USER MOD reduce.3.24.130724 H: found=0, std=0, add=1002, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1003 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A1025 LYS NZ :NH3+ 144:sc= 0.753 (180deg=-0.0917) USER MOD Set 1.2: A1026 ASN : amide:sc= 0.66 K(o=1.4,f=-6.3) USER MOD Set 2.1: A 995 GLN : amide:sc= 0.339 K(o=-0.39,f=-2.5) USER MOD Set 2.2: A 999 LYS NZ :NH3+ 139:sc= -0.725 (180deg=-0.468) USER MOD Set 3.1: A 973 SER OG : rot -89:sc= 1.86 USER MOD Set 3.2: A 983 GLN : amide:sc= -0.478 K(o=1.4,f=-0.31!) USER MOD Single : A 912 THR OG1 : rot 62:sc= -0.163 USER MOD Single : A 915 GLN :FLIP amide:sc= -0.129 F(o=-0.96,f=-0.13) USER MOD Single : A 919 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 922 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 923 GLN : amide:sc= -0.43 X(o=-0.43,f=-0.92) USER MOD Single : A 927 SER OG : rot -81:sc= 1.23 USER MOD Single : A 929 THR OG1 : rot 71:sc= 1.01 USER MOD Single : A 930 GLN : amide:sc= -0.538 X(o=-0.54,f=-0.56) USER MOD Single : A 931 THR OG1 : rot 68:sc= 0.914 USER MOD Single : A 936 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 937 HIS : no HD1:sc= 0 X(o=0,f=-0.0026) USER MOD Single : A 940 SER OG : rot 180:sc= 0 USER MOD Single : A 943 LYS NZ :NH3+ -135:sc= -0.723 (180deg=-3.14!) USER MOD Single : A 945 SER OG : rot 180:sc= 0 USER MOD Single : A 949 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 954 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 955 SER OG : rot 80:sc= 1.2 USER MOD Single : A 956 CYS SG : rot -17:sc= -2.77! USER MOD Single : A 957 LYS NZ :NH3+ -107:sc= -0.938 (180deg=-3.2!) USER MOD Single : A 962 GLN :FLIP amide:sc= -0.0649 F(o=-1.3,f=-0.065) USER MOD Single : A 968 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 974 GLN : amide:sc= -0.981 X(o=-0.98,f=-1) USER MOD Single : A 976 GLN : amide:sc=-0.00371 K(o=-0.0037,f=-1.1) USER MOD Single : A 979 SER OG : rot 180:sc= 0 USER MOD Single : A 981 SER OG : rot 180:sc= 0 USER MOD Single : A 990 SER OG : rot 80:sc= 1.2 USER MOD Single : A 991 GLN : amide:sc=-4.42e-05 K(o=-4.4e-05,f=-0.75) USER MOD Single : A 992 SER OG : rot -26:sc= 0.0427 USER MOD Single : A1000 MET CE :methyl 169:sc= -1.41 (180deg=-1.53) USER MOD Single : A1005 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1007 SER OG : rot 78:sc= 0.459 USER MOD Single : A1010 THR OG1 : rot 8:sc= 0.0184 USER MOD Single : A1012 GLN :FLIP amide:sc= -0.466 F(o=-1.8!,f=-0.47) USER MOD Single : A1014 GLN :FLIP amide:sc= -0.824! C(o=-2.7!,f=-0.82!) USER MOD Single : A1016 SER OG : rot 180:sc= -0.0559 USER MOD Single : A1018 MET CE :methyl -166:sc= 0 (180deg=-0.0123) USER MOD Single : A1019 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A1021 SER OG : rot 180:sc= 0 USER MOD Single : A1022 GLN :FLIP amide:sc=-0.00447 F(o=-1.1,f=-0.0045) USER MOD Single : A1023 CYS SG : rot 78:sc= 0.864 USER MOD Single : A1029 THR OG1 : rot 180:sc= 0 USER MOD Single : A1036 THR OG1 : rot 87:sc= 0.756 USER MOD Single : A1039 GLN : amide:sc= 0.152 X(o=0.15,f=-0.08) USER MOD Single : A1040 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1042 GLN : amide:sc= -0.498 K(o=-0.5,f=-1.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 907 20.819 17.309 8.526 1.00 0.00 N ATOM 2 CA GLY A 907 20.231 15.961 8.348 1.00 0.00 C ATOM 3 C GLY A 907 19.168 15.951 7.275 1.00 0.00 C ATOM 4 O GLY A 907 18.933 16.972 6.625 1.00 0.00 O ATOM 0 HA2 GLY A 907 21.017 15.253 8.087 1.00 0.00 H new ATOM 0 HA3 GLY A 907 19.799 15.625 9.291 1.00 0.00 H new ATOM 10 N ILE A 908 18.528 14.801 7.093 1.00 0.00 N ATOM 11 CA ILE A 908 17.510 14.622 6.064 1.00 0.00 C ATOM 12 C ILE A 908 18.119 14.793 4.671 1.00 0.00 C ATOM 13 O ILE A 908 18.020 15.855 4.049 1.00 0.00 O ATOM 14 CB ILE A 908 16.309 15.587 6.246 1.00 0.00 C ATOM 15 CG1 ILE A 908 15.703 15.432 7.647 1.00 0.00 C ATOM 16 CG2 ILE A 908 15.244 15.333 5.186 1.00 0.00 C ATOM 17 CD1 ILE A 908 15.179 14.039 7.940 1.00 0.00 C ATOM 0 H ILE A 908 18.700 13.967 7.654 1.00 0.00 H new ATOM 0 HA ILE A 908 17.128 13.606 6.168 1.00 0.00 H new ATOM 0 HB ILE A 908 16.676 16.607 6.131 1.00 0.00 H new ATOM 0 HG12 ILE A 908 16.459 15.689 8.389 1.00 0.00 H new ATOM 0 HG13 ILE A 908 14.888 16.147 7.761 1.00 0.00 H new ATOM 0 HG21 ILE A 908 14.412 16.021 5.334 1.00 0.00 H new ATOM 0 HG22 ILE A 908 15.672 15.489 4.196 1.00 0.00 H new ATOM 0 HG23 ILE A 908 14.885 14.307 5.269 1.00 0.00 H new ATOM 0 HD11 ILE A 908 14.767 14.010 8.949 1.00 0.00 H new ATOM 0 HD12 ILE A 908 14.399 13.785 7.222 1.00 0.00 H new ATOM 0 HD13 ILE A 908 15.994 13.319 7.860 1.00 0.00 H new ATOM 29 N ASP A 909 18.790 13.752 4.210 1.00 0.00 N ATOM 30 CA ASP A 909 19.377 13.736 2.878 1.00 0.00 C ATOM 31 C ASP A 909 19.277 12.335 2.298 1.00 0.00 C ATOM 32 O ASP A 909 19.356 11.347 3.029 1.00 0.00 O ATOM 33 CB ASP A 909 20.846 14.191 2.903 1.00 0.00 C ATOM 34 CG ASP A 909 21.791 13.168 3.513 1.00 0.00 C ATOM 35 OD1 ASP A 909 21.819 13.043 4.760 1.00 0.00 O ATOM 36 OD2 ASP A 909 22.483 12.460 2.747 1.00 0.00 O ATOM 0 H ASP A 909 18.944 12.897 4.744 1.00 0.00 H new ATOM 0 HA ASP A 909 18.824 14.436 2.252 1.00 0.00 H new ATOM 0 HB2 ASP A 909 21.168 14.408 1.884 1.00 0.00 H new ATOM 0 HB3 ASP A 909 20.920 15.122 3.466 1.00 0.00 H new ATOM 41 N PRO A 910 19.067 12.225 0.982 1.00 0.00 N ATOM 42 CA PRO A 910 18.970 10.933 0.322 1.00 0.00 C ATOM 43 C PRO A 910 20.328 10.249 0.214 1.00 0.00 C ATOM 44 O PRO A 910 21.072 10.465 -0.745 1.00 0.00 O ATOM 45 CB PRO A 910 18.409 11.273 -1.061 1.00 0.00 C ATOM 46 CG PRO A 910 18.814 12.687 -1.307 1.00 0.00 C ATOM 47 CD PRO A 910 18.916 13.349 0.043 1.00 0.00 C ATOM 0 HA PRO A 910 18.344 10.232 0.873 1.00 0.00 H new ATOM 0 HB2 PRO A 910 18.813 10.609 -1.825 1.00 0.00 H new ATOM 0 HB3 PRO A 910 17.325 11.164 -1.085 1.00 0.00 H new ATOM 0 HG2 PRO A 910 19.768 12.731 -1.833 1.00 0.00 H new ATOM 0 HG3 PRO A 910 18.081 13.196 -1.933 1.00 0.00 H new ATOM 0 HD2 PRO A 910 19.768 14.027 0.092 1.00 0.00 H new ATOM 0 HD3 PRO A 910 18.027 13.939 0.266 1.00 0.00 H new ATOM 55 N PHE A 911 20.669 9.475 1.239 1.00 0.00 N ATOM 56 CA PHE A 911 21.895 8.680 1.235 1.00 0.00 C ATOM 57 C PHE A 911 21.944 7.809 -0.009 1.00 0.00 C ATOM 58 O PHE A 911 22.982 7.678 -0.659 1.00 0.00 O ATOM 59 CB PHE A 911 21.971 7.784 2.474 1.00 0.00 C ATOM 60 CG PHE A 911 21.957 8.523 3.780 1.00 0.00 C ATOM 61 CD1 PHE A 911 23.114 9.097 4.276 1.00 0.00 C ATOM 62 CD2 PHE A 911 20.790 8.628 4.517 1.00 0.00 C ATOM 63 CE1 PHE A 911 23.109 9.767 5.482 1.00 0.00 C ATOM 64 CE2 PHE A 911 20.778 9.298 5.724 1.00 0.00 C ATOM 65 CZ PHE A 911 21.939 9.867 6.207 1.00 0.00 C ATOM 0 H PHE A 911 20.111 9.380 2.088 1.00 0.00 H new ATOM 0 HA PHE A 911 22.741 9.367 1.242 1.00 0.00 H new ATOM 0 HB2 PHE A 911 21.132 7.089 2.456 1.00 0.00 H new ATOM 0 HB3 PHE A 911 22.881 7.187 2.419 1.00 0.00 H new ATOM 0 HD1 PHE A 911 24.032 9.020 3.712 1.00 0.00 H new ATOM 0 HD2 PHE A 911 19.880 8.181 4.144 1.00 0.00 H new ATOM 0 HE1 PHE A 911 24.018 10.212 5.858 1.00 0.00 H new ATOM 0 HE2 PHE A 911 19.861 9.377 6.290 1.00 0.00 H new ATOM 0 HZ PHE A 911 21.932 10.390 7.152 1.00 0.00 H new ATOM 75 N THR A 912 20.801 7.224 -0.330 1.00 0.00 N ATOM 76 CA THR A 912 20.666 6.366 -1.488 1.00 0.00 C ATOM 77 C THR A 912 19.187 6.161 -1.808 1.00 0.00 C ATOM 78 O THR A 912 18.311 6.662 -1.095 1.00 0.00 O ATOM 79 CB THR A 912 21.376 5.007 -1.268 1.00 0.00 C ATOM 80 OG1 THR A 912 21.130 4.112 -2.360 1.00 0.00 O ATOM 81 CG2 THR A 912 20.928 4.372 0.035 1.00 0.00 C ATOM 0 H THR A 912 19.942 7.333 0.208 1.00 0.00 H new ATOM 0 HA THR A 912 21.149 6.851 -2.336 1.00 0.00 H new ATOM 0 HB THR A 912 22.448 5.199 -1.216 1.00 0.00 H new ATOM 0 HG1 THR A 912 21.493 4.496 -3.186 1.00 0.00 H new ATOM 0 HG21 THR A 912 21.439 3.419 0.170 1.00 0.00 H new ATOM 0 HG22 THR A 912 21.172 5.035 0.865 1.00 0.00 H new ATOM 0 HG23 THR A 912 19.851 4.206 0.007 1.00 0.00 H new ATOM 89 N LEU A 913 18.924 5.418 -2.867 1.00 0.00 N ATOM 90 CA LEU A 913 17.573 5.207 -3.370 1.00 0.00 C ATOM 91 C LEU A 913 16.718 4.409 -2.393 1.00 0.00 C ATOM 92 O LEU A 913 15.517 4.639 -2.283 1.00 0.00 O ATOM 93 CB LEU A 913 17.640 4.484 -4.714 1.00 0.00 C ATOM 94 CG LEU A 913 18.240 5.306 -5.852 1.00 0.00 C ATOM 95 CD1 LEU A 913 18.705 4.399 -6.972 1.00 0.00 C ATOM 96 CD2 LEU A 913 17.220 6.296 -6.378 1.00 0.00 C ATOM 0 H LEU A 913 19.644 4.939 -3.408 1.00 0.00 H new ATOM 0 HA LEU A 913 17.103 6.183 -3.492 1.00 0.00 H new ATOM 0 HB2 LEU A 913 18.227 3.574 -4.593 1.00 0.00 H new ATOM 0 HB3 LEU A 913 16.633 4.178 -4.997 1.00 0.00 H new ATOM 0 HG LEU A 913 19.099 5.854 -5.466 1.00 0.00 H new ATOM 0 HD11 LEU A 913 19.130 5.001 -7.775 1.00 0.00 H new ATOM 0 HD12 LEU A 913 19.462 3.712 -6.594 1.00 0.00 H new ATOM 0 HD13 LEU A 913 17.858 3.830 -7.355 1.00 0.00 H new ATOM 0 HD21 LEU A 913 17.660 6.876 -7.189 1.00 0.00 H new ATOM 0 HD22 LEU A 913 16.348 5.757 -6.749 1.00 0.00 H new ATOM 0 HD23 LEU A 913 16.917 6.968 -5.575 1.00 0.00 H new ATOM 108 N VAL A 914 17.339 3.489 -1.667 1.00 0.00 N ATOM 109 CA VAL A 914 16.597 2.610 -0.770 1.00 0.00 C ATOM 110 C VAL A 914 16.095 3.364 0.462 1.00 0.00 C ATOM 111 O VAL A 914 15.209 2.893 1.168 1.00 0.00 O ATOM 112 CB VAL A 914 17.435 1.388 -0.332 1.00 0.00 C ATOM 113 CG1 VAL A 914 17.995 0.673 -1.551 1.00 0.00 C ATOM 114 CG2 VAL A 914 18.556 1.789 0.616 1.00 0.00 C ATOM 0 H VAL A 914 18.347 3.332 -1.680 1.00 0.00 H new ATOM 0 HA VAL A 914 15.738 2.248 -1.334 1.00 0.00 H new ATOM 0 HB VAL A 914 16.778 0.706 0.208 1.00 0.00 H new ATOM 0 HG11 VAL A 914 18.584 -0.186 -1.230 1.00 0.00 H new ATOM 0 HG12 VAL A 914 17.174 0.335 -2.183 1.00 0.00 H new ATOM 0 HG13 VAL A 914 18.629 1.357 -2.115 1.00 0.00 H new ATOM 0 HG21 VAL A 914 19.124 0.904 0.903 1.00 0.00 H new ATOM 0 HG22 VAL A 914 19.217 2.499 0.118 1.00 0.00 H new ATOM 0 HG23 VAL A 914 18.131 2.252 1.507 1.00 0.00 H new ATOM 124 N GLN A 915 16.647 4.553 0.696 1.00 0.00 N ATOM 125 CA GLN A 915 16.238 5.373 1.832 1.00 0.00 C ATOM 126 C GLN A 915 14.798 5.838 1.663 1.00 0.00 C ATOM 127 O GLN A 915 14.001 5.785 2.601 1.00 0.00 O ATOM 128 CB GLN A 915 17.166 6.579 1.986 1.00 0.00 C ATOM 129 CG GLN A 915 18.602 6.204 2.306 1.00 0.00 C ATOM 130 CD GLN A 915 18.739 5.443 3.612 1.00 0.00 C ATOM 131 OE1 GLN A 915 17.898 5.761 4.585 1.00 0.00 O flip ATOM 132 NE2 GLN A 915 19.615 4.591 3.753 1.00 0.00 N flip ATOM 0 H GLN A 915 17.376 4.968 0.116 1.00 0.00 H new ATOM 0 HA GLN A 915 16.305 4.765 2.734 1.00 0.00 H new ATOM 0 HB2 GLN A 915 17.148 7.161 1.064 1.00 0.00 H new ATOM 0 HB3 GLN A 915 16.783 7.223 2.777 1.00 0.00 H new ATOM 0 HG2 GLN A 915 19.003 5.597 1.494 1.00 0.00 H new ATOM 0 HG3 GLN A 915 19.206 7.110 2.355 1.00 0.00 H new ATOM 0 HE21 GLN A 915 20.244 4.374 2.980 1.00 0.00 H new ATOM 0 HE22 GLN A 915 19.712 4.102 4.643 1.00 0.00 H new ATOM 141 N ARG A 916 14.459 6.274 0.455 1.00 0.00 N ATOM 142 CA ARG A 916 13.101 6.713 0.168 1.00 0.00 C ATOM 143 C ARG A 916 12.181 5.505 0.042 1.00 0.00 C ATOM 144 O ARG A 916 10.967 5.617 0.202 1.00 0.00 O ATOM 145 CB ARG A 916 13.049 7.569 -1.105 1.00 0.00 C ATOM 146 CG ARG A 916 13.394 6.816 -2.380 1.00 0.00 C ATOM 147 CD ARG A 916 13.293 7.713 -3.603 1.00 0.00 C ATOM 148 NE ARG A 916 14.321 8.753 -3.623 1.00 0.00 N ATOM 149 CZ ARG A 916 14.089 10.047 -3.399 1.00 0.00 C ATOM 150 NH1 ARG A 916 12.878 10.467 -3.051 1.00 0.00 N ATOM 151 NH2 ARG A 916 15.080 10.919 -3.515 1.00 0.00 N ATOM 0 H ARG A 916 15.101 6.332 -0.335 1.00 0.00 H new ATOM 0 HA ARG A 916 12.759 7.334 0.996 1.00 0.00 H new ATOM 0 HB2 ARG A 916 12.049 7.990 -1.205 1.00 0.00 H new ATOM 0 HB3 ARG A 916 13.738 8.407 -0.994 1.00 0.00 H new ATOM 0 HG2 ARG A 916 14.405 6.415 -2.304 1.00 0.00 H new ATOM 0 HG3 ARG A 916 12.721 5.966 -2.495 1.00 0.00 H new ATOM 0 HD2 ARG A 916 13.379 7.105 -4.503 1.00 0.00 H new ATOM 0 HD3 ARG A 916 12.308 8.180 -3.626 1.00 0.00 H new ATOM 0 HE ARG A 916 15.280 8.469 -3.822 1.00 0.00 H new ATOM 0 HH11 ARG A 916 12.115 9.798 -2.953 1.00 0.00 H new ATOM 0 HH12 ARG A 916 12.711 11.459 -2.882 1.00 0.00 H new ATOM 0 HH21 ARG A 916 16.013 10.599 -3.774 1.00 0.00 H new ATOM 0 HH22 ARG A 916 14.910 11.910 -3.345 1.00 0.00 H new ATOM 165 N LEU A 917 12.776 4.348 -0.225 1.00 0.00 N ATOM 166 CA LEU A 917 12.031 3.101 -0.311 1.00 0.00 C ATOM 167 C LEU A 917 11.502 2.713 1.066 1.00 0.00 C ATOM 168 O LEU A 917 10.330 2.371 1.211 1.00 0.00 O ATOM 169 CB LEU A 917 12.918 1.989 -0.881 1.00 0.00 C ATOM 170 CG LEU A 917 12.256 0.615 -0.998 1.00 0.00 C ATOM 171 CD1 LEU A 917 11.049 0.676 -1.921 1.00 0.00 C ATOM 172 CD2 LEU A 917 13.260 -0.413 -1.498 1.00 0.00 C ATOM 0 H LEU A 917 13.778 4.249 -0.386 1.00 0.00 H new ATOM 0 HA LEU A 917 11.184 3.241 -0.983 1.00 0.00 H new ATOM 0 HB2 LEU A 917 13.262 2.293 -1.870 1.00 0.00 H new ATOM 0 HB3 LEU A 917 13.803 1.895 -0.251 1.00 0.00 H new ATOM 0 HG LEU A 917 11.912 0.313 -0.009 1.00 0.00 H new ATOM 0 HD11 LEU A 917 10.593 -0.312 -1.990 1.00 0.00 H new ATOM 0 HD12 LEU A 917 10.322 1.384 -1.523 1.00 0.00 H new ATOM 0 HD13 LEU A 917 11.365 1.000 -2.913 1.00 0.00 H new ATOM 0 HD21 LEU A 917 12.776 -1.386 -1.577 1.00 0.00 H new ATOM 0 HD22 LEU A 917 13.631 -0.112 -2.478 1.00 0.00 H new ATOM 0 HD23 LEU A 917 14.093 -0.478 -0.798 1.00 0.00 H new ATOM 184 N GLU A 918 12.371 2.789 2.074 1.00 0.00 N ATOM 185 CA GLU A 918 11.974 2.522 3.453 1.00 0.00 C ATOM 186 C GLU A 918 10.818 3.434 3.850 1.00 0.00 C ATOM 187 O GLU A 918 9.792 2.979 4.353 1.00 0.00 O ATOM 188 CB GLU A 918 13.146 2.756 4.410 1.00 0.00 C ATOM 189 CG GLU A 918 14.397 1.964 4.072 1.00 0.00 C ATOM 190 CD GLU A 918 15.538 2.260 5.024 1.00 0.00 C ATOM 191 OE1 GLU A 918 15.955 3.431 5.117 1.00 0.00 O ATOM 192 OE2 GLU A 918 16.025 1.322 5.689 1.00 0.00 O ATOM 0 H GLU A 918 13.355 3.034 1.959 1.00 0.00 H new ATOM 0 HA GLU A 918 11.662 1.480 3.519 1.00 0.00 H new ATOM 0 HB2 GLU A 918 13.392 3.818 4.412 1.00 0.00 H new ATOM 0 HB3 GLU A 918 12.830 2.500 5.421 1.00 0.00 H new ATOM 0 HG2 GLU A 918 14.169 0.899 4.101 1.00 0.00 H new ATOM 0 HG3 GLU A 918 14.707 2.196 3.053 1.00 0.00 H new ATOM 199 N HIS A 919 11.001 4.725 3.595 1.00 0.00 N ATOM 200 CA HIS A 919 10.003 5.737 3.929 1.00 0.00 C ATOM 201 C HIS A 919 8.676 5.454 3.228 1.00 0.00 C ATOM 202 O HIS A 919 7.611 5.523 3.840 1.00 0.00 O ATOM 203 CB HIS A 919 10.525 7.127 3.542 1.00 0.00 C ATOM 204 CG HIS A 919 9.587 8.251 3.865 1.00 0.00 C