ATOM 0 HG2 GLN A 930 -5.045 4.606 8.512 1.00 0.00 H new ATOM 0 HG3 GLN A 930 -3.784 3.960 7.480 1.00 0.00 H new ATOM 0 HE21 GLN A 930 -5.503 6.850 8.516 1.00 0.00 H new ATOM 0 HE22 GLN A 930 -4.369 8.017 7.828 1.00 0.00 H new ATOM 357 N THR A 931 -7.060 2.353 4.467 1.00 0.00 N ATOM 358 CA THR A 931 -8.072 2.089 3.459 1.00 0.00 C ATOM 359 C THR A 931 -8.858 0.828 3.816 1.00 0.00 C ATOM 360 O THR A 931 -10.083 0.790 3.697 1.00 0.00 O ATOM 361 CB THR A 931 -7.441 1.933 2.059 1.00 0.00 C ATOM 362 OG1 THR A 931 -6.442 2.943 1.857 1.00 0.00 O ATOM 363 CG2 THR A 931 -8.502 2.059 0.978 1.00 0.00 C ATOM 0 H THR A 931 -6.099 2.269 4.135 1.00 0.00 H new ATOM 0 HA THR A 931 -8.750 2.942 3.435 1.00 0.00 H new ATOM 0 HB THR A 931 -6.984 0.945 1.998 1.00 0.00 H new ATOM 0 HG1 THR A 931 -5.681 2.774 2.451 1.00 0.00 H new ATOM 0 HG21 THR A 931 -8.038 1.946 -0.002 1.00 0.00 H new ATOM 0 HG22 THR A 931 -9.255 1.283 1.115 1.00 0.00 H new ATOM 0 HG23 THR A 931 -8.975 3.039 1.045 1.00 0.00 H new ATOM 371 N ILE A 932 -8.142 -0.189 4.284 1.00 0.00 N ATOM 372 CA ILE A 932 -8.759 -1.434 4.733 1.00 0.00 C ATOM 373 C ILE A 932 -9.744 -1.181 5.873 1.00 0.00 C ATOM 374 O ILE A 932 -10.847 -1.736 5.889 1.00 0.00 O ATOM 375 CB ILE A 932 -7.683 -2.450 5.188 1.00 0.00 C ATOM 376 CG1 ILE A 932 -6.900 -2.963 3.976 1.00 0.00 C ATOM 377 CG2 ILE A 932 -8.311 -3.607 5.956 1.00 0.00 C ATOM 378 CD1 ILE A 932 -5.779 -3.915 4.333 1.00 0.00 C ATOM 0 H ILE A 932 -7.125 -0.175 4.363 1.00 0.00 H new ATOM 0 HA ILE A 932 -9.305 -1.852 3.887 1.00 0.00 H new ATOM 0 HB ILE A 932 -6.993 -1.943 5.862 1.00 0.00 H new ATOM 0 HG12 ILE A 932 -7.588 -3.465 3.296 1.00 0.00 H new ATOM 0 HG13 ILE A 932 -6.484 -2.112 3.437 1.00 0.00 H new ATOM 0 HG21 ILE A 932 -7.532 -4.305 6.263 1.00 0.00 H new ATOM 0 HG22 ILE A 932 -8.823 -3.223 6.838 1.00 0.00 H new ATOM 0 HG23 ILE A 932 -9.028 -4.122 5.316 1.00 0.00 H new ATOM 0 HD11 ILE A 932 -5.270 -4.236 3.424 1.00 0.00 H new ATOM 0 HD12 ILE A 932 -5.068 -3.411 4.988 1.00 0.00 H new ATOM 0 HD13 ILE A 932 -6.190 -4.785 4.845 1.00 0.00 H new ATOM 390 N ALA A 933 -9.354 -0.313 6.802 1.00 0.00 N ATOM 391 CA ALA A 933 -10.176 0.003 7.967 1.00 0.00 C ATOM 392 C ALA A 933 -11.430 0.784 7.582 1.00 0.00 C ATOM 393 O ALA A 933 -12.275 1.073 8.426 1.00 0.00 O ATOM 394 CB ALA A 933 -9.363 0.785 8.988 1.00 0.00 C ATOM 0 H ALA A 933 -8.466 0.188 6.770 1.00 0.00 H new ATOM 0 HA ALA A 933 -10.498 -0.940 8.409 1.00 0.00 H new ATOM 0 HB1 ALA A 933 -9.987 1.014 9.852 1.00 0.00 H new ATOM 0 HB2 ALA A 933 -8.508 0.188 9.306 1.00 0.00 H new ATOM 0 HB3 ALA A 933 -9.010 1.713 8.538 1.00 0.00 H new ATOM 400 N ALA A 934 -11.533 1.149 6.315 1.00 0.00 N ATOM 401 CA ALA A 934 -12.738 1.770 5.795 1.00 0.00 C ATOM 402 C ALA A 934 -13.479 0.787 4.896 1.00 0.00 C ATOM 403 O ALA A 934 -14.704 0.685 4.938 1.00 0.00 O ATOM 404 CB ALA A 934 -12.398 3.043 5.035 1.00 0.00 C ATOM 0 H ALA A 934 -10.792 1.025 5.625 1.00 0.00 H new ATOM 0 HA ALA A 934 -13.385 2.039 6.630 1.00 0.00 H new ATOM 0 HB1 ALA A 934 -13.314 3.494 4.653 1.00 0.00 H new ATOM 0 HB2 ALA A 934 -11.900 3.744 5.704 1.00 0.00 H new ATOM 0 HB3 ALA A 934 -11.736 2.804 4.202 1.00 0.00 H new ATOM 410 N ALA A 935 -12.708 0.042 4.109 1.00 0.00 N ATOM 411 CA ALA A 935 -13.253 -0.913 3.153 1.00 0.00 C ATOM 412 C ALA A 935 -14.087 -1.992 3.835 1.00 0.00 C ATOM 413 O ALA A 935 -15.247 -2.202 3.486 1.00 0.00 O ATOM 414 CB ALA A 935 -12.128 -1.549 2.351 1.00 0.00 C ATOM 0 H ALA A 935 -11.689 0.084 4.117 1.00 0.00 H new ATOM 0 HA ALA A 935 -13.914 -0.365 2.481 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -12.546 -2.261 1.639 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -11.583 -0.774 1.812 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -11.448 -2.068 3.027 1.00 0.00 H new ATOM 420 N GLN A 936 -13.506 -2.672 4.818 1.00 0.00 N ATOM 421 CA GLN A 936 -14.203 -3.769 5.482 1.00 0.00 C ATOM 422 C GLN A 936 -14.948 -3.278 6.722 1.00 0.00 C ATOM 423 O GLN A 936 -15.418 -4.074 7.535 1.00 0.00 O ATOM 424 CB GLN A 936 -13.231 -4.895 5.854 1.00 0.00 C ATOM 425 CG GLN A 936 -12.155 -4.489 6.846 1.00 0.00 C ATOM 426 CD GLN A 936 -11.306 -5.664 7.299 1.00 0.00 C ATOM 427 OE1 GLN A 936 -10.809 -5.689 8.424 1.00 0.00 O ATOM 428 NE2 GLN A 936 -11.135 -6.650 6.432 1.00 0.00 N ATOM 0 H GLN A 936 -12.567 -2.487 5.169 1.00 0.00 H new ATOM 0 HA GLN A 936 -14.935 -4.166 4.779 1.00 0.00 H new ATOM 0 HB2 GLN A 936 -13.799 -5.726 6.272 1.00 0.00 H new ATOM 0 HB3 GLN A 936 -12.752 -5.261 4.946 1.00 0.00 H new ATOM 0 HG2 GLN A 936 -11.512 -3.735 6.391 1.00 0.00 H new ATOM 0 HG3 GLN A 936 -12.623 -4.027 7.715 1.00 0.00 H new ATOM 0 HE21 GLN A 936 -11.562 -6.596 5.507 1.00 0.00 H new ATOM 0 HE22 GLN A 936 -10.576 -7.464 6.689 1.00 0.00 H new ATOM 437 N HIS A 937 -15.057 -1.965 6.853 1.00 0.00 N ATOM 438 CA HIS A 937 -15.785 -1.372 7.967 1.00 0.00 C ATOM 439 C HIS A 937 -17.107 -0.797 7.477 1.00 0.00 C ATOM 440 O HIS A 937 -18.070 -0.699 8.228 1.00 0.00 O ATOM 441 CB HIS A 937 -14.946 -0.277 8.629 1.00 0.00 C ATOM 442 CG HIS A 937 -15.504 0.230 9.927 1.00 0.00 C ATOM 443 ND1 HIS A 937 -15.008 -0.151 11.156 1.00 0.00 N ATOM 444 CD2 HIS A 937 -16.505 1.106 10.185 1.00 0.00 C ATOM 445 CE1 HIS A 937 -15.682 0.464 12.110 1.00 0.00 C ATOM 446 NE2 HIS A 937 -16.594 1.234 11.547 1.00 0.00 N ATOM 0 H HIS A 937 -14.652 -1.290 6.204 1.00 0.00 H new ATOM 0 HA HIS A 937 -15.988 -2.147 8.706 1.00 0.00 H new ATOM 0 HB2 HIS A 937 -13.941 -0.662 8.805 1.00 0.00 H new ATOM 0 HB3 HIS A 937 -14.850 0.560 7.937 1.00 0.00 H new ATOM 0 HD2 HIS A 937 -17.119 1.610 9.453 1.00 0.00 H new ATOM 0 HE1 HIS A 937 -15.515 0.355 13.172 1.00 0.00 H new ATOM 0 HE2 HIS A 937 -17.257 1.828 12.044 1.00 0.00 H new ATOM 454 N ALA A 938 -17.138 -0.414 6.209 1.00 0.00 N ATOM 455 CA ALA A 938 -18.340 0.143 5.609 1.00 0.00 C ATOM 456 C ALA A 938 -18.903 -0.806 4.560 1.00 0.00 C ATOM 457 O ALA A 938 -19.707 -0.414 3.714 1.00 0.00 O ATOM 458 CB ALA A 938 -18.036 1.499 4.993 1.00 0.00 C ATOM 0 H ALA A 938 -16.342 -0.479 5.575 1.00 0.00 H new ATOM 0 HA ALA A 938 -19.091 0.274 6.388 1.00 0.00 H new ATOM 0 HB1 ALA A 938 -18.943 1.907 4.546 1.00 0.00 H new ATOM 0 HB2 ALA A 938 -17.675 2.177 5.766 1.00 0.00 H new ATOM 0 HB3 ALA A 938 -17.272 1.386 4.224 1.00 0.00 H new ATOM 464 N ALA A 939 -18.479 -2.058 4.632 1.00 0.00 N ATOM 465 CA ALA A 939 -18.913 -3.074 3.689 1.00 0.00 C ATOM 466 C ALA A 939 -20.312 -3.560 4.039 1.00 0.00 C ATOM 467 O ALA A 939 -20.485 -4.342 4.973 1.00 0.00 O ATOM 468 CB ALA A 939 -17.929 -4.234 3.674 1.00 0.00 C ATOM 0 H ALA A 939 -17.829 -2.396 5.341 1.00 0.00 H new ATOM 0 HA ALA A 939 -18.943 -2.635 2.692 1.00 0.00 H new ATOM 0 HB1 ALA A 939 -18.266 -4.988 2.963 1.00 0.00 H new ATOM 0 HB2 ALA A 939 -16.944 -3.872 3.379 1.00 0.00 H new ATOM 0 HB3 ALA A 939 -17.870 -4.674 4.669 1.00 0.00 H new ATOM 474 N SER A 940 -21.294 -3.036 3.302 1.00 0.00 N ATOM 475 CA SER A 940 -22.731 -3.351 3.443 1.00 0.00 C ATOM 476 C SER A 940 -23.318 -2.875 4.782 1.00 0.00 C ATOM 477 O SER A 940 -24.483 -2.472 4.847 1.00 0.00 O ATOM 478 CB SER A 940 -23.033 -4.846 3.195 1.00 0.00 C ATOM 479 OG SER A 940 -22.448 -5.695 4.165 1.00 0.00 O ATOM 0 H SER A 940 -21.112 -2.357 2.563 1.00 0.00 H new ATOM 0 HA SER A 940 -23.234 -2.784 2.660 1.00 0.00 H new ATOM 0 HB2 SER A 940 -24.112 -4.997 3.191 1.00 0.00 H new ATOM 0 HB3 SER A 940 -22.668 -5.126 2.207 1.00 0.00 H new ATOM 0 HG SER A 940 -21.945 -5.156 4.811 1.00 0.00 H new ATOM 485 N ALA A 941 -22.519 -2.904 5.836 1.00 0.00 N ATOM 486 CA ALA A 941 -22.938 -2.424 7.143 1.00 0.00 C ATOM 487 C ALA A 941 -21.842 -1.554 7.745 1.00 0.00 C ATOM 488 O ALA A 941 -20.663 -1.772 7.471 1.00 0.00 O ATOM 489 CB ALA A 941 -23.263 -3.594 8.062 1.00 0.00 C ATOM 0 H ALA A 941 -21.564 -3.260 5.810 1.00 0.00 H new ATOM 0 HA ALA A 941 -23.841 -1.824 7.030 1.00 0.00 H new ATOM 0 HB1 ALA A 941 -23.575 -3.216 9.036 1.00 0.00 H new ATOM 0 HB2 ALA A 941 -24.069 -4.185 7.627 1.00 0.00 H new ATOM 0 HB3 ALA A 941 -22.378 -4.219 8.182 1.00 0.00 H new ATOM 495 N PRO A 942 -22.212 -0.564 8.576 1.00 0.00 N ATOM 496 CA PRO A 942 -21.254 0.382 9.170 1.00 0.00 C ATOM 497 C PRO A 942 -20.442 -0.219 10.324 1.00 0.00 C ATOM 498 O PRO A 942 -19.988 0.500 11.218 1.00 0.00 O ATOM 499 CB PRO A 942 -22.157 1.502 9.685 1.00 0.00 C ATOM 500 CG PRO A 942 -23.445 0.827 10.003 1.00 0.00 C ATOM 501 CD PRO A 942 -23.598 -0.276 8.992 1.00 0.00 C ATOM 0 HA PRO A 942 -20.503 0.700 8.447 1.00 0.00 H new ATOM 0 HB2 PRO A 942 -21.732 1.981 10.567 1.00 0.00 H new ATOM 0 HB3 PRO A 942 -22.292 2.280 8.934 1.00 0.00 H new ATOM 0 HG2 PRO A 942 -23.436 0.428 11.017 1.00 0.00 H new ATOM 0 HG3 PRO A 942 -24.278 1.528 9.944 1.00 0.00 H new ATOM 0 HD2 PRO A 942 -24.076 -1.154 9.426 1.00 0.00 H new ATOM 0 HD3 PRO A 942 -24.213 0.037 8.148 1.00 0.00 H new ATOM 509 N LYS A 943 -20.263 -1.531 10.295 1.00 0.00 N ATOM 510 CA LYS A 943 -19.462 -2.226 11.293 1.00 0.00 C ATOM 511 C LYS A 943 -18.583 -3.267 10.617 1.00 0.00 C ATOM 512 O LYS A 943 -17.413 -3.017 10.329 1.00 0.00 O ATOM 513 CB LYS A 943 -20.350 -2.908 12.338 1.00 0.00 C ATOM 514 CG LYS A 943 -21.148 -1.945 13.195 1.00 0.00 C ATOM 515 CD LYS A 943 -22.074 -2.687 14.141 1.00 0.00 C ATOM 516 CE LYS A 943 -22.886 -1.726 14.990 1.00 0.00 C ATOM 517 NZ LYS A 943 -23.667 -0.776 14.157 1.00 0.00 N ATOM 0 H LYS A 943 -20.666 -2.141 9.584 1.00 0.00 H new ATOM 0 HA LYS A 943 -18.838 -1.489 11.799 1.00 0.00 H new ATOM 0 HB2 LYS A 943 -21.039 -3.582 11.829 1.00 0.00 H new ATOM 0 HB3 LYS A 943 -19.724 -3.522 12.986 1.00 0.00 H new ATOM 0 HG2 LYS A 943 -20.468 -1.315 13.768 1.00 0.00 H new ATOM 0 HG3 LYS A 943 -21.732 -1.284 12.555 1.00 0.00 H new ATOM 0 HD2 LYS A 943 -22.746 -3.325 13.568 1.00 0.00 H new ATOM 0 HD3 LYS A 943 -21.488 -3.340 14.788 1.00 0.00 H new ATOM 0 HE2 LYS A 943 -23.564 -2.291 15.630 1.00 0.00 H new ATOM 0 HE3 LYS A 943 -22.218 -1.169 15.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 943 -24.345 -0.264 14.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 943 -23.021 -0.096 13.