USER MOD reduce.3.24.130724 H: found=0, std=0, add=1002, rem=0, adj=27 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: A 991 GLN : amide:sc= -0.451 K(o=-1.5,f=-0.66) USER MOD Set 1.2: A1042 GLN : amide:sc= -1.09 K(o=-1.5,f=0.029) USER MOD Single : A 912 THR OG1 : rot -170:sc= 0.0633 USER MOD Single : A 915 GLN : amide:sc= -0.335 K(o=-0.34,f=-0.91) USER MOD Single : A 919 HIS : no HD1:sc= -0.121 X(o=-0.12,f=-0.0076) USER MOD Single : A 922 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 923 GLN : amide:sc= -0.2 K(o=-0.2,f=-0.9) USER MOD Single : A 927 SER OG : rot 81:sc= 0.626 USER MOD Single : A 929 THR OG1 : rot 82:sc= 0.54 USER MOD Single : A 930 GLN : amide:sc= -0.418 X(o=-0.42,f=-0.14) USER MOD Single : A 931 THR OG1 : rot 78:sc= 0.564 USER MOD Single : A 936 GLN : amide:sc=-0.000128 K(o=-0.00013,f=-0.91) USER MOD Single : A 937 HIS : no HD1:sc= 0 X(o=0,f=-0.0092) USER MOD Single : A 940 SER OG : rot 180:sc= 0 USER MOD Single : A 943 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.01) USER MOD Single : A 945 SER OG : rot 180:sc= 0 USER MOD Single : A 949 GLN : amide:sc= -0.104 K(o=-0.1,f=-0.78) USER MOD Single : A 954 GLN : amide:sc= -0.36 K(o=-0.36,f=-1) USER MOD Single : A 955 SER OG : rot 90:sc= 0.376 USER MOD Single : A 956 CYS SG : rot -30:sc= 1.06 USER MOD Single : A 957 LYS NZ :NH3+ -122:sc= -0.33 (180deg=-1.51) USER MOD Single : A 962 GLN : amide:sc= -2.32! C(o=-2.3!,f=-8.5!) USER MOD Single : A 968 GLN : amide:sc= -2.84! C(o=-2.8!,f=-9.1!) USER MOD Single : A 973 SER OG : rot 89:sc= 0.364 USER MOD Single : A 974 GLN : amide:sc= -2.16! K(o=-2.2!,f=-0.16) USER MOD Single : A 976 GLN : amide:sc= -0.092 K(o=-0.092,f=-0.79) USER MOD Single : A 979 SER OG : rot 180:sc= 0.0147 USER MOD Single : A 981 SER OG : rot 180:sc= 0 USER MOD Single : A 983 GLN : amide:sc= 0.825 K(o=0.82,f=-0.18) USER MOD Single : A 990 SER OG : rot 50:sc= 0.897 USER MOD Single : A 992 SER OG : rot 80:sc= 0.135 USER MOD Single : A 995 GLN : amide:sc= -5.05! K(o=-5!,f=-0.84) USER MOD Single : A 999 LYS NZ :NH3+ -163:sc= -0.066 (180deg=-0.344) USER MOD Single : A1000 MET CE :methyl 153:sc= -1.89 (180deg=-3.45!) USER MOD Single : A1005 LYS NZ :NH3+ -170:sc=-0.00579 (180deg=-0.105) USER MOD Single : A1007 SER OG : rot -110:sc= -0.728 USER MOD Single : A1010 THR OG1 : rot 10:sc= 0.657 USER MOD Single : A1012 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A1014 GLN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A1016 SER OG : rot 21:sc= -1.17 USER MOD Single : A1018 MET CE :methyl -165:sc= -0.0658 (180deg=-0.397) USER MOD Single : A1019 GLN : amide:sc= -1.44 K(o=-1.4,f=-3.2!) USER MOD Single : A1021 SER OG : rot 76:sc= 0.365 USER MOD Single : A1022 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1023 CYS SG : rot 75:sc= 1.2 USER MOD Single : A1025 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1026 ASN : amide:sc= -0.0074 K(o=-0.0074,f=-1.1) USER MOD Single : A1029 THR OG1 : rot 82:sc= 1.24 USER MOD Single : A1036 THR OG1 : rot 86:sc= 1.21 USER MOD Single : A1039 GLN : amide:sc= -0.165 X(o=-0.17,f=-0.02) USER MOD Single : A1040 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0818) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 907 25.045 19.649 7.201 1.00 0.00 N ATOM 2 CA GLY A 907 25.958 19.361 6.071 1.00 0.00 C ATOM 3 C GLY A 907 25.277 18.546 4.993 1.00 0.00 C ATOM 4 O GLY A 907 24.049 18.454 4.961 1.00 0.00 O ATOM 0 HA2 GLY A 907 26.317 20.298 5.646 1.00 0.00 H new ATOM 0 HA3 GLY A 907 26.831 18.822 6.438 1.00 0.00 H new ATOM 10 N ILE A 908 26.068 17.941 4.114 1.00 0.00 N ATOM 11 CA ILE A 908 25.520 17.133 3.039 1.00 0.00 C ATOM 12 C ILE A 908 25.204 15.720 3.538 1.00 0.00 C ATOM 13 O ILE A 908 25.966 14.769 3.341 1.00 0.00 O ATOM 14 CB ILE A 908 26.462 17.100 1.802 1.00 0.00 C ATOM 15 CG1 ILE A 908 25.912 16.175 0.707 1.00 0.00 C ATOM 16 CG2 ILE A 908 27.877 16.692 2.191 1.00 0.00 C ATOM 17 CD1 ILE A 908 24.574 16.612 0.149 1.00 0.00 C ATOM 0 H ILE A 908 27.086 17.996 4.127 1.00 0.00 H new ATOM 0 HA ILE A 908 24.589 17.597 2.714 1.00 0.00 H new ATOM 0 HB ILE A 908 26.504 18.112 1.400 1.00 0.00 H new ATOM 0 HG12 ILE A 908 26.635 16.123 -0.107 1.00 0.00 H new ATOM 0 HG13 ILE A 908 25.814 15.168 1.112 1.00 0.00 H new ATOM 0 HG21 ILE A 908 28.509 16.679 1.303 1.00 0.00 H new ATOM 0 HG22 ILE A 908 28.277 17.406 2.911 1.00 0.00 H new ATOM 0 HG23 ILE A 908 27.859 15.698 2.638 1.00 0.00 H new ATOM 0 HD11 ILE A 908 24.253 15.908 -0.619 1.00 0.00 H new ATOM 0 HD12 ILE A 908 23.836 16.636 0.951 1.00 0.00 H new ATOM 0 HD13 ILE A 908 24.669 17.606 -0.287 1.00 0.00 H new ATOM 29 N ASP A 909 24.082 15.605 4.233 1.00 0.00 N ATOM 30 CA ASP A 909 23.602 14.315 4.709 1.00 0.00 C ATOM 31 C ASP A 909 22.182 14.082 4.220 1.00 0.00 C ATOM 32 O ASP A 909 21.215 14.431 4.901 1.00 0.00 O ATOM 33 CB ASP A 909 23.642 14.232 6.240 1.00 0.00 C ATOM 34 CG ASP A 909 25.049 14.248 6.805 1.00 0.00 C ATOM 35 OD1 ASP A 909 25.713 13.191 6.796 1.00 0.00 O ATOM 36 OD2 ASP A 909 25.508 15.320 7.245 1.00 0.00 O ATOM 0 H ASP A 909 23.484 16.393 4.481 1.00 0.00 H new ATOM 0 HA ASP A 909 24.261 13.543 4.311 1.00 0.00 H new ATOM 0 HB2 ASP A 909 23.081 15.068 6.657 1.00 0.00 H new ATOM 0 HB3 ASP A 909 23.139 13.319 6.561 1.00 0.00 H new ATOM 41 N PRO A 910 22.036 13.532 3.009 1.00 0.00 N ATOM 42 CA PRO A 910 20.738 13.257 2.414 1.00 0.00 C ATOM 43 C PRO A 910 20.235 11.864 2.772 1.00 0.00 C ATOM 44 O PRO A 910 20.708 11.248 3.733 1.00 0.00 O ATOM 45 CB PRO A 910 21.053 13.350 0.926 1.00 0.00 C ATOM 46 CG PRO A 910 22.424 12.784 0.817 1.00 0.00 C ATOM 47 CD PRO A 910 23.131 13.139 2.102 1.00 0.00 C ATOM 0 HA PRO A 910 19.954 13.934 2.753 1.00 0.00 H new ATOM 0 HB2 PRO A 910 20.338 12.783 0.330 1.00 0.00 H new ATOM 0 HB3 PRO A 910 21.017 14.381 0.573 1.00 0.00 H new ATOM 0 HG2 PRO A 910 22.389 11.703 0.678 1.00 0.00 H new ATOM 0 HG3 PRO A 910 22.949 13.199 -0.043 1.00 0.00 H new ATOM 0 HD2 PRO A 910 23.693 12.292 2.497 1.00 0.00 H new ATOM 0 HD3 PRO A 910 23.841 13.953 1.956 1.00 0.00 H new ATOM 55 N PHE A 911 19.294 11.368 1.992 1.00 0.00 N ATOM 56 CA PHE A 911 18.746 10.039 2.205 1.00 0.00 C ATOM 57 C PHE A 911 19.044 9.147 1.007 1.00 0.00 C ATOM 58 O PHE A 911 19.247 9.631 -0.107 1.00 0.00 O ATOM 59 CB PHE A 911 17.237 10.106 2.478 1.00 0.00 C ATOM 60 CG PHE A 911 16.449 10.876 1.452 1.00 0.00 C ATOM 61 CD1 PHE A 911 16.254 12.241 1.587 1.00 0.00 C ATOM 62 CD2 PHE A 911 15.911 10.233 0.349 1.00 0.00 C ATOM 63 CE1 PHE A 911 15.536 12.949 0.641 1.00 0.00 C ATOM 64 CE2 PHE A 911 15.193 10.936 -0.600 1.00 0.00 C ATOM 65 CZ PHE A 911 14.985 12.303 -0.431 1.00 0.00 C ATOM 0 H PHE A 911 18.890 11.868 1.200 1.00 0.00 H new ATOM 0 HA PHE A 911 19.223 9.606 3.084 1.00 0.00 H new ATOM 0 HB2 PHE A 911 16.845 9.090 2.531 1.00 0.00 H new ATOM 0 HB3 PHE A 911 17.078 10.561 3.456 1.00 0.00 H new ATOM 0 HD1 PHE A 911 16.667 12.758 2.441 1.00 0.00 H new ATOM 0 HD2 PHE A 911 16.054 9.169 0.229 1.00 0.00 H new ATOM 0 HE1 PHE A 911 15.410 14.016 0.749 1.00 0.00 H new ATOM 0 HE2 PHE A 911 14.796 10.429 -1.467 1.00 0.00 H new ATOM 0 HZ PHE A 911 14.389 12.852 -1.146 1.00 0.00 H new ATOM 75 N THR A 912 19.083 7.848 1.246 1.00 0.00 N ATOM 76 CA THR A 912 19.419 6.887 0.212 1.00 0.00 C ATOM 77 C THR A 912 18.186 6.472 -0.587 1.00 0.00 C ATOM 78 O THR A 912 17.062 6.881 -0.279 1.00 0.00 O ATOM 79 CB THR A 912 20.057 5.637 0.838 1.00 0.00 C ATOM 80 OG1 THR A 912 19.200 5.128 1.867 1.00 0.00 O ATOM 81 CG2 THR A 912 21.421 5.960 1.424 1.00 0.00 C ATOM 0 H THR A 912 18.884 7.432 2.156 1.00 0.00 H new ATOM 0 HA THR A 912 20.126 7.367 -0.464 1.00 0.00 H new ATOM 0 HB THR A 912 20.186 4.886 0.058 1.00 0.00 H new ATOM 0 HG1 THR A 912 19.671 4.432 2.371 1.00 0.00 H new ATOM 0 HG21 THR A 912 21.852 5.059 1.861 1.00 0.00 H new ATOM 0 HG22 THR A 912 22.077 6.331 0.636 1.00 0.00 H new ATOM 0 HG23 THR A 912 21.314 6.722 2.196 1.00 0.00 H new ATOM 89 N LEU A 913 18.403 5.659 -1.613 1.00 0.00 N ATOM 90 CA LEU A 913 17.314 5.112 -2.408 1.00 0.00 C ATOM 91 C LEU A 913 16.468 4.169 -1.561 1.00 0.00 C ATOM 92 O LEU A 913 15.238 4.178 -1.643 1.00 0.00 O ATOM 93 CB LEU A 913 17.865 4.369 -3.628 1.00 0.00 C ATOM 94 CG LEU A 913 18.659 5.232 -4.611 1.00 0.00 C ATOM 95 CD1 LEU A 913 19.305 4.365 -5.678 1.00 0.00 C ATOM 96 CD2 LEU A 913 17.760 6.276 -5.253 1.00 0.00 C ATOM 0 H LEU A 913 19.331 5.363 -1.915 1.00 0.00 H new ATOM 0 HA LEU A 913 16.689 5.935 -2.753 1.00 0.00 H new ATOM 0 HB2 LEU A 913 18.506 3.558 -3.281 1.00 0.00 H new ATOM 0 HB3 LEU A 913 17.032 3.911 -4.162 1.00 0.00 H new ATOM 0 HG LEU A 913 19.445 5.746 -4.058 1.00 0.00 H new ATOM 0 HD11 LEU A 913 19.866 4.995 -6.369 1.00 0.00 H new ATOM 0 HD12 LEU A 913 19.981 3.652 -5.207 1.00 0.00 H new ATOM 0 HD13 LEU A 913 18.532 3.825 -6.225 1.00 0.00 H new ATOM 0 HD21 LEU A 913 18.343 6.880 -5.949 1.00 0.00 H new ATOM 0 HD22 LEU A 913 16.953 5.779 -5.792 1.00 0.00 H new ATOM 0 HD23 LEU A 913 17.339 6.919 -4.480 1.00 0.00 H new ATOM 108 N VAL A 914 17.132 3.367 -0.733 1.00 0.00 N ATOM 109 CA VAL A 914 16.430 2.451 0.156 1.00 0.00 C ATOM 110 C VAL A 914 15.688 3.215 1.247 1.00 0.00 C ATOM 111 O VAL A 914 14.671 2.746 1.750 1.00 0.00 O ATOM 112 CB VAL A 914 17.372 1.407 0.798 1.00 0.00 C ATOM 113 CG1 VAL A 914 18.004 0.539 -0.274 1.00 0.00 C ATOM 114 CG2 VAL A 914 18.445 2.071 1.647 1.00 0.00 C ATOM 0 H VAL A 914 18.149 3.334 -0.660 1.00 0.00 H new ATOM 0 HA VAL A 914 15.712 1.911 -0.462 1.00 0.00 H new ATOM 0 HB VAL A 914 16.774 0.777 1.456 1.00 0.00 H new ATOM 0 HG11 VAL A 914 18.665 -0.192 0.192 1.00 0.00 H new ATOM 0 HG12 VAL A 914 17.223 0.020 -0.829 1.00 0.00 H new ATOM 0 HG13 VAL A 914 18.579 1.165 -0.957 1.00 0.00 H new ATOM 0 HG21 VAL A 914 19.089 1.307 2.083 1.00 0.00 H new ATOM 0 HG22 VAL A 914 19.042 2.736 1.024 1.00 0.00 H new ATOM 0 HG23 VAL A 914 17.974 2.646 2.444 1.00 0.00 H new ATOM 124 N GLN A 915 16.184 4.402 1.593 1.00 0.00 N ATOM 125 CA GLN A 915 15.495 5.262 2.546 1.00 0.00 C ATOM 126 C GLN A 915 14.133 5.672 2.011 1.00 0.00 C ATOM 127 O GLN A 915 13.169 5.782 2.767 1.00 0.00 O ATOM 128 CB GLN A 915 16.326 6.503 2.872 1.00 0.00 C ATOM 129 CG GLN A 915 17.154 6.361 4.135 1.00 0.00 C ATOM 130 CD GLN A 915 16.294 6.164 5.371 1.00 0.00 C ATOM 131 OE1 GLN A 915 15.168 6.662 5.450 1.00 0.00 O ATOM 132 NE2 GLN A 915 16.814 5.428 6.339 1.00 0.00 N ATOM 0 H GLN A 915 17.056 4.786 1.228 1.00 0.00 H new ATOM 0 HA GLN A 915 15.356 4.693 3.465 1.00 0.00 H new ATOM 0 HB2 GLN A 915 16.989 6.717 2.034 1.00 0.00 H new ATOM 0 HB3 GLN A 915 15.660 7.359 2.978 1.00 0.00 H new ATOM 0 HG2 GLN A 915 17.832 5.514 4.029 1.00 0.00 H new ATOM 0 HG3 GLN A 915 17.772 7.250 4.263 1.00 0.00 H new ATOM 0 HE21 GLN A 915 17.749 5.034 6.234 1.00 0.00 H new ATOM 0 HE22 GLN A 915 16.280 5.254 7.190 1.00 0.00 H new ATOM 141 N ARG A 916 14.053 5.888 0.702 1.00 0.00 N ATOM 142 CA ARG A 916 12.775 6.181 0.067 1.00 0.00 C ATOM 143 C ARG A 916 11.873 4.962 0.129 1.00 0.00 C ATOM 144 O ARG A 916 10.679 5.079 0.398 1.00 0.00 O ATOM 145 CB ARG A 916 12.950 6.615 -1.387 1.00 0.00 C ATOM 146 CG ARG A 916 13.639 7.955 -1.556 1.00 0.00 C ATOM 147 CD ARG A 916 13.346 8.549 -2.923 1.00 0.00 C ATOM 148 NE ARG A 916 11.918 8.820 -3.098 1.00 0.00 N ATOM 149 CZ ARG A 916 11.360 9.208 -4.244 1.00 0.00 C ATOM 150 NH1 ARG A 916 12.106 9.372 -5.331 1.00 0.00 N ATOM 151 NH2 ARG A 916 10.051 9.438 -4.300 1.00 0.00 N ATOM 0 H ARG A 916 14.850 5.866 0.066 1.00 0.00 H new ATOM 0 HA ARG A 916 12.319 7.007 0.612 1.00 0.00 H new ATOM 0 HB2 ARG A 916 13.525 5.854 -1.915 1.00 0.00 H new ATOM 0 HB3 ARG A 916 11.970 6.660 -1.862 1.00 0.00 H new ATOM 0 HG2 ARG A 916 13.304 8.641 -0.778 1.00 0.00 H new ATOM 0 HG3 ARG A 916 14.715 7.833 -1.432 1.00 0.00 H new ATOM 0 HD2 ARG A 916 13.910 9.473 -3.047 1.00 0.00 H new ATOM 0 HD3 ARG A 916 13.684 7.862 -3.699 1.00 0.00 H new ATOM 0 HE ARG A 916 11.309 8.704 -2.288 1.00 0.00 H new ATOM 0 HH11 ARG A 916 13.111 9.201 -5.291 1.00 0.00 H new ATOM 0 HH12 ARG A 916 11.674 9.669 -6.206 1.00 0.00 H new ATOM 0 HH21 ARG A 916 9.476 9.317 -3.466 1.00 0.00 H new ATOM 0 HH22 ARG A 916 9.622 9.735 -5.177 1.00 0.00 H new ATOM 165 N LEU A 917 12.456 3.793 -0.114 1.00 0.00 N ATOM 166 CA LEU A 917 11.722 2.539 -0.027 1.00 0.00 C ATOM 167 C LEU A 917 11.175 2.336 1.379 1.00 0.00 C ATOM 168 O LEU A 917 9.995 2.050 1.549 1.00 0.00 O ATOM 169 CB LEU A 917 12.612 1.363 -0.430 1.00 0.00 C ATOM 170 CG LEU A 917 12.919 1.273 -1.923 1.00 0.00 C ATOM 171 CD1 LEU A 917 13.907 0.152 -2.202 1.00 0.00 C ATOM 172 CD2 LEU A 917 11.636 1.055 -2.709 1.00 0.00 C ATOM 0 H LEU A 917 13.437 3.689 -0.373 1.00 0.00 H new ATOM 0 HA LEU A 917 10.882 2.586 -0.720 1.00 0.00 H new ATOM 0 HB2 LEU A 917 13.553 1.434 0.116 1.00 0.00 H new ATOM 0 HB3 LEU A 917 12.130 0.437 -0.116 1.00 0.00 H new ATOM 0 HG LEU A 917 13.371 2.213 -2.240 1.00 0.00 H new ATOM 0 HD11 LEU A 917 14.112 0.105 -3.272 1.00 0.00 H new ATOM 0 HD12 LEU A 917 14.835 0.342 -1.663 1.00 0.00 H new ATOM 0 HD13 LEU A 917 13.484 -0.797 -1.872 1.00 0.00 H new ATOM 0 HD21 LEU A 917 11.867 0.992 -3.772 1.00 0.00 H new ATOM 0 HD22 LEU A 917 11.164 0.128 -2.385 1.00 0.00 H new ATOM 0 HD23 LEU A 917 10.956 1.889 -2.534 1.00 0.00 H new ATOM 184 N GLU A 918 12.034 2.505 2.380 1.00 0.00 N ATOM 185 CA GLU A 918 11.609 2.436 3.775 1.00 0.00 C ATOM 186 C GLU A 918 10.484 3.433 4.032 1.00 0.00 C ATOM 187 O GLU A 918 9.421 3.075 4.540 1.00 0.00 O ATOM 188 CB GLU A 918 12.779 2.743 4.717 1.00 0.00 C ATOM 189 CG GLU A 918 13.911 1.731 4.662 1.00 0.00 C ATOM 190 CD GLU A 918 15.011 2.052 5.654 1.00 0.00 C ATOM 191 OE1 GLU A 918 14.722 2.083 6.869 1.00 0.00 O ATOM 192 OE2 GLU A 918 16.162 2.292 5.231 1.00 0.00 O ATOM 0 H GLU A 918 13.029 2.691 2.251 1.00 0.00 H new ATOM 0 HA GLU A 918 11.254 1.424 3.969 1.00 0.00 H new ATOM 0 HB2 GLU A 918 13.177 3.728 4.474 1.00 0.00 H new ATOM 0 HB3 GLU A 918 12.403 2.794 5.739 1.00 0.00 H new ATOM 0 HG2 GLU A 918 13.517 0.736 4.868 1.00 0.00 H new ATOM 0 HG3 GLU A 918 14.327 1.707 3.655 1.00 0.00 H new ATOM 199 N HIS A 919 10.736 4.681 3.654 1.00 0.00 N ATOM 200 CA HIS A 919 9.793 5.777 3.855 1.00 0.00 C ATOM 201 C HIS A 919 8.434 5.455 3.239 1.00 0.00 C ATOM 202 O HIS A 919 7.400 5.566 3.897 1.00 0.00 O ATOM 203 CB HIS A 919 10.367 7.057 3.228 1.00 0.00 C ATOM 204 CG HIS A 919 9.618 8.316 3.554 1.00 0.00 