ATOM 205 ND1 HIS A 919 9.481 8.803 5.121 1.00 0.00 N ATOM 206 CD2 HIS A 919 8.718 8.936 3.083 1.00 0.00 C ATOM 207 CE1 HIS A 919 8.590 9.776 5.101 1.00 0.00 C ATOM 208 NE2 HIS A 919 8.113 9.876 3.875 1.00 0.00 N ATOM 0 H HIS A 919 11.841 5.099 3.153 1.00 0.00 H new ATOM 0 HA HIS A 919 9.826 5.706 5.004 1.00 0.00 H new ATOM 0 HB2 HIS A 919 11.472 7.302 4.053 1.00 0.00 H new ATOM 0 HB3 HIS A 919 10.733 7.139 2.472 1.00 0.00 H new ATOM 0 HD2 HIS A 919 8.536 8.772 2.031 1.00 0.00 H new ATOM 0 HE1 HIS A 919 8.301 10.386 5.944 1.00 0.00 H new ATOM 0 HE2 HIS A 919 7.408 10.545 3.567 1.00 0.00 H new ATOM 216 N ALA A 920 8.750 5.129 1.944 1.00 0.00 N ATOM 217 CA ALA A 920 7.555 4.880 1.149 1.00 0.00 C ATOM 218 C ALA A 920 6.835 3.620 1.606 1.00 0.00 C ATOM 219 O ALA A 920 5.610 3.603 1.705 1.00 0.00 O ATOM 220 CB ALA A 920 7.911 4.781 -0.325 1.00 0.00 C ATOM 0 H ALA A 920 9.626 5.032 1.431 1.00 0.00 H new ATOM 0 HA ALA A 920 6.878 5.722 1.293 1.00 0.00 H new ATOM 0 HB1 ALA A 920 7.008 4.595 -0.906 1.00 0.00 H new ATOM 0 HB2 ALA A 920 8.367 5.715 -0.653 1.00 0.00 H new ATOM 0 HB3 ALA A 920 8.614 3.962 -0.475 1.00 0.00 H new ATOM 226 N ALA A 921 7.595 2.572 1.898 1.00 0.00 N ATOM 227 CA ALA A 921 7.016 1.295 2.295 1.00 0.00 C ATOM 228 C ALA A 921 6.292 1.400 3.634 1.00 0.00 C ATOM 229 O ALA A 921 5.214 0.830 3.808 1.00 0.00 O ATOM 230 CB ALA A 921 8.091 0.222 2.353 1.00 0.00 C ATOM 0 H ALA A 921 8.614 2.581 1.867 1.00 0.00 H new ATOM 0 HA ALA A 921 6.279 1.015 1.542 1.00 0.00 H new ATOM 0 HB1 ALA A 921 7.643 -0.726 2.651 1.00 0.00 H new ATOM 0 HB2 ALA A 921 8.550 0.113 1.370 1.00 0.00 H new ATOM 0 HB3 ALA A 921 8.852 0.508 3.079 1.00 0.00 H new ATOM 236 N LYS A 922 6.880 2.140 4.572 1.00 0.00 N ATOM 237 CA LYS A 922 6.273 2.332 5.887 1.00 0.00 C ATOM 238 C LYS A 922 4.900 2.984 5.760 1.00 0.00 C ATOM 239 O LYS A 922 3.910 2.479 6.293 1.00 0.00 O ATOM 240 CB LYS A 922 7.163 3.204 6.776 1.00 0.00 C ATOM 241 CG LYS A 922 8.494 2.568 7.137 1.00 0.00 C ATOM 242 CD LYS A 922 9.348 3.519 7.958 1.00 0.00 C ATOM 243 CE LYS A 922 10.692 2.906 8.308 1.00 0.00 C ATOM 244 NZ LYS A 922 11.551 3.856 9.061 1.00 0.00 N ATOM 0 H LYS A 922 7.774 2.615 4.446 1.00 0.00 H new ATOM 0 HA LYS A 922 6.163 1.349 6.344 1.00 0.00 H new ATOM 0 HB2 LYS A 922 7.351 4.150 6.267 1.00 0.00 H new ATOM 0 HB3 LYS A 922 6.623 3.437 7.694 1.00 0.00 H new ATOM 0 HG2 LYS A 922 8.322 1.651 7.700 1.00 0.00 H new ATOM 0 HG3 LYS A 922 9.026 2.289 6.228 1.00 0.00 H new ATOM 0 HD2 LYS A 922 9.503 4.443 7.400 1.00 0.00 H new ATOM 0 HD3 LYS A 922 8.820 3.785 8.874 1.00 0.00 H new ATOM 0 HE2 LYS A 922 10.537 2.006 8.903 1.00 0.00 H new ATOM 0 HE3 LYS A 922 11.202 2.601 7.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 922 12.460 3.402 9.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 922 11.719 4.704 8.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 922 11.076 4.128 9.945 1.00 0.00 H new ATOM 258 N GLN A 923 4.849 4.101 5.040 1.00 0.00 N ATOM 259 CA GLN A 923 3.610 4.855 4.891 1.00 0.00 C ATOM 260 C GLN A 923 2.620 4.124 3.988 1.00 0.00 C ATOM 261 O GLN A 923 1.409 4.287 4.133 1.00 0.00 O ATOM 262 CB GLN A 923 3.897 6.258 4.351 1.00 0.00 C ATOM 263 CG GLN A 923 4.590 6.269 3.000 1.00 0.00 C ATOM 264 CD GLN A 923 5.013 7.657 2.573 1.00 0.00 C ATOM 265 OE1 GLN A 923 5.303 8.514 3.405 1.00 0.00 O ATOM 266 NE2 GLN A 923 5.052 7.885 1.274 1.00 0.00 N ATOM 0 H GLN A 923 5.650 4.503 4.552 1.00 0.00 H new ATOM 0 HA GLN A 923 3.155 4.948 5.877 1.00 0.00 H new ATOM 0 HB2 GLN A 923 2.957 6.805 4.271 1.00 0.00 H new ATOM 0 HB3 GLN A 923 4.517 6.793 5.070 1.00 0.00 H new ATOM 0 HG2 GLN A 923 5.467 5.623 3.041 1.00 0.00 H new ATOM 0 HG3 GLN A 923 3.920 5.851 2.249 1.00 0.00 H new ATOM 0 HE21 GLN A 923 4.803 7.144 0.618 1.00 0.00 H new ATOM 0 HE22 GLN A 923 5.331 8.802 0.925 1.00 0.00 H new ATOM 275 N ALA A 924 3.131 3.320 3.063 1.00 0.00 N ATOM 276 CA ALA A 924 2.277 2.515 2.199 1.00 0.00 C ATOM 277 C ALA A 924 1.591 1.426 3.008 1.00 0.00 C ATOM 278 O ALA A 924 0.380 1.244 2.919 1.00 0.00 O ATOM 279 CB ALA A 924 3.077 1.906 1.061 1.00 0.00 C ATOM 0 H ALA A 924 4.130 3.208 2.892 1.00 0.00 H new ATOM 0 HA ALA A 924 1.516 3.165 1.767 1.00 0.00 H new ATOM 0 HB1 ALA A 924 2.417 1.310 0.431 1.00 0.00 H new ATOM 0 HB2 ALA A 924 3.527 2.701 0.466 1.00 0.00 H new ATOM 0 HB3 ALA A 924 3.862 1.269 1.468 1.00 0.00 H new ATOM 285 N ALA A 925 2.378 0.717 3.811 1.00 0.00 N ATOM 286 CA ALA A 925 1.847 -0.312 4.692 1.00 0.00 C ATOM 287 C ALA A 925 0.833 0.291 5.663 1.00 0.00 C ATOM 288 O ALA A 925 -0.177 -0.332 6.003 1.00 0.00 O ATOM 289 CB ALA A 925 2.986 -0.988 5.450 1.00 0.00 C ATOM 0 H ALA A 925 3.389 0.838 3.868 1.00 0.00 H new ATOM 0 HA ALA A 925 1.336 -1.064 4.091 1.00 0.00 H new ATOM 0 HB1 ALA A 925 2.580 -1.757 6.107 1.00 0.00 H new ATOM 0 HB2 ALA A 925 3.675 -1.445 4.740 1.00 0.00 H new ATOM 0 HB3 ALA A 925 3.518 -0.246 6.045 1.00 0.00 H new ATOM 295 N ALA A 926 1.103 1.521 6.081 1.00 0.00 N ATOM 296 CA ALA A 926 0.221 2.239 6.988 1.00 0.00 C ATOM 297 C ALA A 926 -1.087 2.623 6.303 1.00 0.00 C ATOM 298 O ALA A 926 -2.162 2.222 6.744 1.00 0.00 O ATOM 299 CB ALA A 926 0.916 3.478 7.525 1.00 0.00 C ATOM 0 H ALA A 926 1.933 2.044 5.803 1.00 0.00 H new ATOM 0 HA ALA A 926 -0.018 1.575 7.819 1.00 0.00 H new ATOM 0 HB1 ALA A 926 0.245 4.007 8.203 1.00 0.00 H new ATOM 0 HB2 ALA A 926 1.818 3.185 8.062 1.00 0.00 H new ATOM 0 HB3 ALA A 926 1.184 4.133 6.696 1.00 0.00 H new ATOM 305 N SER A 927 -0.990 3.383 5.216 1.00 0.00 N ATOM 306 CA SER A 927 -2.171 3.874 4.509 1.00 0.00 C ATOM 307 C SER A 927 -3.041 2.719 4.017 1.00 0.00 C ATOM 308 O SER A 927 -4.270 2.821 3.996 1.00 0.00 O ATOM 309 CB SER A 927 -1.756 4.767 3.339 1.00 0.00 C ATOM 310 OG SER A 927 -0.771 4.135 2.540 1.00 0.00 O ATOM 0 H SER A 927 -0.103 3.673 4.804 1.00 0.00 H new ATOM 0 HA SER A 927 -2.763 4.464 5.209 1.00 0.00 H new ATOM 0 HB2 SER A 927 -2.628 5.001 2.729 1.00 0.00 H new ATOM 0 HB3 SER A 927 -1.369 5.713 3.719 1.00 0.00 H new ATOM 0 HG SER A 927 0.108 4.241 2.960 1.00 0.00 H new ATOM 316 N ALA A 928 -2.398 1.620 3.636 1.00 0.00 N ATOM 317 CA ALA A 928 -3.112 0.419 3.230 1.00 0.00 C ATOM 318 C ALA A 928 -3.995 -0.085 4.360 1.00 0.00 C ATOM 319 O ALA A 928 -5.132 -0.489 4.133 1.00 0.00 O ATOM 320 CB ALA A 928 -2.137 -0.664 2.805 1.00 0.00 C ATOM 0 H ALA A 928 -1.382 1.538 3.601 1.00 0.00 H new ATOM 0 HA ALA A 928 -3.745 0.671 2.379 1.00 0.00 H new ATOM 0 HB1 ALA A 928 -2.690 -1.554 2.505 1.00 0.00 H new ATOM 0 HB2 ALA A 928 -1.540 -0.307 1.965 1.00 0.00 H new ATOM 0 HB3 ALA A 928 -1.480 -0.909 3.639 1.00 0.00 H new ATOM 326 N THR A 929 -3.469 -0.035 5.578 1.00 0.00 N ATOM 327 CA THR A 929 -4.206 -0.472 6.754 1.00 0.00 C ATOM 328 C THR A 929 -5.488 0.346 6.917 1.00 0.00 C ATOM 329 O THR A 929 -6.573 -0.209 7.083 1.00 0.00 O ATOM 330 CB THR A 929 -3.340 -0.352 8.025 1.00 0.00 C ATOM 331 OG1 THR A 929 -2.107 -1.070 7.848 1.00 0.00 O ATOM 332 CG2 THR A 929 -4.072 -0.897 9.244 1.00 0.00 C ATOM 0 H THR A 929 -2.528 0.306 5.776 1.00 0.00 H new ATOM 0 HA THR A 929 -4.470 -1.520 6.614 1.00 0.00 H new ATOM 0 HB THR A 929 -3.131 0.705 8.191 1.00 0.00 H new ATOM 0 HG1 THR A 929 -1.541 -0.595 7.204 1.00 0.00 H new ATOM 0 HG21 THR A 929 -3.436 -0.799 10.124 1.00 0.00 H new ATOM 0 HG22 THR A 929 -4.993 -0.335 9.397 1.00 0.00 H new ATOM 0 HG23 THR A 929 -4.311 -1.948 9.085 1.00 0.00 H new ATOM 340 N GLN A 930 -5.353 1.670 6.845 1.00 0.00 N ATOM 341 CA GLN A 930 -6.499 2.566 6.920 1.00 0.00 C ATOM 342 C GLN A 930 -7.480 2.310 5.780 1.00 0.00 C ATOM 343 O GLN A 930 -8.692 2.312 5.987 1.00 0.00 O ATOM 344 CB GLN A 930 -6.036 4.025 6.899 1.00 0.00 C ATOM 345 CG GLN A 930 -5.515 4.524 8.238 1.00 0.00 C ATOM 346 CD GLN A 930 -4.262 3.815 8.710 1.00 0.00 C ATOM 347 OE1 GLN A 930 -4.331 2.797 9.398 1.00 0.00 O ATOM 348 NE2 GLN A 930 -3.106 4.357 8.366 1.00 0.00 N ATOM 0 H GLN A 930 -4.457 2.144 6.734 1.00 0.00 H new ATOM 0 HA GLN A 930 -7.015 2.369 7.860 1.00 0.00 H new ATOM 0 HB2 GLN A 930 -5.252 4.137 6.150 1.00 0.00 H new ATOM 0 HB3 GLN A 930 -6.868 4.656 6.586 1.00 0.00 H new ATOM 0 HG2 GLN A 930 -5.310 5.592 8.162 1.00 0.00 H new ATOM 0 HG3 GLN A 930 -6.295 4.402 8.989 1.00 0.00 H new ATOM 0 HE21 GLN A 930 -3.089 5.202 7.794 1.00 0.00 H new ATOM 0 HE22 GLN A 930 -2.232 3.930 8.672 1.00 0.00 H new ATOM 357 N THR A 931 -6.957 2.079 4.581 1.00 0.00 N ATOM 358 CA THR A 931 -7.801 1.803 3.427 1.00 0.00 C ATOM 359 C THR A 931 -8.572 0.497 3.630 1.00 0.00 C ATOM 360 O THR A 931 -9.766 0.418 3.341 1.00 0.00 O ATOM 361 CB THR A 931 -6.973 1.725 2.131 1.00 0.00 C ATOM 362 OG1 THR A 931 -6.141 2.886 2.015 1.00 0.00 O ATOM 363 CG2 THR A 931 -7.876 1.633 0.910 1.00 0.00 C ATOM 0 H THR A 931 -5.956 2.078 4.384 1.00 0.00 H new ATOM 0 HA THR A 931 -8.508 2.627 3.331 1.00 0.00 H new ATOM 0 HB THR A 931 -6.356 0.828 2.178 1.00 0.00 H new ATOM 0 HG1 THR A 931 -5.454 2.867 2.714 1.00 0.00 H new ATOM 0 HG21 THR A 931 -7.265 1.579 0.009 1.00 0.00 H new ATOM 0 HG22 THR A 931 -8.496 0.739 0.982 1.00 0.00 H new ATOM 0 HG23 THR A 931 -8.515 2.515 0.863 1.00 0.00 H new ATOM 371 N ILE A 932 -7.884 -0.515 4.148 1.00 0.00 N ATOM 372 CA ILE A 932 -8.510 -1.791 4.474 1.00 0.00 C ATOM 373 C ILE A 932 -9.607 -1.604 5.518 1.00 0.00 C ATOM 374 O ILE A 932 -10.743 -2.041 5.326 1.00 0.00 O ATOM 375 CB ILE A 932 -7.463 -2.803 4.999 1.00 0.00 C ATOM 376 CG1 ILE A 932 -6.521 -3.221 3.867 1.00 0.00 C ATOM 377 CG2 ILE A 932 -8.139 -4.020 5.618 1.00 0.00 C ATOM 378 CD1 ILE A 932 -5.378 -4.099 4.323 1.00 0.00 C ATOM 0 H ILE A 932 -6.885 -0.475 4.352 1.00 0.00 H new ATOM 0 HA ILE A 932 -8.953 -2.184 3.559 1.00 0.00 H new ATOM 0 HB ILE A 932 -6.877 -2.318 5.780 1.00 0.00 H new ATOM 0 HG12 ILE A 932 -7.094 -3.751 3.106 1.00 0.00 H new ATOM 0 HG13 ILE A 932 -6.115 -2.326 3.395 1.00 0.00 H new ATOM 0 HG21 ILE A 932 -7.380 -4.714 5.978 1.00 0.00 H new ATOM 0 HG22 ILE A 932 -8.766 -3.703 6.452 1.00 0.00 H new ATOM 0 HG23 ILE A 932 -8.756 -4.515 4.868 1.00 0.00 H new ATOM 0 HD11 ILE A 932 -4.753 -4.356 3.468 1.00 0.00 H new ATOM 0 HD12 ILE A 932 -4.781 -3.564 5.062 1.00 0.00 H new ATOM 0 HD13 ILE A 932 -5.775 -5.011 4.769 1.00 0.00 H new ATOM 390 N ALA A 933 -9.259 -0.928 6.609 1.00 0.00 N ATOM 391 CA ALA A 933 -10.188 -0.685 7.709 1.00 0.00 C ATOM 392 C ALA A 933 -11.404 0.108 7.247 1.00 0.00 C ATOM 393 O ALA A 933 -12.476 0.029 7.847 1.00 0.00 O ATOM 394 CB ALA A 933 -9.482 0.052 8.834 1.00 0.00 C ATOM 0 H ALA A 933 -8.329 -0.535 6.756 1.00 0.00 H new ATOM 0 HA ALA A 933 -10.537 -1.651 8.073 1.00 0.00 H new ATOM 0 HB1 ALA A 933 -10.183 0.229 9.650 1.00 0.00 H new ATOM 0 HB2 ALA A 933 -8.648 -0.550 9.196 1.00 0.00 H new ATOM 0 HB3 ALA A 933 -9.107 1.007 8.465 1.00 0.00 H new ATOM 400 N ALA A 934 -11.226 0.883 6.190 1.00 0.00 N ATOM 401 CA ALA A 934 -12.315 1.652 5.618 1.00 0.00 C ATOM 402 C ALA A 934 -13.143 0.797 4.669 1.00 0.00 C ATOM 403 O ALA A 934 -14.361 0.723 4.792 1.00 0.00 O ATOM 404 CB ALA A 934 -11.771 2.873 4.888 1.00 0.00 C ATOM 0 H ALA A 934 -10.333 0.995 5.710 1.00 0.00 H new ATOM 0 HA ALA A 934 -12.961 1.985 6.430 1.00 0.00 H new ATOM 0 HB1 ALA A 934 -12.598 3.442 4.463 1.00 0.00 H new ATOM 0 HB2 ALA A 934 -11.221 3.501 5.589 1.00 0.00 H new ATOM 0 HB3 ALA A 934 -11.104 2.551 4.088 1.00 0.00 H new ATOM 410 N ALA A 935 -12.467 0.128 3.747 1.00 0.00 N ATOM 411 CA ALA A 935 -13.131 -0.597 2.669 1.00 0.00 C ATOM 412 C ALA A 935 -13.995 -1.746 3.178 1.00 0.00 C ATOM 413 O ALA A 935 -15.199 -1.779 2.928 1.00 0.00 O ATOM 414 CB ALA A 935 -12.100 -1.113 1.679 1.00 0.00 C ATOM 0 H ALA A 935 -11.449 0.071 3.723 1.00 0.00 H new ATOM 0 HA ALA A 935 -13.800 0.106 2.172 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -12.604 -1.653 0.877 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -11.547 -0.273 1.259 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -11.409 -1.784 2.190 1.00 0.00 H new ATOM 420 N GLN A 936 -13.391 -2.676 3.909 1.00 0.00 N ATOM 421 CA GLN A 936 -14.095 -3.887 4.326 1.00 0.00 C ATOM 422 C GLN A 936 -15.098 -3.604 5.442 1.00 0.00 C ATOM 423 O GLN A 936 -15.908 -4.462 5.789 1.00 0.00 O ATOM 424 CB GLN A 936 -13.105 -4.964 4.771 1.00 0.00 C ATOM 425 CG GLN A 936 -12.309 -4.591 6.008 1.00 0.00 C ATOM 426 CD GLN A 936 -11.367 -5.692 6.445 1.00 0.00 C ATOM 427 OE1 GLN A 936 -10.873 -6.468 5.624 1.00 0.00 O ATOM 428 NE2 GLN A 936 -11.120 -5.775 7.741 1.00 0.00 N ATOM 0 H GLN A 936 -12.423 -2.618 4.224 1.00 0.00 H new ATOM 0 HA GLN A 936 -14.650 -4.251 3.461 1.00 0.00 H new ATOM 0 HB2 GLN A 936 -13.650 -5.887 4.966 1.00 0.00 H new ATOM 0 HB3 GLN A 936 -12.414 -5.169 3.954 1.00 0.00 H new ATOM 0 HG2 GLN A 936 -11.736 -3.685 5.808 1.00 0.00 H new ATOM 0 HG3 GLN A 936 -12.996 -4.361 6.822 1.00 0.00 H new ATOM 0 HE21 GLN A 936 -11.550 -5.112 8.386 1.00 0.00 H new ATOM 0 HE22 GLN A 936 -10.499 -6.502 8.096 1.00 0.00 H new ATOM 437 N HIS A 937 -15.040 -2.405 6.010 1.00 0.00 N ATOM 438 CA HIS A 937 -15.972 -2.019 7.063 1.00 0.00 C ATOM 439 C HIS A 937 -17.111 -1.191 6.475 1.00 0.00 C ATOM 440 O HIS A 937 -18.228 -1.192 6.992 1.00 0.00 O ATOM 441 CB HIS A 937 -15.252 -1.231 8.159 1.00 0.00 C ATOM 442 CG HIS A 937 -16.058 -1.063 9.412 1.00 0.00 C ATOM 443 ND1 HIS A 937 -16.698 0.109 9.750 1.00 0.00 N ATOM 444 CD2 HIS A 937 -16.319 -1.933 10.415 1.00 0.00 C ATOM 445 CE1 HIS A 937 -17.317 -0.048 10.906 1.00 0.00 C ATOM 446 NE2 HIS A 937 -17.102 -1.277 11.329 1.00 0.00 N ATOM 0 H HIS A 937 -14.361 -1.686 5.761 1.00 0.00 H new ATOM 0 HA HIS A 937 -16.386 -2.923 7.509 1.00 0.00 H new ATOM 0 HB2 HIS A 937 -14.318 -1.737 8.404 1.00 0.00 H new ATOM 0 HB3 HIS A 937 -14.989 -0.246 7.773 1.00 0.00 H new ATOM 0 HD2 HIS A 937 -15.974 -2.954 10.483 1.00 0.00 H new ATOM 0 HE1 HIS A 937 -17.900 0.703 11.418 1.00 0.00 H new ATOM 0 HE2 HIS A 937 -17.460 -1.676 12.197 1.00 0.00 H new ATOM 454 N ALA A 938 -16.817 -0.480 5.396 1.00 0.00 N ATOM 455 CA ALA A 938 -17.829 0.293 4.695 1.00 0.00 C ATOM 456 C ALA A 938 -18.665 -0.616 3.808 1.00 0.00 C ATOM 457 O ALA A 938 -19.891 -0.525 3.788 1.00 0.00 O ATOM 458 CB ALA A 938 -17.188 1.394 3.867 1.00 0.00 C ATOM 0 H ALA A 938 -15.884 -0.423 4.987 1.00 0.00 H new ATOM 0 HA ALA A 938 -18.480 0.757 5.436 1.00 0.00 H new ATOM 0 HB1 ALA A 938 -17.964 1.960 3.351 1.00 0.00 H new ATOM 0 HB2 ALA A 938 -16.627 2.061 4.521 1.00 0.00 H new ATOM 0 HB3 ALA A 938 -16.513 