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 943 -24.183 -1.301 13.422 1.00 0.00 H new ATOM 531 N ALA A 944 -19.168 -4.428 10.351 1.00 0.00 N ATOM 532 CA ALA A 944 -18.467 -5.518 9.690 1.00 0.00 C ATOM 533 C ALA A 944 -19.462 -6.533 9.155 1.00 0.00 C ATOM 534 O ALA A 944 -20.266 -7.086 9.908 1.00 0.00 O ATOM 535 CB ALA A 944 -17.504 -6.198 10.643 1.00 0.00 C ATOM 0 H ALA A 944 -20.138 -4.639 10.587 1.00 0.00 H new ATOM 0 HA ALA A 944 -17.897 -5.100 8.860 1.00 0.00 H new ATOM 0 HB1 ALA A 944 -16.992 -7.009 10.126 1.00 0.00 H new ATOM 0 HB2 ALA A 944 -16.771 -5.474 10.997 1.00 0.00 H new ATOM 0 HB3 ALA A 944 -18.056 -6.601 11.492 1.00 0.00 H new ATOM 541 N SER A 945 -19.419 -6.762 7.858 1.00 0.00 N ATOM 542 CA SER A 945 -20.308 -7.714 7.218 1.00 0.00 C ATOM 543 C SER A 945 -19.691 -8.225 5.923 1.00 0.00 C ATOM 544 O SER A 945 -19.806 -7.594 4.876 1.00 0.00 O ATOM 545 CB SER A 945 -21.663 -7.059 6.947 1.00 0.00 C ATOM 546 OG SER A 945 -22.338 -6.759 8.160 1.00 0.00 O ATOM 0 H SER A 945 -18.772 -6.298 7.221 1.00 0.00 H new ATOM 0 HA SER A 945 -20.457 -8.564 7.884 1.00 0.00 H new ATOM 0 HB2 SER A 945 -21.520 -6.145 6.371 1.00 0.00 H new ATOM 0 HB3 SER A 945 -22.277 -7.725 6.340 1.00 0.00 H new ATOM 0 HG SER A 945 -21.757 -6.973 8.919 1.00 0.00 H new ATOM 552 N ALA A 946 -19.021 -9.363 6.010 1.00 0.00 N ATOM 553 CA ALA A 946 -18.315 -9.922 4.867 1.00 0.00 C ATOM 554 C ALA A 946 -19.165 -10.953 4.136 1.00 0.00 C ATOM 555 O ALA A 946 -18.671 -11.649 3.248 1.00 0.00 O ATOM 556 CB ALA A 946 -16.999 -10.540 5.314 1.00 0.00 C ATOM 0 H ALA A 946 -18.951 -9.919 6.862 1.00 0.00 H new ATOM 0 HA ALA A 946 -18.108 -9.110 4.170 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -16.480 -10.955 4.450 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -16.377 -9.775 5.778 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -17.196 -11.334 6.035 1.00 0.00 H new ATOM 562 N GLY A 947 -20.434 -11.059 4.522 1.00 0.00 N ATOM 563 CA GLY A 947 -21.351 -11.947 3.827 1.00 0.00 C ATOM 564 C GLY A 947 -21.477 -11.588 2.358 1.00 0.00 C ATOM 565 O GLY A 947 -20.930 -12.280 1.497 1.00 0.00 O ATOM 0 H GLY A 947 -20.844 -10.546 5.303 1.00 0.00 H new ATOM 0 HA2 GLY A 947 -21.003 -12.976 3.921 1.00 0.00 H new ATOM 0 HA3 GLY A 947 -22.332 -11.898 4.299 1.00 0.00 H new ATOM 569 N PRO A 948 -22.184 -10.499 2.043 1.00 0.00 N ATOM 570 CA PRO A 948 -22.266 -9.982 0.683 1.00 0.00 C ATOM 571 C PRO A 948 -21.051 -9.122 0.348 1.00 0.00 C ATOM 572 O PRO A 948 -21.182 -7.950 -0.011 1.00 0.00 O ATOM 573 CB PRO A 948 -23.540 -9.139 0.713 1.00 0.00 C ATOM 574 CG PRO A 948 -23.651 -8.657 2.121 1.00 0.00 C ATOM 575 CD PRO A 948 -22.971 -9.685 2.990 1.00 0.00 C ATOM 0 HA PRO A 948 -22.285 -10.767 -0.073 1.00 0.00 H new ATOM 0 HB2 PRO A 948 -23.478 -8.305 0.014 1.00 0.00 H new ATOM 0 HB3 PRO A 948 -24.411 -9.729 0.428 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -23.178 -7.682 2.234 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -24.696 -8.539 2.408 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -22.332 -9.214 3.737 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -23.697 -10.293 3.529 1.00 0.00 H new ATOM 583 N GLN A 949 -19.866 -9.713 0.484 1.00 0.00 N ATOM 584 CA GLN A 949 -18.617 -8.988 0.281 1.00 0.00 C ATOM 585 C GLN A 949 -18.445 -8.581 -1.182 1.00 0.00 C ATOM 586 O GLN A 949 -18.498 -9.414 -2.090 1.00 0.00 O ATOM 587 CB GLN A 949 -17.418 -9.822 0.755 1.00 0.00 C ATOM 588 CG GLN A 949 -17.236 -11.137 0.014 1.00 0.00 C ATOM 589 CD GLN A 949 -16.031 -11.918 0.505 1.00 0.00 C ATOM 590 OE1 GLN A 949 -15.052 -11.341 0.979 1.00 0.00 O ATOM 591 NE2 GLN A 949 -16.086 -13.234 0.371 1.00 0.00 N ATOM 0 H GLN A 949 -19.746 -10.694 0.735 1.00 0.00 H new ATOM 0 HA GLN A 949 -18.660 -8.078 0.880 1.00 0.00 H new ATOM 0 HB2 GLN A 949 -16.511 -9.228 0.644 1.00 0.00 H new ATOM 0 HB3 GLN A 949 -17.534 -10.031 1.818 1.00 0.00 H new ATOM 0 HG2 GLN A 949 -18.133 -11.745 0.134 1.00 0.00 H new ATOM 0 HG3 GLN A 949 -17.126 -10.938 -1.052 1.00 0.00 H new ATOM 0 HE21 GLN A 949 -16.917 -13.672 -0.027 1.00 0.00 H new ATOM 0 HE22 GLN A 949 -15.298 -13.810 0.666 1.00 0.00 H new ATOM 600 N PRO A 950 -18.264 -7.279 -1.425 1.00 0.00 N ATOM 601 CA PRO A 950 -18.047 -6.742 -2.756 1.00 0.00 C ATOM 602 C PRO A 950 -16.562 -6.612 -3.074 1.00 0.00 C ATOM 603 O PRO A 950 -15.719 -7.232 -2.417 1.00 0.00 O ATOM 604 CB PRO A 950 -18.702 -5.370 -2.643 1.00 0.00 C ATOM 605 CG PRO A 950 -18.472 -4.948 -1.227 1.00 0.00 C ATOM 606 CD PRO A 950 -18.271 -6.207 -0.416 1.00 0.00 C ATOM 0 HA PRO A 950 -18.449 -7.368 -3.552 1.00 0.00 H new ATOM 0 HB2 PRO A 950 -18.259 -4.662 -3.343 1.00 0.00 H new ATOM 0 HB3 PRO A 950 -19.766 -5.421 -2.872 1.00 0.00 H new ATOM 0 HG2 PRO A 950 -17.599 -4.300 -1.155 1.00 0.00 H new ATOM 0 HG3 PRO A 950 -19.323 -4.379 -0.851 1.00 0.00 H new ATOM 0 HD2 PRO A 950 -17.335 -6.178 0.143 1.00 0.00 H new ATOM 0 HD3 PRO A 950 -19.072 -6.347 0.310 1.00 0.00 H new ATOM 614 N LEU A 951 -16.242 -5.790 -4.068 1.00 0.00 N ATOM 615 CA LEU A 951 -14.853 -5.520 -4.416 1.00 0.00 C ATOM 616 C LEU A 951 -14.231 -4.584 -3.387 1.00 0.00 C ATOM 617 O LEU A 951 -13.968 -3.418 -3.664 1.00 0.00 O ATOM 618 CB LEU A 951 -14.732 -4.921 -5.825 1.00 0.00 C ATOM 619 CG LEU A 951 -14.769 -5.922 -6.988 1.00 0.00 C ATOM 620 CD1 LEU A 951 -13.639 -6.932 -6.860 1.00 0.00 C ATOM 621 CD2 LEU A 951 -16.114 -6.632 -7.059 1.00 0.00 C ATOM 0 H LEU A 951 -16.925 -5.300 -4.646 1.00 0.00 H new ATOM 0 HA LEU A 951 -14.314 -6.467 -4.412 1.00 0.00 H new ATOM 0 HB2 LEU A 951 -15.541 -4.203 -5.964 1.00 0.00 H new ATOM 0 HB3 LEU A 951 -13.797 -4.363 -5.882 1.00 0.00 H new ATOM 0 HG LEU A 951 -14.633 -5.365 -7.915 1.00 0.00 H new ATOM 0 HD11 LEU A 951 -13.682 -7.633 -7.693 1.00 0.00 H new ATOM 0 HD12 LEU A 951 -12.682 -6.411 -6.873 1.00 0.00 H new ATOM 0 HD13 LEU A 951 -13.743 -7.477 -5.922 1.00 0.00 H new ATOM 0 HD21 LEU A 951 -16.111 -7.335 -7.892 1.00 0.00 H new ATOM 0 HD22 LEU A 951 -16.290 -7.173 -6.129 1.00 0.00 H new ATOM 0 HD23 LEU A 951 -16.906 -5.898 -7.207 1.00 0.00 H new ATOM 633 N LEU A 952 -14.061 -5.108 -2.184 1.00 0.00 N ATOM 634 CA LEU A 952 -13.404 -4.402 -1.092 1.00 0.00 C ATOM 635 C LEU A 952 -12.779 -5.410 -0.151 1.00 0.00 C ATOM 636 O LEU A 952 -11.564 -5.464 0.000 1.00 0.00 O ATOM 637 CB LEU A 952 -14.390 -3.525 -0.311 1.00 0.00 C ATOM 638 CG LEU A 952 -14.694 -2.159 -0.924 1.00 0.00 C ATOM 639 CD1 LEU A 952 -15.678 -1.398 -0.051 1.00 0.00 C ATOM 640 CD2 LEU A 952 -13.409 -1.362 -1.104 1.00 0.00 C ATOM 0 H LEU A 952 -14.378 -6.045 -1.934 1.00 0.00 H new ATOM 0 HA LEU A 952 -12.640 -3.753 -1.520 1.00 0.00 H new ATOM 0 HB2 LEU A 952 -15.327 -4.071 -0.204 1.00 0.00 H new ATOM 0 HB3 LEU A 952 -13.994 -3.372 0.693 1.00 0.00 H new ATOM 0 HG LEU A 952 -15.146 -2.308 -1.905 1.00 0.00 H new ATOM 0 HD11 LEU A 952 -15.886 -0.426 -0.499 1.00 0.00 H new ATOM 0 HD12 LEU A 952 -16.605 -1.965 0.032 1.00 0.00 H new ATOM 0 HD13 LEU A 952 -15.250 -1.256 0.941 1.00 0.00 H new ATOM 0 HD21 LEU A 952 -13.641 -0.391 -1.542 1.00 0.00 H new ATOM 0 HD22 LEU A 952 -12.931 -1.218 -0.135 1.00 0.00 H new ATOM 0 HD23 LEU A 952 -12.733 -1.905 -1.765 1.00 0.00 H new ATOM 652 N VAL A 953 -13.628 -6.230 0.459 1.00 0.00 N ATOM 653 CA VAL A 953 -13.182 -7.250 1.402 1.00 0.00 C ATOM 654 C VAL A 953 -12.286 -8.273 0.705 1.00 0.00 C ATOM 655 O VAL A 953 -11.333 -8.786 1.291 1.00 0.00 O ATOM 656 CB VAL A 953 -14.385 -7.970 2.047 1.00 0.00 C ATOM 657 CG1 VAL A 953 -13.923 -8.981 3.082 1.00 0.00 C ATOM 658 CG2 VAL A 953 -15.337 -6.960 2.671 1.00 0.00 C ATOM 0 H VAL A 953 -14.638 -6.207 0.316 1.00 0.00 H new ATOM 0 HA VAL A 953 -12.611 -6.750 2.185 1.00 0.00 H new ATOM 0 HB VAL A 953 -14.917 -8.510 1.264 1.00 0.00 H new ATOM 0 HG11 VAL A 953 -14.790 -9.474 3.521 1.00 0.00 H new ATOM 0 HG12 VAL A 953 -13.286 -9.725 2.605 1.00 0.00 H new ATOM 0 HG13 VAL A 953 -13.361 -8.470 3.864 1.00 0.00 H new ATOM 0 HG21 VAL A 953 -16.180 -7.484 3.121 1.00 0.00 H new ATOM 0 HG22 VAL A 953 -14.812 -6.391 3.438 1.00 0.00 H new ATOM 0 HG23 VAL A 953 -15.702 -6.280 1.901 1.00 0.00 H new ATOM 668 N GLN A 954 -12.594 -8.549 -0.554 1.00 0.00 N ATOM 669 CA GLN A 954 -11.808 -9.480 -1.352 1.00 0.00 C ATOM 670 C GLN A 954 -10.394 -8.947 -1.572 1.00 0.00 C ATOM 671 O GLN A 954 -9.410 -9.574 -1.169 1.00 0.00 O ATOM 672 CB GLN A 954 -12.497 -9.725 -2.697 1.00 0.00 C ATOM 673 CG GLN A 954 -13.862 -10.379 -2.566 1.00 0.00 C ATOM 674 CD GLN A 954 -14.601 -10.468 -3.885 1.00 0.00 C ATOM 675 OE1 GLN A 954 -14.448 -9.610 -4.757 1.00 0.00 O ATOM 676 NE2 GLN A 954 -15.394 -11.513 -4.050 1.00 0.00 N ATOM 0 H GLN A 954 -13.387 -8.139 -1.047 1.00 0.00 H new ATOM 0 HA GLN A 954 -11.735 -10.424 -0.811 1.00 0.00 H new ATOM 0 HB2 GLN A 954 -12.606 -8.774 -3.219 1.00 0.00 H new ATOM 0 HB3 GLN A 954 -11.858 -10.356 -3.315 1.00 0.00 H new ATOM 0 HG2 GLN A 954 -13.741 -11.381 -2.154 1.00 0.00 H new ATOM 0 HG3 GLN A 954 -14.464 -9.813 -1.855 1.00 0.00 H new ATOM 0 HE21 GLN A 954 -15.493 -12.201 -3.303 1.00 0.00 H new ATOM 0 HE22 GLN A 954 -15.907 -11.631 -4.924 1.00 0.00 H new ATOM 685 N SER A 955 -10.301 -7.771 -2.190 1.00 0.00 N ATOM 686 CA SER A 955 -9.015 -7.149 -2.470 1.00 0.00 C ATOM 687 C SER A 955 -8.283 -6.808 -1.172 1.00 0.00 C ATOM 688 O SER A 955 -7.054 -6.784 -1.132 1.00 0.00 O ATOM 689 CB SER A 955 -9.229 -5.897 -3.319 1.00 0.00 C ATOM 690 OG SER A 955 -10.052 -6.192 -4.437 1.00 0.00 O ATOM 0 H SER A 955 -11.106 -7.231 -2.506 1.00 0.00 H new ATOM 0 HA SER A 955 -8.393 -7.852 -3.025 1.00 0.00 H new ATOM 0 HB2 SER A 955 -9.691 -5.115 -2.716 1.00 0.00 H new ATOM 0 HB3 SER A 955 -8.268 -5.512 -3.659 1.00 0.00 H new ATOM 0 HG SER A 955 -10.182 -5.380 -4.971 1.00 0.00 H new ATOM 696 N CYS A 956 -9.051 -6.558 -0.113 1.00 0.00 N ATOM 697 CA CYS A 956 -8.496 -6.319 1.213 1.00 0.00 C ATOM 698 C CYS A 956 -7.583 -7.462 1.631 1.00 0.00 C ATOM 699 O CYS A 956 -6.488 -7.234 2.141 1.00 0.00 O ATOM 700 CB CYS A 956 -9.623 -6.157 2.234 1.00 0.00 C ATOM 701 SG CYS A 956 -9.080 -6.195 3.955 1.00 0.00 S ATOM 0 H CYS A 956 -10.069 -6.516 -0.152 1.00 0.00 H new ATOM 0 HA CYS A 956 -7.909 -5.401 1.176 1.00 0.00 H new ATOM 0 HB2 CYS A 956 -10.133 -5.212 2.047 1.00 0.00 H new ATOM 0 HB3 CYS A 956 -10.354 -6.950 2.079 1.00 0.00 H new ATOM 0 HG CYS A 956 -9.493 -7.293 4.516 1.00 0.00 H new ATOM 707 N LYS A 957 -8.035 -8.691 1.397 1.00 0.00 N ATOM 708 CA LYS A 957 -7.263 -9.870 1.759 1.00 0.00 C ATOM 709 C LYS A 957 -5.917 -9.872 1.055 1.00 0.00 C ATOM 710 O LYS A 957 -4.883 -10.083 1.688 1.00 0.00 O ATOM 711 CB LYS A 957 -8.029 -11.148 1.424 1.00 0.00 C ATOM 712 CG LYS A 957 -9.307 -11.313 2.223 1.00 0.00 C ATOM 713 CD LYS A 957 -9.999 -12.626 1.903 1.00 0.00 C ATOM 714 CE LYS A 957 -11.269 -12.796 2.718 1.00 0.00 C ATOM 715 NZ LYS A 957 -12.247 -11.709 2.450 1.00 0.00 N ATOM 0 H LYS A 957 -8.933 -8.894 0.958 1.00 0.00 H new ATOM 0 HA LYS A 957 -7.094 -9.838 2.835 1.00 0.00 H new ATOM 0 HB2 LYS A 957 -8.271 -11.149 0.361 1.00 0.00 H new ATOM 0 HB3 LYS A 957 -7.383 -12.007 1.605 1.00 0.00 H new ATOM 0 HG2 LYS A 957 -9.079 -11.271 3.288 1.00 0.00 H new ATOM 0 HG3 LYS A 957 -9.981 -10.484 2.008 1.00 0.00 H new ATOM 0 HD2 LYS A 957 -10.239 -12.663 0.840 1.00 0.00 H new ATOM 0 HD3 LYS A 957 -9.321 -13.455 2.106 1.00 0.00 H new ATOM 0 HE2 LYS A 957 -11.724 -13.759 2.486 1.00 0.00 H new ATOM 0 HE3 LYS A 957 -11.021 -12.808 3.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 957 -13.192 -12.119 2.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 957 -12.270 -11.055 3.