C ATOM 205 ND1 HIS A 919 10.153 9.322 4.325 1.00 0.00 N ATOM 206 CD2 HIS A 919 8.390 8.746 3.182 1.00 0.00 C ATOM 207 CE1 HIS A 919 9.289 10.312 4.418 1.00 0.00 C ATOM 208 NE2 HIS A 919 8.208 9.989 3.733 1.00 0.00 N ATOM 0 H HIS A 919 11.603 4.963 3.198 1.00 0.00 H new ATOM 0 HA HIS A 919 9.647 5.922 4.925 1.00 0.00 H new ATOM 0 HB2 HIS A 919 11.400 7.172 3.556 1.00 0.00 H new ATOM 0 HB3 HIS A 919 10.388 6.935 2.145 1.00 0.00 H new ATOM 0 HD2 HIS A 919 7.684 8.210 2.565 1.00 0.00 H new ATOM 0 HE1 HIS A 919 9.440 11.232 4.963 1.00 0.00 H new ATOM 0 HE2 HIS A 919 7.375 10.568 3.630 1.00 0.00 H new ATOM 216 N ALA A 920 8.447 5.049 1.981 1.00 0.00 N ATOM 217 CA ALA A 920 7.219 4.779 1.254 1.00 0.00 C ATOM 218 C ALA A 920 6.535 3.514 1.758 1.00 0.00 C ATOM 219 O ALA A 920 5.322 3.497 1.934 1.00 0.00 O ATOM 220 CB ALA A 920 7.501 4.674 -0.234 1.00 0.00 C ATOM 0 H ALA A 920 9.299 4.899 1.440 1.00 0.00 H new ATOM 0 HA ALA A 920 6.539 5.613 1.428 1.00 0.00 H new ATOM 0 HB1 ALA A 920 6.572 4.471 -0.767 1.00 0.00 H new ATOM 0 HB2 ALA A 920 7.927 5.612 -0.591 1.00 0.00 H new ATOM 0 HB3 ALA A 920 8.207 3.863 -0.414 1.00 0.00 H new ATOM 226 N ALA A 921 7.312 2.470 2.009 1.00 0.00 N ATOM 227 CA ALA A 921 6.756 1.190 2.436 1.00 0.00 C ATOM 228 C ALA A 921 6.063 1.297 3.789 1.00 0.00 C ATOM 229 O ALA A 921 4.995 0.722 3.989 1.00 0.00 O ATOM 230 CB ALA A 921 7.839 0.127 2.480 1.00 0.00 C ATOM 0 H ALA A 921 8.328 2.482 1.925 1.00 0.00 H new ATOM 0 HA ALA A 921 6.004 0.900 1.702 1.00 0.00 H new ATOM 0 HB1 ALA A 921 7.406 -0.821 2.800 1.00 0.00 H new ATOM 0 HB2 ALA A 921 8.274 0.010 1.488 1.00 0.00 H new ATOM 0 HB3 ALA A 921 8.615 0.427 3.184 1.00 0.00 H new ATOM 236 N LYS A 922 6.660 2.045 4.711 1.00 0.00 N ATOM 237 CA LYS A 922 6.089 2.195 6.047 1.00 0.00 C ATOM 238 C LYS A 922 4.747 2.923 5.993 1.00 0.00 C ATOM 239 O LYS A 922 3.797 2.537 6.677 1.00 0.00 O ATOM 240 CB LYS A 922 7.057 2.933 6.976 1.00 0.00 C ATOM 241 CG LYS A 922 8.276 2.107 7.359 1.00 0.00 C ATOM 242 CD LYS A 922 9.257 2.894 8.218 1.00 0.00 C ATOM 243 CE LYS A 922 9.856 4.066 7.456 1.00 0.00 C ATOM 244 NZ LYS A 922 10.953 4.729 8.211 1.00 0.00 N ATOM 0 H LYS A 922 7.532 2.553 4.561 1.00 0.00 H new ATOM 0 HA LYS A 922 5.920 1.196 6.448 1.00 0.00 H new ATOM 0 HB2 LYS A 922 7.388 3.851 6.489 1.00 0.00 H new ATOM 0 HB3 LYS A 922 6.527 3.226 7.882 1.00 0.00 H new ATOM 0 HG2 LYS A 922 7.954 1.217 7.900 1.00 0.00 H new ATOM 0 HG3 LYS A 922 8.780 1.765 6.455 1.00 0.00 H new ATOM 0 HD2 LYS A 922 8.748 3.261 9.109 1.00 0.00 H new ATOM 0 HD3 LYS A 922 10.055 2.234 8.557 1.00 0.00 H new ATOM 0 HE2 LYS A 922 10.238 3.716 6.497 1.00 0.00 H new ATOM 0 HE3 LYS A 922 9.074 4.794 7.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 922 11.330 5.521 7.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 922 10.585 5.088 9.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 922 11.712 4.043 8.394 1.00 0.00 H new ATOM 258 N GLN A 923 4.665 3.965 5.170 1.00 0.00 N ATOM 259 CA GLN A 923 3.431 4.734 5.053 1.00 0.00 C ATOM 260 C GLN A 923 2.427 4.011 4.158 1.00 0.00 C ATOM 261 O GLN A 923 1.216 4.168 4.317 1.00 0.00 O ATOM 262 CB GLN A 923 3.712 6.146 4.527 1.00 0.00 C ATOM 263 CG GLN A 923 4.253 6.192 3.107 1.00 0.00 C ATOM 264 CD GLN A 923 4.676 7.587 2.693 1.00 0.00 C ATOM 265 OE1 GLN A 923 5.107 8.389 3.522 1.00 0.00 O ATOM 266 NE2 GLN A 923 4.552 7.889 1.411 1.00 0.00 N ATOM 0 H GLN A 923 5.430 4.293 4.580 1.00 0.00 H new ATOM 0 HA GLN A 923 2.995 4.827 6.048 1.00 0.00 H new ATOM 0 HB2 GLN A 923 2.791 6.727 4.571 1.00 0.00 H new ATOM 0 HB3 GLN A 923 4.427 6.632 5.191 1.00 0.00 H new ATOM 0 HG2 GLN A 923 5.105 5.518 3.024 1.00 0.00 H new ATOM 0 HG3 GLN A 923 3.490 5.828 2.419 1.00 0.00 H new ATOM 0 HE21 GLN A 923 4.190 7.195 0.756 1.00 0.00 H new ATOM 0 HE22 GLN A 923 4.818 8.815 1.077 1.00 0.00 H new ATOM 275 N ALA A 924 2.936 3.211 3.226 1.00 0.00 N ATOM 276 CA ALA A 924 2.084 2.389 2.378 1.00 0.00 C ATOM 277 C ALA A 924 1.424 1.303 3.208 1.00 0.00 C ATOM 278 O ALA A 924 0.216 1.104 3.132 1.00 0.00 O ATOM 279 CB ALA A 924 2.880 1.773 1.236 1.00 0.00 C ATOM 0 H ALA A 924 3.934 3.116 3.040 1.00 0.00 H new ATOM 0 HA ALA A 924 1.313 3.026 1.944 1.00 0.00 H new ATOM 0 HB1 ALA A 924 2.219 1.164 0.619 1.00 0.00 H new ATOM 0 HB2 ALA A 924 3.317 2.565 0.628 1.00 0.00 H new ATOM 0 HB3 ALA A 924 3.675 1.148 1.642 1.00 0.00 H new ATOM 285 N ALA A 925 2.229 0.620 4.016 1.00 0.00 N ATOM 286 CA ALA A 925 1.731 -0.416 4.911 1.00 0.00 C ATOM 287 C ALA A 925 0.691 0.157 5.869 1.00 0.00 C ATOM 288 O ALA A 925 -0.328 -0.478 6.162 1.00 0.00 O ATOM 289 CB ALA A 925 2.889 -1.038 5.682 1.00 0.00 C ATOM 0 H ALA A 925 3.237 0.768 4.068 1.00 0.00 H new ATOM 0 HA ALA A 925 1.250 -1.193 4.316 1.00 0.00 H new ATOM 0 HB1 ALA A 925 2.508 -1.812 6.349 1.00 0.00 H new ATOM 0 HB2 ALA A 925 3.597 -1.480 4.981 1.00 0.00 H new ATOM 0 HB3 ALA A 925 3.391 -0.268 6.268 1.00 0.00 H new ATOM 295 N ALA A 926 0.947 1.373 6.339 1.00 0.00 N ATOM 296 CA ALA A 926 0.024 2.068 7.225 1.00 0.00 C ATOM 297 C ALA A 926 -1.276 2.402 6.502 1.00 0.00 C ATOM 298 O ALA A 926 -2.357 1.987 6.924 1.00 0.00 O ATOM 299 CB ALA A 926 0.673 3.335 7.761 1.00 0.00 C ATOM 0 H ALA A 926 1.792 1.900 6.118 1.00 0.00 H new ATOM 0 HA ALA A 926 -0.214 1.410 8.061 1.00 0.00 H new ATOM 0 HB1 ALA A 926 -0.024 3.849 8.423 1.00 0.00 H new ATOM 0 HB2 ALA A 926 1.575 3.075 8.315 1.00 0.00 H new ATOM 0 HB3 ALA A 926 0.934 3.990 6.930 1.00 0.00 H new ATOM 305 N SER A 927 -1.159 3.133 5.397 1.00 0.00 N ATOM 306 CA SER A 927 -2.317 3.555 4.621 1.00 0.00 C ATOM 307 C SER A 927 -3.121 2.357 4.120 1.00 0.00 C ATOM 308 O SER A 927 -4.348 2.409 4.066 1.00 0.00 O ATOM 309 CB SER A 927 -1.871 4.423 3.444 1.00 0.00 C ATOM 310 OG SER A 927 -1.233 5.604 3.901 1.00 0.00 O ATOM 0 H SER A 927 -0.265 3.447 5.018 1.00 0.00 H new ATOM 0 HA SER A 927 -2.965 4.140 5.274 1.00 0.00 H new ATOM 0 HB2 SER A 927 -1.189 3.859 2.808 1.00 0.00 H new ATOM 0 HB3 SER A 927 -2.734 4.684 2.832 1.00 0.00 H new ATOM 0 HG SER A 927 -0.304 5.403 4.138 1.00 0.00 H new ATOM 316 N ALA A 928 -2.428 1.283 3.763 1.00 0.00 N ATOM 317 CA ALA A 928 -3.084 0.068 3.303 1.00 0.00 C ATOM 318 C ALA A 928 -3.985 -0.503 4.387 1.00 0.00 C ATOM 319 O ALA A 928 -5.169 -0.748 4.154 1.00 0.00 O ATOM 320 CB ALA A 928 -2.056 -0.964 2.878 1.00 0.00 C ATOM 0 H ALA A 928 -1.410 1.230 3.784 1.00 0.00 H new ATOM 0 HA ALA A 928 -3.701 0.322 2.441 1.00 0.00 H new ATOM 0 HB1 ALA A 928 -2.565 -1.866 2.537 1.00 0.00 H new ATOM 0 HB2 ALA A 928 -1.450 -0.561 2.067 1.00 0.00 H new ATOM 0 HB3 ALA A 928 -1.414 -1.208 3.724 1.00 0.00 H new ATOM 326 N THR A 929 -3.424 -0.687 5.577 1.00 0.00 N ATOM 327 CA THR A 929 -4.175 -1.216 6.705 1.00 0.00 C ATOM 328 C THR A 929 -5.352 -0.300 7.040 1.00 0.00 C ATOM 329 O THR A 929 -6.452 -0.765 7.349 1.00 0.00 O ATOM 330 CB THR A 929 -3.273 -1.375 7.948 1.00 0.00 C ATOM 331 OG1 THR A 929 -2.061 -2.062 7.590 1.00 0.00 O ATOM 332 CG2 THR A 929 -3.988 -2.152 9.042 1.00 0.00 C ATOM 0 H THR A 929 -2.448 -0.476 5.784 1.00 0.00 H new ATOM 0 HA THR A 929 -4.552 -2.198 6.421 1.00 0.00 H new ATOM 0 HB THR A 929 -3.035 -0.380 8.324 1.00 0.00 H new ATOM 0 HG1 THR A 929 -1.428 -1.425 7.197 1.00 0.00 H new ATOM 0 HG21 THR A 929 -3.332 -2.250 9.907 1.00 0.00 H new ATOM 0 HG22 THR A 929 -4.894 -1.621 9.333 1.00 0.00 H new ATOM 0 HG23 THR A 929 -4.251 -3.143 8.672 1.00 0.00 H new ATOM 340 N GLN A 930 -5.119 1.006 6.948 1.00 0.00 N ATOM 341 CA GLN A 930 -6.163 1.990 7.193 1.00 0.00 C ATOM 342 C GLN A 930 -7.267 1.889 6.147 1.00 0.00 C ATOM 343 O GLN A 930 -8.449 1.973 6.475 1.00 0.00 O ATOM 344 CB GLN A 930 -5.574 3.401 7.200 1.00 0.00 C ATOM 345 CG GLN A 930 -4.694 3.687 8.405 1.00 0.00 C ATOM 346 CD GLN A 930 -5.469 3.655 9.709 1.00 0.00 C ATOM 347 OE1 GLN A 930 -6.007 4.672 10.147 1.00 0.00 O ATOM 348 NE2 GLN A 930 -5.528 2.492 10.337 1.00 0.00 N ATOM 0 H GLN A 930 -4.213 1.406 6.705 1.00 0.00 H new ATOM 0 HA GLN A 930 -6.598 1.782 8.171 1.00 0.00 H new ATOM 0 HB2 GLN A 930 -4.990 3.546 6.291 1.00 0.00 H new ATOM 0 HB3 GLN A 930 -6.388 4.126 7.175 1.00 0.00 H new ATOM 0 HG2 GLN A 930 -3.889 2.953 8.446 1.00 0.00 H new ATOM 0 HG3 GLN A 930 -4.228 4.665 8.287 1.00 0.00 H new ATOM 0 HE21 GLN A 930 -5.068 1.673 9.939 1.00 0.00 H new ATOM 0 HE22 GLN A 930 -6.034 2.414 11.219 1.00 0.00 H new ATOM 357 N THR A 931 -6.881 1.699 4.891 1.00 0.00 N ATOM 358 CA THR A 931 -7.848 1.573 3.810 1.00 0.00 C ATOM 359 C THR A 931 -8.655 0.286 3.961 1.00 0.00 C ATOM 360 O THR A 931 -9.844 0.258 3.660 1.00 0.00 O ATOM 361 CB THR A 931 -7.160 1.606 2.428 1.00 0.00 C ATOM 362 OG1 THR A 931 -6.317 2.762 2.336 1.00 0.00 O ATOM 363 CG2 THR A 931 -8.189 1.640 1.305 1.00 0.00 C ATOM 0 H THR A 931 -5.907 1.629 4.597 1.00 0.00 H new ATOM 0 HA THR A 931 -8.523 2.427 3.872 1.00 0.00 H new ATOM 0 HB THR A 931 -6.562 0.701 2.323 1.00 0.00 H new ATOM 0 HG1 THR A 931 -5.485 2.600 2.829 1.00 0.00 H new ATOM 0 HG21 THR A 931 -7.677 1.663 0.343 1.00 0.00 H new ATOM 0 HG22 THR A 931 -8.818 0.751 1.361 1.00 0.00 H new ATOM 0 HG23 THR A 931 -8.810 2.530 1.407 1.00 0.00 H new ATOM 371 N ILE A 932 -8.009 -0.771 4.448 1.00 0.00 N ATOM 372 CA ILE A 932 -8.698 -2.028 4.727 1.00 0.00 C ATOM 373 C ILE A 932 -9.770 -1.816 5.791 1.00 0.00 C ATOM 374 O ILE A 932 -10.920 -2.227 5.624 1.00 0.00 O ATOM 375 CB ILE A 932 -7.720 -3.124 5.207 1.00 0.00 C ATOM 376 CG1 ILE A 932 -6.709 -3.457 4.106 1.00 0.00 C ATOM 377 CG2 ILE A 932 -8.483 -4.374 5.631 1.00 0.00 C ATOM 378 CD1 ILE A 932 -5.629 -4.422 4.543 1.00 0.00 C ATOM 0 H ILE A 932 -7.011 -0.782 4.657 1.00 0.00 H new ATOM 0 HA ILE A 932 -9.156 -2.359 3.795 1.00 0.00 H new ATOM 0 HB ILE A 932 -7.175 -2.746 6.072 1.00 0.00 H new ATOM 0 HG12 ILE A 932 -7.240 -3.881 3.254 1.00 0.00 H new ATOM 0 HG13 ILE A 932 -6.242 -2.534 3.763 1.00 0.00 H new ATOM 0 HG21 ILE A 932 -7.778 -5.135 5.966 1.00 0.00 H new ATOM 0 HG22 ILE A 932 -9.163 -4.126 6.446 1.00 0.00 H new ATOM 0 HG23 ILE A 932 -9.054 -4.756 4.785 1.00 0.00 H new ATOM 0 HD11 ILE A 932 -4.951 -4.610 3.711 1.00 0.00 H new ATOM 0 HD12 ILE A 932 -5.072 -3.992 5.375 1.00 0.00 H new ATOM 0 HD13 ILE A 932 -6.085 -5.360 4.858 1.00 0.00 H new ATOM 390 N ALA A 933 -9.383 -1.159 6.879 1.00 0.00 N ATOM 391 CA ALA A 933 -10.305 -0.857 7.963 1.00 0.00 C ATOM 392 C ALA A 933 -11.447 0.018 7.466 1.00 0.00 C ATOM 393 O ALA A 933 -12.607 -0.197 7.817 1.00 0.00 O ATOM 394 CB ALA A 933 -9.570 -0.172 9.105 1.00 0.00 C ATOM 0 H ALA A 933 -8.432 -0.825 7.032 1.00 0.00 H new ATOM 0 HA ALA A 933 -10.725 -1.793 8.330 1.00 0.00 H new ATOM 0 HB1 ALA A 933 -10.272 0.048 9.909 1.00 0.00 H new ATOM 0 HB2 ALA A 933 -8.785 -0.829 9.479 1.00 0.00 H new ATOM 0 HB3 ALA A 933 -9.126 0.757 8.747 1.00 0.00 H new ATOM 400 N ALA A 934 -11.110 0.993 6.633 1.00 0.00 N ATOM 401 CA ALA A 934 -12.097 1.889 6.056 1.00 0.00 C ATOM 402 C ALA A 934 -13.031 1.138 5.115 1.00 0.00 C ATOM 403 O ALA A 934 -14.245 1.301 5.175 1.00 0.00 O ATOM 404 CB ALA A 934 -11.413 3.030 5.322 1.00 0.00 C ATOM 0 H ALA A 934 -10.151 1.183 6.341 1.00 0.00 H new ATOM 0 HA ALA A 934 -12.694 2.303 6.869 1.00 0.00 H new ATOM 0 HB1 ALA A 934 -12.167 3.692 4.896 1.00 0.00 H new ATOM 0 HB2 ALA A 934 -10.791 3.590 6.020 1.00 0.00 H new ATOM 0 HB3 ALA A 934 -10.790 2.627 4.523 1.00 0.00 H new ATOM 410 N ALA A 935 -12.458 0.301 4.261 1.00 0.00 N ATOM 411 CA ALA A 935 -13.231 -0.440 3.270 1.00 0.00 C ATOM 412 C ALA A 935 -14.265 -1.343 3.933 1.00 0.00 C ATOM 413 O ALA A 935 -15.361 -1.538 3.409 1.00 0.00 O ATOM 414 CB ALA A 935 -12.303 -1.259 2.381 1.00 0.00 C ATOM 0 H ALA A 935 -11.455 0.117 4.234 1.00 0.00 H new ATOM 0 HA ALA A 935 -13.766 0.282 2.653 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -12.893 -1.807 1.646 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -11.610 -0.593 1.867 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -11.741 -1.964 2.994 1.00 0.00 H new ATOM 420 N GLN A 936 -13.919 -1.876 5.096 1.00 0.00 N ATOM 421 CA GLN A 936 -14.798 -2.799 5.795 1.00 0.00 C ATOM 422 C GLN A 936 -15.617 -2.089 6.876 1.00 0.00 C ATOM 423 O GLN A 936 -16.298 -2.736 7.672 1.00 0.00 O ATOM 424 CB GLN A 936 -13.982 -3.942 6.409 1.00 0.00 C ATOM 425 CG GLN A 936 -13.149 -4.708 5.387 1.00 0.00 C ATOM 426 CD GLN A 936 -12.501 -5.952 5.960 1.00 0.00 C ATOM 427 OE1 GLN A 936 -13.024 -6.574 6.887 1.00 0.00 O ATOM 428 NE2 GLN A 936 -11.358 -6.329 5.409 1.00 0.00 N ATOM 0 H GLN A 936 -13.038 -1.685 5.573 1.00 0.00 H new ATOM 0 HA GLN A 936 -15.498 -3.209 5.067 1.00 0.00 H new ATOM 0 HB2 GLN A 936 -13.321 -3.536 7.175 1.00 0.00 H new ATOM 0 HB3 GLN A 936 -14.659 -4.635 6.908 1.00 0.00 H new ATOM 0 HG2 GLN A 936 -13.785 -4.990 4.548 1.00 0.00 H new ATOM 0 HG3 GLN A 936 -12.374 -4.051 4.993 1.00 0.00 H new ATOM 0 HE21 GLN A 936 -10.958 -5.787 4.643 1.00 0.00 H new ATOM 0 HE22 GLN A 936 -10.878 -7.162 5.750 1.00 0.00 H new ATOM 437 N HIS A 937 -15.564 -0.758 6.901 1.00 0.00 N ATOM 438 CA HIS A 937 -16.332 0.006 7.885 1.00 0.00 C ATOM 439 C HIS A 937 -17.198 1.066 7.207 1.00 0.00 C ATOM 440 O HIS A 937 -18.303 1.358 7.665 1.00 0.00 O ATOM 441 CB HIS A 937 -15.402 0.668 8.910 1.00 0.00 C ATOM 442 CG HIS A 937 -16.126 1.224 10.098 1.00 0.00 C ATOM 443 ND1 HIS A 937 -16.182 2.571 10.399 1.00 0.00 N ATOM 444 CD2 HIS A 937 -16.827 0.598 11.075 1.00 0.00 C ATOM 445 CE1 HIS A 937 -16.885 2.742 11.503 1.00 0.00 C ATOM 446 NE2 HIS A 937 -17.286 1.563 11.929 1.00 0.00 N ATOM 0 H HIS A 937 -15.006 -0.192 6.261 1.00 0.00 H new ATOM 0 HA HIS A 937 -16.986 -0.694 8.405 1.00 0.00 H new ATOM 0 HB2 HIS A 937 -14.669 -0.063 9.250 1.00 0.00 H new ATOM 0 HB3 HIS A 937 -14.849 1.471 8.422 1.00 0.00 H new ATOM 0 HD2 HIS A 937 -16.992 -0.466 11.163 1.00 0.00 H new ATOM 0 HE1 HIS A 937 -17.096 3.689 11.977 1.00 0.00 H new ATOM 0 HE2 HIS A 937 -17.849 1.396 12.763 1.00 0.00 H new ATOM 454 N ALA A 938 -16.685 1.646 6.128 1.00 0.00 N ATOM 455 CA ALA A 938 -17.414 2.666 5.388 1.00 0.00 C ATOM 456 C ALA A 938 -18.622 2.064 4.689 1.00 0.00 C ATOM 457 O ALA A 938 -19.715 2.630 4.721 1.00 0.00 O ATOM 458 CB ALA A 938 -16.500 3.345 4.379 1.00 0.00 C ATOM 0 H ALA A 938 -15.765 1.426 5.747 1.00 0.00 H new ATOM 0 HA ALA A 938 -17.767 3.415 6.096 1.00 0.00 H new ATOM 0 HB1 ALA A 938 -17.060 4.105 3.834 1.00 0.00 H new ATOM 0 HB2 ALA A 938 -15.666 3.814 4.901 1.00 0.00 H new ATOM 0 HB3 ALA A 938 -16.118 2.603 3.678 1.00 0.00 H new ATOM 464 N ALA A 939 -18.421 0.909 4.063 1.00 0.00 N ATOM 465 CA ALA A 939 -19.503 0.210 3.393 1.00 0.00 C ATOM 466 C ALA A 939 -20.457 -0.391 4.421 1.00 0.00 C ATOM 467 O ALA A 939 -20.273 -1.520 4.875 1.00 0.00 O ATOM 468 CB ALA A 939 -18.956 -0.866 2.468 1.00 0.00 C ATOM 0 H ALA A 939 -17.517 0.440 4.008 1.00 0.00 H new ATOM 0 HA ALA A 939 -20.057 0.926 2.785 1.00 0.00 H new ATOM 0 HB1 ALA A 939 -19.783 -1.378 1.976 1.00 0.00 H new ATOM 0 HB2 ALA A 939 -18.314 -0.407 1.716 1.00 0.00 H new ATOM 0 HB3 ALA A 939 -18.378 -1.585 3.048 1.00 0.00 H new ATOM 474 N SER A 940 -21.448 0.392 4.811 1.00 0.00 N ATOM 475 CA SER A 940 -22.406 -0.027 5.815 1.00 0.00 C ATOM 476 C SER A 940 -23.497 -0.887 5.188 1.00 0.00 C ATOM 477 O SER A 940 -24.248 -0.424 4.326 1.00 0.00 O ATOM 478 CB SER A 940 -23.009 1.201 6.486 1.00 0.00 C ATOM 479 OG SER A 940 -21.985 2.089 6.918 1.00 0.00 O ATOM 0 H SER A 940 -21.609 1.329 4.443 1.00 0.00 H new ATOM 0 HA SER A 940 -21.895 -0.628 6.567 1.00 0.00 H new ATOM 0 HB2 SER A 940 -23.672 1.714 5.790 1.00 0.00 H new ATOM 0 HB3 SER A 940 -23.616 0.895 7.338 1.00 0.00 H new ATOM 0 HG SER A 940 -22.390 2.873 7.345 1.00 0.00 H new ATOM 485 N ALA A 941 -23.563 -2.139 5.610 1.00 0.00 N ATOM 486 CA ALA A 941 -24.535 -3.077 5.074 1.00 0.00 C ATOM 487 C ALA A 941 -25.839 -3.027 5.864 1.00 0.00 C ATOM 488 O ALA A 941 -25.858 -3.321 7.058 1.00 0.00 O ATOM 489 CB ALA A 941 -23.959 -4.483 5.089 1.00 0.00 C ATOM 0 H ALA A 941 -22.951 -2.531 6.326 1.00 0.00 H new ATOM 0 HA ALA A 941 -24.757 -2.793 4.045 1.00 0.00 H new ATOM 0 HB1 ALA A 941 -24.693 -5.181 4.686 1.00 0.00 H new ATOM 0 HB2 ALA A 941 -23.056 -4.513 4.479 1.00 0.00 H new ATOM 0 HB3 ALA A 941 -23.714 -4.765 6.113 1.00 0.00 H new ATOM 495 N PRO A 942 -26.945 -2.635 5.207 1.00 0.00 N ATOM 496 CA PRO A 942 -28.269 -2.608 5.827 1.00 0.00 C ATOM 497 C PRO A 942 -28.961 -3.964 5.749 1.00 0.00 C ATOM 498 O PRO A 942 -30.154 -4.096 6.036 1.00 0.00 O ATOM 499 CB PRO A 942 -29.011 -1.576 4.984 1.00 0.00 C ATOM 500 CG PRO A 942 -28.417 -1.708 3.621 1.00 0.00 C ATOM 501 CD PRO A 942 -26.988 -2.165 3.811 1.00 0.00 C ATOM 0 HA PRO A 942 -28.233 -2.369 6.890 1.00 0.00 H new ATOM 0 HB2 PRO A 942 -30.083 -1.772 4.970 1.00 0.00 H new ATOM 0 HB3 PRO A 942 -28.876 -0.569 5.380 1.00 0.00 H new ATOM 0 HG2 PRO A 942 -28.977 -2.427 3.023 1.00 0.00 H new ATOM 0 HG3 PRO A 942 -28.452 -0.757 3.090 1.00 0.00 H new ATOM 0 HD2 PRO A 942 -26.728 -2.961 3.114 1.00 0.00 H new ATOM 0 HD3 PRO A 942 -26.283 -1.351 3.642 1.00 0.00 H new ATOM 509 N LYS A 943 -28.188 -4.961 5.345 1.00 0.00 N ATOM 510 CA LYS A 943 -28.661 -6.329 5.188 1.00 0.00 C ATOM 511 C LYS A 943 -27.473 -7.216 4.843 1.00 0.00 C ATOM 512 O LYS A 943 -26.330 -6.808 5.052 1.00 0.00 O ATOM 513 CB LYS A 943 -29.746 -6.414 4.103 1.00 0.00 C ATOM 514 CG LYS A 943 -29.336 -5.871 2.741 1.00 0.00 C ATOM 515 CD LYS A 943 -30.507 -5.931 1.770 1.00 0.00 C ATOM 516 CE LYS A 943 -30.168 -5.342 0.409 1.00 0.00 C ATOM 517 NZ LYS A 943 -29.142 -6.135 -0.318 1.00 0.00 N ATOM 0 H LYS A 943 -27.202 -4.841 5.114 1.00 0.00 H new ATOM 0 HA LYS A 943 -29.112 -6.670 6.120 1.00 0.00 H new ATOM 0 HB2 LYS A 943 -30.043 -7.456 3.988 1.00 0.00 H new ATOM 0 HB3 LYS A 943 -30.625 -5.868 4.446 1.00 0.00 H new ATOM 0 HG2 LYS A 943 -28.992 -4.842 2.842 1.00 0.00 H new ATOM 0 HG3 LYS A 943 -28.500 -6.450 2.348 1.00 0.00 H new ATOM 0 HD2 LYS A 943 -30.819 -6.968 1.646 1.00 0.00 H new ATOM 0 HD3 LYS A 943 -31.354 -5.392 2.194 1.00 0.00 H new ATOM 0 HE2 LYS A 943 -31.074 -5.287 -0.195 1.00 0.00 H new ATOM 0 HE3 LYS A 943 -29.808 -4.321 0.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 943 -28.972 -5.710 -1.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 943 -28.256 -6.139 0.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 943 -29.479 -7.112 -0.438 1.00 0.00 H new ATOM 531 N ALA A 944 -27.733 -8.419 4.331 1.00 0.00 N ATOM 532 CA ALA A 944 -26.660 -9.324 3.919 1.00 0.00 C ATOM 533 C ALA A 944 -25.660 -8.600 3.024 1.00 0.00 C ATOM 534 O ALA A 944 -24.451 -8.643 3.270 1.00 0.00 O ATOM 535 CB ALA A 944 -27.235 -10.540 3.206 1.00 0.00 C ATOM 0 H ALA A 944 -28.674 -8.788 4.192 1.00 0.00 H new ATOM 0 HA ALA A 944 -26.135 -9.664 4.812 1.00 0.00 H new ATOM 0 HB1 ALA A 944 -26.424 -11.203 2.906 1.00 0.00 H new ATOM 0 HB2 ALA A 944 -27.908 -11.071 3.879 1.00 0.00 H new ATOM 0 HB3 ALA A 944 -27.785 -10.217 2.322 1.00 0.00 H new ATOM 541 N SER A 945 -26.185 -7.941 1.988 1.00 0.00 N ATOM 542 CA SER A 945 -25.413 -7.047 1.118 1.00 0.00 C ATOM 543 C SER A 945 -24.481 -7.817 0.180 1.00 0.00 C ATOM 544 O SER A 945 -24.522 -7.628 -1.040 1.00 0.00 O ATOM 545 CB SER A 945 -24.621 -6.029 1.953 1.00 0.00 C ATOM 546 OG SER A 945 -24.077 -4.997 1.141 1.00 0.00 O ATOM 0 H SER A 945 -27.168 -8.013 1.726 1.00 0.00 H new ATOM 0 HA SER A 945 -26.127 -6.510 0.493 1.00 0.00 H new ATOM 0 HB2 SER A 945 -25.273 -5.592 2.709 1.00 0.00 H new ATOM 0 HB3 SER A 945 -23.816 -6.539 2.482 1.00 0.00 H new ATOM 0 HG SER A 945 -23.581 -4.366 1.703 1.00 0.00 H new ATOM 552 N ALA A 946 -23.655 -8.687 0.740 1.00 0.00 N ATOM 553 CA ALA A 946 -22.662 -9.407 -0.040 1.00 0.00 C ATOM 554 C ALA A 946 -23.287 -10.551 -0.831 1.00 0.00 C ATOM 555 O ALA A 946 -23.299 -11.701 -0.384 1.00 0.00 O ATOM 556 CB ALA A 946 -21.549 -9.924 0.863 1.00 0.00 C ATOM 0 H ALA A 946 -23.653 -8.912 1.735 1.00 0.00 H new ATOM 0 HA ALA A 946 -22.235 -8.707 -0.759 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -20.814 -10.461 0.263 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -21.066 -9.084 1.363 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -21.970 -10.598 1.610 1.00 0.00 H new ATOM 562 N GLY A 947 -23.856 -10.216 -1.981 1.00 0.00 N ATOM 563 CA GLY A 947 -24.318 -11.230 -2.909 1.00 0.00 C ATOM 564 C GLY A 947 -23.153 -11.795 -3.693 1.00 0.00 C ATOM 565 O GLY A 947 -22.674 -12.890 -3.400 1.00 0.00 O ATOM 0 H GLY A 947 -24.007 -9.255 -2.289 1.00 0.00 H new ATOM 0 HA2 GLY A 947 -24.820 -12.029 -2.364 1.00 0.00 H new ATOM 0 HA3 GLY A 947 -25.051 -10.801 -3.592 1.00 0.00 H new ATOM 569 N PRO A 948 -22.676 -11.061 -4.704 1.00 0.00 N ATOM 570 CA PRO A 948 -21.411 -11.368 -5.365 1.00 0.00 C ATOM 571 C PRO A 948 -20.235 -10.926 -4.497 1.00 0.00 C ATOM 572 O PRO A 948 -20.382 -10.019 -3.673 1.00 0.00 O ATOM 573 CB PRO A 948 -21.475 -10.546 -6.651 1.00 0.00 C ATOM 574 CG PRO A 948 -22.345 -9.383 -6.312 1.00 0.00 C ATOM 575 CD PRO A 948 -23.340 -9.885 -5.298 1.00 0.00 C ATOM 0 HA PRO A 948 -21.269 -12.433 -5.549 1.00 0.00 H new ATOM 0 HB2 PRO A 948 -20.483 -10.221 -6.963 1.00 0.00 H new ATOM 0 HB3 PRO A 948 -21.893 -11.128 -7.473 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -21.756 -8.561 -5.905 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -22.851 -9.004 -7.200 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -23.561 -9.128 -4.546 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -24.287 -10.154 -5.766 1.00 0.00 H new ATOM 583 N GLN A 949 -19.085 -11.569 -4.664 1.00 0.00 N ATOM 584 CA GLN A 949 -17.902 -11.229 -3.882 1.00 0.00 C ATOM 585 C GLN A 949 -17.544 -9.749 -4.036 1.00 0.00 C ATOM 586 O GLN A 949 -17.326 -9.261 -5.150 1.00 0.00 O ATOM 587 CB GLN A 949 -16.707 -12.107 -4.279 1.00 0.00 C ATOM 588 CG GLN A 949 -16.364 -12.060 -5.760 1.00 0.00 C ATOM 589 CD GLN A 949 -15.032 -12.715 -6.075 1.00 0.00 C ATOM 590 OE1 GLN A 949 -13.990 -12.059 -6.072 1.00 0.00 O ATOM 591 NE2 GLN A 949 -15.053 -14.011 -6.336 1.00 0.00 N ATOM 0 H GLN A 949 -18.947 -12.327 -5.332 1.00 0.00 H new ATOM 0 HA GLN A 949 -18.137 -11.418 -2.835 1.00 0.00 H new ATOM 0 HB2 GLN A 949 -15.834 -11.795 -3.705 1.00 0.00 H new ATOM 0 HB3 GLN A 949 -16.920 -13.139 -3.999 1.00 0.00 H new ATOM 0 HG2 GLN A 949 -17.151 -12.557 -6.327 1.00 0.00 H new ATOM 0 HG3 GLN A 949 -16.340 -11.022 -6.090 1.00 0.00 H new ATOM 0 HE21 GLN A 949 -15.938 -14.518 -6.328 1.00 0.00 H new ATOM 0 HE22 GLN A 949 -14.184 -14.503 -6.545 1.00 0.00 H new ATOM 600 N PRO A 950 -17.516 -9.007 -2.919 1.00 0.00 N ATOM 601 CA PRO A 950 -17.108 -7.603 -2.913 1.00 0.00 C ATOM 602 C PRO A 950 -15.625 -7.454 -3.222 1.00 0.00 C ATOM 603 O PRO A 950 -14.782 -8.053 -2.550 1.00 0.00 O ATOM 604 CB PRO A 950 -17.403 -7.132 -1.481 1.00 0.00 C ATOM 605 CG PRO A 950 -18.266 -8.191 -0.881 1.00 0.00 C ATOM 606 CD PRO A 950 -17.898 -9.468 -1.577 1.00 0.00 C ATOM 0 HA PRO A 950 -17.634 -7.022 -3.671 1.00 0.00 H new ATOM 0 HB2 PRO A 950 -16.482 -7.008 -0.912 1.00 0.00 H new ATOM 0 HB3 PRO A 950 -17.910 -6.167 -1.482 1.00 0.00 H new ATOM 0 HG2 PRO A 950 -18.097 -8.269 0.193 1.00 0.00 H new ATOM 0 HG3 PRO A 950 -19.322 -7.960 -1.022 1.00 0.00 H new ATOM 0 HD2 PRO A 950 -17.077 -9.980 -1.076 1.00 0.00 H new ATOM 0 HD3 PRO A 950 -18.735 -10.166 -1.612 1.00 0.00 H new ATOM 614 N LEU A 951 -15.312 -6.656 -4.233 1.00 0.00 N ATOM 615 CA LEU A 951 -13.933 -6.458 -4.665 1.00 0.00 C ATOM 616 C LEU A 951 -13.102 -5.862 -3.529 1.00 0.00 C ATOM 617 O LEU A 951 -11.898 -6.116 -3.428 1.00 0.00 O ATOM 618 CB LEU A 951 -13.902 -5.542 -5.898 1.00 0.00 C ATOM 619 CG LEU A 951 -12.882 -5.909 -6.984 1.00 0.00 C ATOM 620 CD1 LEU A 951 -11.462 -5.651 -6.512 1.00 0.00 C ATOM 621 CD2 LEU A 951 -13.046 -7.363 -7.397 1.00 0.00 C ATOM 0 H LEU A 951 -15.999 -6.131 -4.774 1.00 0.00 H new ATOM 0 HA LEU A 951 -13.501 -7.422 -4.933 1.00 0.00 H new ATOM 0 HB2 LEU A 951 -14.895 -5.537 -6.347 1.00 0.00 H new ATOM 0 HB3 LEU A 951 -13.698 -4.524 -5.565 1.00 0.00 H new ATOM 0 HG LEU A 951 -13.070 -5.275 -7.850 1.00 0.00 H new ATOM 0 HD11 LEU A 951 -10.761 -5.920 -7.302 1.00 0.00 H new ATOM 0 HD12 LEU A 951 -11.346 -4.595 -6.268 1.00 0.00 H new ATOM 0 HD13 LEU A 951 -11.258 -6.252 -5.626 1.00 0.00 H new ATOM 0 HD21 LEU A 951 -12.315 -7.607 -8.168 1.00 0.00 H new ATOM 0 HD22 LEU A 951 -12.889 -8.007 -6.532 1.00 0.00 H new ATOM 0 HD23 LEU A 951 -14.051 -7.519 -7.788 1.00 0.00 H new ATOM 633 N LEU A 952 -13.760 -5.087 -2.667 1.00 0.00 N ATOM 634 CA LEU A 952 -13.110 -4.488 -1.502 1.00 0.00 C ATOM 635 C LEU A 952 -12.391 -5.538 -0.664 1.00 0.00 C ATOM 636 O LEU A 952 -11.162 -5.584 -0.636 1.00 0.00 O ATOM 637 CB LEU A 952 -14.133 -3.762 -0.623 1.00 0.00 C ATOM 638 CG LEU A 952 -14.725 -2.484 -1.214 1.00 0.00 C ATOM 639 CD1 LEU A 952 -15.797 -1.927 -0.290 1.00 0.00 C ATOM 640 CD2 LEU A 952 -13.636 -1.451 -1.445 1.00 0.00 C ATOM 0 H LEU A 952 -14.750 -4.858 -2.755 1.00 0.00 H new ATOM 0 HA LEU A 952 -12.377 -3.773 -1.876 1.00 0.00 H new ATOM 0 HB2 LEU A 952 -14.949 -4.450 -0.403 1.00 0.00 H new ATOM 0 HB3 LEU A 952 -13.659 -3.515 0.327 1.00 0.00 H new ATOM 0 HG LEU A 952 -15.181 -2.723 -2.175 1.00 0.00 H new ATOM 0 HD11 LEU A 952 -16.212 -1.016 -0.722 1.00 0.00 H new ATOM 0 HD12 LEU A 952 -16.590 -2.664 -0.167 1.00 0.00 H new ATOM 0 HD13 LEU A 952 -15.358 -1.701 0.682 1.00 0.00 H new ATOM 0 HD21 LEU A 952 -14.076 -0.547 -1.866 1.00 0.00 H new ATOM 0 HD22 LEU A 952 -13.154 -1.212 -0.497 1.00 0.00 H new ATOM 0 HD23 LEU A 952 -12.896 -1.851 -2.138 1.00 0.00 H new ATOM 652 N VAL A 953 -13.165 -6.399 -0.008 1.00 0.00 N ATOM 653 CA VAL A 953 -12.625 -7.379 0.911 1.00 0.00 C ATOM 654 C VAL A 953 -11.631 -8.322 0.239 1.00 0.00 C ATOM 655 O VAL A 953 -10.633 -8.708 0.843 1.00 0.00 O ATOM 656 CB VAL A 953 -13.745 -8.194 1.571 1.00 0.00 C ATOM 657 CG1 VAL A 953 -14.580 -7.319 2.494 1.00 0.00 C ATOM 658 CG2 VAL A 953 -14.625 -8.859 0.533 1.00 0.00 C ATOM 0 H VAL A 953 -14.180 -6.432 -0.103 1.00 0.00 H new ATOM 0 HA VAL A 953 -12.089 -6.818 1.677 1.00 0.00 H new ATOM 0 HB VAL A 953 -13.276 -8.976 2.168 1.00 0.00 H new ATOM 0 HG11 VAL A 953 -15.367 -7.919 2.950 1.00 0.00 H new ATOM 0 HG12 VAL A 953 -13.943 -6.902 3.274 1.00 0.00 H new ATOM 0 HG13 VAL A 953 -15.028 -6.508 1.920 1.00 0.00 H new ATOM 0 HG21 VAL A 953 -15.409 -9.429 1.032 1.00 0.00 H new ATOM 0 HG22 VAL A 953 -15.078 -8.097 -0.102 1.00 0.00 H new ATOM 0 HG23 VAL A 953 -14.022 -9.530 -0.079 1.00 0.00 H new ATOM 668 N GLN A 954 -11.898 -8.677 -1.012 1.00 0.00 N ATOM 669 CA GLN A 954 -11.007 -9.561 -1.759 1.00 0.00 C ATOM 670 C GLN A 954 -9.628 -8.927 -1.909 1.00 0.00 C ATOM 671 O GLN A 954 -8.604 -9.599 -1.765 1.00 0.00 O ATOM 672 CB GLN A 954 -11.584 -9.883 -3.141 1.00 0.00 C ATOM 673 CG GLN A 954 -12.997 -10.444 -3.100 1.00 0.00 C ATOM 674 CD GLN A 954 -13.145 -11.621 -2.153 1.00 0.00 C ATOM 675 OE1 GLN A 954 -12.208 -12.386 -1.934 1.00 0.00 O ATOM 676 NE2 GLN A 954 -14.325 -11.760 -1.575 1.00 0.00 N ATOM 0 H GLN A 954 -12.721 -8.369 -1.530 1.00 0.00 H new ATOM 0 HA GLN A 954 -10.912 -10.491 -1.198 1.00 0.00 H new ATOM 0 HB2 GLN A 954 -11.580 -8.977 -3.746 1.00 0.00 H new ATOM 0 HB3 GLN A 954 -10.932 -10.601 -3.638 1.00 0.00 H new ATOM 0 HG2 GLN A 954 -13.686 -9.655 -2.799 1.00 0.00 H new ATOM 0 HG3 GLN A 954 -13.287 -10.755 -4.104 1.00 0.00 H new ATOM 0 HE21 GLN A 954 -15.076 -11.103 -1.785 1.00 0.00 H new ATOM 0 HE22 GLN A 954 -14.485 -12.525 -0.919 1.00 0.00 H new ATOM 685 N SER A 955 -9.607 -7.631 -2.182 1.00 0.00 N ATOM 686 CA SER A 955 -8.358 -6.902 -2.306 1.00 0.00 C ATOM 687 C SER A 955 -7.746 -6.659 -0.930 1.00 0.00 C ATOM 688 O SER A 955 -6.537 -6.798 -0.750 1.00 0.00 O ATOM 689 CB SER A 955 -8.594 -5.577 -3.024 1.00 0.00 C ATOM 690 OG SER A 955 -9.246 -5.784 -4.263 1.00 0.00 O ATOM 0 H SER A 955 -10.443 -7.064 -2.322 1.00 0.00 H new ATOM 0 HA SER A 955 -7.660 -7.499 -2.893 1.00 0.00 H new ATOM 0 HB2 SER A 955 -9.197 -4.921 -2.396 1.00 0.00 H new ATOM 0 HB3 SER A 955 -7.642 -5.073 -3.189 1.00 0.00 H new ATOM 0 HG SER A 955 -10.217 -5.759 -4.130 1.00 0.00 H new ATOM 696 N CYS A 956 -8.593 -6.316 0.041 1.00 0.00 N ATOM 697 CA CYS A 956 -8.150 -6.068 1.411 1.00 0.00 C ATOM 698 C CYS A 956 -7.349 -7.244 1.958 1.00 0.00 C ATOM 699 O CYS A 956 -6.284 -7.057 2.544 1.00 0.00 O ATOM 700 CB CYS A 956 -9.350 -5.800 2.323 1.00 0.00 C ATOM 701 SG CYS A 956 -10.229 -4.262 1.962 1.00 0.00 S ATOM 0 H CYS A 956 -9.597 -6.203 -0.099 1.00 0.00 H new ATOM 0 HA CYS A 956 -7.506 -5.189 1.392 1.00 0.00 H new ATOM 0 HB2 CYS A 956 -10.049 -6.632 2.239 1.00 0.00 H new ATOM 0 HB3 CYS A 956 -9.007 -5.775 3.357 1.00 0.00 H new ATOM 0 HG CYS A 956 -9.397 -3.392 1.471 1.00 0.00 H new ATOM 707 N LYS A 957 -7.861 -8.452 1.756 1.00 0.00 N ATOM 708 CA LYS A 957 -7.187 -9.651 2.239 1.00 0.00 C ATOM 709 C LYS A 957 -5.826 -9.806 1.571 1.00 0.00 C ATOM 710 O LYS A 957 -4.831 -10.082 2.236 1.00 0.00 O ATOM 711 CB LYS A 957 -8.037 -10.895 1.980 1.00 0.00 C ATOM 712 CG LYS A 957 -9.400 -10.859 2.652 1.00 0.00 C ATOM 713 CD LYS A 957 -10.179 -12.157 2.462 1.00 0.00 C ATOM 714 CE LYS A 957 -10.333 -12.532 0.994 1.00 0.00 C ATOM 715 NZ LYS A 957 -9.183 -13.337 0.495 1.00 0.00 N ATOM 0 H LYS A 957 -8.737 -8.627 1.263 1.00 0.00 H new ATOM 0 HA LYS A 957 -7.044 -9.545 3.314 1.00 0.00 H new ATOM 0 HB2 LYS A 957 -8.175 -11.011 0.905 1.00 0.00 H new ATOM 0 HB3 LYS A 957 -7.494 -11.773 2.328 1.00 0.00 H new ATOM 0 HG2 LYS A 957 -9.271 -10.669 3.718 1.00 0.00 H new ATOM 0 HG3 LYS A 957 -9.979 -10.029 2.248 1.00 0.00 H new ATOM 0 HD2 LYS A 957 -9.669 -12.964 2.989 1.00 0.00 H new ATOM 0 HD3 LYS A 957 -11.166 -12.055 2.914 1.00 0.00 H new ATOM 0 HE2 LYS A 957 -11.255 -13.097 0.860 1.00 0.00 H new ATOM 0 HE3 LYS A 957 -10.426 -11.625 0.