0.952 3.134 1.00 0.00 H new ATOM 464 N ALA A 939 -17.998 -1.506 3.084 1.00 0.00 N ATOM 465 CA ALA A 939 -18.686 -2.470 2.244 1.00 0.00 C ATOM 466 C ALA A 939 -19.156 -3.654 3.078 1.00 0.00 C ATOM 467 O ALA A 939 -18.620 -4.761 2.974 1.00 0.00 O ATOM 468 CB ALA A 939 -17.794 -2.935 1.104 1.00 0.00 C ATOM 0 H ALA A 939 -16.981 -1.578 3.064 1.00 0.00 H new ATOM 0 HA ALA A 939 -19.558 -1.983 1.807 1.00 0.00 H new ATOM 0 HB1 ALA A 939 -18.334 -3.656 0.491 1.00 0.00 H new ATOM 0 HB2 ALA A 939 -17.510 -2.079 0.492 1.00 0.00 H new ATOM 0 HB3 ALA A 939 -16.898 -3.404 1.511 1.00 0.00 H new ATOM 474 N SER A 940 -20.137 -3.400 3.929 1.00 0.00 N ATOM 475 CA SER A 940 -20.703 -4.430 4.775 1.00 0.00 C ATOM 476 C SER A 940 -21.619 -5.325 3.958 1.00 0.00 C ATOM 477 O SER A 940 -21.651 -6.542 4.159 1.00 0.00 O ATOM 478 CB SER A 940 -21.478 -3.787 5.925 1.00 0.00 C ATOM 479 OG SER A 940 -20.669 -2.847 6.614 1.00 0.00 O ATOM 0 H SER A 940 -20.559 -2.479 4.050 1.00 0.00 H new ATOM 0 HA SER A 940 -19.898 -5.037 5.189 1.00 0.00 H new ATOM 0 HB2 SER A 940 -22.369 -3.292 5.538 1.00 0.00 H new ATOM 0 HB3 SER A 940 -21.817 -4.558 6.617 1.00 0.00 H new ATOM 0 HG SER A 940 -21.184 -2.446 7.345 1.00 0.00 H new ATOM 485 N ALA A 941 -22.338 -4.702 3.022 1.00 0.00 N ATOM 486 CA ALA A 941 -23.278 -5.392 2.145 1.00 0.00 C ATOM 487 C ALA A 941 -24.431 -5.988 2.944 1.00 0.00 C ATOM 488 O ALA A 941 -24.243 -6.961 3.681 1.00 0.00 O ATOM 489 CB ALA A 941 -22.574 -6.465 1.320 1.00 0.00 C ATOM 0 H ALA A 941 -22.282 -3.698 2.852 1.00 0.00 H new ATOM 0 HA ALA A 941 -23.691 -4.657 1.454 1.00 0.00 H new ATOM 0 HB1 ALA A 941 -23.299 -6.963 0.676 1.00 0.00 H new ATOM 0 HB2 ALA A 941 -21.800 -6.003 0.707 1.00 0.00 H new ATOM 0 HB3 ALA A 941 -22.119 -7.197 1.987 1.00 0.00 H new ATOM 495 N PRO A 942 -25.637 -5.394 2.814 1.00 0.00 N ATOM 496 CA PRO A 942 -26.840 -5.867 3.501 1.00 0.00 C ATOM 497 C PRO A 942 -26.925 -7.373 3.494 1.00 0.00 C ATOM 498 O PRO A 942 -26.987 -8.017 2.440 1.00 0.00 O ATOM 499 CB PRO A 942 -27.970 -5.233 2.697 1.00 0.00 C ATOM 500 CG PRO A 942 -27.388 -3.957 2.194 1.00 0.00 C ATOM 501 CD PRO A 942 -25.917 -4.215 1.974 1.00 0.00 C ATOM 0 HA PRO A 942 -26.866 -5.594 4.556 1.00 0.00 H new ATOM 0 HB2 PRO A 942 -28.286 -5.878 1.877 1.00 0.00 H new ATOM 0 HB3 PRO A 942 -28.848 -5.053 3.317 1.00 0.00 H new ATOM 0 HG2 PRO A 942 -27.871 -3.649 1.267 1.00 0.00 H new ATOM 0 HG3 PRO A 942 -27.537 -3.152 2.914 1.00 0.00 H new ATOM 0 HD2 PRO A 942 -25.698 -4.411 0.924 1.00 0.00 H new ATOM 0 HD3 PRO A 942 -25.312 -3.359 2.272 1.00 0.00 H new ATOM 509 N LYS A 943 -26.910 -7.920 4.687 1.00 0.00 N ATOM 510 CA LYS A 943 -26.615 -9.310 4.877 1.00 0.00 C ATOM 511 C LYS A 943 -27.830 -10.189 4.621 1.00 0.00 C ATOM 512 O LYS A 943 -28.516 -10.637 5.541 1.00 0.00 O ATOM 513 CB LYS A 943 -26.043 -9.515 6.276 1.00 0.00 C ATOM 514 CG LYS A 943 -25.404 -10.868 6.488 1.00 0.00 C ATOM 515 CD LYS A 943 -24.220 -11.130 5.555 1.00 0.00 C ATOM 516 CE LYS A 943 -22.983 -10.304 5.909 1.00 0.00 C ATOM 517 NZ LYS A 943 -23.093 -8.872 5.507 1.00 0.00 N ATOM 0 H LYS A 943 -27.103 -7.410 5.549 1.00 0.00 H new ATOM 0 HA LYS A 943 -25.868 -9.616 4.145 1.00 0.00 H new ATOM 0 HB2 LYS A 943 -25.302 -8.740 6.471 1.00 0.00 H new ATOM 0 HB3 LYS A 943 -26.841 -9.383 7.006 1.00 0.00 H new ATOM 0 HG2 LYS A 943 -25.067 -10.945 7.522 1.00 0.00 H new ATOM 0 HG3 LYS A 943 -26.154 -11.644 6.338 1.00 0.00 H new ATOM 0 HD2 LYS A 943 -23.965 -12.189 5.590 1.00 0.00 H new ATOM 0 HD3 LYS A 943 -24.517 -10.908 4.530 1.00 0.00 H new ATOM 0 HE2 LYS A 943 -22.813 -10.360 6.984 1.00 0.00 H new ATOM 0 HE3 LYS A 943 -22.111 -10.744 5.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 943 -22.208 -8.570 5.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 943 -23.882 -8.759 4.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 943 -23.266 -8.287 6.349 1.00 0.00 H new ATOM 531 N ALA A 944 -28.105 -10.375 3.345 1.00 0.00 N ATOM 532 CA ALA A 944 -29.085 -11.333 2.883 1.00 0.00 C ATOM 533 C ALA A 944 -28.464 -12.132 1.754 1.00 0.00 C ATOM 534 O ALA A 944 -28.118 -13.302 1.923 1.00 0.00 O ATOM 535 CB ALA A 944 -30.355 -10.629 2.429 1.00 0.00 C ATOM 0 H ALA A 944 -27.648 -9.859 2.593 1.00 0.00 H new ATOM 0 HA ALA A 944 -29.368 -12.004 3.694 1.00 0.00 H new ATOM 0 HB1 ALA A 944 -31.078 -11.369 2.086 1.00 0.00 H new ATOM 0 HB2 ALA A 944 -30.778 -10.068 3.262 1.00 0.00 H new ATOM 0 HB3 ALA A 944 -30.120 -9.945 1.613 1.00 0.00 H new ATOM 541 N SER A 945 -28.280 -11.471 0.617 1.00 0.00 N ATOM 542 CA SER A 945 -27.523 -12.030 -0.490 1.00 0.00 C ATOM 543 C SER A 945 -27.200 -10.928 -1.497 1.00 0.00 C ATOM 544 O SER A 945 -28.024 -10.584 -2.349 1.00 0.00 O ATOM 545 CB SER A 945 -28.293 -13.170 -1.167 1.00 0.00 C ATOM 546 OG SER A 945 -27.448 -13.913 -2.030 1.00 0.00 O ATOM 0 H SER A 945 -28.650 -10.537 0.440 1.00 0.00 H new ATOM 0 HA SER A 945 -26.593 -12.446 -0.102 1.00 0.00 H new ATOM 0 HB2 SER A 945 -28.714 -13.830 -0.408 1.00 0.00 H new ATOM 0 HB3 SER A 945 -29.129 -12.762 -1.734 1.00 0.00 H new ATOM 0 HG SER A 945 -27.962 -14.635 -2.449 1.00 0.00 H new ATOM 552 N ALA A 946 -26.015 -10.348 -1.367 1.00 0.00 N ATOM 553 CA ALA A 946 -25.589 -9.270 -2.251 1.00 0.00 C ATOM 554 C ALA A 946 -24.434 -9.726 -3.130 1.00 0.00 C ATOM 555 O ALA A 946 -24.318 -9.317 -4.285 1.00 0.00 O ATOM 556 CB ALA A 946 -25.188 -8.048 -1.438 1.00 0.00 C ATOM 0 H ALA A 946 -25.330 -10.606 -0.657 1.00 0.00 H new ATOM 0 HA ALA A 946 -26.425 -9.000 -2.896 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -24.872 -7.251 -2.111 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -26.039 -7.708 -0.848 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -24.365 -8.308 -0.772 1.00 0.00 H new ATOM 562 N GLY A 947 -23.586 -10.572 -2.574 1.00 0.00 N ATOM 563 CA GLY A 947 -22.451 -11.084 -3.305 1.00 0.00 C ATOM 564 C GLY A 947 -21.423 -11.699 -2.381 1.00 0.00 C ATOM 565 O GLY A 947 -21.096 -11.114 -1.347 1.00 0.00 O ATOM 0 H GLY A 947 -23.666 -10.917 -1.617 1.00 0.00 H new ATOM 0 HA2 GLY A 947 -22.788 -11.831 -4.024 1.00 0.00 H new ATOM 0 HA3 GLY A 947 -21.991 -10.277 -3.876 1.00 0.00 H new ATOM 569 N PRO A 948 -20.922 -12.896 -2.710 1.00 0.00 N ATOM 570 CA PRO A 948 -19.907 -13.581 -1.906 1.00 0.00 C ATOM 571 C PRO A 948 -18.554 -12.874 -1.960 1.00 0.00 C ATOM 572 O PRO A 948 -17.775 -13.079 -2.896 1.00 0.00 O ATOM 573 CB PRO A 948 -19.811 -14.978 -2.539 1.00 0.00 C ATOM 574 CG PRO A 948 -20.991 -15.090 -3.447 1.00 0.00 C ATOM 575 CD PRO A 948 -21.311 -13.690 -3.881 1.00 0.00 C ATOM 0 HA PRO A 948 -20.178 -13.604 -0.850 1.00 0.00 H new ATOM 0 HB2 PRO A 948 -18.879 -15.095 -3.092 1.00 0.00 H new ATOM 0 HB3 PRO A 948 -19.829 -15.756 -1.776 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -20.765 -15.723 -4.305 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -21.838 -15.543 -2.932 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -20.750 -13.403 -4.770 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -22.368 -13.571 -4.119 1.00 0.00 H new ATOM 583 N GLN A 949 -18.304 -12.029 -0.959 1.00 0.00 N ATOM 584 CA GLN A 949 -17.066 -11.252 -0.852 1.00 0.00 C ATOM 585 C GLN A 949 -16.935 -10.239 -1.989 1.00 0.00 C ATOM 586 O GLN A 949 -16.541 -10.582 -3.104 1.00 0.00 O ATOM 587 CB GLN A 949 -15.837 -12.165 -0.823 1.00 0.00 C ATOM 588 CG GLN A 949 -15.773 -13.061 0.401 1.00 0.00 C ATOM 589 CD GLN A 949 -14.574 -13.985 0.383 1.00 0.00 C ATOM 590 OE1 GLN A 949 -13.523 -13.653 -0.168 1.00 0.00 O ATOM 591 NE2 GLN A 949 -14.722 -15.153 0.982 1.00 0.00 N ATOM 0 H GLN A 949 -18.958 -11.863 -0.194 1.00 0.00 H new ATOM 0 HA GLN A 949 -17.117 -10.705 0.089 1.00 0.00 H new ATOM 0 HB2 GLN A 949 -15.836 -12.787 -1.718 1.00 0.00 H new ATOM 0 HB3 GLN A 949 -14.938 -11.550 -0.860 1.00 0.00 H new ATOM 0 HG2 GLN A 949 -15.737 -12.443 1.298 1.00 0.00 H new ATOM 0 HG3 GLN A 949 -16.685 -13.656 0.460 1.00 0.00 H new ATOM 0 HE21 GLN A 949 -15.609 -15.389 1.427 1.00 0.00 H new ATOM 0 HE22 GLN A 949 -13.949 -15.819 1.000 1.00 0.00 H new ATOM 600 N PRO A 950 -17.279 -8.972 -1.723 1.00 0.00 N ATOM 601 CA PRO A 950 -17.117 -7.892 -2.699 1.00 0.00 C ATOM 602 C PRO A 950 -15.644 -7.632 -3.010 1.00 0.00 C ATOM 603 O PRO A 950 -14.752 -8.137 -2.317 1.00 0.00 O ATOM 604 CB PRO A 950 -17.756 -6.678 -2.014 1.00 0.00 C ATOM 605 CG PRO A 950 -17.744 -7.001 -0.559 1.00 0.00 C ATOM 606 CD PRO A 950 -17.866 -8.495 -0.458 1.00 0.00 C ATOM 0 HA PRO A 950 -17.578 -8.129 -3.658 1.00 0.00 H new ATOM 0 HB2 PRO A 950 -17.193 -5.768 -2.220 1.00 0.00 H new ATOM 0 HB3 PRO A 950 -18.772 -6.513 -2.373 1.00 0.00 H new ATOM 0 HG2 PRO A 950 -16.823 -6.654 -0.091 1.00 0.00 H new ATOM 0 HG3 PRO A 950 -18.569 -6.508 -0.044 1.00 0.00 H new ATOM 0 HD2 PRO A 950 -17.328 -8.885 0.406 1.00 0.00 H new ATOM 0 HD3 PRO A 950 -18.905 -8.807 -0.354 1.00 0.00 H new ATOM 614 N LEU A 951 -15.391 -6.837 -4.045 1.00 0.00 N ATOM 615 CA LEU A 951 -14.027 -6.569 -4.499 1.00 0.00 C ATOM 616 C LEU A 951 -13.176 -5.963 -3.390 1.00 0.00 C ATOM 617 O LEU A 951 -12.001 -6.306 -3.251 1.00 0.00 O ATOM 618 CB LEU A 951 -14.027 -5.643 -5.722 1.00 0.00 C ATOM 619 CG LEU A 951 -14.257 -6.332 -7.075 1.00 0.00 C ATOM 620 CD1 LEU A 951 -13.202 -7.401 -7.321 1.00 0.00 C ATOM 621 CD2 LEU A 951 -15.653 -6.932 -7.150 1.00 0.00 C ATOM 0 H LEU A 951 -16.114 -6.365 -4.588 1.00 0.00 H new ATOM 0 HA LEU A 951 -13.589 -7.526 -4.781 1.00 0.00 H new ATOM 0 HB2 LEU A 951 -14.800 -4.887 -5.583 1.00 0.00 H new ATOM 0 HB3 LEU A 951 -13.072 -5.119 -5.759 1.00 0.00 H new ATOM 0 HG LEU A 951 -14.170 -5.577 -7.856 1.00 0.00 H new ATOM 0 HD11 LEU A 951 -13.384 -7.877 -8.285 1.00 0.00 H new ATOM 0 HD12 LEU A 951 -12.213 -6.943 -7.323 1.00 0.00 H new ATOM 0 HD13 LEU A 951 -13.253 -8.151 -6.531 1.00 0.00 H new ATOM 0 HD21 LEU A 951 -15.790 -7.414 -8.118 1.00 0.00 H new ATOM 0 HD22 LEU A 951 -15.775 -7.670 -6.357 1.00 0.00 H new ATOM 0 HD23 LEU A 951 -16.395 -6.143 -7.029 1.00 0.00 H new ATOM 633 N LEU A 952 -13.769 -5.073 -2.601 1.00 0.00 N ATOM 634 CA LEU A 952 -13.068 -4.462 -1.478 1.00 0.00 C ATOM 635 C LEU A 952 -12.577 -5.522 -0.502 1.00 0.00 C ATOM 636 O LEU A 952 -11.383 -5.624 -0.245 1.00 0.00 O ATOM 637 CB LEU A 952 -13.969 -3.462 -0.747 1.00 0.00 C ATOM 638 CG LEU A 952 -14.257 -2.170 -1.510 1.00 0.00 C ATOM 639 CD1 LEU A 952 -15.151 -1.254 -0.690 1.00 0.00 C ATOM 640 CD2 LEU A 952 -12.956 -1.466 -1.863 1.00 0.00 C ATOM 0 H LEU A 952 -14.732 -4.759 -2.719 1.00 0.00 H new ATOM 0 HA LEU A 952 -12.207 -3.928 -1.880 1.00 0.00 H new ATOM 0 HB2 LEU A 952 -14.917 -3.950 -0.519 1.00 0.00 H new ATOM 0 HB3 LEU A 952 -13.504 -3.207 0.206 1.00 0.00 H new ATOM 0 HG LEU A 952 -14.779 -2.422 -2.433 1.00 0.00 H new ATOM 0 HD11 LEU A 952 -15.345 -0.339 -1.249 1.00 0.00 H new ATOM 0 HD12 LEU A 952 -16.094 -1.758 -0.480 1.00 0.00 H new ATOM 0 HD13 LEU A 952 -14.655 -1.007 0.249 1.00 0.00 H new ATOM 0 HD21 LEU A 952 -13.175 -0.547 -2.406 1.00 0.00 H new ATOM 0 HD22 LEU A 952 -12.412 -1.226 -0.949 1.00 0.00 H new ATOM 0 HD23 LEU A 952 -12.346 -2.120 -2.487 1.00 0.00 H new ATOM 652 N VAL A 953 -13.504 -6.327 0.009 1.00 0.00 N ATOM 653 CA VAL A 953 -13.180 -7.345 1.008 1.00 0.00 C ATOM 654 C VAL A 953 -12.088 -8.291 0.510 1.00 0.00 C ATOM 655 O VAL A 953 -11.151 -8.614 1.243 1.00 0.00 O ATOM 656 CB VAL A 953 -14.435 -8.157 1.404 1.00 0.00 C ATOM 657 CG1 VAL A 953 -14.072 -9.332 2.301 1.00 0.00 C ATOM 658 CG2 VAL A 953 -15.447 -7.258 2.098 1.00 0.00 C ATOM 0 H VAL A 953 -14.489 -6.295 -0.252 1.00 0.00 H new ATOM 0 HA VAL A 953 -12.808 -6.821 1.888 1.00 0.00 H new ATOM 0 HB VAL A 953 -14.880 -8.555 0.492 1.00 0.00 H new ATOM 0 HG11 VAL A 953 -14.975 -9.883 2.562 1.00 0.00 H new ATOM 0 HG12 VAL A 953 -13.383 -9.993 1.774 1.00 0.00 H new ATOM 0 HG13 VAL A 953 -13.597 -8.963 3.210 1.00 0.00 H new ATOM 0 HG21 VAL A 953 -16.326 -7.842 2.371 1.00 0.00 H new ATOM 0 HG22 VAL A 953 -15.000 -6.833 2.997 1.00 0.00 H new ATOM 0 HG23 VAL A 953 -15.742 -6.454 1.424 1.00 0.00 H new ATOM 668 N GLN A 954 -12.198 -8.714 -0.744 1.00 0.00 N ATOM 669 CA GLN A 954 -11.207 -9.609 -1.334 1.00 0.00 C ATOM 670 C GLN A 954 -9.839 -8.936 -1.410 1.00 0.00 C ATOM 671 O GLN A 954 -8.836 -9.501 -0.970 1.00 0.00 O ATOM 672 CB GLN A 954 -11.650 -10.062 -2.726 1.00 0.00 C ATOM 673 CG GLN A 954 -12.858 -10.984 -2.711 1.00 0.00 C ATOM 674 CD GLN A 954 -13.205 -11.510 -4.089 1.00 0.00 C ATOM 675 OE1 GLN A 954 -12.698 -12.546 -4.515 1.00 0.00 O ATOM 676 NE2 GLN A 954 -14.081 -10.809 -4.789 1.00 0.00 N ATOM 0 H GLN A 954 -12.960 -8.454 -1.370 1.00 0.00 H new ATOM 0 HA GLN A 954 -11.123 -10.485 -0.691 1.00 0.00 H new ATOM 0 HB2 GLN A 954 -11.882 -9.183 -3.328 1.00 0.00 H new ATOM 0 HB3 GLN A 954 -10.820 -10.573 -3.214 1.00 0.00 H new ATOM 0 HG2 GLN A 954 -12.662 -11.824 -2.044 1.00 0.00 H new ATOM 0 HG3 GLN A 954 -13.715 -10.448 -2.304 1.00 0.00 H new ATOM 0 HE21 GLN A 954 -14.479 -9.954 -4.399 1.00 0.00 H new ATOM 0 HE22 GLN A 954 -14.359 -11.123 -5.719 1.00 0.00 H new ATOM 685 N SER A 955 -9.808 -7.723 -1.944 1.00 0.00 N ATOM 686 CA SER A 955 -8.560 -6.994 -2.111 1.00 0.00 C ATOM 687 C SER A 955 -7.943 -6.644 -0.756 1.00 0.00 C ATOM 688 O SER A 955 -6.731 -6.743 -0.578 1.00 0.00 O ATOM 689 CB SER A 955 -8.800 -5.727 -2.930 1.00 0.00 C ATOM 690 OG SER A 955 -9.429 -6.034 -4.166 1.00 0.00 O ATOM 0 H SER A 955 -10.635 -7.223 -2.269 1.00 0.00 H new ATOM 0 HA SER A 955 -7.858 -7.634 -2.645 1.00 0.00 H new ATOM 0 HB2 SER A 955 -9.422 -5.035 -2.363 1.00 0.00 H new ATOM 0 HB3 SER A 955 -7.851 -5.224 -3.115 1.00 0.00 H new ATOM 0 HG SER A 955 -10.389 -6.169 -4.020 1.00 0.00 H new ATOM 696 N CYS A 956 -8.786 -6.259 0.197 1.00 0.00 N ATOM 697 CA CYS A 956 -8.327 -5.885 1.531 1.00 0.00 C ATOM 698 C CYS A 956 -7.559 -7.016 2.203 1.00 0.00 C ATOM 699 O CYS A 956 -6.478 -6.799 2.749 1.00 0.00 O ATOM 700 CB CYS A 956 -9.508 -5.470 2.406 1.00 0.00 C ATOM 701 SG CYS A 956 -10.237 -3.883 1.952 1.00 0.00 S ATOM 0 H CYS A 956 -9.796 -6.198 0.069 1.00 0.00 H new ATOM 0 HA CYS A 956 -7.649 -5.040 1.415 1.00 0.00 H new ATOM 0 HB2 CYS A 956 -10.277 -6.241 2.350 1.00 0.00 H new ATOM 0 HB3 CYS A 956 -9.179 -5.423 3.444 1.00 0.00 H new ATOM 0 HG CYS A 956 -9.404 -3.221 1.205 1.00 0.00 H new ATOM 707 N LYS A 957 -8.109 -8.223 2.164 1.00 0.00 N ATOM 708 CA LYS A 957 -7.463 -9.364 2.803 1.00 0.00 C ATOM 709 C LYS A 957 -6.162 -9.710 2.084 1.00 0.00 C ATOM 710 O LYS A 957 -5.209 -10.185 2.701 1.00 0.00 O ATOM 711 CB LYS A 957 -8.397 -10.574 2.832 1.00 0.00 C ATOM 712 CG LYS A 957 -9.701 -10.318 3.572 1.00 0.00 C ATOM 713 CD LYS A 957 -10.546 -11.581 3.725 1.00 0.00 C ATOM 714 CE LYS A 957 -11.031 -12.136 2.389 1.00 0.00 C ATOM 715 NZ LYS A 957 -9.977 -12.904 1.672 1.00 0.00 N ATOM 0 H LYS A 957 -8.993 -8.437 1.701 1.00 0.00 H new ATOM 0 HA LYS A 957 -7.230 -9.091 3.832 1.00 0.00 H new ATOM 0 HB2 LYS A 957 -8.622 -10.873 1.808 1.00 0.00 H new ATOM 0 HB3 LYS A 957 -7.880 -11.411 3.302 1.00 0.00 H new ATOM 0 HG2 LYS A 957 -9.481 -9.911 4.559 1.00 0.00 H new ATOM 0 HG3 LYS A 957 -10.276 -9.563 3.037 1.00 0.00 H new ATOM 0 HD2 LYS A 957 -9.961 -12.344 4.239 1.00 0.00 H new ATOM 0 HD3 LYS A 957 -11.407 -11.362 4.356 1.00 0.00 H new ATOM 0 HE2 LYS A 957 -11.893 -12.781 2.559 1.00 0.00 H new ATOM 0 HE3 LYS A 957 -11.368 -11.313 1.