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 957 -11.964 -11.191 1.594 1.00 0.00 H new ATOM 729 N ALA A 958 -5.933 -9.612 -0.247 1.00 0.00 N ATOM 730 CA ALA A 958 -4.707 -9.589 -1.034 1.00 0.00 C ATOM 731 C ALA A 958 -3.750 -8.518 -0.521 1.00 0.00 C ATOM 732 O ALA A 958 -2.549 -8.752 -0.390 1.00 0.00 O ATOM 733 CB ALA A 958 -5.030 -9.363 -2.504 1.00 0.00 C ATOM 0 H ALA A 958 -6.780 -9.414 -0.779 1.00 0.00 H new ATOM 0 HA ALA A 958 -4.214 -10.555 -0.931 1.00 0.00 H new ATOM 0 HB1 ALA A 958 -4.106 -9.348 -3.081 1.00 0.00 H new ATOM 0 HB2 ALA A 958 -5.670 -10.169 -2.864 1.00 0.00 H new ATOM 0 HB3 ALA A 958 -5.546 -8.410 -2.621 1.00 0.00 H new ATOM 739 N VAL A 959 -4.293 -7.349 -0.211 1.00 0.00 N ATOM 740 CA VAL A 959 -3.495 -6.236 0.284 1.00 0.00 C ATOM 741 C VAL A 959 -2.942 -6.527 1.680 1.00 0.00 C ATOM 742 O VAL A 959 -1.751 -6.346 1.935 1.00 0.00 O ATOM 743 CB VAL A 959 -4.318 -4.929 0.323 1.00 0.00 C ATOM 744 CG1 VAL A 959 -3.505 -3.786 0.909 1.00 0.00 C ATOM 745 CG2 VAL A 959 -4.812 -4.571 -1.068 1.00 0.00 C ATOM 0 H VAL A 959 -5.289 -7.146 -0.294 1.00 0.00 H new ATOM 0 HA VAL A 959 -2.663 -6.110 -0.408 1.00 0.00 H new ATOM 0 HB VAL A 959 -5.181 -5.094 0.969 1.00 0.00 H new ATOM 0 HG11 VAL A 959 -4.110 -2.879 0.924 1.00 0.00 H new ATOM 0 HG12 VAL A 959 -3.204 -4.038 1.926 1.00 0.00 H new ATOM 0 HG13 VAL A 959 -2.618 -3.620 0.298 1.00 0.00 H new ATOM 0 HG21 VAL A 959 -5.390 -3.648 -1.023 1.00 0.00 H new ATOM 0 HG22 VAL A 959 -3.959 -4.433 -1.733 1.00 0.00 H new ATOM 0 HG23 VAL A 959 -5.442 -5.375 -1.448 1.00 0.00 H new ATOM 755 N ALA A 960 -3.805 -7.004 2.569 1.00 0.00 N ATOM 756 CA ALA A 960 -3.439 -7.219 3.967 1.00 0.00 C ATOM 757 C ALA A 960 -2.364 -8.289 4.125 1.00 0.00 C ATOM 758 O ALA A 960 -1.667 -8.323 5.138 1.00 0.00 O ATOM 759 CB ALA A 960 -4.668 -7.582 4.784 1.00 0.00 C ATOM 0 H ALA A 960 -4.769 -7.251 2.346 1.00 0.00 H new ATOM 0 HA ALA A 960 -3.021 -6.284 4.339 1.00 0.00 H new ATOM 0 HB1 ALA A 960 -4.380 -7.739 5.824 1.00 0.00 H new ATOM 0 HB2 ALA A 960 -5.395 -6.772 4.727 1.00 0.00 H new ATOM 0 HB3 ALA A 960 -5.111 -8.496 4.388 1.00 0.00 H new ATOM 765 N GLU A 961 -2.224 -9.160 3.136 1.00 0.00 N ATOM 766 CA GLU A 961 -1.201 -10.198 3.186 1.00 0.00 C ATOM 767 C GLU A 961 0.125 -9.683 2.633 1.00 0.00 C ATOM 768 O GLU A 961 1.178 -10.284 2.851 1.00 0.00 O ATOM 769 CB GLU A 961 -1.649 -11.435 2.410 1.00 0.00 C ATOM 770 CG GLU A 961 -2.912 -12.079 2.959 1.00 0.00 C ATOM 771 CD GLU A 961 -2.788 -12.470 4.417 1.00 0.00 C ATOM 772 OE1 GLU A 961 -1.996 -13.386 4.724 1.00 0.00 O ATOM 773 OE2 GLU A 961 -3.487 -11.867 5.260 1.00 0.00 O ATOM 0 H GLU A 961 -2.800 -9.170 2.295 1.00 0.00 H new ATOM 0 HA GLU A 961 -1.056 -10.474 4.230 1.00 0.00 H new ATOM 0 HB2 GLU A 961 -1.816 -11.159 1.369 1.00 0.00 H new ATOM 0 HB3 GLU A 961 -0.844 -12.170 2.419 1.00 0.00 H new ATOM 0 HG2 GLU A 961 -3.746 -11.387 2.843 1.00 0.00 H new ATOM 0 HG3 GLU A 961 -3.148 -12.965 2.369 1.00 0.00 H new ATOM 780 N GLN A 962 0.073 -8.564 1.924 1.00 0.00 N ATOM 781 CA GLN A 962 1.273 -7.970 1.346 1.00 0.00 C ATOM 782 C GLN A 962 1.846 -6.898 2.275 1.00 0.00 C ATOM 783 O GLN A 962 3.036 -6.588 2.223 1.00 0.00 O ATOM 784 CB GLN A 962 0.960 -7.369 -0.027 1.00 0.00 C ATOM 785 CG GLN A 962 0.488 -8.387 -1.054 1.00 0.00 C ATOM 786 CD GLN A 962 1.545 -9.418 -1.402 1.00 0.00 C ATOM 787 OE1 GLN A 962 2.743 -9.138 -1.364 1.00 0.00 O ATOM 788 NE2 GLN A 962 1.110 -10.620 -1.745 1.00 0.00 N ATOM 0 H GLN A 962 -0.786 -8.048 1.735 1.00 0.00 H new ATOM 0 HA GLN A 962 2.020 -8.755 1.224 1.00 0.00 H new ATOM 0 HB2 GLN A 962 0.193 -6.603 0.089 1.00 0.00 H new ATOM 0 HB3 GLN A 962 1.853 -6.872 -0.407 1.00 0.00 H new ATOM 0 HG2 GLN A 962 -0.396 -8.897 -0.671 1.00 0.00 H new ATOM 0 HG3 GLN A 962 0.186 -7.865 -1.962 1.00 0.00 H new ATOM 0 HE21 GLN A 962 0.109 -10.814 -1.765 1.00 0.00 H new ATOM 0 HE22 GLN A 962 1.776 -11.353 -1.990 1.00 0.00 H new ATOM 797 N ILE A 963 0.988 -6.348 3.132 1.00 0.00 N ATOM 798 CA ILE A 963 1.392 -5.321 4.096 1.00 0.00 C ATOM 799 C ILE A 963 2.558 -5.782 4.991 1.00 0.00 C ATOM 800 O ILE A 963 3.563 -5.076 5.098 1.00 0.00 O ATOM 801 CB ILE A 963 0.207 -4.869 4.985 1.00 0.00 C ATOM 802 CG1 ILE A 963 -0.889 -4.229 4.128 1.00 0.00 C ATOM 803 CG2 ILE A 963 0.678 -3.896 6.059 1.00 0.00 C ATOM 804 CD1 ILE A 963 -2.114 -3.812 4.913 1.00 0.00 C ATOM 0 H ILE A 963 0.000 -6.598 3.180 1.00 0.00 H new ATOM 0 HA ILE A 963 1.732 -4.473 3.501 1.00 0.00 H new ATOM 0 HB ILE A 963 -0.206 -5.749 5.478 1.00 0.00 H new ATOM 0 HG12 ILE A 963 -0.478 -3.355 3.623 1.00 0.00 H new ATOM 0 HG13 ILE A 963 -1.189 -4.934 3.352 1.00 0.00 H new ATOM 0 HG21 ILE A 963 -0.171 -3.592 6.672 1.00 0.00 H new ATOM 0 HG22 ILE A 963 1.424 -4.382 6.688 1.00 0.00 H new ATOM 0 HG23 ILE A 963 1.118 -3.018 5.587 1.00 0.00 H new ATOM 0 HD11 ILE A 963 -2.845 -3.367 4.238 1.00 0.00 H new ATOM 0 HD12 ILE A 963 -2.551 -4.686 5.397 1.00 0.00 H new ATOM 0 HD13 ILE A 963 -1.829 -3.082 5.671 1.00 0.00 H new ATOM 816 N PRO A 964 2.455 -6.959 5.655 1.00 0.00 N ATOM 817 CA PRO A 964 3.530 -7.470 6.514 1.00 0.00 C ATOM 818 C PRO A 964 4.854 -7.614 5.769 1.00 0.00 C ATOM 819 O PRO A 964 5.921 -7.456 6.355 1.00 0.00 O ATOM 820 CB PRO A 964 3.024 -8.844 6.978 1.00 0.00 C ATOM 821 CG PRO A 964 1.903 -9.181 6.058 1.00 0.00 C ATOM 822 CD PRO A 964 1.298 -7.871 5.649 1.00 0.00 C ATOM 0 HA PRO A 964 3.737 -6.786 7.337 1.00 0.00 H new ATOM 0 HB2 PRO A 964 3.815 -9.593 6.925 1.00 0.00 H new ATOM 0 HB3 PRO A 964 2.686 -8.809 8.014 1.00 0.00 H new ATOM 0 HG2 PRO A 964 2.263 -9.733 5.190 1.00 0.00 H new ATOM 0 HG3 PRO A 964 1.167 -9.813 6.555 1.00 0.00 H new ATOM 0 HD2 PRO A 964 0.835 -7.930 4.664 1.00 0.00 H new ATOM 0 HD3 PRO A 964 0.525 -7.548 6.346 1.00 0.00 H new ATOM 830 N LEU A 965 4.774 -7.893 4.469 1.00 0.00 N ATOM 831 CA LEU A 965 5.965 -8.039 3.644 1.00 0.00 C ATOM 832 C LEU A 965 6.689 -6.707 3.506 1.00 0.00 C ATOM 833 O LEU A 965 7.918 -6.656 3.547 1.00 0.00 O ATOM 834 CB LEU A 965 5.603 -8.589 2.264 1.00 0.00 C ATOM 835 CG LEU A 965 5.087 -10.028 2.260 1.00 0.00 C ATOM 836 CD1 LEU A 965 4.755 -10.469 0.845 1.00 0.00 C ATOM 837 CD2 LEU A 965 6.115 -10.960 2.883 1.00 0.00 C ATOM 0 H LEU A 965 3.895 -8.022 3.967 1.00 0.00 H new ATOM 0 HA LEU A 965 6.632 -8.748 4.135 1.00 0.00 H new ATOM 0 HB2 LEU A 965 4.844 -7.945 1.820 1.00 0.00 H new ATOM 0 HB3 LEU A 965 6.483 -8.532 1.624 1.00 0.00 H new ATOM 0 HG LEU A 965 4.175 -10.072 2.856 1.00 0.00 H new ATOM 0 HD11 LEU A 965 4.389 -11.496 0.860 1.00 0.00 H new ATOM 0 HD12 LEU A 965 3.987 -9.816 0.431 1.00 0.00 H new ATOM 0 HD13 LEU A 965 5.651 -10.412 0.227 1.00 0.00 H new ATOM 0 HD21 LEU A 965 5.734 -11.981 2.873 1.00 0.00 H new ATOM 0 HD22 LEU A 965 7.042 -10.913 2.311 1.00 0.00 H new ATOM 0 HD23 LEU A 965 6.307 -10.654 3.911 1.00 0.00 H new ATOM 849 N LEU A 966 5.919 -5.633 3.355 1.00 0.00 N ATOM 850 CA LEU A 966 6.484 -4.289 3.305 1.00 0.00 C ATOM 851 C LEU A 966 7.269 -4.012 4.573 1.00 0.00 C ATOM 852 O LEU A 966 8.463 -3.729 4.532 1.00 0.00 O ATOM 853 CB LEU A 966 5.386 -3.233 3.175 1.00 0.00 C ATOM 854 CG LEU A 966 4.557 -3.281 1.900 1.00 0.00 C ATOM 855 CD1 LEU A 966 3.464 -2.226 1.960 1.00 0.00 C ATOM 856 CD2 LEU A 966 5.441 -3.063 0.682 1.00 0.00 C ATOM 0 H LEU A 966 4.904 -5.668 3.265 1.00 0.00 H new ATOM 0 HA LEU A 966 7.137 -4.236 2.434 1.00 0.00 H new ATOM 0 HB2 LEU A 966 4.712 -3.332 4.026 1.00 0.00 H new ATOM 0 HB3 LEU A 966 5.847 -2.248 3.247 1.00 0.00 H new ATOM 0 HG LEU A 966 4.096 -4.265 1.813 1.00 0.00 H new ATOM 0 HD11 LEU A 966 2.872 -2.263 1.045 1.00 0.00 H new ATOM 0 HD12 LEU A 966 2.819 -2.418 2.818 1.00 0.00 H new ATOM 0 HD13 LEU A 966 3.916 -1.239 2.060 1.00 0.00 H new ATOM 0 HD21 LEU A 966 4.832 -3.100 -0.221 1.00 0.00 H new ATOM 0 HD22 LEU A 966 5.925 -2.089 0.753 1.00 0.00 H new ATOM 0 HD23 LEU A 966 6.201 -3.843 0.640 1.00 0.00 H new ATOM 868 N VAL A 967 6.580 -4.129 5.700 1.00 0.00 N ATOM 869 CA VAL A 967 7.160 -3.823 7.001 1.00 0.00 C ATOM 870 C VAL A 967 8.340 -4.741 7.308 1.00 0.00 C ATOM 871 O VAL A 967 9.341 -4.305 7.880 1.00 0.00 O ATOM 872 CB VAL A 967 6.099 -3.929 8.114 1.00 0.00 C ATOM 873 CG1 VAL A 967 6.680 -3.531 9.463 1.00 0.00 C ATOM 874 CG2 VAL A 967 4.892 -3.068 7.771 1.00 0.00 C ATOM 0 H VAL A 967 5.608 -4.437 5.739 1.00 0.00 H new ATOM 0 HA VAL A 967 7.525 -2.797 6.966 1.00 0.00 H new ATOM 0 HB VAL A 967 5.778 -4.968 8.185 1.00 0.00 H new ATOM 0 HG11 VAL A 967 5.910 -3.615 10.230 1.00 0.00 H new ATOM 0 HG12 VAL A 967 7.512 -4.191 9.710 1.00 0.00 H new ATOM 0 HG13 VAL A 967 7.035 -2.502 9.417 1.00 0.00 H new ATOM 0 HG21 VAL A 967 4.149 -3.151 8.564 1.00 0.00 H new ATOM 0 HG22 VAL A 967 5.203 -2.028 7.672 1.00 0.00 H new ATOM 0 HG23 VAL A 967 4.458 -3.408 6.831 1.00 0.00 H new ATOM 884 N GLN A 968 8.230 -6.005 6.912 1.00 0.00 N ATOM 885 CA GLN A 968 9.326 -6.951 7.075 1.00 0.00 C ATOM 886 C GLN A 968 10.534 -6.486 6.272 1.00 0.00 C ATOM 887 O GLN A 968 11.666 -6.516 6.757 1.00 0.00 O ATOM 888 CB GLN A 968 8.905 -8.350 6.621 1.00 0.00 C ATOM 889 CG GLN A 968 9.951 -9.417 6.889 1.00 0.00 C ATOM 890 CD GLN A 968 9.569 -10.763 6.311 1.00 0.00 C ATOM 891 OE1 GLN A 968 9.907 -11.079 5.173 1.00 0.00 O ATOM 892 NE2 GLN A 968 8.869 -11.566 7.092 1.00 0.00 N ATOM 0 H GLN A 968 7.395 -6.396 6.477 1.00 0.00 H new ATOM 0 HA GLN A 968 9.591 -6.996 8.131 1.00 0.00 H new ATOM 0 HB2 GLN A 968 7.980 -8.624 7.128 1.00 0.00 H new ATOM 0 HB3 GLN A 968 8.688 -8.326 5.553 1.00 0.00 H new ATOM 0 HG2 GLN A 968 10.904 -9.101 6.465 1.00 0.00 H new ATOM 0 HG3 GLN A 968 10.097 -9.516 7.965 1.00 0.00 H new ATOM 0 HE21 GLN A 968 8.609 -11.265 8.031 1.00 0.00 H new ATOM 0 HE22 GLN A 968 8.589 -12.487 6.756 1.00 0.00 H new ATOM 901 N GLY A 969 10.278 -6.045 5.044 1.00 0.00 N ATOM 902 CA GLY A 969 11.332 -5.498 4.213 1.00 0.00 C ATOM 903 C GLY A 969 11.957 -4.263 4.832 1.00 0.00 C ATOM 904 O GLY A 969 13.182 -4.129 4.860 1.00 0.00 O ATOM 0 H GLY A 969 9.355 -6.058 4.610 1.00 0.00 H new ATOM 0 HA2 GLY A 969 12.101 -6.255 4.057 1.00 0.00 H new ATOM 0 HA3 GLY A 969 10.928 -5.248 3.232 1.00 0.00 H new ATOM 908 N VAL A 970 11.111 -3.365 5.339 1.00 0.00 N ATOM 909 CA VAL A 970 11.584 -2.155 6.012 1.00 0.00 C ATOM 910 C VAL A 970 12.501 -2.522 7.176 1.00 0.00 C ATOM 911 O VAL A 970 13.603 -1.990 7.306 1.00 0.00 O ATOM 912 CB VAL A 970 10.420 -1.293 6.557 1.00 0.00 C ATOM 913 CG1 VAL A 970 10.944 0.028 7.093 1.00 0.00 C ATOM 914 CG2 VAL A 970 9.362 -1.043 5.491 1.00 0.00 C ATOM 0 H VAL A 970 10.096 -3.453 5.296 1.00 0.00 H new ATOM 0 HA VAL A 970 12.125 -1.573 5.266 1.00 0.00 H new ATOM 0 HB VAL A 970 9.952 -1.848 7.370 1.00 0.00 H new ATOM 0 HG11 VAL A 970 10.113 0.622 7.472 1.00 0.00 H new ATOM 0 HG12 VAL A 970 11.652 -0.162 7.900 1.00 0.00 H new ATOM 0 HG13 VAL A 970 11.444 0.573 6.292 1.00 0.00 H new ATOM 0 HG21 VAL A 970 8.560 -0.435 5.910 1.00 0.00 H new ATOM 0 HG22 VAL A 970 9.812 -0.520 4.647 1.00 0.00 H new ATOM 0 HG23 VAL A 970 8.955 -1.996 5.152 1.00 0.00 H new ATOM 924 N ARG A 971 12.037 -3.452 8.008 1.00 0.00 N ATOM 925 CA ARG A 971 12.815 -3.924 9.149 1.00 0.00 C ATOM 926 C ARG A 971 14.130 -4.539 8.691 1.00 0.00 C ATOM 927 O ARG A 971 15.174 -4.309 9.297 1.00 0.00 O ATOM 928 CB ARG A 971 12.022 -4.953 9.955 1.00 0.00 C ATOM 929 CG ARG A 971 10.858 -4.365 10.734 1.00 0.00 C ATOM 930 CD ARG A 971 10.156 -5.427 11.564 1.00 0.00 C ATOM 931 NE ARG A 971 11.092 -6.150 12.423 1.00 0.00 N ATOM 932 CZ ARG A 971 10.736 -6.890 13.468 1.00 0.00 C ATOM 933 NH1 ARG A 971 9.460 -6.968 13.835 1.00 0.00 N ATOM 934 NH2 ARG A 971 11.662 -7.540 14.155 1.00 0.00 N ATOM 0 H ARG A 971 11.123 -3.894 7.912 1.00 0.00 H new ATOM 0 HA ARG A 971 13.030 -3.064 9.783 1.00 0.00 H new ATOM 0 HB2 ARG A 971 11.642 -5.717 9.276 1.00 0.00 H new ATOM 0 HB3 ARG A 971 12.696 -5.452 10.651 1.00 0.00 H new ATOM 0 HG2 ARG A 971 11.219 -3.570 11.387 1.00 0.00 H new ATOM 0 HG3 ARG A 971 10.147 -3.912 10.043 1.00 0.00 H new ATOM 0 HD2 ARG A 971 9.386 -4.959 12.178 1.00 0.00 H new ATOM 0 HD3 ARG A 971 9.652 -6.131 10.902 1.00 0.00 H new ATOM 0 HE ARG A 971 12.086 -6.082 12.206 1.00 0.00 H new ATOM 0 HH11 ARG A 971 8.747 -6.458 13.313 1.00 0.00 H new ATOM 0 HH12 ARG A 971 9.194 -7.538 14.638 1.00 0.00 H new ATOM 0 HH21 ARG A 971 12.642 -7.471 13.881 1.00 0.00 H new ATOM 0 HH22 ARG A 971 11.395 -8.110 14.958 1.00 0.00 H new ATOM 948 N GLY A 972 14.068 -5.317 7.617 1.00 0.00 N ATOM 949 CA GLY A 972 15.259 -5.938 7.075 1.00 0.00 C ATOM 950 C GLY A 972 16.294 -4.920 6.644 1.00 0.00 C ATOM 951 O GLY A 972 17.478 -5.066 6.939 1.00 0.00 O ATOM 0 H GLY A 972 13.209 -5.529 7.110 1.00 0.00 H new ATOM 0 HA2 GLY A 972 15.694 -6.600 7.824 1.00 0.00 H new ATOM 0 HA3 GLY A 972 14.986 -6.559 6.222 1.00 0.00 H new ATOM 955 N SER A 973 15.839 -3.868 5.971 1.00 0.00 N ATOM 956 CA SER A 973 16.734 -2.834 5.470 1.00 0.00 C ATOM 957 C SER A 973 17.266 -1.962 6.611 1.00 0.00 C ATOM 958 O SER A 973 18.250 -1.238 6.445 1.00 0.00 O ATOM 959 CB SER A 973 16.007 -1.969 4.436 1.00 0.00 C ATOM 960 OG SER A 973 16.892 -1.055 3.812 1.00 0.00 O ATOM 0 H SER A 973 14.854 -3.710 5.760 1.00 0.00 H new ATOM 0 HA SER A 973 17.586 -3.321 4.995 1.00 0.00 H new ATOM 0 HB2 SER A 973 15.550 -2.609 3.681 1.00 0.00 H new ATOM 0 HB3 SER A 973 15.199 -1.422 4.921 1.00 0.00 H new ATOM 0 HG SER A 973 17.665 -0.899 4.394 1.00 0.00 H new ATOM 966 N GLN A 974 16.609 -2.020 7.763 1.00 0.00 N ATOM 967 CA GLN A 974 17.072 -1.286 8.933 1.00 0.00 C ATOM 968 C GLN A 974 18.024 -2.137 9.764 1.00 0.00 C ATOM 969 O GLN A 974 19.000 -1.630 10.317 1.00 0.00 O ATOM 970 CB GLN A 974 15.892 -0.822 9.787 1.00 0.00 C ATOM 971 CG GLN A 974 15.040 0.242 9.115 1.00 0.00 C ATOM 972 CD GLN A 974 14.004 0.836 10.044 1.00 0.00 C ATOM 973 OE1 GLN A 974 14.195 0.886 11.260 1.00 0.00 O ATOM 974 NE2 GLN A 974 12.913 1.313 9.478 1.00 0.00 N ATOM 0 H GLN A 974 15.759 -2.564 7.911 1.00 0.00 H new ATOM 0 HA GLN A 974 17.611 -0.405 8.584 1.00 0.00 H new ATOM 0 HB2 GLN A 974 15.265 -1.682 10.025 1.00 0.00 H new ATOM 0 HB3 GLN A 974 16.269 -0.431 10.732 1.00 0.00 H new ATOM 0 HG2 GLN A 974 15.686 1.037 8.743 1.00 0.00 H new ATOM 0 HG3 GLN A 974 14.539 -0.193 8.250 1.00 0.00 H new ATOM 0 HE21 GLN A 974 12.794 1.251 8.467 1.00 0.00 H new ATOM 0 HE22 GLN A 974 12.188 1.744 10.051 1.00 0.00 H new ATOM 983 N ALA A 975 17.731 -3.429 9.853 1.00 0.00 N ATOM 984 CA ALA A 975 18.603 -4.362 10.553 1.00 0.00 C ATOM 985 C ALA A 975 19.889 -4.574 9.764 1.00 0.00 C ATOM 986 O ALA A 975 20.972 -4.714 10.335 1.00 0.00 O ATOM 987 CB ALA A 975 17.891 -5.686 10.781 1.00 0.00 C ATOM 0 H ALA A 975 16.896 -3.854 9.449 1.00 0.00 H new ATOM 0 HA ALA A 975 18.858 -3.939 11.525 1.00 0.00 H new ATOM 0 HB1 ALA A 975 18.557 -6.372 11.305 1.00 0.00 H new ATOM 0 HB2 ALA A 975 16.996 -5.519 11.381 1.00 0.00 H new ATOM 0 HB3 ALA A 975 17.609 -6.117 9.821 1.00 0.00 H new ATOM 993 N GLN A 976 19.754 -4.597 8.447 1.00 0.00 N ATOM 994 CA GLN A 976 20.894 -4.691 7.551 1.00 0.00 C ATOM 995 C GLN A 976 20.881 -3.519 6.574 1.00 0.00 C ATOM 996 O GLN A 976 20.300 -3.614 5.493 1.00 0.00 O ATOM 997 CB GLN A 976 20.864 -6.012 6.781 1.00 0.00 C ATOM 998 CG GLN A 976 21.016 -7.246 7.656 1.00 0.00 C ATOM 999 CD GLN A 976 20.776 -8.531 6.887 1.00 0.00 C ATOM 1000 OE1 GLN A 976 19.982 -8.564 5.948 1.00 0.00 O ATOM 1001 NE2 GLN A 976 21.463 -9.595 7.274 1.00 0.00 N ATOM 0 H GLN A 976 18.853 -4.551 7.971 1.00 0.00 H new ATOM 0 HA GLN A 976 21.808 -4.656 8.144 1.00 0.00 H new ATOM 0 HB2 GLN A 976 19.923 -6.081 6.236 1.00 0.00 H new ATOM 0 HB3 GLN A 976 21.663 -6.006 6.039 1.00 0.00 H new ATOM 0 HG2 GLN A 976 22.018 -7.264 8.084 1.00 0.00 H new ATOM 0 HG3 GLN A 976 20.315 -7.187 8.488 1.00 0.00 H new ATOM 0 HE21 GLN A 976 22.112 -9.526 8.058 1.00 0.00 H new ATOM 0 HE22 GLN A 976 21.343 -10.484 6.788 1.00 0.00 H new ATOM 1010 N PRO A 977 21.492 -2.385 6.958 1.00 0.00 N ATOM 1011 CA PRO A 977 21.523 -1.175 6.125 1.00 0.00 C ATOM 1012 C PRO A 977 22.286 -1.388 4.821 1.00 0.00 C ATOM 1013 O PRO A 977 22.042 -0.708 3.823 1.00 0.00 O ATOM 1014 CB PRO A 977 22.244 -0.143 7.004 1.00 0.00 C ATOM 1015 CG PRO A 977 22.177 -0.692 8.388 1.00 0.00 C ATOM 1016 CD PRO A 977 22.188 -2.185 8.238 1.00 0.00 C ATOM 0 HA PRO A 977 20.521 -0.868 5.824 1.00 0.00 H new ATOM 0 HB2 PRO A 977 23.277 -0.007 6.684 1.00 0.00 H new ATOM 0 HB3 PRO A 977 21.760 0.832 6.943 1.00 0.00 H new ATOM 0 HG2 PRO A 977 23.024 -0.353 8.984 1.00 0.00 H new ATOM 0 HG3 PRO A 977 21.274 -0.357 8.898 1.00 0.00 H new ATOM 0 HD2 PRO A 977 23.203 -2.582 8.214 1.00 0.00 H new ATOM 0 HD3 PRO A 977 21.672 -2.679 9.061 1.00 0.00 H new ATOM 1024 N ASP A 978 23.200 -2.346 4.831 1.00 0.00 N ATOM 1025 CA ASP A 978 23.984 -2.670 3.654 1.00 0.00 C ATOM 1026 C ASP A 978 23.893 -4.158 3.381 1.00 0.00 C ATOM 1027 O ASP A 978 24.752 -4.939 3.794 1.00 0.00 O ATOM 1028 CB ASP A 978 25.447 -2.245 3.822 1.00 0.00 C ATOM 1029 CG ASP A 978 26.275 -2.507 2.576 1.00 0.00 C ATOM 1030 OD1 ASP A 978 26.161 -1.724 1.610 1.00 0.00 O ATOM 1031 OD2 ASP A 978 27.049 -3.488 2.558 1.00 0.00 O ATOM 0 H ASP A 978 23.417 -2.915 5.649 1.00 0.00 H new ATOM 0 HA ASP A 978 23.578 -2.119 2.806 1.00 0.00 H new ATOM 0 HB2 ASP A 978 25.488 -1.183 4.065 1.00 0.00 H new ATOM 0 HB3 ASP A 978 25.884 -2.782 4.664 1.00 0.00 H new ATOM 1036 N SER A 979 22.803 -4.551 2.755 1.00 0.00 N ATOM 1037 CA SER A 979 22.593 -5.934 2.371 1.00 0.00 C ATOM 1038 C SER A 979 21.692 -6.003 1.151 1.00 0.00 C ATOM 1039 O SER A 979 20.548 -5.544 1.189 1.00 0.00 O ATOM 1040 CB SER A 979 21.971 -6.723 3.525 1.00 0.00 C ATOM 1041 OG SER A 979 21.794 -8.087 3.178 1.00 0.00 O ATOM 0 H SER A 979 22.040 -3.925 2.498 1.00 0.00 H new ATOM 0 HA SER A 979 23.559 -6.377 2.128 1.00 0.00 H new ATOM 0 HB2 SER A 979 22.610 -6.649 4.405 1.00 0.00 H new ATOM 0 HB3 SER A 979 21.009 -6.285 3.791 1.00 0.00 H new ATOM 0 HG SER A 979 21.397 -8.568 3.934 1.00 0.00 H new ATOM 1047 N PRO A 980 22.198 -6.571 0.047 1.00 0.00 N ATOM 1048 CA PRO A 980 21.423 -6.733 -1.182 1.00 0.00 C ATOM 1049 C PRO A 980 20.202 -7.619 -0.961 1.00 0.00 C ATOM 1050 O PRO A 980 19.174 -7.455 -1.616 1.00 0.00 O ATOM 1051 CB PRO A 980 22.406 -7.391 -2.157 1.00 0.00 C ATOM 1052 CG PRO A 980 23.486 -7.962 -1.305 1.00 0.00 C ATOM 1053 CD PRO A 980 23.567 -7.090 -0.088 1.00 0.00 C ATOM 0 HA PRO A 980 21.032 -5.785 -1.551 1.00 0.00 H new ATOM 0 HB2 PRO A 980 21.916 -8.168 -2.744 1.00 0.00 H new ATOM 0 HB3 PRO A 980 22.806 -6.663 -2.863 1.00 0.00 H new ATOM 0 HG2 PRO A 980 23.261 -8.993 -1.031 1.00 0.00 H new ATOM 0 HG3 PRO A 980 24.436 -7.974 -1.838 1.00 0.00 H new ATOM 0 HD2 PRO A 980 23.872 -7.655 0.793 1.00 0.00 H new ATOM 0 HD3 PRO A 980 24.291 -6.286 -0.217 1.00 0.00 H new ATOM 1061 N SER A 981 20.313 -8.539 -0.009 1.00 0.00 N ATOM 1062 CA SER A 981 19.206 -9.410 0.342 1.00 0.00 C ATOM 1063 C SER A 981 18.057 -8.590 0.920 1.00 0.00 C ATOM 1064 O SER A 981 16.908 -8.739 0.508 1.00 0.00 O ATOM 1065 CB SER A 981 19.669 -10.463 1.347 1.00 0.00 C ATOM 1066 OG SER A 981 20.777 -11.191 0.839 1.00 0.00 O ATOM 0 H SER A 981 21.162 -8.698 0.533 1.00 0.00 H new ATOM 0 HA SER A 981 18.853 -9.916 -0.556 1.00 0.00 H new ATOM 0 HB2 SER A 981 19.944 -9.981 2.285 1.00 0.00 H new ATOM 0 HB3 SER A 981 18.849 -11.147 1.568 1.00 0.00 H new ATOM 0 HG SER A 981 21.059 -11.859 1.498 1.00 0.00 H new ATOM 1072 N ALA A 982 18.385 -7.703 1.855 1.00 0.00 N ATOM 1073 CA ALA A 982 17.396 -6.821 2.456 1.00 0.00 C ATOM 1074 C ALA A 982 16.851 -5.849 1.416 1.00 0.00 C ATOM 1075 O ALA A 982 15.650 -5.574 1.377 1.00 0.00 O ATOM 1076 CB ALA A 982 18.006 -6.065 3.627 1.00 0.00 C ATOM 0 H ALA A 982 19.332 -7.578 2.212 1.00 0.00 H new ATOM 0 HA ALA A 982 16.569 -7.425 2.829 1.00 0.00 H new ATOM 0 HB1 ALA A 982 17.255 -5.409 4.067 1.00 0.00 H new ATOM 0 HB2 ALA A 982 18.352 -6.775 4.378 1.00 0.00 H new ATOM 0 HB3 ALA A 982 18.848 -5.469 3.276 1.00 0.00 H new ATOM 1082 N GLN A 983 17.747 -5.347 0.570 1.00 0.00 N ATOM 1083 CA GLN A 983 17.371 -4.448 -0.513 1.00 0.00 C ATOM 1084 C GLN A 983 16.343 -5.097 -1.430 1.00 0.00 C ATOM 1085 O GLN A 983 15.215 -4.620 -1.539 1.00 0.00 O ATOM 1086 CB GLN A 983 18.605 -4.036 -1.321 1.00 0.00 C ATOM 1087 CG GLN A 983 19.512 -3.066 -0.585 1.00 0.00 C ATOM 1088 CD GLN A 983 20.808 -2.798 -1.320 1.00 0.00 C ATOM 1089 OE1 GLN A 983 21.801 -3.506 -1.138 1.00 0.00 O ATOM 1090 NE2 GLN A 983 20.816 -1.764 -2.140 1.00 0.00 N ATOM 0 H GLN A 983 18.745 -5.551 0.616 1.00 0.00 H new ATOM 0 HA GLN A 983 16.924 -3.558 -0.069 1.00 0.00 H new ATOM 0 HB2 GLN A 983 19.174 -4.928 -1.581 1.00 0.00 H new ATOM 0 HB3 GLN A 983 18.282 -3.581 -2.257 1.00 0.00 H new ATOM 0 HG2 GLN A 983 18.984 -2.124 -0.436 1.00 0.00 H new ATOM 0 HG3 GLN A 983 19.737 -3.466 0.404 1.00 0.00 H new ATOM 0 HE21 GLN A 983 19.973 -1.204 -2.262 1.00 0.00 H new ATOM 0 HE22 GLN A 983 21.666 -1.525 -2.652 1.00 0.00 H new ATOM 1099 N LEU A 984 16.726 -6.202 -2.064 1.00 0.00 N ATOM 1100 CA LEU A 984 15.844 -6.891 -3.000 1.00 0.00 C ATOM 1101 C LEU A 984 14.568 -7.364 -2.318 1.00 0.00 C ATOM 1102 O LEU A 984 13.510 -7.386 -2.937 1.00 0.00 O ATOM 1103 CB LEU A 984 16.556 -8.073 -3.668 1.00 0.00 C ATOM 1104 CG LEU A 984 17.343 -7.740 -4.944 1.00 0.00 C ATOM 1105 CD1 LEU A 984 16.427 -7.127 -5.992 1.00 0.00 C ATOM 1106 CD2 LEU A 984 18.504 -6.806 -4.642 1.00 0.00 C ATOM 0 H LEU A 984 17.640 -6.639 -1.947 1.00 0.00 H new ATOM 0 HA LEU A 984 15.572 -6.171 -3.772 1.00 0.00 H new ATOM 0 HB2 LEU A 984 17.241 -8.516 -2.946 1.00 0.00 H new ATOM 0 HB3 LEU A 984 15.812 -8.832 -3.909 1.00 0.00 H new ATOM 0 HG LEU A 984 17.751 -8.670 -5.340 1.00 0.00 H new ATOM 0 HD11 LEU A 984 17.002 -6.898 -6.889 1.00 0.00 H new ATOM 0 HD12 LEU A 984 15.634 -7.833 -6.240 1.00 0.00 H new ATOM 0 HD13 LEU A 984 15.987 -6.210 -5.599 1.00 0.00 H new ATOM 0 HD21 LEU A 984 19.044 -6.587 -5.563 1.00 0.00 H new ATOM 0 HD22 LEU A 984 18.123 -5.878 -4.215 1.00 0.00 H new ATOM 0 HD23 LEU A 984 19.179 -7.282 -3.931 1.00 0.00 H new ATOM 1118 N ALA A 985 14.667 -7.729 -1.043 1.00 0.00 N ATOM 1119 CA ALA A 985 13.494 -8.141 -0.280 1.00 0.00 C ATOM 1120 C ALA A 985 12.479 -7.007 -0.202 1.00 0.00 C ATOM 1121 O ALA A 985 11.298 -7.199 -0.486 1.00 0.00 O ATOM 1122 CB ALA A 985 13.890 -8.591 1.118 1.00 0.00 C ATOM 0 H ALA A 985 15.542 -7.748 -0.519 1.00 0.00 H new ATOM 0 HA ALA A 985 13.034 -8.984 -0.796 1.00 0.00 H new ATOM 0 HB1 ALA A 985 12.999 -8.894 1.669 1.00 0.00 H new ATOM 0 HB2 ALA A 985 14.577 -9.434 1.048 1.00 0.00 H new ATOM 0 HB3 ALA A 985 14.378 -7.768 1.641 1.00 0.00 H new ATOM 1128 N LEU A 986 12.954 -5.822 0.165 1.00 0.00 N ATOM 1129 CA LEU A 986 12.097 -4.649 0.271 1.00 0.00 C ATOM 1130 C LEU A 986 11.576 -4.262 -1.112 1.00 0.00 C ATOM 1131 O LEU A 986 10.387 -3.991 -1.283 1.00 0.00 O ATOM 1132 CB LEU A 986 12.874 -3.481 0.897 1.00 0.00 C ATOM 1133 CG LEU A 986 12.068 -2.557 1.821 1.00 0.00 C ATOM 1134 CD1 LEU A 986 12.974 -1.498 2.428 1.00 0.00 C ATOM 1135 CD2 LEU A 986 10.913 -1.899 1.081 1.00 0.00 C ATOM 0 H LEU A 986 13.933 -5.649 0.395 1.00 0.00 H new ATOM 0 HA LEU A 986 11.249 -4.884 0.914 1.00 0.00 H new ATOM 0 HB2 LEU A 986 13.711 -3.889 1.464 1.00 0.00 H new ATOM 0 HB3 LEU A 986 13.297 -2.879 0.093 1.00 0.00 H new ATOM 0 HG LEU A 986 11.648 -3.168 2.620 1.00 0.00 H new ATOM 0 HD11 LEU A 986 12.389 -0.850 3.081 1.00 0.00 H new ATOM 0 HD12 LEU A 986 13.761 -1.981 3.007 1.00 0.00 H new ATOM 0 HD13 LEU A 986 13.422 -0.903 1.632 1.00 0.00 H new ATOM 0 HD21 LEU A 986 10.364 -1.252 1.765 1.00 0.00 H new ATOM 0 HD22 LEU A 986 11.302 -1.305 0.254 1.00 0.00 H new ATOM 0 HD23 LEU A 986 10.244 -2.668 0.693 1.00 0.00 H new ATOM 1147 N ILE A 987 12.473 -4.256 -2.094 1.00 0.00 N ATOM 1148 CA ILE A 987 12.118 -3.917 -3.470 1.00 0.00 C ATOM 1149 C ILE A 987 11.029 -4.850 -3.999 1.00 0.00 C ATOM 1150 O ILE A 987 9.999 -4.395 -4.503 1.00 0.00 O ATOM 1151 CB ILE A 987 13.356 -3.984 -4.399 1.00 0.00 C ATOM 1152 CG1 ILE A 987 14.419 -2.984 -3.934 1.00 0.00 C ATOM 1153 CG2 ILE A 987 12.960 -3.706 -5.843 1.00 0.00 C ATOM 1154 CD1 ILE A 987 15.765 -3.161 -4.604 1.00 0.00 C ATOM 0 H ILE A 987 13.458 -4.484 -1.961 1.00 0.00 H new ATOM 0 HA ILE A 987 11.738 -2.895 -3.466 1.00 0.00 H new ATOM 0 HB ILE A 987 13.774 -4.989 -4.348 1.00 0.00 H new ATOM 0 HG12 ILE A 987 14.060 -1.973 -4.125 1.00 0.00 H new ATOM 0 HG13 ILE A 987 14.546 -3.079 -2.856 1.00 0.00 H new ATOM 0 HG21 ILE A 987 13.844 -3.758 -6.479 1.00 0.00 H new ATOM 0 HG22 ILE A 987 12.233 -4.449 -6.170 1.00 0.00 H new ATOM 0 HG23 ILE A 987 12.519 -2.712 -5.914 1.00 0.00 H new ATOM 0 HD11 ILE A 987 16.463 -2.416 -4.221 1.00 0.00 H new ATOM 0 HD12 