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 957 -8.742 -12.850 -0.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 957 -8.483 -13.451 1.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 957 -9.520 -14.273 0.191 1.00 0.00 H new ATOM 729 N ALA A 958 -5.790 -9.600 0.257 1.00 0.00 N ATOM 730 CA ALA A 958 -4.555 -9.723 -0.508 1.00 0.00 C ATOM 731 C ALA A 958 -3.516 -8.713 -0.033 1.00 0.00 C ATOM 732 O ALA A 958 -2.338 -9.039 0.118 1.00 0.00 O ATOM 733 CB ALA A 958 -4.832 -9.541 -1.995 1.00 0.00 C ATOM 0 H ALA A 958 -6.606 -9.346 -0.301 1.00 0.00 H new ATOM 0 HA ALA A 958 -4.154 -10.723 -0.346 1.00 0.00 H new ATOM 0 HB1 ALA A 958 -3.900 -9.636 -2.553 1.00 0.00 H new ATOM 0 HB2 ALA A 958 -5.535 -10.304 -2.330 1.00 0.00 H new ATOM 0 HB3 ALA A 958 -5.259 -8.553 -2.167 1.00 0.00 H new ATOM 739 N VAL A 959 -3.964 -7.488 0.214 1.00 0.00 N ATOM 740 CA VAL A 959 -3.087 -6.447 0.729 1.00 0.00 C ATOM 741 C VAL A 959 -2.575 -6.823 2.113 1.00 0.00 C ATOM 742 O VAL A 959 -1.376 -6.751 2.381 1.00 0.00 O ATOM 743 CB VAL A 959 -3.804 -5.080 0.805 1.00 0.00 C ATOM 744 CG1 VAL A 959 -2.882 -4.015 1.374 1.00 0.00 C ATOM 745 CG2 VAL A 959 -4.312 -4.662 -0.563 1.00 0.00 C ATOM 0 H VAL A 959 -4.929 -7.193 0.066 1.00 0.00 H new ATOM 0 HA VAL A 959 -2.250 -6.358 0.037 1.00 0.00 H new ATOM 0 HB VAL A 959 -4.658 -5.187 1.473 1.00 0.00 H new ATOM 0 HG11 VAL A 959 -3.410 -3.062 1.417 1.00 0.00 H new ATOM 0 HG12 VAL A 959 -2.570 -4.303 2.378 1.00 0.00 H new ATOM 0 HG13 VAL A 959 -2.004 -3.915 0.736 1.00 0.00 H new ATOM 0 HG21 VAL A 959 -4.813 -3.697 -0.486 1.00 0.00 H new ATOM 0 HG22 VAL A 959 -3.473 -4.581 -1.254 1.00 0.00 H new ATOM 0 HG23 VAL A 959 -5.016 -5.408 -0.933 1.00 0.00 H new ATOM 755 N ALA A 960 -3.490 -7.260 2.974 1.00 0.00 N ATOM 756 CA ALA A 960 -3.162 -7.614 4.351 1.00 0.00 C ATOM 757 C ALA A 960 -2.123 -8.728 4.419 1.00 0.00 C ATOM 758 O ALA A 960 -1.371 -8.821 5.386 1.00 0.00 O ATOM 759 CB ALA A 960 -4.420 -8.021 5.102 1.00 0.00 C ATOM 0 H ALA A 960 -4.475 -7.378 2.738 1.00 0.00 H new ATOM 0 HA ALA A 960 -2.729 -6.732 4.824 1.00 0.00 H new ATOM 0 HB1 ALA A 960 -4.162 -8.283 6.128 1.00 0.00 H new ATOM 0 HB2 ALA A 960 -5.126 -7.191 5.106 1.00 0.00 H new ATOM 0 HB3 ALA A 960 -4.874 -8.882 4.611 1.00 0.00 H new ATOM 765 N GLU A 961 -2.086 -9.569 3.390 1.00 0.00 N ATOM 766 CA GLU A 961 -1.114 -10.654 3.315 1.00 0.00 C ATOM 767 C GLU A 961 0.282 -10.121 2.999 1.00 0.00 C ATOM 768 O GLU A 961 1.286 -10.651 3.480 1.00 0.00 O ATOM 769 CB GLU A 961 -1.526 -11.661 2.238 1.00 0.00 C ATOM 770 CG GLU A 961 -2.843 -12.362 2.515 1.00 0.00 C ATOM 771 CD GLU A 961 -2.790 -13.247 3.739 1.00 0.00 C ATOM 772 OE1 GLU A 961 -2.304 -14.393 3.634 1.00 0.00 O ATOM 773 OE2 GLU A 961 -3.218 -12.793 4.823 1.00 0.00 O ATOM 0 H GLU A 961 -2.721 -9.519 2.593 1.00 0.00 H new ATOM 0 HA GLU A 961 -1.090 -11.146 4.287 1.00 0.00 H new ATOM 0 HB2 GLU A 961 -1.596 -11.144 1.281 1.00 0.00 H new ATOM 0 HB3 GLU A 961 -0.742 -12.411 2.138 1.00 0.00 H new ATOM 0 HG2 GLU A 961 -3.626 -11.615 2.646 1.00 0.00 H new ATOM 0 HG3 GLU A 961 -3.118 -12.964 1.649 1.00 0.00 H new ATOM 780 N GLN A 962 0.338 -9.063 2.199 1.00 0.00 N ATOM 781 CA GLN A 962 1.608 -8.537 1.710 1.00 0.00 C ATOM 782 C GLN A 962 2.183 -7.469 2.638 1.00 0.00 C ATOM 783 O GLN A 962 3.383 -7.194 2.598 1.00 0.00 O ATOM 784 CB GLN A 962 1.440 -7.966 0.301 1.00 0.00 C ATOM 785 CG GLN A 962 1.032 -9.000 -0.741 1.00 0.00 C ATOM 786 CD GLN A 962 2.095 -10.061 -0.984 1.00 0.00 C ATOM 787 OE1 GLN A 962 2.864 -10.418 -0.090 1.00 0.00 O ATOM 788 NE2 GLN A 962 2.148 -10.574 -2.201 1.00 0.00 N ATOM 0 H GLN A 962 -0.482 -8.551 1.874 1.00 0.00 H new ATOM 0 HA GLN A 962 2.313 -9.368 1.685 1.00 0.00 H new ATOM 0 HB2 GLN A 962 0.690 -7.176 0.327 1.00 0.00 H new ATOM 0 HB3 GLN A 962 2.378 -7.505 -0.007 1.00 0.00 H new ATOM 0 HG2 GLN A 962 0.111 -9.486 -0.420 1.00 0.00 H new ATOM 0 HG3 GLN A 962 0.814 -8.492 -1.681 1.00 0.00 H new ATOM 0 HE21 GLN A 962 1.496 -10.255 -2.918 1.00 0.00 H new ATOM 0 HE22 GLN A 962 2.841 -11.289 -2.424 1.00 0.00 H new ATOM 797 N ILE A 963 1.328 -6.869 3.461 1.00 0.00 N ATOM 798 CA ILE A 963 1.759 -5.829 4.401 1.00 0.00 C ATOM 799 C ILE A 963 2.896 -6.311 5.316 1.00 0.00 C ATOM 800 O ILE A 963 3.952 -5.680 5.365 1.00 0.00 O ATOM 801 CB ILE A 963 0.587 -5.310 5.272 1.00 0.00 C ATOM 802 CG1 ILE A 963 -0.488 -4.669 4.395 1.00 0.00 C ATOM 803 CG2 ILE A 963 1.091 -4.309 6.306 1.00 0.00 C ATOM 804 CD1 ILE A 963 -1.720 -4.232 5.160 1.00 0.00 C ATOM 0 H ILE A 963 0.331 -7.082 3.499 1.00 0.00 H new ATOM 0 HA ILE A 963 2.129 -5.009 3.785 1.00 0.00 H new ATOM 0 HB ILE A 963 0.148 -6.159 5.796 1.00 0.00 H new ATOM 0 HG12 ILE A 963 -0.061 -3.804 3.887 1.00 0.00 H new ATOM 0 HG13 ILE A 963 -0.784 -5.378 3.622 1.00 0.00 H new ATOM 0 HG21 ILE A 963 0.254 -3.955 6.908 1.00 0.00 H new ATOM 0 HG22 ILE A 963 1.825 -4.791 6.952 1.00 0.00 H new ATOM 0 HG23 ILE A 963 1.555 -3.464 5.798 1.00 0.00 H new ATOM 0 HD11 ILE A 963 -2.437 -3.787 4.471 1.00 0.00 H new ATOM 0 HD12 ILE A 963 -2.172 -5.097 5.646 1.00 0.00 H new ATOM 0 HD13 ILE A 963 -1.438 -3.498 5.915 1.00 0.00 H new ATOM 816 N PRO A 964 2.713 -7.434 6.051 1.00 0.00 N ATOM 817 CA PRO A 964 3.742 -7.956 6.959 1.00 0.00 C ATOM 818 C PRO A 964 5.052 -8.266 6.241 1.00 0.00 C ATOM 819 O PRO A 964 6.126 -8.150 6.826 1.00 0.00 O ATOM 820 CB PRO A 964 3.128 -9.241 7.528 1.00 0.00 C ATOM 821 CG PRO A 964 2.001 -9.576 6.615 1.00 0.00 C ATOM 822 CD PRO A 964 1.501 -8.270 6.081 1.00 0.00 C ATOM 0 HA PRO A 964 4.001 -7.225 7.725 1.00 0.00 H new ATOM 0 HB2 PRO A 964 3.861 -10.047 7.560 1.00 0.00 H new ATOM 0 HB3 PRO A 964 2.776 -9.090 8.549 1.00 0.00 H new ATOM 0 HG2 PRO A 964 2.334 -10.226 5.806 1.00 0.00 H new ATOM 0 HG3 PRO A 964 1.212 -10.108 7.147 1.00 0.00 H new ATOM 0 HD2 PRO A 964 1.064 -8.381 5.089 1.00 0.00 H new ATOM 0 HD3 PRO A 964 0.731 -7.841 6.722 1.00 0.00 H new ATOM 830 N LEU A 965 4.958 -8.642 4.971 1.00 0.00 N ATOM 831 CA LEU A 965 6.140 -8.957 4.180 1.00 0.00 C ATOM 832 C LEU A 965 6.836 -7.680 3.736 1.00 0.00 C ATOM 833 O LEU A 965 8.065 -7.609 3.694 1.00 0.00 O ATOM 834 CB LEU A 965 5.762 -9.808 2.967 1.00 0.00 C ATOM 835 CG LEU A 965 5.269 -11.216 3.302 1.00 0.00 C ATOM 836 CD1 LEU A 965 4.922 -11.978 2.033 1.00 0.00 C ATOM 837 CD2 LEU A 965 6.323 -11.963 4.108 1.00 0.00 C ATOM 0 H LEU A 965 4.076 -8.736 4.468 1.00 0.00 H new ATOM 0 HA LEU A 965 6.829 -9.529 4.801 1.00 0.00 H new ATOM 0 HB2 LEU A 965 4.985 -9.290 2.405 1.00 0.00 H new ATOM 0 HB3 LEU A 965 6.630 -9.888 2.312 1.00 0.00 H new ATOM 0 HG LEU A 965 4.365 -11.134 3.905 1.00 0.00 H new ATOM 0 HD11 LEU A 965 4.573 -12.978 2.293 1.00 0.00 H new ATOM 0 HD12 LEU A 965 4.137 -11.448 1.494 1.00 0.00 H new ATOM 0 HD13 LEU A 965 5.807 -12.055 1.401 1.00 0.00 H new ATOM 0 HD21 LEU A 965 5.961 -12.964 4.341 1.00 0.00 H new ATOM 0 HD22 LEU A 965 7.242 -12.036 3.526 1.00 0.00 H new ATOM 0 HD23 LEU A 965 6.522 -11.425 5.035 1.00 0.00 H new ATOM 849 N LEU A 966 6.038 -6.671 3.417 1.00 0.00 N ATOM 850 CA LEU A 966 6.562 -5.365 3.058 1.00 0.00 C ATOM 851 C LEU A 966 7.320 -4.774 4.241 1.00 0.00 C ATOM 852 O LEU A 966 8.472 -4.361 4.111 1.00 0.00 O ATOM 853 CB LEU A 966 5.419 -4.432 2.645 1.00 0.00 C ATOM 854 CG LEU A 966 5.851 -3.055 2.142 1.00 0.00 C ATOM 855 CD1 LEU A 966 6.639 -3.184 0.848 1.00 0.00 C ATOM 856 CD2 LEU A 966 4.639 -2.155 1.945 1.00 0.00 C ATOM 0 H LEU A 966 5.020 -6.735 3.400 1.00 0.00 H new ATOM 0 HA LEU A 966 7.244 -5.474 2.215 1.00 0.00 H new ATOM 0 HB2 LEU A 966 4.837 -4.920 1.863 1.00 0.00 H new ATOM 0 HB3 LEU A 966 4.755 -4.297 3.499 1.00 0.00 H new ATOM 0 HG LEU A 966 6.497 -2.600 2.893 1.00 0.00 H new ATOM 0 HD11 LEU A 966 6.939 -2.194 0.504 1.00 0.00 H new ATOM 0 HD12 LEU A 966 7.527 -3.792 1.022 1.00 0.00 H new ATOM 0 HD13 LEU A 966 6.017 -3.659 0.089 1.00 0.00 H new ATOM 0 HD21 LEU A 966 4.965 -1.179 1.587 1.00 0.00 H new ATOM 0 HD22 LEU A 966 3.967 -2.604 1.213 1.00 0.00 H new ATOM 0 HD23 LEU A 966 4.115 -2.037 2.894 1.00 0.00 H new ATOM 868 N VAL A 967 6.675 -4.772 5.403 1.00 0.00 N ATOM 869 CA VAL A 967 7.290 -4.263 6.624 1.00 0.00 C ATOM 870 C VAL A 967 8.490 -5.118 7.025 1.00 0.00 C ATOM 871 O VAL A 967 9.480 -4.604 7.542 1.00 0.00 O ATOM 872 CB VAL A 967 6.272 -4.200 7.786 1.00 0.00 C ATOM 873 CG1 VAL A 967 6.930 -3.705 9.067 1.00 0.00 C ATOM 874 CG2 VAL A 967 5.102 -3.304 7.412 1.00 0.00 C ATOM 0 H VAL A 967 5.723 -5.118 5.525 1.00 0.00 H new ATOM 0 HA VAL A 967 7.633 -3.249 6.417 1.00 0.00 H new ATOM 0 HB VAL A 967 5.901 -5.209 7.967 1.00 0.00 H new ATOM 0 HG11 VAL A 967 6.190 -3.671 9.867 1.00 0.00 H new ATOM 0 HG12 VAL A 967 7.736 -4.383 9.347 1.00 0.00 H new ATOM 0 HG13 VAL A 967 7.335 -2.706 8.905 1.00 0.00 H new ATOM 0 HG21 VAL A 967 4.392 -3.268 8.239 1.00 0.00 H new ATOM 0 HG22 VAL A 967 5.466 -2.298 7.203 1.00 0.00 H new ATOM 0 HG23 VAL A 967 4.607 -3.702 6.526 1.00 0.00 H new ATOM 884 N GLN A 968 8.408 -6.419 6.765 1.00 0.00 N ATOM 885 CA GLN A 968 9.525 -7.321 7.031 1.00 0.00 C ATOM 886 C GLN A 968 10.735 -6.906 6.205 1.00 0.00 C ATOM 887 O GLN A 968 11.856 -6.832 6.715 1.00 0.00 O ATOM 888 CB GLN A 968 9.140 -8.769 6.714 1.00 0.00 C ATOM 889 CG GLN A 968 10.216 -9.785 7.068 1.00 0.00 C ATOM 890 CD GLN A 968 10.473 -9.887 8.563 1.00 0.00 C ATOM 891 OE1 GLN A 968 10.322 -8.919 9.308 1.00 0.00 O ATOM 892 NE2 GLN A 968 10.853 -11.066 9.017 1.00 0.00 N ATOM 0 H GLN A 968 7.583 -6.872 6.372 1.00 0.00 H new ATOM 0 HA GLN A 968 9.777 -7.258 8.090 1.00 0.00 H new ATOM 0 HB2 GLN A 968 8.227 -9.018 7.254 1.00 0.00 H new ATOM 0 HB3 GLN A 968 8.913 -8.850 5.651 1.00 0.00 H new ATOM 0 HG2 GLN A 968 9.922 -10.764 6.689 1.00 0.00 H new ATOM 0 HG3 GLN A 968 11.143 -9.513 6.564 1.00 0.00 H new ATOM 0 HE21 GLN A 968 10.969 -11.848 8.372 1.00 0.00 H new ATOM 0 HE22 GLN A 968 11.031 -11.196 10.013 1.00 0.00 H new ATOM 901 N GLY A 969 10.494 -6.623 4.928 1.00 0.00 N ATOM 902 CA GLY A 969 11.542 -6.103 4.070 1.00 0.00 C ATOM 903 C GLY A 969 12.116 -4.810 4.613 1.00 0.00 C ATOM 904 O GLY A 969 13.328 -4.596 4.582 1.00 0.00 O ATOM 0 H GLY A 969 9.590 -6.745 4.472 1.00 0.00 H new ATOM 0 HA2 GLY A 969 12.337 -6.843 3.975 1.00 0.00 H new ATOM 0 HA3 GLY A 969 11.144 -5.933 3.070 1.00 0.00 H new ATOM 908 N VAL A 970 11.238 -3.954 5.129 1.00 0.00 N ATOM 909 CA VAL A 970 11.656 -2.702 5.750 1.00 0.00 C ATOM 910 C VAL A 970 12.546 -2.976 6.959 1.00 0.00 C ATOM 911 O VAL A 970 13.587 -2.353 7.121 1.00 0.00 O ATOM 912 CB VAL A 970 10.450 -1.845 6.195 1.00 0.00 C ATOM 913 CG1 VAL A 970 10.913 -0.530 6.801 1.00 0.00 C ATOM 914 CG2 VAL A 970 9.511 -1.584 5.030 1.00 0.00 C ATOM 0 H VAL A 970 10.229 -4.106 5.129 1.00 0.00 H new ATOM 0 HA VAL A 970 12.213 -2.146 4.996 1.00 0.00 H new ATOM 0 HB VAL A 970 9.908 -2.405 6.957 1.00 0.00 H new ATOM 0 HG11 VAL A 970 10.046 0.055 7.106 1.00 0.00 H new ATOM 0 HG12 VAL A 970 11.540 -0.731 7.670 1.00 0.00 H new ATOM 0 HG13 VAL A 970 11.486 0.029 6.062 1.00 0.00 H new ATOM 0 HG21 VAL A 970 8.670 -0.979 5.369 1.00 0.00 H new ATOM 0 HG22 VAL A 970 10.046 -1.053 4.243 1.00 0.00 H new ATOM 0 HG23 VAL A 970 9.142 -2.533 4.641 1.00 0.00 H new ATOM 924 N ARG A 971 12.131 -3.924 7.797 1.00 0.00 N ATOM 925 CA ARG A 971 12.884 -4.282 9.001 1.00 0.00 C ATOM 926 C ARG A 971 14.311 -4.695 8.660 1.00 0.00 C ATOM 927 O ARG A 971 15.268 -4.194 9.252 1.00 0.00 O ATOM 928 CB ARG A 971 12.199 -5.420 9.753 1.00 0.00 C ATOM 929 CG ARG A 971 10.850 -5.046 10.338 1.00 0.00 C ATOM 930 CD ARG A 971 10.248 -6.201 11.119 1.00 0.00 C ATOM 931 NE ARG A 971 11.090 -6.597 12.249 1.00 0.00 N ATOM 932 CZ ARG A 971 10.621 -6.811 13.479 1.00 0.00 C ATOM 933 NH1 ARG A 971 9.321 -6.687 13.729 1.00 0.00 N ATOM 934 NH2 ARG A 971 11.446 -7.158 14.459 1.00 0.00 N ATOM 0 H ARG A 971 11.274 -4.461 7.665 1.00 0.00 H new ATOM 0 HA ARG A 971 12.915 -3.396 9.636 1.00 0.00 H new ATOM 0 HB2 ARG A 971 12.069 -6.264 9.075 1.00 0.00 H new ATOM 0 HB3 ARG A 971 12.853 -5.756 10.558 1.00 0.00 H new ATOM 0 HG2 ARG A 971 10.962 -4.181 10.992 1.00 0.00 H new ATOM 0 HG3 ARG A 971 10.172 -4.754 9.536 1.00 0.00 H new ATOM 0 HD2 ARG A 971 9.261 -5.916 11.484 1.00 0.00 H new ATOM 0 HD3 ARG A 971 10.108 -7.054 10.455 1.00 0.00 H new ATOM 0 HE ARG A 971 12.090 -6.716 12.087 1.00 0.00 H new ATOM 0 HH11 ARG A 971 8.680 -6.428 12.979 1.00 0.00 H new ATOM 0 HH12 ARG A 971 8.965 -6.851 14.671 1.00 0.00 H new ATOM 0 HH21 ARG A 971 12.444 -7.262 14.273 1.00 0.00 H new ATOM 0 HH22 ARG A 971 11.083 -7.321 15.398 1.00 0.00 H new ATOM 948 N GLY A 972 14.443 -5.603 7.701 1.00 0.00 N ATOM 949 CA GLY A 972 15.757 -6.058 7.285 1.00 0.00 C ATOM 950 C GLY A 972 16.597 -4.930 6.726 1.00 0.00 C ATOM 951 O GLY A 972 17.814 -4.904 6.894 1.00 0.00 O ATOM 0 H GLY A 972 13.663 -6.033 7.203 1.00 0.00 H new ATOM 0 HA2 GLY A 972 16.271 -6.506 8.135 1.00 0.00 H new ATOM 0 HA3 GLY A 972 15.649 -6.838 6.531 1.00 0.00 H new ATOM 955 N SER A 973 15.934 -3.982 6.084 1.00 0.00 N ATOM 956 CA SER A 973 16.605 -2.840 5.482 1.00 0.00 C ATOM 957 C SER A 973 16.971 -1.796 6.536 1.00 0.00 C ATOM 958 O SER A 973 17.995 -1.122 6.424 1.00 0.00 O ATOM 959 CB SER A 973 15.705 -2.243 4.408 1.00 0.00 C ATOM 960 OG SER A 973 15.410 -3.214 3.422 1.00 0.00 O ATOM 0 H SER A 973 14.921 -3.981 5.965 1.00 0.00 H new ATOM 0 HA SER A 973 17.537 -3.173 5.025 1.00 0.00 H new ATOM 0 HB2 SER A 973 14.781 -1.879 4.858 1.00 0.00 H new ATOM 0 HB3 SER A 973 16.195 -1.385 3.948 1.00 0.00 H new ATOM 0 HG SER A 973 14.611 -3.716 3.686 1.00 0.00 H