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 957 -9.633 -12.349 0.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 957 -9.187 -13.097 2.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 957 -10.373 -13.803 1.332 1.00 0.00 H new ATOM 729 N ALA A 958 -6.125 -9.446 0.783 1.00 0.00 N ATOM 730 CA ALA A 958 -4.928 -9.682 -0.014 1.00 0.00 C ATOM 731 C ALA A 958 -3.835 -8.683 0.350 1.00 0.00 C ATOM 732 O ALA A 958 -2.683 -9.059 0.587 1.00 0.00 O ATOM 733 CB ALA A 958 -5.257 -9.591 -1.496 1.00 0.00 C ATOM 0 H ALA A 958 -6.913 -9.067 0.257 1.00 0.00 H new ATOM 0 HA ALA A 958 -4.561 -10.685 0.202 1.00 0.00 H new ATOM 0 HB1 ALA A 958 -4.354 -9.769 -2.081 1.00 0.00 H new ATOM 0 HB2 ALA A 958 -6.007 -10.340 -1.749 1.00 0.00 H new ATOM 0 HB3 ALA A 958 -5.646 -8.598 -1.722 1.00 0.00 H new ATOM 739 N VAL A 959 -4.205 -7.408 0.404 1.00 0.00 N ATOM 740 CA VAL A 959 -3.274 -6.346 0.771 1.00 0.00 C ATOM 741 C VAL A 959 -2.751 -6.555 2.190 1.00 0.00 C ATOM 742 O VAL A 959 -1.574 -6.325 2.470 1.00 0.00 O ATOM 743 CB VAL A 959 -3.940 -4.954 0.661 1.00 0.00 C ATOM 744 CG1 VAL A 959 -3.006 -3.857 1.147 1.00 0.00 C ATOM 745 CG2 VAL A 959 -4.372 -4.684 -0.771 1.00 0.00 C ATOM 0 H VAL A 959 -5.149 -7.083 0.197 1.00 0.00 H new ATOM 0 HA VAL A 959 -2.438 -6.386 0.072 1.00 0.00 H new ATOM 0 HB VAL A 959 -4.822 -4.953 1.301 1.00 0.00 H new ATOM 0 HG11 VAL A 959 -3.502 -2.891 1.057 1.00 0.00 H new ATOM 0 HG12 VAL A 959 -2.746 -4.036 2.190 1.00 0.00 H new ATOM 0 HG13 VAL A 959 -2.099 -3.857 0.542 1.00 0.00 H new ATOM 0 HG21 VAL A 959 -4.839 -3.701 -0.831 1.00 0.00 H new ATOM 0 HG22 VAL A 959 -3.501 -4.713 -1.425 1.00 0.00 H new ATOM 0 HG23 VAL A 959 -5.087 -5.445 -1.085 1.00 0.00 H new ATOM 755 N ALA A 960 -3.626 -7.032 3.068 1.00 0.00 N ATOM 756 CA ALA A 960 -3.278 -7.265 4.467 1.00 0.00 C ATOM 757 C ALA A 960 -2.154 -8.289 4.606 1.00 0.00 C ATOM 758 O ALA A 960 -1.448 -8.311 5.615 1.00 0.00 O ATOM 759 CB ALA A 960 -4.502 -7.719 5.247 1.00 0.00 C ATOM 0 H ALA A 960 -4.590 -7.267 2.834 1.00 0.00 H new ATOM 0 HA ALA A 960 -2.920 -6.322 4.880 1.00 0.00 H new ATOM 0 HB1 ALA A 960 -4.228 -7.889 6.288 1.00 0.00 H new ATOM 0 HB2 ALA A 960 -5.272 -6.949 5.196 1.00 0.00 H new ATOM 0 HB3 ALA A 960 -4.885 -8.645 4.817 1.00 0.00 H new ATOM 765 N GLU A 961 -1.990 -9.130 3.594 1.00 0.00 N ATOM 766 CA GLU A 961 -0.929 -10.131 3.589 1.00 0.00 C ATOM 767 C GLU A 961 0.390 -9.532 3.109 1.00 0.00 C ATOM 768 O GLU A 961 1.466 -10.026 3.444 1.00 0.00 O ATOM 769 CB GLU A 961 -1.318 -11.313 2.700 1.00 0.00 C ATOM 770 CG GLU A 961 -2.426 -12.172 3.280 1.00 0.00 C ATOM 771 CD GLU A 961 -2.000 -12.873 4.551 1.00 0.00 C ATOM 772 OE1 GLU A 961 -1.338 -13.927 4.459 1.00 0.00 O ATOM 773 OE2 GLU A 961 -2.315 -12.373 5.652 1.00 0.00 O ATOM 0 H GLU A 961 -2.580 -9.140 2.762 1.00 0.00 H new ATOM 0 HA GLU A 961 -0.794 -10.482 4.612 1.00 0.00 H new ATOM 0 HB2 GLU A 961 -1.634 -10.936 1.727 1.00 0.00 H new ATOM 0 HB3 GLU A 961 -0.439 -11.935 2.531 1.00 0.00 H new ATOM 0 HG2 GLU A 961 -3.297 -11.549 3.485 1.00 0.00 H new ATOM 0 HG3 GLU A 961 -2.732 -12.914 2.543 1.00 0.00 H new ATOM 780 N GLN A 962 0.303 -8.459 2.341 1.00 0.00 N ATOM 781 CA GLN A 962 1.490 -7.824 1.779 1.00 0.00 C ATOM 782 C GLN A 962 2.061 -6.780 2.735 1.00 0.00 C ATOM 783 O GLN A 962 3.249 -6.460 2.673 1.00 0.00 O ATOM 784 CB GLN A 962 1.159 -7.178 0.432 1.00 0.00 C ATOM 785 CG GLN A 962 0.744 -8.172 -0.641 1.00 0.00 C ATOM 786 CD GLN A 962 1.860 -9.124 -1.036 1.00 0.00 C ATOM 787 OE1 GLN A 962 3.098 -8.650 -1.001 1.00 0.00 O flip ATOM 788 NE2 GLN A 962 1.609 -10.276 -1.390 1.00 0.00 N flip ATOM 0 H GLN A 962 -0.576 -8.007 2.090 1.00 0.00 H new ATOM 0 HA GLN A 962 2.245 -8.596 1.628 1.00 0.00 H new ATOM 0 HB2 GLN A 962 0.356 -6.455 0.574 1.00 0.00 H new ATOM 0 HB3 GLN A 962 2.029 -6.623 0.082 1.00 0.00 H new ATOM 0 HG2 GLN A 962 -0.108 -8.750 -0.283 1.00 0.00 H new ATOM 0 HG3 GLN A 962 0.411 -7.626 -1.524 1.00 0.00 H new ATOM 0 HE21 GLN A 962 0.644 -10.606 -1.404 1.00 0.00 H new ATOM 0 HE22 GLN A 962 2.366 -10.900 -1.669 1.00 0.00 H new ATOM 797 N ILE A 963 1.211 -6.261 3.616 1.00 0.00 N ATOM 798 CA ILE A 963 1.625 -5.257 4.600 1.00 0.00 C ATOM 799 C ILE A 963 2.805 -5.742 5.463 1.00 0.00 C ATOM 800 O ILE A 963 3.834 -5.067 5.525 1.00 0.00 O ATOM 801 CB ILE A 963 0.448 -4.834 5.515 1.00 0.00 C ATOM 802 CG1 ILE A 963 -0.661 -4.184 4.683 1.00 0.00 C ATOM 803 CG2 ILE A 963 0.926 -3.880 6.605 1.00 0.00 C ATOM 804 CD1 ILE A 963 -1.879 -3.788 5.491 1.00 0.00 C ATOM 0 H ILE A 963 0.226 -6.519 3.671 1.00 0.00 H new ATOM 0 HA ILE A 963 1.954 -4.389 4.028 1.00 0.00 H new ATOM 0 HB ILE A 963 0.048 -5.726 5.996 1.00 0.00 H new ATOM 0 HG12 ILE A 963 -0.260 -3.299 4.189 1.00 0.00 H new ATOM 0 HG13 ILE A 963 -0.966 -4.876 3.898 1.00 0.00 H new ATOM 0 HG21 ILE A 963 0.083 -3.596 7.235 1.00 0.00 H new ATOM 0 HG22 ILE A 963 1.684 -4.373 7.213 1.00 0.00 H new ATOM 0 HG23 ILE A 963 1.353 -2.988 6.146 1.00 0.00 H new ATOM 0 HD11 ILE A 963 -2.620 -3.335 4.833 1.00 0.00 H new ATOM 0 HD12 ILE A 963 -2.306 -4.673 5.963 1.00 0.00 H new ATOM 0 HD13 ILE A 963 -1.589 -3.071 6.259 1.00 0.00 H new ATOM 816 N PRO A 964 2.691 -6.914 6.134 1.00 0.00 N ATOM 817 CA PRO A 964 3.782 -7.449 6.955 1.00 0.00 C ATOM 818 C PRO A 964 5.048 -7.680 6.141 1.00 0.00 C ATOM 819 O PRO A 964 6.157 -7.510 6.641 1.00 0.00 O ATOM 820 CB PRO A 964 3.234 -8.782 7.486 1.00 0.00 C ATOM 821 CG PRO A 964 2.085 -9.111 6.601 1.00 0.00 C ATOM 822 CD PRO A 964 1.513 -7.795 6.166 1.00 0.00 C ATOM 0 HA PRO A 964 4.067 -6.756 7.747 1.00 0.00 H new ATOM 0 HB2 PRO A 964 3.994 -9.562 7.451 1.00 0.00 H new ATOM 0 HB3 PRO A 964 2.918 -8.692 8.525 1.00 0.00 H new ATOM 0 HG2 PRO A 964 2.409 -9.699 5.742 1.00 0.00 H new ATOM 0 HG3 PRO A 964 1.340 -9.705 7.132 1.00 0.00 H new ATOM 0 HD2 PRO A 964 1.036 -7.866 5.189 1.00 0.00 H new ATOM 0 HD3 PRO A 964 0.758 -7.433 6.864 1.00 0.00 H new ATOM 830 N LEU A 965 4.870 -8.045 4.874 1.00 0.00 N ATOM 831 CA LEU A 965 5.995 -8.288 3.983 1.00 0.00 C ATOM 832 C LEU A 965 6.762 -6.999 3.729 1.00 0.00 C ATOM 833 O LEU A 965 7.994 -6.999 3.676 1.00 0.00 O ATOM 834 CB LEU A 965 5.515 -8.891 2.660 1.00 0.00 C ATOM 835 CG LEU A 965 4.850 -10.262 2.785 1.00 0.00 C ATOM 836 CD1 LEU A 965 4.465 -10.796 1.416 1.00 0.00 C ATOM 837 CD2 LEU A 965 5.776 -11.234 3.498 1.00 0.00 C ATOM 0 H LEU A 965 3.955 -8.178 4.443 1.00 0.00 H new ATOM 0 HA LEU A 965 6.664 -9.001 4.464 1.00 0.00 H new ATOM 0 HB2 LEU A 965 4.809 -8.201 2.197 1.00 0.00 H new ATOM 0 HB3 LEU A 965 6.367 -8.976 1.985 1.00 0.00 H new ATOM 0 HG LEU A 965 3.941 -10.154 3.376 1.00 0.00 H new ATOM 0 HD11 LEU A 965 3.993 -11.772 1.526 1.00 0.00 H new ATOM 0 HD12 LEU A 965 3.767 -10.107 0.940 1.00 0.00 H new ATOM 0 HD13 LEU A 965 5.358 -10.892 0.799 1.00 0.00 H new ATOM 0 HD21 LEU A 965 5.290 -12.206 3.580 1.00 0.00 H new ATOM 0 HD22 LEU A 965 6.701 -11.338 2.931 1.00 0.00 H new ATOM 0 HD23 LEU A 965 6.002 -10.856 4.495 1.00 0.00 H new ATOM 849 N LEU A 966 6.030 -5.899 3.584 1.00 0.00 N ATOM 850 CA LEU A 966 6.647 -4.589 3.443 1.00 0.00 C ATOM 851 C LEU A 966 7.483 -4.274 4.669 1.00 0.00 C ATOM 852 O LEU A 966 8.694 -4.098 4.577 1.00 0.00 O ATOM 853 CB LEU A 966 5.594 -3.492 3.277 1.00 0.00 C ATOM 854 CG LEU A 966 4.775 -3.539 1.993 1.00 0.00 C ATOM 855 CD1 LEU A 966 3.776 -2.394 1.984 1.00 0.00 C ATOM 856 CD2 LEU A 966 5.681 -3.465 0.774 1.00 0.00 C ATOM 0 H LEU A 966 5.010 -5.891 3.561 1.00 0.00 H new ATOM 0 HA LEU A 966 7.275 -4.616 2.552 1.00 0.00 H new ATOM 0 HB2 LEU A 966 4.909 -3.543 4.123 1.00 0.00 H new ATOM 0 HB3 LEU A 966 6.094 -2.525 3.330 1.00 0.00 H new ATOM 0 HG LEU A 966 4.235 -4.485 1.953 1.00 0.00 H new ATOM 0 HD11 LEU A 966 3.191 -2.429 1.065 1.00 0.00 H new ATOM 0 HD12 LEU A 966 3.110 -2.486 2.842 1.00 0.00 H new ATOM 0 HD13 LEU A 966 4.310 -1.445 2.039 1.00 0.00 H new ATOM 0 HD21 LEU A 966 5.076 -3.500 -0.132 1.00 0.00 H new ATOM 0 HD22 LEU A 966 6.246 -2.533 0.797 1.00 0.00 H new ATOM 0 HD23 LEU A 966 6.371 -4.308 0.782 1.00 0.00 H new ATOM 868 N VAL A 967 6.822 -4.248 5.818 1.00 0.00 N ATOM 869 CA VAL A 967 7.449 -3.842 7.067 1.00 0.00 C ATOM 870 C VAL A 967 8.615 -4.760 7.435 1.00 0.00 C ATOM 871 O VAL A 967 9.656 -4.289 7.891 1.00 0.00 O ATOM 872 CB VAL A 967 6.419 -3.807 8.213 1.00 0.00 C ATOM 873 CG1 VAL A 967 7.043 -3.272 9.492 1.00 0.00 C ATOM 874 CG2 VAL A 967 5.224 -2.962 7.805 1.00 0.00 C ATOM 0 H VAL A 967 5.840 -4.507 5.910 1.00 0.00 H new ATOM 0 HA VAL A 967 7.844 -2.837 6.919 1.00 0.00 H new ATOM 0 HB VAL A 967 6.083 -4.825 8.409 1.00 0.00 H new ATOM 0 HG11 VAL A 967 6.294 -3.258 10.284 1.00 0.00 H new ATOM 0 HG12 VAL A 967 7.873 -3.914 9.788 1.00 0.00 H new ATOM 0 HG13 VAL A 967 7.410 -2.260 9.322 1.00 0.00 H new ATOM 0 HG21 VAL A 967 4.499 -2.940 8.619 1.00 0.00 H new ATOM 0 HG22 VAL A 967 5.554 -1.947 7.586 1.00 0.00 H new ATOM 0 HG23 VAL A 967 4.760 -3.392 6.917 1.00 0.00 H new ATOM 884 N GLN A 968 8.451 -6.063 7.217 1.00 0.00 N ATOM 885 CA GLN A 968 9.531 -7.013 7.466 1.00 0.00 C ATOM 886 C GLN A 968 10.728 -6.673 6.586 1.00 0.00 C ATOM 887 O GLN A 968 11.879 -6.736 7.023 1.00 0.00 O ATOM 888 CB GLN A 968 9.078 -8.447 7.189 1.00 0.00 C ATOM 889 CG GLN A 968 10.075 -9.498 7.652 1.00 0.00 C ATOM 890 CD GLN A 968 9.730 -10.895 7.175 1.00 0.00 C ATOM 891 OE1 GLN A 968 8.562 -11.221 6.950 1.00 0.00 O ATOM 892 NE2 GLN A 968 10.742 -11.733 7.024 1.00 0.00 N ATOM 0 H GLN A 968 7.588 -6.482 6.871 1.00 0.00 H new ATOM 0 HA GLN A 968 9.814 -6.941 8.516 1.00 0.00 H new ATOM 0 HB2 GLN A 968 8.123 -8.620 7.685 1.00 0.00 H new ATOM 0 HB3 GLN A 968 8.908 -8.566 6.119 1.00 0.00 H new ATOM 0 HG2 GLN A 968 11.068 -9.232 7.291 1.00 0.00 H new ATOM 0 HG3 GLN A 968 10.120 -9.493 8.741 1.00 0.00 H new ATOM 0 HE21 GLN A 968 11.694 -11.424 7.221 1.00 0.00 H new ATOM 0 HE22 GLN A 968 10.571 -12.688 6.711 1.00 0.00 H new ATOM 901 N GLY A 969 10.442 -6.304 5.344 1.00 0.00 N ATOM 902 CA GLY A 969 11.488 -5.894 4.429 1.00 0.00 C ATOM 903 C GLY A 969 12.136 -4.594 4.863 1.00 0.00 C ATOM 904 O GLY A 969 13.360 -4.462 4.831 1.00 0.00 O ATOM 0 H GLY A 969 9.500 -6.282 4.953 1.00 0.00 H new ATOM 0 HA2 GLY A 969 12.245 -6.676 4.369 1.00 0.00 H new ATOM 0 HA3 GLY A 969 11.071 -5.776 3.429 1.00 0.00 H new ATOM 908 N VAL A 970 11.311 -3.636 5.279 1.00 0.00 N ATOM 909 CA VAL A 970 11.806 -2.351 5.759 1.00 0.00 C ATOM 910 C VAL A 970 12.719 -2.546 6.965 1.00 0.00 C ATOM 911 O VAL A 970 13.802 -1.973 7.035 1.00 0.00 O ATOM 912 CB VAL A 970 10.663 -1.389 6.159 1.00 0.00 C ATOM 913 CG1 VAL A 970 11.222 -0.016 6.490 1.00 0.00 C ATOM 914 CG2 VAL A 970 9.615 -1.283 5.061 1.00 0.00 C ATOM 0 H VAL A 970 10.295 -3.727 5.293 1.00 0.00 H new ATOM 0 HA VAL A 970 12.358 -1.906 4.931 1.00 0.00 H new ATOM 0 HB VAL A 970 10.177 -1.798 7.045 1.00 0.00 H new ATOM 0 HG11 VAL A 970 10.407 0.651 6.770 1.00 0.00 H new ATOM 0 HG12 VAL A 970 11.924 -0.099 7.320 1.00 0.00 H new ATOM 0 HG13 VAL A 970 11.737 0.387 5.618 1.00 0.00 H new ATOM 0 HG21 VAL A 970 8.827 -0.599 5.375 1.00 0.00 H new ATOM 0 HG22 VAL A 970 10.080 -0.907 4.150 1.00 0.00 H new ATOM 0 HG23 VAL A 970 9.187 -2.267 4.870 1.00 0.00 H new ATOM 924 N ARG A 971 12.279 -3.370 7.911 1.00 0.00 N ATOM 925 CA ARG A 971 13.066 -3.647 9.106 1.00 0.00 C ATOM 926 C ARG A 971 14.326 -4.428 8.750 1.00 0.00 C ATOM 927 O ARG A 971 15.333 -4.355 9.454 1.00 0.00 O ATOM 928 CB ARG A 971 12.238 -4.416 10.135 1.00 0.00 C ATOM 929 CG ARG A 971 11.016 -3.654 10.621 1.00 0.00 C ATOM 930 CD ARG A 971 10.236 -4.449 11.653 1.00 0.00 C ATOM 931 NE ARG A 971 9.892 -5.785 11.168 1.00 0.00 N ATOM 932 CZ ARG A 971 8.674 -6.319 11.235 1.00 0.00 C ATOM 933 NH1 ARG A 971 7.664 -5.628 11.754 1.00 0.00 N ATOM 934 NH2 ARG A 971 8.475 -7.552 10.790 1.00 0.00 N ATOM 0 H ARG A 971 11.383 -3.856 7.873 1.00 0.00 H new ATOM 0 HA ARG A 971 13.361 -2.694 9.545 1.00 0.00 H new ATOM 0 HB2 ARG A 971 11.917 -5.361 9.698 1.00 0.00 H new ATOM 0 HB3 ARG A 971 12.869 -4.658 10.990 1.00 0.00 H new ATOM 0 HG2 ARG A 971 11.327 -2.703 11.053 1.00 0.00 H new ATOM 0 HG3 ARG A 971 10.370 -3.423 9.774 1.00 0.00 H new ATOM 0 HD2 ARG A 971 10.825 -4.535 12.566 1.00 0.00 H new ATOM 0 HD3 ARG A 971 9.324 -3.911 11.912 1.00 0.00 H new ATOM 0 HE ARG A 971 10.635 -6.345 10.750 1.00 0.00 H new ATOM 0 HH11 ARG A 971 7.819 -4.683 12.104 1.00 0.00 H new ATOM 0 HH12 ARG A 971 6.734 -6.043 11.802 1.00 0.00 H new ATOM 0 HH21 ARG A 971 9.252 -8.085 10.400 1.00 0.00 H new ATOM 0 HH22 ARG A 971 7.545 -7.968 10.838 1.00 0.00 H new ATOM 948 N GLY A 972 14.266 -5.169 7.650 1.00 0.00 N ATOM 949 CA GLY A 972 15.445 -5.840 7.141 1.00 0.00 C ATOM 950 C GLY A 972 16.456 -4.845 6.615 1.00 0.00 C ATOM 951 O GLY A 972 17.664 -5.017 6.793 1.00 0.00 O ATOM 0 H GLY A 972 13.419 -5.317 7.101 1.00 0.00 H new ATOM 0 HA2 GLY A 972 15.897 -6.438 7.933 1.00 0.00 H new ATOM 0 HA3 GLY A 972 15.160 -6.528 6.345 1.00 0.00 H new ATOM 955 N SER A 973 15.951 -3.798 5.974 1.00 0.00 N ATOM 956 CA SER A 973 16.783 -2.700 5.508 1.00 0.00 C ATOM 957 C SER A 973 17.328 -1.918 6.702 1.00 0.00 C ATOM 958 O SER A 973 18.441 -1.396 6.663 1.00 0.00 O ATOM 959 CB SER A 973 15.973 -1.782 4.584 1.00 0.00 C ATOM 960 OG SER A 973 16.764 -0.712 4.090 1.00 0.00 O ATOM 0 H SER A 973 14.959 -3.688 5.764 1.00 0.00 H new ATOM 0 HA SER A 973 17.624 -3.102 4.943 1.00 0.00 H new ATOM 0 HB2 SER A 973 15.579 -2.361 3.748 1.00 0.00 H new ATOM 0 HB3 SER A 973 15.116 -1.382 5.127 1.00 0.00 H new ATOM 0 HG SER A 973 16.710 0.047 