ILE A 987 16.148 -4.159 -4.393 1.00 0.00 H new ATOM 0 HD13 ILE A 987 15.655 -3.035 -5.681 1.00 0.00 H new ATOM 1166 N ALA A 988 11.252 -6.153 -3.860 1.00 0.00 N ATOM 1167 CA ALA A 988 10.297 -7.150 -4.327 1.00 0.00 C ATOM 1168 C ALA A 988 8.981 -7.043 -3.569 1.00 0.00 C ATOM 1169 O ALA A 988 7.910 -7.076 -4.173 1.00 0.00 O ATOM 1170 CB ALA A 988 10.874 -8.551 -4.186 1.00 0.00 C ATOM 0 H ALA A 988 12.089 -6.543 -3.426 1.00 0.00 H new ATOM 0 HA ALA A 988 10.100 -6.957 -5.382 1.00 0.00 H new ATOM 0 HB1 ALA A 988 10.146 -9.281 -4.540 1.00 0.00 H new ATOM 0 HB2 ALA A 988 11.785 -8.630 -4.779 1.00 0.00 H new ATOM 0 HB3 ALA A 988 11.104 -8.746 -3.139 1.00 0.00 H new ATOM 1176 N ALA A 989 9.067 -6.895 -2.249 1.00 0.00 N ATOM 1177 CA ALA A 989 7.878 -6.771 -1.410 1.00 0.00 C ATOM 1178 C ALA A 989 7.049 -5.559 -1.814 1.00 0.00 C ATOM 1179 O ALA A 989 5.824 -5.630 -1.885 1.00 0.00 O ATOM 1180 CB ALA A 989 8.266 -6.681 0.058 1.00 0.00 C ATOM 0 H ALA A 989 9.949 -6.858 -1.737 1.00 0.00 H new ATOM 0 HA ALA A 989 7.270 -7.664 -1.555 1.00 0.00 H new ATOM 0 HB1 ALA A 989 7.367 -6.589 0.667 1.00 0.00 H new ATOM 0 HB2 ALA A 989 8.809 -7.581 0.347 1.00 0.00 H new ATOM 0 HB3 ALA A 989 8.900 -5.808 0.214 1.00 0.00 H new ATOM 1186 N SER A 990 7.728 -4.453 -2.092 1.00 0.00 N ATOM 1187 CA SER A 990 7.061 -3.236 -2.532 1.00 0.00 C ATOM 1188 C SER A 990 6.306 -3.485 -3.834 1.00 0.00 C ATOM 1189 O SER A 990 5.130 -3.148 -3.956 1.00 0.00 O ATOM 1190 CB SER A 990 8.081 -2.111 -2.721 1.00 0.00 C ATOM 1191 OG SER A 990 8.788 -1.862 -1.519 1.00 0.00 O ATOM 0 H SER A 990 8.742 -4.375 -2.020 1.00 0.00 H new ATOM 0 HA SER A 990 6.346 -2.936 -1.766 1.00 0.00 H new ATOM 0 HB2 SER A 990 8.782 -2.380 -3.511 1.00 0.00 H new ATOM 0 HB3 SER A 990 7.571 -1.203 -3.042 1.00 0.00 H new ATOM 0 HG SER A 990 9.553 -2.471 -1.457 1.00 0.00 H new ATOM 1197 N GLN A 991 6.982 -4.107 -4.794 1.00 0.00 N ATOM 1198 CA GLN A 991 6.385 -4.405 -6.089 1.00 0.00 C ATOM 1199 C GLN A 991 5.254 -5.421 -5.944 1.00 0.00 C ATOM 1200 O GLN A 991 4.225 -5.328 -6.618 1.00 0.00 O ATOM 1201 CB GLN A 991 7.454 -4.924 -7.052 1.00 0.00 C ATOM 1202 CG GLN A 991 8.539 -3.901 -7.355 1.00 0.00 C ATOM 1203 CD GLN A 991 9.674 -4.470 -8.182 1.00 0.00 C ATOM 1204 OE1 GLN A 991 9.999 -5.654 -8.089 1.00 0.00 O ATOM 1205 NE2 GLN A 991 10.285 -3.631 -9.003 1.00 0.00 N ATOM 0 H GLN A 991 7.949 -4.416 -4.698 1.00 0.00 H new ATOM 0 HA GLN A 991 5.962 -3.486 -6.496 1.00 0.00 H new ATOM 0 HB2 GLN A 991 7.914 -5.816 -6.627 1.00 0.00 H new ATOM 0 HB3 GLN A 991 6.977 -5.225 -7.985 1.00 0.00 H new ATOM 0 HG2 GLN A 991 8.097 -3.057 -7.886 1.00 0.00 H new ATOM 0 HG3 GLN A 991 8.938 -3.514 -6.417 1.00 0.00 H new ATOM 0 HE21 GLN A 991 9.987 -2.657 -9.052 1.00 0.00 H new ATOM 0 HE22 GLN A 991 11.054 -3.958 -9.587 1.00 0.00 H new ATOM 1214 N SER A 992 5.448 -6.374 -5.042 1.00 0.00 N ATOM 1215 CA SER A 992 4.454 -7.402 -4.771 1.00 0.00 C ATOM 1216 C SER A 992 3.204 -6.785 -4.150 1.00 0.00 C ATOM 1217 O SER A 992 2.102 -7.307 -4.306 1.00 0.00 O ATOM 1218 CB SER A 992 5.041 -8.463 -3.834 1.00 0.00 C ATOM 1219 OG SER A 992 4.171 -9.576 -3.704 1.00 0.00 O ATOM 0 H SER A 992 6.295 -6.456 -4.480 1.00 0.00 H new ATOM 0 HA SER A 992 4.175 -7.875 -5.712 1.00 0.00 H new ATOM 0 HB2 SER A 992 6.006 -8.796 -4.217 1.00 0.00 H new ATOM 0 HB3 SER A 992 5.222 -8.024 -2.853 1.00 0.00 H new ATOM 0 HG SER A 992 3.636 -9.480 -2.889 1.00 0.00 H new ATOM 1225 N PHE A 993 3.390 -5.669 -3.457 1.00 0.00 N ATOM 1226 CA PHE A 993 2.288 -4.958 -2.824 1.00 0.00 C ATOM 1227 C PHE A 993 1.589 -4.046 -3.828 1.00 0.00 C ATOM 1228 O PHE A 993 0.381 -3.817 -3.737 1.00 0.00 O ATOM 1229 CB PHE A 993 2.815 -4.143 -1.641 1.00 0.00 C ATOM 1230 CG PHE A 993 1.754 -3.382 -0.900 1.00 0.00 C ATOM 1231 CD1 PHE A 993 0.984 -4.002 0.069 1.00 0.00 C ATOM 1232 CD2 PHE A 993 1.527 -2.046 -1.175 1.00 0.00 C ATOM 1233 CE1 PHE A 993 0.010 -3.302 0.750 1.00 0.00 C ATOM 1234 CE2 PHE A 993 0.555 -1.341 -0.498 1.00 0.00 C ATOM 1235 CZ PHE A 993 -0.208 -1.980 0.470 1.00 0.00 C ATOM 0 H PHE A 993 4.302 -5.234 -3.319 1.00 0.00 H new ATOM 0 HA PHE A 993 1.560 -5.685 -2.462 1.00 0.00 H new ATOM 0 HB2 PHE A 993 3.318 -4.815 -0.946 1.00 0.00 H new ATOM 0 HB3 PHE A 993 3.565 -3.440 -2.003 1.00 0.00 H new ATOM 0 HD1 PHE A 993 1.148 -5.045 0.294 1.00 0.00 H new ATOM 0 HD2 PHE A 993 2.119 -1.549 -1.929 1.00 0.00 H new ATOM 0 HE1 PHE A 993 -0.582 -3.798 1.505 1.00 0.00 H new ATOM 0 HE2 PHE A 993 0.388 -0.297 -0.719 1.00 0.00 H new ATOM 0 HZ PHE A 993 -0.973 -1.434 1.002 1.00 0.00 H new ATOM 1245 N LEU A 994 2.358 -3.539 -4.789 1.00 0.00 N ATOM 1246 CA LEU A 994 1.843 -2.621 -5.801 1.00 0.00 C ATOM 1247 C LEU A 994 0.651 -3.213 -6.540 1.00 0.00 C ATOM 1248 O LEU A 994 -0.355 -2.535 -6.749 1.00 0.00 O ATOM 1249 CB LEU A 994 2.935 -2.275 -6.815 1.00 0.00 C ATOM 1250 CG LEU A 994 4.147 -1.535 -6.252 1.00 0.00 C ATOM 1251 CD1 LEU A 994 5.226 -1.413 -7.313 1.00 0.00 C ATOM 1252 CD2 LEU A 994 3.747 -0.162 -5.737 1.00 0.00 C ATOM 0 H LEU A 994 3.351 -3.752 -4.888 1.00 0.00 H new ATOM 0 HA LEU A 994 1.520 -1.719 -5.282 1.00 0.00 H new ATOM 0 HB2 LEU A 994 3.279 -3.198 -7.281 1.00 0.00 H new ATOM 0 HB3 LEU A 994 2.494 -1.666 -7.604 1.00 0.00 H new ATOM 0 HG LEU A 994 4.544 -2.109 -5.415 1.00 0.00 H new ATOM 0 HD11 LEU A 994 6.085 -0.884 -6.900 1.00 0.00 H new ATOM 0 HD12 LEU A 994 5.534 -2.408 -7.635 1.00 0.00 H new ATOM 0 HD13 LEU A 994 4.836 -0.860 -8.167 1.00 0.00 H new ATOM 0 HD21 LEU A 994 4.625 0.348 -5.340 1.00 0.00 H new ATOM 0 HD22 LEU A 994 3.325 0.424 -6.553 1.00 0.00 H new ATOM 0 HD23 LEU A 994 3.004 -0.272 -4.947 1.00 0.00 H new ATOM 1264 N GLN A 995 0.766 -4.478 -6.929 1.00 0.00 N ATOM 1265 CA GLN A 995 -0.284 -5.128 -7.707 1.00 0.00 C ATOM 1266 C GLN A 995 -1.626 -5.156 -6.948 1.00 0.00 C ATOM 1267 O GLN A 995 -2.595 -4.550 -7.411 1.00 0.00 O ATOM 1268 CB GLN A 995 0.142 -6.539 -8.138 1.00 0.00 C ATOM 1269 CG GLN A 995 -0.887 -7.252 -9.002 1.00 0.00 C ATOM 1270 CD GLN A 995 -1.078 -6.608 -10.366 1.00 0.00 C ATOM 1271 OE1 GLN A 995 -0.906 -5.400 -10.537 1.00 0.00 O ATOM 1272 NE2 GLN A 995 -1.447 -7.413 -11.347 1.00 0.00 N ATOM 0 H GLN A 995 1.569 -5.071 -6.721 1.00 0.00 H new ATOM 0 HA GLN A 995 -0.437 -4.533 -8.608 1.00 0.00 H new ATOM 0 HB2 GLN A 995 1.081 -6.473 -8.687 1.00 0.00 H new ATOM 0 HB3 GLN A 995 0.334 -7.138 -7.248 1.00 0.00 H new ATOM 0 HG2 GLN A 995 -0.581 -8.289 -9.138 1.00 0.00 H new ATOM 0 HG3 GLN A 995 -1.843 -7.267 -8.478 1.00 0.00 H new ATOM 0 HE21 GLN A 995 -1.580 -8.408 -11.167 1.00 0.00 H new ATOM 0 HE22 GLN A 995 -1.599 -7.039 -12.284 1.00 0.00 H new ATOM 1281 N PRO A 996 -1.717 -5.831 -5.777 1.00 0.00 N ATOM 1282 CA PRO A 996 -2.974 -5.910 -5.019 1.00 0.00 C ATOM 1283 C PRO A 996 -3.418 -4.549 -4.501 1.00 0.00 C ATOM 1284 O PRO A 996 -4.603 -4.210 -4.551 1.00 0.00 O ATOM 1285 CB PRO A 996 -2.643 -6.841 -3.841 1.00 0.00 C ATOM 1286 CG PRO A 996 -1.384 -7.532 -4.230 1.00 0.00 C ATOM 1287 CD PRO A 996 -0.639 -6.564 -5.098 1.00 0.00 C ATOM 0 HA PRO A 996 -3.794 -6.270 -5.641 1.00 0.00 H new ATOM 0 HB2 PRO A 996 -2.513 -6.276 -2.918 1.00 0.00 H new ATOM 0 HB3 PRO A 996 -3.447 -7.556 -3.667 1.00 0.00 H new ATOM 0 HG2 PRO A 996 -0.798 -7.801 -3.351 1.00 0.00 H new ATOM 0 HG3 PRO A 996 -1.595 -8.457 -4.767 1.00 0.00 H new ATOM 0 HD2 PRO A 996 -0.007 -5.899 -4.510 1.00 0.00 H new ATOM 0 HD3 PRO A 996 0.010 -7.076 -5.808 1.00 0.00 H new ATOM 1295 N GLY A 997 -2.457 -3.767 -4.020 1.00 0.00 N ATOM 1296 CA GLY A 997 -2.760 -2.456 -3.488 1.00 0.00 C ATOM 1297 C GLY A 997 -3.391 -1.553 -4.526 1.00 0.00 C ATOM 1298 O GLY A 997 -4.407 -0.911 -4.261 1.00 0.00 O ATOM 0 H GLY A 997 -1.470 -4.022 -3.990 1.00 0.00 H new ATOM 0 HA2 GLY A 997 -3.435 -2.557 -2.638 1.00 0.00 H new ATOM 0 HA3 GLY A 997 -1.845 -1.996 -3.116 1.00 0.00 H new ATOM 1302 N GLY A 998 -2.801 -1.529 -5.717 1.00 0.00 N ATOM 1303 CA GLY A 998 -3.312 -0.697 -6.790 1.00 0.00 C ATOM 1304 C GLY A 998 -4.728 -1.064 -7.182 1.00 0.00 C ATOM 1305 O GLY A 998 -5.535 -0.189 -7.506 1.00 0.00 O ATOM 0 H GLY A 998 -1.974 -2.074 -5.958 1.00 0.00 H new ATOM 0 HA2 GLY A 998 -3.283 0.348 -6.481 1.00 0.00 H new ATOM 0 HA3 GLY A 998 -2.662 -0.790 -7.660 1.00 0.00 H new ATOM 1309 N LYS A 999 -5.037 -2.354 -7.132 1.00 0.00 N ATOM 1310 CA LYS A 999 -6.368 -2.827 -7.481 1.00 0.00 C ATOM 1311 C LYS A 999 -7.387 -2.399 -6.431 1.00 0.00 C ATOM 1312 O LYS A 999 -8.539 -2.114 -6.755 1.00 0.00 O ATOM 1313 CB LYS A 999 -6.389 -4.349 -7.631 1.00 0.00 C ATOM 1314 CG LYS A 999 -5.513 -4.869 -8.759 1.00 0.00 C ATOM 1315 CD LYS A 999 -5.752 -6.349 -9.002 1.00 0.00 C ATOM 1316 CE LYS A 999 -4.817 -6.903 -10.065 1.00 0.00 C ATOM 1317 NZ LYS A 999 -5.150 -8.309 -10.413 1.00 0.00 N ATOM 0 H LYS A 999 -4.386 -3.088 -6.854 1.00 0.00 H new ATOM 0 HA LYS A 999 -6.636 -2.379 -8.438 1.00 0.00 H new ATOM 0 HB2 LYS A 999 -6.064 -4.801 -6.694 1.00 0.00 H new ATOM 0 HB3 LYS A 999 -7.415 -4.673 -7.802 1.00 0.00 H new ATOM 0 HG2 LYS A 999 -5.720 -4.310 -9.671 1.00 0.00 H new ATOM 0 HG3 LYS A 999 -4.464 -4.703 -8.515 1.00 0.00 H new ATOM 0 HD2 LYS A 999 -5.610 -6.898 -8.071 1.00 0.00 H new ATOM 0 HD3 LYS A 999 -6.786 -6.505 -9.310 1.00 0.00 H new ATOM 0 HE2 LYS A 999 -4.876 -6.283 -10.960 1.00 0.00 H new ATOM 0 HE3 LYS A 999 -3.789 -6.851 -9.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 999 -4.491 -8.652 -11.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 999 -5.070 -8.905 -9.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 999 -6.123 -8.355 -10.778 1.00 0.00 H new ATOM 1331 N MET A1000 -6.959 -2.331 -5.174 1.00 0.00 N ATOM 1332 CA MET A1000 -7.866 -1.975 -4.096 1.00 0.00 C ATOM 1333 C MET A1000 -8.109 -0.473 -4.099 1.00 0.00 C ATOM 1334 O MET A1000 -9.151 -0.006 -3.649 1.00 0.00 O ATOM 1335 CB MET A1000 -7.330 -2.451 -2.742 1.00 0.00 C ATOM 1336 CG MET A1000 -8.342 -2.335 -1.610 1.00 0.00 C ATOM 1337 SD MET A1000 -8.073 -0.894 -0.565 1.00 0.00 S ATOM 1338 CE MET A1000 -6.491 -1.296 0.170 1.00 0.00 C ATOM 0 H MET A1000 -5.999 -2.516 -4.882 1.00 0.00 H new ATOM 0 HA MET A1000 -8.818 -2.480 -4.260 1.00 0.00 H new ATOM 0 HB2 MET A1000 -7.015 -3.491 -2.831 1.00 0.00 H new ATOM 0 HB3 MET A1000 -6.444 -1.870 -2.487 1.00 0.00 H new ATOM 0 HG2 MET A1000 -9.346 -2.288 -2.032 1.00 0.00 H new ATOM 0 HG3 MET A1000 -8.296 -3.235 -0.996 1.00 0.00 H new ATOM 0 HE1 MET A1000 -6.329 -0.672 1.049 1.00 0.00 H new ATOM 0 HE2 MET A1000 -6.482 -2.346 0.464 1.00 0.00 H new ATOM 0 HE3 MET A1000 -5.697 -1.116 -0.554 1.00 0.00 H new ATOM 1348 N VAL A1001 -7.150 0.279 -4.636 1.00 0.00 N ATOM 1349 CA VAL A1001 -7.332 1.713 -4.840 1.00 0.00 C ATOM 1350 C VAL A1001 -8.532 1.955 -5.753 1.00 0.00 C ATOM 1351 O VAL A1001 -9.383 2.798 -5.470 1.00 0.00 O ATOM 1352 CB VAL A1001 -6.077 2.369 -5.462 1.00 0.00 C ATOM 1353 CG1 VAL A1001 -6.307 3.852 -5.717 1.00 0.00 C ATOM 1354 CG2 VAL A1001 -4.865 2.171 -4.569 1.00 0.00 C ATOM 0 H VAL A1001 -6.243 -0.080 -4.936 1.00 0.00 H new ATOM 0 HA VAL A1001 -7.503 2.167 -3.864 1.00 0.00 H new ATOM 0 HB VAL A1001 -5.886 1.881 -6.418 1.00 0.00 H new ATOM 0 HG11 VAL A1001 -5.410 4.289 -6.154 1.00 0.00 H new ATOM 0 HG12 VAL A1001 -7.144 3.978 -6.404 1.00 0.00 H new ATOM 0 HG13 VAL A1001 -6.533 4.352 -4.775 1.00 0.00 H new ATOM 0 HG21 VAL A1001 -3.995 2.641 -5.027 1.00 0.00 H new ATOM 0 HG22 VAL A1001 -5.052 2.625 -3.596 1.00 0.00 H new ATOM 0 HG23 VAL A1001 -4.677 1.105 -4.442 1.00 0.00 H new ATOM 1364 N ALA A1002 -8.602 1.188 -6.836 1.00 0.00 N ATOM 1365 CA ALA A1002 -9.714 1.285 -7.773 1.00 0.00 C ATOM 1366 C ALA A1002 -10.992 