new ATOM 966 N GLN A 974 16.136 -1.671 7.563 1.00 0.00 N ATOM 967 CA GLN A 974 16.431 -0.792 8.688 1.00 0.00 C ATOM 968 C GLN A 974 17.680 -1.273 9.408 1.00 0.00 C ATOM 969 O GLN A 974 18.443 -0.479 9.958 1.00 0.00 O ATOM 970 CB GLN A 974 15.258 -0.742 9.671 1.00 0.00 C ATOM 971 CG GLN A 974 14.014 -0.075 9.112 1.00 0.00 C ATOM 972 CD GLN A 974 12.866 -0.066 10.098 1.00 0.00 C ATOM 973 OE1 GLN A 974 12.717 0.867 10.886 1.00 0.00 O ATOM 974 NE2 GLN A 974 12.046 -1.103 10.060 1.00 0.00 N ATOM 0 H GLN A 974 15.249 -2.168 7.639 1.00 0.00 H new ATOM 0 HA GLN A 974 16.597 0.212 8.298 1.00 0.00 H new ATOM 0 HB2 GLN A 974 15.008 -1.759 9.975 1.00 0.00 H new ATOM 0 HB3 GLN A 974 15.572 -0.209 10.569 1.00 0.00 H new ATOM 0 HG2 GLN A 974 14.252 0.950 8.828 1.00 0.00 H new ATOM 0 HG3 GLN A 974 13.705 -0.594 8.205 1.00 0.00 H new ATOM 0 HE21 GLN A 974 12.206 -1.856 9.390 1.00 0.00 H new ATOM 0 HE22 GLN A 974 11.253 -1.150 10.700 1.00 0.00 H new ATOM 983 N ALA A 975 17.871 -2.583 9.410 1.00 0.00 N ATOM 984 CA ALA A 975 19.051 -3.182 10.005 1.00 0.00 C ATOM 985 C ALA A 975 20.231 -3.115 9.042 1.00 0.00 C ATOM 986 O ALA A 975 21.302 -2.617 9.393 1.00 0.00 O ATOM 987 CB ALA A 975 18.767 -4.622 10.405 1.00 0.00 C ATOM 0 H ALA A 975 17.219 -3.253 9.003 1.00 0.00 H new ATOM 0 HA ALA A 975 19.311 -2.618 10.901 1.00 0.00 H new ATOM 0 HB1 ALA A 975 19.661 -5.059 10.850 1.00 0.00 H new ATOM 0 HB2 ALA A 975 17.953 -4.645 11.129 1.00 0.00 H new ATOM 0 HB3 ALA A 975 18.483 -5.196 9.523 1.00 0.00 H new ATOM 993 N GLN A 976 20.029 -3.606 7.824 1.00 0.00 N ATOM 994 CA GLN A 976 21.090 -3.643 6.826 1.00 0.00 C ATOM 995 C GLN A 976 20.663 -2.938 5.541 1.00 0.00 C ATOM 996 O GLN A 976 20.097 -3.561 4.645 1.00 0.00 O ATOM 997 CB GLN A 976 21.476 -5.091 6.511 1.00 0.00 C ATOM 998 CG GLN A 976 21.908 -5.891 7.726 1.00 0.00 C ATOM 999 CD GLN A 976 23.071 -5.253 8.451 1.00 0.00 C ATOM 1000 OE1 GLN A 976 23.914 -4.595 7.842 1.00 0.00 O ATOM 1001 NE2 GLN A 976 23.117 -5.433 9.760 1.00 0.00 N ATOM 0 H GLN A 976 19.138 -3.985 7.504 1.00 0.00 H new ATOM 0 HA GLN A 976 21.952 -3.120 7.240 1.00 0.00 H new ATOM 0 HB2 GLN A 976 20.627 -5.589 6.043 1.00 0.00 H new ATOM 0 HB3 GLN A 976 22.286 -5.090 5.782 1.00 0.00 H new ATOM 0 HG2 GLN A 976 21.066 -5.990 8.411 1.00 0.00 H new ATOM 0 HG3 GLN A 976 22.185 -6.898 7.415 1.00 0.00 H new ATOM 0 HE21 GLN A 976 22.397 -5.986 10.224 1.00 0.00 H new ATOM 0 HE22 GLN A 976 23.873 -5.019 10.306 1.00 0.00 H new ATOM 1010 N PRO A 977 20.924 -1.628 5.432 1.00 0.00 N ATOM 1011 CA PRO A 977 20.569 -0.848 4.239 1.00 0.00 C ATOM 1012 C PRO A 977 21.498 -1.141 3.061 1.00 0.00 C ATOM 1013 O PRO A 977 21.123 -0.987 1.899 1.00 0.00 O ATOM 1014 CB PRO A 977 20.730 0.599 4.704 1.00 0.00 C ATOM 1015 CG PRO A 977 21.747 0.539 5.793 1.00 0.00 C ATOM 1016 CD PRO A 977 21.567 -0.796 6.467 1.00 0.00 C ATOM 0 HA PRO A 977 19.568 -1.083 3.877 1.00 0.00 H new ATOM 0 HB2 PRO A 977 21.061 1.242 3.889 1.00 0.00 H new ATOM 0 HB3 PRO A 977 19.786 1.005 5.067 1.00 0.00 H new ATOM 0 HG2 PRO A 977 22.755 0.638 5.390 1.00 0.00 H new ATOM 0 HG3 PRO A 977 21.606 1.355 6.502 1.00 0.00 H new ATOM 0 HD2 PRO A 977 22.522 -1.217 6.783 1.00 0.00 H new ATOM 0 HD3 PRO A 977 20.945 -0.714 7.358 1.00 0.00 H new ATOM 1024 N ASP A 978 22.711 -1.579 3.373 1.00 0.00 N ATOM 1025 CA ASP A 978 23.709 -1.871 2.349 1.00 0.00 C ATOM 1026 C ASP A 978 23.565 -3.308 1.855 1.00 0.00 C ATOM 1027 O ASP A 978 24.232 -3.727 0.911 1.00 0.00 O ATOM 1028 CB ASP A 978 25.119 -1.627 2.905 1.00 0.00 C ATOM 1029 CG ASP A 978 26.213 -1.841 1.874 1.00 0.00 C ATOM 1030 OD1 ASP A 978 26.340 -1.006 0.955 1.00 0.00 O ATOM 1031 OD2 ASP A 978 26.944 -2.853 1.972 1.00 0.00 O ATOM 0 H ASP A 978 23.029 -1.740 4.329 1.00 0.00 H new ATOM 0 HA ASP A 978 23.548 -1.204 1.502 1.00 0.00 H new ATOM 0 HB2 ASP A 978 25.181 -0.607 3.285 1.00 0.00 H new ATOM 0 HB3 ASP A 978 25.290 -2.294 3.750 1.00 0.00 H new ATOM 1036 N SER A 979 22.668 -4.051 2.486 1.00 0.00 N ATOM 1037 CA SER A 979 22.447 -5.447 2.140 1.00 0.00 C ATOM 1038 C SER A 979 21.665 -5.572 0.835 1.00 0.00 C ATOM 1039 O SER A 979 20.552 -5.055 0.715 1.00 0.00 O ATOM 1040 CB SER A 979 21.697 -6.161 3.267 1.00 0.00 C ATOM 1041 OG SER A 979 21.373 -7.497 2.913 1.00 0.00 O ATOM 0 H SER A 979 22.078 -3.708 3.244 1.00 0.00 H new ATOM 0 HA SER A 979 23.421 -5.918 2.003 1.00 0.00 H new ATOM 0 HB2 SER A 979 22.309 -6.161 4.169 1.00 0.00 H new ATOM 0 HB3 SER A 979 20.784 -5.614 3.501 1.00 0.00 H new ATOM 0 HG SER A 979 20.896 -7.925 3.654 1.00 0.00 H new ATOM 1047 N PRO A 980 22.244 -6.262 -0.160 1.00 0.00 N ATOM 1048 CA PRO A 980 21.565 -6.563 -1.425 1.00 0.00 C ATOM 1049 C PRO A 980 20.297 -7.371 -1.203 1.00 0.00 C ATOM 1050 O PRO A 980 19.313 -7.190 -1.910 1.00 0.00 O ATOM 1051 CB PRO A 980 22.595 -7.386 -2.205 1.00 0.00 C ATOM 1052 CG PRO A 980 23.905 -7.047 -1.587 1.00 0.00 C ATOM 1053 CD PRO A 980 23.618 -6.791 -0.137 1.00 0.00 C ATOM 0 HA PRO A 980 21.250 -5.660 -1.947 1.00 0.00 H new ATOM 0 HB2 PRO A 980 22.387 -8.453 -2.129 1.00 0.00 H new ATOM 0 HB3 PRO A 980 22.581 -7.133 -3.265 1.00 0.00 H new ATOM 0 HG2 PRO A 980 24.617 -7.864 -1.707 1.00 0.00 H new ATOM 0 HG3 PRO A 980 24.345 -6.169 -2.060 1.00 0.00 H new ATOM 0 HD2 PRO A 980 23.690 -7.703 0.456 1.00 0.00 H new ATOM 0 HD3 PRO A 980 24.319 -6.075 0.293 1.00 0.00 H new ATOM 1061 N SER A 981 20.323 -8.252 -0.211 1.00 0.00 N ATOM 1062 CA SER A 981 19.162 -9.067 0.108 1.00 0.00 C ATOM 1063 C SER A 981 18.037 -8.192 0.654 1.00 0.00 C ATOM 1064 O SER A 981 16.877 -8.364 0.289 1.00 0.00 O ATOM 1065 CB SER A 981 19.529 -10.153 1.121 1.00 0.00 C ATOM 1066 OG SER A 981 18.484 -11.101 1.259 1.00 0.00 O ATOM 0 H SER A 981 21.134 -8.419 0.384 1.00 0.00 H new ATOM 0 HA SER A 981 18.818 -9.551 -0.806 1.00 0.00 H new ATOM 0 HB2 SER A 981 20.441 -10.657 0.802 1.00 0.00 H new ATOM 0 HB3 SER A 981 19.739 -9.696 2.088 1.00 0.00 H new ATOM 0 HG SER A 981 18.746 -11.784 1.911 1.00 0.00 H new ATOM 1072 N ALA A 982 18.392 -7.240 1.514 1.00 0.00 N ATOM 1073 CA ALA A 982 17.409 -6.330 2.092 1.00 0.00 C ATOM 1074 C ALA A 982 16.862 -5.384 1.029 1.00 0.00 C ATOM 1075 O ALA A 982 15.654 -5.163 0.942 1.00 0.00 O ATOM 1076 CB ALA A 982 18.023 -5.547 3.242 1.00 0.00 C ATOM 0 H ALA A 982 19.350 -7.080 1.825 1.00 0.00 H new ATOM 0 HA ALA A 982 16.580 -6.920 2.481 1.00 0.00 H new ATOM 0 HB1 ALA A 982 17.277 -4.873 3.662 1.00 0.00 H new ATOM 0 HB2 ALA A 982 18.362 -6.239 4.013 1.00 0.00 H new ATOM 0 HB3 ALA A 982 18.871 -4.968 2.876 1.00 0.00 H new ATOM 1082 N GLN A 983 17.762 -4.842 0.215 1.00 0.00 N ATOM 1083 CA GLN A 983 17.380 -3.996 -0.911 1.00 0.00 C ATOM 1084 C GLN A 983 16.418 -4.735 -1.828 1.00 0.00 C ATOM 1085 O GLN A 983 15.342 -4.237 -2.156 1.00 0.00 O ATOM 1086 CB GLN A 983 18.621 -3.575 -1.700 1.00 0.00 C ATOM 1087 CG GLN A 983 19.428 -2.490 -1.017 1.00 0.00 C ATOM 1088 CD GLN A 983 20.809 -2.315 -1.614 1.00 0.00 C ATOM 1089 OE1 GLN A 983 21.027 -2.557 -2.803 1.00 0.00 O ATOM 1090 NE2 GLN A 983 21.753 -1.880 -0.793 1.00 0.00 N ATOM 0 H GLN A 983 18.768 -4.975 0.315 1.00 0.00 H new ATOM 0 HA GLN A 983 16.885 -3.107 -0.521 1.00 0.00 H new ATOM 0 HB2 GLN A 983 19.257 -4.447 -1.856 1.00 0.00 H new ATOM 0 HB3 GLN A 983 18.314 -3.224 -2.685 1.00 0.00 H new ATOM 0 HG2 GLN A 983 18.887 -1.546 -1.084 1.00 0.00 H new ATOM 0 HG3 GLN A 983 19.524 -2.728 0.042 1.00 0.00 H new ATOM 0 HE21 GLN A 983 21.531 -1.691 0.185 1.00 0.00 H new ATOM 0 HE22 GLN A 983 22.702 -1.734 -1.138 1.00 0.00 H new ATOM 1099 N LEU A 984 16.818 -5.935 -2.217 1.00 0.00 N ATOM 1100 CA LEU A 984 16.031 -6.779 -3.079 1.00 0.00 C ATOM 1101 C LEU A 984 14.691 -7.113 -2.432 1.00 0.00 C ATOM 1102 O LEU A 984 13.657 -7.111 -3.099 1.00 0.00 O ATOM 1103 CB LEU A 984 16.841 -8.037 -3.348 1.00 0.00 C ATOM 1104 CG LEU A 984 16.257 -9.022 -4.339 1.00 0.00 C ATOM 1105 CD1 LEU A 984 15.957 -8.345 -5.668 1.00 0.00 C ATOM 1106 CD2 LEU A 984 17.241 -10.159 -4.520 1.00 0.00 C ATOM 0 H LEU A 984 17.708 -6.347 -1.936 1.00 0.00 H new ATOM 0 HA LEU A 984 15.809 -6.269 -4.016 1.00 0.00 H new ATOM 0 HB2 LEU A 984 17.826 -7.738 -3.706 1.00 0.00 H new ATOM 0 HB3 LEU A 984 16.990 -8.555 -2.401 1.00 0.00 H new ATOM 0 HG LEU A 984 15.313 -9.410 -3.957 1.00 0.00 H new ATOM 0 HD11 LEU A 984 15.539 -9.074 -6.362 1.00 0.00 H new ATOM 0 HD12 LEU A 984 15.240 -7.539 -5.512 1.00 0.00 H new ATOM 0 HD13 LEU A 984 16.878 -7.936 -6.084 1.00 0.00 H new ATOM 0 HD21 LEU A 984 16.837 -10.880 -5.231 1.00 0.00 H new ATOM 0 HD22 LEU A 984 18.185 -9.766 -4.897 1.00 0.00 H new ATOM 0 HD23 LEU A 984 17.410 -10.650 -3.562 1.00 0.00 H new ATOM 1118 N ALA A 985 14.716 -7.377 -1.129 1.00 0.00 N ATOM 1119 CA ALA A 985 13.500 -7.643 -0.375 1.00 0.00 C ATOM 1120 C ALA A 985 12.535 -6.471 -0.486 1.00 0.00 C ATOM 1121 O ALA A 985 11.362 -6.660 -0.791 1.00 0.00 O ATOM 1122 CB ALA A 985 13.820 -7.930 1.085 1.00 0.00 C ATOM 0 H ALA A 985 15.571 -7.412 -0.573 1.00 0.00 H new ATOM 0 HA ALA A 985 13.024 -8.526 -0.801 1.00 0.00 H new ATOM 0 HB1 ALA A 985 12.896 -8.126 1.628 1.00 0.00 H new ATOM 0 HB2 ALA A 985 14.471 -8.802 1.150 1.00 0.00 H new ATOM 0 HB3 ALA A 985 14.323 -7.068 1.523 1.00 0.00 H new ATOM 1128 N LEU A 986 13.042 -5.261 -0.249 1.00 0.00 N ATOM 1129 CA LEU A 986 12.239 -4.051 -0.395 1.00 0.00 C ATOM 1130 C LEU A 986 11.648 -3.954 -1.794 1.00 0.00 C ATOM 1131 O LEU A 986 10.432 -3.901 -1.961 1.00 0.00 O ATOM 1132 CB LEU A 986 13.074 -2.796 -0.125 1.00 0.00 C ATOM 1133 CG LEU A 986 13.263 -2.429 1.345 1.00 0.00 C ATOM 1134 CD1 LEU A 986 14.115 -1.174 1.464 1.00 0.00 C ATOM 1135 CD2 LEU A 986 11.915 -2.224 2.019 1.00 0.00 C ATOM 0 H LEU A 986 14.005 -5.095 0.045 1.00 0.00 H new ATOM 0 HA LEU A 986 11.434 -4.113 0.337 1.00 0.00 H new ATOM 0 HB2 LEU A 986 14.057 -2.932 -0.575 1.00 0.00 H new ATOM 0 HB3 LEU A 986 12.605 -1.954 -0.633 1.00 0.00 H new ATOM 0 HG LEU A 986 13.776 -3.249 1.848 1.00 0.00 H new ATOM 0 HD11 LEU A 986 14.244 -0.920 2.516 1.00 0.00 H new ATOM 0 HD12 LEU A 986 15.090 -1.352 1.011 1.00 0.00 H new ATOM 0 HD13 LEU A 986 13.622 -0.349 0.950 1.00 0.00 H new ATOM 0 HD21 LEU A 986 12.068 -1.963 3.066 1.00 0.00 H new ATOM 0 HD22 LEU A 986 11.377 -1.419 1.519 1.00 0.00 H new ATOM 0 HD23 LEU A 986 11.333 -3.143 1.955 1.00 0.00 H new ATOM 1147 N ILE A 987 12.523 -3.950 -2.792 1.00 0.00 N ATOM 1148 CA ILE A 987 12.124 -3.757 -4.183 1.00 0.00 C ATOM 1149 C ILE A 987 11.094 -4.803 -4.624 1.00 0.00 C ATOM 1150 O ILE A 987 10.069 -4.463 -5.219 1.00 0.00 O ATOM 1151 CB ILE A 987 13.356 -3.811 -5.113 1.00 0.00 C ATOM 1152 CG1 ILE A 987 14.382 -2.758 -4.673 1.00 0.00 C ATOM 1153 CG2 ILE A 987 12.943 -3.585 -6.562 1.00 0.00 C ATOM 1154 CD1 ILE A 987 15.758 -2.941 -5.279 1.00 0.00 C ATOM 0 H ILE A 987 13.526 -4.080 -2.662 1.00 0.00 H new ATOM 0 HA ILE A 987 11.662 -2.773 -4.256 1.00 0.00 H new ATOM 0 HB ILE A 987 13.811 -4.799 -5.042 1.00 0.00 H new ATOM 0 HG12 ILE A 987 14.008 -1.769 -4.940 1.00 0.00 H new ATOM 0 HG13 ILE A 987 14.469 -2.784 -3.587 1.00 0.00 H new ATOM 0 HG21 ILE A 987 13.824 -3.627 -7.202 1.00 0.00 H new ATOM 0 HG22 ILE A 987 12.238 -4.359 -6.864 1.00 0.00 H new ATOM 0 HG23 ILE A 987 12.471 -2.607 -6.658 1.00 0.00 H new ATOM 0 HD11 ILE A 987 16.422 -2.156 -4.917 1.00 0.00 H new ATOM 0 HD12 ILE A 987 16.156 -3.914 -4.992 1.00 0.00 H new ATOM 0 HD13 ILE A 987 15.688 -2.884 -6.365 1.00 0.00 H new ATOM 1166 N ALA A 988 11.358 -6.061 -4.307 1.00 0.00 N ATOM 1167 CA ALA A 988 10.462 -7.149 -4.683 1.00 0.00 C ATOM 1168 C ALA A 988 9.137 -7.059 -3.933 1.00 0.00 C ATOM 1169 O ALA A 988 8.066 -7.133 -4.541 1.00 0.00 O ATOM 1170 CB ALA A 988 11.125 -8.492 -4.430 1.00 0.00 C ATOM 0 H ALA A 988 12.186 -6.356 -3.790 1.00 0.00 H new ATOM 0 HA ALA A 988 10.250 -7.057 -5.748 1.00 0.00 H new ATOM 0 HB1 ALA A 988 10.444 -9.294 -4.716 1.00 0.00 H new ATOM 0 HB2 ALA A 988 12.038 -8.564 -5.021 1.00 0.00 H new ATOM 0 HB3 ALA A 988 11.370 -8.583 -3.372 1.00 0.00 H new ATOM 1176 N ALA A 989 9.212 -6.883 -2.616 1.00 0.00 N ATOM 1177 CA ALA A 989 8.017 -6.809 -1.781 1.00 0.00 C ATOM 1178 C ALA A 989 7.150 -5.623 -2.176 1.00 0.00 C ATOM 1179 O ALA A 989 5.924 -5.691 -2.105 1.00 0.00 O ATOM 1180 CB ALA A 989 8.390 -6.716 -0.310 1.00 0.00 C ATOM 0 H ALA A 989 10.089 -6.789 -2.104 1.00 0.00 H new ATOM 0 HA ALA A 989 7.445 -7.724 -1.938 1.00 0.00 H new ATOM 0 HB1 ALA A 989 7.483 -6.662 0.293 1.00 0.00 H new ATOM 0 HB2 ALA A 989 8.964 -7.597 -0.024 1.00 0.00 H new ATOM 0 HB3 ALA A 989 8.991 -5.822 -0.143 1.00 0.00 H new ATOM 1186 N SER A 990 7.796 -4.543 -2.595 1.00 0.00 N ATOM 1187 CA SER A 990 7.093 -3.355 -3.051 1.00 0.00 C ATOM 1188 C SER A 990 6.237 -3.673 -4.270 1.00 0.00 C ATOM 1189 O SER A 990 5.052 -3.352 -4.309 1.00 0.00 O ATOM 1190 CB SER A 990 8.092 -2.248 -3.389 1.00 0.00 C ATOM 1191 OG SER A 990 8.833 -1.865 -2.245 1.00 0.00 O ATOM 0 H SER A 990 8.813 -4.467 -2.628 1.00 0.00 H new ATOM 0 HA SER A 990 6.441 -3.012 -2.248 1.00 0.00 H new ATOM 0 HB2 SER A 990 8.772 -2.593 -4.168 1.00 0.00 H new ATOM 0 HB3 SER A 990 7.561 -1.384 -3.789 1.00 0.00 H new ATOM 0 HG SER A 990 9.202 -2.663 -1.812 1.00 0.00 H new ATOM 1197 N GLN A 991 6.836 -4.331 -5.253 1.00 0.00 N ATOM 1198 CA GLN A 991 6.142 -4.659 -6.490 1.00 0.00 C ATOM 1199 C GLN A 991 5.014 -5.656 -6.238 1.00 0.00 C ATOM 1200 O GLN A 991 3.941 -5.563 -6.842 1.00 0.00 O ATOM 1201 CB GLN A 991 7.137 -5.207 -7.511 1.00 0.00 C ATOM 1202 CG GLN A 991 8.181 -4.182 -7.924 1.00 0.00 C ATOM 1203 CD GLN A 991 9.223 -4.750 -8.859 1.00 0.00 C ATOM 1204 OE1 GLN A 991 9.570 -5.927 -8.784 1.00 0.00 O ATOM 1205 NE2 GLN A 991 9.723 -3.920 -9.756 1.00 0.00 N ATOM 0 H GLN A 991 7.804 -4.649 -5.217 1.00 0.00 H new ATOM 0 HA GLN A 991 5.692 -3.750 -6.890 1.00 0.00 H new ATOM 0 HB2 GLN A 991 7.637 -6.080 -7.092 1.00 0.00 H new ATOM 0 HB3 GLN A 991 6.595 -5.544 -8.395 1.00 0.00 H new ATOM 0 HG2 GLN A 991 7.685 -3.341 -8.408 1.00 0.00 H new ATOM 0 HG3 GLN A 991 8.673 -3.792 -7.033 1.00 0.00 H new ATOM 0 HE21 GLN A 991 9.408 -2.950 -9.785 1.00 0.00 H new ATOM 0 HE22 GLN A 991 10.424 -4.249 -10.420 1.00 0.00 H new ATOM 1214 N SER A 992 5.246 -6.592 -5.329 1.00 0.00 N ATOM 1215 CA SER A 992 4.247 -7.565 -4.949 1.00 0.00 C ATOM 1216 C SER A 992 3.187 -6.943 -4.035 1.00 0.00 C ATOM 1217 O SER A 992 2.197 -7.583 -3.689 1.00 0.00 O ATOM 1218 CB SER A 992 4.938 -8.731 -4.256 1.00 0.00 C ATOM 1219 OG SER A 992 