4.708 1.00 0.00 H new ATOM 966 N GLN A 974 16.537 -1.853 7.772 1.00 0.00 N ATOM 967 CA GLN A 974 16.975 -1.220 9.011 1.00 0.00 C ATOM 968 C GLN A 974 18.129 -2.003 9.628 1.00 0.00 C ATOM 969 O GLN A 974 19.012 -1.433 10.266 1.00 0.00 O ATOM 970 CB GLN A 974 15.824 -1.131 10.016 1.00 0.00 C ATOM 971 CG GLN A 974 14.635 -0.316 9.531 1.00 0.00 C ATOM 972 CD GLN A 974 13.556 -0.191 10.589 1.00 0.00 C ATOM 973 OE1 GLN A 974 13.844 -0.179 11.785 1.00 0.00 O ATOM 974 NE2 GLN A 974 12.306 -0.102 10.162 1.00 0.00 N ATOM 0 H GLN A 974 15.590 -2.231 7.804 1.00 0.00 H new ATOM 0 HA GLN A 974 17.310 -0.211 8.771 1.00 0.00 H new ATOM 0 HB2 GLN A 974 15.486 -2.139 10.255 1.00 0.00 H new ATOM 0 HB3 GLN A 974 16.198 -0.693 10.941 1.00 0.00 H new ATOM 0 HG2 GLN A 974 14.973 0.679 9.240 1.00 0.00 H new ATOM 0 HG3 GLN A 974 14.215 -0.783 8.640 1.00 0.00 H new ATOM 0 HE21 GLN A 974 12.107 -0.115 9.162 1.00 0.00 H new ATOM 0 HE22 GLN A 974 11.542 -0.020 10.833 1.00 0.00 H new ATOM 983 N ALA A 975 18.107 -3.317 9.433 1.00 0.00 N ATOM 984 CA ALA A 975 19.166 -4.180 9.931 1.00 0.00 C ATOM 985 C ALA A 975 20.432 -4.011 9.097 1.00 0.00 C ATOM 986 O ALA A 975 21.484 -3.645 9.622 1.00 0.00 O ATOM 987 CB ALA A 975 18.713 -5.632 9.930 1.00 0.00 C ATOM 0 H ALA A 975 17.365 -3.806 8.932 1.00 0.00 H new ATOM 0 HA ALA A 975 19.392 -3.891 10.957 1.00 0.00 H new ATOM 0 HB1 ALA A 975 19.517 -6.264 10.306 1.00 0.00 H new ATOM 0 HB2 ALA A 975 17.837 -5.740 10.570 1.00 0.00 H new ATOM 0 HB3 ALA A 975 18.459 -5.933 8.914 1.00 0.00 H new ATOM 993 N GLN A 976 20.327 -4.281 7.800 1.00 0.00 N ATOM 994 CA GLN A 976 21.457 -4.129 6.890 1.00 0.00 C ATOM 995 C GLN A 976 20.997 -3.535 5.563 1.00 0.00 C ATOM 996 O GLN A 976 20.540 -4.257 4.675 1.00 0.00 O ATOM 997 CB GLN A 976 22.152 -5.469 6.629 1.00 0.00 C ATOM 998 CG GLN A 976 22.784 -6.096 7.861 1.00 0.00 C ATOM 999 CD GLN A 976 23.645 -7.296 7.520 1.00 0.00 C ATOM 1000 OE1 GLN A 976 24.241 -7.360 6.446 1.00 0.00 O ATOM 1001 NE2 GLN A 976 23.717 -8.255 8.428 1.00 0.00 N ATOM 0 H GLN A 976 19.469 -4.607 7.355 1.00 0.00 H new ATOM 0 HA GLN A 976 22.169 -3.455 7.367 1.00 0.00 H new ATOM 0 HB2 GLN A 976 21.425 -6.167 6.213 1.00 0.00 H new ATOM 0 HB3 GLN A 976 22.924 -5.324 5.873 1.00 0.00 H new ATOM 0 HG2 GLN A 976 23.391 -5.350 8.374 1.00 0.00 H new ATOM 0 HG3 GLN A 976 21.999 -6.400 8.554 1.00 0.00 H new ATOM 0 HE21 GLN A 976 23.208 -8.164 9.307 1.00 0.00 H new ATOM 0 HE22 GLN A 976 24.282 -9.085 8.249 1.00 0.00 H new ATOM 1010 N PRO A 977 21.107 -2.208 5.407 1.00 0.00 N ATOM 1011 CA PRO A 977 20.674 -1.519 4.189 1.00 0.00 C ATOM 1012 C PRO A 977 21.597 -1.790 3.002 1.00 0.00 C ATOM 1013 O PRO A 977 21.221 -1.577 1.849 1.00 0.00 O ATOM 1014 CB PRO A 977 20.722 -0.041 4.581 1.00 0.00 C ATOM 1015 CG PRO A 977 21.728 0.033 5.675 1.00 0.00 C ATOM 1016 CD PRO A 977 21.646 -1.274 6.415 1.00 0.00 C ATOM 0 HA PRO A 977 19.691 -1.855 3.861 1.00 0.00 H new ATOM 0 HB2 PRO A 977 21.012 0.583 3.735 1.00 0.00 H new ATOM 0 HB3 PRO A 977 19.746 0.310 4.917 1.00 0.00 H new ATOM 0 HG2 PRO A 977 22.729 0.190 5.273 1.00 0.00 H new ATOM 0 HG3 PRO A 977 21.517 0.870 6.340 1.00 0.00 H new ATOM 0 HD2 PRO A 977 22.624 -1.593 6.775 1.00 0.00 H new ATOM 0 HD3 PRO A 977 20.993 -1.202 7.285 1.00 0.00 H new ATOM 1024 N ASP A 978 22.799 -2.275 3.288 1.00 0.00 N ATOM 1025 CA ASP A 978 23.785 -2.535 2.245 1.00 0.00 C ATOM 1026 C ASP A 978 23.687 -3.978 1.770 1.00 0.00 C ATOM 1027 O ASP A 978 24.440 -4.410 0.897 1.00 0.00 O ATOM 1028 CB ASP A 978 25.203 -2.257 2.757 1.00 0.00 C ATOM 1029 CG ASP A 978 25.351 -0.871 3.345 1.00 0.00 C ATOM 1030 OD1 ASP A 978 25.603 0.079 2.572 1.00 0.00 O ATOM 1031 OD2 ASP A 978 25.228 -0.720 4.580 1.00 0.00 O ATOM 0 H ASP A 978 23.115 -2.496 4.232 1.00 0.00 H new ATOM 0 HA ASP A 978 23.576 -1.868 1.409 1.00 0.00 H new ATOM 0 HB2 ASP A 978 25.463 -2.998 3.513 1.00 0.00 H new ATOM 0 HB3 ASP A 978 25.911 -2.377 1.937 1.00 0.00 H new ATOM 1036 N SER A 979 22.754 -4.718 2.349 1.00 0.00 N ATOM 1037 CA SER A 979 22.564 -6.115 2.006 1.00 0.00 C ATOM 1038 C SER A 979 21.514 -6.256 0.906 1.00 0.00 C ATOM 1039 O SER A 979 20.358 -5.867 1.087 1.00 0.00 O ATOM 1040 CB SER A 979 22.142 -6.909 3.246 1.00 0.00 C ATOM 1041 OG SER A 979 22.059 -8.298 2.969 1.00 0.00 O ATOM 0 H SER A 979 22.114 -4.370 3.063 1.00 0.00 H new ATOM 0 HA SER A 979 23.508 -6.515 1.636 1.00 0.00 H new ATOM 0 HB2 SER A 979 22.859 -6.739 4.050 1.00 0.00 H new ATOM 0 HB3 SER A 979 21.176 -6.549 3.599 1.00 0.00 H new ATOM 0 HG SER A 979 21.789 -8.778 3.780 1.00 0.00 H new ATOM 1047 N PRO A 980 21.903 -6.815 -0.249 1.00 0.00 N ATOM 1048 CA PRO A 980 20.985 -7.033 -1.372 1.00 0.00 C ATOM 1049 C PRO A 980 19.842 -7.971 -0.997 1.00 0.00 C ATOM 1050 O PRO A 980 18.717 -7.808 -1.466 1.00 0.00 O ATOM 1051 CB PRO A 980 21.867 -7.667 -2.453 1.00 0.00 C ATOM 1052 CG PRO A 980 23.056 -8.193 -1.726 1.00 0.00 C ATOM 1053 CD PRO A 980 23.266 -7.280 -0.554 1.00 0.00 C ATOM 0 HA PRO A 980 20.509 -6.107 -1.694 1.00 0.00 H new ATOM 0 HB2 PRO A 980 21.339 -8.465 -2.974 1.00 0.00 H new ATOM 0 HB3 PRO A 980 22.158 -6.933 -3.205 1.00 0.00 H new ATOM 0 HG2 PRO A 980 22.889 -9.218 -1.396 1.00 0.00 H new ATOM 0 HG3 PRO A 980 23.934 -8.205 -2.372 1.00 0.00 H new ATOM 0 HD2 PRO A 980 23.712 -7.804 0.291 1.00 0.00 H new ATOM 0 HD3 PRO A 980 23.929 -6.451 -0.802 1.00 0.00 H new ATOM 1061 N SER A 981 20.134 -8.931 -0.126 1.00 0.00 N ATOM 1062 CA SER A 981 19.137 -9.893 0.330 1.00 0.00 C ATOM 1063 C SER A 981 17.997 -9.189 1.066 1.00 0.00 C ATOM 1064 O SER A 981 16.837 -9.597 0.979 1.00 0.00 O ATOM 1065 CB SER A 981 19.795 -10.927 1.241 1.00 0.00 C ATOM 1066 OG SER A 981 20.878 -11.569 0.584 1.00 0.00 O ATOM 0 H SER A 981 21.060 -9.064 0.281 1.00 0.00 H new ATOM 0 HA SER A 981 18.718 -10.397 -0.541 1.00 0.00 H new ATOM 0 HB2 SER A 981 20.152 -10.442 2.149 1.00 0.00 H new ATOM 0 HB3 SER A 981 19.058 -11.670 1.546 1.00 0.00 H new ATOM 0 HG SER A 981 21.284 -12.225 1.188 1.00 0.00 H new ATOM 1072 N ALA A 982 18.337 -8.121 1.780 1.00 0.00 N ATOM 1073 CA ALA A 982 17.351 -7.346 2.512 1.00 0.00 C ATOM 1074 C ALA A 982 16.608 -6.403 1.576 1.00 0.00 C ATOM 1075 O ALA A 982 15.386 -6.268 1.656 1.00 0.00 O ATOM 1076 CB ALA A 982 18.021 -6.562 3.631 1.00 0.00 C ATOM 0 H ALA A 982 19.292 -7.774 1.865 1.00 0.00 H new ATOM 0 HA ALA A 982 16.628 -8.034 2.951 1.00 0.00 H new ATOM 0 HB1 ALA A 982 17.270 -5.986 4.171 1.00 0.00 H new ATOM 0 HB2 ALA A 982 18.511 -7.253 4.317 1.00 0.00 H new ATOM 0 HB3 ALA A 982 18.763 -5.885 3.207 1.00 0.00 H new ATOM 1082 N GLN A 983 17.350 -5.764 0.678 1.00 0.00 N ATOM 1083 CA GLN A 983 16.760 -4.814 -0.255 1.00 0.00 C ATOM 1084 C GLN A 983 15.811 -5.501 -1.223 1.00 0.00 C ATOM 1085 O GLN A 983 14.695 -5.035 -1.431 1.00 0.00 O ATOM 1086 CB GLN A 983 17.836 -4.054 -1.029 1.00 0.00 C ATOM 1087 CG GLN A 983 18.588 -3.043 -0.179 1.00 0.00 C ATOM 1088 CD GLN A 983 17.656 -2.142 0.616 1.00 0.00 C ATOM 1089 OE1 GLN A 983 16.535 -1.858 0.198 1.00 0.00 O ATOM 1090 NE2 GLN A 983 18.123 -1.678 1.763 1.00 0.00 N ATOM 0 H GLN A 983 18.358 -5.887 0.577 1.00 0.00 H new ATOM 0 HA GLN A 983 16.189 -4.099 0.337 1.00 0.00 H new ATOM 0 HB2 GLN A 983 18.547 -4.768 -1.446 1.00 0.00 H new ATOM 0 HB3 GLN A 983 17.373 -3.538 -1.870 1.00 0.00 H new ATOM 0 HG2 GLN A 983 19.250 -3.571 0.507 1.00 0.00 H new ATOM 0 HG3 GLN A 983 19.219 -2.430 -0.823 1.00 0.00 H new ATOM 0 HE21 GLN A 983 19.059 -1.937 2.075 1.00 0.00 H new ATOM 0 HE22 GLN A 983 17.547 -1.061 2.336 1.00 0.00 H new ATOM 1099 N LEU A 984 16.242 -6.613 -1.807 1.00 0.00 N ATOM 1100 CA LEU A 984 15.407 -7.338 -2.755 1.00 0.00 C ATOM 1101 C LEU A 984 14.120 -7.804 -2.089 1.00 0.00 C ATOM 1102 O LEU A 984 13.068 -7.836 -2.720 1.00 0.00 O ATOM 1103 CB LEU A 984 16.159 -8.529 -3.356 1.00 0.00 C ATOM 1104 CG LEU A 984 17.356 -8.162 -4.238 1.00 0.00 C ATOM 1105 CD1 LEU A 984 17.970 -9.409 -4.851 1.00 0.00 C ATOM 1106 CD2 LEU A 984 16.940 -7.183 -5.325 1.00 0.00 C ATOM 0 H LEU A 984 17.158 -7.029 -1.642 1.00 0.00 H new ATOM 0 HA LEU A 984 15.152 -6.655 -3.566 1.00 0.00 H new ATOM 0 HB2 LEU A 984 16.508 -9.166 -2.543 1.00 0.00 H new ATOM 0 HB3 LEU A 984 15.459 -9.120 -3.947 1.00 0.00 H new ATOM 0 HG LEU A 984 18.107 -7.681 -3.612 1.00 0.00 H new ATOM 0 HD11 LEU A 984 18.819 -9.128 -5.474 1.00 0.00 H new ATOM 0 HD12 LEU A 984 18.307 -10.076 -4.058 1.00 0.00 H new ATOM 0 HD13 LEU A 984 17.225 -9.919 -5.462 1.00 0.00 H new ATOM 0 HD21 LEU A 984 17.804 -6.935 -5.941 1.00 0.00 H new ATOM 0 HD22 LEU A 984 16.169 -7.637 -5.948 1.00 0.00 H new ATOM 0 HD23 LEU A 984 16.548 -6.275 -4.866 1.00 0.00 H new ATOM 1118 N ALA A 985 14.205 -8.133 -0.806 1.00 0.00 N ATOM 1119 CA ALA A 985 13.029 -8.523 -0.039 1.00 0.00 C ATOM 1120 C ALA A 985 12.049 -7.361 0.062 1.00 0.00 C ATOM 1121 O ALA A 985 10.839 -7.539 -0.086 1.00 0.00 O ATOM 1122 CB ALA A 985 13.427 -9.001 1.349 1.00 0.00 C ATOM 0 H ALA A 985 15.076 -8.137 -0.275 1.00 0.00 H new ATOM 0 HA ALA A 985 12.540 -9.346 -0.559 1.00 0.00 H new ATOM 0 HB1 ALA A 985 12.534 -9.287 1.905 1.00 0.00 H new ATOM 0 HB2 ALA A 985 14.091 -9.861 1.261 1.00 0.00 H new ATOM 0 HB3 ALA A 985 13.941 -8.198 1.877 1.00 0.00 H new ATOM 1128 N LEU A 986 12.582 -6.171 0.309 1.00 0.00 N ATOM 1129 CA LEU A 986 11.770 -4.962 0.407 1.00 0.00 C ATOM 1130 C LEU A 986 11.204 -4.603 -0.972 1.00 0.00 C ATOM 1131 O LEU A 986 9.998 -4.403 -1.132 1.00 0.00 O ATOM 1132 CB LEU A 986 12.623 -3.806 0.951 1.00 0.00 C ATOM 1133 CG LEU A 986 11.885 -2.762 1.802 1.00 0.00 C ATOM 1134 CD1 LEU A 986 12.862 -1.715 2.314 1.00 0.00 C ATOM 1135 CD2 LEU A 986 10.766 -2.095 1.018 1.00 0.00 C ATOM 0 H LEU A 986 13.581 -6.016 0.446 1.00 0.00 H new ATOM 0 HA LEU A 986 10.940 -5.139 1.091 1.00 0.00 H new ATOM 0 HB2 LEU A 986 13.430 -4.228 1.550 1.00 0.00 H new ATOM 0 HB3 LEU A 986 13.086 -3.295 0.107 1.00 0.00 H new ATOM 0 HG LEU A 986 11.437 -3.280 2.650 1.00 0.00 H new ATOM 0 HD11 LEU A 986 12.326 -0.981 2.916 1.00 0.00 H new ATOM 0 HD12 LEU A 986 13.625 -2.197 2.925 1.00 0.00 H new ATOM 0 HD13 LEU A 986 13.336 -1.215 1.469 1.00 0.00 H new ATOM 0 HD21 LEU A 986 10.265 -1.362 1.651 1.00 0.00 H new ATOM 0 HD22 LEU A 986 11.182 -1.595 0.143 1.00 0.00 H new ATOM 0 HD23 LEU A 986 10.047 -2.849 0.697 1.00 0.00 H new ATOM 1147 N ILE A 987 12.091 -4.547 -1.960 1.00 0.00 N ATOM 1148 CA ILE A 987 11.726 -4.176 -3.325 1.00 0.00 C ATOM 1149 C ILE A 987 10.656 -5.109 -3.891 1.00 0.00 C ATOM 1150 O ILE A 987 9.613 -4.652 -4.364 1.00 0.00 O ATOM 1151 CB ILE A 987 12.967 -4.192 -4.252 1.00 0.00 C ATOM 1152 CG1 ILE A 987 14.009 -3.183 -3.755 1.00 0.00 C ATOM 1153 CG2 ILE A 987 12.569 -3.886 -5.690 1.00 0.00 C ATOM 1154 CD1 ILE A 987 15.357 -3.304 -4.437 1.00 0.00 C ATOM 0 H ILE A 987 13.082 -4.757 -1.839 1.00 0.00 H new ATOM 0 HA ILE A 987 11.321 -3.165 -3.285 1.00 0.00 H new ATOM 0 HB ILE A 987 13.406 -5.189 -4.227 1.00 0.00 H new ATOM 0 HG12 ILE A 987 13.625 -2.174 -3.908 1.00 0.00 H new ATOM 0 HG13 ILE A 987 14.143 -3.314 -2.681 1.00 0.00 H new ATOM 0 HG21 ILE A 987 13.455 -3.902 -6.324 1.00 0.00 H new ATOM 0 HG22 ILE A 987 11.860 -4.636 -6.039 1.00 0.00 H new ATOM 0 HG23 ILE A 987 12.107 -2.900 -5.738 1.00 0.00 H new ATOM 0 HD11 ILE A 987 16.039 -2.557 -4.031 1.00 0.00 H new ATOM 0 HD12 ILE A 987 15.765 -4.300 -4.263 1.00 0.00 H new ATOM 0 HD13 ILE A 987 15.238 -3.143 -5.508 1.00 0.00 H new ATOM 1166 N ALA A 988 10.911 -6.414 -3.822 1.00 0.00 N ATOM 1167 CA ALA A 988 9.977 -7.405 -4.346 1.00 0.00 C ATOM 1168 C ALA A 988 8.629 -7.311 -3.644 1.00 0.00 C ATOM 1169 O ALA A 988 7.580 -7.353 -4.289 1.00 0.00 O ATOM 1170 CB ALA A 988 10.552 -8.806 -4.204 1.00 0.00 C ATOM 0 H ALA A 988 11.756 -6.808 -3.409 1.00 0.00 H new ATOM 0 HA ALA A 988 9.823 -7.196 -5.405 1.00 0.00 H new ATOM 0 HB1 ALA A 988 9.842 -9.532 -4.600 1.00 0.00 H new ATOM 0 HB2 ALA A 988 11.488 -8.873 -4.759 1.00 0.00 H new ATOM 0 HB3 ALA A 988 10.739 -9.018 -3.151 1.00 0.00 H new ATOM 1176 N ALA A 989 8.662 -7.154 -2.324 1.00 0.00 N ATOM 1177 CA ALA A 989 7.441 -7.044 -1.538 1.00 0.00 C ATOM 1178 C ALA A 989 6.646 -5.810 -1.937 1.00 0.00 C ATOM 1179 O ALA A 989 5.419 -5.841 -1.968 1.00 0.00 O ATOM 1180 CB ALA A 989 7.763 -7.005 -0.053 1.00 0.00 C ATOM 0 H ALA A 989 9.522 -7.100 -1.778 1.00 0.00 H new ATOM 0 HA ALA A 989 6.831 -7.924 -1.740 1.00 0.00 H new ATOM 0 HB1 ALA A 989 6.838 -6.923 0.518 1.00 0.00 H new ATOM 0 HB2 ALA A 989 8.284 -7.919 0.230 1.00 0.00 H new ATOM 0 HB3 ALA A 989 8.398 -6.145 0.159 1.00 0.00 H new ATOM 1186 N SER A 990 7.352 -4.731 -2.259 1.00 0.00 N ATOM 1187 CA SER A 990 6.709 -3.486 -2.651 1.00 0.00 C ATOM 1188 C SER A 990 6.032 -3.625 -4.011 1.00 0.00 C ATOM 1189 O SER A 990 4.897 -3.195 -4.193 1.00 0.00 O ATOM 1190 CB SER A 990 7.730 -2.348 -2.681 1.00 0.00 C ATOM 1191 OG SER A 990 8.386 -2.219 -1.431 1.00 0.00 O ATOM 0 H SER A 990 8.371 -4.696 -2.256 1.00 0.00 H new ATOM 0 HA SER A 990 5.942 -3.253 -1.912 1.00 0.00 H new ATOM 0 HB2 SER A 990 8.465 -2.535 -3.464 1.00 0.00 H new ATOM 0 HB3 SER A 990 7.230 -1.413 -2.931 1.00 0.00 H new ATOM 0 HG SER A 990 9.088 -2.899 -1.358 1.00 0.00 H new ATOM 1197 N GLN A 991 6.726 -4.243 -4.960 1.00 0.00 N ATOM 1198 CA GLN A 991 6.165 -4.469 -6.288 1.00 0.00 C ATOM 1199 C GLN A 991 4.966 -5.411 -6.206 1.00 0.00 C ATOM 1200 O GLN A 991 3.940 -5.202 -6.863 1.00 0.00 O ATOM 1201 CB GLN A 991 7.231 -5.041 -7.225 1.00 0.00 C ATOM 1202 CG GLN A 991 8.392 -4.092 -7.473 1.00 0.00 C ATOM 1203 CD GLN A 991 9.500 -4.723 -8.294 1.00 0.00 C ATOM 1204 OE1 GLN A 991 9.727 -5.929 -8.229 1.00 0.00 O ATOM 1205 NE2 GLN A 991 10.194 -3.913 -9.076 1.00 0.00 N ATOM 0 H GLN A 991 7.675 -4.596 -4.836 1.00 0.00 H new ATOM 0 HA GLN A 991 5.827 -3.514 -6.690 1.00 0.00 H new ATOM 0 HB2 GLN A 991 7.615 -5.969 -6.802 1.00 0.00 H new ATOM 0 HB3 GLN A 991 6.768 -5.293 -8.179 1.00 0.00 H new ATOM 0 HG2 GLN A 991 8.026 -3.203 -7.987 1.00 0.00 H new ATOM 0 HG3 GLN A 991 8.797 -3.763 -6.516 1.00 0.00 H new ATOM 0 HE21 GLN A 991 9.975 -2.917 -9.102 1.00 0.00 H new ATOM 0 HE22 GLN A 991 10.949 -4.284 -9.653 1.00 0.00 H new ATOM 1214 N SER A 992 5.096 -6.425 -5.362 1.00 0.00 N ATOM 1215 CA SER A 992 4.032 -7.395 -5.148 1.00 0.00 C ATOM 1216 C SER A 992 2.897 -6.769 -4.332 1.00 0.00 C ATOM 1217 O SER A 992 1.799 -7.313 -4.256 1.00 0.00 O ATOM 1218 CB SER A 992 4.595 -8.626 -4.430 1.00 0.00 C ATOM 1219 OG SER A 992 3.673 -9.702 -4.431 1.00 0.00 O ATOM 0 H SER A 992 5.936 -6.598 -4.810 1.00 0.00 H new ATOM 0 HA SER A 992 3.628 -7.702 -6.113 1.00 0.00 H new ATOM 0 HB2 SER A 992 5.520 -8.939 -4.915 1.00 0.00 H new ATOM 0 HB3 SER A 992 4.847 -8.364 -3.402 1.00 0.00 H new ATOM 0 HG SER A 992 2.761 -9.351 -4.505 1.00 0.00 H new ATOM 1225 N PHE A 993 3.178 -5.621 -3.725 1.00 0.00 N ATOM 1226 CA PHE A 993 2.180 -4.882 -2.961 1.00 0.00 C ATOM 1227 C PHE A 993 1.420 -3.928 -3.875 1.00 0.00 C ATOM 1228 O PHE A 993 0.228 -3.686 -3.686 1.00 0.00 O ATOM 1229 CB PHE A 993 2.865 -4.105 -1.831 1.00 0.00 C ATOM 1230 CG PHE A 993 1.930 -3.304 -0.970 1.00 0.00 C ATOM 1231 CD1 PHE A 993 1.252 -3.898 0.078 1.00 0.00 C ATOM 1232 CD2 PHE A 993 1.741 -1.952 -1.202 1.00 0.00 C ATOM 1233 CE1 PHE A 993 0.401 -3.163 0.878 1.00 0.00 C ATOM 1234 CE2 PHE A 993 0.889 -1.211 -0.406 1.00 0.00 C ATOM 1235 CZ PHE A 993 0.220 -1.818 0.634 1.00 0.00 C ATOM 0 H PHE A 993 4.097 -5.179 -3.748 1.00 0.00 H new ATOM 0 HA PHE A 993 1.469 -5.585 -2.527 1.00 0.00 H new ATOM 0 HB2 PHE A 993 3.407 -4.809 -1.200 1.00 0.00 H new ATOM 0 HB3 PHE A 993 3.604 -3.432 -2.266 1.00 0.00 H new ATOM 0 HD1 PHE A 993 1.390 -4.951 0.273 1.00 0.00 H new ATOM 0 HD2 PHE A 993 2.266 -1.471 -2.014 1.00 0.00 H new ATOM 0 HE1 PHE A 993 -0.122 -3.640 1.693 1.00 0.00 H new ATOM 0 HE2 PHE A 993 0.748 -0.158 -0.599 1.00 0.00 H new ATOM 0 HZ PHE A 993 -0.446 -1.241 1.258 1.00 0.00 H new ATOM 1245 N LEU A 994 2.125 -3.399 -4.871 1.00 0.00 N ATOM 1246 CA LEU A 994 1.546 -2.463 -5.830 1.00 0.00 C ATOM 1247 C LEU A 994 0.322 -3.053 -6.522 1.00 0.00 C ATOM 1248 O LEU A 994 -0.708 -2.393 -6.641 1.00 0.00 O ATOM 1249 CB LEU A 994 2.583 -2.084 -6.888 1.00 0.00 C ATOM 1250 CG LEU A 994 3.793 -1.304 -6.379 1.00 0.00 C ATOM 1251 CD1 LEU A 994 4.846 -1.204 -7.467 1.00 0.00 C ATOM 1252 CD2 LEU A 994 3.377 0.082 -5.912 1.00 0.00 C ATOM 0 H LEU A 994 3.110 -3.606 -5.036 1.00 0.00 H new ATOM 0 HA LEU A 994 1.237 -1.577 -5.275 1.00 0.00 H new ATOM 0 HB2 LEU A 994 2.937 -2.997 -7.366 1.00 0.00 H new ATOM 0 HB3 LEU A 994 2.089 -1.491 -7.658 1.00 0.00 H new ATOM 0 HG LEU A 994 4.218 -1.838 -5.529 1.00 0.00 H new ATOM 0 HD11 LEU A 994 5.704 -0.646 -7.093 1.00 0.00 H new ATOM 0 HD12 LEU A 994 5.164 -2.205 -7.759 1.00 0.00 H new ATOM 0 HD13 LEU A 994 4.428 -0.689 -8.332 1.00 0.00 H new ATOM 0 HD21 LEU A 994 4.252 0.623 -5.553 1.00 0.00 H new ATOM 0 HD22 LEU A 994 2.930 0.627 -6.743 1.00 0.00 H new ATOM 0 HD23 LEU A 994 2.650 -0.009 -5.105 1.00 0.00 H new ATOM 1264 N GLN A 995 0.448 -4.297 -6.971 1.00 0.00 N ATOM 1265 CA GLN A 995 -0.619 -4.956 -7.725 1.00 0.00 C ATOM 1266 C GLN A 995 -1.951 -5.001 -6.943 1.00 0.00 C ATOM 1267 O GLN A 995 -2.953 -4.459 -7.412 1.00 0.00 O ATOM 1268 CB GLN A 995 -0.176 -6.360 -8.168 1.00 0.00 C ATOM 1269 CG GLN A 995 -1.251 -7.151 -8.899 1.00 0.00 C ATOM 1270 CD GLN A 995 -1.790 -6.437 -10.124 1.00 0.00 C ATOM 1271 OE1 GLN A 995 -2.755 -5.679 -10.034 1.00 0.00 O ATOM 1272 NE2 GLN A 995 -1.189 -6.685 -11.275 1.00 0.00 N ATOM 0 H GLN A 995 1.278 -4.872 -6.827 1.00 0.00 H new ATOM 0 HA GLN A 995 -0.808 -4.358 -8.616 1.00 0.00 H new ATOM 0 HB2 GLN A 995 0.695 -6.266 -8.817 1.00 0.00 H new ATOM 0 HB3 GLN A 995 0.140 -6.923 -7.290 1.00 0.00 H new ATOM 0 HG2 GLN A 995 -0.842 -8.116 -9.199 1.00 0.00 H new ATOM 0 HG3 GLN A 995 -2.074 -7.353 -8.213 1.00 0.00 H new ATOM 0 HE21 GLN A 995 -0.391 -7.320 -11.307 1.00 0.00 H new ATOM 0 HE22 GLN A 995 -1.523 -6.241 -12.131 1.00 0.00 H new ATOM 1281 N PRO A 996 -2.014 -5.637 -5.753 1.00 0.00 N ATOM 1282 CA PRO A 996 -3.255 -5.676 -4.974 1.00 0.00 C ATOM 1283 C PRO A 996 -3.591 -4.325 -4.350 1.00 0.00 C ATOM 1284 O PRO A 996 -4.761 -3.999 -4.151 1.00 0.00 O ATOM 1285 CB PRO A 996 -2.974 -6.715 -3.890 1.00 0.00 C ATOM 1286 CG PRO A 996 -1.494 -6.707 -3.729 1.00 0.00 C ATOM 1287 CD PRO A 996 -0.926 -6.375 -5.084 1.00 0.00 C ATOM 0 HA PRO A 996 -4.115 -5.922 -5.597 1.00 0.00 H new ATOM 0 HB2 PRO A 996 -3.475 -6.458 -2.957 1.00 0.00 H new ATOM 0 HB3 PRO A 996 -3.334 -7.701 -4.184 1.00 0.00 H new ATOM 0 HG2 PRO A 996 -1.187 -5.970 -2.987 1.00 0.00 H new ATOM 0 HG3 PRO A 996 -1.135 -7.676 -3.383 1.00 0.00 H new ATOM 0 HD2 PRO A 996 -0.024 -5.769 -5.002 1.00 0.00 H new ATOM 0 HD3 PRO A 996 -0.656 -7.275 -5.636 1.00 0.00 H new ATOM 1295 N GLY A 997 -2.565 -3.539 -4.050 1.00 0.00 N ATOM 1296 CA GLY A 997 -2.784 -2.220 -3.497 1.00 0.00 C ATOM 1297 C GLY A 997 -3.524 -1.325 -4.468 1.00 0.00 C ATOM 1298 O GLY A 997 -4.547 -0.733 -4.124 1.00 0.00 O ATOM 0 H GLY A 997 -1.586 -3.793 -4.180 1.00 0.00 H new ATOM 0 HA2 GLY A 997 -3.353 -2.303 -2.571 1.00 0.00 H new ATOM 0 HA3 GLY A 997 -1.825 -1.768 -3.242 1.00 0.00 H new ATOM 1302 N GLY A 998 -3.020 -1.256 -5.695 1.00 0.00 N ATOM 1303 CA GLY A 998 -3.629 -0.425 -6.714 1.00 0.00 C ATOM 1304 C GLY A 998 -5.031 -0.872 -7.071 1.00 0.00 C ATOM 1305 O GLY A 998 -5.909 -0.041 -7.315 1.00 0.00 O ATOM 0 H GLY A 998 -2.192 -1.767 -6.003 1.00 0.00 H new ATOM 0 HA2 GLY A 998 -3.659 0.607 -6.365 1.00 0.00 H new ATOM 0 HA3 GLY A 998 -3.008 -0.441 -7.609 1.00 0.00 H new ATOM 1309 N LYS A 999 -5.257 -2.183 -7.084 1.00 0.00 N ATOM 1310 CA LYS A 999 -6.567 -2.708 -7.432 1.00 0.00 C ATOM 1311 C LYS A 999 -7.567 -2.461 -6.305 1.00 0.00 C ATOM 1312 O LYS A 999 -8.777 -2.453 -6.531 1.00 0.00 O ATOM 1313 CB LYS A 999 -6.504 -4.201 -7.780 1.00 0.00 C ATOM 1314 CG LYS A 999 -6.250 -5.119 -6.601 1.00 0.00 C ATOM 1315 CD LYS A 999 -6.630 -6.558 -6.924 1.00 0.00 C ATOM 1316 CE LYS A 999 -5.982 -7.052 -8.212 1.00 0.00 C ATOM 1317 NZ LYS A 999 -4.499 -7.109 -8.119 1.00 0.00 N ATOM 0 H LYS A 999 -4.557 -2.891 -6.860 1.00 0.00 H new ATOM 0 HA LYS A 999 -6.907 -2.175 -8.320 1.00 0.00 H new ATOM 0 HB2 LYS A 999 -7.444 -4.490 -8.251 1.00 0.00 H new ATOM 0 HB3 LYS A 999 -5.717 -4.355 -8.518 1.00 0.00 H new ATOM 0 HG2 LYS A 999 -5.197 -5.073 -6.323 1.00 0.00 H new ATOM 0 HG3 LYS A 999 -6.823 -4.775 -5.740 1.00 0.00 H new ATOM 0 HD2 LYS A 999 -6.331 -7.204 -6.099 1.00 0.00 H new ATOM 0 HD3 LYS A 999 -7.714 -6.634 -7.013 1.00 0.00 H new ATOM 0 HE2 LYS A 999 -6.366 -8.044 -8.451 1.00 0.00 H new ATOM 0 HE3 LYS A 999 -6.266 -6.394 -9.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 999 -4.155 -7.976 -8.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 999 -4.089 -6.279 -8.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 999 -4.214 -7.112 -7.119 1.00 0.00 H new ATOM 1331 N MET A1000 -7.065 -2.244 -5.092 1.00 0.00 N ATOM 1332 CA MET A1000 -7.935 -1.918 -3.973 1.00 0.00 C ATOM 1333 C MET A1000 -8.247 -0.429 -3.989 1.00 0.00 C ATOM 1334 O MET A1000 -9.335 -0.014 -3.602 1.00 0.00 O ATOM 1335 CB MET A1000 -7.303 -2.318 -2.637 1.00 0.00 C ATOM 1336 CG MET A1000 -8.256 -2.174 -1.457 1.00 0.00 C ATOM 1337 SD MET A1000 -7.536 -2.726 0.102 1.00 0.00 S ATOM 1338 CE MET A1000 -6.195 -1.557 0.290 1.00 0.00 C ATOM 0 H MET A1000 -6.072 -2.288 -4.863 1.00 0.00 H new ATOM 0 HA MET A1000 -8.860 -2.484 -4.079 1.00 0.00 H new ATOM 0 HB2 MET A1000 -6.964 -3.352 -2.698 1.00 0.00 H new ATOM 0 HB3 MET A1000 -6.421 -1.703 -2.461 1.00 0.00 H new ATOM 0 HG2 MET A1000 -8.554 -1.130 -1.363 1.00 0.00 H new ATOM 0 HG3 MET A1000 -9.161 -2.748 -1.656 1.00 0.00 H new ATOM 0 HE1 MET A1000 -5.778 -1.640 1.294 1.00 0.00 H new ATOM 0 HE2 MET A1000 -5.419 -1.772 -0.445 1.00 0.00 H new ATOM 0 HE3 MET A1000 -6.570 -0.545 0.136 1.00 0.00 H new ATOM 1348 N VAL A1001 -7.283 0.366 -4.451 1.00 0.00 N ATOM 1349 CA VAL A1001 -7.496 1.798 -4.640 1.00 0.00 C ATOM 1350 C VAL A1001 -8.638 2.030 -5.620 1.00 0.00 C ATOM 1351 O VAL A1001 -9.576 2.775 -5.337 1.00 0.00 O ATOM 1352 CB VAL A1001 -6.224 2.501 -5.169 1.00 0.00 C ATOM 1353 CG1 VAL A1001 -6.491 3.972 -5.452 1.00 0.00 C ATOM 1354 CG2 VAL A1001 -5.075 2.356 -4.186 1.00 0.00 C ATOM 0 H VAL A1001 -6.349 0.042 -4.701 1.00 0.00 H new ATOM 0 HA VAL A1001 -7.744 2.223 -3.667 1.00 0.00 H new ATOM 0 HB VAL A1001 -5.943 2.016 -6.104 1.00 0.00 H new ATOM 0 HG11 VAL A1001 -5.580 4.442 -5.823 1.00 0.00 H new ATOM 0 HG12 VAL A1001 -7.277 4.061 -6.202 1.00 0.00 H new ATOM 0 HG13 VAL A1001 -6.808 4.467 -4.534 1.00 0.00 H new ATOM 0 HG21 VAL A1001 -4.192 2.859 -4.581 1.00 0.00 H new ATOM 0 HG22 VAL A1001 -5.353 2.806 -3.233 1.00 0.00 H new ATOM 0 HG23 VAL A1001 -4.854 1.299 -4.038 1.00 0.00 H new ATOM 1364 N ALA A1002 -8.554 1.371 -6.771 1.00 0.00 N ATOM 1365 CA ALA A1002 -9.583 1.482 -7.798 1.00 0.00 C ATOM 1366 C ALA A1002 -10.929 0.984 -7.283 1.00 0.00 C ATOM 1367 O ALA A1002 -11.960 1.626 -7.492 1.00 0.00 O ATOM 1368 CB ALA A1002 -9.172 0.704 -9.035 1.00 0.00 C ATOM 0 H ALA A1002 -7.781 0.752 -7.016 1.00 0.00 H new ATOM 0 HA ALA A1002 -9.691 2.535 -8.059 1.00 0.00 H new ATOM 0 HB1 ALA A1002 -9.948 0.794 -9.796 1.00 0.00 H new ATOM 0 HB2 ALA A1002 -8.236 1.105 -9.423 1.00 0.00 H new ATOM 0 HB3 ALA A1002 -9.037 -0.346 -8.776 1.00 0.00 H new ATOM 1374 N ALA A1003 -10.909 -0.158 -6.605 1.00 0.00 N ATOM 1375 CA ALA A1003 -12.119 -0.728 -6.029 1.00 0.00 C ATOM 1376 C ALA A1003 -12.745 0.240 -5.034 1.00 0.00 C ATOM 1377 O ALA A1003 -13.956 0.453 -5.040 1.00 0.00 O ATOM 1378 CB ALA A1003 -11.815 -2.062 -5.362 1.00 0.00 C ATOM 0 H ALA A1003 -10.066 -0.708 -6.441 1.00 0.00 H new ATOM 0 HA ALA A1003 -12.834 -0.902 -6.833 1.00 0.00 H new ATOM 0 HB1 ALA A1003 -12.731 -2.473 -4.937 1.00 0.00 H new ATOM 0 HB2 ALA A1003 -11.415 -2.756 -6.101 1.00 0.00 H new ATOM 0 HB3 ALA A1003 -11.082 -1.914 -4.569 1.00 0.00 H new ATOM 1384 N ALA A1004 -11.903 0.837 -4.194 1.00 0.00 N ATOM 1385 CA ALA A1004 -12.355 1.797 -3.194 1.00 0.00 C ATOM 1386 C ALA A1004 -13.008 3.005 -3.855 1.00 0.00 C ATOM 1387 O ALA A1004 -14.102 3.415 -3.467 1.00 0.00 O ATOM 1388 CB ALA A1004 -11.188 2.232 -2.314 1.00 0.00 C ATOM 0 H ALA A1004 -10.897 0.670 -4.188 1.00 0.00 H new ATOM 0 HA ALA A1004 -13.103 1.312 -2.567 1.00 0.00 H new ATOM 0 HB1 ALA A1004 -11.539 2.949 -1.572 1.00 0.00 H new ATOM 0 HB2 ALA A1004 -10.769 1.362 -1.808 1.00 0.00 H new ATOM 0 HB3 ALA A1004 -10.420 2.697 -2.932 1.00 0.00 H new ATOM 1394 N LYS A1005 -12.342 3.550 -4.870 1.00 0.00 N ATOM 1395 CA LYS A1005 -12.840 4.722 -5.591 1.00 0.00 C ATOM 1396 C LYS A1005 -14.222 4.472 -6.188 1.00 0.00 C ATOM 1397 O LYS A1005 -15.065 5.366 -6.226 1.00 0.00 O ATOM 1398 CB LYS A1005 -11.882 5.106 -6.719 1.00 0.00 C ATOM 1399 CG LYS A1005 -10.546 5.645 -6.245 1.00 0.00 C ATOM 1400 CD LYS A1005 -9.651 5.990 -7.423 1.00 0.00 C ATOM 1401 CE LYS A1005 -8.374 6.680 -6.977 1.00 0.00 C ATOM 1402 NZ LYS A1005 -7.496 7.005 -8.129 1.00 0.00 N ATOM 0 H LYS A1005 -11.449 3.197 -5.215 1.00 0.00 H new ATOM 0 HA LYS A1005 -12.910 5.534 -4.867 1.00 0.00 H new ATOM 0 HB2 LYS A1005 -11.706 4.231 -7.345 1.00 0.00 H new ATOM 0 HB3 LYS A1005 -12.361 5.856 -7.348 1.00 0.00 H new ATOM 0 HG2 LYS A1005 -10.704 6.532 -5.632 1.00 0.00 H new ATOM 0 HG3 LYS A1005 -10.054 4.905 -5.614 1.00 0.00 H new ATOM 0 HD2 LYS A1005 -9.401 5.080 -7.969 1.00 0.00 H new ATOM 0 HD3 LYS A1005 -10.192 6.637 -8.113 1.00 0.00 H new ATOM 0 HE2 LYS A1005 -8.623 7.595 -6.439 1.00 0.00 H new ATOM 0 HE3 LYS A1005 -7.837 6.037 -6.280 1.00 0.00 H new ATOM 0 HZ1 LYS A1005 -6.634 7.475 -7.787 1.00 0.00 H new ATOM 0 HZ2 LYS A1005 -7.238 6.129 -8.627 1.00 0.00 H new ATOM 0 HZ3 LYS A1005 -8.000 7.639 -8.782 1.00 0.00 H new ATOM 1416 N ALA A1006 -14.447 3.255 -6.659 1.00 0.00 N ATOM 1417 CA ALA A1006 -15.700 2.910 -7.311 1.00 0.00 C ATOM 1418 C ALA A1006 -16.803 2.635 -6.293 1.00 0.00 C ATOM 1419 O ALA A1006 -17.989 2.751 -6.606 1.00 0.00 O ATOM 1420 CB ALA A1006 -15.504 1.712 -8.225 1.00 0.00 C ATOM 0 H ALA A1006 -13.776 2.489 -6.601 1.00 0.00 H new ATOM 0 HA ALA A1006 -16.013 3.764 -7.911 1.00 0.00 H new ATOM 0 HB1 ALA A1006 -16.449 1.464 -8.707 1.00 0.00 H new ATOM 0 HB2 ALA A1006 -14.761 1.952 -8.985 1.00 0.00 H new ATOM 0 HB3 ALA A1006 -15.161 0.859 -7.639 1.00 0.00 H new ATOM 1426 N SER A1007 -16.413 2.280 -5.076 1.00 0.00 N ATOM 1427 CA SER A1007 -17.377 1.991 -4.026 1.00 0.00 C ATOM 1428 C SER A1007 -17.818 3.268 -3.312 1.00 0.00 C ATOM 1429 O SER A1007 -18.893 3.306 -2.711 1.00 0.00 O ATOM 1430 CB SER A1007 -16.791 0.994 -3.029 1.00 0.00 C ATOM 1431 OG SER A1007 -16.512 -0.247 -3.660 1.00 0.00 O ATOM 0 H SER A1007 -15.438 2.186 -4.793 1.00 0.00 H new ATOM 0 HA SER A1007 -18.258 1.547 -4.489 1.00 0.00 H new ATOM 0 HB2 SER A1007 -15.877 1.400 -2.596 1.00 0.00 H new ATOM 0 HB3 SER A1007 -17.491 0.840 -2.208 1.00 0.00 H new ATOM 0 HG SER A1007 -15.678 -0.175 -4.169 1.00 0.00 H new ATOM 1437 N VAL A1008 -16.996 4.312 -3.400 1.00 0.00 N ATOM 1438 CA VAL A1008 -17.306 5.601 -2.779 1.00 0.00 C ATOM 1439 C VAL A1008 -18.705 6.109 -3.170 1.00 0.00 C ATOM 1440 O VAL A1008 -19.540 6.337 -2.294 1.00 0.00 O ATOM 1441 CB VAL A1008 -16.243 6.673 -3.128 1.00 0.00 C ATOM 1442 CG1 VAL A1008 -16.646 8.041 -2.593 1.00 0.00 C ATOM 1443 CG2 VAL A1008 -14.881 6.274 -2.585 1.00 0.00 C ATOM 0 H VAL A1008 -16.106 4.291 -3.898 1.00 0.00 H new ATOM 0 HA VAL A1008 -17.293 5.432 -1.702 1.00 0.00 H new ATOM 0 HB VAL A1008 -16.180 6.738 -4.214 1.00 0.00 H new ATOM 0 HG11 VAL A1008 -15.881 8.773 -2.853 1.00 0.00 H new ATOM 0 HG12 VAL A1008 -17.598 8.338 -3.034 1.00 0.00 H new ATOM 0 HG13 VAL A1008 -16.748 7.992 -1.509 1.00 0.00 H new ATOM 0 HG21 VAL A1008 -14.149 7.040 -2.841 1.00 0.00 H new ATOM 0 HG22 VAL A1008 -14.937 6.173 -1.501 1.00 0.00 H new ATOM 0 HG23 VAL A1008 -14.579 5.323 -3.023 1.00 0.00 H new ATOM 1453 N PRO A1009 -19.000 6.278 -4.478 1.00 0.00 N ATOM 1454 CA PRO A1009 -20.290 6.825 -4.920 1.00 0.00 C ATOM 1455 C PRO A1009 -21.456 5.855 -4.737 1.00 0.00 C ATOM 1456 O PRO A1009 -22.617 6.251 -4.839 1.00 0.00 O ATOM 1457 CB PRO A1009 -20.065 7.110 -6.406 1.00 0.00 C ATOM 1458 CG PRO A1009 -19.010 6.147 -6.820 1.00 0.00 C ATOM 1459 CD PRO A1009 -18.117 5.973 -5.624 1.00 0.00 C ATOM 0 HA PRO A1009 -20.569 7.700 -4.333 1.00 0.00 H new ATOM 0 HB2 PRO A1009 -20.980 6.965 -6.980 1.00 0.00 H new ATOM 0 HB3 PRO A1009 -19.747 8.140 -6.568 1.00 0.00 H new ATOM 0 HG2 PRO A1009 -19.447 5.195 -7.123 1.00 0.00 H new ATOM 0 HG3 PRO A1009 -18.449 6.526 -7.674 1.00 0.00 H new ATOM 0 HD2 PRO A1009 -17.720 4.959 -5.565 1.00 0.00 H new ATOM 0 HD3 PRO A1009 -17.262 6.648 -5.661 1.00 0.00 H new ATOM 1467 N THR A1010 -21.161 4.586 -4.474 1.00 0.00 N ATOM 1468 CA THR A1010 -22.212 3.587 -4.320 1.00 0.00 C ATOM 1469 C THR A1010 -22.643 3.444 -2.860 1.00 0.00 C ATOM 1470 