0.744 -7.142 1.00 0.00 C ATOM 1367 O ALA A1002 -12.063 1.341 -7.269 1.00 0.00 O ATOM 1368 CB ALA A1002 -9.391 0.530 -9.054 1.00 0.00 C ATOM 0 H ALA A1002 -7.900 0.491 -7.086 1.00 0.00 H new ATOM 0 HA ALA A1002 -9.871 2.335 -8.019 1.00 0.00 H new ATOM 0 HB1 ALA A1002 -10.230 0.611 -9.745 1.00 0.00 H new ATOM 0 HB2 ALA A1002 -8.500 0.958 -9.514 1.00 0.00 H new ATOM 0 HB3 ALA A1002 -9.211 -0.520 -8.822 1.00 0.00 H new ATOM 1374 N ALA A1003 -10.857 -0.382 -6.448 1.00 0.00 N ATOM 1375 CA ALA A1003 -11.978 -1.015 -5.766 1.00 0.00 C ATOM 1376 C ALA A1003 -12.609 -0.070 -4.745 1.00 0.00 C ATOM 1377 O ALA A1003 -13.834 -0.001 -4.623 1.00 0.00 O ATOM 1378 CB ALA A1003 -11.518 -2.301 -5.093 1.00 0.00 C ATOM 0 H ALA A1003 -9.972 -0.878 -6.343 1.00 0.00 H new ATOM 0 HA ALA A1003 -12.739 -1.256 -6.508 1.00 0.00 H new ATOM 0 HB1 ALA A1003 -12.362 -2.768 -4.585 1.00 0.00 H new ATOM 0 HB2 ALA A1003 -11.124 -2.984 -5.845 1.00 0.00 H new ATOM 0 HB3 ALA A1003 -10.739 -2.073 -4.366 1.00 0.00 H new ATOM 1384 N ALA A1004 -11.768 0.662 -4.023 1.00 0.00 N ATOM 1385 CA ALA A1004 -12.234 1.615 -3.027 1.00 0.00 C ATOM 1386 C ALA A1004 -12.999 2.760 -3.680 1.00 0.00 C ATOM 1387 O ALA A1004 -14.084 3.122 -3.230 1.00 0.00 O ATOM 1388 CB ALA A1004 -11.064 2.152 -2.217 1.00 0.00 C ATOM 0 H ALA A1004 -10.753 0.611 -4.111 1.00 0.00 H new ATOM 0 HA ALA A1004 -12.915 1.094 -2.354 1.00 0.00 H new ATOM 0 HB1 ALA A1004 -11.430 2.863 -1.477 1.00 0.00 H new ATOM 0 HB2 ALA A1004 -10.563 1.327 -1.711 1.00 0.00 H new ATOM 0 HB3 ALA A1004 -10.359 2.651 -2.882 1.00 0.00 H new ATOM 1394 N LYS A1005 -12.438 3.311 -4.755 1.00 0.00 N ATOM 1395 CA LYS A1005 -13.054 4.430 -5.469 1.00 0.00 C ATOM 1396 C LYS A1005 -14.462 4.083 -5.936 1.00 0.00 C ATOM 1397 O LYS A1005 -15.393 4.874 -5.783 1.00 0.00 O ATOM 1398 CB LYS A1005 -12.210 4.827 -6.682 1.00 0.00 C ATOM 1399 CG LYS A1005 -10.844 5.392 -6.332 1.00 0.00 C ATOM 1400 CD LYS A1005 -10.011 5.615 -7.583 1.00 0.00 C ATOM 1401 CE LYS A1005 -8.626 6.140 -7.250 1.00 0.00 C ATOM 1402 NZ LYS A1005 -8.661 7.520 -6.702 1.00 0.00 N ATOM 0 H LYS A1005 -11.552 2.999 -5.153 1.00 0.00 H new ATOM 0 HA LYS A1005 -13.109 5.266 -4.772 1.00 0.00 H new ATOM 0 HB2 LYS A1005 -12.077 3.953 -7.320 1.00 0.00 H new ATOM 0 HB3 LYS A1005 -12.758 5.567 -7.266 1.00 0.00 H new ATOM 0 HG2 LYS A1005 -10.962 6.334 -5.797 1.00 0.00 H new ATOM 0 HG3 LYS A1005 -10.324 4.708 -5.662 1.00 0.00 H new ATOM 0 HD2 LYS A1005 -9.922 4.678 -8.133 1.00 0.00 H new ATOM 0 HD3 LYS A1005 -10.520 6.322 -8.238 1.00 0.00 H new ATOM 0 HE2 LYS A1005 -8.153 5.476 -6.526 1.00 0.00 H new ATOM 0 HE3 LYS A1005 -8.009 6.124 -8.148 1.00 0.00 H new ATOM 0 HZ1 LYS A1005 -7.689 7.872 -6.586 1.00 0.00 H new ATOM 0 HZ2 LYS A1005 -9.178 8.141 -7.357 1.00 0.00 H new ATOM 0 HZ3 LYS A1005 -9.140 7.515 -5.779 1.00 0.00 H new ATOM 1416 N ALA A1006 -14.611 2.890 -6.496 1.00 0.00 N ATOM 1417 CA ALA A1006 -15.886 2.453 -7.049 1.00 0.00 C ATOM 1418 C ALA A1006 -16.922 2.202 -5.954 1.00 0.00 C ATOM 1419 O ALA A1006 -18.127 2.222 -6.210 1.00 0.00 O ATOM 1420 CB ALA A1006 -15.685 1.198 -7.884 1.00 0.00 C ATOM 0 H ALA A1006 -13.860 2.204 -6.579 1.00 0.00 H new ATOM 0 HA ALA A1006 -16.268 3.253 -7.683 1.00 0.00 H new ATOM 0 HB1 ALA A1006 -16.642 0.877 -8.294 1.00 0.00 H new ATOM 0 HB2 ALA A1006 -14.994 1.410 -8.699 1.00 0.00 H new ATOM 0 HB3 ALA A1006 -15.275 0.406 -7.257 1.00 0.00 H new ATOM 1426 N SER A1007 -16.450 1.986 -4.735 1.00 0.00 N ATOM 1427 CA SER A1007 -17.332 1.673 -3.621 1.00 0.00 C ATOM 1428 C SER A1007 -17.753 2.935 -2.870 1.00 0.00 C ATOM 1429 O SER A1007 -18.713 2.919 -2.103 1.00 0.00 O ATOM 1430 CB SER A1007 -16.637 0.704 -2.670 1.00 0.00 C ATOM 1431 OG SER A1007 -16.174 -0.440 -3.371 1.00 0.00 O ATOM 0 H SER A1007 -15.460 2.022 -4.492 1.00 0.00 H new ATOM 0 HA SER A1007 -18.233 1.208 -4.021 1.00 0.00 H new ATOM 0 HB2 SER A1007 -15.799 1.202 -2.183 1.00 0.00 H new ATOM 0 HB3 SER A1007 -17.328 0.400 -1.883 1.00 0.00 H new ATOM 0 HG SER A1007 -15.218 -0.341 -3.564 1.00 0.00 H new ATOM 1437 N VAL A1008 -17.036 4.028 -3.100 1.00 0.00 N ATOM 1438 CA VAL A1008 -17.351 5.303 -2.460 1.00 0.00 C ATOM 1439 C VAL A1008 -18.805 5.738 -2.727 1.00 0.00 C ATOM 1440 O VAL A1008 -19.549 6.007 -1.784 1.00 0.00 O ATOM 1441 CB VAL A1008 -16.375 6.419 -2.908 1.00 0.00 C ATOM 1442 CG1 VAL A1008 -16.765 7.764 -2.312 1.00 0.00 C ATOM 1443 CG2 VAL A1008 -14.946 6.063 -2.523 1.00 0.00 C ATOM 0 H VAL A1008 -16.231 4.059 -3.726 1.00 0.00 H new ATOM 0 HA VAL A1008 -17.235 5.148 -1.387 1.00 0.00 H new ATOM 0 HB VAL A1008 -16.436 6.501 -3.993 1.00 0.00 H new ATOM 0 HG11 VAL A1008 -16.061 8.527 -2.645 1.00 0.00 H new ATOM 0 HG12 VAL A1008 -17.770 8.030 -2.640 1.00 0.00 H new ATOM 0 HG13 VAL A1008 -16.743 7.700 -1.224 1.00 0.00 H new ATOM 0 HG21 VAL A1008 -14.274 6.858 -2.845 1.00 0.00 H new ATOM 0 HG22 VAL A1008 -14.879 5.947 -1.441 1.00 0.00 H new ATOM 0 HG23 VAL A1008 -14.661 5.129 -3.006 1.00 0.00 H new ATOM 1453 N PRO A1009 -19.252 5.798 -4.002 1.00 0.00 N ATOM 1454 CA PRO A1009 -20.606 6.258 -4.329 1.00 0.00 C ATOM 1455 C PRO A1009 -21.697 5.244 -3.981 1.00 0.00 C ATOM 1456 O PRO A1009 -22.879 5.582 -3.961 1.00 0.00 O ATOM 1457 CB PRO A1009 -20.550 6.472 -5.841 1.00 0.00 C ATOM 1458 CG PRO A1009 -19.504 5.529 -6.316 1.00 0.00 C ATOM 1459 CD PRO A1009 -18.483 5.455 -5.218 1.00 0.00 C ATOM 0 HA PRO A1009 -20.868 7.147 -3.756 1.00 0.00 H new ATOM 0 HB2 PRO A1009 -21.513 6.263 -6.307 1.00 0.00 H new ATOM 0 HB3 PRO A1009 -20.295 7.503 -6.086 1.00 0.00 H new ATOM 0 HG2 PRO A1009 -19.929 4.546 -6.521 1.00 0.00 H new ATOM 0 HG3 PRO A1009 -19.054 5.881 -7.244 1.00 0.00 H new ATOM 0 HD2 PRO A1009 -18.043 4.460 -5.146 1.00 0.00 H new ATOM 0 HD3 PRO A1009 -17.664 6.155 -5.385 1.00 0.00 H new ATOM 1467 N THR A1010 -21.311 4.006 -3.712 1.00 0.00 N ATOM 1468 CA THR A1010 -22.290 2.980 -3.397 1.00 0.00 C ATOM 1469 C THR A1010 -22.558 2.913 -1.896 1.00 0.00 C ATOM 1470 O THR A1010 -23.603 2.424 -1.464 1.00 0.00 O ATOM 1471 CB THR A1010 -21.850 1.603 -3.927 1.00 0.00 C ATOM 1472 OG1 THR A1010 -20.492 1.337 -3.560 1.00 0.00 O ATOM 1473 CG2 THR A1010 -21.988 1.545 -5.436 1.00 0.00 C ATOM 0 H THR A1010 -20.341 3.691 -3.705 1.00 0.00 H new ATOM 0 HA THR A1010 -23.219 3.255 -3.897 1.00 0.00 H new ATOM 0 HB THR A1010 -22.496 0.846 -3.482 1.00 0.00 H new ATOM 0 HG1 THR A1010 -20.188 2.013 -2.919 1.00 0.00 H new ATOM 0 HG21 THR A1010 -21.673 0.565 -5.793 1.00 0.00 H new ATOM 0 HG22 THR A1010 -23.029 1.714 -5.713 1.00 0.00 H new ATOM 0 HG23 THR A1010 -21.362 2.314 -5.888 1.00 0.00 H new ATOM 1481 N ILE A1011 -21.622 3.421 -1.106 1.00 0.00 N ATOM 1482 CA ILE A1011 -21.802 3.496 0.336 1.00 0.00 C ATOM 1483 C ILE A1011 -22.621 4.730 0.690 1.00 0.00 C ATOM 1484 O ILE A1011 -22.297 5.842 0.270 1.00 0.00 O ATOM 1485 CB ILE A1011 -20.446 3.535 1.076 1.00 0.00 C ATOM 1486 CG1 ILE A1011 -19.653 2.260 0.787 1.00 0.00 C ATOM 1487 CG2 ILE A1011 -20.656 3.702 2.575 1.00 0.00 C ATOM 1488 CD1 ILE A1011 -18.272 2.252 1.400 1.00 0.00 C ATOM 0 H ILE A1011 -20.731 3.787 -1.440 1.00 0.00 H new ATOM 0 HA ILE A1011 -22.332 2.599 0.656 1.00 0.00 H new ATOM 0 HB ILE A1011 -19.878 4.392 0.714 1.00 0.00 H new ATOM 0 HG12 ILE A1011 -20.212 1.402 1.161 1.00 0.00 H new ATOM 0 HG13 ILE A1011 -19.563 2.136 -0.292 1.00 0.00 H new ATOM 0 HG21 ILE A1011 -19.689 3.727 3.077 1.00 0.00 H new ATOM 0 HG22 ILE A1011 -21.188 4.634 2.766 1.00 0.00 H new ATOM 0 HG23 ILE A1011 -21.241 2.865 2.956 1.00 0.00 H new ATOM 0 HD11 ILE A1011 -17.770 1.317 1.153 1.00 0.00 H new ATOM 0 HD12 ILE A1011 -17.695 3.089 1.007 1.00 0.00 H new ATOM 0 HD13 ILE A1011 -18.354 2.344 2.483 1.00 0.00 H new ATOM 1500 N GLN A1012 -23.686 4.528 1.453 1.00 0.00 N ATOM 1501 CA GLN A1012 -24.589 5.616 1.807 1.00 0.00 C ATOM 1502 C GLN A1012 -24.009 6.454 2.941 1.00 0.00 C ATOM 1503 O GLN A1012 -24.302 7.644 3.058 1.00 0.00 O ATOM 1504 CB GLN A1012 -25.957 5.059 2.200 1.00 0.00 C ATOM 1505 CG GLN A1012 -26.605 4.225 1.105 1.00 0.00 C ATOM 1506 CD GLN A1012 -26.843 5.014 -0.170 1.00 0.00 C ATOM 1507 OE1 GLN A1012 -27.092 6.219 -0.137 1.00 0.00 O ATOM 1508 NE2 GLN A1012 -26.766 4.338 -1.304 1.00 0.00 N ATOM 0 H GLN A1012 -23.947 3.621 1.839 1.00 0.00 H new ATOM 0 HA GLN A1012 -24.709 6.261 0.936 1.00 0.00 H new ATOM 0 HB2 GLN A1012 -25.849 4.448 3.096 1.00 0.00 H new ATOM 0 HB3 GLN A1012 -26.618 5.887 2.456 1.00 0.00 H new ATOM 0 HG2 GLN A1012 -25.970 3.367 0.883 1.00 0.00 H new ATOM 0 HG3 GLN A1012 -27.555 3.833 1.467 1.00 0.00 H new ATOM 0 HE21 GLN A1012 -26.557 3.340 -1.289 1.00 0.00 H new ATOM 0 HE22 GLN A1012 -26.915 4.815 -2.193 1.00 0.00 H new ATOM 1517 N ASP A1013 -23.190 5.825 3.775 1.00 0.00 N ATOM 1518 CA ASP A1013 -22.515 6.526 4.861 1.00 0.00 C ATOM 1519 C ASP A1013 -21.448 7.454 4.302 1.00 0.00 C ATOM 1520 O ASP A1013 -20.400 7.002 3.838 1.00 0.00 O ATOM 1521 CB ASP A1013 -21.888 5.534 5.844 1.00 0.00 C ATOM 1522 CG ASP A1013 -22.921 4.800 6.672 1.00 0.00 C ATOM 1523 OD1 ASP A1013 -23.554 3.857 6.144 1.00 0.00 O ATOM 1524 OD2 ASP A1013 -23.106 5.156 7.853 1.00 0.00 O ATOM 0 H ASP A1013 -22.977 4.829 3.720 1.00 0.00 H new ATOM 0 HA ASP A1013 -23.256 7.118 5.398 1.00 0.00 H new ATOM 0 HB2 ASP A1013 -21.290 4.810 5.291 1.00 0.00 H new ATOM 0 HB3 ASP A1013 -21.208 6.068 6.508 1.00 0.00 H new ATOM 1529 N GLN A1014 -21.722 8.751 4.354 1.00 0.00 N ATOM 1530 CA GLN A1014 -20.849 9.753 3.750 1.00 0.00 C ATOM 1531 C GLN A1014 -19.457 9.727 4.371 1.00 0.00 C ATOM 1532 O GLN A1014 -18.457 9.755 3.656 1.00 0.00 O ATOM 1533 CB GLN A1014 -21.460 11.147 3.897 1.00 0.00 C ATOM 1534 CG GLN A1014 -20.662 12.235 3.198 1.00 0.00 C ATOM 1535 CD GLN A1014 -21.270 13.617 3.364 1.00 0.00 C ATOM 1536 OE1 GLN A1014 -21.148 14.466 2.483 1.00 0.00 O ATOM 1537 NE2 GLN A1014 -21.922 13.854 4.491 1.00 0.00 N ATOM 0 H GLN A1014 -22.548 9.137 4.811 1.00 0.00 H new ATOM 0 HA GLN A1014 -20.751 9.513 2.691 1.00 0.00 H new ATOM 0 HB2 GLN A1014 -22.473 11.135 3.495 1.00 0.00 H new ATOM 0 HB3 GLN A1014 -21.540 11.390 4.957 1.00 0.00 H new ATOM 0 HG2 GLN A1014 -19.645 12.242 3.591 1.00 0.00 H new ATOM 0 HG3 GLN A1014 -20.591 12.000 2.136 1.00 0.00 H new ATOM 0 HE21 GLN A1014 -22.001 13.123 5.198 1.00 0.00 H new ATOM 0 HE22 GLN A1014 -22.345 14.768 4.653 1.00 0.00 H new ATOM 1546 N ALA A1015 -19.398 9.668 5.697 1.00 0.00 N ATOM 1547 CA ALA A1015 -18.125 9.649 6.409 1.00 0.00 C ATOM 1548 C ALA A1015 -17.271 8.466 5.968 1.00 0.00 C ATOM 1549 O ALA A1015 -16.062 8.599 5.775 1.00 0.00 O ATOM 1550 CB ALA A1015 -18.358 9.604 7.911 1.00 0.00 C ATOM 0 H ALA A1015 -20.219 9.632 6.302 1.00 0.00 H new ATOM 0 HA ALA A1015 -17.587 10.565 6.166 1.00 0.00 H new ATOM 0 HB1 ALA A1015 -17.398 9.590 8.428 1.00 0.00 H new ATOM 0 HB2 ALA A1015 -18.923 10.484 8.218 1.00 0.00 H new ATOM 0 HB3 ALA A1015 -18.920 8.705 8.165 1.00 0.00 H new ATOM 1556 N SER A1016 -17.914 7.320 5.788 1.00 0.00 N ATOM 1557 CA SER A1016 -17.225 6.111 5.366 1.00 0.00 C ATOM 1558 C SER A1016 -16.824 6.202 3.893 1.00 0.00 C ATOM 1559 O SER A1016 -15.732 5.776 3.511 1.00 0.00 O ATOM 1560 CB SER A1016 -18.125 4.901 5.604 1.00 0.00 C ATOM 1561 OG SER A1016 -18.533 4.837 6.961 1.00 0.00 O ATOM 0 H SER A1016 -18.917 7.204 5.929 1.00 0.00 H new ATOM 0 HA SER A1016 -16.314 5.999 5.954 1.00 0.00 H new ATOM 0 HB2 SER A1016 -19.001 4.961 4.958 1.00 0.00 H new ATOM 0 HB3 SER A1016 -17.593 3.988 5.336 1.00 0.00 H new ATOM 0 HG SER A1016 -19.110 4.056 7.093 1.00 0.00 H new ATOM 1567 N ALA A1017 -17.705 6.769 3.077 1.00 0.00 N ATOM 1568 CA ALA A1017 -17.430 6.956 1.659 1.00 0.00 