5.901 -9.321 -5.115 1.00 0.00 O ATOM 0 H SER A 992 6.134 -6.693 -4.837 1.00 0.00 H new ATOM 0 HA SER A 992 3.734 -7.920 -5.843 1.00 0.00 H new ATOM 0 HB2 SER A 992 5.421 -8.384 -3.343 1.00 0.00 H new ATOM 0 HB3 SER A 992 4.199 -9.477 -3.962 1.00 0.00 H new ATOM 0 HG SER A 992 6.720 -8.783 -5.107 1.00 0.00 H new ATOM 1225 N PHE A 993 3.407 -5.694 -3.645 1.00 0.00 N ATOM 1226 CA PHE A 993 2.452 -4.962 -2.824 1.00 0.00 C ATOM 1227 C PHE A 993 1.663 -3.981 -3.689 1.00 0.00 C ATOM 1228 O PHE A 993 0.483 -3.728 -3.446 1.00 0.00 O ATOM 1229 CB PHE A 993 3.187 -4.219 -1.705 1.00 0.00 C ATOM 1230 CG PHE A 993 2.282 -3.550 -0.711 1.00 0.00 C ATOM 1231 CD1 PHE A 993 1.710 -4.273 0.323 1.00 0.00 C ATOM 1232 CD2 PHE A 993 1.998 -2.199 -0.816 1.00 0.00 C ATOM 1233 CE1 PHE A 993 0.873 -3.659 1.235 1.00 0.00 C ATOM 1234 CE2 PHE A 993 1.163 -1.581 0.092 1.00 0.00 C ATOM 1235 CZ PHE A 993 0.617 -2.312 1.135 1.00 0.00 C ATOM 0 H PHE A 993 4.244 -5.164 -3.886 1.00 0.00 H new ATOM 0 HA PHE A 993 1.753 -5.667 -2.374 1.00 0.00 H new ATOM 0 HB2 PHE A 993 3.829 -4.924 -1.177 1.00 0.00 H new ATOM 0 HB3 PHE A 993 3.838 -3.467 -2.150 1.00 0.00 H new ATOM 0 HD1 PHE A 993 1.921 -5.328 0.417 1.00 0.00 H new ATOM 0 HD2 PHE A 993 2.435 -1.622 -1.618 1.00 0.00 H new ATOM 0 HE1 PHE A 993 0.420 -4.237 2.027 1.00 0.00 H new ATOM 0 HE2 PHE A 993 0.935 -0.530 -0.010 1.00 0.00 H new ATOM 0 HZ PHE A 993 -0.009 -1.824 1.868 1.00 0.00 H new ATOM 1245 N LEU A 994 2.331 -3.445 -4.708 1.00 0.00 N ATOM 1246 CA LEU A 994 1.721 -2.494 -5.634 1.00 0.00 C ATOM 1247 C LEU A 994 0.501 -3.091 -6.319 1.00 0.00 C ATOM 1248 O LEU A 994 -0.524 -2.425 -6.469 1.00 0.00 O ATOM 1249 CB LEU A 994 2.737 -2.070 -6.697 1.00 0.00 C ATOM 1250 CG LEU A 994 3.977 -1.350 -6.173 1.00 0.00 C ATOM 1251 CD1 LEU A 994 5.016 -1.231 -7.273 1.00 0.00 C ATOM 1252 CD2 LEU A 994 3.612 0.023 -5.630 1.00 0.00 C ATOM 0 H LEU A 994 3.307 -3.657 -4.915 1.00 0.00 H new ATOM 0 HA LEU A 994 1.405 -1.626 -5.055 1.00 0.00 H new ATOM 0 HB2 LEU A 994 3.057 -2.958 -7.242 1.00 0.00 H new ATOM 0 HB3 LEU A 994 2.236 -1.419 -7.414 1.00 0.00 H new ATOM 0 HG LEU A 994 4.399 -1.935 -5.356 1.00 0.00 H new ATOM 0 HD11 LEU A 994 5.896 -0.716 -6.888 1.00 0.00 H new ATOM 0 HD12 LEU A 994 5.299 -2.226 -7.615 1.00 0.00 H new ATOM 0 HD13 LEU A 994 4.600 -0.665 -8.107 1.00 0.00 H new ATOM 0 HD21 LEU A 994 4.510 0.519 -5.262 1.00 0.00 H new ATOM 0 HD22 LEU A 994 3.167 0.622 -6.424 1.00 0.00 H new ATOM 0 HD23 LEU A 994 2.897 -0.087 -4.814 1.00 0.00 H new ATOM 1264 N GLN A 995 0.621 -4.343 -6.741 1.00 0.00 N ATOM 1265 CA GLN A 995 -0.463 -5.012 -7.451 1.00 0.00 C ATOM 1266 C GLN A 995 -1.723 -5.136 -6.573 1.00 0.00 C ATOM 1267 O GLN A 995 -2.772 -4.613 -6.945 1.00 0.00 O ATOM 1268 CB GLN A 995 -0.007 -6.382 -7.969 1.00 0.00 C ATOM 1269 CG GLN A 995 -1.016 -7.072 -8.880 1.00 0.00 C ATOM 1270 CD GLN A 995 -1.064 -6.490 -10.286 1.00 0.00 C ATOM 1271 OE1 GLN A 995 -1.345 -7.204 -11.249 1.00 0.00 O ATOM 1272 NE2 GLN A 995 -0.801 -5.198 -10.423 1.00 0.00 N ATOM 0 H GLN A 995 1.455 -4.915 -6.605 1.00 0.00 H new ATOM 0 HA GLN A 995 -0.729 -4.397 -8.310 1.00 0.00 H new ATOM 0 HB2 GLN A 995 0.931 -6.259 -8.511 1.00 0.00 H new ATOM 0 HB3 GLN A 995 0.199 -7.030 -7.117 1.00 0.00 H new ATOM 0 HG2 GLN A 995 -0.771 -8.132 -8.943 1.00 0.00 H new ATOM 0 HG3 GLN A 995 -2.007 -7.000 -8.432 1.00 0.00 H new ATOM 0 HE21 GLN A 995 -0.572 -4.635 -9.604 1.00 0.00 H new ATOM 0 HE22 GLN A 995 -0.828 -4.767 -11.347 1.00 0.00 H new ATOM 1281 N PRO A 996 -1.653 -5.808 -5.397 1.00 0.00 N ATOM 1282 CA PRO A 996 -2.807 -5.917 -4.494 1.00 0.00 C ATOM 1283 C PRO A 996 -3.277 -4.551 -4.001 1.00 0.00 C ATOM 1284 O PRO A 996 -4.477 -4.303 -3.884 1.00 0.00 O ATOM 1285 CB PRO A 996 -2.285 -6.757 -3.322 1.00 0.00 C ATOM 1286 CG PRO A 996 -1.086 -7.456 -3.852 1.00 0.00 C ATOM 1287 CD PRO A 996 -0.480 -6.521 -4.857 1.00 0.00 C ATOM 0 HA PRO A 996 -3.669 -6.361 -4.992 1.00 0.00 H new ATOM 0 HB2 PRO A 996 -2.030 -6.128 -2.469 1.00 0.00 H new ATOM 0 HB3 PRO A 996 -3.037 -7.468 -2.980 1.00 0.00 H new ATOM 0 HG2 PRO A 996 -0.380 -7.682 -3.053 1.00 0.00 H new ATOM 0 HG3 PRO A 996 -1.359 -8.404 -4.315 1.00 0.00 H new ATOM 0 HD2 PRO A 996 0.230 -5.836 -4.394 1.00 0.00 H new ATOM 0 HD3 PRO A 996 0.059 -7.060 -5.636 1.00 0.00 H new ATOM 1295 N GLY A 997 -2.322 -3.671 -3.722 1.00 0.00 N ATOM 1296 CA GLY A 997 -2.648 -2.335 -3.264 1.00 0.00 C ATOM 1297 C GLY A 997 -3.468 -1.572 -4.282 1.00 0.00 C ATOM 1298 O GLY A 997 -4.510 -1.008 -3.950 1.00 0.00 O ATOM 0 H GLY A 997 -1.323 -3.861 -3.806 1.00 0.00 H new ATOM 0 HA2 GLY A 997 -3.201 -2.398 -2.327 1.00 0.00 H new ATOM 0 HA3 GLY A 997 -1.728 -1.788 -3.056 1.00 0.00 H new ATOM 1302 N GLY A 998 -3.005 -1.576 -5.529 1.00 0.00 N ATOM 1303 CA GLY A 998 -3.716 -0.899 -6.598 1.00 0.00 C ATOM 1304 C GLY A 998 -5.112 -1.452 -6.797 1.00 0.00 C ATOM 1305 O GLY A 998 -6.042 -0.710 -7.115 1.00 0.00 O ATOM 0 H GLY A 998 -2.144 -2.040 -5.819 1.00 0.00 H new ATOM 0 HA2 GLY A 998 -3.778 0.166 -6.374 1.00 0.00 H new ATOM 0 HA3 GLY A 998 -3.153 -0.997 -7.526 1.00 0.00 H new ATOM 1309 N LYS A 999 -5.255 -2.758 -6.594 1.00 0.00 N ATOM 1310 CA LYS A 999 -6.554 -3.411 -6.682 1.00 0.00 C ATOM 1311 C LYS A 999 -7.522 -2.823 -5.664 1.00 0.00 C ATOM 1312 O LYS A 999 -8.676 -2.535 -5.985 1.00 0.00 O ATOM 1313 CB LYS A 999 -6.417 -4.915 -6.449 1.00 0.00 C ATOM 1314 CG LYS A 999 -5.657 -5.638 -7.547 1.00 0.00 C ATOM 1315 CD LYS A 999 -5.448 -7.103 -7.201 1.00 0.00 C ATOM 1316 CE LYS A 999 -4.800 -7.862 -8.347 1.00 0.00 C ATOM 1317 NZ LYS A 999 -5.642 -7.840 -9.573 1.00 0.00 N ATOM 0 H LYS A 999 -4.484 -3.386 -6.367 1.00 0.00 H new ATOM 0 HA LYS A 999 -6.947 -3.241 -7.684 1.00 0.00 H new ATOM 0 HB2 LYS A 999 -5.910 -5.081 -5.499 1.00 0.00 H new ATOM 0 HB3 LYS A 999 -7.412 -5.352 -6.360 1.00 0.00 H new ATOM 0 HG2 LYS A 999 -6.206 -5.558 -8.485 1.00 0.00 H new ATOM 0 HG3 LYS A 999 -4.691 -5.157 -7.701 1.00 0.00 H new ATOM 0 HD2 LYS A 999 -4.822 -7.182 -6.312 1.00 0.00 H new ATOM 0 HD3 LYS A 999 -6.407 -7.560 -6.957 1.00 0.00 H new ATOM 0 HE2 LYS A 999 -3.826 -7.425 -8.567 1.00 0.00 H new ATOM 0 HE3 LYS A 999 -4.625 -8.895 -8.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 999 -5.325 -8.586 -10.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 999 -6.636 -8.005 -9.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 999 -5.555 -6.914 -10.038 1.00 0.00 H new ATOM 1331 N MET A1000 -7.046 -2.622 -4.438 1.00 0.00 N ATOM 1332 CA MET A1000 -7.900 -2.109 -3.381 1.00 0.00 C ATOM 1333 C MET A1000 -8.158 -0.621 -3.578 1.00 0.00 C ATOM 1334 O MET A1000 -9.223 -0.122 -3.227 1.00 0.00 O ATOM 1335 CB MET A1000 -7.293 -2.370 -2.001 1.00 0.00 C ATOM 1336 CG MET A1000 -8.271 -2.120 -0.863 1.00 0.00 C ATOM 1337 SD MET A1000 -7.623 -2.615 0.744 1.00 0.00 S ATOM 1338 CE MET A1000 -6.269 -1.464 0.932 1.00 0.00 C ATOM 0 H MET A1000 -6.083 -2.806 -4.158 1.00 0.00 H new ATOM 0 HA MET A1000 -8.852 -2.638 -3.433 1.00 0.00 H new ATOM 0 HB2 MET A1000 -6.945 -3.402 -1.953 1.00 0.00 H new ATOM 0 HB3 MET A1000 -6.419 -1.732 -1.868 1.00 0.00 H new ATOM 0 HG2 MET A1000 -8.525 -1.060 -0.836 1.00 0.00 H new ATOM 0 HG3 MET A1000 -9.195 -2.664 -1.059 1.00 0.00 H new ATOM 0 HE1 MET A1000 -6.078 -1.296 1.992 1.00 0.00 H new ATOM 0 HE2 MET A1000 -5.375 -1.874 0.463 1.00 0.00 H new ATOM 0 HE3 MET A1000 -6.527 -0.518 0.456 1.00 0.00 H new ATOM 1348 N VAL A1001 -7.183 0.083 -4.147 1.00 0.00 N ATOM 1349 CA VAL A1001 -7.364 1.489 -4.494 1.00 0.00 C ATOM 1350 C VAL A1001 -8.503 1.632 -5.498 1.00 0.00 C ATOM 1351 O VAL A1001 -9.412 2.445 -5.314 1.00 0.00 O ATOM 1352 CB VAL A1001 -6.077 2.110 -5.091 1.00 0.00 C ATOM 1353 CG1 VAL A1001 -6.319 3.545 -5.532 1.00 0.00 C ATOM 1354 CG2 VAL A1001 -4.940 2.058 -4.085 1.00 0.00 C ATOM 0 H VAL A1001 -6.264 -0.295 -4.377 1.00 0.00 H new ATOM 0 HA VAL A1001 -7.602 2.024 -3.574 1.00 0.00 H new ATOM 0 HB VAL A1001 -5.798 1.523 -5.966 1.00 0.00 H new ATOM 0 HG11 VAL A1001 -5.400 3.958 -5.947 1.00 0.00 H new ATOM 0 HG12 VAL A1001 -7.101 3.565 -6.291 1.00 0.00 H new ATOM 0 HG13 VAL A1001 -6.630 4.142 -4.674 1.00 0.00 H new ATOM 0 HG21 VAL A1001 -4.045 2.499 -4.524 1.00 0.00 H new ATOM 0 HG22 VAL A1001 -5.219 2.617 -3.191 1.00 0.00 H new ATOM 0 HG23 VAL A1001 -4.739 1.021 -3.817 1.00 0.00 H new ATOM 1364 N ALA A1002 -8.454 0.819 -6.549 1.00 0.00 N ATOM 1365 CA ALA A1002 -9.491 0.821 -7.571 1.00 0.00 C ATOM 1366 C ALA A1002 -10.837 0.425 -6.974 1.00 0.00 C ATOM 1367 O ALA A1002 -11.850 1.087 -7.211 1.00 0.00 O ATOM 1368 CB ALA A1002 -9.114 -0.115 -8.710 1.00 0.00 C ATOM 0 H ALA A1002 -7.703 0.148 -6.714 1.00 0.00 H new ATOM 0 HA ALA A1002 -9.580 1.832 -7.969 1.00 0.00 H new ATOM 0 HB1 ALA A1002 -9.899 -0.103 -9.466 1.00 0.00 H new ATOM 0 HB2 ALA A1002 -8.175 0.214 -9.156 1.00 0.00 H new ATOM 0 HB3 ALA A1002 -8.997 -1.128 -8.325 1.00 0.00 H new ATOM 1374 N ALA A1003 -10.832 -0.649 -6.189 1.00 0.00 N ATOM 1375 CA ALA A1003 -12.042 -1.135 -5.537 1.00 0.00 C ATOM 1376 C ALA A1003 -12.645 -0.069 -4.630 1.00 0.00 C ATOM 1377 O ALA A1003 -13.853 0.161 -4.648 1.00 0.00 O ATOM 1378 CB ALA A1003 -11.744 -2.397 -4.742 1.00 0.00 C ATOM 0 H ALA A1003 -9.998 -1.201 -5.989 1.00 0.00 H new ATOM 0 HA ALA A1003 -12.771 -1.370 -6.313 1.00 0.00 H new ATOM 0 HB1 ALA A1003 -12.657 -2.748 -4.261 1.00 0.00 H new ATOM 0 HB2 ALA A1003 -11.367 -3.169 -5.413 1.00 0.00 H new ATOM 0 HB3 ALA A1003 -10.994 -2.179 -3.982 1.00 0.00 H new ATOM 1384 N ALA A1004 -11.795 0.586 -3.844 1.00 0.00 N ATOM 1385 CA ALA A1004 -12.241 1.634 -2.935 1.00 0.00 C ATOM 1386 C ALA A1004 -12.913 2.763 -3.703 1.00 0.00 C ATOM 1387 O ALA A1004 -14.035 3.153 -3.389 1.00 0.00 O ATOM 1388 CB ALA A1004 -11.071 2.168 -2.121 1.00 0.00 C ATOM 0 H ALA A1004 -10.791 0.408 -3.819 1.00 0.00 H new ATOM 0 HA ALA A1004 -12.971 1.203 -2.250 1.00 0.00 H new ATOM 0 HB1 ALA A1004 -11.423 2.950 -1.448 1.00 0.00 H new ATOM 0 HB2 ALA A1004 -10.633 1.357 -1.538 1.00 0.00 H new ATOM 0 HB3 ALA A1004 -10.318 2.580 -2.793 1.00 0.00 H new ATOM 1394 N LYS A1005 -12.228 3.261 -4.731 1.00 0.00 N ATOM 1395 CA LYS A1005 -12.740 4.356 -5.551 1.00 0.00 C ATOM 1396 C LYS A1005 -14.056 3.981 -6.221 1.00 0.00 C ATOM 1397 O LYS A1005 -14.925 4.829 -6.427 1.00 0.00 O ATOM 1398 CB LYS A1005 -11.720 4.743 -6.619 1.00 0.00 C ATOM 1399 CG LYS A1005 -10.458 5.381 -6.060 1.00 0.00 C ATOM 1400 CD LYS A1005 -9.455 5.679 -7.161 1.00 0.00 C ATOM 1401 CE LYS A1005 -8.218 6.382 -6.625 1.00 0.00 C ATOM 1402 NZ LYS A1005 -8.519 7.753 -6.138 1.00 0.00 N ATOM 0 H LYS A1005 -11.310 2.920 -5.017 1.00 0.00 H new ATOM 0 HA LYS A1005 -12.917 5.205 -4.890 1.00 0.00 H new ATOM 0 HB2 LYS A1005 -11.446 3.853 -7.186 1.00 0.00 H new ATOM 0 HB3 LYS A1005 -12.186 5.436 -7.320 1.00 0.00 H new ATOM 0 HG2 LYS A1005 -10.714 6.304 -5.540 1.00 0.00 H new ATOM 0 HG3 LYS A1005 -10.007 4.715 -5.325 1.00 0.00 H new ATOM 0 HD2 LYS A1005 -9.162 4.748 -7.647 1.00 0.00 H new ATOM 0 HD3 LYS A1005 -9.925 6.302 -7.922 1.00 0.00 H new ATOM 0 HE2 LYS A1005 -7.792 5.795 -5.812 1.00 0.00 H new ATOM 0 HE3 LYS A1005 -7.463 6.434 -7.410 1.00 0.00 H new ATOM 0 HZ1 LYS A1005 -7.629 8.255 -5.941 1.00 0.00 H new ATOM 0 HZ2 LYS A1005 -9.054 8.270 -6.865 1.00 0.00 H new ATOM 0 HZ3 LYS A1005 -9.084 7.696 -5.267 1.00 0.00 H new ATOM 1416 N ALA A1006 -14.198 2.710 -6.557 1.00 0.00 N ATOM 1417 CA ALA A1006 -15.394 2.226 -7.223 1.00 0.00 C ATOM 1418 C ALA A1006 -16.538 2.033 -6.231 1.00 0.00 C ATOM 1419 O ALA A1006 -17.710 2.076 -6.606 1.00 0.00 O ATOM 1420 CB ALA A1006 -15.088 0.932 -7.956 1.00 0.00 C ATOM 0 H ALA A1006 -13.496 1.992 -6.378 1.00 0.00 H new ATOM 0 HA ALA A1006 -15.714 2.974 -7.948 1.00 0.00 H new ATOM 0 HB1 ALA A1006 -15.989 0.574 -8.454 1.00 0.00 H new ATOM 0 HB2 ALA A1006 -14.310 1.110 -8.698 1.00 0.00 H new ATOM 0 HB3 ALA A1006 -14.745 0.182 -7.243 1.00 0.00 H new ATOM 1426 N SER A1007 -16.187 1.843 -4.965 1.00 0.00 N ATOM 1427 CA SER A1007 -17.177 1.639 -3.918 1.00 0.00 C ATOM 1428 C SER A1007 -17.664 2.976 -3.357 1.00 0.00 C ATOM 1429 O SER A1007 -18.798 3.083 -2.892 1.00 0.00 O ATOM 1430 CB SER A1007 -16.591 0.777 -2.797 1.00 0.00 C ATOM 1431 OG SER A1007 -17.582 0.427 -1.847 1.00 0.00 O ATOM 0 H SER A1007 -15.221 1.826 -4.639 1.00 0.00 H new ATOM 0 HA SER A1007 -18.032 1.121 -4.354 1.00 0.00 H new ATOM 0 HB2 SER A1007 -16.155 -0.127 -3.221 1.00 0.00 H new ATOM 0 HB3 SER A1007 -15.785 1.318 -2.302 1.00 0.00 H new ATOM 0 HG SER A1007 -17.411 0.901 -1.006 1.00 0.00 H new ATOM 1437 N VAL A1008 -16.803 3.989 -3.427 1.00 0.00 N ATOM 1438 CA VAL A1008 -17.118 5.330 -2.921 1.00 0.00 C ATOM 1439 C VAL A1008 -18.501 5.834 -3.380 1.00 0.00 C ATOM 1440 O VAL A1008 -19.309 6.249 -2.548 1.00 0.00 O ATOM 1441 CB VAL A1008 -16.026 6.351 -3.327 1.00 0.00 C ATOM 1442 CG1 VAL A1008 -16.424 7.770 -2.946 1.00 0.00 C ATOM 1443 CG2 VAL A1008 -14.694 5.990 -2.687 1.00 0.00 C ATOM 0 H VAL A1008 -15.871 3.908 -3.833 1.00 0.00 H new ATOM 0 HA VAL A1008 -17.145 5.243 -1.835 1.00 0.00 H new ATOM 0 HB VAL A1008 -15.921 6.309 -4.411 1.00 0.00 H new ATOM 0 HG11 VAL A1008 -15.636 8.461 -3.245 1.00 0.00 H new ATOM 0 HG12 VAL A1008 -17.352 8.036 -3.453 1.00 0.00 H new ATOM 0 HG13 VAL A1008 -16.570 7.830 -1.867 1.00 0.00 H new ATOM 0 HG21 VAL A1008 -13.939 6.718 -2.983 1.00 0.00 H new ATOM 0 HG22 VAL A1008 -14.798 5.996 -1.602 1.00 0.00 H new ATOM 0 HG23 VAL A1008 -14.389 4.997 -3.017 1.00 0.00 H new ATOM 1453 N PRO A1009 -18.813 5.809 -4.692 1.00 0.00 N ATOM 1454 CA PRO A1009 -20.106 6.295 -5.188 1.00 0.00 C ATOM 1455 C PRO A1009 -21.270 5.362 -4.851 1.00 0.00 C ATOM 1456 O PRO A1009 -22.431 5.754 -4.954 1.00 0.00 O ATOM 1457 CB PRO A1009 -19.903 6.366 -6.700 1.00 0.00 C ATOM 1458 CG PRO A1009 -18.858 5.349 -6.987 1.00 0.00 C ATOM 1459 CD PRO A1009 -17.947 5.344 -5.794 1.00 0.00 C ATOM 0 HA PRO A1009 -20.375 7.246 -4.729 1.00 0.00 H new ATOM 0 HB2 PRO A1009 -20.827 6.146 -7.235 1.00 0.00 H new ATOM 0 HB3 PRO A1009 -19.584 7.361 -7.011 1.00 0.00 H new ATOM 0 HG2 PRO A1009 -19.303 4.366 -7.143 1.00 0.00 H new ATOM 0 HG3 PRO A1009 -18.310 5.598 -7.896 1.00 0.00 H new ATOM 0 HD2 PRO A1009 -17.549 4.348 -5.598 1.00 0.00 H new ATOM 0 HD3 PRO A1009 -17.093 6.006 -5.939 1.00 0.00 H new ATOM 1467 N THR A1010 -20.966 4.139 -4.441 1.00 0.00 N ATOM 1468 CA THR A1010 -22.010 3.163 -4.158 1.00 0.00 C ATOM 1469 C THR A1010 -22.327 3.092 -2.666 1.00 0.00 C