O THR A1010 -23.698 2.878 -2.566 1.00 0.00 O ATOM 1471 CB THR A1010 -21.774 2.216 -4.875 1.00 0.00 C ATOM 1472 OG1 THR A1010 -20.486 1.858 -4.362 1.00 0.00 O ATOM 1473 CG2 THR A1010 -21.726 2.241 -6.395 1.00 0.00 C ATOM 0 H THR A1010 -20.212 4.228 -4.364 1.00 0.00 H new ATOM 0 HA THR A1010 -23.066 3.938 -4.899 1.00 0.00 H new ATOM 0 HB THR A1010 -22.507 1.474 -4.557 1.00 0.00 H new ATOM 0 HG1 THR A1010 -20.219 2.499 -3.671 1.00 0.00 H new ATOM 0 HG21 THR A1010 -21.415 1.264 -6.765 1.00 0.00 H new ATOM 0 HG22 THR A1010 -22.715 2.479 -6.786 1.00 0.00 H new ATOM 0 HG23 THR A1010 -21.014 2.998 -6.724 1.00 0.00 H new ATOM 1481 N ILE A1011 -21.838 3.975 -1.951 1.00 0.00 N ATOM 1482 CA ILE A1011 -22.151 3.924 -0.527 1.00 0.00 C ATOM 1483 C ILE A1011 -23.079 5.078 -0.146 1.00 0.00 C ATOM 1484 O ILE A1011 -22.941 6.191 -0.659 1.00 0.00 O ATOM 1485 CB ILE A1011 -20.861 3.968 0.327 1.00 0.00 C ATOM 1486 CG1 ILE A1011 -20.024 2.712 0.070 1.00 0.00 C ATOM 1487 CG2 ILE A1011 -21.182 4.096 1.810 1.00 0.00 C ATOM 1488 CD1 ILE A1011 -18.708 2.695 0.816 1.00 0.00 C ATOM 0 H ILE A1011 -20.962 4.447 -2.173 1.00 0.00 H new ATOM 0 HA ILE A1011 -22.659 2.981 -0.325 1.00 0.00 H new ATOM 0 HB ILE A1011 -20.288 4.848 0.034 1.00 0.00 H new ATOM 0 HG12 ILE A1011 -20.605 1.835 0.355 1.00 0.00 H new ATOM 0 HG13 ILE A1011 -19.827 2.630 -0.999 1.00 0.00 H new ATOM 0 HG21 ILE A1011 -20.255 4.124 2.382 1.00 0.00 H new ATOM 0 HG22 ILE A1011 -21.743 5.014 1.983 1.00 0.00 H new ATOM 0 HG23 ILE A1011 -21.779 3.241 2.128 1.00 0.00 H new ATOM 0 HD11 ILE A1011 -18.170 1.775 0.585 1.00 0.00 H new ATOM 0 HD12 ILE A1011 -18.107 3.553 0.513 1.00 0.00 H new ATOM 0 HD13 ILE A1011 -18.897 2.745 1.888 1.00 0.00 H new ATOM 1500 N GLN A1012 -24.035 4.808 0.735 1.00 0.00 N ATOM 1501 CA GLN A1012 -24.992 5.821 1.157 1.00 0.00 C ATOM 1502 C GLN A1012 -24.396 6.654 2.287 1.00 0.00 C ATOM 1503 O GLN A1012 -24.528 7.879 2.308 1.00 0.00 O ATOM 1504 CB GLN A1012 -26.303 5.150 1.597 1.00 0.00 C ATOM 1505 CG GLN A1012 -27.494 6.098 1.696 1.00 0.00 C ATOM 1506 CD GLN A1012 -27.520 6.917 2.975 1.00 0.00 C ATOM 1507 OE1 GLN A1012 -27.058 6.332 4.070 1.00 0.00 O flip ATOM 1508 NE2 GLN A1012 -27.979 8.059 2.981 1.00 0.00 N flip ATOM 0 H GLN A1012 -24.167 3.895 1.171 1.00 0.00 H new ATOM 0 HA GLN A1012 -25.213 6.485 0.321 1.00 0.00 H new ATOM 0 HB2 GLN A1012 -26.545 4.355 0.891 1.00 0.00 H new ATOM 0 HB3 GLN A1012 -26.148 4.679 2.567 1.00 0.00 H new ATOM 0 HG2 GLN A1012 -27.480 6.775 0.842 1.00 0.00 H new ATOM 0 HG3 GLN A1012 -28.415 5.518 1.628 1.00 0.00 H new ATOM 0 HE21 GLN A1012 -28.325 8.474 2.116 1.00 0.00 H new ATOM 0 HE22 GLN A1012 -28.013 8.590 3.851 1.00 0.00 H new ATOM 1517 N ASP A1013 -23.725 5.976 3.214 1.00 0.00 N ATOM 1518 CA ASP A1013 -23.078 6.640 4.342 1.00 0.00 C ATOM 1519 C ASP A1013 -21.941 7.529 3.851 1.00 0.00 C ATOM 1520 O ASP A1013 -20.933 7.039 3.335 1.00 0.00 O ATOM 1521 CB ASP A1013 -22.534 5.613 5.342 1.00 0.00 C ATOM 1522 CG ASP A1013 -23.616 4.754 5.966 1.00 0.00 C ATOM 1523 OD1 ASP A1013 -24.206 5.171 6.984 1.00 0.00 O ATOM 1524 OD2 ASP A1013 -23.875 3.645 5.449 1.00 0.00 O ATOM 0 H ASP A1013 -23.615 4.962 3.206 1.00 0.00 H new ATOM 0 HA ASP A1013 -23.825 7.255 4.844 1.00 0.00 H new ATOM 0 HB2 ASP A1013 -21.815 4.969 4.836 1.00 0.00 H new ATOM 0 HB3 ASP A1013 -21.994 6.135 6.132 1.00 0.00 H new ATOM 1529 N GLN A1014 -22.103 8.836 4.020 1.00 0.00 N ATOM 1530 CA GLN A1014 -21.138 9.798 3.504 1.00 0.00 C ATOM 1531 C GLN A1014 -19.782 9.679 4.201 1.00 0.00 C ATOM 1532 O GLN A1014 -18.746 9.908 3.581 1.00 0.00 O ATOM 1533 CB GLN A1014 -21.667 11.241 3.600 1.00 0.00 C ATOM 1534 CG GLN A1014 -22.025 11.725 5.005 1.00 0.00 C ATOM 1535 CD GLN A1014 -23.380 11.233 5.483 1.00 0.00 C ATOM 1536 OE1 GLN A1014 -23.391 10.143 6.230 1.00 0.00 O flip ATOM 1537 NE2 GLN A1014 -24.410 11.852 5.216 1.00 0.00 N flip ATOM 0 H GLN A1014 -22.894 9.254 4.511 1.00 0.00 H new ATOM 0 HA GLN A1014 -20.994 9.558 2.451 1.00 0.00 H new ATOM 0 HB2 GLN A1014 -20.915 11.912 3.185 1.00 0.00 H new ATOM 0 HB3 GLN A1014 -22.552 11.326 2.970 1.00 0.00 H new ATOM 0 HG2 GLN A1014 -21.258 11.391 5.703 1.00 0.00 H new ATOM 0 HG3 GLN A1014 -22.016 12.815 5.020 1.00 0.00 H new ATOM 0 HE21 GLN A1014 -24.366 12.690 4.636 1.00 0.00 H new ATOM 0 HE22 GLN A1014 -25.308 11.527 5.575 1.00 0.00 H new ATOM 1546 N ALA A1015 -19.783 9.289 5.472 1.00 0.00 N ATOM 1547 CA ALA A1015 -18.538 9.157 6.218 1.00 0.00 C ATOM 1548 C ALA A1015 -17.708 8.006 5.671 1.00 0.00 C ATOM 1549 O ALA A1015 -16.481 8.096 5.589 1.00 0.00 O ATOM 1550 CB ALA A1015 -18.812 8.959 7.701 1.00 0.00 C ATOM 0 H ALA A1015 -20.624 9.061 6.002 1.00 0.00 H new ATOM 0 HA ALA A1015 -17.971 10.080 6.098 1.00 0.00 H new ATOM 0 HB1 ALA A1015 -17.867 8.863 8.236 1.00 0.00 H new ATOM 0 HB2 ALA A1015 -19.362 9.817 8.087 1.00 0.00 H new ATOM 0 HB3 ALA A1015 -19.403 8.055 7.844 1.00 0.00 H new ATOM 1556 N SER A1016 -18.388 6.935 5.277 1.00 0.00 N ATOM 1557 CA SER A1016 -17.729 5.784 4.683 1.00 0.00 C ATOM 1558 C SER A1016 -17.110 6.174 3.343 1.00 0.00 C ATOM 1559 O SER A1016 -15.967 5.821 3.045 1.00 0.00 O ATOM 1560 CB SER A1016 -18.736 4.652 4.485 1.00 0.00 C ATOM 1561 OG SER A1016 -19.514 4.448 5.655 1.00 0.00 O ATOM 0 H SER A1016 -19.400 6.843 5.360 1.00 0.00 H new ATOM 0 HA SER A1016 -16.939 5.442 5.352 1.00 0.00 H new ATOM 0 HB2 SER A1016 -19.391 4.887 3.646 1.00 0.00 H new ATOM 0 HB3 SER A1016 -18.209 3.733 4.231 1.00 0.00 H new ATOM 0 HG SER A1016 -20.151 3.720 5.501 1.00 0.00 H new ATOM 1567 N ALA A1017 -17.872 6.928 2.554 1.00 0.00 N ATOM 1568 CA ALA A1017 -17.423 7.378 1.243 1.00 0.00 C ATOM 1569 C ALA A1017 -16.222 8.311 1.362 1.00 0.00 C ATOM 1570 O ALA A1017 -15.231 8.157 0.644 1.00 0.00 O ATOM 1571 CB ALA A1017 -18.564 8.071 0.512 1.00 0.00 C ATOM 0 H ALA A1017 -18.810 7.241 2.804 1.00 0.00 H new ATOM 0 HA ALA A1017 -17.111 6.505 0.670 1.00 0.00 H new ATOM 0 HB1 ALA A1017 -18.220 8.404 -0.467 1.00 0.00 H new ATOM 0 HB2 ALA A1017 -19.393 7.374 0.387 1.00 0.00 H new ATOM 0 HB3 ALA A1017 -18.898 8.932 1.091 1.00 0.00 H new ATOM 1577 N MET A1018 -16.312 9.274 2.276 1.00 0.00 N ATOM 1578 CA MET A1018 -15.232 10.232 2.489 1.00 0.00 C ATOM 1579 C MET A1018 -13.954 9.523 2.915 1.00 0.00 C ATOM 1580 O MET A1018 -12.882 9.776 2.363 1.00 0.00 O ATOM 1581 CB MET A1018 -15.619 11.268 3.546 1.00 0.00 C ATOM 1582 CG MET A1018 -16.756 12.183 3.129 1.00 0.00 C ATOM 1583 SD MET A1018 -17.143 13.415 4.386 1.00 0.00 S ATOM 1584 CE MET A1018 -18.518 14.263 3.610 1.00 0.00 C ATOM 0 H MET A1018 -17.122 9.411 2.881 1.00 0.00 H new ATOM 0 HA MET A1018 -15.056 10.743 1.542 1.00 0.00 H new ATOM 0 HB2 MET A1018 -15.902 10.749 4.462 1.00 0.00 H new ATOM 0 HB3 MET A1018 -14.745 11.876 3.781 1.00 0.00 H new ATOM 0 HG2 MET A1018 -16.491 12.687 2.200 1.00 0.00 H new ATOM 0 HG3 MET A1018 -17.644 11.585 2.925 1.00 0.00 H new ATOM 0 HE1 MET A1018 -18.712 15.198 4.135 1.00 0.00 H new ATOM 0 HE2 MET A1018 -18.274 14.475 2.569 1.00 0.00 H new ATOM 0 HE3 MET A1018 -19.406 13.632 3.653 1.00 0.00 H new ATOM 1594 N GLN A1019 -14.081 8.627 3.887 1.00 0.00 N ATOM 1595 CA GLN A1019 -12.929 7.916 4.424 1.00 0.00 C ATOM 1596 C GLN A1019 -12.256 7.078 3.341 1.00 0.00 C ATOM 1597 O GLN A1019 -11.032 7.087 3.217 1.00 0.00 O ATOM 1598 CB GLN A1019 -13.351 7.039 5.605 1.00 0.00 C ATOM 1599 CG GLN A1019 -12.187 6.355 6.306 1.00 0.00 C ATOM 1600 CD GLN A1019 -12.596 5.689 7.605 1.00 0.00 C ATOM 1601 OE1 GLN A1019 -12.999 4.433 7.529 1.00 0.00 O flip ATOM 1602 NE2 GLN A1019 -12.549 6.306 8.670 1.00 0.00 N flip ATOM 0 H GLN A1019 -14.971 8.376 4.319 1.00 0.00 H new ATOM 0 HA GLN A1019 -12.205 8.650 4.779 1.00 0.00 H new ATOM 0 HB2 GLN A1019 -13.889 7.653 6.328 1.00 0.00 H new ATOM 0 HB3 GLN A1019 -14.048 6.279 5.251 1.00 0.00 H new ATOM 0 HG2 GLN A1019 -11.755 5.608 5.640 1.00 0.00 H new ATOM 0 HG3 GLN A1019 -11.408 7.090 6.509 1.00 0.00 H new ATOM 0 HE21 GLN A1019 -12.231 7.275 8.684 1.00 0.00 H new ATOM 0 HE22 GLN A1019 -12.828 5.848 9.538 1.00 0.00 H new ATOM 1611 N LEU A1020 -13.060 6.374 2.548 1.00 0.00 N ATOM 1612 CA LEU A1020 -12.537 5.565 1.450 1.00 0.00 C ATOM 1613 C LEU A1020 -11.774 6.411 0.439 1.00 0.00 C ATOM 1614 O LEU A1020 -10.627 6.109 0.110 1.00 0.00 O ATOM 1615 CB LEU A1020 -13.669 4.820 0.742 1.00 0.00 C ATOM 1616 CG LEU A1020 -13.996 3.444 1.317 1.00 0.00 C ATOM 1617 CD1 LEU A1020 -15.172 2.828 0.582 1.00 0.00 C ATOM 1618 CD2 LEU A1020 -12.780 2.539 1.221 1.00 0.00 C ATOM 0 H LEU A1020 -14.075 6.347 2.645 1.00 0.00 H new ATOM 0 HA LEU A1020 -11.845 4.844 1.885 1.00 0.00 H new ATOM 0 HB2 LEU A1020 -14.568 5.436 0.780 1.00 0.00 H new ATOM 0 HB3 LEU A1020 -13.406 4.704 -0.309 1.00 0.00 H new ATOM 0 HG LEU A1020 -14.268 3.558 2.366 1.00 0.00 H new ATOM 0 HD11 LEU A1020 -15.392 1.848 1.004 1.00 0.00 H new ATOM 0 HD12 LEU A1020 -16.045 3.472 0.687 1.00 0.00 H new ATOM 0 HD13 LEU A1020 -14.925 2.721 -0.474 1.00 0.00 H new ATOM 0 HD21 LEU A1020 -13.022 1.559 1.633 1.00 0.00 H new ATOM 0 HD22 LEU A1020 -12.488 2.431 0.176 1.00 0.00 H new ATOM 0 HD23 LEU A1020 -11.956 2.976 1.784 1.00 0.00 H new ATOM 1630 N SER A1021 -12.412 7.472 -0.041 1.00 0.00 N ATOM 1631 CA SER A1021 -11.823 8.327 -1.064 1.00 0.00 C ATOM 1632 C SER A1021 -10.501 8.919 -0.583 1.00 0.00 C ATOM 1633 O SER A1021 -9.545 9.032 -1.354 1.00 0.00 O ATOM 1634 CB SER A1021 -12.801 9.444 -1.443 1.00 0.00 C ATOM 1635 OG SER A1021 -12.316 10.219 -2.529 1.00 0.00 O ATOM 0 H SER A1021 -13.341 7.761 0.264 1.00 0.00 H new ATOM 0 HA SER A1021 -11.621 7.719 -1.946 1.00 0.00 H new ATOM 0 HB2 SER A1021 -13.765 9.010 -1.708 1.00 0.00 H new ATOM 0 HB3 SER A1021 -12.968 10.090 -0.581 1.00 0.00 H new ATOM 0 HG SER A1021 -12.965 10.921 -2.745 1.00 0.00 H new ATOM 1641 N GLN A1022 -10.445 9.278 0.694 1.00 0.00 N ATOM 1642 CA GLN A1022 -9.240 9.855 1.268 1.00 0.00 C ATOM 1643 C GLN A1022 -8.137 8.807 1.393 1.00 0.00 C ATOM 1644 O GLN A1022 -7.003 9.041 0.972 1.00 0.00 O ATOM 1645 CB GLN A1022 -9.541 10.470 2.636 1.00 0.00 C ATOM 1646 CG GLN A1022 -8.321 11.079 3.304 1.00 0.00 C ATOM 1647 CD GLN A1022 -8.643 11.765 4.617 1.00 0.00 C ATOM 1648 OE1 GLN A1022 -9.830 12.341 4.719 1.00 0.00 O flip ATOM 1649 NE2 GLN A1022 -7.820 11.791 5.532 1.00 0.00 N flip ATOM 0 H GLN A1022 -11.220 9.179 1.349 1.00 0.00 H new ATOM 0 HA GLN A1022 -8.891 10.640 0.598 1.00 0.00 H new ATOM 0 HB2 GLN A1022 -10.305 11.239 2.520 1.00 0.00 H new ATOM 0 HB3 GLN A1022 -9.958 9.702 3.288 1.00 0.00 H new ATOM 0 HG2 GLN A1022 -7.583 10.297 3.481 1.00 0.00 H new ATOM 0 HG3 GLN A1022 -7.865 11.801 2.626 1.00 0.00 H new ATOM 0 HE21 GLN A1022 -6.915 11.335 5.417 1.00 0.00 H new ATOM 0 HE22 GLN A1022 -8.043 12.268 6.405 1.00 0.00 H new ATOM 1658 N CYS A1023 -8.476 7.651 1.952 1.00 0.00 N ATOM 1659 CA CYS A1023 -7.499 6.589 2.162 1.00 0.00 C ATOM 1660 C CYS A1023 -6.947 6.077 0.836 1.00 0.00 C ATOM 1661 O CYS A1023 -5.739 5.916 0.688 1.00 0.00 O ATOM 1662 CB CYS A1023 -8.119 5.440 2.957 1.00 0.00 C ATOM 1663 SG CYS A1023 -8.695 5.915 4.603 1.00 0.00 S ATOM 0 H CYS A1023 -9.419 7.425 2.268 1.00 0.00 H new ATOM 0 HA CYS A1023 -6.671 7.006 2.735 1.00 0.00 H new ATOM 0 HB2 CYS A1023 -8.958 5.032 2.393 1.00 0.00 H new ATOM 0 HB3 CYS A1023 -7.384 4.642 3.057 1.00 0.00 H new ATOM 0 HG CYS A1023 -9.830 6.540 4.502 1.00 0.00 H new ATOM 1669 N ALA A1024 -7.828 5.850 -0.135 1.00 0.00 N ATOM 1670 CA ALA A1024 -7.412 5.371 -1.450 1.00 0.00 C ATOM 1671 C ALA A1024 -6.516 6.392 -2.141 1.00 0.00 C ATOM 1672 O ALA A1024 -5.626 6.038 -2.915 1.00 0.00 O ATOM 1673 CB ALA A1024 -8.624 5.063 -2.311 1.00 0.00 C ATOM 0 H ALA A1024 -8.833 5.990 -0.036 1.00 0.00 H new ATOM 0 HA ALA A1024 -6.840 4.453 -1.312 1.00 0.00 H new ATOM 0 HB1 ALA A1024 -8.296 4.707 -3.288 1.00 0.00 H new ATOM 0 HB2 ALA A1024 -9.227 4.294 -1.829 1.00 0.00 H new ATOM 0 HB3 ALA A1024 -9.221 5.967 -2.436 1.00 0.00 H new ATOM 1679 N LYS A1025 -6.764 7.662 -1.857 1.00 0.00 N ATOM 1680 CA LYS A1025 -5.937 8.741 -2.371 1.00 0.00 C ATOM 1681 C LYS A1025 -4.538 8.663 -1.768 1.00 0.00 C ATOM 1682 O LYS A1025 -3.536 8.721 -2.482 1.00 0.00 O ATOM 1683 CB LYS A1025 -6.584 10.088 -2.040 1.00 0.00 C ATOM 1684 CG LYS A1025 -5.753 11.297 -2.435 1.00 0.00 C ATOM 1685 CD LYS A1025 -6.454 12.595 -2.063 1.00 0.00 C ATOM 1686 CE LYS A1025 -6.692 12.708 -0.562 1.00 0.00 C ATOM 1687 NZ LYS A1025 -5.417 12.745 0.206 1.00 0.00 N ATOM 0 H LYS A1025 -7.538 7.971 -1.269 1.00 0.00 H new ATOM 0 HA LYS A1025 -5.853 8.644 -3.453 1.00 0.00 H new ATOM 0 HB2 LYS A1025 -7.550 10.147 -2.542 1.00 0.00 H new ATOM 0 HB3 LYS A1025 -6.778 10.130 -0.968 1.00 0.00 H new ATOM 0 HG2 LYS A1025 -4.782 11.251 -1.941 1.00 0.00 H new ATOM 0 HG3 LYS A1025 -5.566 11.277 -3.509 1.00 0.00 H new ATOM 0 HD2 LYS A1025 -5.853 13.440 -2.399 1.00 0.00 H new ATOM 0 HD3 LYS A1025 -7.408 12.654 -2.586 1.00 0.00 H new ATOM 0 HE2 LYS A1025 -7.267 13.610 -0.353 1.00 0.00 H new ATOM 0 HE3 LYS A1025 -7.293 11.863 -0.226 1.00 0.00 H new ATOM 0 HZ1 LYS A1025 -5.521 13.384 1.020 1.00 0.00 H new ATOM 0 HZ2 LYS A1025 -5.187 11.788 0.543 1.00 0.00 H new ATOM 0 HZ3 LYS A1025 -4.651 13.089 -0.408 1.00 0.00 H new ATOM 1701 N ASN A1026 -4.488 8.507 -0.452 1.00 0.00 N ATOM 1702 CA ASN A1026 -3.225 8.449 0.273 1.00 0.00 C ATOM 1703 C ASN A1026 -2.466 7.170 -0.057 1.00 0.00 C ATOM 1704 O ASN A1026 -1.242 7.183 -0.202 1.00 0.00 O ATOM 1705 CB ASN A1026 -3.473 8.551 1.782 1.00 0.00 C ATOM 1706 CG ASN A1026 -4.066 9.891 2.169 1.00 0.00 C ATOM 1707 OD1 ASN A1026 -3.806 10.905 1.519 1.00 0.00 O ATOM 1708 ND2 ASN A1026 -4.867 9.914 3.220 1.00 0.00 N ATOM 0 H ASN A1026 -5.314 8.418 0.139 1.00 0.00 H new ATOM 0 HA ASN A1026 -2.613 9.295 -0.039 1.00 0.00 H new ATOM 0 HB2 ASN A1026 -4.146 7.753 2.094 1.00 0.00 H new ATOM 0 HB3 ASN A1026 -2.534 8.402 2.315 1.00 0.00 H new ATOM 0 HD21 ASN A1026 -5.293 10.792 3.517 1.00 0.00 H new ATOM 0 HD22 ASN A1026 -5.059 9.054 3.734 1.00 0.00 H new ATOM 1715 N LEU A1027 -3.201 6.072 -0.184 1.00 0.00 N ATOM 1716 CA LEU A1027 -2.627 4.793 -0.579 1.00 0.00 C ATOM 1717 C LEU A1027 -2.070 4.885 -1.994 1.00 0.00 C ATOM 1718 O LEU A1027 -1.017 4.324 -2.295 1.00 0.00 O ATOM 1719 CB LEU A1027 -3.694 3.694 -0.494 1.00 0.00 C ATOM 1720 CG LEU A1027 -3.244 2.293 -0.924 1.00 0.00 C ATOM 1721 CD1 LEU A1027 -2.098 1.803 -0.052 1.00 0.00 C ATOM 1722 CD2 LEU A1027 -4.416 1.320 -0.868 1.00 0.00 C ATOM 0 H LEU A1027 -4.207 6.043 -0.017 1.00 0.00 H new ATOM 0 HA LEU A1027 -1.811 4.543 0.099 1.00 0.00 H new ATOM 0 HB2 LEU A1027 -4.052 3.640 0.534 1.00 0.00 H new ATOM 0 HB3 LEU A1027 -4.542 3.988 -1.112 1.00 0.00 H new ATOM 0 HG LEU A1027 -2.887 2.347 -1.953 1.00 0.00 H new ATOM 0 HD11 LEU A1027 -1.795 0.807 -0.375 1.00 0.00 H new ATOM 0 HD12 LEU A1027 -1.254 2.486 -0.143 1.00 0.00 H new ATOM 0 HD13 LEU A1027 -2.423 1.764 0.988 1.00 0.00 H new ATOM 0 HD21 LEU A1027 -4.081 0.329 -1.176 1.00 0.00 H new ATOM 0 HD22 LEU A1027 -4.801 1.273 0.151 1.00 0.00 H new ATOM 0 HD23 LEU A1027 -5.205 1.661 -1.539 1.00 0.00 H new ATOM 1734 N GLY A1028 -2.775 5.613 -2.854 1.00 0.00 N ATOM 1735 CA GLY A1028 -2.321 5.811 -4.217 1.00 0.00 C ATOM 1736 C GLY A1028 -0.972 6.499 -4.279 1.00 0.00 C ATOM 1737 O GLY A1028 -0.078 6.059 -5.002 1.00 0.00 O ATOM 0 H GLY A1028 -3.658 6.072 -2.629 1.00 0.00 H new ATOM 0 HA2 GLY A1028 -2.258 4.846 -4.720 1.00 0.00 H new ATOM 0 HA3 GLY A1028 -3.055 6.406 -4.760 1.00 0.00 H new ATOM 1741 N THR A1029 -0.820 7.573 -3.509 1.00 0.00 N ATOM 1742 CA THR A1029 0.441 8.298 -3.451 1.00 0.00 C ATOM 1743 C THR A1029 1.513 7.456 -2.761 1.00 0.00 C ATOM 1744 O THR A1029 2.692 7.522 -3.109 1.00 0.00 O ATOM 1745 CB THR A1029 0.278 9.630 -2.700 1.00 0.00 C ATOM 1746 OG1 THR A1029 -0.927 10.281 -3.123 1.00 0.00 O ATOM 1747 CG2 THR A1029 1.463 10.551 -2.954 1.00 0.00 C ATOM 0 H THR A1029 -1.556 7.959 -2.917 1.00 0.00 H new ATOM 0 HA THR A1029 0.749 8.506 -4.476 1.00 0.00 H new ATOM 0 HB THR A1029 0.229 9.413 -1.633 1.00 0.00 H new ATOM 0 HG1 THR A1029 -1.028 11.128 -2.641 1.00 0.00 H new ATOM 0 HG21 THR A1029 1.321 11.485 -2.411 1.00 0.00 H new ATOM 0 HG22 THR A1029 2.379 10.068 -2.612 1.00 0.00 H new ATOM 0 HG23 THR A1029 1.539 10.760 -4.021 1.00 0.00 H new ATOM 1755 N ALA A1030 1.090 6.657 -1.788 1.00 0.00 N ATOM 1756 CA ALA A1030 1.991 5.741 -1.107 1.00 0.00 C ATOM 1757 C ALA A1030 2.566 4.736 -2.101 1.00 0.00 C ATOM 1758 O ALA A1030 3.765 4.451 -2.096 1.00 0.00 O ATOM 1759 CB ALA A1030 1.258 5.029 0.020 1.00 0.00 C ATOM 0 H ALA A1030 0.127 6.627 -1.454 1.00 0.00 H new ATOM 0 HA ALA A1030 2.817 6.307 -0.675 1.00 0.00 H new ATOM 0 HB1 ALA A1030 1.941 4.345 0.524 1.00 0.00 H new ATOM 0 HB2 ALA A1030 0.888 5.764 0.735 1.00 0.00 H new ATOM 0 HB3 ALA A1030 0.419 4.467 -0.390 1.00 0.00 H new ATOM 1765 N LEU A1031 1.699 4.222 -2.964 1.00 0.00 N ATOM 1766 CA LEU A1031 2.113 3.321 -4.034 1.00 0.00 C ATOM 1767 C LEU A1031 2.955 4.066 -5.059 1.00 0.00 C ATOM 1768 O LEU A1031 3.897 3.512 -5.614 1.00 0.00 O ATOM 1769 CB LEU A1031 0.891 2.713 -4.722 1.00 0.00 C ATOM 1770 CG LEU A1031 -0.014 1.875 -3.823 1.00 0.00 C ATOM 1771 CD1 LEU A1031 -1.250 1.433 -4.586 1.00 0.00 C ATOM 1772 CD2 LEU A1031 0.737 0.673 -3.281 1.00 0.00 C ATOM 0 H LEU A1031 0.698 4.415 -2.944 1.00 0.00 H new ATOM 0 HA LEU A1031 2.710 2.522 -3.594 1.00 0.00 H new ATOM 0 HB2 LEU A1031 0.299 3.520 -5.155 1.00 0.00 H new ATOM 0 HB3 LEU A1031 1.232 2.090 -5.548 1.00 0.00 H new ATOM 0 HG LEU A1031 -0.329 2.489 -2.979 1.00 0.00 H new ATOM 0 HD11 LEU A1031 -1.887 0.836 -3.933 1.00 0.00 H new ATOM 0 HD12 LEU A1031 -1.800 2.310 -4.927 1.00 0.00 H new ATOM 0 HD13 LEU A1031 -0.952 0.835 -5.447 1.00 0.00 H new ATOM 0 HD21 LEU A1031 0.075 0.088 -2.642 1.00 0.00 H new ATOM 0 HD22 LEU A1031 1.081 0.055 -4.110 1.00 0.00 H new ATOM 0 HD23 LEU A1031 1.595 1.012 -2.701 1.00 0.00 H new ATOM 1784 N ALA A1032 2.600 5.323 -5.307 1.00 0.00 N ATOM 1785 CA ALA A1032 3.350 6.169 -6.227 1.00 0.00 C ATOM 1786 C ALA A1032 4.796 6.299 -5.771 1.00 0.00 C ATOM 1787 O ALA A1032 5.723 6.236 -6.578 1.00 0.00 O ATOM 1788 CB ALA A1032 2.698 7.539 -6.334 1.00 0.00 C ATOM 0 H ALA A1032 1.793 5.779 -4.881 1.00 0.00 H new ATOM 0 HA ALA A1032 3.342 5.704 -7.213 1.00 0.00 H new ATOM 0 HB1 ALA A1032 3.268 8.161 -7.024 1.00 0.00 H new ATOM 0 HB2 ALA A1032 1.678 7.429 -6.703 1.00 0.00 H new ATOM 0 HB3 ALA A1032 2.679 8.011 -5.352 1.00 0.00 H new ATOM 1794 N GLU A1033 4.979 6.480 -4.471 1.00 0.00 N ATOM 1795 CA GLU A1033 6.308 6.518 -3.884 1.00 0.00 C ATOM 1796 C GLU A1033 6.988 5.165 -4.034 1.00 0.00 C ATOM 1797 O GLU A1033 8.074 5.075 -4.594 1.00 0.00 O ATOM 1798 CB GLU A1033 6.226 6.903 -2.411 1.00 0.00 C ATOM 1799 CG GLU A1033 5.754 8.325 -2.181 1.00 0.00 C ATOM 1800 CD GLU A1033 6.733 9.353 -2.706 1.00 0.00 C ATOM 1801 OE1 GLU A1033 6.698 9.639 -3.921 1.00 0.00 O ATOM 1802 OE2 GLU A1033 7.541 9.882 -1.914 1.00 0.00 O ATOM 0 H GLU A1033 4.220 6.603 -3.801 1.00 0.00 H new ATOM 0 HA GLU A1033 6.899 7.269 -4.409 1.00 0.00 H new ATOM 0 HB2 GLU A1033 5.549 6.217 -1.902 1.00 0.00 H new ATOM 0 HB3 GLU A1033 7.208 6.777 -1.956 1.00 0.00 H new ATOM 0 HG2 GLU A1033 4.788 8.467 -2.666 1.00 0.00 H new ATOM 0 HG3 GLU A1033 5.601 8.485 -1.114 1.00 0.00 H new ATOM 1809 N LEU A1034 6.324 4.124 -3.542 1.00 0.00 N ATOM 1810 CA LEU A1034 6.831 2.763 -3.599 1.00 0.00 C ATOM 1811 C LEU A1034 7.272 2.374 -5.003 1.00 0.00 C ATOM 1812 O LEU A1034 8.410 1.968 -5.211 1.00 0.00 O ATOM 1813 CB LEU A1034 5.749 1.798 -3.136 1.00 0.00 C ATOM 1814 CG LEU A1034 5.829 1.360 -1.678 1.00 0.00 C ATOM 1815 CD1 LEU A1034 4.865 0.215 -1.434 1.00 0.00 C ATOM 1816 CD2 LEU A1034 7.249 0.959 -1.311 1.00 0.00 C ATOM 0 H LEU A1034 5.413 4.205 -3.090 1.00 0.00 H new ATOM 0 HA LEU A1034 7.701 2.710 -2.945 1.00 0.00 H new ATOM 0 HB2 LEU A1034 4.778 2.264 -3.303 1.00 0.00 H new ATOM 0 HB3 LEU A1034 5.788 0.909 -3.765 1.00 0.00 H new ATOM 0 HG LEU A1034 5.547 2.199 -1.042 1.00 0.00 H new ATOM 0 HD11 LEU A1034 4.925 -0.095 -0.391 1.00 0.00 H new ATOM 0 HD12 LEU A1034 3.849 0.541 -1.658 1.00 0.00 H new ATOM 0 HD13 LEU A1034 5.127 -0.625 -2.078 1.00 0.00 H new ATOM 0 HD21 LEU A1034 7.281 0.650 -0.266 1.00 0.00 H new ATOM 0 HD22 LEU A1034 7.568 0.131 -1.944 1.00 0.00 H new ATOM 0 HD23 LEU A1034 7.917 1.808 -1.459 1.00 0.00 H new ATOM 1828 N ARG A1035 6.354 2.491 -5.948 1.00 0.00 N ATOM 1829 CA ARG A1035 6.607 2.125 -7.337 1.00 0.00 C ATOM 1830 C ARG A1035 7.863 2.806 -7.879 1.00 0.00 C ATOM 1831 O ARG A1035 8.721 2.150 -8.465 1.00 0.00 O ATOM 1832 CB ARG A1035 5.394 2.489 -8.192 1.00 0.00 C ATOM 1833 CG ARG A1035 5.527 2.116 -9.657 1.00 0.00 C ATOM 1834 CD ARG A1035 4.317 2.587 -10.447 1.00 0.00 C ATOM 1835 NE ARG A1035 4.187 4.043 -10.418 1.00 0.00 N ATOM 1836 CZ ARG A1035 3.121 4.695 -9.946 1.00 0.00 C ATOM 1837 NH1 ARG A1035 2.095 4.028 -9.430 1.00 0.00 N ATOM 1838 NH2 ARG A1035 3.091 6.022 -9.983 1.00 0.00 N ATOM 0 H ARG A1035 5.412 2.842 -5.777 1.00 0.00 H new ATOM 0 HA ARG A1035 6.774 1.049 -7.381 1.00 0.00 H new ATOM 0 HB2 ARG A1035 4.514 1.994 -7.782 1.00 0.00 H new ATOM 0 HB3 ARG A1035 5.220 3.562 -8.117 1.00 0.00 H new ATOM 0 HG2 ARG A1035 6.432 2.562 -10.069 1.00 0.00 H new ATOM 0 HG3 ARG A1035 5.632 1.035 -9.754 1.00 0.00 H new ATOM 0 HD2 ARG A1035 4.403 2.250 -11.480 1.00 0.00 H new ATOM 0 HD3 ARG A1035 3.415 2.133 -10.037 1.00 0.00 H new ATOM 0 HE ARG A1035 4.962 4.598 -10.782 1.00 0.00 H new ATOM 0 HH11 ARG A1035 2.117 3.009 -9.392 1.00 0.00 H new ATOM 0 HH12 ARG A1035 1.285 4.535 -9.072 1.00 0.00 H new ATOM 0 HH21 ARG A1035 3.880 6.539 -10.371 1.00 0.00 H new ATOM 0 HH22 ARG A1035 2.279 6.524 -9.624 1.00 0.00 H new ATOM 1852 N THR A1036 7.977 4.110 -7.666 1.00 0.00 N ATOM 1853 CA THR A1036 9.126 4.860 -8.152 1.00 0.00 C ATOM 1854 C THR A1036 10.390 4.514 -7.356 1.00 0.00 C ATOM 1855 O THR A1036 11.467 4.315 -7.927 1.00 0.00 O ATOM 1856 CB THR A1036 8.861 6.374 -8.065 1.00 0.00 C ATOM 1857 OG1 THR A1036 7.616 6.684 -8.709 1.00 0.00 O ATOM 1858 CG2 THR A1036 9.979 7.171 -8.714 1.00 0.00 C ATOM 0 H THR A1036 7.289 4.669 -7.161 1.00 0.00 H new ATOM 0 HA THR A1036 9.283 4.582 -9.194 1.00 0.00 H new ATOM 0 HB THR A1036 8.815 6.648 -7.011 1.00 0.00 H new ATOM 0 HG1 THR A1036 6.882 6.580 -8.068 1.00 0.00 H new ATOM 0 HG21 THR A1036 9.760 8.236 -8.635 1.00 0.00 H new ATOM 0 HG22 THR A1036 10.920 6.956 -8.208 1.00 0.00 H new ATOM 0 HG23 THR A1036 10.060 6.894 -9.765 1.00 0.00 H new ATOM 1866 N ALA A1037 10.242 4.427 -6.040 1.00 0.00 N ATOM 1867 CA ALA A1037 11.357 4.133 -5.150 1.00 0.00 C ATOM 1868 C ALA A1037 11.921 2.740 -5.414 1.00 0.00 C ATOM 1869 O ALA A1037 13.122 2.579 -5.629 1.00 0.00 O ATOM 1870 CB ALA A1037 10.915 4.265 -3.698 1.00 0.00 C ATOM 0 H ALA A1037 9.350 4.558 -5.562 1.00 0.00 H new ATOM 0 HA ALA A1037 12.150 4.855 -5.345 1.00 0.00 H new ATOM 0 HB1 ALA A1037 11.755 4.043 -3.040 1.00 0.00 H new ATOM 0 HB2 ALA A1037 10.569 5.282 -3.514 1.00 0.00 H new ATOM 0 HB3 ALA A1037 10.104 3.564 -3.499 1.00 0.00 H new ATOM 1876 N ALA A1038 11.042 1.743 -5.418 1.00 0.00 N ATOM 1877 CA ALA A1038 11.446 0.358 -5.616 1.00 0.00 C ATOM 1878 C ALA A1038 12.001 0.146 -7.015 1.00 0.00 C ATOM 1879 O ALA A1038 12.906 -0.657 -7.210 1.00 0.00 O ATOM 1880 CB ALA A1038 10.278 -0.582 -5.364 1.00 0.00 C ATOM 0 H ALA A1038 10.039 1.871 -5.285 1.00 0.00 H new ATOM 0 HA ALA A1038 12.235 0.134 -4.898 1.00 0.00 H new ATOM 0 HB1 ALA A1038 10.600 -1.612 -5.517 1.00 0.00 H new ATOM 0 HB2 ALA A1038 9.927 -0.460 -4.339 1.00 0.00 H new ATOM 0 HB3 ALA A1038 9.468 -0.349 -6.055 1.00 0.00 H new ATOM 1886 N GLN A1039 11.458 0.871 -7.986 1.00 0.00 N ATOM 1887 CA GLN A1039 11.917 0.765 -9.365 1.00 0.00 C ATOM 1888 C GLN A1039 13.379 1.182 -9.475 1.00 0.00 C ATOM 1889 O GLN A1039 14.211 0.431 -9.986 1.00 0.00 O ATOM 1890 CB GLN A1039 11.054 1.632 -10.286 1.00 0.00 C ATOM 1891 CG GLN A1039 11.444 1.559 -11.753 1.00 0.00 C ATOM 1892 CD GLN A1039 11.399 0.147 -12.303 1.00 0.00 C ATOM 1893 OE1 GLN A1039 10.361 -0.313 -12.777 1.00 0.00 O ATOM 1894 NE2 GLN A1039 12.528 -0.541 -12.262 1.00 0.00 N ATOM 0 H GLN A1039 10.700 1.538 -7.844 1.00 0.00 H new ATOM 0 HA GLN A1039 11.825 -0.276 -9.676 1.00 0.00 H new ATOM 0 HB2 GLN A1039 10.012 1.328 -10.183 1.00 0.00 H new ATOM 0 HB3 GLN A1039 11.117 2.669 -9.956 1.00 0.00 H new ATOM 0 HG2 GLN A1039 10.774 2.192 -12.334 1.00 0.00 H new ATOM 0 HG3 GLN A1039 12.450 1.961 -11.877 1.00 0.00 H new ATOM 0 HE21 GLN A1039 13.366 -0.122 -11.860 1.00 0.00 H new ATOM 0 HE22 GLN A1039 12.560 -1.491 -12.632 1.00 0.00 H new ATOM 1903 N LYS A1040 13.690 2.373 -8.980 1.00 0.00 N ATOM 1904 CA LYS A1040 15.045 2.898 -9.059 1.00 0.00 C ATOM 1905 C LYS A1040 15.990 2.123 -8.151 1.00 0.00 C ATOM 1906 O LYS A1040 17.157 1.924 -8.485 1.00 0.00 O ATOM 1907 CB LYS A1040 15.072 4.390 -8.711 1.00 0.00 C ATOM 1908 CG LYS A1040 14.381 5.259 -9.748 1.00 0.00 C ATOM 1909 CD LYS A1040 14.602 6.741 -9.492 1.00 0.00 C ATOM 1910 CE LYS A1040 13.851 7.226 -8.265 1.00 0.00 C ATOM 1911 NZ LYS A1040 13.967 8.698 -8.094 1.00 0.00 N ATOM 0 H LYS A1040 13.023 2.992 -8.520 1.00 0.00 H new ATOM 0 HA LYS A1040 15.388 2.776 -10.087 1.00 0.00 H new ATOM 0 HB2 LYS A1040 14.593 4.540 -7.744 1.00 0.00 H new ATOM 0 HB3 LYS A1040 16.108 4.714 -8.607 1.00 0.00 H new ATOM 0 HG2 LYS A1040 14.753 5.004 -10.740 1.00 0.00 H new ATOM 0 HG3 LYS A1040 13.312 5.046 -9.744 1.00 0.00 H new ATOM 0 HD2 LYS A1040 15.667 6.931 -9.363 1.00 0.00 H new ATOM 0 HD3 LYS A1040 14.279 7.311 -10.363 1.00 0.00 H new ATOM 0 HE2 LYS A1040 12.800 6.952 -8.350 1.00 0.00 H new ATOM 0 HE3 LYS A1040 14.240 6.725 -7.379 1.00 0.00 H new ATOM 0 HZ1 LYS A1040 13.441 8.991 -7.246 1.00 0.00 H new ATOM 0 HZ2 LYS A1040 14.969 8.957 -7.988 1.00 0.00 H new ATOM 0 HZ3 LYS A1040 13.572 9.177 -8.929 1.00 0.00 H new ATOM 1925 N ALA A1041 15.481 1.673 -7.010 1.00 0.00 N ATOM 1926 CA ALA A1041 16.284 0.904 -6.067 1.00 0.00 C ATOM 1927 C ALA A1041 16.570 -0.496 -6.600 1.00 0.00 C ATOM 1928 O ALA A1041 17.613 -1.078 -6.312 1.00 0.00 O ATOM 1929 CB ALA A1041 15.589 0.823 -4.716 1.00 0.00 C ATOM 0 H ALA A1041 14.517 1.827 -6.716 1.00 0.00 H new ATOM 0 HA ALA A1041 17.236 1.419 -5.941 1.00 0.00 H new ATOM 0 HB1 ALA A1041 16.203 0.245 -4.025 1.00 0.00 H new ATOM 0 HB2 ALA A1041 15.445 1.828 -4.320 1.00 0.00 H new ATOM 0 HB3 ALA A1041 14.620 0.337 -4.834 1.00 0.00 H new ATOM 1935 N GLN A1042 15.642 -1.033 -7.382 1.00 0.00 N ATOM 1936 CA GLN A1042 15.793 -2.367 -7.950 1.00 0.00 C ATOM 1937 C GLN A1042 16.940 -2.384 -8.952 1.00 0.00 C ATOM 1938 O GLN A1042 17.720 -3.335 -9.010 1.00 0.00 O ATOM 1939 CB GLN A1042 14.480 -2.810 -8.611 1.00 0.00 C ATOM 1940 CG GLN A1042 14.410 -4.293 -8.946 1.00 0.00 C ATOM 1941 CD GLN A1042 15.107 -4.646 -10.244 1.00 0.00 C ATOM 1942 OE1 GLN A1042 15.146 -3.848 -11.182 1.00 0.00 O ATOM 1943 NE2 GLN A1042 15.669 -5.841 -10.302 1.00 0.00 N ATOM 0 H GLN A1042 14.774 -0.563 -7.638 1.00 0.00 H new ATOM 0 HA GLN A1042 16.028 -3.070 -7.151 1.00 0.00 H new ATOM 0 HB2 GLN A1042 13.652 -2.561 -7.947 1.00 0.00 H new ATOM 0 HB3 GLN A1042 14.338 -2.237 -9.527 1.00 0.00 H new ATOM 0 HG2 GLN A1042 14.859 -4.864 -8.133 1.00 0.00 H new ATOM 0 HG3 GLN A1042 13.365 -4.596 -9.009 1.00 0.00 H new ATOM 0 HE21 GLN A1042 15.613 -6.471 -9.501 1.00 0.00 H new ATOM 0 HE22 GLN A1042 16.159 -6.134 -11.147 1.00 0.00 H new ATOM 1952 N GLU A1043 17.051 -1.314 -9.725 1.00 0.00 N ATOM 1953 CA GLU A1043 18.107 -1.201 -10.720 1.00 0.00 C ATOM 1954 C GLU A1043 19.314 -0.455 -10.152 1.00 0.00 C ATOM 1955 O GLU A1043 20.197 -0.023 -10.894 1.00 0.00 O ATOM 1956 CB GLU A1043 17.577 -0.503 -11.975 1.00 0.00 C ATOM 1957 CG GLU A1043 16.863 0.806 -11.698 1.00 0.00 C ATOM 1958 CD GLU A1043 16.290 1.428 -12.952 1.00 0.00 C ATOM 1959 OE1 GLU A1043 15.258 0.931 -13.451 1.00 0.00 O ATOM 1960 OE2 GLU A1043 16.863 2.422 -13.442 1.00 0.00 O ATOM 0 H GLU A1043 16.423 -0.512 -9.682 1.00 0.00 H new ATOM 0 HA GLU A1043 18.434 -2.204 -10.993 1.00 0.00 H new ATOM 0 HB2 GLU A1043 18.410 -0.314 -12.652 1.00 0.00 H new ATOM 0 HB3 GLU A1043 16.892 -1.176 -12.491 1.00 0.00 H new ATOM 0 HG2 GLU A1043 16.060 0.634 -10.982 1.00 0.00 H new ATOM 0 HG3 GLU A1043 17.559 1.505 -11.234 1.00 0.00 H new ATOM 1967 N ALA A1044 19.348 -0.319 -8.834 1.00 0.00 N ATOM 1968 CA ALA A1044 20.472 0.305 -8.153 1.00 0.00 C ATOM 1969 C ALA A1044 21.377 -0.766 -7.557 1.00 0.00 C ATOM 1970 O ALA A1044 21.155 -1.158 -6.393 1.00 0.00 O ATOM 1971 CB ALA A1044 19.981 1.258 -7.071 1.00 0.00 C ATOM 1972 OXT ALA A1044 22.284 -1.240 -8.268 1.00 0.00 O ATOM 0 H ALA A1044 18.604 -0.635 -8.212 1.00 0.00 H new ATOM 0 HA ALA A1044 21.045 0.884 -8.877 1.00 0.00 H new ATOM 0 HB1 ALA A1044 20.836 1.715 -6.573 1.00 0.00 H new ATOM 0 HB2 ALA A1044 19.366 2.036 -7.523 1.00 0.00 H new ATOM 0 HB3 ALA A1044 19.389 0.706 -6.341 1.00 0.00 H new TER 1978 ALA A1044