C ATOM 1569 C ALA A1017 -16.244 7.893 1.462 1.00 0.00 C ATOM 1570 O ALA A1017 -15.315 7.593 0.710 1.00 0.00 O ATOM 1571 CB ALA A1017 -18.661 7.503 0.950 1.00 0.00 C ATOM 0 H ALA A1017 -18.619 7.108 3.376 1.00 0.00 H new ATOM 0 HA ALA A1017 -17.179 5.988 1.226 1.00 0.00 H new ATOM 0 HB1 ALA A1017 -18.441 7.638 -0.109 1.00 0.00 H new ATOM 0 HB2 ALA A1017 -19.488 6.801 1.062 1.00 0.00 H new ATOM 0 HB3 ALA A1017 -18.937 8.462 1.388 1.00 0.00 H new ATOM 1577 N MET A1018 -16.276 9.024 2.163 1.00 0.00 N ATOM 1578 CA MET A1018 -15.191 9.997 2.103 1.00 0.00 C ATOM 1579 C MET A1018 -13.897 9.380 2.614 1.00 0.00 C ATOM 1580 O MET A1018 -12.823 9.630 2.071 1.00 0.00 O ATOM 1581 CB MET A1018 -15.527 11.247 2.926 1.00 0.00 C ATOM 1582 CG MET A1018 -16.739 12.013 2.420 1.00 0.00 C ATOM 1583 SD MET A1018 -16.518 12.652 0.749 1.00 0.00 S ATOM 1584 CE MET A1018 -18.107 13.433 0.471 1.00 0.00 C ATOM 0 H MET A1018 -17.044 9.288 2.780 1.00 0.00 H new ATOM 0 HA MET A1018 -15.062 10.291 1.061 1.00 0.00 H new ATOM 0 HB2 MET A1018 -15.702 10.952 3.961 1.00 0.00 H new ATOM 0 HB3 MET A1018 -14.664 11.912 2.926 1.00 0.00 H new ATOM 0 HG2 MET A1018 -17.611 11.359 2.441 1.00 0.00 H new ATOM 0 HG3 MET A1018 -16.947 12.842 3.096 1.00 0.00 H new ATOM 0 HE1 MET A1018 -18.125 13.876 -0.525 1.00 0.00 H new ATOM 0 HE2 MET A1018 -18.898 12.687 0.551 1.00 0.00 H new ATOM 0 HE3 MET A1018 -18.265 14.211 1.217 1.00 0.00 H new ATOM 1594 N GLN A1019 -14.018 8.552 3.649 1.00 0.00 N ATOM 1595 CA GLN A1019 -12.862 7.899 4.251 1.00 0.00 C ATOM 1596 C GLN A1019 -12.165 7.000 3.237 1.00 0.00 C ATOM 1597 O GLN A1019 -10.935 6.972 3.163 1.00 0.00 O ATOM 1598 CB GLN A1019 -13.286 7.082 5.478 1.00 0.00 C ATOM 1599 CG GLN A1019 -12.114 6.528 6.270 1.00 0.00 C ATOM 1600 CD GLN A1019 -11.218 7.622 6.812 1.00 0.00 C ATOM 1601 OE1 GLN A1019 -10.287 8.065 6.141 1.00 0.00 O ATOM 1602 NE2 GLN A1019 -11.475 8.058 8.033 1.00 0.00 N ATOM 0 H GLN A1019 -14.908 8.318 4.088 1.00 0.00 H new ATOM 0 HA GLN A1019 -12.162 8.671 4.570 1.00 0.00 H new ATOM 0 HB2 GLN A1019 -13.892 7.710 6.131 1.00 0.00 H new ATOM 0 HB3 GLN A1019 -13.919 6.256 5.154 1.00 0.00 H new ATOM 0 HG2 GLN A1019 -12.490 5.926 7.097 1.00 0.00 H new ATOM 0 HG3 GLN A1019 -11.529 5.865 5.633 1.00 0.00 H new ATOM 0 HE21 GLN A1019 -12.256 7.667 8.560 1.00 0.00 H new ATOM 0 HE22 GLN A1019 -10.892 8.785 8.448 1.00 0.00 H new ATOM 1611 N LEU A1020 -12.957 6.276 2.452 1.00 0.00 N ATOM 1612 CA LEU A1020 -12.417 5.411 1.411 1.00 0.00 C ATOM 1613 C LEU A1020 -11.604 6.202 0.399 1.00 0.00 C ATOM 1614 O LEU A1020 -10.442 5.889 0.153 1.00 0.00 O ATOM 1615 CB LEU A1020 -13.535 4.655 0.693 1.00 0.00 C ATOM 1616 CG LEU A1020 -13.849 3.274 1.261 1.00 0.00 C ATOM 1617 CD1 LEU A1020 -14.964 2.617 0.468 1.00 0.00 C ATOM 1618 CD2 LEU A1020 -12.601 2.405 1.240 1.00 0.00 C ATOM 0 H LEU A1020 -13.975 6.272 2.518 1.00 0.00 H new ATOM 0 HA LEU A1020 -11.759 4.692 1.900 1.00 0.00 H new ATOM 0 HB2 LEU A1020 -14.441 5.260 0.727 1.00 0.00 H new ATOM 0 HB3 LEU A1020 -13.263 4.546 -0.357 1.00 0.00 H new ATOM 0 HG LEU A1020 -14.180 3.387 2.293 1.00 0.00 H new ATOM 0 HD11 LEU A1020 -15.176 1.633 0.885 1.00 0.00 H new ATOM 0 HD12 LEU A1020 -15.861 3.235 0.521 1.00 0.00 H new ATOM 0 HD13 LEU A1020 -14.657 2.511 -0.572 1.00 0.00 H new ATOM 0 HD21 LEU A1020 -12.836 1.422 1.647 1.00 0.00 H new ATOM 0 HD22 LEU A1020 -12.249 2.298 0.214 1.00 0.00 H new ATOM 0 HD23 LEU A1020 -11.823 2.872 1.844 1.00 0.00 H new ATOM 1630 N SER A1021 -12.210 7.233 -0.173 1.00 0.00 N ATOM 1631 CA SER A1021 -11.546 8.033 -1.191 1.00 0.00 C ATOM 1632 C SER A1021 -10.304 8.710 -0.615 1.00 0.00 C ATOM 1633 O SER A1021 -9.263 8.777 -1.269 1.00 0.00 O ATOM 1634 CB SER A1021 -12.507 9.077 -1.764 1.00 0.00 C ATOM 1635 OG SER A1021 -11.938 9.742 -2.878 1.00 0.00 O ATOM 0 H SER A1021 -13.159 7.534 0.050 1.00 0.00 H new ATOM 0 HA SER A1021 -11.234 7.371 -1.999 1.00 0.00 H new ATOM 0 HB2 SER A1021 -13.437 8.594 -2.062 1.00 0.00 H new ATOM 0 HB3 SER A1021 -12.759 9.805 -0.993 1.00 0.00 H new ATOM 0 HG SER A1021 -12.574 10.402 -3.225 1.00 0.00 H new ATOM 1641 N GLN A1022 -10.420 9.185 0.623 1.00 0.00 N ATOM 1642 CA GLN A1022 -9.312 9.834 1.316 1.00 0.00 C ATOM 1643 C GLN A1022 -8.113 8.897 1.406 1.00 0.00 C ATOM 1644 O GLN A1022 -6.990 9.275 1.074 1.00 0.00 O ATOM 1645 CB GLN A1022 -9.749 10.253 2.724 1.00 0.00 C ATOM 1646 CG GLN A1022 -8.735 11.107 3.469 1.00 0.00 C ATOM 1647 CD GLN A1022 -8.687 12.539 2.969 1.00 0.00 C ATOM 1648 OE1 GLN A1022 -8.943 12.815 1.797 1.00 0.00 O ATOM 1649 NE2 GLN A1022 -8.364 13.464 3.856 1.00 0.00 N ATOM 0 H GLN A1022 -11.279 9.131 1.170 1.00 0.00 H new ATOM 0 HA GLN A1022 -9.022 10.719 0.750 1.00 0.00 H new ATOM 0 HB2 GLN A1022 -10.686 10.804 2.651 1.00 0.00 H new ATOM 0 HB3 GLN A1022 -9.951 9.357 3.310 1.00 0.00 H new ATOM 0 HG2 GLN A1022 -8.978 11.107 4.532 1.00 0.00 H new ATOM 0 HG3 GLN A1022 -7.746 10.659 3.368 1.00 0.00 H new ATOM 0 HE21 GLN A1022 -8.158 13.198 4.819 1.00 0.00 H new ATOM 0 HE22 GLN A1022 -8.321 14.444 3.578 1.00 0.00 H new ATOM 1658 N CYS A1023 -8.364 7.672 1.838 1.00 0.00 N ATOM 1659 CA CYS A1023 -7.304 6.690 2.001 1.00 0.00 C ATOM 1660 C CYS A1023 -6.808 6.186 0.650 1.00 0.00 C ATOM 1661 O CYS A1023 -5.602 6.099 0.419 1.00 0.00 O ATOM 1662 CB CYS A1023 -7.797 5.523 2.850 1.00 0.00 C ATOM 1663 SG CYS A1023 -8.418 6.009 4.474 1.00 0.00 S ATOM 0 H CYS A1023 -9.294 7.333 2.083 1.00 0.00 H new ATOM 0 HA CYS A1023 -6.469 7.173 2.508 1.00 0.00 H new ATOM 0 HB2 CYS A1023 -8.588 5.003 2.310 1.00 0.00 H new ATOM 0 HB3 CYS A1023 -6.981 4.812 2.982 1.00 0.00 H new ATOM 0 HG CYS A1023 -9.603 6.527 4.348 1.00 0.00 H new ATOM 1669 N ALA A1024 -7.744 5.875 -0.242 1.00 0.00 N ATOM 1670 CA ALA A1024 -7.413 5.327 -1.553 1.00 0.00 C ATOM 1671 C ALA A1024 -6.526 6.270 -2.358 1.00 0.00 C ATOM 1672 O ALA A1024 -5.563 5.833 -2.988 1.00 0.00 O ATOM 1673 CB ALA A1024 -8.682 5.015 -2.332 1.00 0.00 C ATOM 0 H ALA A1024 -8.744 5.994 -0.079 1.00 0.00 H new ATOM 0 HA ALA A1024 -6.854 4.406 -1.388 1.00 0.00 H new ATOM 0 HB1 ALA A1024 -8.419 4.607 -3.308 1.00 0.00 H new ATOM 0 HB2 ALA A1024 -9.276 4.286 -1.782 1.00 0.00 H new ATOM 0 HB3 ALA A1024 -9.261 5.929 -2.465 1.00 0.00 H new ATOM 1679 N LYS A1025 -6.840 7.563 -2.336 1.00 0.00 N ATOM 1680 CA LYS A1025 -6.065 8.531 -3.102 1.00 0.00 C ATOM 1681 C LYS A1025 -4.651 8.654 -2.536 1.00 0.00 C ATOM 1682 O LYS A1025 -3.688 8.831 -3.283 1.00 0.00 O ATOM 1683 CB LYS A1025 -6.753 9.901 -3.136 1.00 0.00 C ATOM 1684 CG LYS A1025 -6.742 10.638 -1.808 1.00 0.00 C ATOM 1685 CD LYS A1025 -7.321 12.034 -1.948 1.00 0.00 C ATOM 1686 CE LYS A1025 -7.108 12.852 -0.685 1.00 0.00 C ATOM 1687 NZ LYS A1025 -5.668 12.946 -0.328 1.00 0.00 N ATOM 0 H LYS A1025 -7.615 7.959 -1.804 1.00 0.00 H new ATOM 0 HA LYS A1025 -6.000 8.167 -4.128 1.00 0.00 H new ATOM 0 HB2 LYS A1025 -6.264 10.522 -3.887 1.00 0.00 H new ATOM 0 HB3 LYS A1025 -7.786 9.768 -3.456 1.00 0.00 H new ATOM 0 HG2 LYS A1025 -7.317 10.075 -1.073 1.00 0.00 H new ATOM 0 HG3 LYS A1025 -5.720 10.701 -1.433 1.00 0.00 H new ATOM 0 HD2 LYS A1025 -6.855 12.540 -2.794 1.00 0.00 H new ATOM 0 HD3 LYS A1025 -8.387 11.967 -2.165 1.00 0.00 H new ATOM 0 HE2 LYS A1025 -7.514 13.854 -0.827 1.00 0.00 H new ATOM 0 HE3 LYS A1025 -7.659 12.399 0.139 1.00 0.00 H new ATOM 0 HZ1 LYS A1025 -5.539 13.668 0.409 1.00 0.00 H new ATOM 0 HZ2 LYS A1025 -5.338 12.026 0.028 1.00 0.00 H new ATOM 0 HZ3 LYS A1025 -5.118 13.209 -1.170 1.00 0.00 H new ATOM 1701 N ASN A1026 -4.531 8.539 -1.214 1.00 0.00 N ATOM 1702 CA ASN A1026 -3.223 8.578 -0.565 1.00 0.00 C ATOM 1703 C ASN A1026 -2.455 7.302 -0.867 1.00 0.00 C ATOM 1704 O ASN A1026 -1.252 7.337 -1.130 1.00 0.00 O ATOM 1705 CB ASN A1026 -3.351 8.755 0.951 1.00 0.00 C ATOM 1706 CG ASN A1026 -3.952 10.091 1.341 1.00 0.00 C ATOM 1707 OD1 ASN A1026 -3.879 11.064 0.588 1.00 0.00 O ATOM 1708 ND2 ASN A1026 -4.523 10.158 2.532 1.00 0.00 N ATOM 0 H ASN A1026 -5.318 8.419 -0.576 1.00 0.00 H new ATOM 0 HA ASN A1026 -2.681 9.437 -0.962 1.00 0.00 H new ATOM 0 HB2 ASN A1026 -3.969 7.953 1.354 1.00 0.00 H new ATOM 0 HB3 ASN A1026 -2.366 8.659 1.407 1.00 0.00 H new ATOM 0 HD21 ASN A1026 -4.923 11.038 2.857 1.00 0.00 H new ATOM 0 HD22 ASN A1026 -4.563 9.330 3.126 1.00 0.00 H new ATOM 1715 N LEU A1027 -3.165 6.179 -0.840 1.00 0.00 N ATOM 1716 CA LEU A1027 -2.585 4.887 -1.174 1.00 0.00 C ATOM 1717 C LEU A1027 -2.049 4.913 -2.601 1.00 0.00 C ATOM 1718 O LEU A1027 -0.991 4.359 -2.887 1.00 0.00 O ATOM 1719 CB LEU A1027 -3.638 3.781 -1.009 1.00 0.00 C ATOM 1720 CG LEU A1027 -3.148 2.350 -1.252 1.00 0.00 C ATOM 1721 CD1 LEU A1027 -2.008 2.005 -0.305 1.00 0.00 C ATOM 1722 CD2 LEU A1027 -4.298 1.364 -1.084 1.00 0.00 C ATOM 0 H LEU A1027 -4.152 6.140 -0.587 1.00 0.00 H new ATOM 0 HA LEU A1027 -1.757 4.678 -0.497 1.00 0.00 H new ATOM 0 HB2 LEU A1027 -4.043 3.839 0.001 1.00 0.00 H new ATOM 0 HB3 LEU A1027 -4.461 3.984 -1.694 1.00 0.00 H new ATOM 0 HG LEU A1027 -2.775 2.281 -2.274 1.00 0.00 H new ATOM 0 HD11 LEU A1027 -1.674 0.985 -0.494 1.00 0.00 H new ATOM 0 HD12 LEU A1027 -1.179 2.694 -0.467 1.00 0.00 H new ATOM 0 HD13 LEU A1027 -2.353 2.089 0.726 1.00 0.00 H new ATOM 0 HD21 LEU A1027 -3.937 0.351 -1.259 1.00 0.00 H new ATOM 0 HD22 LEU A1027 -4.695 1.438 -0.072 1.00 0.00 H new ATOM 0 HD23 LEU A1027 -5.085 1.598 -1.801 1.00 0.00 H new ATOM 1734 N GLY A1028 -2.780 5.589 -3.483 1.00 0.00 N ATOM 1735 CA GLY A1028 -2.344 5.747 -4.856 1.00 0.00 C ATOM 1736 C GLY A1028 -1.000 6.447 -4.964 1.00 0.00 C ATOM 1737 O GLY A1028 -0.109 5.982 -5.674 1.00 0.00 O ATOM 0 H GLY A1028 -3.673 6.032 -3.267 1.00 0.00 H new ATOM 0 HA2 GLY A1028 -2.278 4.767 -5.328 1.00 0.00 H new ATOM 0 HA3 GLY A1028 -3.092 6.317 -5.408 1.00 0.00 H new ATOM 1741 N THR A1029 -0.847 7.558 -4.251 1.00 0.00 N ATOM 1742 CA THR A1029 0.405 8.306 -4.274 1.00 0.00 C ATOM 1743 C THR A1029 1.499 7.540 -3.531 1.00 0.00 C ATOM 1744 O THR A1029 2.671 7.585 -3.906 1.00 0.00 O ATOM 1745 CB THR A1029 0.241 9.693 -3.633 1.00 0.00 C ATOM 1746 OG1 THR A1029 -0.993 10.289 -4.054 1.00 0.00 O ATOM 1747 CG2 THR A1029 1.398 10.607 -4.013 1.00 0.00 C ATOM 0 H THR A1029 -1.570 7.959 -3.653 1.00 0.00 H new ATOM 0 HA THR A1029 0.688 8.433 -5.319 1.00 0.00 H new ATOM 0 HB THR A1029 0.234 9.565 -2.551 1.00 0.00 H new ATOM 0 HG1 THR A1029 -1.089 11.171 -3.639 1.00 0.00 H new ATOM 0 HG21 THR A1029 1.259 11.583 -3.547 1.00 0.00 H new ATOM 0 HG22 THR A1029 2.335 10.170 -3.668 1.00 0.00 H new ATOM 0 HG23 THR A1029 1.429 10.723 -5.096 1.00 0.00 H new ATOM 1755 N ALA A1030 1.105 6.837 -2.474 1.00 0.00 N ATOM 1756 CA ALA A1030 2.028 6.006 -1.717 1.00 0.00 C ATOM 1757 C ALA A1030 2.638 4.942 -2.620 1.00 0.00 C ATOM 1758 O ALA A1030 3.851 4.756 -2.643 1.00 0.00 O ATOM 1759 CB ALA A1030 1.316 5.363 -0.536 1.00 0.00 C ATOM 0 H ALA A1030 0.147 6.828 -2.123 1.00 0.00 H new ATOM 0 HA ALA A1030 2.831 6.635 -1.331 1.00 0.00 H new ATOM 0 HB1 ALA A1030 2.020 4.744 0.020 1.00 0.00 H new ATOM 0 HB2 ALA A1030 0.921 6.140 0.118 1.00 0.00 H new ATOM 0 HB3 ALA A1030 0.496 4.743 -0.899 1.00 0.00 H new ATOM 1765 N LEU A1031 1.783 4.265 -3.379 1.00 0.00 N ATOM 1766 CA LEU A1031 2.229 3.257 -4.332 1.00 0.00 C ATOM 1767 C LEU A1031 3.044 3.894 -5.447 1.00 0.00 C ATOM 1768 O LEU A1031 3.993 3.295 -5.951 1.00 0.00 O ATOM 1769 CB LEU A1031 1.028 2.522 -4.931 1.00 0.00 C ATOM 1770 CG LEU A1031 0.193 1.726 -3.930 1.00 0.00 C ATOM 1771 CD1 LEU A1031 -1.029 1.136 -4.612 1.00 0.00 C ATOM 1772 CD2 LEU A1031 1.032 0.631 -3.296 1.00 0.00 C ATOM 0 H LEU A1031 0.772 4.398 -3.352 1.00 0.00 