ATOM 1470 O THR A1010 -23.138 2.273 -2.231 1.00 0.00 O ATOM 1471 CB THR A1010 -21.636 1.761 -4.688 1.00 0.00 C ATOM 1472 OG1 THR A1010 -20.337 1.371 -4.221 1.00 0.00 O ATOM 1473 CG2 THR A1010 -21.654 1.740 -6.207 1.00 0.00 C ATOM 0 H THR A1010 -20.015 3.800 -4.298 1.00 0.00 H new ATOM 0 HA THR A1010 -22.904 3.501 -4.682 1.00 0.00 H new ATOM 0 HB THR A1010 -22.376 1.055 -4.312 1.00 0.00 H new ATOM 0 HG1 THR A1010 -20.030 2.005 -3.540 1.00 0.00 H new ATOM 0 HG21 THR A1010 -21.388 0.744 -6.560 1.00 0.00 H new ATOM 0 HG22 THR A1010 -22.652 1.997 -6.563 1.00 0.00 H new ATOM 0 HG23 THR A1010 -20.935 2.465 -6.589 1.00 0.00 H new ATOM 1481 N ILE A1011 -21.693 3.957 -1.884 1.00 0.00 N ATOM 1482 CA ILE A1011 -21.963 4.020 -0.454 1.00 0.00 C ATOM 1483 C ILE A1011 -23.109 4.991 -0.179 1.00 0.00 C ATOM 1484 O ILE A1011 -23.128 6.109 -0.697 1.00 0.00 O ATOM 1485 CB ILE A1011 -20.710 4.434 0.349 1.00 0.00 C ATOM 1486 CG1 ILE A1011 -19.584 3.420 0.126 1.00 0.00 C ATOM 1487 CG2 ILE A1011 -21.033 4.546 1.833 1.00 0.00 C ATOM 1488 CD1 ILE A1011 -18.299 3.761 0.850 1.00 0.00 C ATOM 0 H ILE A1011 -20.992 4.621 -2.214 1.00 0.00 H new ATOM 0 HA ILE A1011 -22.249 3.020 -0.127 1.00 0.00 H new ATOM 0 HB ILE A1011 -20.381 5.412 -0.004 1.00 0.00 H new ATOM 0 HG12 ILE A1011 -19.924 2.437 0.453 1.00 0.00 H new ATOM 0 HG13 ILE A1011 -19.380 3.348 -0.942 1.00 0.00 H new ATOM 0 HG21 ILE A1011 -20.136 4.839 2.379 1.00 0.00 H new ATOM 0 HG22 ILE A1011 -21.809 5.297 1.981 1.00 0.00 H new ATOM 0 HG23 ILE A1011 -21.385 3.583 2.202 1.00 0.00 H new ATOM 0 HD11 ILE A1011 -17.551 2.996 0.643 1.00 0.00 H new ATOM 0 HD12 ILE A1011 -17.934 4.729 0.507 1.00 0.00 H new ATOM 0 HD13 ILE A1011 -18.486 3.804 1.923 1.00 0.00 H new ATOM 1500 N GLN A1012 -24.065 4.546 0.630 1.00 0.00 N ATOM 1501 CA GLN A1012 -25.269 5.324 0.914 1.00 0.00 C ATOM 1502 C GLN A1012 -24.940 6.616 1.659 1.00 0.00 C ATOM 1503 O GLN A1012 -25.621 7.631 1.494 1.00 0.00 O ATOM 1504 CB GLN A1012 -26.247 4.487 1.737 1.00 0.00 C ATOM 1505 CG GLN A1012 -26.624 3.168 1.079 1.00 0.00 C ATOM 1506 CD GLN A1012 -27.627 2.374 1.891 1.00 0.00 C ATOM 1507 OE1 GLN A1012 -27.255 1.564 2.743 1.00 0.00 O ATOM 1508 NE2 GLN A1012 -28.904 2.597 1.630 1.00 0.00 N ATOM 0 H GLN A1012 -24.030 3.644 1.104 1.00 0.00 H new ATOM 0 HA GLN A1012 -25.726 5.592 -0.039 1.00 0.00 H new ATOM 0 HB2 GLN A1012 -25.806 4.284 2.713 1.00 0.00 H new ATOM 0 HB3 GLN A1012 -27.152 5.068 1.911 1.00 0.00 H new ATOM 0 HG2 GLN A1012 -27.038 3.365 0.090 1.00 0.00 H new ATOM 0 HG3 GLN A1012 -25.725 2.569 0.934 1.00 0.00 H new ATOM 0 HE21 GLN A1012 -29.168 3.276 0.916 1.00 0.00 H new ATOM 0 HE22 GLN A1012 -29.625 2.090 2.142 1.00 0.00 H new ATOM 1517 N ASP A1013 -23.898 6.577 2.473 1.00 0.00 N ATOM 1518 CA ASP A1013 -23.494 7.739 3.251 1.00 0.00 C ATOM 1519 C ASP A1013 -22.289 8.422 2.616 1.00 0.00 C ATOM 1520 O ASP A1013 -21.259 7.794 2.377 1.00 0.00 O ATOM 1521 CB ASP A1013 -23.181 7.325 4.687 1.00 0.00 C ATOM 1522 CG ASP A1013 -22.644 8.470 5.514 1.00 0.00 C ATOM 1523 OD1 ASP A1013 -23.433 9.363 5.883 1.00 0.00 O ATOM 1524 OD2 ASP A1013 -21.430 8.477 5.799 1.00 0.00 O ATOM 0 H ASP A1013 -23.315 5.752 2.613 1.00 0.00 H new ATOM 0 HA ASP A1013 -24.318 8.452 3.263 1.00 0.00 H new ATOM 0 HB2 ASP A1013 -24.085 6.936 5.155 1.00 0.00 H new ATOM 0 HB3 ASP A1013 -22.452 6.514 4.678 1.00 0.00 H new ATOM 1529 N GLN A1014 -22.429 9.713 2.339 1.00 0.00 N ATOM 1530 CA GLN A1014 -21.387 10.473 1.654 1.00 0.00 C ATOM 1531 C GLN A1014 -20.127 10.610 2.512 1.00 0.00 C ATOM 1532 O GLN A1014 -19.010 10.544 1.999 1.00 0.00 O ATOM 1533 CB GLN A1014 -21.909 11.857 1.267 1.00 0.00 C ATOM 1534 CG GLN A1014 -20.929 12.667 0.434 1.00 0.00 C ATOM 1535 CD GLN A1014 -21.451 14.047 0.092 1.00 0.00 C ATOM 1536 OE1 GLN A1014 -22.215 14.642 0.850 1.00 0.00 O ATOM 1537 NE2 GLN A1014 -21.046 14.562 -1.057 1.00 0.00 N ATOM 0 H GLN A1014 -23.257 10.258 2.579 1.00 0.00 H new ATOM 0 HA GLN A1014 -21.118 9.922 0.753 1.00 0.00 H new ATOM 0 HB2 GLN A1014 -22.839 11.742 0.709 1.00 0.00 H new ATOM 0 HB3 GLN A1014 -22.148 12.413 2.174 1.00 0.00 H new ATOM 0 HG2 GLN A1014 -19.989 12.763 0.978 1.00 0.00 H new ATOM 0 HG3 GLN A1014 -20.710 12.128 -0.487 1.00 0.00 H new ATOM 0 HE21 GLN A1014 -20.411 14.035 -1.657 1.00 0.00 H new ATOM 0 HE22 GLN A1014 -21.368 15.486 -1.343 1.00 0.00 H new ATOM 1546 N ALA A1015 -20.307 10.797 3.814 1.00 0.00 N ATOM 1547 CA ALA A1015 -19.179 10.959 4.726 1.00 0.00 C ATOM 1548 C ALA A1015 -18.288 9.721 4.727 1.00 0.00 C ATOM 1549 O ALA A1015 -17.066 9.827 4.611 1.00 0.00 O ATOM 1550 CB ALA A1015 -19.668 11.265 6.134 1.00 0.00 C ATOM 0 H ALA A1015 -21.222 10.840 4.263 1.00 0.00 H new ATOM 0 HA ALA A1015 -18.583 11.801 4.374 1.00 0.00 H new ATOM 0 HB1 ALA A1015 -18.812 11.382 6.799 1.00 0.00 H new ATOM 0 HB2 ALA A1015 -20.249 12.187 6.125 1.00 0.00 H new ATOM 0 HB3 ALA A1015 -20.293 10.445 6.488 1.00 0.00 H new ATOM 1556 N SER A1016 -18.895 8.549 4.853 1.00 0.00 N ATOM 1557 CA SER A1016 -18.147 7.299 4.820 1.00 0.00 C ATOM 1558 C SER A1016 -17.602 7.024 3.415 1.00 0.00 C ATOM 1559 O SER A1016 -16.585 6.351 3.254 1.00 0.00 O ATOM 1560 CB SER A1016 -19.016 6.138 5.312 1.00 0.00 C ATOM 1561 OG SER A1016 -20.314 6.189 4.746 1.00 0.00 O ATOM 0 H SER A1016 -19.901 8.437 4.979 1.00 0.00 H new ATOM 0 HA SER A1016 -17.295 7.393 5.494 1.00 0.00 H new ATOM 0 HB2 SER A1016 -18.542 5.191 5.054 1.00 0.00 H new ATOM 0 HB3 SER A1016 -19.090 6.172 6.399 1.00 0.00 H new ATOM 0 HG SER A1016 -20.293 6.727 3.927 1.00 0.00 H new ATOM 1567 N ALA A1017 -18.268 7.568 2.405 1.00 0.00 N ATOM 1568 CA ALA A1017 -17.778 7.473 1.037 1.00 0.00 C ATOM 1569 C ALA A1017 -16.480 8.260 0.881 1.00 0.00 C ATOM 1570 O ALA A1017 -15.529 7.807 0.238 1.00 0.00 O ATOM 1571 CB ALA A1017 -18.831 7.978 0.062 1.00 0.00 C ATOM 0 H ALA A1017 -19.146 8.078 2.507 1.00 0.00 H new ATOM 0 HA ALA A1017 -17.574 6.426 0.812 1.00 0.00 H new ATOM 0 HB1 ALA A1017 -18.451 7.901 -0.957 1.00 0.00 H new ATOM 0 HB2 ALA A1017 -19.735 7.376 0.158 1.00 0.00 H new ATOM 0 HB3 ALA A1017 -19.063 9.019 0.285 1.00 0.00 H new ATOM 1577 N MET A1018 -16.437 9.436 1.493 1.00 0.00 N ATOM 1578 CA MET A1018 -15.242 10.274 1.462 1.00 0.00 C ATOM 1579 C MET A1018 -14.135 9.662 2.312 1.00 0.00 C ATOM 1580 O MET A1018 -12.957 9.981 2.144 1.00 0.00 O ATOM 1581 CB MET A1018 -15.558 11.693 1.942 1.00 0.00 C ATOM 1582 CG MET A1018 -16.524 12.439 1.034 1.00 0.00 C ATOM 1583 SD MET A1018 -15.953 12.515 -0.676 1.00 0.00 S ATOM 1584 CE MET A1018 -14.408 13.404 -0.482 1.00 0.00 C ATOM 0 H MET A1018 -17.216 9.833 2.018 1.00 0.00 H new ATOM 0 HA MET A1018 -14.897 10.330 0.430 1.00 0.00 H new ATOM 0 HB2 MET A1018 -15.980 11.643 2.946 1.00 0.00 H new ATOM 0 HB3 MET A1018 -14.629 12.259 2.015 1.00 0.00 H new ATOM 0 HG2 MET A1018 -17.498 11.950 1.066 1.00 0.00 H new ATOM 0 HG3 MET A1018 -16.663 13.452 1.412 1.00 0.00 H new ATOM 0 HE1 MET A1018 -14.070 13.762 -1.454 1.00 0.00 H new ATOM 0 HE2 MET A1018 -14.558 14.253 0.185 1.00 0.00 H new ATOM 0 HE3 MET A1018 -13.656 12.738 -0.058 1.00 0.00 H new ATOM 1594 N GLN A1019 -14.525 8.777 3.219 1.00 0.00 N ATOM 1595 CA GLN A1019 -13.577 8.033 4.041 1.00 0.00 C ATOM 1596 C GLN A1019 -12.703 7.146 3.159 1.00 0.00 C ATOM 1597 O GLN A1019 -11.477 7.155 3.273 1.00 0.00 O ATOM 1598 CB GLN A1019 -14.340 7.187 5.060 1.00 0.00 C ATOM 1599 CG GLN A1019 -13.473 6.281 5.915 1.00 0.00 C ATOM 1600 CD GLN A1019 -14.304 5.418 6.844 1.00 0.00 C ATOM 1601 OE1 GLN A1019 -13.927 4.295 7.171 1.00 0.00 O ATOM 1602 NE2 GLN A1019 -15.439 5.940 7.280 1.00 0.00 N ATOM 0 H GLN A1019 -15.503 8.554 3.406 1.00 0.00 H new ATOM 0 HA GLN A1019 -12.932 8.732 4.573 1.00 0.00 H new ATOM 0 HB2 GLN A1019 -14.902 7.853 5.715 1.00 0.00 H new ATOM 0 HB3 GLN A1019 -15.068 6.574 4.529 1.00 0.00 H new ATOM 0 HG2 GLN A1019 -12.868 5.643 5.271 1.00 0.00 H new ATOM 0 HG3 GLN A1019 -12.783 6.887 6.502 1.00 0.00 H new ATOM 0 HE21 GLN A1019 -15.716 6.876 6.985 1.00 0.00 H new ATOM 0 HE22 GLN A1019 -16.037 5.406 7.911 1.00 0.00 H new ATOM 1611 N LEU A1020 -13.344 6.395 2.269 1.00 0.00 N ATOM 1612 CA LEU A1020 -12.624 5.566 1.310 1.00 0.00 C ATOM 1613 C LEU A1020 -11.818 6.429 0.353 1.00 0.00 C ATOM 1614 O LEU A1020 -10.681 6.104 0.019 1.00 0.00 O ATOM 1615 CB LEU A1020 -13.592 4.681 0.523 1.00 0.00 C ATOM 1616 CG LEU A1020 -13.951 3.361 1.199 1.00 0.00 C ATOM 1617 CD1 LEU A1020 -14.949 2.582 0.355 1.00 0.00 C ATOM 1618 CD2 LEU A1020 -12.695 2.540 1.426 1.00 0.00 C ATOM 0 H LEU A1020 -14.360 6.344 2.192 1.00 0.00 H new ATOM 0 HA LEU A1020 -11.940 4.926 1.868 1.00 0.00 H new ATOM 0 HB2 LEU A1020 -14.509 5.242 0.343 1.00 0.00 H new ATOM 0 HB3 LEU A1020 -13.154 4.466 -0.452 1.00 0.00 H new ATOM 0 HG LEU A1020 -14.413 3.574 2.163 1.00 0.00 H new ATOM 0 HD11 LEU A1020 -15.193 1.644 0.853 1.00 0.00 H new ATOM 0 HD12 LEU A1020 -15.857 3.172 0.228 1.00 0.00 H new ATOM 0 HD13 LEU A1020 -14.513 2.371 -0.622 1.00 0.00 H new ATOM 0 HD21 LEU A1020 -12.958 1.599 1.909 1.00 0.00 H new ATOM 0 HD22 LEU A1020 -12.216 2.335 0.468 1.00 0.00 H new ATOM 0 HD23 LEU A1020 -12.008 3.095 2.064 1.00 0.00 H new ATOM 1630 N SER A1021 -12.414 7.534 -0.069 1.00 0.00 N ATOM 1631 CA SER A1021 -11.770 8.461 -0.977 1.00 0.00 C ATOM 1632 C SER A1021 -10.457 8.983 -0.387 1.00 0.00 C ATOM 1633 O SER A1021 -9.438 9.054 -1.078 1.00 0.00 O ATOM 1634 CB SER A1021 -12.727 9.611 -1.265 1.00 0.00 C ATOM 1635 OG SER A1021 -13.973 9.126 -1.735 1.00 0.00 O ATOM 0 H SER A1021 -13.356 7.810 0.210 1.00 0.00 H new ATOM 0 HA SER A1021 -11.527 7.946 -1.907 1.00 0.00 H new ATOM 0 HB2 SER A1021 -12.879 10.198 -0.360 1.00 0.00 H new ATOM 0 HB3 SER A1021 -12.288 10.277 -2.007 1.00 0.00 H new ATOM 0 HG SER A1021 -14.484 8.755 -0.985 1.00 0.00 H new ATOM 1641 N GLN A1022 -10.489 9.331 0.894 1.00 0.00 N ATOM 1642 CA GLN A1022 -9.307 9.824 1.592 1.00 0.00 C ATOM 1643 C GLN A1022 -8.230 8.743 1.679 1.00 0.00 C ATOM 1644 O GLN A1022 -7.059 8.992 1.386 1.00 0.00 O ATOM 1645 CB GLN A1022 -9.684 10.296 2.998 1.00 0.00 C ATOM 1646 CG GLN A1022 -8.511 10.839 3.797 1.00 0.00 C ATOM 1647 CD GLN A1022 -8.912 11.281 5.189 1.00 0.00 C ATOM 1648 OE1 GLN A1022 -8.869 10.499 6.141 1.00 0.00 O ATOM 1649 NE2 GLN A1022 -9.311 12.535 5.317 1.00 0.00 N ATOM 0 H GLN A1022 -11.327 9.280 1.474 1.00 0.00 H new ATOM 0 HA GLN A1022 -8.906 10.664 1.025 1.00 0.00 H new ATOM 0 HB2 GLN A1022 -10.447 11.070 2.919 1.00 0.00 H new ATOM 0 HB3 GLN A1022 -10.129 9.464 3.543 1.00 0.00 H new ATOM 0 HG2 GLN A1022 -7.740 10.072 3.871 1.00 0.00 H new ATOM 0 HG3 GLN A1022 -8.072 11.682 3.264 1.00 0.00 H new ATOM 0 HE21 GLN A1022 -9.332 13.149 4.503 1.00 0.00 H new ATOM 0 HE22 GLN A1022 -9.598 12.888 6.230 1.00 0.00 H new ATOM 1658 N CYS A1023 -8.637 7.544 2.075 1.00 0.00 N ATOM 1659 CA CYS A1023 -7.706 6.439 2.252 1.00 0.00 C ATOM 1660 C CYS A1023 -7.073 6.035 0.922 1.00 0.00 C ATOM 1661 O CYS A1023 -5.860 5.841 0.840 1.00 0.00 O ATOM 1662 CB CYS A1023 -8.421 5.251 2.892 1.00 0.00 C ATOM 1663 SG CYS A1023 -9.182 5.634 4.487 1.00 0.00 S ATOM 0 H CYS A1023 -9.609 7.312 2.280 1.00 0.00 H new ATOM 0 HA CYS A1023 -6.905 6.766 2.915 1.00 0.00 H new ATOM 0 HB2 CYS A1023 -9.191 4.891 2.209 1.00 0.00 H new ATOM 0 HB3 CYS A1023 -7.708 4.438 3.026 1.00 0.00 H new ATOM 0 HG CYS A1023 -10.263 6.330 4.296 1.00 0.00 H new ATOM 1669 N ALA A1024 -7.895 5.938 -0.120 1.00 0.00 N ATOM 1670 CA ALA A1024 -7.409 5.580 -1.447 1.00 0.00 C ATOM 1671 C ALA A1024 -6.444 6.636 -1.979 1.00 0.00 C ATOM 1672 O ALA A1024 -5.543 6.331 -2.762 1.00 0.00 O ATOM 1673 CB ALA A1024 -8.573 5.393 -2.407 1.00 0.00 C ATOM 0 H ALA A1024 -8.900 6.103 -0.070 1.00 0.00 H new ATOM 0 HA ALA A1024 -6.869 4.637 -1.366 1.00 0.00 H new ATOM 0 HB1 ALA A1024 -8.192 5.126 -3.393 1.00 0.00 H new ATOM 0 HB2 ALA A1024 -9.222 4.597 -2.041 1.00 0.00 H new ATOM 0 HB3 ALA A1024 -9.140 6.321 -2.476 1.00 0.00 H new ATOM 1679 N LYS A1025 -6.632 7.878 -1.550 1.00 0.00 N ATOM 1680 CA LYS A1025 -5.744 8.961 -1.943 1.00 0.00 C ATOM 1681 C LYS A1025 -4.371 8.775 -1.307 1.00 0.00 C ATOM 1682 O LYS A1025 -3.340 8.865 -1.982 1.00 0.00 O ATOM 1683 CB LYS A1025 -6.328 10.313 -1.531 1.00 0.00 C ATOM 1684 CG LYS A1025 -5.461 11.495 -1.935 1.00 0.00 C ATOM 1685 CD LYS A1025 -5.969 12.800 -1.344 1.00 0.00 C ATOM 1686 CE LYS A1025 -5.894 12.790 0.176 1.00 0.00 C ATOM 1687 NZ LYS A1025 -6.251 14.110 0.756 1.00 0.00 N ATOM 0 H LYS A1025 -7.392 8.159 -0.930 1.00 0.00 H new ATOM 0 HA LYS A1025 -5.640 8.941 -3.028 1.00 0.00 H new ATOM 0 HB2 LYS A1025 -7.315 10.426 -1.980 1.00 0.00 H new ATOM 0 HB3 LYS A1025 -6.466 10.326 -0.450 1.00 0.00 H new ATOM 0 HG2 LYS A1025 -4.436 11.322 -1.606 1.00 0.00 H new ATOM 0 HG3 LYS A1025 -5.438 11.574 -3.022 1.00 0.00 H new ATOM 0 HD2 LYS A1025 -5.380 13.631 -1.733 1.00 0.00 H new ATOM 0 HD3 LYS A1025 -7.000 12.966 -1.657 1.00 0.00 H new ATOM 0 HE2 LYS A1025 -6.567 12.027 0.568 1.00 0.00 H new ATOM 0 HE3 LYS A1025 -4.886 12.517 0.488 1.00 0.00 H new ATOM 0 HZ1 LYS A1025 -6.188 14.062 1.793 1.00 0.00 H new ATOM 0 HZ2 LYS A1025 -5.593 14.834 0.402 1.00 0.00 H new ATOM 0 HZ3 LYS A1025 -7.222 14.360 0.479 1.00 0.00 H new ATOM 1701 N ASN A1026 -4.367 8.499 -0.007 1.00 0.00 N ATOM 1702 CA ASN A1026 -3.123 8.311 0.733 1.00 0.00 C ATOM 1703 C ASN A1026 -2.412 7.045 0.281 1.00 0.00 C ATOM 1704 O ASN A1026 -1.201 7.049 0.076 1.00 0.00 O ATOM 1705 CB ASN A1026 -3.380 8.252 2.241 1.00 0.00 C ATOM 1706 CG ASN A1026 -3.833 9.581 2.810 1.00 0.00 C ATOM 1707 OD1 ASN A1026 -3.507 10.643 2.281 1.00 0.00 O ATOM 1708 ND2 ASN A1026 -4.570 9.535 3.908 1.00 0.00 N ATOM 0 H ASN A1026 -5.211 8.400 0.557 1.00 0.00 H new ATOM 0 HA ASN A1026 -2.484 9.169 0.524 1.00 0.00 H new ATOM 0 HB2 ASN A1026 -4.138 7.496 2.447 1.00 0.00 H new ATOM 0 HB3 ASN A1026 -2.469 7.936 2.749 1.00 0.00 H new ATOM 0 HD21 ASN A1026 -4.888 10.400 4.345 1.00 0.00 H new ATOM 0 HD22 ASN A1026 -4.820 8.635 4.317 1.00 0.00 H new ATOM 1715 N LEU A1027 -3.171 5.965 0.119 1.00 0.00 N ATOM 1716 CA LEU A1027 -2.616 4.698 -0.337 1.00 0.00 C ATOM 1717 C LEU A1027 -2.077 4.834 -1.756 1.00 0.00 C ATOM 1718 O LEU A1027 -0.990 4.348 -2.066 1.00 0.00 O ATOM 1719 CB LEU A1027 -3.680 3.596 -0.273 1.00 0.00 C ATOM 1720 CG LEU A1027 -3.219 2.208 -0.728 1.00 0.00 C ATOM 1721 CD1 LEU A1027 -2.055 1.721 0.123 1.00 0.00 C ATOM 1722 CD2 LEU A1027 -4.374 1.219 -0.666 1.00 0.00 C ATOM 0 H LEU A1027 -4.175 5.944 