H new ATOM 0 HA LEU A1031 2.858 2.543 -3.799 1.00 0.00 H new ATOM 0 HB2 LEU A1031 0.383 3.251 -5.421 1.00 0.00 H new ATOM 0 HB3 LEU A1031 1.386 1.842 -5.704 1.00 0.00 H new ATOM 0 HG LEU A1031 -0.145 2.400 -3.143 1.00 0.00 H new ATOM 0 HD11 LEU A1031 -1.614 0.572 -3.886 1.00 0.00 H new ATOM 0 HD12 LEU A1031 -1.639 1.940 -5.024 1.00 0.00 H new ATOM 0 HD13 LEU A1031 -0.712 0.473 -5.417 1.00 0.00 H new ATOM 0 HD21 LEU A1031 0.424 0.072 -2.585 1.00 0.00 H new ATOM 0 HD22 LEU A1031 1.396 -0.044 -4.071 1.00 0.00 H new ATOM 0 HD23 LEU A1031 1.880 1.077 -2.776 1.00 0.00 H new ATOM 1784 N ALA A1032 2.668 5.111 -5.820 1.00 0.00 N ATOM 1785 CA ALA A1032 3.359 5.847 -6.868 1.00 0.00 C ATOM 1786 C ALA A1032 4.840 6.005 -6.546 1.00 0.00 C ATOM 1787 O ALA A1032 5.703 5.578 -7.318 1.00 0.00 O ATOM 1788 CB ALA A1032 2.706 7.209 -7.068 1.00 0.00 C ATOM 0 H ALA A1032 1.881 5.612 -5.407 1.00 0.00 H new ATOM 0 HA ALA A1032 3.280 5.278 -7.794 1.00 0.00 H new ATOM 0 HB1 ALA A1032 3.230 7.752 -7.854 1.00 0.00 H new ATOM 0 HB2 ALA A1032 1.663 7.074 -7.354 1.00 0.00 H new ATOM 0 HB3 ALA A1032 2.757 7.777 -6.139 1.00 0.00 H new ATOM 1794 N GLU A1033 5.141 6.594 -5.396 1.00 0.00 N ATOM 1795 CA GLU A1033 6.526 6.824 -5.016 1.00 0.00 C ATOM 1796 C GLU A1033 7.196 5.536 -4.553 1.00 0.00 C ATOM 1797 O GLU A1033 8.399 5.373 -4.724 1.00 0.00 O ATOM 1798 CB GLU A1033 6.636 7.908 -3.944 1.00 0.00 C ATOM 1799 CG GLU A1033 5.863 7.620 -2.672 1.00 0.00 C ATOM 1800 CD GLU A1033 6.021 8.730 -1.660 1.00 0.00 C ATOM 1801 OE1 GLU A1033 5.306 9.745 -1.763 1.00 0.00 O ATOM 1802 OE2 GLU A1033 6.851 8.588 -0.738 1.00 0.00 O ATOM 0 H GLU A1033 4.452 6.918 -4.717 1.00 0.00 H new ATOM 0 HA GLU A1033 7.052 7.175 -5.904 1.00 0.00 H new ATOM 0 HB2 GLU A1033 7.687 8.045 -3.691 1.00 0.00 H new ATOM 0 HB3 GLU A1033 6.283 8.851 -4.362 1.00 0.00 H new ATOM 0 HG2 GLU A1033 4.807 7.491 -2.909 1.00 0.00 H new ATOM 0 HG3 GLU A1033 6.210 6.681 -2.240 1.00 0.00 H new ATOM 1809 N LEU A1034 6.420 4.619 -3.981 1.00 0.00 N ATOM 1810 CA LEU A1034 6.948 3.317 -3.584 1.00 0.00 C ATOM 1811 C LEU A1034 7.462 2.567 -4.809 1.00 0.00 C ATOM 1812 O LEU A1034 8.569 2.030 -4.803 1.00 0.00 O ATOM 1813 CB LEU A1034 5.868 2.490 -2.879 1.00 0.00 C ATOM 1814 CG LEU A1034 6.324 1.130 -2.347 1.00 0.00 C ATOM 1815 CD1 LEU A1034 7.394 1.302 -1.281 1.00 0.00 C ATOM 1816 CD2 LEU A1034 5.140 0.352 -1.795 1.00 0.00 C ATOM 0 H LEU A1034 5.428 4.752 -3.783 1.00 0.00 H new ATOM 0 HA LEU A1034 7.773 3.475 -2.889 1.00 0.00 H new ATOM 0 HB2 LEU A1034 5.474 3.073 -2.047 1.00 0.00 H new ATOM 0 HB3 LEU A1034 5.044 2.331 -3.575 1.00 0.00 H new ATOM 0 HG LEU A1034 6.754 0.564 -3.174 1.00 0.00 H new ATOM 0 HD11 LEU A1034 7.704 0.323 -0.916 1.00 0.00 H new ATOM 0 HD12 LEU A1034 8.253 1.819 -1.708 1.00 0.00 H new ATOM 0 HD13 LEU A1034 6.993 1.887 -0.454 1.00 0.00 H new ATOM 0 HD21 LEU A1034 5.481 -0.613 -1.421 1.00 0.00 H new ATOM 0 HD22 LEU A1034 4.682 0.915 -0.982 1.00 0.00 H new ATOM 0 HD23 LEU A1034 4.407 0.195 -2.586 1.00 0.00 H new ATOM 1828 N ARG A1035 6.652 2.556 -5.862 1.00 0.00 N ATOM 1829 CA ARG A1035 7.036 1.934 -7.122 1.00 0.00 C ATOM 1830 C ARG A1035 8.260 2.630 -7.700 1.00 0.00 C ATOM 1831 O ARG A1035 9.197 1.980 -8.163 1.00 0.00 O ATOM 1832 CB ARG A1035 5.880 2.005 -8.122 1.00 0.00 C ATOM 1833 CG ARG A1035 6.168 1.316 -9.449 1.00 0.00 C ATOM 1834 CD ARG A1035 5.032 1.523 -10.437 1.00 0.00 C ATOM 1835 NE ARG A1035 4.863 2.934 -10.780 1.00 0.00 N ATOM 1836 CZ ARG A1035 3.684 3.523 -10.971 1.00 0.00 C ATOM 1837 NH1 ARG A1035 2.557 2.826 -10.858 1.00 0.00 N ATOM 1838 NH2 ARG A1035 3.633 4.814 -11.273 1.00 0.00 N ATOM 0 H ARG A1035 5.721 2.973 -5.867 1.00 0.00 H new ATOM 0 HA ARG A1035 7.278 0.888 -6.933 1.00 0.00 H new ATOM 0 HB2 ARG A1035 4.996 1.552 -7.673 1.00 0.00 H new ATOM 0 HB3 ARG A1035 5.641 3.051 -8.312 1.00 0.00 H new ATOM 0 HG2 ARG A1035 7.095 1.706 -9.870 1.00 0.00 H new ATOM 0 HG3 ARG A1035 6.318 0.249 -9.282 1.00 0.00 H new ATOM 0 HD2 ARG A1035 5.229 0.950 -11.343 1.00 0.00 H new ATOM 0 HD3 ARG A1035 4.105 1.139 -10.011 1.00 0.00 H new ATOM 0 HE ARG A1035 5.703 3.504 -10.879 1.00 0.00 H new ATOM 0 HH11 ARG A1035 2.592 1.834 -10.624 1.00 0.00 H new ATOM 0 HH12 ARG A1035 1.657 3.284 -11.006 1.00 0.00 H new ATOM 0 HH21 ARG A1035 4.495 5.352 -11.358 1.00 0.00 H new ATOM 0 HH22 ARG A1035 2.732 5.268 -11.420 1.00 0.00 H new ATOM 1852 N THR A1036 8.246 3.954 -7.653 1.00 0.00 N ATOM 1853 CA THR A1036 9.345 4.753 -8.170 1.00 0.00 C ATOM 1854 C THR A1036 10.630 4.489 -7.378 1.00 0.00 C ATOM 1855 O THR A1036 11.705 4.323 -7.955 1.00 0.00 O ATOM 1856 CB THR A1036 8.996 6.254 -8.119 1.00 0.00 C ATOM 1857 OG1 THR A1036 7.730 6.484 -8.756 1.00 0.00 O ATOM 1858 CG2 THR A1036 10.064 7.087 -8.810 1.00 0.00 C ATOM 0 H THR A1036 7.480 4.500 -7.259 1.00 0.00 H new ATOM 0 HA THR A1036 9.510 4.465 -9.208 1.00 0.00 H new ATOM 0 HB THR A1036 8.943 6.552 -7.072 1.00 0.00 H new ATOM 0 HG1 THR A1036 7.008 6.357 -8.105 1.00 0.00 H new ATOM 0 HG21 THR A1036 9.792 8.141 -8.759 1.00 0.00 H new ATOM 0 HG22 THR A1036 11.022 6.935 -8.313 1.00 0.00 H new ATOM 0 HG23 THR A1036 10.144 6.783 -9.854 1.00 0.00 H new ATOM 1866 N ALA A1037 10.501 4.431 -6.058 1.00 0.00 N ATOM 1867 CA ALA A1037 11.633 4.172 -5.178 1.00 0.00 C ATOM 1868 C ALA A1037 12.216 2.785 -5.429 1.00 0.00 C ATOM 1869 O ALA A1037 13.429 2.631 -5.586 1.00 0.00 O ATOM 1870 CB ALA A1037 11.206 4.312 -3.725 1.00 0.00 C ATOM 0 H ALA A1037 9.615 4.561 -5.570 1.00 0.00 H new ATOM 0 HA ALA A1037 12.409 4.907 -5.393 1.00 0.00 H new ATOM 0 HB1 ALA A1037 12.059 4.117 -3.075 1.00 0.00 H new ATOM 0 HB2 ALA A1037 10.840 5.324 -3.549 1.00 0.00 H new ATOM 0 HB3 ALA A1037 10.413 3.596 -3.508 1.00 0.00 H new ATOM 1876 N ALA A1038 11.342 1.785 -5.478 1.00 0.00 N ATOM 1877 CA ALA A1038 11.760 0.410 -5.717 1.00 0.00 C ATOM 1878 C ALA A1038 12.393 0.271 -7.093 1.00 0.00 C ATOM 1879 O ALA A1038 13.311 -0.522 -7.290 1.00 0.00 O ATOM 1880 CB ALA A1038 10.577 -0.538 -5.579 1.00 0.00 C ATOM 0 H ALA A1038 10.336 1.903 -5.355 1.00 0.00 H new ATOM 0 HA ALA A1038 12.506 0.145 -4.968 1.00 0.00 H new ATOM 0 HB1 ALA A1038 10.907 -1.561 -5.761 1.00 0.00 H new ATOM 0 HB2 ALA A1038 10.166 -0.463 -4.572 1.00 0.00 H new ATOM 0 HB3 ALA A1038 9.809 -0.270 -6.305 1.00 0.00 H new ATOM 1886 N GLN A1039 11.899 1.053 -8.042 1.00 0.00 N ATOM 1887 CA GLN A1039 12.419 1.027 -9.397 1.00 0.00 C ATOM 1888 C GLN A1039 13.841 1.581 -9.434 1.00 0.00 C ATOM 1889 O GLN A1039 14.705 1.037 -10.113 1.00 0.00 O ATOM 1890 CB GLN A1039 11.508 1.830 -10.328 1.00 0.00 C ATOM 1891 CG GLN A1039 11.795 1.635 -11.811 1.00 0.00 C ATOM 1892 CD GLN A1039 11.354 0.279 -12.345 1.00 0.00 C ATOM 1893 OE1 GLN A1039 10.967 0.162 -13.505 1.00 0.00 O ATOM 1894 NE2 GLN A1039 11.416 -0.757 -11.523 1.00 0.00 N ATOM 0 H GLN A1039 11.136 1.714 -7.896 1.00 0.00 H new ATOM 0 HA GLN A1039 12.444 -0.007 -9.741 1.00 0.00 H new ATOM 0 HB2 GLN A1039 10.472 1.553 -10.131 1.00 0.00 H new ATOM 0 HB3 GLN A1039 11.606 2.889 -10.088 1.00 0.00 H new ATOM 0 HG2 GLN A1039 11.292 2.420 -12.376 1.00 0.00 H new ATOM 0 HG3 GLN A1039 12.865 1.754 -11.984 1.00 0.00 H new ATOM 0 HE21 GLN A1039 11.742 -0.629 -10.565 1.00 0.00 H new ATOM 0 HE22 GLN A1039 11.138 -1.683 -11.848 1.00 0.00 H new ATOM 1903 N LYS A1040 14.079 2.654 -8.691 1.00 0.00 N ATOM 1904 CA LYS A1040 15.405 3.262 -8.626 1.00 0.00 C ATOM 1905 C LYS A1040 16.402 2.320 -7.961 1.00 0.00 C ATOM 1906 O LYS A1040 17.502 2.101 -8.469 1.00 0.00 O ATOM 1907 CB LYS A1040 15.357 4.580 -7.852 1.00 0.00 C ATOM 1908 CG LYS A1040 14.520 5.656 -8.516 1.00 0.00 C ATOM 1909 CD LYS A1040 14.474 6.917 -7.671 1.00 0.00 C ATOM 1910 CE LYS A1040 13.625 7.995 -8.321 1.00 0.00 C ATOM 1911 NZ LYS A1040 14.244 8.539 -9.560 1.00 0.00 N ATOM 0 H LYS A1040 13.372 3.123 -8.124 1.00 0.00 H new ATOM 0 HA LYS A1040 15.730 3.458 -9.648 1.00 0.00 H new ATOM 0 HB2 LYS A1040 14.960 4.389 -6.855 1.00 0.00 H new ATOM 0 HB3 LYS A1040 16.374 4.952 -7.725 1.00 0.00 H new ATOM 0 HG2 LYS A1040 14.934 5.888 -9.497 1.00 0.00 H new ATOM 0 HG3 LYS A1040 13.507 5.285 -8.676 1.00 0.00 H new ATOM 0 HD2 LYS A1040 14.072 6.681 -6.686 1.00 0.00 H new ATOM 0 HD3 LYS A1040 15.486 7.292 -7.520 1.00 0.00 H new ATOM 0 HE2 LYS A1040 12.643 7.585 -8.559 1.00 0.00 H new ATOM 0 HE3 LYS A1040 13.468 8.807 -7.611 1.00 0.00 H new ATOM 0 HZ1 LYS A1040 13.678 9.339 -9.908 1.00 0.00 H new ATOM 0 HZ2 LYS A1040 15.210 8.863 -9.352 1.00 0.00 H new ATOM 0 HZ3 LYS A1040 14.277 7.796 -10.287 1.00 0.00 H new ATOM 1925 N ALA A1041 15.998 1.750 -6.831 1.00 0.00 N ATOM 1926 CA ALA A1041 16.869 0.878 -6.051 1.00 0.00 C ATOM 1927 C ALA A1041 17.159 -0.428 -6.781 1.00 0.00 C ATOM 1928 O ALA A1041 18.149 -1.103 -6.496 1.00 0.00 O ATOM 1929 CB ALA A1041 16.238 0.589 -4.697 1.00 0.00 C ATOM 0 H ALA A1041 15.068 1.877 -6.433 1.00 0.00 H new ATOM 0 HA ALA A1041 17.817 1.396 -5.908 1.00 0.00 H new ATOM 0 HB1 ALA A1041 16.895 -0.063 -4.121 1.00 0.00 H new ATOM 0 HB2 ALA A1041 16.091 1.524 -4.157 1.00 0.00 H new ATOM 0 HB3 ALA A1041 15.276 0.098 -4.841 1.00 0.00 H new ATOM 1935 N GLN A1042 16.301 -0.777 -7.723 1.00 0.00 N ATOM 1936 CA GLN A1042 16.428 -2.036 -8.439 1.00 0.00 C ATOM 1937 C GLN A1042 17.470 -1.932 -9.548 1.00 0.00 C ATOM 1938 O GLN A1042 18.163 -2.906 -9.851 1.00 0.00 O ATOM 1939 CB GLN A1042 15.080 -2.434 -9.035 1.00 0.00 C ATOM 1940 CG GLN A1042 14.978 -3.905 -9.407 1.00 0.00 C ATOM 1941 CD GLN A1042 13.708 -4.216 -10.173 1.00 0.00 C ATOM 1942 OE1 GLN A1042 13.126 -5.290 -10.022 1.00 0.00 O ATOM 1943 NE2 GLN A1042 13.295 -3.301 -11.036 1.00 0.00 N ATOM 0 H GLN A1042 15.507 -0.206 -8.011 1.00 0.00 H new ATOM 0 HA GLN A1042 16.753 -2.799 -7.731 1.00 0.00 H new ATOM 0 HB2 GLN A1042 14.293 -2.195 -8.319 1.00 0.00 H new ATOM 0 HB3 GLN A1042 14.895 -1.831 -9.924 1.00 0.00 H new ATOM 0 HG2 GLN A1042 15.842 -4.186 -10.010 1.00 0.00 H new ATOM 0 HG3 GLN A1042 15.011 -4.510 -8.501 1.00 0.00 H new ATOM 0 HE21 GLN A1042 13.805 -2.423 -11.132 1.00 0.00 H new ATOM 0 HE22 GLN A1042 12.467 -3.474 -11.605 1.00 0.00 H new ATOM 1952 N GLU A1043 17.587 -0.748 -10.139 1.00 0.00 N ATOM 1953 CA GLU A1043 18.453 -0.555 -11.295 1.00 0.00 C ATOM 1954 C GLU A1043 19.858 -0.125 -10.873 1.00 0.00 C ATOM 1955 O GLU A1043 20.775 -0.082 -11.694 1.00 0.00 O ATOM 1956 CB GLU A1043 17.863 0.500 -12.239 1.00 0.00 C ATOM 1957 CG GLU A1043 16.373 0.338 -12.513 1.00 0.00 C ATOM 1958 CD GLU A1043 15.998 -1.042 -13.008 1.00 0.00 C ATOM 1959 OE1 GLU A1043 16.272 -1.351 -14.185 1.00 0.00 O ATOM 1960 OE2 GLU A1043 15.450 -1.836 -12.215 1.00 0.00 O ATOM 0 H GLU A1043 17.093 0.092 -9.836 1.00 0.00 H new ATOM 0 HA GLU A1043 18.521 -1.511 -11.814 1.00 0.00 H new ATOM 0 HB2 GLU A1043 18.036 1.488 -11.813 1.00 0.00 H new ATOM 0 HB3 GLU A1043 18.400 0.463 -13.187 1.00 0.00 H new ATOM 0 HG2 GLU A1043 15.818 0.551 -11.599 1.00 0.00 H new ATOM 0 HG3 GLU A1043 16.065 1.077 -13.253 1.00 0.00 H new ATOM 1967 N ALA A1044 20.024 0.206 -9.601 1.00 0.00 N ATOM 1968 CA ALA A1044 21.314 0.656 -9.101 1.00 0.00 C ATOM 1969 C ALA A1044 21.739 -0.154 -7.882 1.00 0.00 C ATOM 1970 O ALA A1044 22.342 -1.232 -8.065 1.00 0.00 O ATOM 1971 CB ALA A1044 21.267 2.140 -8.770 1.00 0.00 C ATOM 1972 OXT ALA A1044 21.470 0.281 -6.743 1.00 0.00 O ATOM 0 H ALA A1044 19.285 0.172 -8.899 1.00 0.00 H new ATOM 0 HA ALA A1044 22.056 0.499 -9.884 1.00 0.00 H new ATOM 0 HB1 ALA A1044 22.240 2.461 -8.397 1.00 0.00 H new ATOM 0 HB2 ALA A1044 21.018 2.705 -9.668 1.00 0.00 H new ATOM 0 HB3 ALA A1044 20.509 2.319 -8.007 1.00 0.00 H new TER 1978 ALA A1044