0.298 1.00 0.00 H new ATOM 0 HA LEU A1027 -1.792 4.423 0.321 1.00 0.00 H new ATOM 0 HB2 LEU A1027 -4.040 3.522 0.753 1.00 0.00 H new ATOM 0 HB3 LEU A1027 -4.528 3.898 -0.888 1.00 0.00 H new ATOM 0 HG LEU A1027 -2.879 2.281 -1.761 1.00 0.00 H new ATOM 0 HD11 LEU A1027 -1.744 0.733 -0.217 1.00 0.00 H new ATOM 0 HD12 LEU A1027 -1.221 2.416 0.031 1.00 0.00 H new ATOM 0 HD13 LEU A1027 -2.366 1.664 1.166 1.00 0.00 H new ATOM 0 HD21 LEU A1027 -4.030 0.237 -0.992 1.00 0.00 H new ATOM 0 HD22 LEU A1027 -4.742 1.153 0.358 1.00 0.00 H new ATOM 0 HD23 LEU A1027 -5.178 1.557 -1.319 1.00 0.00 H new ATOM 1734 N GLY A1028 -2.834 5.519 -2.607 1.00 0.00 N ATOM 1735 CA GLY A1028 -2.409 5.736 -3.975 1.00 0.00 C ATOM 1736 C GLY A1028 -1.110 6.514 -4.059 1.00 0.00 C ATOM 1737 O GLY A1028 -0.243 6.203 -4.872 1.00 0.00 O ATOM 0 H GLY A1028 -3.738 5.929 -2.371 1.00 0.00 H new ATOM 0 HA2 GLY A1028 -2.286 4.774 -4.472 1.00 0.00 H new ATOM 0 HA3 GLY A1028 -3.188 6.275 -4.514 1.00 0.00 H new ATOM 1741 N THR A1029 -0.971 7.525 -3.209 1.00 0.00 N ATOM 1742 CA THR A1029 0.240 8.333 -3.177 1.00 0.00 C ATOM 1743 C THR A1029 1.379 7.564 -2.503 1.00 0.00 C ATOM 1744 O THR A1029 2.551 7.733 -2.848 1.00 0.00 O ATOM 1745 CB THR A1029 -0.005 9.664 -2.442 1.00 0.00 C ATOM 1746 OG1 THR A1029 -1.196 10.284 -2.953 1.00 0.00 O ATOM 1747 CG2 THR A1029 1.174 10.611 -2.616 1.00 0.00 C ATOM 0 H THR A1029 -1.682 7.804 -2.533 1.00 0.00 H new ATOM 0 HA THR A1029 0.523 8.555 -4.206 1.00 0.00 H new ATOM 0 HB THR A1029 -0.122 9.451 -1.379 1.00 0.00 H new ATOM 0 HG1 THR A1029 -1.982 9.883 -2.527 1.00 0.00 H new ATOM 0 HG21 THR A1029 0.974 11.543 -2.087 1.00 0.00 H new ATOM 0 HG22 THR A1029 2.074 10.150 -2.210 1.00 0.00 H new ATOM 0 HG23 THR A1029 1.320 10.820 -3.676 1.00 0.00 H new ATOM 1755 N ALA A1030 1.019 6.712 -1.549 1.00 0.00 N ATOM 1756 CA ALA A1030 1.984 5.840 -0.896 1.00 0.00 C ATOM 1757 C ALA A1030 2.585 4.873 -1.909 1.00 0.00 C ATOM 1758 O ALA A1030 3.804 4.698 -1.975 1.00 0.00 O ATOM 1759 CB ALA A1030 1.316 5.082 0.241 1.00 0.00 C ATOM 0 H ALA A1030 0.062 6.608 -1.211 1.00 0.00 H new ATOM 0 HA ALA A1030 2.789 6.447 -0.480 1.00 0.00 H new ATOM 0 HB1 ALA A1030 2.046 4.432 0.723 1.00 0.00 H new ATOM 0 HB2 ALA A1030 0.924 5.791 0.970 1.00 0.00 H new ATOM 0 HB3 ALA A1030 0.499 4.479 -0.155 1.00 0.00 H new ATOM 1765 N LEU A1031 1.718 4.261 -2.709 1.00 0.00 N ATOM 1766 CA LEU A1031 2.148 3.372 -3.781 1.00 0.00 C ATOM 1767 C LEU A1031 2.923 4.151 -4.836 1.00 0.00 C ATOM 1768 O LEU A1031 3.866 3.635 -5.431 1.00 0.00 O ATOM 1769 CB LEU A1031 0.944 2.682 -4.425 1.00 0.00 C ATOM 1770 CG LEU A1031 0.124 1.789 -3.493 1.00 0.00 C ATOM 1771 CD1 LEU A1031 -1.080 1.223 -4.227 1.00 0.00 C ATOM 1772 CD2 LEU A1031 0.984 0.667 -2.935 1.00 0.00 C ATOM 0 H LEU A1031 0.706 4.366 -2.634 1.00 0.00 H new ATOM 0 HA LEU A1031 2.799 2.611 -3.352 1.00 0.00 H new ATOM 0 HB2 LEU A1031 0.287 3.447 -4.839 1.00 0.00 H new ATOM 0 HB3 LEU A1031 1.297 2.078 -5.261 1.00 0.00 H new ATOM 0 HG LEU A1031 -0.232 2.394 -2.659 1.00 0.00 H new ATOM 0 HD11 LEU A1031 -1.654 0.590 -3.551 1.00 0.00 H new ATOM 0 HD12 LEU A1031 -1.709 2.041 -4.579 1.00 0.00 H new ATOM 0 HD13 LEU A1031 -0.742 0.632 -5.078 1.00 0.00 H new ATOM 0 HD21 LEU A1031 0.383 0.042 -2.274 1.00 0.00 H new ATOM 0 HD22 LEU A1031 1.369 0.062 -3.755 1.00 0.00 H new ATOM 0 HD23 LEU A1031 1.817 1.091 -2.375 1.00 0.00 H new ATOM 1784 N ALA A1032 2.514 5.396 -5.057 1.00 0.00 N ATOM 1785 CA ALA A1032 3.187 6.279 -6.002 1.00 0.00 C ATOM 1786 C ALA A1032 4.662 6.434 -5.641 1.00 0.00 C ATOM 1787 O ALA A1032 5.535 6.316 -6.503 1.00 0.00 O ATOM 1788 CB ALA A1032 2.495 7.633 -6.040 1.00 0.00 C ATOM 0 H ALA A1032 1.712 5.819 -4.589 1.00 0.00 H new ATOM 0 HA ALA A1032 3.130 5.833 -6.995 1.00 0.00 H new ATOM 0 HB1 ALA A1032 3.007 8.283 -6.749 1.00 0.00 H new ATOM 0 HB2 ALA A1032 1.458 7.503 -6.350 1.00 0.00 H new ATOM 0 HB3 ALA A1032 2.524 8.084 -5.048 1.00 0.00 H new ATOM 1794 N GLU A1033 4.935 6.692 -4.366 1.00 0.00 N ATOM 1795 CA GLU A1033 6.308 6.770 -3.879 1.00 0.00 C ATOM 1796 C GLU A1033 7.003 5.428 -4.032 1.00 0.00 C ATOM 1797 O GLU A1033 8.058 5.329 -4.655 1.00 0.00 O ATOM 1798 CB GLU A1033 6.344 7.175 -2.405 1.00 0.00 C ATOM 1799 CG GLU A1033 6.039 8.634 -2.151 1.00 0.00 C ATOM 1800 CD GLU A1033 7.046 9.557 -2.803 1.00 0.00 C ATOM 1801 OE1 GLU A1033 8.146 9.742 -2.239 1.00 0.00 O ATOM 1802 OE2 GLU A1033 6.745 10.102 -3.884 1.00 0.00 O ATOM 0 H GLU A1033 4.224 6.851 -3.652 1.00 0.00 H new ATOM 0 HA GLU A1033 6.824 7.524 -4.473 1.00 0.00 H new ATOM 0 HB2 GLU A1033 5.627 6.565 -1.856 1.00 0.00 H new ATOM 0 HB3 GLU A1033 7.331 6.947 -2.002 1.00 0.00 H new ATOM 0 HG2 GLU A1033 5.042 8.865 -2.527 1.00 0.00 H new ATOM 0 HG3 GLU A1033 6.025 8.818 -1.077 1.00 0.00 H new ATOM 1809 N LEU A1034 6.378 4.402 -3.468 1.00 0.00 N ATOM 1810 CA LEU A1034 6.954 3.065 -3.404 1.00 0.00 C ATOM 1811 C LEU A1034 7.335 2.551 -4.790 1.00 0.00 C ATOM 1812 O LEU A1034 8.445 2.063 -4.998 1.00 0.00 O ATOM 1813 CB LEU A1034 5.949 2.117 -2.746 1.00 0.00 C ATOM 1814 CG LEU A1034 6.509 0.761 -2.332 1.00 0.00 C ATOM 1815 CD1 LEU A1034 7.588 0.935 -1.274 1.00 0.00 C ATOM 1816 CD2 LEU A1034 5.393 -0.137 -1.820 1.00 0.00 C ATOM 0 H LEU A1034 5.455 4.474 -3.041 1.00 0.00 H new ATOM 0 HA LEU A1034 7.867 3.109 -2.810 1.00 0.00 H new ATOM 0 HB2 LEU A1034 5.537 2.606 -1.864 1.00 0.00 H new ATOM 0 HB3 LEU A1034 5.121 1.955 -3.437 1.00 0.00 H new ATOM 0 HG LEU A1034 6.958 0.287 -3.204 1.00 0.00 H new ATOM 0 HD11 LEU A1034 7.978 -0.042 -0.988 1.00 0.00 H new ATOM 0 HD12 LEU A1034 8.397 1.546 -1.676 1.00 0.00 H new ATOM 0 HD13 LEU A1034 7.163 1.426 -0.399 1.00 0.00 H new ATOM 0 HD21 LEU A1034 5.807 -1.102 -1.528 1.00 0.00 H new ATOM 0 HD22 LEU A1034 4.917 0.330 -0.957 1.00 0.00 H new ATOM 0 HD23 LEU A1034 4.653 -0.283 -2.607 1.00 0.00 H new ATOM 1828 N ARG A1035 6.417 2.688 -5.735 1.00 0.00 N ATOM 1829 CA ARG A1035 6.631 2.208 -7.094 1.00 0.00 C ATOM 1830 C ARG A1035 7.784 2.953 -7.764 1.00 0.00 C ATOM 1831 O ARG A1035 8.632 2.343 -8.417 1.00 0.00 O ATOM 1832 CB ARG A1035 5.348 2.376 -7.912 1.00 0.00 C ATOM 1833 CG ARG A1035 5.423 1.780 -9.304 1.00 0.00 C ATOM 1834 CD ARG A1035 4.115 1.952 -10.049 1.00 0.00 C ATOM 1835 NE ARG A1035 4.157 1.347 -11.376 1.00 0.00 N ATOM 1836 CZ ARG A1035 3.328 1.668 -12.366 1.00 0.00 C ATOM 1837 NH1 ARG A1035 2.380 2.577 -12.180 1.00 0.00 N ATOM 1838 NH2 ARG A1035 3.443 1.069 -13.542 1.00 0.00 N ATOM 0 H ARG A1035 5.510 3.131 -5.585 1.00 0.00 H new ATOM 0 HA ARG A1035 6.893 1.151 -7.048 1.00 0.00 H new ATOM 0 HB2 ARG A1035 4.522 1.912 -7.373 1.00 0.00 H new ATOM 0 HB3 ARG A1035 5.118 3.438 -7.994 1.00 0.00 H new ATOM 0 HG2 ARG A1035 6.228 2.257 -9.863 1.00 0.00 H new ATOM 0 HG3 ARG A1035 5.668 0.720 -9.235 1.00 0.00 H new ATOM 0 HD2 ARG A1035 3.307 1.503 -9.471 1.00 0.00 H new ATOM 0 HD3 ARG A1035 3.888 3.014 -10.142 1.00 0.00 H new ATOM 0 HE ARG A1035 4.865 0.635 -11.556 1.00 0.00 H new ATOM 0 HH11 ARG A1035 2.283 3.035 -11.274 1.00 0.00 H new ATOM 0 HH12 ARG A1035 1.748 2.818 -12.943 1.00 0.00 H new ATOM 0 HH21 ARG A1035 4.166 0.364 -13.687 1.00 0.00 H new ATOM 0 HH22 ARG A1035 2.809 1.313 -14.303 1.00 0.00 H new ATOM 1852 N THR A1036 7.817 4.266 -7.583 1.00 0.00 N ATOM 1853 CA THR A1036 8.843 5.098 -8.194 1.00 0.00 C ATOM 1854 C THR A1036 10.206 4.839 -7.551 1.00 0.00 C ATOM 1855 O THR A1036 11.224 4.745 -8.239 1.00 0.00 O ATOM 1856 CB THR A1036 8.483 6.592 -8.069 1.00 0.00 C ATOM 1857 OG1 THR A1036 7.151 6.811 -8.557 1.00 0.00 O ATOM 1858 CG2 THR A1036 9.456 7.462 -8.851 1.00 0.00 C ATOM 0 H THR A1036 7.142 4.779 -7.016 1.00 0.00 H new ATOM 0 HA THR A1036 8.897 4.837 -9.251 1.00 0.00 H new ATOM 0 HB THR A1036 8.545 6.867 -7.016 1.00 0.00 H new ATOM 0 HG1 THR A1036 6.507 6.641 -7.838 1.00 0.00 H new ATOM 0 HG21 THR A1036 9.175 8.510 -8.743 1.00 0.00 H new ATOM 0 HG22 THR A1036 10.465 7.315 -8.466 1.00 0.00 H new ATOM 0 HG23 THR A1036 9.426 7.185 -9.905 1.00 0.00 H new ATOM 1866 N ALA A1037 10.210 4.698 -6.232 1.00 0.00 N ATOM 1867 CA ALA A1037 11.434 4.452 -5.486 1.00 0.00 C ATOM 1868 C ALA A1037 12.034 3.097 -5.853 1.00 0.00 C ATOM 1869 O ALA A1037 13.238 2.983 -6.084 1.00 0.00 O ATOM 1870 CB ALA A1037 11.158 4.537 -3.991 1.00 0.00 C ATOM 0 H ALA A1037 9.371 4.751 -5.654 1.00 0.00 H new ATOM 0 HA ALA A1037 12.163 5.218 -5.750 1.00 0.00 H new ATOM 0 HB1 ALA A1037 12.080 4.352 -3.440 1.00 0.00 H new ATOM 0 HB2 ALA A1037 10.782 5.531 -3.746 1.00 0.00 H new ATOM 0 HB3 ALA A1037 10.414 3.790 -3.715 1.00 0.00 H new ATOM 1876 N ALA A1038 11.182 2.079 -5.923 1.00 0.00 N ATOM 1877 CA ALA A1038 11.628 0.730 -6.257 1.00 0.00 C ATOM 1878 C ALA A1038 12.135 0.658 -7.691 1.00 0.00 C ATOM 1879 O ALA A1038 13.042 -0.111 -7.997 1.00 0.00 O ATOM 1880 CB ALA A1038 10.505 -0.272 -6.041 1.00 0.00 C ATOM 0 H ALA A1038 10.180 2.162 -5.753 1.00 0.00 H new ATOM 0 HA ALA A1038 12.455 0.477 -5.593 1.00 0.00 H new ATOM 0 HB1 ALA A1038 10.856 -1.272 -6.295 1.00 0.00 H new ATOM 0 HB2 ALA A1038 10.194 -0.251 -4.996 1.00 0.00 H new ATOM 0 HB3 ALA A1038 9.658 -0.012 -6.676 1.00 0.00 H new ATOM 1886 N GLN A1039 11.550 1.470 -8.564 1.00 0.00 N ATOM 1887 CA GLN A1039 11.963 1.518 -9.962 1.00 0.00 C ATOM 1888 C GLN A1039 13.409 1.990 -10.064 1.00 0.00 C ATOM 1889 O GLN A1039 14.219 1.400 -10.779 1.00 0.00 O ATOM 1890 CB GLN A1039 11.030 2.445 -10.752 1.00 0.00 C ATOM 1891 CG GLN A1039 11.282 2.476 -12.255 1.00 0.00 C ATOM 1892 CD GLN A1039 12.138 3.648 -12.695 1.00 0.00 C ATOM 1893 OE1 GLN A1039 11.626 4.732 -12.973 1.00 0.00 O ATOM 1894 NE2 GLN A1039 13.441 3.438 -12.786 1.00 0.00 N ATOM 0 H GLN A1039 10.787 2.105 -8.328 1.00 0.00 H new ATOM 0 HA GLN A1039 11.898 0.518 -10.390 1.00 0.00 H new ATOM 0 HB2 GLN A1039 10.000 2.135 -10.577 1.00 0.00 H new ATOM 0 HB3 GLN A1039 11.130 3.457 -10.360 1.00 0.00 H new ATOM 0 HG2 GLN A1039 11.768 1.547 -12.554 1.00 0.00 H new ATOM 0 HG3 GLN A1039 10.326 2.518 -12.776 1.00 0.00 H new ATOM 0 HE21 GLN A1039 13.828 2.525 -12.547 1.00 0.00 H new ATOM 0 HE22 GLN A1039 14.058 4.189 -13.095 1.00 0.00 H new ATOM 1903 N LYS A1040 13.729 3.049 -9.331 1.00 0.00 N ATOM 1904 CA LYS A1040 15.073 3.609 -9.341 1.00 0.00 C ATOM 1905 C LYS A1040 16.071 2.645 -8.705 1.00 0.00 C ATOM 1906 O LYS A1040 17.152 2.409 -9.246 1.00 0.00 O ATOM 1907 CB LYS A1040 15.095 4.943 -8.593 1.00 0.00 C ATOM 1908 CG LYS A1040 14.231 6.019 -9.229 1.00 0.00 C ATOM 1909 CD LYS A1040 14.250 7.297 -8.407 1.00 0.00 C ATOM 1910 CE LYS A1040 13.398 8.387 -9.036 1.00 0.00 C ATOM 1911 NZ LYS A1040 13.949 8.852 -10.337 1.00 0.00 N ATOM 0 H LYS A1040 13.074 3.538 -8.721 1.00 0.00 H new ATOM 0 HA LYS A1040 15.363 3.773 -10.379 1.00 0.00 H new ATOM 0 HB2 LYS A1040 14.760 4.780 -7.569 1.00 0.00 H new ATOM 0 HB3 LYS A1040 16.123 5.301 -8.539 1.00 0.00 H new ATOM 0 HG2 LYS A1040 14.588 6.227 -10.238 1.00 0.00 H new ATOM 0 HG3 LYS A1040 13.207 5.659 -9.322 1.00 0.00 H new ATOM 0 HD2 LYS A1040 13.887 7.087 -7.401 1.00 0.00 H new ATOM 0 HD3 LYS A1040 15.276 7.650 -8.308 1.00 0.00 H new ATOM 0 HE2 LYS A1040 12.385 8.013 -9.185 1.00 0.00 H new ATOM 0 HE3 LYS A1040 13.328 9.232 -8.351 1.00 0.00 H new ATOM 0 HZ1 LYS A1040 13.427 9.694 -10.654 1.00 0.00 H new ATOM 0 HZ2 LYS A1040 14.955 9.091 -10.223 1.00 0.00 H new ATOM 0 HZ3 LYS A1040 13.851 8.097 -11.045 1.00 0.00 H new ATOM 1925 N ALA A1041 15.689 2.078 -7.566 1.00 0.00 N ATOM 1926 CA ALA A1041 16.577 1.209 -6.800 1.00 0.00 C ATOM 1927 C ALA A1041 16.820 -0.125 -7.504 1.00 0.00 C ATOM 1928 O ALA A1041 17.889 -0.719 -7.359 1.00 0.00 O ATOM 1929 CB ALA A1041 16.008 0.975 -5.410 1.00 0.00 C ATOM 0 H ALA A1041 14.766 2.205 -7.151 1.00 0.00 H new ATOM 0 HA ALA A1041 17.540 1.714 -6.717 1.00 0.00 H new ATOM 0 HB1 ALA A1041 16.678 0.325 -4.847 1.00 0.00 H new ATOM 0 HB2 ALA A1041 15.908 1.929 -4.892 1.00 0.00 H new ATOM 0 HB3 ALA A1041 15.029 0.502 -5.492 1.00 0.00 H new ATOM 1935 N GLN A1042 15.833 -0.583 -8.270 1.00 0.00 N ATOM 1936 CA GLN A1042 15.928 -1.864 -8.970 1.00 0.00 C ATOM 1937 C GLN A1042 17.095 -1.866 -9.953 1.00 0.00 C ATOM 1938 O GLN A1042 17.809 -2.857 -10.089 1.00 0.00 O ATOM 1939 CB GLN A1042 14.629 -2.156 -9.727 1.00 0.00 C ATOM 1940 CG GLN A1042 14.567 -3.554 -10.325 1.00 0.00 C ATOM 1941 CD GLN A1042 13.385 -3.755 -11.258 1.00 0.00 C ATOM 1942 OE1 GLN A1042 13.444 -4.565 -12.185 1.00 0.00 O ATOM 1943 NE2 GLN A1042 12.308 -3.017 -11.033 1.00 0.00 N ATOM 0 H GLN A1042 14.956 -0.086 -8.423 1.00 0.00 H new ATOM 0 HA GLN A1042 16.096 -2.639 -8.222 1.00 0.00 H new ATOM 0 HB2 GLN A1042 13.786 -2.024 -9.048 1.00 0.00 H new ATOM 0 HB3 GLN A1042 14.513 -1.424 -10.526 1.00 0.00 H new ATOM 0 HG2 GLN A1042 15.490 -3.750 -10.871 1.00 0.00 H new ATOM 0 HG3 GLN A1042 14.513 -4.285 -9.518 1.00 0.00 H new ATOM 0 HE21 GLN A1042 12.296 -2.357 -10.256 1.00 0.00 H new ATOM 0 HE22 GLN A1042 11.491 -3.109 -11.637 1.00 0.00 H new ATOM 1952 N GLU A1043 17.283 -0.744 -10.627 1.00 0.00 N ATOM 1953 CA GLU A1043 18.295 -0.636 -11.666 1.00 0.00 C ATOM 1954 C GLU A1043 19.483 0.200 -11.198 1.00 0.00 C ATOM 1955 O GLU A1043 20.291 0.659 -12.008 1.00 0.00 O ATOM 1956 CB GLU A1043 17.671 -0.015 -12.914 1.00 0.00 C ATOM 1957 CG GLU A1043 16.939 1.286 -12.632 1.00 0.00 C ATOM 1958 CD GLU A1043 16.235 1.835 -13.848 1.00 0.00 C ATOM 1959 OE1 GLU A1043 15.100 1.398 -14.133 1.00 0.00 O ATOM 1960 OE2 GLU A1043 16.810 2.715 -14.520 1.00 0.00 O ATOM 0 H GLU A1043 16.746 0.109 -10.473 1.00 0.00 H new ATOM 0 HA GLU A1043 18.665 -1.635 -11.897 1.00 0.00 H new ATOM 0 HB2 GLU A1043 18.453 0.168 -13.651 1.00 0.00 H new ATOM 0 HB3 GLU A1043 16.975 -0.727 -13.358 1.00 0.00 H new ATOM 0 HG2 GLU A1043 16.210 1.123 -11.838 1.00 0.00 H new ATOM 0 HG3 GLU A1043 17.650 2.026 -12.264 1.00 0.00 H new ATOM 1967 N ALA A1044 19.591 0.383 -9.889 1.00 0.00 N ATOM 1968 CA ALA A1044 20.666 1.178 -9.315 1.00 0.00 C ATOM 1969 C ALA A1044 21.887 0.313 -9.031 1.00 0.00 C ATOM 1970 O ALA A1044 22.873 0.412 -9.791 1.00 0.00 O ATOM 1971 CB ALA A1044 20.197 1.873 -8.046 1.00 0.00 C ATOM 1972 OXT ALA A1044 21.853 -0.473 -8.059 1.00 0.00 O ATOM 0 H ALA A1044 18.945 -0.010 -9.204 1.00 0.00 H new ATOM 0 HA ALA A1044 20.950 1.940 -10.041 1.00 0.00 H new ATOM 0 HB1 ALA A1044 21.014 2.463 -7.631 1.00 0.00 H new ATOM 0 HB2 ALA A1044 19.358 2.529 -8.279 1.00 0.00 H new ATOM 0 HB3 ALA A1044 19.882 1.126 -7.317 1.00 0.00 H new TER 1978 ALA A1044